USER MOD reduce.3.24.130724 H: found=0, std=0, add=1079, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1087 hydrogens (9 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD NoAdj-H: B 512 PTR HN2 : B 512 PTR N : B 511 GLN C :(H bumps) USER MOD NoAdj-H: B 512 PTR H : B 512 PTR N : B 511 GLN C :(H bumps) USER MOD Set 1.1: B 501 MET CE :methyl -175:sc= -1.17 (180deg=-0.79) USER MOD Set 1.2: B 502 THR OG1 : rot 24:sc= -0.15 USER MOD Set 2.1: A 99 ASN : amide:sc= -0.247! K(o=-6.1!,f=-7.1) USER MOD Set 2.2: A 102 GLN : amide:sc= -5.81! C(o=-6.1!,f=-11!) USER MOD Set 3.1: A 54 SER OG : rot 42:sc= 0.622 USER MOD Set 3.2: A 56 LYS NZ :NH3+ -120:sc= -0.732 (180deg=-2.53) USER MOD Set 4.1: A 43 THR OG1 : rot -79:sc= 0.0593 USER MOD Set 4.2: A 58 HIS : no HD1:sc= -4.04! C(o=-4!,f=-10!) USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 9 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 10 MET CE :methyl 168:sc= -1.02 (180deg=-1.52) USER MOD Single : A 12 THR OG1 : rot -152:sc= -3.14! USER MOD Single : A 16 ASN : amide:sc= 1.1 K(o=1.1,f=-0.31) USER MOD Single : A 17 HIS : no HD1:sc= -3.13! K(o=-3.1!,f=-0.81) USER MOD Single : A 19 ASN : amide:sc= -2.78! C(o=-2.8!,f=-9.4!) USER MOD Single : A 20 LYS NZ :NH3+ -157:sc= -0.191 (180deg=-1.62!) USER MOD Single : A 22 LYS NZ :NH3+ -161:sc= -0.165 (180deg=-0.65) USER MOD Single : A 25 ASN : amide:sc= 1.01 K(o=1,f=0.32) USER MOD Single : A 31 ASN : amide:sc= 0.0355 K(o=0.035,f=-1.6) USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 38 MET CE :methyl 160:sc= -10.5! (180deg=-13.1!) USER MOD Single : A 41 THR OG1 : rot -47:sc= 1.18 USER MOD Single : A 48 TYR OH : rot 42:sc= 0.0041 USER MOD Single : A 49 THR OG1 : rot -86:sc= -1.49! USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 TYR OH : rot 72:sc= -1.83! USER MOD Single : A 61 CYS SG : rot 180:sc= -1.19 USER MOD Single : A 65 TYR OH : rot -103:sc= -0.562 USER MOD Single : A 67 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 SER OG : rot 95:sc= 1.2 USER MOD Single : A 70 ASN : amide:sc= -1.24! C(o=-1.2!,f=-1.8!) USER MOD Single : A 73 SER OG : rot 60:sc= -3.74! USER MOD Single : A 76 SER OG : rot 33:sc= 0.109 USER MOD Single : A 80 CYS SG : rot -153:sc= 0.965 USER MOD Single : A 81 GLN : amide:sc= -2.34! C(o=-2.3!,f=-2.3!) USER MOD Single : A 82 THR OG1 : rot -38:sc= 1.05 USER MOD Single : A 84 GLN : amide:sc=-0.00434 K(o=-0.0043,f=-1) USER MOD Single : A 90 LYS NZ :NH3+ -157:sc= 0.227 (180deg=-1.42!) USER MOD Single : A 91 CYS SG : rot 66:sc= -4.78! USER MOD Single : A 100 MET CE :methyl -150:sc= -6.7! (180deg=-7.81!) USER MOD Single : A 105 MET CE :methyl -118:sc= -5.61! (180deg=-10.1!) USER MOD Single : A 106 GLN : amide:sc= -2.09! C(o=-2.1!,f=-2.3!) USER MOD Single : A 107 ASN : amide:sc= 1.17 K(o=1.2,f=-0.11) USER MOD Single : A 108 ASN : amide:sc= -2.78! C(o=-2.8!,f=-2!) USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 111 ASN : amide:sc= -3.19! K(o=-3.2!,f=-1.7) USER MOD Single : A 121 ASN : amide:sc=-0.00376 K(o=-0.0038,f=-0.93) USER MOD Single : A 122 ASN : amide:sc= 0 K(o=0,f=-0.61) USER MOD Single : B 503 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 509 ASN : amide:sc= -2.24 K(o=-2.2,f=-12!) USER MOD Single : B 511 GLN : amide:sc= -8.57! C(o=-8.6!,f=-14!) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 8 9.908 17.677 -6.136 1.00 0.00 N ATOM 2 CA SER A 8 8.920 16.678 -5.688 1.00 0.00 C ATOM 3 C SER A 8 7.664 17.372 -5.192 1.00 0.00 C ATOM 4 O SER A 8 7.718 18.500 -4.699 1.00 0.00 O ATOM 5 CB SER A 8 9.518 15.814 -4.572 1.00 0.00 C ATOM 6 OG SER A 8 8.581 14.871 -4.067 1.00 0.00 O ATOM 0 HA SER A 8 8.659 16.038 -6.530 1.00 0.00 H new ATOM 0 HB2 SER A 8 10.394 15.287 -4.951 1.00 0.00 H new ATOM 0 HB3 SER A 8 9.859 16.456 -3.760 1.00 0.00 H new ATOM 0 HG SER A 8 9.001 14.339 -3.359 1.00 0.00 H new ATOM 14 N HIS A 9 6.535 16.709 -5.360 1.00 0.00 N ATOM 15 CA HIS A 9 5.273 17.191 -4.831 1.00 0.00 C ATOM 16 C HIS A 9 4.477 16.033 -4.246 1.00 0.00 C ATOM 17 O HIS A 9 3.620 16.228 -3.386 1.00 0.00 O ATOM 18 CB HIS A 9 4.476 17.914 -5.911 1.00 0.00 C ATOM 19 CG HIS A 9 3.169 18.474 -5.436 1.00 0.00 C ATOM 20 ND1 HIS A 9 1.989 18.340 -6.139 1.00 0.00 N ATOM 21 CD2 HIS A 9 2.861 19.187 -4.325 1.00 0.00 C ATOM 22 CE1 HIS A 9 1.019 18.943 -5.481 1.00 0.00 C ATOM 23 NE2 HIS A 9 1.519 19.463 -4.381 1.00 0.00 N ATOM 0 H HIS A 9 6.467 15.825 -5.865 1.00 0.00 H new ATOM 0 HA HIS A 9 5.476 17.907 -4.034 1.00 0.00 H new ATOM 0 HB2 HIS A 9 5.082 18.726 -6.313 1.00 0.00 H new ATOM 0 HB3 HIS A 9 4.286 17.222 -6.732 1.00 0.00 H new ATOM 0 HD2 HIS A 9 3.544 19.482 -3.543 1.00 0.00 H new ATOM 0 HE1 HIS A 9 -0.013 19.001 -5.793 1.00 0.00 H new ATOM 0 HE2 HIS A 9 0.993 19.987 -3.682 1.00 0.00 H new ATOM 32 N MET A 10 4.787 14.829 -4.710 1.00 0.00 N ATOM 33 CA MET A 10 4.116 13.619 -4.253 1.00 0.00 C ATOM 34 C MET A 10 4.196 13.475 -2.737 1.00 0.00 C ATOM 35 O MET A 10 3.172 13.394 -2.061 1.00 0.00 O ATOM 36 CB MET A 10 4.745 12.398 -4.924 1.00 0.00 C ATOM 37 CG MET A 10 4.188 11.071 -4.435 1.00 0.00 C ATOM 38 SD MET A 10 5.042 9.659 -5.157 1.00 0.00 S ATOM 39 CE MET A 10 6.723 9.955 -4.608 1.00 0.00 C ATOM 0 H MET A 10 5.509 14.664 -5.412 1.00 0.00 H new ATOM 0 HA MET A 10 3.064 13.690 -4.528 1.00 0.00 H new ATOM 0 HB2 MET A 10 4.594 12.469 -6.001 1.00 0.00 H new ATOM 0 HB3 MET A 10 5.821 12.415 -4.751 1.00 0.00 H new ATOM 0 HG2 MET A 10 4.269 11.024 -3.349 1.00 0.00 H new ATOM 0 HG3 MET A 10 3.127 11.014 -4.678 1.00 0.00 H new ATOM 0 HE1 MET A 10 7.327 9.066 -4.790 1.00 0.00 H new ATOM 0 HE2 MET A 10 7.142 10.798 -5.158 1.00 0.00 H new ATOM 0 HE3 MET A 10 6.723 10.181 -3.542 1.00 0.00 H new ATOM 49 N ASP A 11 5.412 13.458 -2.207 1.00 0.00 N ATOM 50 CA ASP A 11 5.608 13.249 -0.775 1.00 0.00 C ATOM 51 C ASP A 11 5.814 14.566 -0.038 1.00 0.00 C ATOM 52 O ASP A 11 5.740 14.609 1.190 1.00 0.00 O ATOM 53 CB ASP A 11 6.788 12.299 -0.524 1.00 0.00 C ATOM 54 CG ASP A 11 7.179 12.205 0.945 1.00 0.00 C ATOM 55 OD1 ASP A 11 6.498 11.494 1.714 1.00 0.00 O ATOM 56 OD2 ASP A 11 8.179 12.850 1.337 1.00 0.00 O ATOM 0 H ASP A 11 6.272 13.585 -2.740 1.00 0.00 H new ATOM 0 HA ASP A 11 4.701 12.790 -0.382 1.00 0.00 H new ATOM 0 HB2 ASP A 11 6.530 11.305 -0.889 1.00 0.00 H new ATOM 0 HB3 ASP A 11 7.648 12.638 -1.102 1.00 0.00 H new ATOM 61 N THR A 12 6.042 15.652 -0.771 1.00 0.00 N ATOM 62 CA THR A 12 6.144 16.965 -0.143 1.00 0.00 C ATOM 63 C THR A 12 4.743 17.456 0.215 1.00 0.00 C ATOM 64 O THR A 12 4.302 18.539 -0.175 1.00 0.00 O ATOM 65 CB THR A 12 6.861 17.983 -1.050 1.00 0.00 C ATOM 66 OG1 THR A 12 6.166 18.135 -2.286 1.00 0.00 O ATOM 67 CG2 THR A 12 8.284 17.549 -1.323 1.00 0.00 C ATOM 0 H THR A 12 6.158 15.651 -1.784 1.00 0.00 H new ATOM 0 HA THR A 12 6.745 16.870 0.761 1.00 0.00 H new ATOM 0 HB THR A 12 6.875 18.940 -0.528 1.00 0.00 H new ATOM 0 HG1 THR A 12 6.799 18.393 -2.988 1.00 0.00 H new ATOM 0 HG21 THR A 12 8.771 18.283 -1.965 1.00 0.00 H new ATOM 0 HG22 THR A 12 8.828 17.473 -0.382 1.00 0.00 H new ATOM 0 HG23 THR A 12 8.280 16.578 -1.819 1.00 0.00 H new ATOM 75 N VAL A 13 4.057 16.621 0.968 1.00 0.00 N ATOM 76 CA VAL A 13 2.662 16.795 1.269 1.00 0.00 C ATOM 77 C VAL A 13 2.433 17.900 2.285 1.00 0.00 C ATOM 78 O VAL A 13 3.157 18.037 3.267 1.00 0.00 O ATOM 79 CB VAL A 13 2.056 15.447 1.727 1.00 0.00 C ATOM 80 CG1 VAL A 13 0.897 15.609 2.696 1.00 0.00 C ATOM 81 CG2 VAL A 13 1.612 14.685 0.498 1.00 0.00 C ATOM 0 H VAL A 13 4.466 15.789 1.393 1.00 0.00 H new ATOM 0 HA VAL A 13 2.148 17.113 0.362 1.00 0.00 H new ATOM 0 HB VAL A 13 2.825 14.899 2.271 1.00 0.00 H new ATOM 0 HG11 VAL A 13 0.518 14.627 2.978 1.00 0.00 H new ATOM 0 HG12 VAL A 13 1.239 16.135 3.587 1.00 0.00 H new ATOM 0 HG13 VAL A 13 0.101 16.182 2.219 1.00 0.00 H new ATOM 0 HG21 VAL A 13 1.181 13.730 0.798 1.00 0.00 H new ATOM 0 HG22 VAL A 13 0.864 15.267 -0.041 1.00 0.00 H new ATOM 0 HG23 VAL A 13 2.470 14.508 -0.150 1.00 0.00 H new ATOM 91 N PRO A 14 1.390 18.692 2.032 1.00 0.00 N ATOM 92 CA PRO A 14 1.079 19.889 2.803 1.00 0.00 C ATOM 93 C PRO A 14 0.453 19.525 4.140 1.00 0.00 C ATOM 94 O PRO A 14 0.626 20.216 5.136 1.00 0.00 O ATOM 95 CB PRO A 14 0.089 20.613 1.888 1.00 0.00 C ATOM 96 CG PRO A 14 -0.618 19.524 1.172 1.00 0.00 C ATOM 97 CD PRO A 14 0.392 18.436 0.984 1.00 0.00 C ATOM 0 HA PRO A 14 1.949 20.494 3.058 1.00 0.00 H new ATOM 0 HB2 PRO A 14 -0.605 21.227 2.461 1.00 0.00 H new ATOM 0 HB3 PRO A 14 0.603 21.277 1.193 1.00 0.00 H new ATOM 0 HG2 PRO A 14 -1.473 19.169 1.747 1.00 0.00 H new ATOM 0 HG3 PRO A 14 -1.001 19.871 0.213 1.00 0.00 H new ATOM 0 HD2 PRO A 14 -0.059 17.450 1.094 1.00 0.00 H new ATOM 0 HD3 PRO A 14 0.838 18.473 -0.010 1.00 0.00 H new ATOM 105 N ASP A 15 -0.272 18.417 4.131 1.00 0.00 N ATOM 106 CA ASP A 15 -0.828 17.821 5.331 1.00 0.00 C ATOM 107 C ASP A 15 -1.409 16.469 4.979 1.00 0.00 C ATOM 108 O ASP A 15 -0.987 15.444 5.517 1.00 0.00 O ATOM 109 CB ASP A 15 -1.919 18.689 5.953 1.00 0.00 C ATOM 110 CG ASP A 15 -2.393 18.144 7.288 1.00 0.00 C ATOM 111 OD1 ASP A 15 -3.245 17.233 7.301 1.00 0.00 O ATOM 112 OD2 ASP A 15 -1.909 18.627 8.332 1.00 0.00 O ATOM 0 H ASP A 15 -0.492 17.902 3.279 1.00 0.00 H new ATOM 0 HA ASP A 15 -0.026 17.725 6.063 1.00 0.00 H new ATOM 0 HB2 ASP A 15 -1.541 19.702 6.090 1.00 0.00 H new ATOM 0 HB3 ASP A 15 -2.764 18.754 5.268 1.00 0.00 H new ATOM 117 N ASN A 16 -2.356 16.468 4.042 1.00 0.00 N ATOM 118 CA ASN A 16 -3.029 15.233 3.663 1.00 0.00 C ATOM 119 C ASN A 16 -3.741 15.334 2.309 1.00 0.00 C ATOM 120 O ASN A 16 -4.531 14.456 1.971 1.00 0.00 O ATOM 121 CB ASN A 16 -4.046 14.857 4.743 1.00 0.00 C ATOM 122 CG ASN A 16 -5.268 15.760 4.751 1.00 0.00 C ATOM 123 OD1 ASN A 16 -6.247 15.508 4.049 1.00 0.00 O ATOM 124 ND2 ASN A 16 -5.225 16.816 5.545 1.00 0.00 N ATOM 0 H ASN A 16 -2.669 17.298 3.539 1.00 0.00 H new ATOM 0 HA ASN A 16 -2.262 14.465 3.568 1.00 0.00 H new ATOM 0 HB2 ASN A 16 -4.365 13.826 4.590 1.00 0.00 H new ATOM 0 HB3 ASN A 16 -3.563 14.900 5.719 1.00 0.00 H new ATOM 0 HD21 ASN A 16 -6.020 17.453 5.590 1.00 0.00 H new ATOM 0 HD22 ASN A 16 -4.397 16.994 6.113 1.00 0.00 H new ATOM 131 N HIS A 17 -3.455 16.381 1.530 1.00 0.00 N ATOM 132 CA HIS A 17 -4.190 16.631 0.278 1.00 0.00 C ATOM 133 C HIS A 17 -4.227 15.394 -0.635 1.00 0.00 C ATOM 134 O HIS A 17 -5.276 15.043 -1.169 1.00 0.00 O ATOM 135 CB HIS A 17 -3.621 17.854 -0.470 1.00 0.00 C ATOM 136 CG HIS A 17 -2.603 17.559 -1.538 1.00 0.00 C ATOM 137 ND1 HIS A 17 -2.905 17.554 -2.882 1.00 0.00 N ATOM 138 CD2 HIS A 17 -1.287 17.254 -1.455 1.00 0.00 C ATOM 139 CE1 HIS A 17 -1.823 17.258 -3.575 1.00 0.00 C ATOM 140 NE2 HIS A 17 -0.827 17.070 -2.732 1.00 0.00 N ATOM 0 H HIS A 17 -2.728 17.066 1.738 1.00 0.00 H new ATOM 0 HA HIS A 17 -5.220 16.852 0.557 1.00 0.00 H new ATOM 0 HB2 HIS A 17 -4.451 18.394 -0.926 1.00 0.00 H new ATOM 0 HB3 HIS A 17 -3.168 18.524 0.261 1.00 0.00 H new ATOM 0 HD2 HIS A 17 -0.706 17.171 -0.548 1.00 0.00 H new ATOM 0 HE1 HIS A 17 -1.763 17.182 -4.651 1.00 0.00 H new ATOM 0 HE2 HIS A 17 0.130 16.827 -2.989 1.00 0.00 H new ATOM 149 N ARG A 18 -3.083 14.743 -0.808 1.00 0.00 N ATOM 150 CA ARG A 18 -2.994 13.576 -1.676 1.00 0.00 C ATOM 151 C ARG A 18 -2.864 12.308 -0.858 1.00 0.00 C ATOM 152 O ARG A 18 -3.692 11.419 -0.932 1.00 0.00 O ATOM 153 CB ARG A 18 -1.789 13.678 -2.614 1.00 0.00 C ATOM 154 CG ARG A 18 -1.716 12.525 -3.597 1.00 0.00 C ATOM 155 CD ARG A 18 -2.621 12.735 -4.789 1.00 0.00 C ATOM 156 NE ARG A 18 -1.959 13.501 -5.836 1.00 0.00 N ATOM 157 CZ ARG A 18 -2.526 14.489 -6.524 1.00 0.00 C ATOM 158 NH1 ARG A 18 -3.779 14.856 -6.270 1.00 0.00 N ATOM 159 NH2 ARG A 18 -1.831 15.101 -7.473 1.00 0.00 N ATOM 0 H ARG A 18 -2.205 15.003 -0.359 1.00 0.00 H new ATOM 0 HA ARG A 18 -3.910 13.542 -2.266 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -1.840 14.617 -3.165 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -0.874 13.705 -2.022 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -0.688 12.406 -3.940 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -1.993 11.600 -3.091 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -2.932 11.768 -5.186 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -3.525 13.255 -4.473 1.00 0.00 H new ATOM 0 HE ARG A 18 -0.992 13.263 -6.058 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -4.313 14.379 -5.543 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -4.206 15.614 -6.802 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -0.872 14.813 -7.669 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -2.255 15.860 -8.007 1.00 0.00 H new ATOM 173 N ASN A 19 -1.826 12.258 -0.058 1.00 0.00 N ATOM 174 CA ASN A 19 -1.381 11.012 0.539 1.00 0.00 C ATOM 175 C ASN A 19 -2.431 10.370 1.445 1.00 0.00 C ATOM 176 O ASN A 19 -2.515 9.145 1.526 1.00 0.00 O ATOM 177 CB ASN A 19 -0.075 11.244 1.302 1.00 0.00 C ATOM 178 CG ASN A 19 -0.251 12.090 2.553 1.00 0.00 C ATOM 179 OD1 ASN A 19 -1.077 13.008 2.597 1.00 0.00 O ATOM 180 ND2 ASN A 19 0.532 11.790 3.578 1.00 0.00 N ATOM 0 H ASN A 19 -1.266 13.071 0.199 1.00 0.00 H new ATOM 0 HA ASN A 19 -1.213 10.306 -0.275 1.00 0.00 H new ATOM 0 HB2 ASN A 19 0.351 10.280 1.581 1.00 0.00 H new ATOM 0 HB3 ASN A 19 0.642 11.730 0.641 1.00 0.00 H new ATOM 0 HD21 ASN A 19 0.466 12.325 4.444 1.00 0.00 H new ATOM 0 HD22 ASN A 19 1.201 11.024 3.501 1.00 0.00 H new ATOM 187 N LYS A 20 -3.230 11.178 2.121 1.00 0.00 N ATOM 188 CA LYS A 20 -4.288 10.643 2.954 1.00 0.00 C ATOM 189 C LYS A 20 -5.506 10.343 2.086 1.00 0.00 C ATOM 190 O LYS A 20 -6.223 11.257 1.666 1.00 0.00 O ATOM 191 CB LYS A 20 -4.652 11.667 4.032 1.00 0.00 C ATOM 192 CG LYS A 20 -5.611 11.152 5.093 1.00 0.00 C ATOM 193 CD LYS A 20 -4.940 10.195 6.054 1.00 0.00 C ATOM 194 CE LYS A 20 -4.363 10.875 7.280 1.00 0.00 C ATOM 195 NZ LYS A 20 -3.388 11.942 6.936 1.00 0.00 N ATOM 0 H LYS A 20 -3.166 12.196 2.109 1.00 0.00 H new ATOM 0 HA LYS A 20 -3.954 9.724 3.434 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -3.737 12.003 4.520 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -5.096 12.539 3.552 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -6.021 11.995 5.649 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -6.450 10.651 4.610 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -5.664 9.444 6.371 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -4.142 9.668 5.531 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -5.174 11.305 7.868 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -3.874 10.130 7.908 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -2.751 12.103 7.742 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -2.831 11.650 6.107 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -3.898 12.821 6.717 1.00 0.00 H new ATOM 209 N PHE A 21 -5.735 9.066 1.813 1.00 0.00 N ATOM 210 CA PHE A 21 -6.914 8.654 1.062 1.00 0.00 C ATOM 211 C PHE A 21 -7.841 7.799 1.902 1.00 0.00 C ATOM 212 O PHE A 21 -7.463 6.722 2.342 1.00 0.00 O ATOM 213 CB PHE A 21 -6.505 7.876 -0.192 1.00 0.00 C ATOM 214 CG PHE A 21 -5.992 8.737 -1.305 1.00 0.00 C ATOM 215 CD1 PHE A 21 -6.430 10.042 -1.469 1.00 0.00 C ATOM 216 CD2 PHE A 21 -5.054 8.244 -2.182 1.00 0.00 C ATOM 217 CE1 PHE A 21 -5.931 10.824 -2.487 1.00 0.00 C ATOM 218 CE2 PHE A 21 -4.555 9.012 -3.181 1.00 0.00 C ATOM 219 CZ PHE A 21 -4.984 10.304 -3.342 1.00 0.00 C ATOM 0 H PHE A 21 -5.124 8.301 2.098 1.00 0.00 H new ATOM 0 HA PHE A 21 -7.447 9.560 0.774 1.00 0.00 H new ATOM 0 HB2 PHE A 21 -5.736 7.152 0.077 1.00 0.00 H new ATOM 0 HB3 PHE A 21 -7.364 7.309 -0.551 1.00 0.00 H new ATOM 0 HD1 PHE A 21 -7.168 10.449 -0.793 1.00 0.00 H new ATOM 0 HD2 PHE A 21 -4.709 7.226 -2.073 1.00 0.00 H new ATOM 0 HE1 PHE A 21 -6.280 11.838 -2.614 1.00 0.00 H new ATOM 0 HE2 PHE A 21 -3.815 8.604 -3.854 1.00 0.00 H new ATOM 0 HZ PHE A 21 -4.580 10.913 -4.137 1.00 0.00 H new ATOM 229 N LYS A 22 -9.045 8.285 2.135 1.00 0.00 N ATOM 230 CA LYS A 22 -10.072 7.478 2.770 1.00 0.00 C ATOM 231 C LYS A 22 -10.434 6.297 1.882 1.00 0.00 C ATOM 232 O LYS A 22 -11.076 6.457 0.843 1.00 0.00 O ATOM 233 CB LYS A 22 -11.312 8.311 3.056 1.00 0.00 C ATOM 234 CG LYS A 22 -11.387 8.850 4.467 1.00 0.00 C ATOM 235 CD LYS A 22 -11.573 7.744 5.497 1.00 0.00 C ATOM 236 CE LYS A 22 -12.968 7.145 