@MOLECULE 7jv0.A 533 543 32 0 0 BIOPOLYMER USER_CHARGES @ATOM 1 N -5.5980 66.1980 -29.7910 N.4 1 VAL601 1.0000 BACKBONE 2 H1 -5.2449 66.0338 -30.7229 H 1 VAL601 0.0000 BACKBONE 3 H2 -6.4978 66.6534 -29.8473 H 1 VAL601 0.0000 BACKBONE 4 H3 -5.6965 65.3164 -29.3081 H 1 VAL601 0.0000 BACKBONE 5 CA -4.6660 67.0510 -29.0610 C.3 1 VAL601 0.0000 BACKBONE 6 HA -4.6000 67.9978 -29.5969 H 1 VAL601 0.0000 BACKBONE 7 C -3.2720 66.4380 -29.0100 C.2 1 VAL601 0.0000 BACKBONE 8 O -3.0450 65.4280 -28.3470 O.2 1 VAL601 0.0000 BACKBONE 9 CB -5.1680 67.3140 -27.6630 C.3 1 VAL601 0.0000 10 HB1 -5.2374 66.3722 -27.1187 H 1 VAL601 0.0000 11 HB2 -6.1527 67.7788 -27.7120 H 1 VAL601 0.0000 12 HB3 -4.4766 67.9811 -27.1482 H 1 VAL601 0.0000 13 N -2.3500 67.0530 -29.7430 N.am 2 TYR602 0.0000 BACKBONE 14 H -2.6289 67.8598 -30.2829 H 2 TYR602 0.0000 BACKBONE 15 CA -0.9600 66.6270 -29.8100 C.3 2 TYR602 0.0000 BACKBONE 16 HA -0.8932 65.5982 -29.4562 H 2 TYR602 0.0000 BACKBONE 17 C -0.0680 67.4530 -28.8920 C.2 2 TYR602 0.0000 BACKBONE 18 O 1.1610 67.3690 -28.9890 O.2 2 TYR602 0.0000 BACKBONE 19 CB -0.4820 66.6860 -31.2600 C.3 2 TYR602 0.0000 20 HB2 0.4757 66.1717 -31.3399 H 2 TYR602 0.0000 21 HB3 -0.3597 67.7290 -31.5519 H 2 TYR602 0.0000 22 CG -1.4760 66.0260 -32.1910 C.ar 2 TYR602 0.0000 23 CD1 -1.7290 64.6620 -32.1100 C.ar 2 TYR602 0.0000 24 HD1 -1.1972 64.0661 -31.3831 H 2 TYR602 0.0000 25 CD2 -2.1930 66.7720 -33.1180 C.ar 2 TYR602 0.0000 26 HD2 -2.0271 67.8371 -33.1854 H 2 TYR602 0.0000 27 CE1 -2.6500 64.0540 -32.9440 C.ar 2 TYR602 0.0000 28 HE1 -2.8275 62.9910 -32.8740 H 2 TYR602 0.0000 29 CE2 -3.1170 66.1720 -33.9570 C.ar 2 TYR602 0.0000 30 HE2 -3.6599 66.7639 -34.6790 H 2 TYR602 0.0000 31 CZ -3.3400 64.8130 -33.8650 C.ar 2 TYR602 0.0000 32 OH -4.2580 64.2110 -34.6970 O.3 2 TYR602 0.0000 33 HH -4.6991 64.8032 -35.3105 H 2 TYR602 0.0000 34 N -0.6760 68.2550 -28.0120 N.am 3 LEU603 0.0000 BACKBONE 35 H -1.6853 68.2816 -28.0403 H 3 LEU603 0.0000 BACKBONE 36 CA -0.0210 69.0970 -27.0130 C.3 3 LEU603 0.0000 BACKBONE 37 HA -0.8050 69.5875 -26.4361 H 3 LEU603 0.0000 BACKBONE 38 C 0.8170 70.2050 -27.6460 C.2 3 LEU603 0.0000 BACKBONE 39 O 1.1610 71.1830 -26.9730 O.2 3 LEU603 0.0000 BACKBONE 40 CB 0.8290 68.2390 -26.0680 C.3 3 LEU603 0.0000 41 HB2 1.6394 67.8138 -26.6600 H 3 LEU603 0.0000 42 HB3 0.1899 67.4372 -25.6981 H 3 LEU603 0.0000 43 CG 1.4640 68.9110 -24.8480 C.3 3 LEU603 0.0000 44 HG 2.3133 69.5077 -25.1809 H 3 LEU603 0.0000 45 CD1 0.4710 69.8320 -24.1630 C.3 3 LEU603 0.0000 46 HD11 -0.3870 69.2524 -23.8225 H 3 LEU603 0.0000 47 HD12 0.1379 70.5949 -24.8666 H 3 LEU603 0.0000 48 HD13 0.9489 70.3101 -23.3080 H 3 LEU603 0.0000 49 CD2 1.9360 67.8510 -23.8750 C.3 3 LEU603 0.0000 50 HD21 1.0844 67.2564 -23.5443 H 3 LEU603 0.0000 51 HD22 2.4012 68.3299 -23.0135 H 3 LEU603 0.0000 52 HD23 2.6621 67.2037 -24.3669 H 3 LEU603 0.0000 53 N 1.1390 70.0900 -28.9330 N.am 4 GLN604 0.0000 BACKBONE 54 H 0.9904 69.2189 -29.4221 H 4 GLN604 0.0000 BACKBONE 55 CA 1.7080 71.2370 -29.6250 C.3 4 GLN604 0.0000 BACKBONE 56 HA 2.4276 71.7044 -28.9529 H 4 GLN604 0.0000 BACKBONE 57 C 0.6520 72.2820 -29.9640 C.2 4 GLN604 0.0000 BACKBONE 58 O 1.0000 73.3500 -30.4800 O.2 4 GLN604 0.0000 BACKBONE 59 CB 2.4150 70.7750 -30.9020 C.3 4 GLN604 0.0000 60 HB2 2.8586 71.6469 -31.3827 H 4 GLN604 0.0000 61 HB3 1.6709 70.3338 -31.5652 H 4 GLN604 0.0000 62 CG 3.5140 69.7480 -30.6650 C.3 4 GLN604 0.0000 63 HG2 3.0946 68.9104 -30.1077 H 4 GLN604 0.0000 64 HG3 4.3065 70.2138 -30.0793 H 4 GLN604 0.0000 65 CD 4.1100 69.2220 -31.9570 C.2 4 GLN604 0.0000 66 OE1 3.4530 69.2160 -32.9990 O.2 4 GLN604 0.0000 67 NE2 5.3590 68.7740 -31.8940 N.am 4 GLN604 0.0000 68 HE21 5.8071 68.4094 -32.7225 H 4 GLN604 0.0000 69 HE22 5.8605 68.7980 -31.0176 H 4 GLN604 0.0000 70 N -0.6200 71.9970 -29.6830 N.am 5 GLU605 0.0000 BACKBONE 71 H -0.8280 71.0937 -29.2820 H 5 GLU605 0.0000 BACKBONE 72 CA -1.7260 72.9130 -29.9210 C.3 5 GLU605 0.0000 BACKBONE 73 HA -1.4440 73.5298 -30.7743 H 5 GLU605 0.0000 BACKBONE 74 C -1.9800 73.8460 -28.7440 C.2 5 GLU605 0.0000 BACKBONE 75 O -2.9810 74.5700 -28.7490 O.2 5 GLU605 0.0000 BACKBONE 76 CB -3.0040 72.1300 -30.2360 C.3 5 GLU605 0.0000 77 HB2 -3.6171 72.7341 -30.9048 H 5 GLU605 0.0000 78 HB3 -3.5405 71.9642 -29.3018 H 5 GLU605 0.0000 79 CG -2.7710 70.7810 -30.8950 C.3 5 GLU605 0.0000 80 HG2 -2.1730 70.1631 -30.2252 H 5 GLU605 0.0000 81 HG3 -2.2284 70.9362 -31.8275 H 5 GLU605 0.0000 82 CD -4.0670 70.0540 -31.2010 C.2 5 GLU605 0.0000 83 OE1 -4.0510 69.1390 -32.0520 O.co2 5 GLU605 -0.5000 84 OE2 -5.1010 70.3950 -30.5880 O.co2 5 GLU605 -0.5000 85 N -1.1080 73.8420 -27.7420 N.am 6 TRP606 0.0000 BACKBONE 86 H -0.2774 73.2735 -27.8263 H 6 TRP606 0.0000 BACKBONE 87 CA -1.2980 74.6210 -26.5290 C.3 6 TRP606 0.0000 BACKBONE 88 HA -2.2926 75.0649 -26.5709 H 6 TRP606 0.0000 BACKBONE 89 C -0.2780 75.7460 -26.4340 C.2 6 TRP606 0.0000 BACKBONE 90 O 0.8240 75.6590 -26.9850 O.2 6 TRP606 0.0000 BACKBONE 91 CB -1.2110 73.7230 -25.2920 C.3 6 TRP606 0.0000 92 HB2 -0.6688 