5.449 1.00 0.00 C ATOM 237 NZ LYS A 22 -14.021 8.178 5.635 1.00 0.00 N ATOM 0 H LYS A 22 -9.337 9.232 1.895 1.00 0.00 H new ATOM 0 HA LYS A 22 -9.679 7.106 3.716 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -11.343 9.147 2.358 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -12.196 7.703 2.864 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -10.475 9.403 4.691 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -12.214 9.556 4.541 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -10.836 6.960 5.323 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -11.385 8.143 6.494 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -13.115 6.644 4.492 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -13.064 6.385 6.224 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -14.911 7.720 5.916 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -13.726 8.845 6.376 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -14.163 8.693 4.743 1.00 0.00 H new ATOM 251 N VAL A 23 -10.002 5.121 2.287 1.00 0.00 N ATOM 252 CA VAL A 23 -10.308 3.905 1.573 1.00 0.00 C ATOM 253 C VAL A 23 -11.454 3.192 2.275 1.00 0.00 C ATOM 254 O VAL A 23 -12.025 3.705 3.232 1.00 0.00 O ATOM 255 CB VAL A 23 -9.069 2.976 1.513 1.00 0.00 C ATOM 256 CG1 VAL A 23 -7.895 3.697 0.880 1.00 0.00 C ATOM 257 CG2 VAL A 23 -8.691 2.491 2.897 1.00 0.00 C ATOM 0 H VAL A 23 -9.430 4.984 3.120 1.00 0.00 H new ATOM 0 HA VAL A 23 -10.595 4.156 0.552 1.00 0.00 H new ATOM 0 HB VAL A 23 -9.326 2.112 0.900 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -7.034 3.030 0.846 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -8.158 4.002 -0.133 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -7.648 4.579 1.471 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -7.819 1.841 2.829 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -8.457 3.346 3.531 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -9.524 1.936 3.328 1.00 0.00 H new ATOM 267 N ILE A 24 -11.812 2.036 1.791 1.00 0.00 N ATOM 268 CA ILE A 24 -12.784 1.213 2.470 1.00 0.00 C ATOM 269 C ILE A 24 -12.203 -0.167 2.685 1.00 0.00 C ATOM 270 O ILE A 24 -12.069 -0.915 1.731 1.00 0.00 O ATOM 271 CB ILE A 24 -14.066 1.058 1.658 1.00 0.00 C ATOM 272 CG1 ILE A 24 -14.762 2.377 1.409 1.00 0.00 C ATOM 273 CG2 ILE A 24 -15.013 0.159 2.384 1.00 0.00 C ATOM 274 CD1 ILE A 24 -15.577 2.348 0.140 1.00 0.00 C ATOM 0 H ILE A 24 -11.446 1.638 0.926 1.00 0.00 H new ATOM 0 HA ILE A 24 -13.022 1.700 3.415 1.00 0.00 H new ATOM 0 HB ILE A 24 -13.779 0.638 0.694 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -15.411 2.611 2.253 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -14.021 3.174 1.347 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -15.928 0.049 1.803 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -14.552 -0.819 2.523 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -15.250 0.590 3.357 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -16.061 3.314 -0.003 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -14.924 2.140 -0.707 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -16.336 1.569 0.213 1.00 0.00 H new ATOM 286 N ASN A 25 -11.840 -0.523 3.904 1.00 0.00 N ATOM 287 CA ASN A 25 -11.303 -1.854 4.110 1.00 0.00 C ATOM 288 C ASN A 25 -12.395 -2.880 3.807 1.00 0.00 C ATOM 289 O ASN A 25 -13.455 -2.899 4.443 1.00 0.00 O ATOM 290 CB ASN A 25 -10.698 -2.017 5.520 1.00 0.00 C ATOM 291 CG ASN A 25 -11.306 -3.145 6.341 1.00 0.00 C ATOM 292 OD1 ASN A 25 -10.928 -4.308 6.214 1.00 0.00 O ATOM 293 ND2 ASN A 25 -12.229 -2.798 7.218 1.00 0.00 N ATOM 0 H ASN A 25 -11.903 0.064 4.736 1.00 0.00 H new ATOM 0 HA ASN A 25 -10.474 -2.023 3.423 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -9.626 -2.191 5.424 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -10.821 -1.081 6.065 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -12.653 -3.505 7.818 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -12.518 -1.823 7.295 1.00 0.00 H new ATOM 300 N VAL A 26 -12.145 -3.676 2.773 1.00 0.00 N ATOM 301 CA VAL A 26 -13.136 -4.593 2.227 1.00 0.00 C ATOM 302 C VAL A 26 -12.491 -5.963 2.042 1.00 0.00 C ATOM 303 O VAL A 26 -11.423 -6.069 1.446 1.00 0.00 O ATOM 304 CB VAL A 26 -13.660 -4.053 0.871 1.00 0.00 C ATOM 305 CG1 VAL A 26 -14.456 -2.775 1.081 1.00 0.00 C ATOM 306 CG2 VAL A 26 -12.528 -3.778 -0.091 1.00 0.00 C ATOM 0 H VAL A 26 -11.247 -3.703 2.290 1.00 0.00 H new ATOM 0 HA VAL A 26 -13.980 -4.681 2.911 1.00 0.00 H new ATOM 0 HB VAL A 26 -14.303 -4.822 0.442 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -14.817 -2.409 0.120 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -15.305 -2.978 1.734 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -13.818 -2.020 1.540 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -12.932 -3.401 -1.030 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -11.857 -3.035 0.340 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -11.977 -4.700 -0.277 1.00 0.00 H new ATOM 316 N ASP A 27 -13.111 -7.022 2.537 1.00 0.00 N ATOM 317 CA ASP A 27 -12.437 -8.312 2.497 1.00 0.00 C ATOM 318 C ASP A 27 -13.231 -9.381 1.766 1.00 0.00 C ATOM 319 O ASP A 27 -14.378 -9.666 2.109 1.00 0.00 O ATOM 320 CB ASP A 27 -12.091 -8.786 3.908 1.00 0.00 C ATOM 321 CG ASP A 27 -11.476 -10.171 3.917 1.00 0.00 C ATOM 322 OD1 ASP A 27 -10.446 -10.381 3.240 1.00 0.00 O ATOM 323 OD2 ASP A 27 -12.018 -11.056 4.610 1.00 0.00 O ATOM 0 H ASP A 27 -14.041 -7.021 2.955 1.00 0.00 H new ATOM 0 HA ASP A 27 -11.519 -8.157 1.929 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -11.398 -8.080 4.366 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -12.993 -8.788 4.519 1.00 0.00 H new ATOM 328 N ASP A 28 -12.562 -9.972 0.766 1.00 0.00 N ATOM 329 CA ASP A 28 -13.062 -11.093 -0.063 1.00 0.00 C ATOM 330 C ASP A 28 -14.473 -10.876 -0.630 1.00 0.00 C ATOM 331 O ASP A 28 -15.028 -11.752 -1.287 1.00 0.00 O ATOM 332 CB ASP A 28 -13.004 -12.407 0.721 1.00 0.00 C ATOM 333 CG ASP A 28 -13.184 -13.616 -0.178 1.00 0.00 C ATOM 334 OD1 ASP A 28 -12.277 -13.903 -0.987 1.00 0.00 O ATOM 335 OD2 ASP A 28 -14.237 -14.276 -0.095 1.00 0.00 O ATOM 0 H ASP A 28 -11.623 -9.677 0.497 1.00 0.00 H new ATOM 0 HA ASP A 28 -12.396 -11.142 -0.924 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -12.047 -12.479 1.237 1.00 0.00 H new ATOM 0 HB3 ASP A 28 -13.780 -12.406 1.487 1.00 0.00 H new ATOM 340 N ASP A 29 -15.030 -9.703 -0.423 1.00 0.00 N ATOM 341 CA ASP A 29 -16.371 -9.407 -0.897 1.00 0.00 C ATOM 342 C ASP A 29 -16.415 -8.000 -1.476 1.00 0.00 C ATOM 343 O ASP A 29 -17.379 -7.600 -2.125 1.00 0.00 O ATOM 344 CB ASP A 29 -17.373 -9.541 0.253 1.00 0.00 C ATOM 345 CG ASP A 29 -18.808 -9.347 -0.195 1.00 0.00 C ATOM 346 OD1 ASP A 29 -19.368 -10.259 -0.831 1.00 0.00 O ATOM 347 OD2 ASP A 29 -19.386 -8.286 0.089 1.00 0.00 O ATOM 0 H ASP A 29 -14.577 -8.935 0.071 1.00 0.00 H new ATOM 0 HA ASP A 29 -16.640 -10.117 -1.679 1.00 0.00 H new ATOM 0 HB2 ASP A 29 -17.269 -10.526 0.707 1.00 0.00 H new ATOM 0 HB3 ASP A 29 -17.135 -8.808 1.024 1.00 0.00 H new ATOM 352 N GLY A 30 -15.326 -7.262 -1.260 1.00 0.00 N ATOM 353 CA GLY A 30 -15.300 -5.844 -1.571 1.00 0.00 C ATOM 354 C GLY A 30 -16.288 -5.119 -0.699 1.00 0.00 C ATOM 355 O GLY A 30 -16.744 -4.024 -1.017 1.00 0.00 O ATOM 0 H GLY A 30 -14.456 -7.627 -0.872 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -14.298 -5.445 -1.413 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -15.543 -5.687 -2.622 1.00 0.00 H new ATOM 359 N ASN A 31 -16.605 -5.752 0.422 1.00 0.00 N ATOM 360 CA ASN A 31 -17.596 -5.244 1.342 1.00 0.00 C ATOM 361 C ASN A 31 -16.948 -4.321 2.325 1.00 0.00 C ATOM 362 O ASN A 31 -15.977 -4.707 2.965 1.00 0.00 O ATOM 363 CB ASN A 31 -18.266 -6.395 2.091 1.00 0.00 C ATOM 364 CG ASN A 31 -19.678 -6.062 2.532 1.00 0.00 C ATOM 365 OD1 ASN A 31 -19.983 -4.922 2.888 1.00 0.00 O ATOM 366 ND2 ASN A 31 -20.560 -7.044 2.483 1.00 0.00 N ATOM 0 H ASN A 31 -16.179 -6.632 0.713 1.00 0.00 H new ATOM 0 HA ASN A 31 -18.352 -4.702 0.775 1.00 0.00 H new ATOM 0 HB2 ASN A 31 -18.288 -7.276 1.450 1.00 0.00 H new ATOM 0 HB3 ASN A 31 -17.668 -6.652 2.965 1.00 0.00 H new ATOM 0 HD21 ASN A 31 -21.531 -6.871 2.745 1.00 0.00 H new ATOM 0 HD22 ASN A 31 -20.271 -7.975 2.183 1.00 0.00 H new ATOM 373 N GLU A 32 -17.439 -3.086 2.382 1.00 0.00 N ATOM 374 CA GLU A 32 -16.988 -2.119 3.364 1.00 0.00 C ATOM 375 C GLU A 32 -17.060 -2.701 4.782 1.00 0.00 C ATOM 376 O GLU A 32 -18.034 -2.484 5.500 1.00 0.00 O ATOM 377 CB GLU A 32 -17.863 -0.859 3.288 1.00 0.00 C ATOM 378 CG GLU A 32 -18.151 -0.405 1.864 1.00 0.00 C ATOM 379 CD GLU A 32 -19.252 0.628 1.760 1.00 0.00 C ATOM 380 OE1 GLU A 32 -19.336 1.514 2.630 1.00 0.00 O ATOM 381 OE2 GLU A 32 -20.035 0.555 0.790 1.00 0.00 O ATOM 0 H GLU A 32 -18.157 -2.734 1.749 1.00 0.00 H new ATOM 0 HA GLU A 32 -15.951 -1.867 3.143 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -18.807 -1.051 3.798 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -17.369 -0.050 3.826 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -17.238 0.006 1.433 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -18.423 -1.274 1.264 1.00 0.00 H new ATOM 388 N LEU A 33 -16.030 -3.439 5.174 1.00 0.00 N ATOM 389 CA LEU A 33 -15.956 -4.047 6.497 1.00 0.00 C ATOM 390 C LEU A 33 -15.345 -3.066 7.481 1.00 0.00 C ATOM 391 O LEU A 33 -14.688 -3.447 8.450 1.00 0.00 O ATOM 392 CB LEU A 33 -15.124 -5.332 6.437 1.00 0.00 C ATOM 393 CG LEU A 33 -15.908 -6.627 6.172 1.00 0.00 C ATOM 394 CD1 LEU A 33 -17.139 -6.344 5.349 1.00 0.00 C ATOM 395 CD2 LEU A 33 -15.049 -7.622 5.423 1.00 0.00 C ATOM 0 H LEU A 33 -15.221 -3.633 4.584 1.00 0.00 H new ATOM 0 HA LEU A 33 -16.962 -4.299 6.832 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -14.372 -5.219 5.656 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -14.589 -5.440 7.381 1.00 0.00 H new ATOM 0 HG LEU A 33 -16.199 -7.041 7.137 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -17.680 -7.274 5.172 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -17.782 -5.646 5.885 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -16.846 -5.908 4.394 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -15.620 -8.533 5.244 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -14.742 -7.192 4.469 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -14.165 -7.858 6.016 1.00 0.00 H new ATOM 407 N GLY A 34 -15.561 -1.796 7.205 1.00 0.00 N ATOM 408 CA GLY A 34 -14.993 -0.741 8.008 1.00 0.00 C ATOM 409 C GLY A 34 -14.103 0.131 7.164 1.00 0.00 C ATOM 410 O GLY A 34 -12.914 -0.157 7.005 1.00 0.00 O ATOM 0 H GLY A 34 -16.131 -1.471 6.424 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -15.789 -0.142 8.450 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -14.421 -1.168 8.832 1.00 0.00 H new ATOM 414 N SER A 35 -14.668 1.176 6.590 1.00 0.00 N ATOM 415 CA SER A 35 -13.920 1.989 5.661 1.00 0.00 C ATOM 416 C SER A 35 -12.821 2.753 6.394 1.00 0.00 C ATOM 417 O SER A 35 -13.056 3.391 7.421 1.00 0.00 O ATOM 418 CB SER A 35 -14.850 2.909 4.868 1.00 0.00 C ATOM 419 OG SER A 35 -15.633 3.730 5.721 1.00 0.00 O ATOM 0 H SER A 35 -15.630 1.476 6.750 1.00 0.00 H new ATOM 0 HA SER A 35 -13.432 1.341 4.933 1.00 0.00 H new ATOM 0 HB2 SER A 35 -14.258 3.537 4.202 1.00 0.00 H new ATOM 0 HB3 SER A 35 -15.507 2.308 4.239 1.00 0.00 H new ATOM 0 HG SER A 35 -16.213 4.305 5.179 1.00 0.00 H new ATOM 425 N GLY A 36 -11.617 2.652 5.866 1.00 0.00 N ATOM 426 CA GLY A 36 -10.454 3.163 6.550 1.00 0.00 C ATOM 427 C GLY A 36 -9.837 4.333 5.820 1.00 0.00 C ATOM 428 O GLY A 36 -10.429 4.898 4.915 1.00 0.00 O ATOM 0 H GLY A 36 -11.422 2.219 4.963 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -10.732 3.470 7.558 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -9.715 2.368 6.652 1.00 0.00 H new ATOM 432 N ILE A 37 -8.661 4.714 6.243 1.00 0.00 N ATOM 433 CA ILE A 37 -7.807 5.585 5.469 1.00 0.00 C ATOM 434 C ILE A 37 -6.718 4.736 4.867 1.00 0.00 C ATOM 435 O ILE A 37 -6.508 3.632 5.299 1.00 0.00 O ATOM 436 CB ILE A 37 -7.113 6.642 6.357 1.00 0.00 C ATOM 437 CG1 ILE A 37 -8.096 7.662 6.933 1.00 0.00 C ATOM 438 CG2 ILE A 37 -6.036 7.374 5.576 1.00 0.00 C ATOM 439 CD1 ILE A 37 -8.451 8.781 5.974 1.00 0.00 C ATOM 0 H ILE A 37 -8.264 4.429 7.138 1.00 0.00 H new ATOM 0 HA ILE A 37 -8.418 6.092 4.722 1.00 0.00 H new ATOM 0 HB ILE A 37 -6.666 6.099 7.189 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -9.010 7.146 7.228 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -7.668 8.094 7.838 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -5.559 8.114 6.219 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -5.289 6.660 5.229 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -6.485 7.875 4.718 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -9.152 9.463 6.455 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -7.547 9.324 5.698 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -8.909 8.361 5.079 1.00 0.00 H new ATOM 451 N MET A 38 -6.033 5.254 3.898 1.00 0.00 N ATOM 452 CA MET A 38 -4.799 4.686 3.473 1.00 0.00 C ATOM 453 C MET A 38 -3.824 5.821 3.245 1.00 0.00 C ATOM 454 O MET A 38 -3.780 6.439 2.181 1.00 0.00 O ATOM 455 CB MET A 38 -4.993 3.813 2.259 1.00 0.00 C ATOM 456 CG MET A 38 -3.788 2.997 1.937 1.00 0.00 C ATOM 457 SD MET A 38 -3.405 1.838 3.243 1.00 0.00 S ATOM 458 CE MET A 38 -5.016 1.084 3.378 1.00 0.00 C ATOM 0 H MET A 38 -6.317 6.085 3.379 1.00 0.00 H new ATOM 0 HA MET A 38 -4.391 4.024 4.236 1.00 0.00 H new ATOM 0 HB2 MET A 38 -5.842 3.150 2.426 1.00 0.00 H new ATOM 0 HB3 MET A 38 -5.242 4.439 1.402 1.00 0.00 H new ATOM 0 HG2 MET A 38 -3.954 2.454 1.006 1.00 0.00 H new ATOM 0 HG3 MET A 38 -2.935 3.656 1.774 1.00 0.00 H new ATOM 0 HE1 MET A 38 -4.924 0.115 3.868 1.00 0.00 H new ATOM 0 HE2 MET A 38 -5.671 1.727 3.966 1.00 0.00 H new ATOM 0 HE3 MET A 38 -5.439 0.949 2.383 1.00 0.00 H new ATOM 468 N GLU A 39 -3.097 6.116 4.306 1.00 0.00 N ATOM 469 CA GLU A 39 -2.172 7.221 4.373 1.00 0.00 C ATOM 470 C GLU A 39 -0.890 6.832 3.659 1.00 0.00 C ATOM 471 O GLU A 39 -0.060 6.102 4.212 1.00 0.00 O ATOM 472 CB GLU A 39 -1.852 7.428 5.835 1.00 0.00 C ATOM 473 CG GLU A 39 -0.752 8.419 6.142 1.00 0.00 C ATOM 474 CD GLU A 39 -1.237 9.834 6.354 1.00 0.00 C ATOM 475 OE1 GLU A 39 -1.759 10.448 5.404 1.00 0.00 O ATOM 476 OE2 GLU A 39 -1.101 10.340 7.490 1.00 0.00 O ATOM 0 H GLU A 39 -3.138 5.574 5.169 1.00 0.00 H new ATOM 0 HA GLU A 39 -2.592 8.117 3.917 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -2.760 7.755 6.342 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -1.576 6.465 6.265 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -0.221 8.091 7.036 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -0.033 8.412 5.323 1.00 0.00 H new ATOM 483 N LEU A 40 -0.730 7.274 2.442 1.00 0.00 N ATOM 484 CA LEU A 40 0.422 6.888 1.676 1.00 0.00 C ATOM 485 C LEU A 40 1.631 7.756 1.989 1.00 0.00 C ATOM 486 O LEU A 40 1.721 8.898 1.551 1.00 0.00 O ATOM 487 CB LEU A 40 0.093 6.952 0.202 1.00 0.00 C ATOM 488 CG LEU A 40 -0.238 5.615 -0.442 1.00 0.00 C ATOM 489 CD1 LEU A 40 -0.542 5.849 -1.886 1.00 0.00 C ATOM 490 CD2 LEU A 40 0.932 4.655 -0.305 1.00 0.00 C ATOM 0 H LEU A 40 -1.379 7.898 1.962 1.00 0.00 H new ATOM 0 HA LEU A 40 0.683 5.866 1.950 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -0.754 7.624 0.063 1.00 0.00 H new ATOM 0 HB3 LEU A 40 0.940 7.392 -0.325 1.00 0.00 H new ATOM 0 HG LEU A 40 -1.100 5.171 0.056 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -0.782 4.900 -2.366 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -1.392 6.525 -1.974 1.00 0.00 H new ATOM 0 HD13 LEU A 40 0.326 6.292 -2.373 1.00 0.00 H new ATOM 0 HD21 LEU A 40 0.678 3.703 -0.771 1.00 0.00 H new ATOM 0 HD22 LEU A 40 1.809 5.077 -0.796 1.00 0.00 H new ATOM 0 HD23 LEU A 40 1.150 4.495 0.751 1.00 0.00 H new ATOM 502 N THR A 41 2.557 7.214 2.763 1.00 0.00 N ATOM 503 CA THR A 41 3.799 7.910 3.032 1.00 0.00 C ATOM 504 C THR A 41 4.973 7.143 2.430 1.00 0.00 C ATOM 505 O THR A 41 4.757 6.247 1.612 1.00 0.00 O ATOM 506 CB THR A 41 4.017 8.131 4.527 1.00 0.00 C ATOM 507 OG1 THR A 41 4.116 6.881 5.218 1.00 0.00 O ATOM 508 CG2 THR A 41 2.886 8.950 5.119 1.00 0.00 C ATOM 0 H THR A 41 