74.2560 -24.5109 H 6 TRP606 0.0000 93 HB3 -0.6681 72.8156 -25.5566 H 6 TRP606 0.0000 94 CG -2.5590 73.3390 -24.7640 C.2 6 TRP606 0.0000 95 CD1 -3.2930 73.9970 -23.8190 C.2 6 TRP606 0.0000 96 HD1 -2.9797 74.8954 -23.3081 H 6 TRP606 0.0000 97 CD2 -3.3580 72.2300 -25.1910 C.ar 6 TRP606 0.0000 98 NE1 -4.4890 73.3500 -23.6120 N.pl3 6 TRP606 0.0000 99 HE1 -5.2023 73.6296 -22.9539 H 6 TRP606 0.0000 100 CE2 -4.5540 72.2640 -24.4450 C.ar 6 TRP606 0.0000 101 CE3 -3.1740 71.2080 -26.1250 C.ar 6 TRP606 0.0000 102 HE3 -2.2678 71.1527 -26.7099 H 6 TRP606 0.0000 103 CZ2 -5.5590 71.3130 -24.6050 C.ar 6 TRP606 0.0000 104 HZ2 -6.4696 71.3555 -24.0258 H 6 TRP606 0.0000 105 CZ3 -4.1720 70.2720 -26.2850 C.ar 6 TRP606 0.0000 106 HZ3 -4.0461 69.4827 -27.0113 H 6 TRP606 0.0000 107 CH2 -5.3470 70.3240 -25.5240 C.ar 6 TRP606 0.0000 108 HH2 -6.1023 69.5654 -25.6668 H 6 TRP606 0.0000 109 N -0.6630 76.8120 -25.7280 N.am 7 ASP607 0.0000 BACKBONE 110 H -1.5463 76.7912 -25.2387 H 7 ASP607 0.0000 BACKBONE 111 CA 0.1700 78.0040 -25.6520 C.3 7 ASP607 0.0000 BACKBONE 112 HA 0.4884 78.2198 -26.6719 H 7 ASP607 0.0000 BACKBONE 113 C 1.4140 77.7990 -24.8050 C.2 7 ASP607 0.0000 BACKBONE 114 O 2.3200 78.6380 -24.8580 O.2 7 ASP607 0.0000 BACKBONE 115 CB -0.6270 79.1780 -25.0820 C.3 7 ASP607 0.0000 116 HB2 -1.4270 79.4285 -25.7787 H 7 ASP607 0.0000 117 HB3 0.0402 80.0330 -24.9723 H 7 ASP607 0.0000 118 CG -1.2410 78.8620 -23.7280 C.2 7 ASP607 0.0000 119 OD1 -1.1730 77.6890 -23.3000 O.co2 7 ASP607 -0.5000 120 OD2 -1.7940 79.7880 -23.0930 O.co2 7 ASP607 -0.5000 121 N 1.4810 76.7290 -24.0210 N.am 8 ILE608 0.0000 BACKBONE 122 H 0.6991 76.0922 -23.9648 H 8 ILE608 0.0000 BACKBONE 123 CA 2.6870 76.4770 -23.2420 C.3 8 ILE608 0.0000 BACKBONE 124 HA 3.0830 77.4094 -22.8396 H 8 ILE608 0.0000 BACKBONE 125 C 3.6910 75.8250 -24.1860 C.2 8 ILE608 0.0000 BACKBONE 126 O 3.4220 74.7400 -24.7220 O.2 8 ILE608 0.0000 BACKBONE 127 CB 2.4020 75.5870 -22.0230 C.3 8 ILE608 0.0000 128 HB 2.0967 74.6056 -22.3859 H 8 ILE608 0.0000 129 CG1 1.2800 76.1790 -21.1650 C.3 8 ILE608 0.0000 130 HG12 0.7598 75.3576 -20.6723 H 8 ILE608 0.0000 131 HG13 0.5886 76.7033 -21.8247 H 8 ILE608 0.0000 132 CG2 3.6490 75.4700 -21.1720 C.3 8 ILE608 0.0000 133 HG21 3.9409 76.4585 -20.8174 H 8 ILE608 0.0000 134 HG22 4.4567 75.0445 -21.7675 H 8 ILE608 0.0000 135 HG23 3.4470 74.8228 -20.3185 H 8 ILE608 0.0000 136 CD1 1.7440 77.1500 -20.1000 C.3 8 ILE608 0.0000 137 HD11 2.4381 76.6466 -19.4270 H 8 ILE608 0.0000 138 HD12 0.8836 77.5070 -19.5341 H 8 ILE608 0.0000 139 HD13 2.2444 77.9954 -20.5722 H 8 ILE608 0.0000 140 N 4.8420 76.4470 -24.4250 N.am 9 PRO609 0.0000 BACKBONE 141 CA 5.8640 75.8230 -25.2720 C.3 9 PRO609 0.0000 BACKBONE 142 HA 5.5083 75.5666 -26.2699 H 9 PRO609 0.0000 BACKBONE 143 C 6.3320 74.4990 -24.6880 C.2 9 PRO609 0.0000 BACKBONE 144 O 6.6590 74.4050 -23.5020 O.2 9 PRO609 0.0000 BACKBONE 145 CB 6.9750 76.8760 -25.2980 C.3 9 PRO609 0.0000 146 HB2 6.8090 77.6007 -26.0951 H 9 PRO609 0.0000 147 HB3 7.9523 76.4110 -25.4275 H 9 PRO609 0.0000 148 CG 6.8610 77.5190 -23.9570 C.3 9 PRO609 0.0000 149 HG2 7.3398 78.4982 -23.9521 H 9 PRO609 0.0000 150 HG3 7.3075 76.8924 -23.1849 H 9 PRO609 0.0000 151 CD 5.3670 77.6460 -23.7540 C.3 9 PRO609 0.0000 152 HD2 5.1136 77.6449 -22.6939 H 9 PRO609 0.0000 153 HD3 4.9839 78.5548 -24.2182 H 9 PRO609 0.0000 154 N 6.3600 73.4660 -25.5260 N.am 10 PHE610 0.0000 BACKBONE 155 H 6.1997 73.6257 -26.5103 H 10 PHE610 0.0000 BACKBONE 156 CA 6.6160 72.1110 -25.0590 C.3 10 PHE610 0.0000 BACKBONE 157 HA 7.0290 72.1308 -24.0505 H 10 PHE610 0.0000 BACKBONE 158 C 7.6340 71.4430 -25.9640 C.2 10 PHE610 0.0000 BACKBONE 159 O 7.4350 71.3610 -27.1800 O.2 10 PHE610 0.0000 BACKBONE 160 CB 5.2870 71.3270 -25.0220 C.3 10 PHE610 0.0000 161 HB2 4.7012 71.6153 -25.8948 H 10 PHE610 0.0000 162 HB3 4.7528 71.6118 -24.1156 H 10 PHE610 0.0000 163 CG 5.4270 69.8150 -25.0290 C.ar 10 PHE610 0.0000 164 CD1 5.7620 69.1280 -26.1940 C.ar 10 PHE610 0.0000 165 HD1 5.9265 69.6829 -27.1058 H 10 PHE610 0.0000 166 CD2 5.2250 69.0830 -23.8750 C.ar 10 PHE610 0.0000 167 HD2 4.9648 69.5898 -22.9574 H 10 PHE610 0.0000 168 CE1 5.8880 67.7550 -26.2080 C.ar 10 PHE610 0.0000 169 HE1 6.1453 67.2438 -27.1239 H 10 PHE610 0.0000 170 CE2 5.3540 67.7000 -23.8860 C.ar 10 PHE610 0.0000 171 HE2 5.1945 67.1386 -22.9773 H 10 PHE610 0.0000 172 CZ 5.6850 67.0390 -25.0520 C.ar 10 PHE610 0.0000 173 HZ 5.7841 65.9636 -25.0560 H 10 PHE610 0.0000 174 N 8.7420 71.0050 -25.3690 N.am 11 GLU611 0.0000 BACKBONE 175 H 8.9193 71.2939 -24.4176 H 11 GLU611 0.0000 BACKBONE 176 CA 9.7110 70.1330 -26.0150 C.3 11 GLU611 0.0000 BACKBONE 177 HA 9.5006 70.1537 -27.0843 H 11 GLU611 0.0000 BACKBONE 178 C 9.5920 68.6860 -25.5570 C.2 11 GLU611 0.0000 BACKBONE 179 O 9.5710 67.7650 -26.3790 O.2 11 GLU611 0.0000 BACKBONE 180 CB 11.1280 70.6430 -25.7420 C.3 11 GLU611 0.0000 181 HB2 11.8265 69.8364 -25.9648 H 11 GLU611 0.0000 182 HB3 11.1966 70.9016 -24.6853 H 11 GLU611 0.0000 183 CG 11.5370 71.8530 -26.5480 C.3 11 GLU611 0.0000 184 