2.471 6.302 3.212 1.00 0.00 H new ATOM 0 HA THR A 41 3.735 8.892 2.564 1.00 0.00 H new ATOM 0 HB THR A 41 4.953 8.677 4.648 1.00 0.00 H new ATOM 0 HG1 THR A 41 3.393 6.288 4.926 1.00 0.00 H new ATOM 0 HG21 THR A 41 3.061 9.096 6.185 1.00 0.00 H new ATOM 0 HG22 THR A 41 2.841 9.920 4.623 1.00 0.00 H new ATOM 0 HG23 THR A 41 1.942 8.424 4.975 1.00 0.00 H new ATOM 516 N ASP A 42 6.205 7.483 2.833 1.00 0.00 N ATOM 517 CA ASP A 42 7.404 6.858 2.262 1.00 0.00 C ATOM 518 C ASP A 42 7.373 5.374 2.348 1.00 0.00 C ATOM 519 O ASP A 42 7.537 4.683 1.353 1.00 0.00 O ATOM 520 CB ASP A 42 8.689 7.278 2.973 1.00 0.00 C ATOM 521 CG ASP A 42 8.504 7.619 4.441 1.00 0.00 C ATOM 522 OD1 ASP A 42 7.954 8.699 4.744 1.00 0.00 O ATOM 523 OD2 ASP A 42 8.920 6.812 5.303 1.00 0.00 O ATOM 0 H ASP A 42 6.396 8.184 3.549 1.00 0.00 H new ATOM 0 HA ASP A 42 7.400 7.196 1.226 1.00 0.00 H new ATOM 0 HB2 ASP A 42 9.418 6.472 2.888 1.00 0.00 H new ATOM 0 HB3 ASP A 42 9.109 8.144 2.460 1.00 0.00 H new ATOM 528 N THR A 43 7.184 4.868 3.528 1.00 0.00 N ATOM 529 CA THR A 43 7.442 3.489 3.712 1.00 0.00 C ATOM 530 C THR A 43 6.275 2.769 4.341 1.00 0.00 C ATOM 531 O THR A 43 6.195 1.557 4.271 1.00 0.00 O ATOM 532 CB THR A 43 8.663 3.261 4.595 1.00 0.00 C ATOM 533 OG1 THR A 43 8.390 3.713 5.928 1.00 0.00 O ATOM 534 CG2 THR A 43 9.877 3.999 4.069 1.00 0.00 C ATOM 0 H THR A 43 6.862 5.378 4.351 1.00 0.00 H new ATOM 0 HA THR A 43 7.620 3.088 2.714 1.00 0.00 H new ATOM 0 HB THR A 43 8.877 2.192 4.592 1.00 0.00 H new ATOM 0 HG1 THR A 43 8.483 4.688 5.968 1.00 0.00 H new ATOM 0 HG21 THR A 43 10.728 3.813 4.724 1.00 0.00 H new ATOM 0 HG22 THR A 43 10.109 3.647 3.064 1.00 0.00 H new ATOM 0 HG23 THR A 43 9.668 5.068 4.040 1.00 0.00 H new ATOM 542 N GLU A 44 5.406 3.494 5.006 1.00 0.00 N ATOM 543 CA GLU A 44 4.261 2.872 5.627 1.00 0.00 C ATOM 544 C GLU A 44 2.959 3.431 5.099 1.00 0.00 C ATOM 545 O GLU A 44 2.744 4.643 5.017 1.00 0.00 O ATOM 546 CB GLU A 44 4.321 2.978 7.148 1.00 0.00 C ATOM 547 CG GLU A 44 4.988 1.790 7.815 1.00 0.00 C ATOM 548 CD GLU A 44 5.392 2.061 9.249 1.00 0.00 C ATOM 549 OE1 GLU A 44 4.502 2.221 10.110 1.00 0.00 O ATOM 550 OE2 GLU A 44 6.610 2.092 9.528 1.00 0.00 O ATOM 0 H GLU A 44 5.469 4.504 5.130 1.00 0.00 H new ATOM 0 HA GLU A 44 4.296 1.815 5.363 1.00 0.00 H new ATOM 0 HB2 GLU A 44 4.860 3.886 7.419 1.00 0.00 H new ATOM 0 HB3 GLU A 44 3.308 3.080 7.537 1.00 0.00 H new ATOM 0 HG2 GLU A 44 4.308 0.939 7.791 1.00 0.00 H new ATOM 0 HG3 GLU A 44 5.872 1.509 7.242 1.00 0.00 H new ATOM 557 N LEU A 45 2.122 2.508 4.708 1.00 0.00 N ATOM 558 CA LEU A 45 0.773 2.778 4.290 1.00 0.00 C ATOM 559 C LEU A 45 -0.136 2.788 5.500 1.00 0.00 C ATOM 560 O LEU A 45 -0.628 1.749 5.933 1.00 0.00 O ATOM 561 CB LEU A 45 0.377 1.688 3.299 1.00 0.00 C ATOM 562 CG LEU A 45 0.569 2.020 1.846 1.00 0.00 C ATOM 563 CD1 LEU A 45 1.007 0.792 1.083 1.00 0.00 C ATOM 564 CD2 LEU A 45 -0.721 2.514 1.281 1.00 0.00 C ATOM 0 H LEU A 45 2.367 1.519 4.670 1.00 0.00 H new ATOM 0 HA LEU A 45 0.688 3.753 3.810 1.00 0.00 H new ATOM 0 HB2 LEU A 45 0.953 0.791 3.526 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -0.673 1.442 3.460 1.00 0.00 H new ATOM 0 HG LEU A 45 1.337 2.788 1.755 1.00 0.00 H new ATOM 0 HD11 LEU A 45 1.143 1.046 0.032 1.00 0.00 H new ATOM 0 HD12 LEU A 45 1.949 0.426 1.492 1.00 0.00 H new ATOM 0 HD13 LEU A 45 0.246 0.017 1.174 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -0.587 2.756 0.227 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -1.482 1.740 1.382 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -1.037 3.406 1.821 1.00 0.00 H new ATOM 576 N ILE A 46 -0.339 3.966 6.062 1.00 0.00 N ATOM 577 CA ILE A 46 -1.046 4.072 7.320 1.00 0.00 C ATOM 578 C ILE A 46 -2.569 4.049 7.078 1.00 0.00 C ATOM 579 O ILE A 46 -3.191 5.077 6.836 1.00 0.00 O ATOM 580 CB ILE A 46 -0.629 5.343 8.126 1.00 0.00 C ATOM 581 CG1 ILE A 46 0.886 5.448 8.274 1.00 0.00 C ATOM 582 CG2 ILE A 46 -1.272 5.301 9.469 1.00 0.00 C ATOM 583 CD1 ILE A 46 1.572 4.122 8.338 1.00 0.00 C ATOM 0 H ILE A 46 -0.026 4.854 5.669 1.00 0.00 H new ATOM 0 HA ILE A 46 -0.770 3.209 7.927 1.00 0.00 H new ATOM 0 HB ILE A 46 -0.964 6.223 7.577 1.00 0.00 H new ATOM 0 HG12 ILE A 46 1.287 6.015 7.434 1.00 0.00 H new ATOM 0 HG13 ILE A 46 1.117 6.011 9.178 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -0.985 6.186 10.038 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -2.356 5.280 9.353 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -0.946 4.407 10.001 1.00 0.00 H new ATOM 0 HD11 ILE A 46 2.646 4.273 8.443 1.00 0.00 H new ATOM 0 HD12 ILE A 46 1.199 3.560 9.194 1.00 0.00 H new ATOM 0 HD13 ILE A 46 1.372 3.564 7.423 1.00 0.00 H new ATOM 595 N LEU A 47 -3.161 2.864 7.144 1.00 0.00 N ATOM 596 CA LEU A 47 -4.604 2.701 6.973 1.00 0.00 C ATOM 597 C LEU A 47 -5.323 3.116 8.257 1.00 0.00 C ATOM 598 O LEU A 47 -5.210 2.436 9.271 1.00 0.00 O ATOM 599 CB LEU A 47 -4.947 1.236 6.743 1.00 0.00 C ATOM 600 CG LEU A 47 -6.418 0.846 6.983 1.00 0.00 C ATOM 601 CD1 LEU A 47 -7.284 0.993 5.741 1.00 0.00 C ATOM 602 CD2 LEU A 47 -6.455 -0.571 7.442 1.00 0.00 C ATOM 0 H LEU A 47 -2.661 1.992 7.316 1.00 0.00 H new ATOM 0 HA LEU A 47 -4.911 3.312 6.124 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -4.685 0.978 5.717 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -4.319 0.629 7.395 1.00 0.00 H new ATOM 0 HG LEU A 47 -6.825 1.525 7.733 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -8.308 0.703 5.975 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -7.268 2.030 5.407 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -6.897 0.351 4.950 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -7.488 -0.869 7.618 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -6.018 -1.213 6.677 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -5.886 -0.669 8.367 1.00 0.00 H new ATOM 614 N TYR A 48 -6.068 4.195 8.241 1.00 0.00 N ATOM 615 CA TYR A 48 -6.799 4.578 9.448 1.00 0.00 C ATOM 616 C TYR A 48 -8.129 3.853 9.478 1.00 0.00 C ATOM 617 O TYR A 48 -9.072 4.280 8.825 1.00 0.00 O ATOM 618 CB TYR A 48 -7.064 6.082 9.536 1.00 0.00 C ATOM 619 CG TYR A 48 -5.841 6.896 9.779 1.00 0.00 C ATOM 620 CD1 TYR A 48 -4.798 6.768 8.928 1.00 0.00 C ATOM 621 CD2 TYR A 48 -5.728 7.777 10.845 1.00 0.00 C ATOM 622 CE1 TYR A 48 -3.658 7.470 9.086 1.00 0.00 C ATOM 623 CE2 TYR A 48 -4.571 8.509 11.027 1.00 0.00 C ATOM 624 CZ TYR A 48 -3.530 8.350 10.138 1.00 0.00 C ATOM 625 OH TYR A 48 -2.368 9.065 10.303 1.00 0.00 O ATOM 0 H TYR A 48 -6.190 4.813 7.439 1.00 0.00 H new ATOM 0 HA TYR A 48 -6.174 4.303 10.297 1.00 0.00 H new ATOM 0 HB2 TYR A 48 -7.531 6.414 8.609 1.00 0.00 H new ATOM 0 HB3 TYR A 48 -7.778 6.269 10.338 1.00 0.00 H new ATOM 0 HD1 TYR A 48 -4.881 6.083 8.097 1.00 0.00 H new ATOM 0 HD2 TYR A 48 -6.550 7.891 11.537 1.00 0.00 H new ATOM 0 HE1 TYR A 48 -2.844 7.342 8.387 1.00 0.00 H new ATOM 0 HE2 TYR A 48 -4.483 9.197 11.855 1.00 0.00 H new ATOM 0 HH TYR A 48 -2.056 9.388 9.432 1.00 0.00 H new ATOM 635 N THR A 49 -8.218 2.773 10.227 1.00 0.00 N ATOM 636 CA THR A 49 -9.459 2.008 10.285 1.00 0.00 C ATOM 637 C THR A 49 -10.549 2.781 11.026 1.00 0.00 C ATOM 638 O THR A 49 -10.392 3.969 11.324 1.00 0.00 O ATOM 639 CB THR A 49 -9.270 0.660 10.969 1.00 0.00 C ATOM 640 OG1 THR A 49 -8.563 0.841 12.183 1.00 0.00 O ATOM 641 CG2 THR A 49 -8.536 -0.304 10.067 1.00 0.00 C ATOM 0 H THR A 49 -7.459 2.404 10.800 1.00 0.00 H new ATOM 0 HA THR A 49 -9.761 1.840 9.251 1.00 0.00 H new ATOM 0 HB THR A 49 -10.250 0.234 11.184 1.00 0.00 H new ATOM 0 HG1 THR A 49 -7.599 0.833 12.005 1.00 0.00 H new ATOM 0 HG21 THR A 49 -8.413 -1.259 10.578 1.00 0.00 H new ATOM 0 HG22 THR A 49 -9.108 -0.453 9.151 1.00 0.00 H new ATOM 0 HG23 THR A 49 -7.556 0.104 9.820 1.00 0.00 H new ATOM 649 N ARG A 50 -11.647 2.113 11.336 1.00 0.00 N ATOM 650 CA ARG A 50 -12.693 2.734 12.120 1.00 0.00 C ATOM 651 C ARG A 50 -12.280 2.822 13.581 1.00 0.00 C ATOM 652 O ARG A 50 -12.032 3.904 14.109 1.00 0.00 O ATOM 653 CB ARG A 50 -13.985 1.947 12.004 1.00 0.00 C ATOM 654 CG ARG A 50 -15.136 2.765 11.454 1.00 0.00 C ATOM 655 CD ARG A 50 -15.417 3.990 12.310 1.00 0.00 C ATOM 656 NE ARG A 50 -14.498 5.086 12.007 1.00 0.00 N ATOM 657 CZ ARG A 50 -14.195 6.071 12.850 1.00 0.00 C ATOM 658 NH1 ARG A 50 -14.737 6.113 14.060 1.00 0.00 N ATOM 659 NH2 ARG A 50 -13.338 7.010 12.487 1.00 0.00 N ATOM 0 H ARG A 50 -11.834 1.149 11.058 1.00 0.00 H new ATOM 0 HA ARG A 50 -12.854 3.740 11.733 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -13.820 1.084 11.359 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -14.258 1.563 12.987 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -14.906 3.078 10.436 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -16.031 2.145 11.402 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -16.443 4.320 12.147 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -15.331 3.725 13.364 1.00 0.00 H new ATOM 0 HE ARG A 50 -14.059 5.097 11.086 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -15.392 5.387 14.351 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -14.499 6.871 14.699 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -12.910 6.979 11.562 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -13.105 7.765 13.132 1.00 0.00 H new ATOM 673 N LYS A 51 -12.207 1.672 14.220 1.00 0.00 N ATOM 674 CA LYS A 51 -11.884 1.594 15.633 1.00 0.00 C ATOM 675 C LYS A 51 -10.586 0.840 15.883 1.00 0.00 C ATOM 676 O LYS A 51 -10.061 0.833 16.994 1.00 0.00 O ATOM 677 CB LYS A 51 -13.050 0.975 16.364 1.00 0.00 C ATOM 678 CG LYS A 51 -14.266 1.884 16.372 1.00 0.00 C ATOM 679 CD LYS A 51 -14.130 2.966 17.426 1.00 0.00 C ATOM 680 CE LYS A 51 -13.483 4.227 16.891 1.00 0.00 C ATOM 681 NZ LYS A 51 -13.657 5.372 17.819 1.00 0.00 N ATOM 0 H LYS A 51 -12.369 0.767 13.778 1.00 0.00 H new ATOM 0 HA LYS A 51 -11.716 2.600 16.017 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -13.310 0.027 15.894 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -12.757 0.753 17.390 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -14.389 2.341 15.390 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -15.163 1.295 16.564 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -15.117 3.208 17.821 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -13.539 2.584 18.258 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -12.420 4.049 16.728 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -13.917 4.475 15.922 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -13.201 6.216 17.418 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -14.671 5.558 17.955 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -13.221 5.145 18.736 1.00 0.00 H new ATOM 695 N ARG A 52 -10.072 0.196 14.845 1.00 0.00 N ATOM 696 CA ARG A 52 -8.830 -0.563 14.943 1.00 0.00 C ATOM 697 C ARG A 52 -7.619 0.384 14.938 1.00 0.00 C ATOM 698 O ARG A 52 -6.477 -0.032 15.153 1.00 0.00 O ATOM 699 CB ARG A 52 -8.772 -1.578 13.786 1.00 0.00 C ATOM 700 CG ARG A 52 -7.465 -2.336 13.654 1.00 0.00 C ATOM 701 CD ARG A 52 -7.219 -3.220 14.863 1.00 0.00 C ATOM 702 NE ARG A 52 -7.987 -4.461 14.792 1.00 0.00 N ATOM 703 CZ ARG A 52 -8.849 -4.872 15.722 1.00 0.00 C ATOM 704 NH1 ARG A 52 -9.021 -4.171 16.837 1.00 0.00 N ATOM 705 NH2 ARG A 52 -9.523 -6.003 15.552 1.00 0.00 N ATOM 0 H ARG A 52 -10.498 0.183 13.918 1.00 0.00 H new ATOM 0 HA ARG A 52 -8.800 -1.110 15.885 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -9.579 -2.299 13.916 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -8.963 -1.050 12.852 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -7.485 -2.947 12.752 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -6.642 -1.630 13.543 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -6.157 -3.453 14.933 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -7.487 -2.678 15.770 1.00 0.00 H new ATOM 0 HE ARG A 52 -7.854 -5.055 13.973 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -8.492 -3.312 16.986 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -9.682 -4.492 17.544 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -9.382 -6.559 14.709 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -10.182 -6.316 16.265 1.00 0.00 H new ATOM 719 N ASP A 53 -7.908 1.671 14.726 1.00 0.00 N ATOM 720 CA ASP A 53 -6.910 2.725 14.659 1.00 0.00 C ATOM 721 C ASP A 53 -6.010 2.573 13.438 1.00 0.00 C ATOM 722 O ASP A 53 -6.133 1.623 12.663 1.00 0.00 O ATOM 723 CB ASP A 53 -6.125 2.772 15.968 1.00 0.00 C ATOM 724 CG ASP A 53 -4.892 3.652 15.939 1.00 0.00 C ATOM 725 OD1 ASP A 53 -5.051 4.888 15.880 1.00 0.00 O ATOM 726 OD2 ASP A 53 -3.762 3.122 15.960 1.00 0.00 O ATOM 0 H ASP A 53 -8.862 2.009 14.595 1.00 0.00 H new ATOM 0 HA ASP A 53 -7.414 3.684 14.535 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -6.787 3.124 16.759 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -5.824 1.758 16.231 1.00 0.00 H new ATOM 731 N SER A 54 -5.160 3.555 13.249 1.00 0.00 N ATOM 732 CA SER A 54 -4.218 3.588 12.149 1.00 0.00 C ATOM 733 C SER A 54 -3.389 2.312 12.085 1.00 0.00 C ATOM 734 O SER A 54 -2.441 2.114 12.844 1.00 0.00 O ATOM 735 CB SER A 54 -3.306 4.806 12.263 1.00 0.00 C ATOM 736 OG SER A 54 -2.652 4.850 13.523 1.00 0.00 O ATOM 0 H SER A 54 -5.101 4.367 13.863 1.00 0.00 H new ATOM 0 HA SER A 54 -4.792 3.661 11.225 1.00 0.00 H new ATOM 0 HB2 SER A 54 -2.562 4.781 11.466 1.00 0.00 H new ATOM 0 HB3 SER A 54 -3.892 5.715 12.124 1.00 0.00 H new ATOM 0 HG SER A 54 -2.355 3.949 13.769 1.00 0.00 H new ATOM 742 N VAL A 55 -3.790 1.450 11.185 1.00 0.00 N ATOM 743 CA VAL A 55 -3.001 0.302 10.803 1.00 0.00 C ATOM 744 C VAL A 55 -1.932 0.793 9.851 1.00 0.00 C ATOM 745 O VAL A 55 -2.051 1.891 9.317 1.00 0.00 O ATOM 746 CB VAL A 55 -3.837 -0.761 10.093 1.00 0.00 C ATOM 747 CG1 VAL A 55 -3.093 -2.052 10.009 1.00 0.00 C ATOM 748 CG2 VAL A 55 -5.153 -0.999 10.783 1.00 0.00 C ATOM 0 H VAL A 55 -4.680 1.524 10.692 1.00 0.00 H new ATOM 0 HA VAL A 55 -2.583 -0.155 11.699 1.00 0.00 H new ATOM 0 HB VAL A 55 -4.035 -0.383 9.090 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -3.708 -2.794 9.500 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -2.168 -1.903 9.452 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -2.859 -2.403 11.014 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -5.714 -1.762 10.244 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -4.973 -1.335 11.804 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -5.727 -0.072 10.802 1.00 0.00 H new ATOM 758 N LYS A 56 -0.887 0.033 9.642 1.00 0.00 N ATOM 759 CA LYS A 56 0.186 0.505 8.769 1.00 0.00 C ATOM 760 C LYS A 56 0.667 -0.611 7.847 1.00 0.00 C ATOM 761 O LYS A 56 0.656 -1.780 8.230 1.00 0.00 O ATOM 762 CB LYS A 56 1.412 1.015 9.532 1.00 0.00 C ATOM 763 CG LYS A 56 1.225 1.503 10.969 1.00 0.00 C ATOM 764 CD LYS A 56 0.197 2.594 11.185 1.00 0.00 C ATOM 765 CE LYS A 56 0.898 3.895 11.512 1.00 0.00 C ATOM 766 NZ LYS A 56 0.057 4.837 12.293 1.00 0.00 N ATOM 0 H LYS A 56 -0.746 -0.893 10.047 1.00 0.00 H new ATOM 0 HA LYS A 56 -0.251 1.331 8.207 1.00 0.00 H new ATOM 0 HB2 LYS A 56 2.150 0.213 9.547 1.00 0.00 H new ATOM 0 HB3 LYS A 56 1.843 1.834 8.957 1.00 0.00 H new ATOM 0 HG2 LYS A 56 0.949 0.648 11.586 1.00 0.00 H new ATOM 0 HG3 LYS A 56 2.187 1.863 11.335 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -0.414 2.714 10.291 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -0.476 2.318 11.997 1.00 0.00 H new ATOM 0 HE2 LYS A 56 1.806 3.679 12.074 1.00 0.00 H new ATOM 0 HE3 LYS A 56 1.205 4.377 10.584 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -0.064 5.720 11.757 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -0.874 4.408 12.468 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 0.519 5.043 13.202 1.00 0.00 H new ATOM 780 N TRP A 57 1.112 -0.251 6.645 1.00 0.00 N ATOM 781 CA TRP A 57 1.736 -1.217 5.744 1.00 0.00 C ATOM 782 C TRP A 57 3.067 -0.745 5.222 1.00 0.00 C ATOM 783 O TRP A 57 3.138 0.101 4.336 1.00 0.00 O ATOM 784 CB TRP A 57 0.818 -1.605 4.598 1.00 0.00 C ATOM 785 CG TRP A 57 -0.056 -2.721 5.022 1.00 0.00 C ATOM 786 CD1 TRP A 57 0.206 -4.049 4.903 1.00 0.00 C ATOM 787 CD2 TRP A 57 -1.301 -2.609 5.692 1.00 0.00 C ATOM 788 NE1 TRP A 57 -0.822 -4.779 