HG2 10.7476 72.6023 -26.4890 H 11 GLU611 0.0000 185 HG3 11.6790 71.5560 -27.5871 H 11 GLU611 0.0000 186 CD 12.8230 72.4510 -26.0270 C.2 11 GLU611 0.0000 187 OE1 13.0600 72.3450 -24.8050 O.co2 11 GLU611 -0.5000 188 OE2 13.6020 73.0080 -26.8280 O.co2 11 GLU611 -0.5000 189 N 9.4950 68.4840 -24.2420 N.am 12 GLN612 0.0000 BACKBONE 190 H 9.3895 69.2936 -23.6475 H 12 GLN612 0.0000 BACKBONE 191 CA 9.5310 67.1740 -23.6060 C.3 12 GLN612 0.0000 BACKBONE 192 HA 8.8649 66.4936 -24.1366 H 12 GLN612 0.0000 BACKBONE 193 C 9.0670 67.3100 -22.1620 C.2 12 GLN612 0.0000 BACKBONE 194 O 9.4000 68.2940 -21.4970 O.2 12 GLN612 0.0000 BACKBONE 195 CB 10.9480 66.5880 -23.6650 C.3 12 GLN612 0.0000 196 HB2 11.6132 67.2622 -23.1255 H 12 GLN612 0.0000 197 HB3 11.2490 66.5412 -24.7116 H 12 GLN612 0.0000 198 CG 11.1050 65.2020 -23.0710 C.3 12 GLN612 0.0000 199 HG2 10.9338 64.4620 -23.8528 H 12 GLN612 0.0000 200 HG3 10.3668 65.0720 -22.2796 H 12 GLN612 0.0000 201 CD 12.4890 64.9900 -22.4900 C.2 12 GLN612 0.0000 202 OE1 13.2460 65.9440 -22.3030 O.2 12 GLN612 0.0000 203 NE2 12.8290 63.7380 -22.2040 N.am 12 GLN612 0.0000 204 HE21 13.7402 63.5380 -21.8168 H 12 GLN612 0.0000 205 HE22 12.1763 62.9861 -22.3737 H 12 GLN612 0.0000 206 N 8.2930 66.3350 -21.6860 N.am 13 VAL613 0.0000 BACKBONE 207 H 7.9338 65.6449 -22.3300 H 13 VAL613 0.0000 BACKBONE 208 CA 7.9420 66.2220 -20.2720 C.3 13 VAL613 0.0000 BACKBONE 209 HA 8.5665 66.9187 -19.7128 H 13 VAL613 0.0000 BACKBONE 210 C 8.2060 64.7950 -19.8140 C.2 13 VAL613 0.0000 BACKBONE 211 O 7.9440 63.8350 -20.5470 O.2 13 VAL613 0.0000 BACKBONE 212 CB 6.4820 66.6380 -19.9750 C.3 13 VAL613 0.0000 213 HB 6.3866 66.7510 -18.8951 H 13 VAL613 0.0000 214 CG1 6.1620 67.9510 -20.6370 C.3 13 VAL613 0.0000 215 HG11 6.2555 67.8452 -21.7178 H 13 VAL613 0.0000 216 HG12 6.8563 68.7140 -20.2852 H 13 VAL613 0.0000 217 HG13 5.1424 68.2448 -20.3875 H 13 VAL613 0.0000 218 CG2 5.4970 65.5750 -20.4240 C.3 13 VAL613 0.0000 219 HG21 5.5725 65.4424 -21.5033 H 13 VAL613 0.0000 220 HG22 4.4845 65.8856 -20.1660 H 13 VAL613 0.0000 221 HG23 5.7263 64.6333 -19.9253 H 13 VAL613 0.0000 222 N 8.7820 64.6590 -18.6220 N.am 14 GLU614 0.0000 BACKBONE 223 H 8.8901 65.4759 -18.0379 H 14 GLU614 0.0000 BACKBONE 224 CA 9.2620 63.3760 -18.1290 C.3 14 GLU614 0.0000 BACKBONE 225 HA 9.1871 62.6396 -18.9292 H 14 GLU614 0.0000 BACKBONE 226 C 8.4030 62.9410 -16.9500 C.2 14 GLU614 0.0000 BACKBONE 227 O 8.1120 63.7440 -16.0570 O.2 14 GLU614 0.0000 BACKBONE 228 CB 10.7330 63.4630 -17.7110 C.3 14 GLU614 0.0000 229 HB2 11.3490 63.2140 -18.5751 H 14 GLU614 0.0000 230 HB3 10.9067 62.7346 -16.9189 H 14 GLU614 0.0000 231 CG 11.1580 64.8330 -17.2010 C.3 14 GLU614 0.0000 232 HG2 10.6767 65.0113 -16.2394 H 14 GLU614 0.0000 233 HG3 10.8311 65.5876 -17.9164 H 14 GLU614 0.0000 234 CD 12.6610 64.9540 -17.0210 C.2 14 GLU614 0.0000 235 OE1 13.2590 64.0670 -16.3730 O.co2 14 GLU614 -0.5000 236 OE2 13.2440 65.9380 -17.5260 O.co2 14 GLU614 -0.5000 237 N 7.9940 61.6750 -16.9610 N.am 15 LEU615 0.0000 BACKBONE 238 H 8.1935 61.0997 -17.7668 H 15 LEU615 0.0000 BACKBONE 239 CA 7.2660 61.0990 -15.8400 C.3 15 LEU615 0.0000 BACKBONE 240 HA 6.4705 61.7913 -15.5644 H 15 LEU615 0.0000 BACKBONE 241 C 8.1670 60.9170 -14.6230 C.2 15 LEU615 0.0000 BACKBONE 242 O 9.3280 60.5160 -14.7420 O.2 15 LEU615 0.0000 BACKBONE 243 CB 6.6520 59.7610 -16.2470 C.3 15 LEU615 0.0000 244 HB2 6.8478 59.0446 -15.4492 H 15 LEU615 0.0000 245 HB3 7.1437 59.4297 -17.1616 H 15 LEU615 0.0000 246 CG 5.1430 59.7820 -16.5030 C.3 15 LEU615 0.0000 247 HG 4.6451 59.9796 -15.5537 H 15 LEU615 0.0000 248 CD1 4.7770 60.8910 -17.4790 C.3 15 LEU615 0.0000 249 HD11 5.2670 60.7095 -18.4356 H 15 LEU615 0.0000 250 HD12 5.1054 61.8502 -17.0788 H 15 LEU615 0.0000 251 HD13 3.6965 60.9076 -17.6216 H 15 LEU615 0.0000 252 CD2 4.6600 58.4370 -17.0220 C.3 15 LEU615 0.0000 253 HD21 5.1462 58.2186 -17.9728 H 15 LEU615 0.0000 254 HD22 3.5799 58.4694 -17.1652 H 15 LEU615 0.0000 255 HD23 4.9076 57.6588 -16.3001 H 15 LEU615 0.0000 256 N 7.6180 61.2190 -13.4450 N.am 16 GLY616 0.0000 BACKBONE 257 H 6.7248 61.6905 -13.4395 H 16 GLY616 0.0000 BACKBONE 258 CA 8.2340 60.9070 -12.1800 C.3 16 GLY616 0.0000 BACKBONE 259 HA2 8.3191 61.8233 -11.5958 H 16 GLY616 0.0000 BACKBONE 260 HA3 9.2283 60.5003 -12.3648 H 16 GLY616 0.0000 BACKBONE 261 C 7.4330 59.8950 -11.3860 C.2 16 GLY616 0.0000 BACKBONE 262 O 6.6300 59.1250 -11.9310 O.2 16 GLY616 0.0000 BACKBONE 263 N 7.6550 59.8960 -10.0720 N.am 17 GLU617 0.0000 BACKBONE 264 H 8.2467 60.6063 -9.6652 H 17 GLU617 0.0000 BACKBONE 265 CA 7.0540 58.8850 -9.2190 C.3 17 GLU617 0.0000 BACKBONE 266 HA 7.3032 57.9061 -9.6286 H 17 GLU617 0.0000 BACKBONE 267 C 5.5340 59.0480 -9.1850 C.2 17 GLU617 0.0000 BACKBONE 268 O 5.0200 60.1670 -9.2670 O.2 17 GLU617 0.0000 BACKBONE 269 CB 7.6010 58.9960 -7.7950 C.3 17 GLU617 0.0000 270 HB2 6.9636 58.3944 -7.1469 H 17 GLU617 0.0000 271 HB3 7.5385 60.0424 -7.4962 H 17 GLU617 0.0000 272 CG 9.0450 58.5370 -7.5840 C.3 17 GLU617 0.0000 273 HG2 9.1716 58.2752 -6.5335 H 17 