5.443 1.00 0.00 N ATOM 789 CE2 TRP A 57 -1.761 -3.911 5.934 1.00 0.00 C ATOM 790 CE3 TRP A 57 -2.076 -1.528 6.096 1.00 0.00 C ATOM 791 CZ2 TRP A 57 -2.964 -4.156 6.576 1.00 0.00 C ATOM 792 CZ3 TRP A 57 -3.263 -1.777 6.729 1.00 0.00 C ATOM 793 CH2 TRP A 57 -3.697 -3.075 6.965 1.00 0.00 C ATOM 0 H TRP A 57 1.053 0.697 6.274 1.00 0.00 H new ATOM 0 HA TRP A 57 1.919 -2.108 6.344 1.00 0.00 H new ATOM 0 HB2 TRP A 57 0.213 -0.750 4.297 1.00 0.00 H new ATOM 0 HB3 TRP A 57 1.407 -1.900 3.730 1.00 0.00 H new ATOM 0 HD1 TRP A 57 1.093 -4.468 4.450 1.00 0.00 H new ATOM 0 HE1 TRP A 57 -0.878 -5.797 5.474 1.00 0.00 H new ATOM 0 HE3 TRP A 57 -1.749 -0.515 5.914 1.00 0.00 H new ATOM 0 HZ2 TRP A 57 -3.307 -5.163 6.761 1.00 0.00 H new ATOM 0 HZ3 TRP A 57 -3.875 -0.948 7.052 1.00 0.00 H new ATOM 0 HH2 TRP A 57 -4.639 -3.232 7.469 1.00 0.00 H new ATOM 804 N HIS A 58 4.132 -1.301 5.774 1.00 0.00 N ATOM 805 CA HIS A 58 5.458 -0.949 5.325 1.00 0.00 C ATOM 806 C HIS A 58 5.706 -1.520 3.923 1.00 0.00 C ATOM 807 O HIS A 58 5.325 -2.645 3.607 1.00 0.00 O ATOM 808 CB HIS A 58 6.540 -1.422 6.303 1.00 0.00 C ATOM 809 CG HIS A 58 7.866 -0.786 6.022 1.00 0.00 C ATOM 810 ND1 HIS A 58 8.769 -1.308 5.128 1.00 0.00 N ATOM 811 CD2 HIS A 58 8.390 0.384 6.442 1.00 0.00 C ATOM 812 CE1 HIS A 58 9.786 -0.477 4.988 1.00 0.00 C ATOM 813 NE2 HIS A 58 9.584 0.557 5.784 1.00 0.00 N ATOM 0 H HIS A 58 4.101 -1.990 6.525 1.00 0.00 H new ATOM 0 HA HIS A 58 5.518 0.139 5.284 1.00 0.00 H new ATOM 0 HB2 HIS A 58 6.234 -1.188 7.323 1.00 0.00 H new ATOM 0 HB3 HIS A 58 6.637 -2.506 6.240 1.00 0.00 H new ATOM 0 HD2 HIS A 58 7.952 1.060 7.162 1.00 0.00 H new ATOM 0 HE1 HIS A 58 10.635 -0.619 4.336 1.00 0.00 H new ATOM 0 HE2 HIS A 58 10.212 1.354 5.893 1.00 0.00 H new ATOM 822 N TYR A 59 6.350 -0.705 3.105 1.00 0.00 N ATOM 823 CA TYR A 59 6.559 -0.953 1.683 1.00 0.00 C ATOM 824 C TYR A 59 7.373 -2.213 1.414 1.00 0.00 C ATOM 825 O TYR A 59 7.189 -2.872 0.396 1.00 0.00 O ATOM 826 CB TYR A 59 7.263 0.263 1.095 1.00 0.00 C ATOM 827 CG TYR A 59 6.335 1.367 0.703 1.00 0.00 C ATOM 828 CD1 TYR A 59 5.236 1.658 1.473 1.00 0.00 C ATOM 829 CD2 TYR A 59 6.539 2.084 -0.451 1.00 0.00 C ATOM 830 CE1 TYR A 59 4.355 2.646 1.114 1.00 0.00 C ATOM 831 CE2 TYR A 59 5.677 3.082 -0.824 1.00 0.00 C ATOM 832 CZ TYR A 59 4.587 3.363 -0.040 1.00 0.00 C ATOM 833 OH TYR A 59 3.739 4.364 -0.414 1.00 0.00 O ATOM 0 H TYR A 59 6.756 0.176 3.419 1.00 0.00 H new ATOM 0 HA TYR A 59 5.588 -1.114 1.214 1.00 0.00 H new ATOM 0 HB2 TYR A 59 7.979 0.644 1.823 1.00 0.00 H new ATOM 0 HB3 TYR A 59 7.834 -0.047 0.220 1.00 0.00 H new ATOM 0 HD1 TYR A 59 5.062 1.098 2.380 1.00 0.00 H new ATOM 0 HD2 TYR A 59 7.392 1.858 -1.074 1.00 0.00 H new ATOM 0 HE1 TYR A 59 3.492 2.859 1.727 1.00 0.00 H new ATOM 0 HE2 TYR A 59 5.855 3.644 -1.729 1.00 0.00 H new ATOM 0 HH TYR A 59 3.859 5.134 0.181 1.00 0.00 H new ATOM 843 N LEU A 60 8.248 -2.555 2.347 1.00 0.00 N ATOM 844 CA LEU A 60 9.089 -3.747 2.237 1.00 0.00 C ATOM 845 C LEU A 60 8.285 -4.991 2.544 1.00 0.00 C ATOM 846 O LEU A 60 8.828 -6.063 2.815 1.00 0.00 O ATOM 847 CB LEU A 60 10.284 -3.645 3.182 1.00 0.00 C ATOM 848 CG LEU A 60 11.583 -3.191 2.534 1.00 0.00 C ATOM 849 CD1 LEU A 60 12.155 -4.274 1.635 1.00 0.00 C ATOM 850 CD2 LEU A 60 11.333 -1.934 1.755 1.00 0.00 C ATOM 0 H LEU A 60 8.398 -2.019 3.201 1.00 0.00 H new ATOM 0 HA LEU A 60 9.458 -3.815 1.214 1.00 0.00 H new ATOM 0 HB2 LEU A 60 10.034 -2.951 3.984 1.00 0.00 H new ATOM 0 HB3 LEU A 60 10.447 -4.619 3.643 1.00 0.00 H new ATOM 0 HG LEU A 60 12.317 -2.994 3.315 1.00 0.00 H new ATOM 0 HD11 LEU A 60 13.083 -3.921 1.186 1.00 0.00 H new ATOM 0 HD12 LEU A 60 12.355 -5.169 2.225 1.00 0.00 H new ATOM 0 HD13 LEU A 60 11.438 -4.510 0.849 1.00 0.00 H new ATOM 0 HD21 LEU A 60 12.261 -1.604 1.288 1.00 0.00 H new ATOM 0 HD22 LEU A 60 10.587 -2.126 0.983 1.00 0.00 H new ATOM 0 HD23 LEU A 60 10.968 -1.156 2.426 1.00 0.00 H new ATOM 862 N CYS A 61 6.986 -4.834 2.526 1.00 0.00 N ATOM 863 CA CYS A 61 6.104 -5.921 2.814 1.00 0.00 C ATOM 864 C CYS A 61 5.049 -6.047 1.720 1.00 0.00 C ATOM 865 O CYS A 61 4.474 -7.116 1.537 1.00 0.00 O ATOM 866 CB CYS A 61 5.455 -5.699 4.181 1.00 0.00 C ATOM 867 SG CYS A 61 4.717 -7.172 4.916 1.00 0.00 S ATOM 0 H CYS A 61 6.519 -3.953 2.312 1.00 0.00 H new ATOM 0 HA CYS A 61 6.669 -6.853 2.842 1.00 0.00 H new ATOM 0 HB2 CYS A 61 6.207 -5.307 4.865 1.00 0.00 H new ATOM 0 HB3 CYS A 61 4.684 -4.934 4.082 1.00 0.00 H new ATOM 0 HG CYS A 61 4.200 -6.869 6.070 1.00 0.00 H new ATOM 873 N LEU A 62 4.816 -4.957 0.987 1.00 0.00 N ATOM 874 CA LEU A 62 3.846 -4.946 -0.102 1.00 0.00 C ATOM 875 C LEU A 62 4.321 -5.800 -1.279 1.00 0.00 C ATOM 876 O LEU A 62 4.843 -5.266 -2.248 1.00 0.00 O ATOM 877 CB LEU A 62 3.643 -3.525 -0.636 1.00 0.00 C ATOM 878 CG LEU A 62 2.866 -2.504 0.213 1.00 0.00 C ATOM 879 CD1 LEU A 62 1.804 -1.850 -0.640 1.00 0.00 C ATOM 880 CD2 LEU A 62 2.212 -3.107 1.439 1.00 0.00 C ATOM 0 H LEU A 62 5.291 -4.066 1.132 1.00 0.00 H new ATOM 0 HA LEU A 62 2.918 -5.345 0.307 1.00 0.00 H new ATOM 0 HB2 LEU A 62 4.630 -3.105 -0.832 1.00 0.00 H new ATOM 0 HB3 LEU A 62 3.135 -3.606 -1.597 1.00 0.00 H new ATOM 0 HG LEU A 62 3.595 -1.776 0.568 1.00 0.00 H new ATOM 0 HD11 LEU A 62 1.251 -1.126 -0.041 1.00 0.00 H new ATOM 0 HD12 LEU A 62 2.275 -1.341 -1.481 1.00 0.00 H new ATOM 0 HD13 LEU A 62 1.118 -2.610 -1.014 1.00 0.00 H new ATOM 0 HD21 LEU A 62 1.683 -2.329 1.989 1.00 0.00 H new ATOM 0 HD22 LEU A 62 1.506 -3.879 1.132 1.00 0.00 H new ATOM 0 HD23 LEU A 62 2.976 -3.548 2.079 1.00 0.00 H new ATOM 892 N ARG A 63 4.132 -7.108 -1.210 1.00 0.00 N ATOM 893 CA ARG A 63 4.495 -7.983 -2.318 1.00 0.00 C ATOM 894 C ARG A 63 3.755 -7.577 -3.581 1.00 0.00 C ATOM 895 O ARG A 63 4.380 -7.295 -4.598 1.00 0.00 O ATOM 896 CB ARG A 63 4.195 -9.451 -2.017 1.00 0.00 C ATOM 897 CG ARG A 63 5.094 -10.082 -0.970 1.00 0.00 C ATOM 898 CD ARG A 63 4.974 -11.595 -1.022 1.00 0.00 C ATOM 899 NE ARG A 63 5.564 -12.253 0.138 1.00 0.00 N ATOM 900 CZ ARG A 63 4.861 -12.976 1.009 1.00 0.00 C ATOM 901 NH1 ARG A 63 3.552 -13.129 0.842 1.00 0.00 N ATOM 902 NH2 ARG A 63 5.468 -13.547 2.039 1.00 0.00 N ATOM 0 H ARG A 63 3.732 -7.587 -0.404 1.00 0.00 H new ATOM 0 HA ARG A 63 5.570 -7.876 -2.463 1.00 0.00 H new ATOM 0 HB2 ARG A 63 3.160 -9.535 -1.686 1.00 0.00 H new ATOM 0 HB3 ARG A 63 4.281 -10.022 -2.941 1.00 0.00 H new ATOM 0 HG2 ARG A 63 6.129 -9.785 -1.142 1.00 0.00 H new ATOM 0 HG3 ARG A 63 4.819 -9.722 0.021 1.00 0.00 H new ATOM 0 HD2 ARG A 63 3.921 -11.868 -1.092 1.00 0.00 H new ATOM 0 HD3 ARG A 63 5.459 -11.962 -1.927 1.00 0.00 H new ATOM 0 HE ARG A 63 6.568 -12.155 0.291 1.00 0.00 H new ATOM 0 HH11 ARG A 63 3.085 -12.693 0.047 1.00 0.00 H new ATOM 0 HH12 ARG A 63 3.014 -13.682 1.509 1.00 0.00 H new ATOM 0 HH21 ARG A 63 6.474 -13.433 2.165 1.00 0.00 H new ATOM 0 HH22 ARG A 63 4.930 -14.100 2.706 1.00 0.00 H new ATOM 916 N ARG A 64 2.425 -7.525 -3.520 1.00 0.00 N ATOM 917 CA ARG A 64 1.662 -7.167 -4.715 1.00 0.00 C ATOM 918 C ARG A 64 0.532 -6.190 -4.418 1.00 0.00 C ATOM 919 O ARG A 64 -0.393 -6.496 -3.694 1.00 0.00 O ATOM 920 CB ARG A 64 1.145 -8.421 -5.427 1.00 0.00 C ATOM 921 CG ARG A 64 0.035 -9.202 -4.744 1.00 0.00 C ATOM 922 CD ARG A 64 -0.333 -10.424 -5.574 1.00 0.00 C ATOM 923 NE ARG A 64 -0.952 -11.489 -4.779 1.00 0.00 N ATOM 924 CZ ARG A 64 -2.169 -12.003 -4.992 1.00 0.00 C ATOM 925 NH1 ARG A 64 -3.004 -11.444 -5.854 1.00 0.00 N ATOM 926 NH2 ARG A 64 -2.564 -13.069 -4.311 1.00 0.00 N ATOM 0 H ARG A 64 1.869 -7.719 -2.687 1.00 0.00 H new ATOM 0 HA ARG A 64 2.346 -6.649 -5.387 1.00 0.00 H new ATOM 0 HB2 ARG A 64 0.792 -8.126 -6.415 1.00 0.00 H new ATOM 0 HB3 ARG A 64 1.988 -9.095 -5.578 1.00 0.00 H new ATOM 0 HG2 ARG A 64 0.357 -9.512 -3.750 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -0.840 -8.565 -4.612 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -1.018 -10.125 -6.367 1.00 0.00 H new ATOM 0 HD3 ARG A 64 0.564 -10.812 -6.057 1.00 0.00 H new ATOM 0 HE ARG A 64 -0.412 -11.868 -4.001 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -2.723 -10.609 -6.368 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -3.928 -11.849 -6.005 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -1.941 -13.496 -3.626 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -3.491 -13.462 -4.472 1.00 0.00 H new ATOM 940 N TYR A 65 0.590 -5.036 -5.052 1.00 0.00 N ATOM 941 CA TYR A 65 -0.298 -3.925 -4.736 1.00 0.00 C ATOM 942 C TYR A 65 -0.961 -3.404 -5.987 1.00 0.00 C ATOM 943 O TYR A 65 -0.344 -3.360 -7.043 1.00 0.00 O ATOM 944 CB TYR A 65 0.479 -2.820 -4.021 1.00 0.00 C ATOM 945 CG TYR A 65 1.753 -2.410 -4.721 1.00 0.00 C ATOM 946 CD1 TYR A 65 2.839 -3.268 -4.784 1.00 0.00 C ATOM 947 CD2 TYR A 65 1.879 -1.164 -5.305 1.00 0.00 C ATOM 948 CE1 TYR A 65 4.001 -2.897 -5.417 1.00 0.00 C ATOM 949 CE2 TYR A 65 3.030 -0.788 -5.930 1.00 0.00 C ATOM 950 CZ TYR A 65 4.092 -1.653 -5.993 1.00 0.00 C ATOM 951 OH TYR A 65 5.248 -1.276 -6.640 1.00 0.00 O ATOM 0 H TYR A 65 1.253 -4.838 -5.802 1.00 0.00 H new ATOM 0 HA TYR A 65 -1.083 -4.279 -4.067 1.00 0.00 H new ATOM 0 HB2 TYR A 65 -0.164 -1.946 -3.919 1.00 0.00 H new ATOM 0 HB3 TYR A 65 0.723 -3.156 -3.013 1.00 0.00 H new ATOM 0 HD1 TYR A 65 2.771 -4.245 -4.328 1.00 0.00 H new ATOM 0 HD2 TYR A 65 1.049 -0.474 -5.265 1.00 0.00 H new ATOM 0 HE1 TYR A 65 4.837 -3.579 -5.461 1.00 0.00 H new ATOM 0 HE2 TYR A 65 3.106 0.193 -6.376 1.00 0.00 H new ATOM 0 HH TYR A 65 5.760 -0.667 -6.068 1.00 0.00 H new ATOM 961 N GLY A 66 -2.221 -3.018 -5.873 1.00 0.00 N ATOM 962 CA GLY A 66 -3.003 -2.791 -7.058 1.00 0.00 C ATOM 963 C GLY A 66 -4.084 -1.761 -6.924 1.00 0.00 C ATOM 964 O GLY A 66 -4.174 -1.027 -5.941 1.00 0.00 O ATOM 0 H GLY A 66 -2.708 -2.861 -4.991 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -2.333 -2.488 -7.863 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -3.458 -3.734 -7.360 1.00 0.00 H new ATOM 968 N TYR A 67 -4.946 -1.805 -7.914 1.00 0.00 N ATOM 969 CA TYR A 67 -5.997 -0.831 -8.128 1.00 0.00 C ATOM 970 C TYR A 67 -7.008 -1.418 -9.110 1.00 0.00 C ATOM 971 O TYR A 67 -6.619 -1.911 -10.169 1.00 0.00 O ATOM 972 CB TYR A 67 -5.395 0.455 -8.713 1.00 0.00 C ATOM 973 CG TYR A 67 -6.293 1.150 -9.713 1.00 0.00 C ATOM 974 CD1 TYR A 67 -7.543 1.601 -9.334 1.00 0.00 C ATOM 975 CD2 TYR A 67 -5.893 1.354 -11.026 1.00 0.00 C ATOM 976 CE1 TYR A 67 -8.379 2.232 -10.223 1.00 0.00 C ATOM 977 CE2 TYR A 67 -6.723 1.988 -11.931 1.00 0.00 C ATOM 978 CZ TYR A 67 -7.967 2.426 -11.525 1.00 0.00 C ATOM 979 OH TYR A 67 -8.799 3.054 -12.423 1.00 0.00 O ATOM 0 H TYR A 67 -4.936 -2.544 -8.617 1.00 0.00 H new ATOM 0 HA TYR A 67 -6.487 -0.595 -7.184 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -5.172 1.144 -7.898 1.00 0.00 H new ATOM 0 HB3 TYR A 67 -4.447 0.215 -9.195 1.00 0.00 H new ATOM 0 HD1 TYR A 67 -7.870 1.454 -8.315 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -4.919 1.013 -11.345 1.00 0.00 H new ATOM 0 HE1 TYR A 67 -9.353 2.574 -9.904 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -6.400 2.140 -12.950 1.00 0.00 H new ATOM 0 HH TYR A 67 -8.356 3.111 -13.295 1.00 0.00 H new ATOM 989 N ASP A 68 -8.284 -1.415 -8.752 1.00 0.00 N ATOM 990 CA ASP A 68 -9.324 -1.713 -9.718 1.00 0.00 C ATOM 991 C ASP A 68 -10.643 -1.062 -9.349 1.00 0.00 C ATOM 992 O ASP A 68 -11.234 -1.411 -8.344 1.00 0.00 O ATOM 993 CB ASP A 68 -9.540 -3.199 -9.875 1.00 0.00 C ATOM 994 CG ASP A 68 -10.496 -3.490 -11.037 1.00 0.00 C ATOM 995 OD1 ASP A 68 -11.732 -3.346 -10.882 1.00 0.00 O ATOM 996 OD2 ASP A 68 -10.005 -3.832 -12.134 1.00 0.00 O ATOM 0 H ASP A 68 -8.619 -1.212 -7.810 1.00 0.00 H new ATOM 0 HA ASP A 68 -8.976 -1.302 -10.666 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -8.585 -3.693 -10.052 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -9.946 -3.612 -8.952 1.00 0.00 H new ATOM 1001 N SER A 69 -11.095 -0.122 -10.171 1.00 0.00 N ATOM 1002 CA SER A 69 -12.408 0.497 -10.004 1.00 0.00 C ATOM 1003 C SER A 69 -12.675 0.891 -8.547 1.00 0.00 C ATOM 1004 O SER A 69 -13.646 0.436 -7.940 1.00 0.00 O ATOM 1005 CB SER A 69 -13.489 -0.465 -10.492 1.00 0.00 C ATOM 1006 OG SER A 69 -13.061 -1.140 -11.664 1.00 0.00 O ATOM 0 H SER A 69 -10.566 0.232 -10.968 1.00 0.00 H new ATOM 0 HA SER A 69 -12.427 1.411 -10.597 1.00 0.00 H new ATOM 0 HB2 SER A 69 -13.719 -1.190 -9.711 1.00 0.00 H new ATOM 0 HB3 SER A 69 -14.408 0.085 -10.697 1.00 0.00 H new ATOM 0 HG SER A 69 -12.669 -2.004 -11.419 1.00 0.00 H new ATOM 1012 N ASN A 70 -11.792 1.724 -7.999 1.00 0.00 N ATOM 1013 CA ASN A 70 -11.884 2.174 -6.607 1.00 0.00 C ATOM 1014 C ASN A 70 -11.609 1.030 -5.625 1.00 0.00 C ATOM 1015 O ASN A 70 -12.101 1.032 -4.507 1.00 0.00 O ATOM 1016 CB ASN A 70 -13.242 2.796 -6.302 1.00 0.00 C ATOM 1017 CG ASN A 70 -13.620 3.905 -7.270 1.00 0.00 C ATOM 1018 OD1 ASN A 70 -12.760 4.621 -7.790 1.00 0.00 O ATOM 1019 ND2 ASN A 70 -14.909 4.057 -7.523 1.00 0.00 N ATOM 0 H ASN A 70 -10.993 2.107 -8.505 1.00 0.00 H new ATOM 0 HA ASN A 70 -11.117 2.938 -6.478 1.00 0.00 H new ATOM 0 HB2 ASN A 70 -14.006 2.019 -6.332 1.00 0.00 H new ATOM 0 HB3 ASN A 70 -13.233 3.195 -5.288 1.00 0.00 H new ATOM 0 HD21 ASN A 70 -15.220 4.785 -8.166 1.00 0.00 H new ATOM 0 HD22 ASN A 70 -15.592 3.446 -7.075 1.00 0.00 H new ATOM 1026 N LEU A 71 -10.834 0.049 -6.056 1.00 0.00 N ATOM 1027 CA LEU A 71 -10.337 -0.997 -5.166 1.00 0.00 C ATOM 1028 C LEU A 71 -8.797 -0.932 -5.171 1.00 0.00 C ATOM 1029 O LEU A 71 -8.188 -1.227 -6.185 1.00 0.00 O ATOM 1030 CB LEU A 71 -10.798 -2.386 -5.689 1.00 0.00 C ATOM 1031 CG LEU A 71 -11.637 -3.285 -4.749 1.00 0.00 C ATOM 1032 CD1 LEU A 71 -11.319 -4.773 -4.894 1.00 0.00 C ATOM 1033 CD2 LEU A 71 -11.476 -2.890 -3.302 1.00 0.00 C ATOM 0 H LEU A 71 -10.531 -0.048 -7.025 1.00 0.00 H new ATOM 0 HA LEU A 71 -10.722 -0.853 -4.157 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -11.378 -2.223 -6.597 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -9.907 -2.945 -5.976 1.00 0.00 H new ATOM 0 HG LEU A 71 -12.670 -3.127 -5.059 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -11.941 -5.347 -4.207 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -11.520 -5.090 -5.917 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -10.268 -4.945 -4.661 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -12.081 -3.546 -2.676 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -10.428 -2.980 -3.015 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -11.802 -1.858 -3.168 1.00 0.00 H new ATOM 1045 N PHE A 72 -8.158 -0.542 -4.070 1.00 0.00 N ATOM 1046 CA PHE A 72 -6.689 -0.553 -4.008 1.00 0.00 C ATOM 1047 C PHE A 72 -6.245 -1.697 -3.119 1.00 0.00 C ATOM 1048 O PHE A 72 -6.845 -1.947 -2.083 1.00 0.00 O ATOM 1049 CB PHE A 72 -6.095 0.797 -3.525 1.00 0.00 C ATOM 1050 CG PHE A 72 -5.067 0.696 -2.431 1.00 0.00 C ATOM 1051 CD1 PHE A 72 -5.456 0.697 -1.110 1.00 0.00 C ATOM 1052 CD2 PHE A 72 -3.706 0.617 -2.719 1.00 0.00 C ATOM 1053 CE1 PHE A 72 -4.515 0.624 -0.115 1.00 0.00 C ATOM 1054 CE2 PHE A 72 -2.781 0.550 -1.726 1.00 0.00 C ATOM 1055 CZ PHE A 72 -3.180 0.554 -0.434 1.00 0.00 C ATOM 0 H PHE A 72 -8.620 -0.219 -3.220 1.00 0.00 H new ATOM 0 HA PHE A 72 -6.307 -0.698 -5.019 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -5.643 1.302 -4.379 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -6.911 1.429 -3.176 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -6.504 0.755 -0.857 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -3.381 0.609 -3.749 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -4.823 0.622 0.920 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -1.730 0.494 -1.968 1.00 0.00 H new ATOM 0 HZ PHE A 72 -2.443 0.502 0.354 1.00 0.00 H new ATOM 1065 N SER A 73 -5.213 -2.401 -3.521 1.00 0.00 N ATOM 1066 CA SER A 73 -4.805 -3.586 -2.798 1.00 0.00 C ATOM 1067 C SER A 73 -3.297 -3.644 -2.595 1.00 0.00 C ATOM 1068 O SER A 73 -2.556 -2.860 -3.182 1.00 0.00 O ATOM 1069 CB SER A 73 -5.281 -4.812 -3.556 1.00 0.00 C ATOM 1070 OG SER A 73 -4.859 -6.012 -2.936 1.00 0.00 O ATOM 0 H SER A 73 -4.644 -2.178 -4.337 1.00 0.00 H new ATOM 0 HA SER A 73 -5.257 -3.555 -1.807 1.00 0.00 H new ATOM 0 HB2 SER A 73 -6.369 -4.800 -3.620 1.00 0.00 H new ATOM 0 HB3 SER A 73 -4.901 -4.778 -4.577 1.00 0.00 H new ATOM 0 HG SER A 73 -5.219 -6.054 -2.025 1.00 0.00 H new ATOM 1076 N PHE A 74 -2.868 -4.567 -1.737 1.00 0.00 N ATOM 1077 CA PHE A 74 -1.463 -4.905 -1.561 1.00 0.00 C ATOM 1078 C PHE A 74 -1.339 -6.253 -0.834 1.00 0.00 C ATOM 1079 O PHE A 74 -2.134 -6.562 0.054 1.00 0.00 O ATOM 1080 CB PHE A 74 -0.710 -3.796 -0.824 1.00 0.00 C ATOM 1081 CG PHE A 74 -1.351 -3.295 0.430 1.00 0.00 C ATOM 1082 CD1 PHE A 74 -1.601 -4.157 1.479 1.00 0.00 C ATOM 1083 CD2 PHE A 74 -1.674 -1.951 0.576 1.00 0.00 C ATOM 1084 CE1 PHE A 74 -2.167 -3.706 2.640 1.00 0.00 C ATOM 1085 CE2 PHE A 74 -2.233 -1.498 1.750 1.00 0.00 C ATOM 1086 CZ PHE A 74 -2.479 -2.374 2.777 1.00 0.00 C ATOM 0 H PHE A 74 -3.495 -5.105 -1.139 1.00 0.00 H new ATOM 0 HA PHE A 74 -1.001 -4.999 -2.544 1.00 0.00 H new ATOM 0 HB2 PHE A 74 0.287 -4.161 -0.579 1.00 0.00 H new ATOM 0 HB3 PHE A 74 -0.583 -2.955 -1.505 1.00 0.00 H new ATOM 0 HD1 PHE A 74 -1.346 -5.202 1.382 1.00 0.00 H new ATOM 0 HD2 PHE A 74 -1.486 -1.261 -0.233 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -2.368 -4.395 3.447 1.00 0.00 H new ATOM 0 HE2 PHE A 74 -2.478 -0.452 1.863 1.00 0.00 H new ATOM 0 HZ PHE A 74 -2.919 -2.016 3.696 1.00 0.00 H new ATOM 1096 N GLU A 75 -0.392 -7.088 -1.261 1.00 0.00 N ATOM 1097 CA GLU A 75 -0.097 -8.325 -0.559 1.00 0.00 C ATOM 1098 C GLU A 75 1.000 -8.081 0.440 1.00 0.00 C ATOM 1099 O GLU A 75 2.156 -8.001 0.054 1.00 0.00 O ATOM 1100 CB GLU A 75 0.355 -9.454 -1.487 1.00 0.00 C ATOM 1101 CG GLU A 75 0.663 -10.744 -0.740 1.00 0.00 C ATOM 1102 CD GLU A 75 1.099 -11.866 -1.653 1.00 0.00 C ATOM 1103 OE1 GLU A 75 0.367 -12.178 -2.609 1.00 0.00 O ATOM 1104 OE2 GLU A 75 2.168 -12.457 -1.405 1.00 0.00 O ATOM 0 H GLU A 75 0.180 -6.926 -2.089 1.00 0.00 H new ATOM 0 HA GLU A 75 -1.025 -8.636 -0.079 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -0.423 -9.644 -2.226 1.00 0.00 H new ATOM 0 HB3 GLU A 75 1.242 -9.135 -2.034 1.00 0.00 H new ATOM 0 HG2 GLU A 75 1.447 -10.554 -0.007 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -0.222 -11.057 -0.186 1.00 0.00 H new ATOM 1111 N SER A 76 0.663 -7.953 1.704 1.00 0.00 N ATOM 1112 CA SER A 76 1.681 -7.768 2.711 1.00 0.00 C ATOM 1113 C SER A 76 2.267 -9.132 3.077 1.00 0.00 C ATOM 1114 O SER A 76 1.537 -10.048 3.453 1.00 0.00 O ATOM 1115 CB SER A 76 1.083 -7.056 3.922 1.00 0.00 C ATOM 1116 OG SER A 76 0.083 -7.848 4.548 1.00 0.00 O ATOM 0 H SER A 76 -0.295 -7.973 2.055 1.00 0.00 H new ATOM 0 HA SER A 76 2.488 -7.141 2.332 1.00 0.00 H new ATOM 0 HB2 SER A 76 1.872 -6.830 4.639 1.00 0.00 H new ATOM 0 HB3 SER A 76 0.653 -6.104 3.611 1.00 0.00 H new ATOM 0 HG SER A 76 0.312 -8.796 4.457 1.00 0.00 H new ATOM 1122 N GLY A 77 3.583 -9.255 2.971 1.00 0.00 N ATOM 1123 CA GLY A 77 4.210 -10.559 3.034 1.00 0.00 C ATOM 1124 C GLY A 77 4.967 -10.827 4.315 1.00 0.00 C ATOM 1125 O GLY A 77 5.999 -11.491 4.295 1.00 0.00 O ATOM 0 H GLY A 77 4.227 -8.475 2.843 1.00 0.00 H new ATOM 0 HA2 GLY A 77 3.443 -11.324 2.913 1.00 0.00 H new ATOM 0 HA3 GLY A 77 4.896 -10.660 2.193 1.00 0.00 H new ATOM 1129 N ARG A 78 4.484 -10.282 5.412 1.00 0.00 N ATOM 1130 CA ARG A 78 4.989 -10.638 6.732 1.00 0.00 C ATOM 1131 C ARG A 78 3.809 -10.781 7.683 1.00 0.00 C ATOM 1132 O ARG A 78 3.021 -11.715 7.561 1.00 0.00 O ATOM 1133 CB ARG A 78 5.997 -9.599 7.256 1.00 0.00 C ATOM 1134 CG ARG A 78 7.303 -9.563 6.477 1.00 0.00 C ATOM 1135 CD ARG A 78 8.230 -8.459 6.961 1.00 0.00 C ATOM 1136 NE ARG A 78 9.467 -8.400 6.177 1.00 0.00 N ATOM 1137 CZ ARG A 78 10.180 -7.288 5.981 1.00 0.00 C ATOM 1138 NH1 ARG A 78 9.772 -6.131 6.485 1.00 0.00 N ATOM 1139 NH2 ARG A 78 11.296 -7.338 5.272 1.00 0.00 N ATOM 0 H ARG A 78 3.738 -9.586 5.421 1.00 0.00 H new ATOM 0 HA ARG A 78 5.525 -11.585 6.664 1.00 0.00 H new ATOM 0 HB2 ARG A 78 5.537 -8.611 7.222 1.00 0.00 H new ATOM 0 HB3 ARG A 78 6.215 -9.813 8.302 1.00 0.00 H new ATOM 0 HG2 ARG A 78 7.807 -10.525 6.571 1.00 0.00 H new ATOM 0 HG3 ARG A 78 7.089 -9.417 5.418 1.00 0.00 H new ATOM 0 HD2 ARG A 78 7.715 -7.500 6.900 1.00 0.00 H new ATOM 0 HD3 ARG A 78 8.473 -8.624 8.011 1.00 0.00 H new ATOM 0 HE ARG A 78 9.805 -9.264 5.754 1.00 0.00 H new ATOM 0 HH11 ARG A 78 8.909 -6.087 7.026 1.00 0.00 H new ATOM 0 HH12 ARG A 78 10.322 -5.286 6.331 1.00 0.00 H new ATOM 0 HH21 ARG A 78 11.610 -8.224 4.877 1.00 0.00 H new ATOM 0 HH22 ARG A 78 11.843 -6.490 5.121 1.00 0.00 H new ATOM 1153 N ARG A 79 3.687 -9.861 8.620 1.00 0.00 N ATOM 1154 CA ARG A 79 2.495 -9.764 9.439 1.00 0.00 C ATOM 1155 C ARG A 79 2.006 -8.331 9.460 1.00 0.00 C ATOM 1156 O ARG A 79 2.683 -7.433 8.953 1.00 0.00 O ATOM 1157 CB ARG A 79 2.784 -10.230 10.852 1.00 0.00 C ATOM 1158 CG ARG A 79 3.152 -11.689 10.925 1.00 0.00 C ATOM 1159 CD ARG A 79 3.725 -12.031 12.275 1.00 0.00 C ATOM 1160 NE ARG A 79 4.186 -13.415 12.338 1.00 0.00 N ATOM 1161 CZ ARG A 79 5.372 -13.784 12.813 1.00 0.00 C ATOM 1162 NH1 ARG A 79 6.246 -12.866 13.209 1.00 0.00 N ATOM 1163 NH2 ARG A 79 5.694 -15.069 12.870 1.00 0.00 N ATOM 0 H ARG A 79 4.403 -9.167 8.834 1.00 0.00 H new ATOM 0 HA ARG A 79 1.723 -10.404 9.012 1.00 0.00 H new ATOM 0 HB2 ARG A 79 3.597 -9.634 11.266 1.00 0.00 H new ATOM 0 HB3 ARG A 79 1.908 -10.050 11.475 1.00 0.00 H new ATOM 0 HG2 ARG A 79 2.270 -12.301 10.734 1.00 0.00 H new ATOM 0 HG3 ARG A 79 3.878 -11.925 10.147 1.00 0.00 H new ATOM 0 HD2 ARG A 79 4.556 -11.361 12.496 1.00 0.00 H new ATOM 0 HD3 ARG A 79 2.969 -11.865 13.042 1.00 0.00 H new ATOM 0 HE ARG A 79 3.560 -14.144 11.997 1.00 0.00 H new ATOM 0 HH11 ARG A 79 6.008 -11.876 13.149 1.00 0.00 H new ATOM 0 HH12 ARG A 79 7.155 -13.151 13.573 1.00 0.00 H new ATOM 0 HH21 ARG A 79 5.032 -15.775 12.549 1.00 0.00 H new ATOM 0 HH22 ARG A 79 6.604 -15.351 13.234 1.00 0.00 H new ATOM 1177 N CYS A 80 0.837 -8.119 10.028 1.00 0.00 N ATOM 1178 CA CYS A 80 0.313 -6.785 10.200 1.00 0.00 C ATOM 1179 C CYS A 80 -0.813 -6.800 11.224 1.00 0.00 C ATOM 1180 O CYS A 80 -1.300 -7.875 11.591 1.00 0.00 O ATOM 1181 CB CYS A 80 -0.213 -6.235 8.880 1.00 0.00 C ATOM 1182 SG CYS A 80 -0.588 -4.467 8.927 1.00 0.00 S ATOM 0 H CYS A 80 0.230 -8.860 10.379 1.00 0.00 H new ATOM 0 HA CYS A 80 1.122 -6.143 10.550 1.00 0.00 H new ATOM 0 HB2 CYS A 80 0.525 -6.420 8.100 1.00 0.00 H new ATOM 0 HB3 CYS A 80 -1.114 -6.781 8.602 1.00 0.00 H new ATOM 0 HG CYS A 80 -1.509 -4.195 8.050 1.00 0.00 H new ATOM 1188 N GLN A 81 -1.210 -5.618 11.680 1.00 0.00 N ATOM 1189 CA GLN A 81 -2.414 -5.450 12.488 1.00 0.00 C ATOM 1190 C GLN A 81 -3.560 -6.259 11.910 1.00 0.00 C ATOM 1191 O GLN A 81 -4.109 -7.153 12.554 1.00 0.00 O ATOM 1192 CB GLN A 81 -2.820 -3.988 12.494 1.00 0.00 C ATOM 1193 CG GLN A 81 -4.063 -3.723 13.294 1.00 0.00 C ATOM 1194 CD GLN A 81 -3.833 -3.764 14.791 1.00 0.00 C ATOM 1195 OE1 GLN A 81 -3.514 -2.750 15.410 1.00 0.00 O ATOM 1196 NE2 GLN A 81 -4.016 -4.930 15.387 1.00 0.00 N ATOM 0 H GLN A 81 -0.707 -4.749 11.501 1.00 0.00 H new ATOM 0 HA GLN A 81 -2.199 -5.793 13.500 1.00 0.00 H new ATOM 0 HB2 GLN A 81 -2.002 -3.392 12.898 1.00 0.00 H new ATOM 0 HB3 GLN A 81 -2.979 -3.657 11.468 1.00 0.00 H new ATOM 0 HG2 GLN A 81 -4.461 -2.745 13.021 1.00 0.00 H new ATOM 0 HG3 GLN A 81 -4.821 -4.460 13.030 1.00 0.00 H new ATOM 0 HE21 GLN A 81 -4.280 -5.748 14.838 1.00 0.00 H new ATOM 0 HE22 GLN A 81 -3.893 -5.012 16.396 1.00 0.00 H new ATOM 1205 N THR A 82 -3.898 -5.936 10.678 1.00 0.00 N ATOM 1206 CA THR A 82 -4.995 -6.577 10.000 1.00 0.00 C ATOM 1207 C THR A 82 -4.565 -6.992 8.591 1.00 0.00 C ATOM 1208 O THR A 82 -5.387 -7.232 7.708 1.00 0.00 O ATOM 1209 CB THR A 82 -6.233 -5.645 9.979 1.00 0.00 C ATOM 1210 OG1 THR A 82 -7.288 -6.199 9.180 1.00 0.00 O ATOM 1211 CG2 THR A 82 -5.861 -4.266 9.468 1.00 0.00 C ATOM 0 H THR A 82 -3.420 -5.225 10.125 1.00 0.00 H new ATOM 0 HA THR A 82 -5.279 -7.480 10.540 1.00 0.00 H new ATOM 0 HB THR A 82 -6.592 -5.554 11.004 1.00 0.00 H new ATOM 0 HG1 THR A 82 -6.906 -6.633 8.389 1.00 0.00 H new ATOM 0 HG21 THR A 82 -6.746 -3.629 9.462 1.00 0.00 H new ATOM 0 HG22 THR A 82 -5.104 -3.829 10.119 1.00 0.00 H new ATOM 0 HG23 THR A 82 -5.466 -4.348 8.455 1.00 0.00 H new ATOM 1219 N GLY A 83 -3.254 -7.102 8.406 1.00 0.00 N ATOM 1220 CA GLY A 83 -2.703 -7.455 7.109 1.00 0.00 C ATOM 1221 C GLY A 83 -2.314 -8.909 7.050 1.00 0.00 C ATOM 1222 O GLY A 83 -1.242 -9.301 7.504 1.00 0.00 O ATOM 0 H GLY A 83 -2.558 -6.952 9.136 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -3.436 -7.242 6.331 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -1.830 -6.835 6.903 1.00 0.00 H new ATOM 1226 N GLN A 84 -3.204 -9.696 6.490 1.00 0.00 N ATOM 1227 CA GLN A 84 -3.026 -11.139 6.396 1.00 0.00 C ATOM 1228 C GLN A 84 -2.584 -11.535 4.992 1.00 0.00 C ATOM 1229 O GLN A 84 -2.834 -12.650 4.536 1.00 0.00 O ATOM 1230 CB GLN A 84 -4.337 -11.836 6.755 1.00 0.00 C ATOM 1231 CG GLN A 84 -4.832 -11.504 8.153 1.00 0.00 C ATOM 1232 CD GLN A 84 -6.234 -12.011 8.411 1.00 0.00 C ATOM 1233 OE1 GLN A 84 -7.059 -12.087 7.499 1.00 0.00 O ATOM 1234 NE2 GLN A 84 -6.518 -12.361 9.655 1.00 0.00 N ATOM 0 H GLN A 84 -4.077 -9.359 6.084 1.00 0.00 H new ATOM 0 HA GLN A 84 -2.249 -11.448 7.095 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -5.101 -11.554 6.030 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -4.202 -12.914 6.672 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -4.153 -11.937 8.887 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -4.809 -10.424 8.295 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -5.807 -12.283 10.382 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -7.448 -12.709 9.887 1.00 0.00 H new ATOM 1243 N GLY A 85 -1.935 -10.606 4.307 1.00 0.00 N ATOM 1244 CA GLY A 85 -1.480 -10.859 2.955 1.00 0.00 C ATOM 1245 C GLY A 85 -2.112 -9.897 1.980 1.00 0.00 C ATOM 1246 O GLY A 85 -1.987 -8.685 2.142 1.00 0.00 O ATOM 0 H GLY A 85 -1.714 -9.677 4.665 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -0.395 -10.767 2.910 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -1.725 -11.883 2.671 1.00 0.00 H new ATOM 1250 N ILE A 86 -2.789 -10.427 0.969 1.00 0.00 N ATOM 1251 CA ILE A 86 -3.561 -9.595 0.059 1.00 0.00 C ATOM 1252 C ILE A 86 -4.703 -8.936 0.807 1.00 0.00 C ATOM 1253 O ILE A 86 -5.700 -9.572 1.145 1.00 0.00 O ATOM 1254 CB ILE A 86 -4.096 -10.393 -1.144 1.00 0.00 C ATOM 1255 CG1 ILE A 86 -2.999 -10.517 -2.165 1.00 0.00 C ATOM 1256 CG2 ILE A 86 -5.254 -9.673 -1.814 1.00 0.00 C ATOM 1257 CD1 ILE A 86 -2.743 -9.188 -2.837 1.00 0.00 C ATOM 0 H ILE A 86 -2.818 -11.425 0.760 1.00 0.00 H new ATOM 0 HA ILE A 86 -2.894 -8.828 -0.336 1.00 0.00 H new ATOM 0 HB ILE A 86 -4.432 -11.365 -0.782 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -2.086 -10.869 -1.685 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -3.273 -11.261 -2.912 1.00 0.00 H new ATOM 0 HG21 ILE A 86 -5.609 -10.263 -2.659 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -6.065 -9.542 -1.097 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -4.920 -8.697 -2.167 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -1.946 -9.300 -3.572 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -3.652 -8.851 -3.336 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -2.446 -8.453 -2.089 1.00 0.00 H new ATOM 1269 N PHE A 87 -4.529 -7.671 1.103 1.00 0.00 N ATOM 1270 CA PHE A 87 -5.542 -6.914 1.794 1.00 0.00 C ATOM 1271 C PHE A 87 -5.913 -5.725 0.941 1.00 0.00 C ATOM 1272 O PHE A 87 -5.121 -4.802 0.750 1.00 0.00 O ATOM 1273 CB PHE A 87 -5.022 -6.492 3.172 1.00 0.00 C ATOM 1274 CG PHE A 87 -6.060 -5.956 4.127 1.00 0.00 C ATOM 1275 CD1 PHE A 87 -7.415 -6.222 3.972 1.00 0.00 C ATOM 1276 CD2 PHE A 87 -5.660 -5.190 5.202 1.00 0.00 C ATOM 1277 CE1 PHE A 87 -8.339 -5.723 4.877 1.00 0.00 C ATOM 1278 CE2 PHE A 87 -6.575 -4.693 6.106 1.00 0.00 C ATOM 1279 CZ PHE A 87 -7.911 -4.956 5.947 1.00 0.00 C ATOM 0 H PHE A 87 -3.688 -7.141 0.874 1.00 0.00 H new ATOM 0 HA PHE A 87 -6.435 -7.517 1.957 1.00 0.00 H new ATOM 0 HB2 PHE A 87 -4.537 -7.351 3.636 1.00 0.00 H new ATOM 0 HB3 PHE A 87 -4.255 -5.730 3.033 1.00 0.00 H new ATOM 0 HD1 PHE A 87 -7.751 -6.822 3.140 1.00 0.00 H new ATOM 0 HD2 PHE A 87 -4.610 -4.975 5.338 1.00 0.00 H new ATOM 0 HE1 PHE A 87 -9.391 -5.932 4.748 1.00 0.00 H new ATOM 0 HE2 PHE A 87 -6.239 -4.096 6.941 1.00 0.00 H new ATOM 0 HZ PHE A 87 -8.628 -4.566 6.655 1.00 0.00 H new ATOM 1289 N ALA A 88 -7.101 -5.786 0.382 1.00 0.00 N ATOM 1290 CA ALA A 88 -7.552 -4.769 -0.529 1.00 0.00 C ATOM 1291 C ALA A 88 -8.565 -3.852 0.148 1.00 0.00 C ATOM 1292 O ALA A 88 -9.368 -4.283 0.982 1.00 0.00 O ATOM 1293 CB ALA A 88 -8.131 -5.409 -1.770 1.00 0.00 C ATOM 0 H ALA A 88 -7.773 -6.536 0.547 1.00 0.00 H new ATOM 0 HA ALA A 88 -6.702 -4.155 -0.826 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -8.471 -4.632 -2.455 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -7.367 -6.014 -2.257 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -8.974 -6.042 -1.493 1.00 0.00 H new ATOM 1299 N PHE A 89 -8.509 -2.586 -0.197 1.00 0.00 N ATOM 1300 CA PHE A 89 -9.428 -1.611 0.338 1.00 0.00 C ATOM 1301 C PHE A 89 -10.078 -0.905 -0.806 1.00 0.00 C ATOM 1302 O PHE A 89 -9.421 -0.526 -1.771 1.00 0.00 O ATOM 1303 CB PHE A 89 -8.738 -0.579 1.220 1.00 0.00 C ATOM 1304 CG PHE A 89 -7.677 -1.165 2.064 1.00 0.00 C ATOM 1305 CD1 PHE A 89 -6.443 -1.345 1.524 1.00 0.00 C ATOM 1306 CD2 PHE A 89 -7.905 -1.536 3.373 1.00 0.00 C ATOM 1307 CE1 PHE A 89 -5.433 -1.893 2.255 1.00 0.00 C ATOM 1308 CE2 PHE A 89 -6.893 -2.088 4.125 1.00 0.00 C ATOM 1309 CZ PHE A 89 -5.651 -2.270 3.561 1.00 0.00 C ATOM 0 H PHE A 89 -7.828 -2.205 -0.854 1.00 0.00 H new ATOM 0 HA PHE A 89 -10.154 -2.138 0.957 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -8.307 0.200 0.591 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -9.480 -0.099 1.858 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -6.261 -1.049 0.501 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -8.882 -1.393 3.810 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -4.459 -2.032 1.809 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -7.072 -2.376 5.150 1.00 0.00 H new ATOM 0 HZ PHE A 89 -4.851 -2.707 4.140 1.00 0.00 H new ATOM 1319 N LYS A 90 -11.355 -0.726 -0.697 1.00 0.00 N ATOM 1320 CA LYS A 90 -12.103 -0.082 -1.721 1.00 0.00 C ATOM 1321 C LYS A 90 -11.836 1.415 -1.649 1.00 0.00 C ATOM 1322 O LYS A 90 -12.566 2.170 -1.014 1.00 0.00 O ATOM 1323 CB LYS A 90 -13.559 -0.397 -1.523 1.00 0.00 C ATOM 1324 CG LYS A 90 -14.352 -0.528 -2.791 1.00 0.00 C ATOM 1325 CD LYS A 90 -15.621 -1.313 -2.567 1.00 0.00 C ATOM 1326 CE LYS A 90 -16.369 -0.777 -1.377 1.00 0.00 C ATOM 1327 NZ LYS A 90 -17.652 -1.496 -1.167 1.00 0.00 N ATOM 0 H LYS A 90 -11.907 -1.024 0.107 1.00 0.00 H new ATOM 0 HA LYS A 90 -11.809 -0.435 -2.709 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -13.642 -1.327 -0.961 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -14.006 0.386 -0.911 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -14.598 0.463 -3.172 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -13.747 -1.021 -3.551 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -16.251 -1.258 -3.455 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -15.382 -2.365 -2.410 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -15.749 -0.870 -0.485 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -16.566 0.286 -1.519 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -18.304 -0.892 -0.627 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -18.076 -1.726 -2.088 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -17.475 -2.374 -0.639 1.00 0.00 H new ATOM 1341 N CYS A 91 -10.752 1.820 -2.276 1.00 0.00 N ATOM 1342 CA CYS A 91 -10.316 3.202 -2.252 1.00 0.00 C ATOM 1343 C CYS A 91 -10.738 3.868 -3.546 1.00 0.00 C ATOM 1344 O CYS A 91 -10.332 3.434 -4.608 1.00 0.00 O ATOM 1345 CB CYS A 91 -8.794 3.296 -2.128 1.00 0.00 C ATOM 1346 SG CYS A 91 -8.189 5.000 -2.115 1.00 0.00 S ATOM 0 H CYS A 91 -10.148 1.201 -2.817 1.00 0.00 H new ATOM 0 HA CYS A 91 -10.769 3.695 -1.392 1.00 0.00 H new ATOM 0 HB2 CYS A 91 -8.478 2.797 -1.212 1.00 0.00 H new ATOM 0 HB3 CYS A 91 -8.334 2.759 -2.958 1.00 0.00 H new ATOM 0 HG CYS A 91 -8.606 5.600 -1.040 1.00 0.00 H new ATOM 1352 N ALA A 92 -11.543 4.913 -3.484 1.00 0.00 N ATOM 1353 CA