GLU617 0.0000 274 HG3 9.7082 59.3650 -7.8346 H 17 GLU617 0.0000 275 CD 9.4400 57.3360 -8.4270 C.2 17 GLU617 0.0000 276 OE1 10.5300 57.3760 -9.0360 O.co2 17 GLU617 -0.5000 277 OE2 8.6860 56.3380 -8.4520 O.co2 17 GLU617 -0.5000 278 N 4.7920 57.9490 -9.0660 N.am 18 PRO618 0.0000 BACKBONE 279 CA 3.3400 58.0630 -8.9080 C.3 18 PRO618 0.0000 BACKBONE 280 HA 2.8749 58.7350 -9.6293 H 18 PRO618 0.0000 BACKBONE 281 C 3.0010 58.6310 -7.5400 C.2 18 PRO618 0.0000 BACKBONE 282 O 3.7680 58.4970 -6.5830 O.2 18 PRO618 0.0000 BACKBONE 283 CB 2.8480 56.6190 -9.0600 C.3 18 PRO618 0.0000 284 HB2 2.5586 56.4174 -10.0913 H 18 PRO618 0.0000 285 HB3 2.0006 56.4296 -8.4012 H 18 PRO618 0.0000 286 CG 4.0170 55.7820 -8.6680 C.3 18 PRO618 0.0000 287 HG2 3.9755 54.8150 -9.1694 H 18 PRO618 0.0000 288 HG3 4.0298 55.6313 -7.5885 H 18 PRO618 0.0000 289 CD 5.2390 56.5450 -9.1040 C.3 18 PRO618 0.0000 290 HD2 6.0684 56.3803 -8.4162 H 18 PRO618 0.0000 291 HD3 5.5400 56.2579 -10.1115 H 18 PRO618 0.0000 292 N 1.8360 59.2720 -7.4500 N.am 19 ILE619 0.0000 BACKBONE 293 H 1.2478 59.3599 -8.2663 H 19 ILE619 0.0000 BACKBONE 294 CA 1.4040 59.8480 -6.1800 C.3 19 ILE619 0.0000 BACKBONE 295 HA 1.9363 59.3256 -5.3851 H 19 ILE619 0.0000 BACKBONE 296 C -0.0900 59.6460 -5.9540 C.2 19 ILE619 0.0000 BACKBONE 297 O -0.7860 60.5640 -5.5080 O.2 19 ILE619 0.0000 BACKBONE 298 CB 1.7600 61.3470 -6.1110 C.3 19 ILE619 0.0000 299 HB 1.1813 61.8001 -5.3060 H 19 ILE619 0.0000 300 CG1 1.3840 62.0450 -7.4200 C.3 19 ILE619 0.0000 301 HG12 0.3539 61.7855 -7.6642 H 19 ILE619 0.0000 302 HG13 2.0463 61.6816 -8.2058 H 19 ILE619 0.0000 303 CG2 3.2350 61.5480 -5.7790 C.3 19 ILE619 0.0000 304 HG21 3.8477 61.1061 -6.5648 H 19 ILE619 0.0000 305 HG22 3.4621 61.0672 -4.8275 H 19 ILE619 0.0000 306 HG23 3.4493 62.6143 -5.7075 H 19 ILE619 0.0000 307 CD1 1.4950 63.5500 -7.3620 C.3 19 ILE619 0.0000 308 HD11 0.8387 63.9329 -6.5805 H 19 ILE619 0.0000 309 HD12 1.2015 63.9733 -8.3226 H 19 ILE619 0.0000 310 HD13 2.5249 63.8301 -7.1410 H 19 ILE619 0.0000 311 N -0.5920 58.4480 -6.2440 N.am 20 GLY620 0.0000 BACKBONE 312 H -0.0131 57.7587 -6.7021 H 20 GLY620 0.0000 BACKBONE 313 CA -1.9660 58.1260 -5.9060 C.3 20 GLY620 0.0000 BACKBONE 314 HA2 -2.4221 59.0111 -5.4626 H 20 GLY620 0.0000 BACKBONE 315 HA3 -1.9544 57.3181 -5.1744 H 20 GLY620 0.0000 BACKBONE 316 C -2.8240 57.6900 -7.0750 C.2 20 GLY620 0.0000 BACKBONE 317 O -2.7530 58.2720 -8.1620 O.2 20 GLY620 0.0000 BACKBONE 318 N -3.6420 56.6660 -6.8580 N.am 21 GLN621 0.0000 BACKBONE 319 H -3.5827 56.1853 -5.9717 H 21 GLN621 0.0000 BACKBONE 320 CA -4.6190 56.2010 -7.8310 C.3 21 GLN621 0.0000 BACKBONE 321 HA -4.3875 56.6592 -8.7925 H 21 GLN621 0.0000 BACKBONE 322 C -6.0290 56.6310 -7.4330 C.2 21 GLN621 0.0000 BACKBONE 323 O -6.2650 57.1780 -6.3520 O.2 21 GLN621 0.0000 BACKBONE 324 CB -4.5360 54.6810 -7.9960 C.3 21 GLN621 0.0000 325 HB2 -5.5042 54.3163 -8.3390 H 21 GLN621 0.0000 326 HB3 -4.3040 54.2394 -7.0268 H 21 GLN621 0.0000 327 CG -3.4740 54.2440 -8.9930 C.3 21 GLN621 0.0000 328 HG2 -2.6736 54.9840 -8.9950 H 21 GLN621 0.0000 329 HG3 -3.9262 54.1953 -9.9836 H 21 GLN621 0.0000 330 CD -2.8800 52.8920 -8.6670 C.2 21 GLN621 0.0000 331 OE1 -3.1550 52.3170 -7.6140 O.2 21 GLN621 0.0000 332 NE2 -2.0590 52.3730 -9.5740 N.am 21 GLN621 0.0000 333 HE21 -1.6329 51.4716 -9.4125 H 21 GLN621 0.0000 334 HE22 -1.8611 52.8799 -10.4249 H 21 GLN621 0.0000 335 N -6.9700 56.3780 -8.3340 N.am 22 GLY622 0.0000 BACKBONE 336 H -6.7167 55.9136 -9.1944 H 22 GLY622 0.0000 BACKBONE 337 CA -8.3550 56.7530 -8.1120 C.3 22 GLY622 0.0000 BACKBONE 338 HA2 -8.4245 57.8362 -8.0119 H 22 GLY622 0.0000 BACKBONE 339 HA3 -8.7155 56.2798 -7.1987 H 22 GLY622 0.0000 BACKBONE 340 C -9.2040 56.3020 -9.2790 C.2 22 GLY622 0.0000 BACKBONE 341 O -8.7290 55.6280 -10.1990 O.2 22 GLY622 0.0000 BACKBONE 342 N -10.4860 56.6840 -9.2290 N.am 23 ARG623 0.0000 BACKBONE 343 H -10.8154 57.2463 -8.4574 H 23 ARG623 0.0000 BACKBONE 344 CA -11.4090 56.2880 -10.2900 C.3 23 ARG623 0.0000 BACKBONE 345 HA -11.3717 55.1989 -10.3118 H 23 ARG623 0.0000 BACKBONE 346 C -10.9950 56.8360 -11.6450 C.2 23 ARG623 0.0000 BACKBONE 347 O -11.3860 56.2730 -12.6740 O.2 23 ARG623 0.0000 BACKBONE 348 CB -12.8410 56.7460 -10.0080 C.3 23 ARG623 0.0000 349 HB2 -13.5120 56.0906 -10.5633 H 23 ARG623 0.0000 350 HB3 -12.9399 57.7660 -10.3793 H 23 ARG623 0.0000 351 CG -13.2870 56.7400 -8.5670 C.3 23 ARG623 0.0000 352 HG2 -12.9434 57.6490 -8.0732 H 23 ARG623 0.0000 353 HG3 -12.8707 55.8706 -8.0581 H 23 ARG623 0.0000 354 CD -14.8120 56.6780 -8.5250 C.3 23 ARG623 0.0000 355 HD2 -15.1099 56.1165 -7.6395 H 23 ARG623 0.0000 356 HD3 -15.1607 56.1596 -9.4182 H 23 ARG623 0.0000 357 NE -15.4490 57.9920 -8.4750 N.pl3 23 ARG623 0.0000 358 HE -15.9753 58.2861 -9.2853 H 23 ARG623 0.0000 359 CZ -15.3890 58.8300 -7.4450 C.cat 23 ARG623 1.0000 360 NH1 -14.7050 58.5120 -6.3530 N.pl3 23 ARG623 0.0000 361 HH11 -14.6616 59.1584 -5.5782 H 23 ARG623 0.0000 362 HH12 -14.2279 57.6236 -6.2968 H 23 ARG623 0.0000 363 NH2 -16.0120 59.9970 -7.5110 N.pl3 23 ARG623 0.0000 364 HH21 -15.9650 60.6393 -6.7330 H 23 ARG623 0.0000 365 HH22 -16.5341 60.2446 -8.3394 H 23 ARG623 0.0000 366 N -10.2200 57.9150 -11.6760 N.am 24 TRP624 0.0000 BACKBONE 367 H -9.8696 58.2887 -10.8056 H 24 TRP624 0.0000 BACKBONE 368 CA -9.8580 58.5780 -12.9230 C.3 24 TRP624 0.0000 BACKBONE 369 HA -10.3399 58.0976 -13.7745 H 24 TRP624 0.0000 BACKBONE 370 C -8.3470 58.4820 -13.0720 C.2 24 TRP624 0.0000 BACKBONE 371 O -7.6050 59.4030 -12.7200 O.2 24 TRP624 0.0000 BACKBONE 372 CB -10.3290 60.0170 -12.9090 C.3 24 TRP624 0.0000 373 HB2 -10.3112 60.3967 -13.9306 H 24 TRP624 0.0000 374 HB3 -9.6436 60.5992 -12.2931 H 24 TRP624 0.0000 375 CG -11.7110 60.1820 -12.3660 C.2 24 TRP624 0.0000 376 CD1 -12.0620 60.3660 -11.0590 C.2 24 TRP624 0.0000 377 HD1 -11.3684 60.4079 -10.2323 H 24 TRP624 0.0000 378 CD2 -12.9290 60.2160 -13.1170 C.ar 24 TRP624 0.0000 379 NE1 -13.4250 60.4900 -10.9490 N.pl3 24 TRP624 0.0000 380 HE1 -13.9349 60.6223 -10.0873 H 24 TRP624 0.0000 381 CE2 -13.9810 60.4050 -12.1990 C.ar 24 TRP624 0.0000 382 CE3 -13.2330 60.0970 -14.4770 C.ar 24 TRP624 0.0000 383 HE3 -12.4493 59.9518 -15.2058 H 24 TRP624 0.0000 384 CZ2 -15.3140 60.4780 -12.5970 C.ar 24 TRP624 0.0000 385 HZ2 -16.1065 60.6238 -11.8779 H 24 TRP624 0.0000 386 CZ3 -14.5570 60.1690 -14.8700 C.ar 24 TRP624 0.0000 387 HZ3 -14.8057 60.0780 -15.9170 H 24 TRP624 0.0000 388 CH2 -15.5810 60.3580 -13.9330 C.ar 24 TRP624 0.0000 389 HH2 -16.6047 60.4101 -14.2733 H 24 TRP624 0.0000 390 N -7.9010 57.3460 -13.5990 N.am 25 GLY625 0.0000 BACKBONE 391 H -8.5701 56.6245 -13.8266 H 25 GLY625 0.0000 BACKBONE 392 CA -6.5010 57.0970 -13.8610 C.3 25 GLY625 0.0000 BACKBONE 393 HA2 -6.1879 57.7770 -14.6532 H 25 GLY625 0.0000 BACKBONE 394 HA3 -6.4086 56.0679 -14.2080 H 25 GLY625 0.0000 BACKBONE 395 C -5.5470 57.2760 -12.7010 C.2 25 GLY625 0.0000 BACKBONE 396 O -5.9480 57.3860 -11.5370 O.2 25 GLY625 0.0000 BACKBONE 397 N -4.2630 57.3070 -13.0340 N.am 26 ARG626 0.0000 BACKBONE 398 H -4.0266 57.2581 -14.0147 H 26 ARG626 0.0000 BACKBONE 399 CA -3.1760 57.4070 -12.0750 C.3 26 ARG626 0.0000 BACKBONE 400 HA -3.5768 57.3481 -11.0631 H 26 ARG626 0.0000 BACKBONE 401 C -2.4720 58.7410 -12.2700 C.2 26 ARG626 0.0000 BACKBONE 402 O -2.2260 59.1620 -13.4050 O.2 26 ARG626 0.0000 BACKBONE 403 CB -2.1910 56.2520 -12.2560 C.3 26 ARG626 0.0000 404 HB2 -1.7466 56.0201 -11.2881 H 26 ARG626 0.0000 405 HB3 -1.4102 56.5671 -12.9482 H 26 ARG626 0.0000 406 CG -2.8430 54.9930 -12.8030 C.3 26 ARG626 0.0000 407 HG2 -3.4359 55.2529 -13.6799 H 26 ARG626 0.0000 408 HG3 -3.4930 54.5689 -12.0376 H 26 ARG626 0.0000 409 CD -1.8090 53.9630 -13.1960 C.3 26 ARG626 0.0000 410 HD2 -2.2767 52.9788 -13.2249 H 26 ARG626 0.0000 411 HD3 -1.0060 53.9621 -12.4589 H 26 ARG626 0.0000 412 NE -1.2530 54.2690 -14.5110 N.pl3 26 ARG626 0.0000 413 HE -1.7859 54.8762 -15.1171 H 26 ARG626 0.0000 414 CZ -0.0950 53.8040 -14.9650 C.cat 26 ARG626 1.0000 415 NH1 0.6360 52.9880 -14.2150 N.pl3 26 ARG626 0.0000 416 HH11 1.5096 52.6244 -14.5681 H 26 ARG626 0.0000 417 HH12 0.3185 52.7308 -13.2913 H 26 ARG626 0.0000 418 NH2 0.3240 54.1410 -16.1790 N.pl3 26 ARG626 0.0000 419 HH21 1.1978 53.7767 -16.5309 H 26 ARG626 0.0000 420 HH22 -0.2311 54.7617 -16.7506 H 26 ARG626 0.0000 421 N -2.1420 59.4000 -11.1670 N.am 27 VAL627 0.0000 BACKBONE 422 H -2.2936 58.9561 -10.2725 H 27 VAL627 0.0000 BACKBONE 423 CA -1.5690 60.7400 -11.1960 C.3 27 VAL627 0.0000 BACKBONE 424 HA -1.6897 61.1713 -12.1897 H 27 VAL627 0.0000 BACKBONE 425 C -0.0970 60.6140 -10.8460 C.2 27 VAL627 0.0000 BACKBONE 426 O 0.2540 60.1450 -9.7550 O.2 27 VAL627 0.0000 BACKBONE 427 CB -2.2910 61.6950 -10.2330 C.3 27 VAL627 0.0000 428 HB -2.5096 61.1561 -9.3111 H 27 VAL627 0.0000 429 CG1 -1.4030 62.8850 -9.8950 C.3 27 VAL627 0.0000 430 HG11 -1.1732 63.4373 -10.8062 H 27 VAL627 0.0000 431 HG12 -0.4772 62.5304 -9.4418 H 27 VAL627 0.0000 432 HG13 -1.9229 63.5391 -9.1950 H 27 VAL627 0.0000 433 CG2 -3.6010 62.1670 -10.8410 C.3 27 VAL627 0.0000 434 HG21 -3.3984 62.7085 -11.7650 H 27 VAL627 0.0000 435 HG22 -4.1112 62.8257 -10.1383 H 27 VAL627 0.0000 436 HG23 -4.2331 61.3054 -11.0559 H 27 VAL627 0.0000 437 N 0.7620 61.0170 -11.7730 N.am 28 HIS628 0.0000 BACKBONE 438 H 0.4053 61.3161 -12.6693 H 28 HIS628 0.0000 BACKBONE 439 CA 2.1950 61.0440 -11.5470 C.3 28 HIS628 0.0000 BACKBONE 440 HA 2.3768 60.4722 -10.6370 H 28 HIS628 0.0000 BACKBONE 441 C 2.6910 62.4690 -11.3610 C.2 28 HIS628 0.0000 BACKBONE 442 O 2.0830 63.4420 -11.8140 O.2 28 HIS628 0.0000 BACKBONE 443 CB 2.9690 60.3910 -12.6990 C.3 28 HIS628 0.0000 444 HB2 4.0285 60.6108 -12.5681 H 28 HIS628 0.0000 445 HB3 2.6208 60.8259 -13.6359 H 28 HIS628 0.0000 446 CG 2.8030 58.9070 -12.7790 C.2 28 HIS628 0.0000 447 ND1 3.7660 58.0310 -12.3290 N.2 28 HIS628 0.0000 448 CD2 1.7950 58.1440 -13.2640 C.2 28 HIS628 0.0000 449 HD2 0.8747 58.5002 -13.7028 H 28 HIS628 0.0000 450 CE1 3.3560 56.7910 -12.5270 C.2 28 HIS628 0.0000 451 HE1 3.9030 55.8960 -12.2699 H 28 HIS628 0.0000 452 NE2 2.1630 56.8320 -13.0930 N.pl3 28 