ALA A 92 -11.962 5.573 -4.714 1.00 0.00 C ATOM 1354 C ALA A 92 -10.786 6.253 -5.398 1.00 0.00 C ATOM 1355 O ALA A 92 -10.761 6.381 -6.619 1.00 0.00 O ATOM 1356 CB ALA A 92 -13.101 6.527 -4.461 1.00 0.00 C ATOM 0 H ALA A 92 -11.913 5.317 -2.623 1.00 0.00 H new ATOM 0 HA ALA A 92 -12.333 4.810 -5.398 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -13.391 7.004 -5.397 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -13.951 5.979 -4.054 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -12.786 7.289 -3.748 1.00 0.00 H new ATOM 1362 N ARG A 93 -9.797 6.664 -4.620 1.00 0.00 N ATOM 1363 CA ARG A 93 -8.520 7.058 -5.193 1.00 0.00 C ATOM 1364 C ARG A 93 -7.596 5.857 -5.258 1.00 0.00 C ATOM 1365 O ARG A 93 -6.416 6.016 -5.092 1.00 0.00 O ATOM 1366 CB ARG A 93 -7.823 8.178 -4.396 1.00 0.00 C ATOM 1367 CG ARG A 93 -8.217 9.606 -4.769 1.00 0.00 C ATOM 1368 CD ARG A 93 -9.633 9.721 -5.305 1.00 0.00 C ATOM 1369 NE ARG A 93 -9.708 9.416 -6.734 1.00 0.00 N ATOM 1370 CZ ARG A 93 -10.847 9.346 -7.416 1.00 0.00 C ATOM 1371 NH1 ARG A 93 -12.003 9.552 -6.798 1.00 0.00 N ATOM 1372 NH2 ARG A 93 -10.829 9.056 -8.711 1.00 0.00 N ATOM 0 H ARG A 93 -9.852 6.733 -3.604 1.00 0.00 H new ATOM 0 HA ARG A 93 -8.730 7.444 -6.190 1.00 0.00 H new ATOM 0 HB2 ARG A 93 -8.033 8.029 -3.337 1.00 0.00 H new ATOM 0 HB3 ARG A 93 -6.746 8.073 -4.525 1.00 0.00 H new ATOM 0 HG2 ARG A 93 -8.116 10.244 -3.891 1.00 0.00 H new ATOM 0 HG3 ARG A 93 -7.521 9.983 -5.519 1.00 0.00 H new ATOM 0 HD2 ARG A 93 -10.284 9.042 -4.755 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -10.005 10.730 -5.130 1.00 0.00 H new ATOM 0 HE ARG A 93 -8.836 9.247 -7.236 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -12.017 9.764 -5.800 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -12.877 9.498 -7.321 1.00 0.00 H new ATOM 0 HH21 ARG A 93 -9.941 8.887 -9.183 1.00 0.00 H new ATOM 0 HH22 ARG A 93 -11.703 9.002 -9.234 1.00 0.00 H new ATOM 1386 N ALA A 94 -8.139 4.656 -5.468 1.00 0.00 N ATOM 1387 CA ALA A 94 -7.313 3.450 -5.612 1.00 0.00 C ATOM 1388 C ALA A 94 -6.243 3.693 -6.642 1.00 0.00 C ATOM 1389 O ALA A 94 -5.064 3.513 -6.400 1.00 0.00 O ATOM 1390 CB ALA A 94 -8.140 2.278 -6.102 1.00 0.00 C ATOM 0 H ALA A 94 -9.143 4.490 -5.542 1.00 0.00 H new ATOM 0 HA ALA A 94 -6.886 3.225 -4.634 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -7.503 1.399 -6.200 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -8.937 2.071 -5.388 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -8.575 2.520 -7.072 1.00 0.00 H new ATOM 1396 N GLU A 95 -6.727 4.059 -7.812 1.00 0.00 N ATOM 1397 CA GLU A 95 -5.901 4.500 -8.935 1.00 0.00 C ATOM 1398 C GLU A 95 -4.752 5.375 -8.463 1.00 0.00 C ATOM 1399 O GLU A 95 -3.580 5.055 -8.645 1.00 0.00 O ATOM 1400 CB GLU A 95 -6.789 5.287 -9.903 1.00 0.00 C ATOM 1401 CG GLU A 95 -7.994 5.930 -9.217 1.00 0.00 C ATOM 1402 CD GLU A 95 -8.848 6.761 -10.147 1.00 0.00 C ATOM 1403 OE1 GLU A 95 -9.695 6.179 -10.851 1.00 0.00 O ATOM 1404 OE2 GLU A 95 -8.683 8.000 -10.165 1.00 0.00 O ATOM 0 H GLU A 95 -7.726 4.061 -8.020 1.00 0.00 H new ATOM 0 HA GLU A 95 -5.471 3.628 -9.429 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -6.194 6.064 -10.384 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -7.139 4.620 -10.691 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -8.610 5.147 -8.774 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -7.643 6.560 -8.400 1.00 0.00 H new ATOM 1411 N GLU A 96 -5.132 6.463 -7.837 1.00 0.00 N ATOM 1412 CA GLU A 96 -4.209 7.440 -7.297 1.00 0.00 C ATOM 1413 C GLU A 96 -3.326 6.836 -6.210 1.00 0.00 C ATOM 1414 O GLU A 96 -2.114 7.009 -6.220 1.00 0.00 O ATOM 1415 CB GLU A 96 -5.036 8.576 -6.718 1.00 0.00 C ATOM 1416 CG GLU A 96 -4.237 9.781 -6.313 1.00 0.00 C ATOM 1417 CD GLU A 96 -3.409 10.359 -7.439 1.00 0.00 C ATOM 1418 OE1 GLU A 96 -3.967 11.112 -8.262 1.00 0.00 O ATOM 1419 OE2 GLU A 96 -2.197 10.069 -7.508 1.00 0.00 O ATOM 0 H GLU A 96 -6.112 6.701 -7.684 1.00 0.00 H new ATOM 0 HA GLU A 96 -3.548 7.794 -8.088 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -5.780 8.879 -7.454 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -5.580 8.207 -5.849 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -4.915 10.548 -5.939 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -3.577 9.510 -5.489 1.00 0.00 H new ATOM 1426 N LEU A 97 -3.954 6.137 -5.279 1.00 0.00 N ATOM 1427 CA LEU A 97 -3.288 5.556 -4.148 1.00 0.00 C ATOM 1428 C LEU A 97 -2.289 4.519 -4.588 1.00 0.00 C ATOM 1429 O LEU A 97 -1.104 4.660 -4.346 1.00 0.00 O ATOM 1430 CB LEU A 97 -4.321 4.924 -3.238 1.00 0.00 C ATOM 1431 CG LEU A 97 -3.919 4.908 -1.787 1.00 0.00 C ATOM 1432 CD1 LEU A 97 -5.125 4.949 -0.922 1.00 0.00 C ATOM 1433 CD2 LEU A 97 -3.173 3.645 -1.492 1.00 0.00 C ATOM 0 H LEU A 97 -4.958 5.960 -5.298 1.00 0.00 H new ATOM 0 HA LEU A 97 -2.750 6.338 -3.613 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -5.262 5.465 -3.340 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -4.505 3.901 -3.567 1.00 0.00 H new ATOM 0 HG LEU A 97 -3.292 5.778 -1.589 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -4.822 4.937 0.125 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -5.689 5.859 -1.126 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -5.751 4.081 -1.129 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -2.881 3.632 -0.442 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -3.812 2.787 -1.702 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -2.281 3.595 -2.117 1.00 0.00 H new ATOM 1445 N PHE A 98 -2.776 3.483 -5.240 1.00 0.00 N ATOM 1446 CA PHE A 98 -1.915 2.449 -5.753 1.00 0.00 C ATOM 1447 C PHE A 98 -0.728 3.081 -6.476 1.00 0.00 C ATOM 1448 O PHE A 98 0.417 2.789 -6.162 1.00 0.00 O ATOM 1449 CB PHE A 98 -2.689 1.522 -6.694 1.00 0.00 C ATOM 1450 CG PHE A 98 -1.790 0.816 -7.644 1.00 0.00 C ATOM 1451 CD1 PHE A 98 -0.820 -0.007 -7.147 1.00 0.00 C ATOM 1452 CD2 PHE A 98 -1.861 1.032 -9.009 1.00 0.00 C ATOM 1453 CE1 PHE A 98 0.082 -0.606 -7.973 1.00 0.00 C ATOM 1454 CE2 PHE A 98 -0.967 0.411 -9.856 1.00 0.00 C ATOM 1455 CZ PHE A 98 0.015 -0.405 -9.330 1.00 0.00 C ATOM 0 H PHE A 98 -3.769 3.339 -5.425 1.00 0.00 H new ATOM 0 HA PHE A 98 -1.544 1.850 -4.921 1.00 0.00 H new ATOM 0 HB2 PHE A 98 -3.243 0.790 -6.107 1.00 0.00 H new ATOM 0 HB3 PHE A 98 -3.423 2.103 -7.253 1.00 0.00 H new ATOM 0 HD1 PHE A 98 -0.767 -0.185 -6.083 1.00 0.00 H new ATOM 0 HD2 PHE A 98 -2.618 1.688 -9.412 1.00 0.00 H new ATOM 0 HE1 PHE A 98 0.852 -1.241 -7.560 1.00 0.00 H new ATOM 0 HE2 PHE A 98 -1.035 0.562 -10.923 1.00 0.00 H new ATOM 0 HZ PHE A 98 0.729 -0.884 -9.984 1.00 0.00 H new ATOM 1465 N ASN A 99 -1.032 3.968 -7.417 1.00 0.00 N ATOM 1466 CA ASN A 99 -0.019 4.734 -8.155 1.00 0.00 C ATOM 1467 C ASN A 99 0.940 5.418 -7.217 1.00 0.00 C ATOM 1468 O ASN A 99 2.125 5.135 -7.251 1.00 0.00 O ATOM 1469 CB ASN A 99 -0.689 5.798 -9.023 1.00 0.00 C ATOM 1470 CG ASN A 99 0.167 6.236 -10.196 1.00 0.00 C ATOM 1471 OD1 ASN A 99 0.103 7.390 -10.619 1.00 0.00 O ATOM 1472 ND2 ASN A 99 0.945 5.323 -10.748 1.00 0.00 N ATOM 0 H ASN A 99 -1.990 4.181 -7.695 1.00 0.00 H new ATOM 0 HA ASN A 99 0.531 4.030 -8.779 1.00 0.00 H new ATOM 0 HB2 ASN A 99 -1.636 5.409 -9.397 1.00 0.00 H new ATOM 0 HB3 ASN A 99 -0.922 6.667 -8.407 1.00 0.00 H new ATOM 0 HD21 ASN A 99 1.521 5.564 -11.555 1.00 0.00 H new ATOM 0 HD22 ASN A 99 0.970 4.377 -10.368 1.00 0.00 H new ATOM 1479 N MET A 100 0.417 6.305 -6.387 1.00 0.00 N ATOM 1480 CA MET A 100 1.227 7.047 -5.433 1.00 0.00 C ATOM 1481 C MET A 100 2.122 6.080 -4.689 1.00 0.00 C ATOM 1482 O MET A 100 3.319 6.285 -4.609 1.00 0.00 O ATOM 1483 CB MET A 100 0.322 7.797 -4.457 1.00 0.00 C ATOM 1484 CG MET A 100 1.033 8.859 -3.636 1.00 0.00 C ATOM 1485 SD MET A 100 0.261 9.172 -2.041 1.00 0.00 S ATOM 1486 CE MET A 100 -1.449 9.210 -2.522 1.00 0.00 C ATOM 0 H MET A 100 -0.577 6.531 -6.355 1.00 0.00 H new ATOM 0 HA MET A 100 1.844 7.776 -5.959 1.00 0.00 H new ATOM 0 HB2 MET A 100 -0.486 8.268 -5.017 1.00 0.00 H new ATOM 0 HB3 MET A 100 -0.137 7.077 -3.779 1.00 0.00 H new ATOM 0 HG2 MET A 100 2.066 8.551 -3.476 1.00 0.00 H new ATOM 0 HG3 MET A 100 1.061 9.788 -4.205 1.00 0.00 H new ATOM 0 HE1 MET A 100 -1.999 9.878 -1.859 1.00 0.00 H new ATOM 0 HE2 MET A 100 -1.531 9.570 -3.548 1.00 0.00 H new ATOM 0 HE3 MET A 100 -1.868 8.206 -2.455 1.00 0.00 H new ATOM 1496 N LEU A 101 1.524 5.014 -4.192 1.00 0.00 N ATOM 1497 CA LEU A 101 2.251 3.919 -3.576 1.00 0.00 C ATOM 1498 C LEU A 101 3.391 3.422 -4.465 1.00 0.00 C ATOM 1499 O LEU A 101 4.541 3.450 -4.039 1.00 0.00 O ATOM 1500 CB LEU A 101 1.261 2.798 -3.266 1.00 0.00 C ATOM 1501 CG LEU A 101 1.829 1.403 -3.068 1.00 0.00 C ATOM 1502 CD1 LEU A 101 2.862 1.378 -1.969 1.00 0.00 C ATOM 1503 CD2 LEU A 101 0.698 0.453 -2.756 1.00 0.00 C ATOM 0 H LEU A 101 0.513 4.882 -4.204 1.00 0.00 H new ATOM 0 HA LEU A 101 2.714 4.269 -2.654 1.00 0.00 H new ATOM 0 HB2 LEU A 101 0.714 3.071 -2.364 1.00 0.00 H new ATOM 0 HB3 LEU A 101 0.535 2.755 -4.078 1.00 0.00 H new ATOM 0 HG LEU A 101 2.329 1.092 -3.986 1.00 0.00 H new ATOM 0 HD11 LEU A 101 3.247 0.365 -1.855 1.00 0.00 H new ATOM 0 HD12 LEU A 101 3.681 2.051 -2.224 1.00 0.00 H new ATOM 0 HD13 LEU A 101 2.406 1.700 -1.033 1.00 0.00 H new ATOM 0 HD21 LEU A 101 1.096 -0.552 -2.612 1.00 0.00 H new ATOM 0 HD22 LEU A 101 0.192 0.776 -1.847 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -0.011 0.447 -3.584 1.00 0.00 H new ATOM 1515 N GLN A 102 3.089 2.981 -5.692 1.00 0.00 N ATOM 1516 CA GLN A 102 4.148 2.499 -6.580 1.00 0.00 C ATOM 1517 C GLN A 102 5.194 3.593 -6.783 1.00 0.00 C ATOM 1518 O GLN A 102 6.384 3.327 -6.746 1.00 0.00 O ATOM 1519 CB GLN A 102 3.653 2.022 -7.952 1.00 0.00 C ATOM 1520 CG GLN A 102 2.195 2.020 -8.161 1.00 0.00 C ATOM 1521 CD GLN A 102 1.866 2.163 -9.628 1.00 0.00 C ATOM 1522 OE1 GLN A 102 0.826 2.692 -10.012 1.00 0.00 O ATOM 1523 NE2 GLN A 102 2.777 1.715 -10.457 1.00 0.00 N ATOM 0 H GLN A 102 2.147 2.948 -6.083 1.00 0.00 H new ATOM 0 HA GLN A 102 4.576 1.629 -6.082 1.00 0.00 H new ATOM 0 HB2 GLN A 102 4.106 2.653 -8.716 1.00 0.00 H new ATOM 0 HB3 GLN A 102 4.022 1.009 -8.115 1.00 0.00 H new ATOM 0 HG2 GLN A 102 1.769 1.094 -7.776 1.00 0.00 H new ATOM 0 HG3 GLN A 102 1.741 2.837 -7.600 1.00 0.00 H new ATOM 0 HE21 GLN A 102 3.627 1.282 -10.095 1.00 0.00 H new ATOM 0 HE22 GLN A 102 2.636 1.799 -11.464 1.00 0.00 H new ATOM 1532 N GLU A 103 4.730 4.828 -6.976 1.00 0.00 N ATOM 1533 CA GLU A 103 5.613 5.984 -7.161 1.00 0.00 C ATOM 1534 C GLU A 103 6.487 6.199 -5.939 1.00 0.00 C ATOM 1535 O GLU A 103 7.695 6.376 -6.056 1.00 0.00 O ATOM 1536 CB GLU A 103 4.799 7.250 -7.382 1.00 0.00 C ATOM 1537 CG GLU A 103 3.742 7.153 -8.460 1.00 0.00 C ATOM 1538 CD GLU A 103 4.291 7.379 -9.850 1.00 0.00 C ATOM 1539 OE1 GLU A 103 4.600 8.545 -10.179 1.00 0.00 O ATOM 1540 OE2 GLU A 103 4.401 6.412 -10.629 1.00 0.00 O ATOM 0 H GLU A 103 3.736 5.057 -7.009 1.00 0.00 H new ATOM 0 HA GLU A 103 6.235 5.778 -8.032 1.00 0.00 H new ATOM 0 HB2 GLU A 103 4.315 7.521 -6.444 1.00 0.00 H new ATOM 0 HB3 GLU A 103 5.481 8.062 -7.635 1.00 0.00 H new ATOM 0 HG2 GLU A 103 3.275 6.169 -8.416 1.00 0.00 H new ATOM 0 HG3 GLU A 103 2.960 7.886 -8.261 1.00 0.00 H new ATOM 1547 N ILE A 104 5.870 6.215 -4.768 1.00 0.00 N ATOM 1548 CA ILE A 104 6.608 6.335 -3.531 1.00 0.00 C ATOM 1549 C ILE A 104 7.620 5.202 -3.443 1.00 0.00 C ATOM 1550 O ILE A 104 8.775 5.418 -3.072 1.00 0.00 O ATOM 1551 CB ILE A 104 5.698 6.321 -2.285 1.00 0.00 C ATOM 1552 CG1 ILE A 104 4.886 7.610 -2.172 1.00 0.00 C ATOM 1553 CG2 ILE A 104 6.544 6.157 -1.051 1.00 0.00 C ATOM 1554 CD1 ILE A 104 3.419 7.387 -1.910 1.00 0.00 C ATOM 0 H ILE A 104 4.859 6.146 -4.653 1.00 0.00 H new ATOM 0 HA ILE A 104 7.111 7.302 -3.542 1.00 0.00 H new ATOM 0 HB ILE A 104 5.003 5.487 -2.382 1.00 0.00 H new ATOM 0 HG12 ILE A 104 5.300 8.219 -1.369 1.00 0.00 H new ATOM 0 HG13 ILE A 104 4.998 8.180 -3.094 1.00 0.00 H new ATOM 0 HG21 ILE A 104 5.903 6.147 -0.169 1.00 0.00 H new ATOM 0 HG22 ILE A 104 7.095 5.218 -1.110 1.00 0.00 H new ATOM 0 HG23 ILE A 104 7.247 6.987 -0.979 1.00 0.00 H new ATOM 0 HD11 ILE A 104 2.911 8.349 -1.843 1.00 0.00 H new ATOM 0 HD12 ILE A 104 2.988 6.805 -2.725 1.00 0.00 H new ATOM 0 HD13 ILE A 104 3.295 6.845 -0.972 1.00 0.00 H new ATOM 1566 N MET A 105 7.182 4.006 -3.827 1.00 0.00 N ATOM 1567 CA MET A 105 8.062 2.850 -3.899 1.00 0.00 C ATOM 1568 C MET A 105 9.252 3.145 -4.807 1.00 0.00 C ATOM 1569 O MET A 105 10.408 2.915 -4.444 1.00 0.00 O ATOM 1570 CB MET A 105 7.330 1.625 -4.433 1.00 0.00 C ATOM 1571 CG MET A 105 6.276 1.073 -3.496 1.00 0.00 C ATOM 1572 SD MET A 105 6.033 -0.686 -3.736 1.00 0.00 S ATOM 1573 CE MET A 105 5.084 -1.072 -2.286 1.00 0.00 C ATOM 0 H MET A 105 6.216 3.815 -4.094 1.00 0.00 H new ATOM 0 HA MET A 105 8.407 2.642 -2.886 1.00 0.00 H new ATOM 0 HB2 MET A 105 6.858 1.883 -5.381 1.00 0.00 H new ATOM 0 HB3 MET A 105 8.059 0.843 -4.642 1.00 0.00 H new ATOM 0 HG2 MET A 105 6.571 1.262 -2.464 1.00 0.00 H new ATOM 0 HG3 MET A 105 5.334 1.596 -3.659 1.00 0.00 H new ATOM 0 HE1 MET A 105 5.635 -1.781 -1.669 1.00 0.00 H new ATOM 0 HE2 MET A 105 4.902 -0.160 -1.717 1.00 0.00 H new ATOM 0 HE3 MET A 105 4.131 -1.512 -2.581 1.00 0.00 H new ATOM 1583 N GLN A 106 8.937 3.672 -5.989 1.00 0.00 N ATOM 1584 CA GLN A 106 9.922 4.025 -6.995 1.00 0.00 C ATOM 1585 C GLN A 106 10.933 5.019 -6.443 1.00 0.00 C ATOM 1586 O GLN A 106 12.145 4.826 -6.527 1.00 0.00 O ATOM 1587 CB GLN A 106 9.216 4.679 -8.173 1.00 0.00 C ATOM 1588 CG GLN A 106 8.228 3.788 -8.880 1.00 0.00 C ATOM 1589 CD GLN A 106 7.300 4.558 -9.799 1.00 0.00 C ATOM 1590 OE1 GLN A 106 7.667 5.604 -10.336 1.00 0.00 O ATOM 1591 NE2 GLN A 106 6.102 4.041 -10.001 1.00 0.00 N ATOM 0 H GLN A 106 7.977 3.866 -6.273 1.00 0.00 H new ATOM 0 HA GLN A 106 10.440 3.116 -7.300 1.00 0.00 H new ATOM 0 HB2 GLN A 106 8.696 5.570 -7.820 1.00 0.00 H new ATOM 0 HB3 GLN A 106 9.966 5.011 -8.891 1.00 0.00 H new ATOM 0 HG2 GLN A 106 8.769 3.040 -9.460 1.00 0.00 H new ATOM 0 HG3 GLN A 106 7.636 3.250 -8.140 1.00 0.00 H new ATOM 0 HE21 GLN A 106 5.837 3.172 -9.537 1.00 0.00 H new ATOM 0 HE22 GLN A 106 5.442 4.510 -10.621 1.00 0.00 H new ATOM 1600 N ASN A 107 10.389 6.067 -5.847 1.00 0.00 N ATOM 1601 CA ASN A 107 11.133 7.274 -5.533 1.00 0.00 C ATOM 1602 C ASN A 107 11.852 7.220 -4.188 1.00 0.00 C ATOM 1603 O ASN A 107 12.908 7.827 -4.034 1.00 0.00 O ATOM 1604 CB ASN A 107 10.181 8.466 -5.560 1.00 0.00 C ATOM 1605 CG ASN A 107 9.839 8.922 -6.964 1.00 0.00 C ATOM 1606 OD1 ASN A 107 10.524 9.769 -7.537 1.00 0.00 O ATOM 1607 ND2 ASN A 107 8.769 8.373 -7.520 1.00 0.00 N ATOM 0 H ASN A 107 9.409 6.104 -5.565 1.00 0.00 H new ATOM 0 HA ASN A 107 11.911 7.374 -6.290 1.00 0.00 H new ATOM 0 HB2 ASN A 107 9.262 8.202 -5.036 1.00 0.00 H new ATOM 0 HB3 ASN A 107 10.631 9.295 -5.015 1.00 0.00 H new ATOM 0 HD21 ASN A 107 8.484 8.649 -8.460 1.00 0.00 H new ATOM 0 HD22 ASN A 107 8.230 7.674 -7.008 1.00 0.00 H new ATOM 1614 N ASN A 108 11.303 6.505 -3.216 1.00 0.00 N ATOM 1615 CA ASN A 108 11.859 6.551 -1.867 1.00 0.00 C ATOM 1616 C ASN A 108 12.828 5.415 -1.635 1.00 0.00 C ATOM 1617 O ASN A 108 13.711 5.518 -0.784 1.00 0.00 O ATOM 1618 CB ASN A 108 10.760 6.546 -0.790 1.00 0.00 C ATOM 1619 CG ASN A 108 10.006 7.861 -0.749 1.00 0.00 C ATOM 1620 OD1 ASN A 108 10.354 8.767 0.003 1.00 0.00 O ATOM 1621 ND2 ASN A 108 8.981 7.985 -1.574 1.00 0.00 N ATOM 0 H ASN A 108 10.491 5.898 -3.329 1.00 0.00 H new ATOM 0 HA ASN A 108 12.402 7.492 -1.782 1.00 0.00 H new ATOM 0 HB2 ASN A 108 10.062 5.733 -0.987 1.00 0.00 H new ATOM 0 HB3 ASN A 108 11.207 6.353 0.185 1.00 0.00 H new ATOM 0 HD21 ASN A 108 8.450 8.855 -1.600 1.00 0.00 H new ATOM 0 HD22 ASN A 108 8.721 7.210 -2.184 1.00 0.00 H new ATOM 1628 N SER A 109 12.652 4.336 -2.397 1.00 0.00 N ATOM 1629 CA SER A 109 13.438 3.101 -2.230 1.00 0.00 C ATOM 1630 C SER A 109 13.035 2.387 -0.939 1.00 0.00 C ATOM 1631 O SER A 109 13.045 1.157 -0.876 1.00 0.00 O ATOM 1632 CB SER A 109 14.945 3.389 -2.239 1.00 0.00 C ATOM 1633 OG SER A 109 15.341 3.987 -3.464 1.00 0.00 O ATOM 0 H SER A 109 11.963 4.287 -3.148 1.00 0.00 H new ATOM 0 HA SER A 109 13.222 2.449 -3.076 1.00 0.00 H new ATOM 0 HB2 SER A 109 15.198 4.049 -1.409 1.00 0.00 H new ATOM 0 HB3 SER A 109 15.497 2.461 -2.088 1.00 0.00 H new ATOM 0 HG SER A 109 16.305 4.163 -3.446 1.00 0.00 H new ATOM 1639 N ILE A 110 12.669 3.172 0.072 1.00 0.00 N ATOM 1640 CA ILE A 110 12.070 2.670 1.290 1.00 0.00 C ATOM 1641 C ILE A 110 13.044 1.850 2.118 1.00 0.00 C ATOM 1642 O ILE A 110 13.250 0.651 1.890 1.00 0.00 O ATOM 1643 CB ILE A 110 10.803 1.859 1.027 1.00 0.00 C ATOM 1644 CG1 ILE A 110 9.688 2.755 0.519 1.00 0.00 C ATOM 1645 CG2 ILE A 110 10.383 1.179 2.295 1.00 0.00 C ATOM 1646 CD1 ILE A 110 9.874 3.283 -0.877 1.00 0.00 C ATOM 0 H ILE A 110 12.785 4.185 0.061 1.00 0.00 H new ATOM 0 HA ILE A 110 11.794 3.555 1.863 1.00 0.00 H new ATOM 0 HB ILE A 110 11.010 1.111 0.261 1.00 0.00 H new ATOM 0 HG12 ILE A 110 8.751 2.199 0.558 1.00 0.00 H new ATOM 0 HG13 ILE A 110 9.585 3.601 1.199 1.00 0.00 H new ATOM 0 HG21 ILE A 110 9.479 0.598 2.114 1.00 0.00 H new ATOM 0 HG22 ILE A 110 11.179 0.515 2.633 1.00 0.00 H new ATOM 0 HG23 ILE A 110 10.186 1.928 3.062 1.00 0.00 H new ATOM 0 HD11 ILE A 110 9.024 3.911 -1.145 1.00 0.00 H new ATOM 0 HD12 ILE A 110 10.790 3.872 -0.924 1.00 0.00 H new ATOM 0 HD13 ILE A 110 9.943 2.449 -1.575 1.00 0.00 H new ATOM 1658 N ASN A 111 13.643 2.500 3.092 1.00 0.00 N ATOM 1659 CA ASN A 111 14.520 1.814 4.009 1.00 0.00 C ATOM 1660 C ASN A 111 14.268 2.269 5.426 1.00 0.00 C ATOM 1661 O ASN A 111 14.271 3.464 5.726 1.00 0.00 O ATOM 1662 CB ASN A 111 15.989 2.035 3.640 1.00 0.00 C ATOM 1663 CG ASN A 111 16.316 1.533 2.249 1.00 0.00 C ATOM 1664 OD1 ASN A 111 16.323 2.297 1.283 1.00 0.00 O ATOM 1665 ND2 ASN A 111 16.558 0.237 2.135 1.00 0.00 N ATOM 0 H ASN A 111 13.538 3.499 3.267 1.00 0.00 H new ATOM 0 HA ASN A 111 14.306 0.748 3.937 1.00 0.00 H new ATOM 0 HB2 ASN A 111 16.221 3.098 3.704 1.00 0.00 H new ATOM 0 HB3 ASN A 111 16.624 1.526 4.366 1.00 0.00 H new ATOM 0 HD21 ASN A 111 16.761 -0.165 1.220 1.00 0.00 H new ATOM 0 HD22 ASN A 111 16.542 -0.360 2.962 1.00 0.00 H new ATOM 1672 N VAL A 112 14.016 1.299 6.286 1.00 0.00 N ATOM 1673 CA VAL A 112 13.908 1.543 7.712 1.00 0.00 C ATOM 1674 C VAL A 112 15.273 1.970 8.227 1.00 0.00 C ATOM 1675 O VAL A 112 15.399 2.800 9.122 1.00 0.00 O ATOM 1676 CB VAL A 112 13.442 0.271 8.442 1.00 0.00 C ATOM 1677 CG1 VAL A 112 13.150 0.558 9.906 1.00 0.00 C ATOM 1678 CG2 VAL A 112 12.222 -0.309 7.747 1.00 0.00 C ATOM 0 H VAL A 112 13.881 0.324 6.017 1.00 0.00 H new ATOM 0 HA VAL A 112 13.173 2.326 7.898 1.00 0.00 H new ATOM 0 HB VAL A 112 14.246 -0.464 8.406 1.00 0.00 H new ATOM 0 HG11 VAL A 112 12.823 -0.358 10.398 1.00 0.00 H new ATOM 0 HG12 VAL A 112 14.053 0.928 10.391 1.00 0.00 H new ATOM 0 HG13 VAL A 112 12.365 1.310 9.980 1.00 0.00 H new ATOM 0 HG21 VAL A 112 11.899 -1.209 8.270 1.00 0.00 H new ATOM 0 HG22 VAL A 112 11.416 0.425 7.755 1.00 0.00 H new ATOM 0 HG23 VAL A 112 12.475 -0.559 6.717 1.00 0.00 H new ATOM 1688 N VAL A 113 16.286 1.382 7.617 1.00 0.00 N ATOM 1689 CA VAL A 113 17.670 1.759 7.819 1.00 0.00 C ATOM 1690 C VAL A 113 18.496 1.000 6.787 1.00 0.00 C ATOM 1691 O VAL A 113 17.954 0.114 6.114 1.00 0.00 O ATOM 1692 CB VAL A 113 18.161 1.437 9.255 1.00 0.00 C ATOM 1693 CG1 VAL A 113 18.604 -0.013 9.382 1.00 0.00 C ATOM 1694 CG2 VAL A 113 19.272 2.384 9.676 1.00 0.00 C ATOM 0 H VAL A 113 16.166 0.615 6.955 1.00 0.00 H new ATOM 0 HA VAL A 113 17.778 2.837 7.697 1.00 0.00 H new ATOM 0 HB VAL A 113 17.318 1.583 9.930 1.00 0.00 H new ATOM 0 HG11 VAL A 113 18.941 -0.202 10.401 1.00 0.00 H new ATOM 0 HG12 VAL A 113 17.767 -0.671 9.149 1.00 0.00 H new ATOM 0 HG13 VAL A 113 19.422 -0.206 8.687 1.00 0.00 H new ATOM 0 HG21 VAL A 113 19.598 2.136 10.686 1.00 0.00 H new ATOM 0 HG22 VAL A 113 20.113 2.286 8.989 1.00 0.00 H new ATOM 0 HG23 VAL A 113 18.903 3.410 9.655 1.00 0.00 H new ATOM 1704 N GLU A 114 19.771 1.341 6.653 1.00 0.00 N ATOM 1705 CA GLU A 114 20.668 0.649 5.744 1.00 0.00 C ATOM 1706 C GLU A 114 20.162 0.695 4.307 1.00 0.00 C ATOM 1707 O GLU A 114 19.566 -0.263 3.806 1.00 0.00 O ATOM 1708 CB GLU A 114 20.837 -0.791 6.199 1.00 0.00 C ATOM 1709 CG GLU A 114 21.601 -0.941 7.490 1.00 0.00 C ATOM 1710 CD GLU A 114 21.503 -2.340 8.050 1.00 0.00 C ATOM 1711 OE1 GLU A 114 22.228 -3.233 7.561 1.00 0.00 O ATOM 1712 OE2 GLU A 114 20.677 -2.568 8.956 1.00 0.00 O ATOM 0 H GLU A 114 20.209 2.103 7.171 1.00 0.00 H new ATOM 0 HA GLU A 114 21.632 1.156 5.764 1.00 0.00 H new ATOM 0 HB2 GLU A 114 19.852 -1.242 6.318 1.00 0.00 H new ATOM 0 HB3 GLU A 114 21.351 -1.350 5.417 1.00 0.00 H new ATOM 0 HG2 GLU A 114 22.649 -0.691 7.322 1.00 0.00 H new ATOM 0 HG3 GLU A 114 21.217 -0.230 8.222 1.00 0.00 H new ATOM 1719 N GLU A 115 20.400 1.814 3.654 1.00 0.00 N ATOM 1720 CA GLU A 115 20.022 1.982 2.260 1.00 0.00 C ATOM 1721 C GLU A 115 20.965 1.207 1.360 1.00 0.00 C ATOM 1722 O GLU A 115 22.174 1.177 1.598 1.00 0.00 O ATOM 1723 CB GLU A 115 20.047 3.457 1.872 1.00 0.00 C ATOM 1724 CG GLU A 115 19.081 4.299 2.681 1.00 0.00 C ATOM 1725 CD GLU A 115 19.219 5.775 2.398 1.00 0.00 C ATOM 1726 OE1 GLU A 115 18.701 6.238 1.363 1.00 0.00 O ATOM 1727 OE2 GLU A 115 19.824 6.485 3.225 1.00 0.00 O ATOM 0 H GLU A 115 20.856 2.627 4.067 1.00 0.00 H new ATOM 0 HA GLU A 115 19.009 1.598 2.135 1.00 0.00 H new ATOM 0 HB2 GLU A 115 21.057 3.845 2.004 1.00 0.00 H new ATOM 0 HB3 GLU A 115 19.805 3.553 0.813 1.00 0.00 H new ATOM 0 HG2 GLU A 115 18.060 3.985 2.463 1.00 0.00 H new ATOM 0 HG3 GLU A 115 19.249 4.119 3.743 1.00 0.00 H new ATOM 1734 N PRO A 116 20.422 0.546 0.331 1.00 0.00 N ATOM 1735 CA PRO A 116 21.217 -0.098 -0.708 1.00 0.00 C ATOM 1736 C PRO A 116 21.897 0.934 -1.596 1.00 0.00 C ATOM 1737 O PRO A 116 21.692 0.942 -2.806 1.00 0.00 O ATOM 1738 CB PRO A 116 20.201 -0.897 -1.528 1.00 0.00 C ATOM 1739 CG PRO A 116 18.943 -0.872 -0.747 1.00 0.00 C ATOM 1740 CD PRO A 116 18.989 0.354 0.113 1.00 0.00 C ATOM 0 HA PRO A 116 22.008 -0.718 -0.286 1.00 0.00 H new ATOM 0 HB2 PRO A 116 20.058 -0.453 -2.513 1.00 0.00 H new ATOM 0 HB3 PRO A 116 20.543 -1.920 -1.685 1.00 0.00 H new ATOM 0 HG2 PRO A 116 18.078 -0.847 -1.409 1.00 0.00 H new ATOM 0 HG3 PRO A 116 18.850 -1.769 -0.135 1.00 0.00 H new ATOM 0 HD2 PRO A 116 18.537 1.213 -0.383 1.00 0.00 H new ATOM 0 HD3 PRO A 116 18.453 0.210 1.051 1.00 0.00 H new ATOM 1748 N VAL A 117 22.706 1.793 -0.976 1.00 0.00 N ATOM 1749 CA VAL A 117 23.356 2.921 -1.642 1.00 0.00 C ATOM 1750 C VAL A 117 22.356 4.018 -1.974 1.00 0.00 C ATOM 1751 O VAL A 117 21.394 3.807 -2.710 1.00 0.00 O ATOM 1752 CB VAL A 117 24.099 2.523 -2.935 1.00 0.00 C ATOM 1753 CG1 VAL A 117 24.995 3.653 -3.417 1.00 0.00 C ATOM 1754 CG2 VAL A 117 24.893 1.243 -2.749 1.00 0.00 C ATOM 0 H VAL A 117 22.931 1.724 0.016 1.00 0.00 H new ATOM 0 HA VAL A 117 24.094 3.287 -0.928 1.00 0.00 H new ATOM 0 HB VAL A 117 23.347 2.335 -3.701 1.00 0.00 H new ATOM 0 HG11 VAL A 117 25.507 3.347 -4.329 1.00 0.00 H new ATOM 0 HG12 VAL A 117 24.389 4.536 -3.619 1.00 0.00 H new ATOM 0 HG13 VAL A 117 25.732 3.886 -2.648 1.00 0.00 H new ATOM 0 HG21 VAL A 117 25.403 0.993 -3.679 1.00 0.00 H new ATOM 0 HG22 VAL A 117 25.629 1.383 -1.958 1.00 0.00 H new ATOM 0 HG23 VAL A 117 24.217 0.432 -2.476 1.00 0.00 H new ATOM 1764 N VAL A 118 22.574 5.183 -1.398 1.00 0.00 N ATOM 1765 CA VAL A 118 21.800 6.363 -1.753 1.00 0.00 C ATOM 1766 C VAL A 118 22.163 6.803 -3.174 1.00 0.00 C ATOM 1767 O VAL A 118 23.322 6.692 -3.579 1.00 0.00 O ATOM 1768 CB VAL A 118 22.031 7.518 -0.752 1.00 0.00 C ATOM 1769 CG1 VAL A 118 23.478 7.990 -0.765 1.00 0.00 C ATOM 1770 CG2 VAL A 118 21.081 8.661 -1.049 1.00 0.00 C ATOM 0 H VAL A 118 23.281 5.342 -0.680 1.00 0.00 H new ATOM 0 HA VAL A 118 20.742 6.105 -1.711 1.00 0.00 H new ATOM 0 HB VAL A 118 21.826 7.145 0.251 1.00 0.00 H new ATOM 0 HG11 VAL A 118 23.602 8.802 -0.049 1.00 0.00 H new ATOM 0 HG12 VAL A 118 24.133 7.163 -0.492 1.00 0.00 H new ATOM 0 HG13 VAL A 118 23.736 8.343 -1.763 1.00 0.00 H new ATOM 0 HG21 VAL A 118 21.251 9.470 -0.338 1.00 0.00 H new ATOM 0 HG22 VAL A 118 21.255 9.025 -2.062 1.00 0.00 H new ATOM 0 HG23 VAL A 118 20.052 8.311 -0.961 1.00 0.00 H new ATOM 1780 N GLU A 119 21.166 7.264 -3.926 1.00 0.00 N ATOM 1781 CA GLU A 119 21.353 7.659 -5.322 1.00 0.00 C ATOM 1782 C GLU A 119 21.659 6.423 -6.170 1.00 0.00 C ATOM 1783 O GLU A 119 22.705 6.329 -6.818 1.00 0.00 O ATOM 1784 CB GLU A 119 22.475 8.702 -5.458 1.00 0.00 C ATOM 1785 CG GLU A 119 22.574 9.327 -6.842 1.00 0.00 C ATOM 1786 CD GLU A 119 23.860 10.099 -7.043 1.00 0.00 C ATOM 1787 OE1 GLU A 119 23.967 11.234 -6.532 1.00 0.00 O ATOM 1788 OE2 GLU A 119 24.776 9.571 -7.712 1.00 0.00 O ATOM 0 H GLU A 119 20.210 7.374 -3.588 1.00 0.00 H new ATOM 0 HA GLU A 119 20.432 8.118 -5.680 1.00 0.00 H new ATOM 0 HB2 GLU A 119 22.314 9.492 -4.724 1.00 0.00 H new ATOM 0 HB3 GLU A 119 23.427 8.230 -5.214 1.00 0.00 H new ATOM 0 HG2 GLU A 119 22.504 8.543 -7.596 1.00 0.00 H new ATOM 0 HG3 GLU A 119 21.726 9.995 -6.996 1.00 0.00 H new ATOM 1795 N ARG A 120 20.738 5.468 -6.149 1.00 0.00 N ATOM 1796 CA ARG A 120 20.902 4.230 -6.892 1.00 0.00 C ATOM 1797 C ARG A 120 20.602 4.436 -8.361 1.00 0.00 C ATOM 1798 O ARG A 120 19.450 4.390 -8.790 1.00 0.00 O ATOM 1799 CB ARG A 120 20.023 3.133 -6.315 1.00 0.00 C ATOM 1800 CG ARG A 120 20.733 2.336 -5.256 1.00 0.00 C ATOM 1801 CD ARG A 120 21.686 1.329 -5.865 1.00 0.00 C ATOM 1802 NE ARG A 120 20.992 0.097 -6.239 1.00 0.00 N ATOM 1803 CZ ARG A 120 21.450 -0.801 -7.109 1.00 0.00 C ATOM 1804 NH1 ARG A 120 22.591 -0.592 -7.753 1.00 0.00 N ATOM 1805 NH2 ARG A 120 20.758 -1.912 -7.336 1.00 0.00 N ATOM 0 H ARG A 120 19.867 5.530 -5.622 1.00 0.00 H new ATOM 0 HA ARG A 120 21.942 3.919 -6.799 1.00 0.00 H new ATOM 0 HB2 ARG A 120 19.122 3.577 -5.891 1.00 0.00 H new ATOM 0 HB3 ARG A 120 19.703 2.467 -7.116 1.00 0.00 H new ATOM 0 HG2 ARG A 120 21.284 3.010 -4.600 1.00 0.00 H new ATOM 0 HG3 ARG A 120 20.001 1.817 -4.637 1.00 0.00 H new ATOM 0 HD2 ARG A 120 22.162 1.762 -6.745 1.00 0.00 H new ATOM 0 HD3 ARG A 120 22.479 1.100 -5.154 1.00 0.00 H new ATOM 0 HE ARG A 120 20.090 -0.088 -5.801 1.00 0.00 H new ATOM 0 HH11 ARG A 120 23.124 0.261 -7.583 1.00 0.00 H new ATOM 0 HH12 ARG A 120 22.936 -1.284 -8.418 1.00 0.00 H new ATOM 0 HH21 ARG A 120 19.879 -2.075 -6.845 1.00 0.00 H new ATOM 0 HH22 ARG A 120 21.106 -2.602 -8.002 1.00 0.00 H new ATOM 1819 N ASN A 121 21.649 4.688 -9.115 1.00 0.00 N ATOM 1820 CA ASN A 121 21.545 4.880 -10.547 1.00 0.00 C ATOM 1821 C ASN A 121 22.594 4.031 -11.229 1.00 0.00 C ATOM 1822 O ASN A 121 22.280 3.058 -11.911 1.00 0.00 O ATOM 1823 CB ASN A 121 21.750 6.350 -10.922 1.00 0.00 C ATOM 1824 CG ASN A 121 20.564 7.229 -10.583 1.00 0.00 C ATOM 1825 OD1 ASN A 121 19.413 6.798 -10.654 1.00 0.00 O ATOM 1826 ND2 ASN A 121 20.843 8.466 -10.207 1.00 0.00 N ATOM 0 H ASN A 121 22.599 4.766 -8.753 1.00 0.00 H new ATOM 0 HA ASN A 121 20.547 4.585 -10.872 1.00 0.00 H new ATOM 0 HB2 ASN A 121 22.633 6.729 -10.407 1.00 0.00 H new ATOM 0 HB3 ASN A 121 21.951 6.420 -11.991 1.00 0.00 H new ATOM 0 HD21 ASN A 121 20.088 9.107 -9.961 1.00 0.00 H new ATOM 0 HD22 ASN A 121 21.813 8.779 -10.163 1.00 0.00 H new ATOM 1833 N ASN A 122 23.845 4.377 -10.989 1.00 0.00 N ATOM 1834 CA ASN A 122 24.965 3.668 -11.574 1.00 0.00 C ATOM 1835 C ASN A 122 26.235 4.003 -10.817 1.00 0.00 C ATOM 1836 O ASN A 122 26.756 3.126 -10.109 1.00 0.00 O ATOM 1837 CB ASN A 122 25.128 4.032 -13.049 1.00 0.00 C ATOM 1838 CG ASN A 122 26.298 3.316 -13.690 1.00 0.00 C ATOM 1839 OD1 ASN A 122 26.650 2.201 -13.302 1.00 0.00 O ATOM 1840 ND2 ASN A 122 26.899 3.940 -14.685 1.00 0.00 N ATOM 1841 OXT ASN A 122 26.698 5.157 -10.917 1.00 0.00 O ATOM 0 H ASN A 122 24.112 5.155 -10.385 1.00 0.00 H new ATOM 0 HA ASN A 122 24.772 2.598 -11.504 1.00 0.00 H new ATOM 0 HB2 ASN A 122 24.213 3.782 -13.586 1.00 0.00 H new ATOM 0 HB3 ASN A 122 25.268 5.109 -13.142 1.00 0.00 H new ATOM 0 HD21 ASN A 122 27.685 3.499 -15.163 1.00 0.00 H new ATOM 0 HD22 ASN A 122 26.577 4.863 -14.977 1.00 0.00 H new TER 1848 ASN A 122 ATOM 1849 N GLY B 493 1.566 -16.946 -11.595 1.00 0.00 N ATOM 1850 CA GLY B 493 0.899 -16.845 -10.277 1.00 0.00 C ATOM 1851 C GLY B 493 -0.176 -15.784 -10.269 1.00 0.00 C ATOM 1852 O GLY B 493 -0.464 -15.181 -11.302 1.00 0.00 O ATOM 0 HA2 GLY B 493 0.460 -17.808 -10.018 1.00 0.00 H new ATOM 0 HA3 GLY B 493 1.641 -16.616 -9.512 1.00 0.00 H new ATOM 1858 N PRO B 494 -0.788 -15.537 -9.110 1.00 0.00 N ATOM 1859 CA PRO B 494 -1.879 -14.591 -8.979 1.00 0.00 C ATOM 1860 C PRO B 494 -1.396 -13.178 -8.679 1.00 0.00 C ATOM 1861 O PRO B 494 -0.496 -12.975 -7.860 1.00 0.00 O ATOM 1862 CB PRO B 494 -2.661 -15.151 -7.794 1.00 0.00 C ATOM 1863 CG PRO B 494 -1.646 -15.851 -6.944 1.00 0.00 C ATOM 1864 CD PRO B 494 -0.456 -16.165 -7.823 1.00 0.00 C ATOM 0 HA PRO B 494 -2.458 -14.496 -9.897 1.00 0.00 H new ATOM 0 HB2 PRO B 494 -3.157 -14.355 -7.239 1.00 0.00 H new ATOM 0 HB3 PRO B 494 -3.438 -15.840 -8.126 1.00 0.00 H new ATOM 0 HG2 PRO B 494 -1.348 -15.221 -6.106 1.00 0.00 H new ATOM 0 HG3 PRO B 494 -2.064 -16.766 -6.523 1.00 0.00 H new ATOM 0 HD2 PRO B 494 0.466 -15.759 -7.407 1.00 0.00 H new ATOM 0 HD3 PRO B 494 -0.311 -17.240 -7.929 1.00 0.00 H new ATOM 1872 N ASP B 495 -1.979 -12.207 -9.358 1.00 0.00 N ATOM 1873 CA ASP B 495 -1.718 -10.811 -9.048 1.00 0.00 C ATOM 1874 C ASP B 495 -3.020 -10.120 -8.753 1.00 0.00 C ATOM 1875 O ASP B 495 -3.182 -9.506 -7.712 1.00 0.00 O ATOM 1876 CB ASP B 495 -1.031 -10.095 -10.213 1.00 0.00 C ATOM 1877 CG ASP B 495 0.281 -10.725 -10.611 1.00 0.00 C ATOM 1878 OD1 ASP B 495 0.274 -11.620 -11.481 1.00 0.00 O ATOM 1879 OD2 ASP B 495 1.330 -10.310 -10.083 1.00 0.00 O ATOM 0 H ASP B 495 -2.634 -12.357 -10.125 1.00 0.00 H new ATOM 0 HA ASP B 495 -1.055 -10.775 -8.183 1.00 0.00 H new ATOM 0 HB2 ASP B 495 -1.700 -10.091 -11.073 1.00 0.00 H new ATOM 0 HB3 ASP B 495 -0.858 -9.054 -9.939 1.00 0.00 H new ATOM 1884 N ALA B 496 -3.986 -10.261 -9.619 1.00 0.00 N ATOM 1885 CA ALA B 496 -5.241 -9.629 -9.347 1.00 0.00 C ATOM 1886 C ALA B 496 -5.862 -10.237 -8.115 1.00 0.00 C ATOM 1887 O ALA B 496 -6.018 -11.453 -8.004 1.00 0.00 O ATOM 1888 CB ALA B 496 -6.176 -9.658 -10.531 1.00 0.00 C ATOM 0 H ALA B 496 -3.931 -10.790 -10.490 1.00 0.00 H new ATOM 0 HA ALA B 496 -5.052 -8.573 -9.154 1.00 0.00 H new ATOM 0 HB1 ALA B 496 -7.112 -9.165 -10.268 1.00 0.00 H new ATOM 0 HB2 ALA B 496 -5.716 -9.138 -11.371 1.00 0.00 H new ATOM 0 HB3 ALA B 496 -6.377 -10.692 -10.811 1.00 0.00 H new ATOM 1894 N VAL B 497 -6.097 -9.380 -7.151 1.00 0.00 N ATOM 1895 CA VAL B 497 -6.814 -9.763 -5.946 1.00 0.00 C ATOM 1896 C VAL B 497 -8.282 -9.621 -6.215 1.00 0.00 C ATOM 1897 O VAL B 497 -8.767 -8.544 -6.520 1.00 0.00 O ATOM 1898 CB VAL B 497 -6.392 -8.904 -4.707 1.00 0.00 C ATOM 1899 CG1 VAL B 497 -5.212 -8.050 -5.055 1.00 0.00 C ATOM 1900 CG2 VAL B 497 -7.527 -8.026 -4.183 1.00 0.00 C ATOM 0 H VAL B 497 -5.802 -8.404 -7.173 1.00 0.00 H new ATOM 0 HA VAL B 497 -6.568 -10.796 -5.699 1.00 0.00 H new ATOM 0 HB VAL B 497 -6.129 -9.601 -3.911 1.00 0.00 H new ATOM 0 HG11 VAL B 497 -4.925 -7.456 -4.188 1.00 0.00 H new ATOM 0 HG12 VAL B 497 -4.378 -8.686 -5.352 1.00 0.00 H new ATOM 0 HG13 VAL B 497 -5.474 -7.386 -5.879 1.00 0.00 H new ATOM 0 HG21 VAL B 497 -7.177 -7.453 -3.324 1.00 0.00 H new ATOM 0 HG22 VAL B 497 -7.850 -7.342 -4.968 1.00 0.00 H new ATOM 0 HG23 VAL B 497 -8.365 -8.655 -3.882 1.00 0.00 H new ATOM 1910 N ILE B 498 -9.015 -10.692 -6.175 1.00 0.00 N ATOM 1911 CA ILE B 498 -10.381 -10.547 -6.552 1.00 0.00 C ATOM 1912 C ILE B 498 -11.191 -10.357 -5.305 1.00 0.00 C ATOM 1913 O ILE B 498 -11.778 -11.302 -4.769 1.00 0.00 O ATOM 1914 CB ILE B 498 -10.982 -11.670 -7.417 1.00 0.00 C ATOM 1915 CG1 ILE B 498 -10.128 -12.087 -8.639 1.00 0.00 C ATOM 1916 CG2 ILE B 498 -12.350 -11.211 -7.913 1.00 0.00 C ATOM 1917 CD1 ILE B 498 -8.783 -11.440 -8.785 1.00 0.00 C ATOM 0 H ILE B 498 -8.711 -11.626 -5.901 1.00 0.00 H new ATOM 0 HA ILE B 498 -10.416 -9.679 -7.211 1.00 0.00 H new ATOM 0 HB ILE B 498 -11.035 -12.551 -6.777 1.00 0.00 H new ATOM 0 HG12 ILE B 498 -9.981 -13.166 -8.597 1.00 0.00 H new ATOM 0 HG13 ILE B 498 -10.703 -11.878 -9.541 1.00 0.00 H new ATOM 0 HG21 ILE B 498 -12.795 -11.993 -8.529 1.00 0.00 H new ATOM 0 HG22 ILE B 498 -12.997 -11.009 -7.060 1.00 0.00 H new ATOM 0 HG23 ILE B 498 -12.236 -10.303 -8.505 1.00 