HIS628 0.0000 453 HE2 1.6110 56.0285 -13.3572 H 28 HIS628 0.0000 454 N 3.8280 62.5570 -10.6890 N.am 29 ARG629 0.0000 BACKBONE 455 H 4.1659 61.7367 -10.2062 H 29 ARG629 0.0000 BACKBONE 456 CA 4.6100 63.7720 -10.6130 C.3 29 ARG629 0.0000 BACKBONE 457 HA 3.9623 64.6487 -10.6138 H 29 ARG629 0.0000 BACKBONE 458 C 5.5360 63.7920 -11.8150 C.2 29 ARG629 0.0000 BACKBONE 459 O 5.9100 62.7460 -12.3470 O.2 29 ARG629 0.0000 BACKBONE 460 CB 5.4270 63.7860 -9.3200 C.3 29 ARG629 0.0000 461 HB2 6.0133 62.8677 -9.2879 H 29 ARG629 0.0000 462 HB3 4.7266 63.7992 -8.4850 H 29 ARG629 0.0000 463 CG 6.3820 64.9500 -9.1400 C.3 29 ARG629 0.0000 464 HG2 5.8771 65.8763 -9.4140 H 29 ARG629 0.0000 465 HG3 7.2509 64.8061 -9.7822 H 29 ARG629 0.0000 466 CD 6.8360 65.0340 -7.6900 C.3 29 ARG629 0.0000 467 HD2 7.4438 64.1580 -7.4634 H 29 ARG629 0.0000 468 HD3 5.9549 65.0407 -7.0483 H 29 ARG629 0.0000 469 NE 7.6220 66.2310 -7.4160 N.pl3 29 ARG629 0.0000 470 HE 8.0688 66.6928 -8.1952 H 29 ARG629 0.0000 471 CZ 7.7870 66.7520 -6.2050 C.cat 29 ARG629 1.0000 472 NH1 7.2150 66.1790 -5.1550 N.pl3 29 ARG629 0.0000 473 HH11 7.3384 66.5749 -4.2341 H 29 ARG629 0.0000 474 HH12 6.6559 65.3466 -5.2761 H 29 ARG629 0.0000 475 NH2 8.5210 67.8450 -6.0450 N.pl3 29 ARG629 0.0000 476 HH21 8.6440 68.2404 -5.1238 H 29 ARG629 0.0000 477 HH22 8.9570 68.2820 -6.8444 H 29 ARG629 0.0000 478 N 5.8580 64.9870 -12.2820 N.am 30 GLY630 0.0000 BACKBONE 479 H 5.5823 65.8186 -11.7794 H 30 GLY630 0.0000 BACKBONE 480 CA 6.6070 65.0990 -13.5160 C.3 30 GLY630 0.0000 BACKBONE 481 HA2 5.9289 65.0060 -14.3643 H 30 GLY630 0.0000 BACKBONE 482 HA3 7.3562 64.3085 -13.5613 H 30 GLY630 0.0000 BACKBONE 483 C 7.2870 66.4410 -13.5590 C.2 30 GLY630 0.0000 BACKBONE 484 O 6.9530 67.3500 -12.7960 O.2 30 GLY630 0.0000 BACKBONE 485 N 8.2500 66.5590 -14.4630 N.am 31 ARG631 0.0000 BACKBONE 486 H 8.5235 65.7439 -14.9929 H 31 ARG631 0.0000 BACKBONE 487 CA 8.9260 67.8210 -14.7180 C.3 31 ARG631 0.0000 BACKBONE 488 HA 8.5939 68.5578 -13.9866 H 31 ARG631 0.0000 BACKBONE 489 C 8.5670 68.3060 -16.1120 C.2 31 ARG631 0.0000 BACKBONE 490 O 8.7990 67.5980 -17.0990 O.2 31 ARG631 0.0000 BACKBONE 491 CB 10.4370 67.6800 -14.5560 C.3 31 ARG631 0.0000 492 HB2 10.9096 68.6189 -14.8447 H 31 ARG631 0.0000 493 HB3 10.7866 66.8812 -15.2100 H 31 ARG631 0.0000 494 CG 10.8350 67.3520 -13.1300 C.3 31 ARG631 0.0000 495 HG2 10.1857 66.5627 -12.7512 H 31 ARG631 0.0000 496 HG3 10.7205 68.2437 -12.5137 H 31 ARG631 0.0000 497 CD 12.2670 66.8870 -13.0630 C.3 31 ARG631 0.0000 498 HD2 12.4132 66.0650 -13.7637 H 31 ARG631 0.0000 499 HD3 12.4894 66.5463 -12.0518 H 31 ARG631 0.0000 500 NE 13.1610 67.9830 -13.4110 N.pl3 31 ARG631 0.0000 501 HE 13.5334 68.0156 -14.3493 H 31 ARG631 0.0000 502 CZ 13.5130 68.9410 -12.5630 C.cat 31 ARG631 1.0000 503 NH1 13.0400 68.9310 -11.3240 N.pl3 31 ARG631 0.0000 504 HH11 13.2990 69.6635 -10.6786 H 31 ARG631 0.0000 505 HH12 12.4208 68.1909 -11.0258 H 31 ARG631 0.0000 506 NH2 14.3260 69.9140 -12.9520 N.pl3 31 ARG631 0.0000 507 HH21 14.5838 70.6455 -12.3051 H 31 ARG631 0.0000 508 HH22 14.6873 69.9234 -13.8951 H 31 ARG631 0.0000 509 N 8.0050 69.5060 -16.1870 N.am 32 TRP632 0.0000 BACKBONE 510 H 7.6564 69.9495 -15.3492 H 32 TRP632 0.0000 BACKBONE 511 CA 7.8880 70.1840 -17.4610 C.3 32 TRP632 0.0000 BACKBONE 512 HA 7.4816 69.5288 -18.2315 H 32 TRP632 0.0000 BACKBONE 513 C 9.3010 70.6470 -17.7680 C.2 32 TRP632 0.0000 BACKBONE 514 H 10.0589 69.9139 -18.0016 H 32 TRP632 0.0000 BACKBONE 515 O 9.6000 71.8400 -17.7560 O.2 32 TRP632 0.0000 BACKBONE 516 CB 6.9160 71.3700 -17.4010 C.3 32 TRP632 0.0000 517 HB2 7.3403 72.1289 -16.7436 H 32 TRP632 0.0000 518 HB3 5.9706 71.0187 -16.9877 H 32 TRP632 0.0000 519 CG 6.6430 72.0010 -18.7390 C.2 32 TRP632 0.0000 520 CD1 7.3220 73.0350 -19.3150 C.2 32 TRP632 0.0000 521 HD1 8.1698 73.5392 -18.8753 H 32 TRP632 0.0000 522 CD2 5.5780 71.6690 -19.6410 C.ar 32 TRP632 0.0000 523 NE1 6.7700 73.3420 -20.5370 N.pl3 32 TRP632 0.0000 524 HE1 7.1030 74.0558 -21.1692 H 32 TRP632 0.0000 525 CE2 5.6940 72.5210 -20.7570 C.ar 32 TRP632 0.0000 526 CE3 4.5430 70.7280 -19.6180 C.ar 32 TRP632 0.0000 527 HE3 4.4227 70.0630 -18.7755 H 32 TRP632 0.0000 528 CZ2 4.8190 72.4530 -21.8420 C.ar 32 TRP632 0.0000 529 HZ2 4.9305 73.1098 -22.6920 H 32 TRP632 0.0000 530 CZ3 3.6730 70.6650 -20.6990 C.ar 32 TRP632 0.0000 531 HZ3 2.8734 69.9391 -20.6954 H 32 TRP632 0.0000 532 CH2 3.8150 71.5250 -21.7910 C.ar 32 TRP632 0.0000 533 HH2 3.1172 71.4557 -22.6124 H 32 TRP632 0.0000 @BOND 1 1 2 1 BACKBONE 2 1 3 1 BACKBONE 3 1 4 1 BACKBONE 4 1 5 1 BACKBONE 5 5 6 1 BACKBONE 6 5 7 1 BACKBONE 7 5 9 1 8 7 8 2 BACKBONE 9 7 13 am BACKBONE|INTERRES 10 9 10 1 11 9 11 1 12 9 12 1 13 13 14 1 BACKBONE 14 13 15 1 BACKBONE 15 15 16 1 BACKBONE 16 15 17 1 BACKBONE 17 15 19 1 18 17 18 2 BACKBONE 19 17 34 am BACKBONE|INTERRES 20 19 20 1 21 19 21 1 22 19 22 1 23 22 23 ar 24 22 25 ar 25 23 24 1 26 23 27 ar 27 25 26 1 28 25 29 ar 29 27 28 1 30 27 31 ar 31 29 30 1 32 29 31 ar 33 31 32 1 34 32 33 1 35 34 35 1 BACKBONE 36 34 36 