0.00 H new ATOM 0 HD11 ILE B 498 -8.291 -11.821 -9.680 1.00 0.00 H new ATOM 0 HD12 ILE B 498 -8.906 -10.360 -8.870 1.00 0.00 H new ATOM 0 HD13 ILE B 498 -8.173 -11.668 -7.911 1.00 0.00 H new ATOM 1929 N ILE B 499 -11.201 -9.132 -4.810 1.00 0.00 N ATOM 1930 CA ILE B 499 -11.854 -8.886 -3.562 1.00 0.00 C ATOM 1931 C ILE B 499 -13.327 -8.628 -3.836 1.00 0.00 C ATOM 1932 O ILE B 499 -13.755 -7.499 -4.087 1.00 0.00 O ATOM 1933 CB ILE B 499 -11.163 -7.742 -2.762 1.00 0.00 C ATOM 1934 CG1 ILE B 499 -9.951 -8.271 -1.975 1.00 0.00 C ATOM 1935 CG2 ILE B 499 -12.131 -7.040 -1.829 1.00 0.00 C ATOM 1936 CD1 ILE B 499 -9.965 -9.763 -1.710 1.00 0.00 C ATOM 0 H ILE B 499 -10.772 -8.318 -5.249 1.00 0.00 H new ATOM 0 HA ILE B 499 -11.772 -9.761 -2.917 1.00 0.00 H new ATOM 0 HB ILE B 499 -10.813 -7.011 -3.491 1.00 0.00 H new ATOM 0 HG12 ILE B 499 -9.043 -8.023 -2.524 1.00 0.00 H new ATOM 0 HG13 ILE B 499 -9.899 -7.747 -1.020 1.00 0.00 H new ATOM 0 HG21 ILE B 499 -11.609 -6.249 -1.290 1.00 0.00 H new ATOM 0 HG22 ILE B 499 -12.946 -6.607 -2.409 1.00 0.00 H new ATOM 0 HG23 ILE B 499 -12.535 -7.759 -1.116 1.00 0.00 H new ATOM 0 HD11 ILE B 499 -9.072 -10.042 -1.151 1.00 0.00 H new ATOM 0 HD12 ILE B 499 -10.851 -10.021 -1.131 1.00 0.00 H new ATOM 0 HD13 ILE B 499 -9.982 -10.301 -2.658 1.00 0.00 H new ATOM 1948 N GLY B 500 -14.069 -9.737 -3.829 1.00 0.00 N ATOM 1949 CA GLY B 500 -15.504 -9.735 -4.044 1.00 0.00 C ATOM 1950 C GLY B 500 -15.952 -8.837 -5.167 1.00 0.00 C ATOM 1951 O GLY B 500 -15.918 -9.221 -6.338 1.00 0.00 O ATOM 0 H GLY B 500 -13.680 -10.667 -3.672 1.00 0.00 H new ATOM 0 HA2 GLY B 500 -15.831 -10.753 -4.254 1.00 0.00 H new ATOM 0 HA3 GLY B 500 -15.999 -9.424 -3.124 1.00 0.00 H new ATOM 1955 N MET B 501 -16.377 -7.639 -4.781 1.00 0.00 N ATOM 1956 CA MET B 501 -16.834 -6.621 -5.683 1.00 0.00 C ATOM 1957 C MET B 501 -15.916 -6.460 -6.882 1.00 0.00 C ATOM 1958 O MET B 501 -16.387 -6.329 -8.010 1.00 0.00 O ATOM 1959 CB MET B 501 -16.912 -5.300 -4.929 1.00 0.00 C ATOM 1960 CG MET B 501 -17.673 -4.256 -5.681 1.00 0.00 C ATOM 1961 SD MET B 501 -17.223 -2.575 -5.215 1.00 0.00 S ATOM 1962 CE MET B 501 -15.551 -2.474 -5.854 1.00 0.00 C ATOM 0 H MET B 501 -16.409 -7.354 -3.802 1.00 0.00 H new ATOM 0 HA MET B 501 -17.813 -6.917 -6.058 1.00 0.00 H new ATOM 0 HB2 MET B 501 -17.387 -5.465 -3.962 1.00 0.00 H new ATOM 0 HB3 MET B 501 -15.903 -4.938 -4.731 1.00 0.00 H new ATOM 0 HG2 MET B 501 -17.500 -4.389 -6.749 1.00 0.00 H new ATOM 0 HG3 MET B 501 -18.740 -4.400 -5.510 1.00 0.00 H new ATOM 0 HE1 MET B 501 -15.107 -1.522 -5.564 1.00 0.00 H new ATOM 0 HE2 MET B 501 -14.956 -3.291 -5.446 1.00 0.00 H new ATOM 0 HE3 MET B 501 -15.572 -2.548 -6.941 1.00 0.00 H new ATOM 1972 N THR B 502 -14.613 -6.464 -6.649 1.00 0.00 N ATOM 1973 CA THR B 502 -13.692 -6.151 -7.721 1.00 0.00 C ATOM 1974 C THR B 502 -12.395 -6.943 -7.680 1.00 0.00 C ATOM 1975 O THR B 502 -11.834 -7.220 -6.622 1.00 0.00 O ATOM 1976 CB THR B 502 -13.411 -4.637 -7.727 1.00 0.00 C ATOM 1977 OG1 THR B 502 -14.386 -3.946 -8.518 1.00 0.00 O ATOM 1978 CG2 THR B 502 -12.037 -4.323 -8.242 1.00 0.00 C ATOM 0 H THR B 502 -14.181 -6.675 -5.750 1.00 0.00 H new ATOM 0 HA THR B 502 -14.178 -6.450 -8.650 1.00 0.00 H new ATOM 0 HB THR B 502 -13.472 -4.298 -6.693 1.00 0.00 H new ATOM 0 HG1 THR B 502 -15.208 -4.478 -8.562 1.00 0.00 H new ATOM 0 HG21 THR B 502 -11.881 -3.244 -8.229 1.00 0.00 H new ATOM 0 HG22 THR B 502 -11.292 -4.805 -7.609 1.00 0.00 H new ATOM 0 HG23 THR B 502 -11.938 -4.691 -9.263 1.00 0.00 H new ATOM 1986 N LYS B 503 -11.953 -7.328 -8.870 1.00 0.00 N ATOM 1987 CA LYS B 503 -10.666 -7.938 -9.058 1.00 0.00 C ATOM 1988 C LYS B 503 -9.579 -6.889 -9.250 1.00 0.00 C ATOM 1989 O LYS B 503 -9.600 -6.138 -10.214 1.00 0.00 O ATOM 1990 CB LYS B 503 -10.731 -8.893 -10.246 1.00 0.00 C ATOM 1991 CG LYS B 503 -9.454 -8.960 -11.062 1.00 0.00 C ATOM 1992 CD LYS B 503 -9.309 -10.271 -11.813 1.00 0.00 C ATOM 1993 CE LYS B 503 -10.635 -10.795 -12.333 1.00 0.00 C ATOM 1994 NZ LYS B 503 -10.477 -12.120 -12.987 1.00 0.00 N ATOM 0 H LYS B 503 -12.490 -7.220 -9.731 1.00 0.00 H new ATOM 0 HA LYS B 503 -10.406 -8.502 -8.162 1.00 0.00 H new ATOM 0 HB2 LYS B 503 -10.969 -9.892 -9.882 1.00 0.00 H new ATOM 0 HB3 LYS B 503 -11.550 -8.588 -10.898 1.00 0.00 H new ATOM 0 HG2 LYS B 503 -9.438 -8.134 -11.773 1.00 0.00 H new ATOM 0 HG3 LYS B 503 -8.597 -8.828 -10.401 1.00 0.00 H new ATOM 0 HD2 LYS B 503 -8.624 -10.133 -12.649 1.00 0.00 H new ATOM 0 HD3 LYS B 503 -8.861 -11.015 -11.154 1.00 0.00 H new ATOM 0 HE2 LYS B 503 -11.344 -10.877 -11.509 1.00 0.00 H new ATOM 0 HE3 LYS B 503 -11.055 -10.084 -13.045 1.00 0.00 H new ATOM 0 HZ1 LYS B 503 -11.401 -12.450 -13.331 1.00 0.00 H new ATOM 0 HZ2 LYS B 503 -9.819 -12.035 -13.788 1.00 0.00 H new ATOM 0 HZ3 LYS B 503 -10.100 -12.803 -12.300 1.00 0.00 H new ATOM 2008 N ILE B 504 -8.622 -6.864 -8.339 1.00 0.00 N ATOM 2009 CA ILE B 504 -7.584 -5.863 -8.334 1.00 0.00 C ATOM 2010 C ILE B 504 -6.324 -6.351 -8.986 1.00 0.00 C ATOM 2011 O ILE B 504 -5.573 -7.113 -8.395 1.00 0.00 O ATOM 2012 CB ILE B 504 -7.209 -5.450 -6.921 1.00 0.00 C ATOM 2013 CG1 ILE B 504 -8.436 -4.993 -6.184 1.00 0.00 C ATOM 2014 CG2 ILE B 504 -6.201 -4.334 -6.973 1.00 0.00 C ATOM 2015 CD1 ILE B 504 -8.116 -4.206 -4.950 1.00 0.00 C ATOM 0 H ILE B 504 -8.548 -7.543 -7.581 1.00 0.00 H new ATOM 0 HA ILE B 504 -7.997 -5.021 -8.889 1.00 0.00 H new ATOM 0 HB ILE B 504 -6.775 -6.303 -6.399 1.00 0.00 H new ATOM 0 HG12 ILE B 504 -9.047 -4.383 -6.849 1.00 0.00 H new ATOM 0 HG13 ILE B 504 -9.034 -5.862 -5.910 1.00 0.00 H new ATOM 0 HG21 ILE B 504 -5.933 -4.038 -5.959 1.00 0.00 H new ATOM 0 HG22 ILE B 504 -5.309 -4.673 -7.500 1.00 0.00 H new ATOM 0 HG23 ILE B 504 -6.630 -3.481 -7.498 1.00 0.00 H new ATOM 0 HD11 ILE B 504 -9.042 -3.904 -4.461 1.00 0.00 H new ATOM 0 HD12 ILE B 504 -7.529 -4.821 -4.268 1.00 0.00 H new ATOM 0 HD13 ILE B 504 -7.543 -3.319 -5.222 1.00 0.00 H new ATOM 2027 N PRO B 505 -6.033 -5.854 -10.164 1.00 0.00 N ATOM 2028 CA PRO B 505 -4.835 -6.210 -10.870 1.00 0.00 C ATOM 2029 C PRO B 505 -3.659 -5.460 -10.264 1.00 0.00 C ATOM 2030 O PRO B 505 -3.456 -4.263 -10.501 1.00 0.00 O ATOM 2031 CB PRO B 505 -5.163 -5.784 -12.292 1.00 0.00 C ATOM 2032 CG PRO B 505 -6.044 -4.599 -12.128 1.00 0.00 C ATOM 2033 CD PRO B 505 -6.811 -4.835 -10.866 1.00 0.00 C ATOM 0 HA PRO B 505 -4.550 -7.261 -10.824 1.00 0.00 H new ATOM 0 HB2 PRO B 505 -4.261 -5.534 -12.850 1.00 0.00 H new ATOM 0 HB3 PRO B 505 -5.666 -6.581 -12.840 1.00 0.00 H new ATOM 0 HG2 PRO B 505 -5.458 -3.682 -12.064 1.00 0.00 H new ATOM 0 HG3 PRO B 505 -6.716 -4.490 -12.980 1.00 0.00 H new ATOM 0 HD2 PRO B 505 -6.899 -3.923 -10.276 1.00 0.00 H new ATOM 0 HD3 PRO B 505 -7.824 -5.179 -11.073 1.00 0.00 H new ATOM 2041 N VAL B 506 -2.955 -6.150 -9.389 1.00 0.00 N ATOM 2042 CA VAL B 506 -1.858 -5.553 -8.659 1.00 0.00 C ATOM 2043 C VAL B 506 -0.523 -5.747 -9.368 1.00 0.00 C ATOM 2044 O VAL B 506 -0.412 -6.487 -10.350 1.00 0.00 O ATOM 2045 CB VAL B 506 -1.751 -6.172 -7.260 1.00 0.00 C ATOM 2046 CG1 VAL B 506 -3.062 -6.074 -6.498 1.00 0.00 C ATOM 2047 CG2 VAL B 506 -1.351 -7.603 -7.382 1.00 0.00 C ATOM 0 H VAL B 506 -3.126 -7.131 -9.166 1.00 0.00 H new ATOM 0 HA VAL B 506 -2.070 -4.486 -8.594 1.00 0.00 H new ATOM 0 HB VAL B 506 -0.998 -5.615 -6.702 1.00 0.00 H new ATOM 0 HG11 VAL B 506 -2.944 -6.524 -5.512 1.00 0.00 H new ATOM 0 HG12 VAL B 506 -3.341 -5.026 -6.388 1.00 0.00 H new ATOM 0 HG13 VAL B 506 -3.842 -6.602 -7.047 1.00 0.00 H new ATOM 0 HG21 VAL B 506 -1.274 -8.045 -6.389 1.00 0.00 H new ATOM 0 HG22 VAL B 506 -2.100 -8.142 -7.962 1.00 0.00 H new ATOM 0 HG23 VAL B 506 -0.386 -7.669 -7.884 1.00 0.00 H new ATOM 2057 N ILE B 507 0.480 -5.077 -8.837 1.00 0.00 N ATOM 2058 CA ILE B 507 1.844 -5.150 -9.328 1.00 0.00 C ATOM 2059 C ILE B 507 2.763 -5.487 -8.163 1.00 0.00 C ATOM 2060 O ILE B 507 2.372 -5.324 -7.010 1.00 0.00 O ATOM 2061 CB ILE B 507 2.268 -3.816 -9.964 1.00 0.00 C ATOM 2062 CG1 ILE B 507 2.515 -2.788 -8.897 1.00 0.00 C ATOM 2063 CG2 ILE B 507 1.164 -3.301 -10.858 1.00 0.00 C ATOM 2064 CD1 ILE B 507 3.122 -1.504 -9.403 1.00 0.00 C ATOM 0 H ILE B 507 0.369 -4.454 -8.037 1.00 0.00 H new ATOM 0 HA ILE B 507 1.911 -5.923 -10.094 1.00 0.00 H new ATOM 0 HB ILE B 507 3.178 -3.986 -10.539 1.00 0.00 H new ATOM 0 HG12 ILE B 507 1.571 -2.560 -8.403 1.00 0.00 H new ATOM 0 HG13 ILE B 507 3.175 -3.216 -8.142 1.00 0.00 H new ATOM 0 HG21 ILE B 507 1.470 -2.356 -11.306 1.00 0.00 H new ATOM 0 HG22 ILE B 507 0.964 -4.028 -11.645 1.00 0.00 H new ATOM 0 HG23 ILE B 507 0.260 -3.148 -10.268 1.00 0.00 H new ATOM 0 HD11 ILE B 507 3.267 -0.817 -8.569 1.00 0.00 H new ATOM 0 HD12 ILE B 507 4.083 -1.716 -9.871 1.00 0.00 H new ATOM 0 HD13 ILE B 507 2.454 -1.050 -10.135 1.00 0.00 H new ATOM 2076 N GLU B 508 3.961 -5.968 -8.439 1.00 0.00 N ATOM 2077 CA GLU B 508 4.863 -6.356 -7.366 1.00 0.00 C ATOM 2078 C GLU B 508 5.864 -5.242 -7.064 1.00 0.00 C ATOM 2079 O GLU B 508 6.269 -4.490 -7.952 1.00 0.00 O ATOM 2080 CB GLU B 508 5.576 -7.664 -7.691 1.00 0.00 C ATOM 2081 CG GLU B 508 4.641 -8.859 -7.773 1.00 0.00 C ATOM 2082 CD GLU B 508 5.384 -10.171 -7.627 1.00 0.00 C ATOM 2083 OE1 GLU B 508 6.343 -10.410 -8.397 1.00 0.00 O ATOM 2084 OE2 GLU B 508 5.042 -10.959 -6.726 1.00 0.00 O ATOM 0 H GLU B 508 4.330 -6.099 -9.381 1.00 0.00 H new ATOM 0 HA GLU B 508 4.265 -6.520 -6.470 1.00 0.00 H new ATOM 0 HB2 GLU B 508 6.100 -7.557 -8.641 1.00 0.00 H new ATOM 0 HB3 GLU B 508 6.332 -7.856 -6.930 1.00 0.00 H new ATOM 0 HG2 GLU B 508 3.884 -8.782 -6.992 1.00 0.00 H new ATOM 0 HG3 GLU B 508 4.116 -8.844 -8.728 1.00 0.00 H new ATOM 2091 N ASN B 509 6.240 -5.144 -5.796 1.00 0.00 N ATOM 2092 CA ASN B 509 7.039 -4.022 -5.296 1.00 0.00 C ATOM 2093 C ASN B 509 8.480 -4.080 -5.786 1.00 0.00 C ATOM 2094 O ASN B 509 9.042 -5.160 -5.975 1.00 0.00 O ATOM 2095 CB ASN B 509 7.040 -4.015 -3.767 1.00 0.00 C ATOM 2096 CG ASN B 509 7.892 -5.126 -3.185 1.00 0.00 C ATOM 2097 OD1 ASN B 509 9.088 -4.955 -2.970 1.00 0.00 O ATOM 2098 ND2 ASN B 509 7.284 -6.268 -2.920 1.00 0.00 N ATOM 0 H ASN B 509 6.003 -5.835 -5.084 1.00 0.00 H new ATOM 0 HA ASN B 509 6.581 -3.111 -5.680 1.00 0.00 H new ATOM 0 HB2 ASN B 509 7.409 -3.053 -3.411 1.00 0.00 H new ATOM 0 HB3 ASN B 509 6.017 -4.118 -3.405 1.00 0.00 H new ATOM 0 HD21 ASN B 509 7.811 -7.046 -2.523 1.00 0.00 H new ATOM 0 HD22 ASN B 509 6.288 -6.372 -3.113 1.00 0.00 H new ATOM 2105 N PRO B 510 9.099 -2.904 -5.995 1.00 0.00 N ATOM 2106 CA PRO B 510 10.511 -2.792 -6.329 1.00 0.00 C ATOM 2107 C PRO B 510 11.408 -2.806 -5.086 1.00 0.00 C ATOM 2108 O PRO B 510 12.630 -2.793 -5.204 1.00 0.00 O ATOM 2109 CB PRO B 510 10.614 -1.426 -7.032 1.00 0.00 C ATOM 2110 CG PRO B 510 9.228 -0.862 -7.050 1.00 0.00 C ATOM 2111 CD PRO B 510 8.474 -1.579 -5.974 1.00 0.00 C ATOM 0 HA PRO B 510 10.844 -3.631 -6.940 1.00 0.00 H new ATOM 0 HB2 PRO B 510 11.297 -0.764 -6.499 1.00 0.00 H new ATOM 0 HB3 PRO B 510 11.003 -1.537 -8.044 1.00 0.00 H new ATOM 0 HG2 PRO B 510 9.242 0.212 -6.866 1.00 0.00 H new ATOM 0 HG3 PRO B 510 8.758 -1.013 -8.022 1.00 0.00 H new ATOM 0 HD2 PRO B 510 8.583 -1.092 -5.005 1.00 0.00 H new ATOM 0 HD3 PRO B 510 7.406 -1.628 -6.187 1.00 0.00 H new ATOM 2119 N GLN B 511 10.804 -2.843 -3.893 1.00 0.00 N ATOM 2120 CA GLN B 511 11.575 -2.775 -2.651 1.00 0.00 C ATOM 2121 C GLN B 511 12.391 -4.043 -2.464 1.00 0.00 C ATOM 2122 O GLN B 511 13.550 -3.998 -2.056 1.00 0.00 O ATOM 2123 CB GLN B 511 10.677 -2.598 -1.430 1.00 0.00 C ATOM 2124 CG GLN B 511 9.438 -1.736 -1.605 1.00 0.00 C ATOM 2125 CD GLN B 511 9.683 -0.291 -2.021 1.00 0.00 C ATOM 2126 OE1 GLN B 511 8.910 0.581 -1.659 1.00 0.00 O ATOM 2127 NE2 GLN B 511 10.718 -0.021 -2.799 1.00 0.00 N ATOM 0 H GLN B 511 9.795 -2.919 -3.763 1.00 0.00 H new ATOM 0 HA GLN B 511 12.230 -1.908 -2.735 1.00 0.00 H new ATOM 0 HB2 GLN B 511 10.358 -3.586 -1.098 1.00 0.00 H new ATOM 0 HB3 GLN B 511 11.277 -2.170 -0.627 1.00 0.00 H new ATOM 0 HG2 GLN B 511 8.796 -2.204 -2.351 1.00 0.00 H new ATOM 0 HG3 GLN B 511 8.885 -1.734 -0.666 1.00 0.00 H new ATOM 0 HE21 GLN B 511 11.349 -0.769 -3.087 1.00 0.00 H new ATOM 0 HE22 GLN B 511 10.886 0.935 -3.111 1.00 0.00 H new HETATM 2136 N PTR B 512 11.775 -5.172 -2.784 1.00 0.00 N HETATM 2137 CA PTR B 512 12.427 -6.474 -2.687 1.00 0.00 C HETATM 2138 C PTR B 512 13.566 -6.584 -3.692 1.00 0.00 C HETATM 2139 O PTR B 512 14.311 -7.564 -3.701 1.00 0.00 O HETATM 2140 CB PTR B 512 11.416 -7.594 -2.942 1.00 0.00 C HETATM 2141 CG PTR B 512 10.396 -7.803 -1.839 1.00 0.00 C HETATM 2142 CD1 PTR B 512 10.118 -6.820 -0.888 1.00 0.00 C HETATM 2143 CD2 PTR B 512 9.703 -9.001 -1.756 1.00 0.00 C HETATM 2144 CE1 PTR B 512 9.191 -7.026 0.101 1.00 0.00 C HETATM 2145 CE2 PTR B 512 8.769 -9.215 -0.767 1.00 0.00 C HETATM 2146 CZ PTR B 512 8.517 -8.228 0.158 1.00 0.00 C HETATM 2147 OH PTR B 512 7.602 -8.452 1.147 1.00 0.00 O HETATM 2148 P PTR B 512 8.065 -9.402 2.369 1.00 0.00 P HETATM 2149 O1P PTR B 512 9.545 -9.139 2.496 1.00 0.00 O HETATM 2150 O2P PTR B 512 7.579 -10.849 1.911 1.00 0.00 O HETATM 2151 O3P PTR B 512 7.350 -8.795 3.552 1.00 0.00 O HETATM 0 HE2 PTR B 512 8.232 -10.162 -0.717 1.00 0.00 H new HETATM 0 HE1 PTR B 512 8.988 -6.247 0.836 1.00 0.00 H new HETATM 0 HD2 PTR B 512 9.901 -9.786 -2.486 1.00 0.00 H new HETATM 0 HD1 PTR B 512 10.649 -5.869 -0.932 1.00 0.00 H new HETATM 0 HB3 PTR B 512 10.886 -7.380 -3.870 1.00 0.00 H new HETATM 0 HB2 PTR B 512 11.960 -8.526 -3.094 1.00 0.00 H new HETATM 0 HA PTR B 512 12.832 -6.573 -1.680 1.00 0.00 H new ATOM 2161 N PHE B 513 13.676 -5.584 -4.554 1.00 0.00 N ATOM 2162 CA PHE B 513 14.724 -5.543 -5.554 1.00 0.00 C ATOM 2163 C PHE B 513 15.665 -4.368 -5.295 1.00 0.00 C ATOM 2164 O PHE B 513 16.745 -4.276 -5.878 1.00 0.00 O ATOM 2165 CB PHE B 513 14.109 -5.453 -6.938 1.00 0.00 C ATOM 2166 CG PHE B 513 13.141 -6.550 -7.222 1.00 0.00 C ATOM 2167 CD1 PHE B 513 13.612 -7.781 -7.605 1.00 0.00 C ATOM 2168 CD2 PHE B 513 11.774 -6.357 -7.116 1.00 0.00 C ATOM 2169 CE1 PHE B 513 12.751 -8.808 -7.880 1.00 0.00 C ATOM 2170 CE2 PHE B 513 10.896 -7.388 -7.389 1.00 0.00 C ATOM 2171 CZ PHE B 513 11.387 -8.619 -7.773 1.00 0.00 C ATOM 0 H PHE B 513 13.044 -4.784 -4.578 1.00 0.00 H new ATOM 0 HA PHE B 513 15.311 -6.460 -5.494 1.00 0.00 H new ATOM 0 HB2 PHE B 513 13.602 -4.494 -7.042 1.00 0.00 H new ATOM 0 HB3 PHE B 513 14.903 -5.476 -7.684 1.00 0.00 H new ATOM 0 HD1 PHE B 513 14.677 -7.941 -7.690 1.00 0.00 H new ATOM 0 HD2 PHE B 513 11.391 -5.392 -6.817 1.00 0.00 H new ATOM 0 HE1 PHE B 513 13.139 -9.770 -8.182 1.00 0.00 H new ATOM 0 HE2 PHE B 513 9.831 -7.231 -7.302 1.00 0.00 H new ATOM 0 HZ PHE B 513 10.708 -9.431 -7.989 1.00 0.00 H new ATOM 2181 N GLY B 514 15.235 -3.465 -4.419 1.00 0.00 N ATOM 2182 CA GLY B 514 16.077 -2.362 -3.997 1.00 0.00 C ATOM 2183 C GLY B 514 15.887 -1.108 -4.830 1.00 0.00 C ATOM 2184 O GLY B 514 16.236 -0.011 -4.392 1.00 0.00 O ATOM 0 H GLY B 514 14.309 -3.479 -3.991 1.00 0.00 H new ATOM 0 HA2 GLY B 514 15.865 -2.132 -2.953 1.00 0.00 H new ATOM 0 HA3 GLY B 514 17.121 -2.670 -4.050 1.00 0.00 H new ATOM 2188 N ILE B 515 15.347 -1.261 -6.030 1.00 0.00 N ATOM 2189 CA ILE B 515 15.205 -0.144 -6.951 1.00 0.00 C ATOM 2190 C ILE B 515 14.050 -0.389 -7.917 1.00 0.00 C ATOM 2191 O ILE B 515 14.056 -1.438 -8.598 1.00 0.00 O ATOM 2192 CB ILE B 515 16.519 0.115 -7.733 1.00 0.00 C ATOM 2193 CG1 ILE B 515 16.310 1.189 -8.808 1.00 0.00 C ATOM 2194 CG2 ILE B 515 17.053 -1.174 -8.348 1.00 0.00 C ATOM 2195 CD1 ILE B 515 17.570 1.540 -9.574 1.00 0.00 C ATOM 2196 OXT ILE B 515 13.144 0.468 -7.997 1.00 0.00 O ATOM 0 H ILE B 515 14.999 -2.150 -6.389 1.00 0.00 H new ATOM 0 HA ILE B 515 14.986 0.746 -6.361 1.00 0.00 H new ATOM 0 HB ILE B 515 17.264 0.482 -7.027 1.00 0.00 H new ATOM 0 HG12 ILE B 515 15.553 0.843 -9.511 1.00 0.00 H new ATOM 0 HG13 ILE B 515 15.919 2.091 -8.337 1.00 0.00 H new ATOM 0 HG21 ILE B 515 17.975 -0.964 -8.890 1.00 0.00 H new ATOM 0 HG22 ILE B 515 17.254 -1.898 -7.558 1.00 0.00 H new ATOM 0 HG23 ILE B 515 16.313 -1.583 -9.036 1.00 0.00 H new ATOM 0 HD11 ILE B 515 17.343 2.306 -10.316 1.00 0.00 H new ATOM 0 HD12 ILE B 515 18.323 1.917 -8.882 1.00 0.00 H new ATOM 0 HD13 ILE B 515 17.951 0.650 -10.075 1.00 0.00 H new TER 2208 ILE B 515