1 BACKBONE 37 36 37 1 BACKBONE 38 36 38 1 BACKBONE 39 36 40 1 40 38 39 2 BACKBONE 41 38 53 am BACKBONE|INTERRES 42 40 41 1 43 40 42 1 44 40 43 1 45 43 44 1 46 43 45 1 47 43 49 1 48 45 46 1 49 45 47 1 50 45 48 1 51 49 50 1 52 49 51 1 53 49 52 1 54 53 54 1 BACKBONE 55 53 55 1 BACKBONE 56 55 56 1 BACKBONE 57 55 57 1 BACKBONE 58 55 59 1 59 57 58 2 BACKBONE 60 57 70 am BACKBONE|INTERRES 61 59 60 1 62 59 61 1 63 59 62 1 64 62 63 1 65 62 64 1 66 62 65 1 67 65 66 2 68 65 67 am 69 67 68 1 70 67 69 1 71 70 71 1 BACKBONE 72 70 72 1 BACKBONE 73 72 73 1 BACKBONE 74 72 74 1 BACKBONE 75 72 76 1 76 74 75 2 BACKBONE 77 74 85 am BACKBONE|INTERRES 78 76 77 1 79 76 78 1 80 76 79 1 81 79 80 1 82 79 81 1 83 79 82 1 84 82 83 ar 85 82 84 ar 86 85 86 1 BACKBONE 87 85 87 1 BACKBONE 88 87 88 1 BACKBONE 89 87 89 1 BACKBONE 90 87 91 1 91 89 90 2 BACKBONE 92 89 109 am BACKBONE|INTERRES 93 91 92 1 94 91 93 1 95 91 94 1 96 94 95 2 97 94 97 1 98 95 96 1 99 95 98 1 100 97 100 ar 101 97 101 ar 102 98 99 1 103 98 100 1 104 100 103 ar 105 101 102 1 106 101 105 ar 107 103 104 1 108 103 107 ar 109 105 106 1 110 105 107 ar 111 107 108 1 112 109 110 1 BACKBONE 113 109 111 1 BACKBONE 114 111 112 1 BACKBONE 115 111 113 1 BACKBONE 116 111 115 1 117 113 114 2 BACKBONE 118 113 121 am BACKBONE|INTERRES 119 115 116 1 120 115 117 1 121 115 118 1 122 118 119 ar 123 118 120 ar 124 121 122 1 BACKBONE 125 121 123 1 BACKBONE 126 123 124 1 BACKBONE 127 123 125 1 BACKBONE 128 123 127 1 129 125 126 2 BACKBONE 130 125 140 am BACKBONE|INTERRES 131 127 128 1 132 127 129 1 133 127 132 1 134 129 130 1 135 129 131 1 136 129 136 1 137 132 133 1 138 132 134 1 139 132 135 1 140 136 137 1 141 136 138 1 142 136 139 1 143 140 141 1 BACKBONE 144 140 151 1 145 141 142 1 BACKBONE 146 141 143 1 BACKBONE 147 141 145 1 148 143 144 2 BACKBONE 149 143 154 am BACKBONE|INTERRES 150 145 146 1 151 145 147 1 152 145 148 1 153 148 149 1 154 148 150 1 155 148 151 1 156 151 152 1 157 151 153 1 158 154 155 1 BACKBONE 159 154 156 1 BACKBONE 160 156 157 1 BACKBONE 161 156 158 1 BACKBONE 162 156 160 1 163 158 159 2 BACKBONE 164 158 174 am BACKBONE|INTERRES 165 160 161 1 166 160 162 1 167 160 163 1 168 163 164 ar 169 163 166 ar 170 164 165 1 171 164 168 ar 172 166 167 1 173 166 170 ar 174 168 169 1 175 168 172 ar 176 170 171 1 177 170 172 ar 178 172 173 1 179 174 175 1 BACKBONE 180 174 176 1 BACKBONE 181 176 177 1 BACKBONE 182 176 178 1 BACKBONE 183 176 180 1 184 178 179 2 BACKBONE 185 178 189 am BACKBONE|INTERRES 186 180 181 1 187 180 182 1 188 180 183 1 189 183 184 1 190 183 185 1 191 183 186 1 192 186 187 ar 193 186 188 ar 194 189 190 1 BACKBONE 195 189 191 1 BACKBONE 196 191 192 1 BACKBONE 197 191 193 1 BACKBONE 198 191 195 1 199 193 194 2 BACKBONE 200 193 206 am BACKBONE|INTERRES 201 195 196 1 202 195 197 1 203 195 198 1 204 198 199 1 205 198 200 1 206 198 201 1 207 201 202 2 208 201 203 am 209 203 204 1 210 203 205 1 211 206 207 1 BACKBONE 212 206 208 1 BACKBONE 213 208 209 1 BACKBONE 214 208 210 1 BACKBONE 215 208 212 1 216 210 211 2 BACKBONE 217 210 222 am BACKBONE|INTERRES 218 212 213 1 219 212 214 1 220 212 218 1 221 214 215 1 222 214 216 1 223 214 217 1 224 218 219 1 225 218 220 1 226 218 221 1 227 222 223 1 BACKBONE 228 222 224 1 BACKBONE 229 224 225 1 BACKBONE 230 224 226 1 BACKBONE 231 224 228 1 232 226 227 2 BACKBONE 233 226 237 am BACKBONE|INTERRES 234 228 229 1 235 228 230 1 236 228 231 1 237 231 232 1 238 231 233 1 239 231 234 1 240 234 235 ar 241 234 236 ar 242 237 238 1 BACKBONE 243 237 239 1 BACKBONE 244 239 240 1 BACKBONE 245 239 241 1 BACKBONE 246 239 243 1 247 241 242 2 BACKBONE 248 241 256 am BACKBONE|INTERRES 249 243 244 1 250 243 245 1 251 243 246 1 252 246 247 1 253 246 248 1 254 246 252 1 255 248 249 1 256 248 250 1 257 248 251 1 258 252 253 1 259 252 254 1 260 252 255 1 261 256 257 1 BACKBONE 262 256 258 1 BACKBONE 263 258 259 1 BACKBONE 264 258 260 1 BACKBONE 265 258 261 1 BACKBONE 266 261 262 2 BACKBONE 267 261 263 am BACKBONE|INTERRES 268 263 264 1 BACKBONE 269 263 265 1 BACKBONE 270 265 266 1 BACKBONE 271 265 267 1 BACKBONE 272 265 269 1 273 267 268 2 BACKBONE 274 267 278 am BACKBONE|INTERRES 275 269 270 1 276 269 271 1 277 269 272 1 278 272 273 1 279 272 274 1 280 272 275 1 281 275 276 ar 282 275 277 ar 283 278 279 1 BACKBONE 284 278 289 1 285 279 280 1 BACKBONE 286 279 281 1 BACKBONE 287 279 283 1 288 281 282 2 BACKBONE 289 281 292 am BACKBONE|INTERRES 290 283 284 1 291 283 285 1 292 283 286 1 293 286 287 1 294 286 288 1 295 286 289 1 296 289 290 1 297 289 291 1 298 292 293 1 BACKBONE 299 292 294 1 BACKBONE 300 294 295 1 BACKBONE 301 294 296 1 BACKBONE 302 294 298 1 303 296 297 2 BACKBONE 304 296 311 am BACKBONE|INTERRES 305 298 299 1 306 298 300 1 307 298 303 1 308 300 301 1 309 300 302 1 310 300 307 1 311 303 304 1 312 303 305 1 313 303 306 1 314 307 308 1 315 307 309 1 316 307 310 1 317 311 312 1 BACKBONE 318 311 313 1 BACKBONE 319 313 314 1 BACKBONE 320 313 315 1 BACKBONE 321 313 316 1 BACKBONE 322 316 317 2 BACKBONE 323 316 318 am BACKBONE|INTERRES 324 318 319 1 BACKBONE 325 318 320 1 BACKBONE 326 320 321 1 BACKBONE 327 320 322 1 BACKBONE 328 320 324 1 329 322 323 2 BACKBONE 330 322 335 am BACKBONE|INTERRES 331 324 325 1 332 324 326 1 333 324 327 1 334 327 328 1 335 327 329 1 336 327 330 1 337 330 331 2 338 330 332 am 339 332 333 1 340 332 334 1 341 335 336 1 BACKBONE 342 335 337 1 BACKBONE 343 337 338 1 BACKBONE 344 337 339 1 BACKBONE 345 337 340 1 BACKBONE 346 340 341 2 BACKBONE 347 340 342 am BACKBONE|INTERRES 348 342 343 1 BACKBONE 349 342 344 1 BACKBONE 350 344 345 1 BACKBONE 351 344 346 1 BACKBONE 352 344 348 1 353 346 347 2 BACKBONE 354 346 366 am BACKBONE|INTERRES 355 348 349 1 356 348 350 1 357 348 351 1 358 351 352 1 359 351 353 1 360 351 354 1 361 354 355 1 362 354 356 1 363 354 357 1 364 357 358 1 365 357 359 ar 366 359 360 ar 367 359 363 ar 368 360 361 1 369 360 362 1 370 363 364 1 371 363 365 1 372 366 367 1 BACKBONE 373 366 368 1 BACKBONE 374 368 369 1 BACKBONE 375 368 370 1 BACKBONE 376 368 372 1 377 370 371 2 BACKBONE 378 370 390 am BACKBONE|INTERRES 379 372 373 1 380 372 374 1 381 372 375 1 382 375 376 2 383 375 378 1 384 376 377 1 385 376 379 1 386 378 381 ar 387 378 382 ar 388 379 380 1 389 379 381 1 390 381 384 ar 391 382 383 1 392 382 386 ar 393 384 385 1 394 384 388 ar 395 386 387 1 396 386 388 ar 397 388 389 1 398 390 391 1 BACKBONE 399 390 392 1 BACKBONE 400 392 393 1 BACKBONE 401 392 394 1 BACKBONE 402 392 395 1 BACKBONE 403 395 396 2 BACKBONE 404 395 397 am BACKBONE|INTERRES 405 397 398 1 BACKBONE 406 397 399 1 BACKBONE 407 399 400 1 BACKBONE 408 399 401 1 BACKBONE 409 399 403 1 410 401 402 2 BACKBONE 411 401 421 am BACKBONE|INTERRES 412 403 404 1 413 403 405 1 414 403 406 1 415 406 407 1 416 406 408 1 417 406 409 1 418 409 410 1 419 409 411 1 420 409 412 1 421 412 413 1 422 412 414 ar 423 414 415 ar 424 414 418 ar 425 415 416 1 426 415 417 1 427 418 419 1 428 418 420 1 429 421 422 1 BACKBONE 430 421 423 1 BACKBONE 431 423 424 1 BACKBONE 432 423 425 1 BACKBONE 433 423 427 1 434 425 426 2 BACKBONE 435 425 437 am BACKBONE|INTERRES 436 427 428 1 437 427 429 1 438 427 433 1 439 429 430 1 440 429 431 1 441 429 432 1 442 433 434 1 443 433 435 1 444 433 436 1 445 437 438 1 BACKBONE 446 437 439 1 BACKBONE 447 439 440 1 BACKBONE 448 439 441 1 BACKBONE 449 439 443 1 450 441 442 2 BACKBONE 451 441 454 am BACKBONE|INTERRES 452 443 444 1 453 443 445 1 454 443 446 1 455 446 447 1 456 446 448 2 457 447 450 2 458 448 449 1 459 448 452 1 460 450 451 1 461 450 452 1 462 452 453 1 463 454 455 1 BACKBONE 464 454 456 1 BACKBONE 465 456 457 1 BACKBONE 466 456 458 1 BACKBONE 467 456 460 1 468 458 459 2 BACKBONE 469 458 478 am BACKBONE|INTERRES 470 460 461 1 471 460 462 1 472 460 463 1 473 463 464 1 474 463 465 1 475 463 466 1 476 466 467 1 477 466 468 1 478 466 469 1 479 469 470 1 480 469 471 ar 481 471 472 ar 482 471 475 ar 483 472 473 1 484 472 474 1 485 475 476 1 486 475 477 1 487 478 479 1 BACKBONE 488 478 480 1 BACKBONE 489 480 481 1 BACKBONE 490 480 482 1 BACKBONE 491 480 483 1 BACKBONE 492 483 484 2 BACKBONE 493 483 485 am BACKBONE|INTERRES 494 485 486 1 BACKBONE 495 485 487 1 BACKBONE 496 487 488 1 BACKBONE 497 487 489 1 BACKBONE 498 487 491 1 499 489 490 2 BACKBONE 500 489 509 am BACKBONE|INTERRES 501 491 492 1 502 491 493 1 503 491 494 1 504 494 495 1 505 494 496 1 506 494 497 1 507 497 498 1 508 497 499 1 509 497 500 1 510 500 501 1 511 500 502 ar 512 502 503 ar 513 502 506 ar 514 503 504 1 515 503 505 1 516 506 507 1 517 506 508 1 518 509 510 1 BACKBONE 519 509 511 1 BACKBONE 520 511 512 1 BACKBONE 521 511 513 1 BACKBONE 522 511 516 1 523 513 514 1 BACKBONE 524 513 515 2 BACKBONE 525 516 517 1 526 516 518 1 527 516 519 1 528 519 520 2 529 519 522 1 530 520 521 1 531 520 523 1 532 522 525 ar 533 522 526 ar 534 523 524 1 535 523 525 1 536 525 528 ar 537 526 527 1 538 526 530 ar 539 528 529 1 540 528 532 ar 541 530 531 1 542 530 532 ar 543 532 533 1 @SUBSTRUCTURE 1 VAL601 5 RESIDUE 4 A VAL 1 2 TYR602 15 RESIDUE 4 A TYR 2 3 LEU603 36 RESIDUE 4 A LEU 2 4 GLN604 55 RESIDUE 4 A GLN 2 5 GLU605 72 RESIDUE 4 A GLU 2 6 TRP606 87 RESIDUE 4 A TRP 2 7 ASP607 111 RESIDUE 4 A ASP 2 8 ILE608 123 RESIDUE 4 A ILE 2 9 PRO609 141 RESIDUE 4 A PRO 2 10 PHE610 156 RESIDUE 4 A PHE 2 11 GLU611 176 RESIDUE 4 A GLU 2 12 GLN612 191 RESIDUE 4 A GLN 2 13 VAL613 208 RESIDUE 4 A VAL 2 14 GLU614 224 RESIDUE 4 A GLU 2 15 LEU615 239 RESIDUE 4 A LEU 2 16 GLY616 258 RESIDUE 4 A GLY 2 17 GLU617 265 RESIDUE 4 A GLU 2 18 PRO618 279 RESIDUE 4 A PRO 2 19 ILE619 294 RESIDUE 4 A ILE 2 20 GLY620 313 RESIDUE 4 A GLY 2 21 GLN621 320 RESIDUE 4 A GLN 2 22 GLY622 337 RESIDUE 4 A GLY 2 23 ARG623 344 RESIDUE 4 A ARG 2 24 TRP624 368 RESIDUE 4 A TRP 2 25 GLY625 392 RESIDUE 4 A GLY 2 26 ARG626 399 RESIDUE 4 A ARG 2 27 VAL627 423 RESIDUE 4 A VAL 2 28 HIS628 439 RESIDUE 4 A HIS 2 29 ARG629 456 RESIDUE 4 A ARG 2 30 GLY630 480 RESIDUE 4 A GLY 2 31 ARG631 487 RESIDUE 4 A ARG 2 32 TRP632 511 RESIDUE 4 A TRP 1 # MOE 2014.09 (io_trps.svl 2012.10)