USER MOD reduce.3.24.130724 H: found=0, std=0, add=1594, rem=0, adj=51 USER MOD reduce.3.24.130724 removed 1586 hydrogens (0 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 Set 1.1: A 74 GLN :FLIP amide:sc= -2.42 F(o=-11!,f=-4.9) USER MOD Set 1.2: B 74 GLN :FLIP amide:sc= -2.43 F(o=-10!,f=-4.9) USER MOD Single : A 1 SER N :NH3+ -142:sc= 0.441 (180deg=0.00219) USER MOD Single : A 1 SER OG : rot 180:sc= 0.152 USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 6 THR OG1 : rot -90:sc= -0.0875 USER MOD Single : A 9 CYS SG : rot -67:sc= -3.68! USER MOD Single : A 12 SER OG : rot 160:sc= -2.12 USER MOD Single : A 18 GLN :FLIP amide:sc= -2.69! C(o=-4.7!,f=-2.7!) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 TYR OH : rot -98:sc= -3.5! USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 HIS : no HE2:sc= 0 K(o=0,f=-0.69) USER MOD Single : A 27 SER OG : rot 180:sc= 0 USER MOD Single : A 29 THR OG1 : rot -140:sc= -0.362 USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 37 SER OG : rot 48:sc= 0.12 USER MOD Single : A 39 MET CE :methyl 165:sc= -6.33! (180deg=-6.9!) USER MOD Single : A 40 ASN : amide:sc= -0.0151 X(o=-0.015,f=0) USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 THR OG1 : rot -41:sc= 0.279 USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 50 GLN : amide:sc= -3.02 K(o=-3,f=-3.8!) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 MET CE :methyl 146:sc= -15.5! (180deg=-20.9!) USER MOD Single : A 60 MET CE :methyl 139:sc= -9.75! (180deg=-14.1!) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 ASN : amide:sc= -0.306 X(o=-0.31,f=-0.31) USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 70 GLN :FLIP amide:sc= -2.04 F(o=-3,f=-2) USER MOD Single : A 78 ASN : amide:sc= -2.35 X(o=-2.3,f=-1.9!) USER MOD Single : A 87 CYS SG : rot 149:sc= -0.196 USER MOD Single : A 88 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 99 LYS NZ :NH3+ 137:sc= -2.44! (180deg=-4.17!) USER MOD Single : B 1 SER N :NH3+ -135:sc= 0.416 (180deg=0.0125) USER MOD Single : B 1 SER OG : rot 180:sc= 0.185 USER MOD Single : B 4 THR OG1 : rot 180:sc= 0 USER MOD Single : B 6 THR OG1 : rot -90:sc= -0.0869 USER MOD Single : B 9 CYS SG : rot -68:sc= -3.37 USER MOD Single : B 12 SER OG : rot 160:sc= -2.2 USER MOD Single : B 18 GLN :FLIP amide:sc= -2.61! C(o=-4.4!,f=-2.6!) USER MOD Single : B 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 20 TYR OH : rot -92:sc= -3.49! USER MOD Single : B 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 26 HIS : no HE2:sc= 0 K(o=0,f=-0.7) USER MOD Single : B 27 SER OG : rot 180:sc= 0 USER MOD Single : B 29 THR OG1 : rot -140:sc= -0.388 USER MOD Single : B 31 SER OG : rot 180:sc= 0 USER MOD Single : B 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 33 THR OG1 : rot 180:sc= 0 USER MOD Single : B 37 SER OG : rot 48:sc= 0.154 USER MOD Single : B 39 MET CE :methyl 159:sc= -6.39! (180deg=-6.76!) USER MOD Single : B 40 ASN : amide:sc= -0.0142 X(o=-0.014,f=0) USER MOD Single : B 41 THR OG1 : rot 180:sc= 0 USER MOD Single : B 47 THR OG1 : rot -41:sc= 0.291 USER MOD Single : B 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 49 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 50 GLN : amide:sc= -2.92 K(o=-2.9,f=-3.8!) USER MOD Single : B 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 59 MET CE :methyl 145:sc= -14.8! (180deg=-21.3!) USER MOD Single : B 60 MET CE :methyl 146:sc= -9.75! (180deg=-13.9!) USER MOD Single : B 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 66 ASN : amide:sc= -0.378 X(o=-0.38,f=-0.38) USER MOD Single : B 67 SER OG : rot 180:sc= 0 USER MOD Single : B 70 GLN :FLIP amide:sc= -2.03 F(o=-2.6,f=-2) USER MOD Single : B 78 ASN :FLIP amide:sc= -1.9! F(o=-2.5,f=-1.9!) USER MOD Single : B 87 CYS SG : rot 150:sc= -0.177 USER MOD Single : B 88 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 90 SER OG : rot 180:sc= 0 USER MOD Single : B 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 98 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 99 LYS NZ :NH3+ 146:sc= -2.46! (180deg=-4.2!) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 12.653 -7.395 17.969 1.00 0.00 N ATOM 2 CA SER A 1 11.857 -6.499 17.090 1.00 0.00 C ATOM 3 C SER A 1 10.649 -7.227 16.510 1.00 0.00 C ATOM 4 O SER A 1 10.726 -8.408 16.172 1.00 0.00 O ATOM 5 CB SER A 1 12.761 -5.994 15.962 1.00 0.00 C ATOM 6 OG SER A 1 13.813 -6.909 15.704 1.00 0.00 O ATOM 0 H1 SER A 1 13.004 -6.857 18.787 1.00 0.00 H new ATOM 0 H2 SER A 1 12.054 -8.178 18.301 1.00 0.00 H new ATOM 0 H3 SER A 1 13.459 -7.778 17.435 1.00 0.00 H new ATOM 0 HA SER A 1 11.484 -5.660 17.678 1.00 0.00 H new ATOM 0 HB2 SER A 1 12.172 -5.848 15.057 1.00 0.00 H new ATOM 0 HB3 SER A 1 13.177 -5.023 16.232 1.00 0.00 H new ATOM 0 HG SER A 1 14.375 -6.565 14.979 1.00 0.00 H new ATOM 14 N ARG A 2 9.533 -6.512 16.395 1.00 0.00 N ATOM 15 CA ARG A 2 8.305 -7.086 15.854 1.00 0.00 C ATOM 16 C ARG A 2 7.181 -6.051 15.822 1.00 0.00 C ATOM 17 O ARG A 2 6.518 -5.880 14.802 1.00 0.00 O ATOM 18 CB ARG A 2 7.872 -8.303 16.677 1.00 0.00 C ATOM 19 CG ARG A 2 7.176 -9.375 15.854 1.00 0.00 C ATOM 20 CD ARG A 2 8.170 -10.356 15.251 1.00 0.00 C ATOM 21 NE ARG A 2 8.077 -10.401 13.792 1.00 0.00 N ATOM 22 CZ ARG A 2 8.512 -11.418 13.052 1.00 0.00 C ATOM 23 NH1 ARG A 2 9.075 -12.476 13.625 1.00 0.00 N ATOM 24 NH2 ARG A 2 8.386 -11.377 11.732 1.00 0.00 N ATOM 0 H ARG A 2 9.454 -5.533 16.670 1.00 0.00 H new ATOM 0 HA ARG A 2 8.509 -7.404 14.832 1.00 0.00 H new ATOM 0 HB2 ARG A 2 8.749 -8.737 17.158 1.00 0.00 H new ATOM 0 HB3 ARG A 2 7.202 -7.975 17.472 1.00 0.00 H new ATOM 0 HG2 ARG A 2 6.468 -9.915 16.483 1.00 0.00 H new ATOM 0 HG3 ARG A 2 6.600 -8.905 15.057 1.00 0.00 H new ATOM 0 HD2 ARG A 2 9.182 -10.072 15.541 1.00 0.00 H new ATOM 0 HD3 ARG A 2 7.989 -11.351 15.657 1.00 0.00 H new ATOM 0 HE ARG A 2 7.654 -9.606 13.313 1.00 0.00 H new ATOM 0 HH11 ARG A 2 9.176 -12.513 14.639 1.00 0.00 H new ATOM 0 HH12 ARG A 2 9.406 -13.251 13.051 1.00 0.00 H new ATOM 0 HH21 ARG A 2 7.956 -10.567 11.286 1.00 0.00 H new ATOM 0 HH22 ARG A 2 8.719 -12.156 11.163 1.00 0.00 H new ATOM 37 N PRO A 3 6.937 -5.355 16.948 1.00 0.00 N ATOM 38 CA PRO A 3 5.879 -4.341 17.060 1.00 0.00 C ATOM 39 C PRO A 3 6.245 -3.006 16.406 1.00 0.00 C ATOM 40 O PRO A 3 5.654 -1.974 16.724 1.00 0.00 O ATOM 41 CB PRO A 3 5.750 -4.145 18.580 1.00 0.00 C ATOM 42 CG PRO A 3 6.526 -5.262 19.187 1.00 0.00 C ATOM 43 CD PRO A 3 7.640 -5.500 18.224 1.00 0.00 C ATOM 0 HA PRO A 3 4.968 -4.663 16.555 1.00 0.00 H new ATOM 0 HB2 PRO A 3 6.147 -3.178 18.887 1.00 0.00 H new ATOM 0 HB3 PRO A 3 4.706 -4.175 18.893 1.00 0.00 H new ATOM 0 HG2 PRO A 3 6.903 -4.994 20.174 1.00 0.00 H new ATOM 0 HG3 PRO A 3 5.910 -6.153 19.312 1.00 0.00 H new ATOM 0 HD2 PRO A 3 8.445 -4.774 18.337 1.00 0.00 H new ATOM 0 HD3 PRO A 3 8.083 -6.489 18.341 1.00 0.00 H new ATOM 51 N THR A 4 7.224 -3.021 15.510 1.00 0.00 N ATOM 52 CA THR A 4 7.657 -1.798 14.842 1.00 0.00 C ATOM 53 C THR A 4 6.529 -1.186 14.030 1.00 0.00 C ATOM 54 O THR A 4 5.710 -1.889 13.439 1.00 0.00 O ATOM 55 CB THR A 4 8.898 -2.035 13.965 1.00 0.00 C ATOM 56 OG1 THR A 4 9.029 -1.009 12.997 1.00 0.00 O ATOM 57 CG2 THR A 4 8.904 -3.356 13.226 1.00 0.00 C ATOM 0 H THR A 4 7.731 -3.860 15.230 1.00 0.00 H new ATOM 0 HA THR A 4 7.937 -1.089 15.621 1.00 0.00 H new ATOM 0 HB THR A 4 9.730 -2.042 14.669 1.00 0.00 H new ATOM 0 HG1 THR A 4 9.825 -1.175 12.450 1.00 0.00 H new ATOM 0 HG21 THR A 4 9.815 -3.437 12.634 1.00 0.00 H new ATOM 0 HG22 THR A 4 8.864 -4.175 13.944 1.00 0.00 H new ATOM 0 HG23 THR A 4 8.037 -3.408 12.567 1.00 0.00 H new ATOM 65 N GLU A 5 6.498 0.141 14.025 1.00 0.00 N ATOM 66 CA GLU A 5 5.480 0.898 13.312 1.00 0.00 C ATOM 67 C GLU A 5 5.242 0.334 11.917 1.00 0.00 C ATOM 68 O GLU A 5 4.101 0.212 11.474 1.00 0.00 O ATOM 69 CB GLU A 5 5.909 2.358 13.228 1.00 0.00 C ATOM 70 CG GLU A 5 4.780 3.343 13.489 1.00 0.00 C ATOM 71 CD GLU A 5 5.284 4.718 13.883 1.00 0.00 C ATOM 72 OE1 GLU A 5 6.055 5.313 13.102 1.00 0.00 O ATOM 73 OE2 GLU A 5 4.908 5.197 14.973 1.00 0.00 O ATOM 0 H GLU A 5 7.178 0.721 14.515 1.00 0.00 H new ATOM 0 HA GLU A 5 4.541 0.821 13.860 1.00 0.00 H new ATOM 0 HB2 GLU A 5 6.707 2.535 13.949 1.00 0.00 H new ATOM 0 HB3 GLU A 5 6.325 2.549 12.239 1.00 0.00 H new ATOM 0 HG2 GLU A 5 4.164 3.429 12.594 1.00 0.00 H new ATOM 0 HG3 GLU A 5 4.140 2.954 14.281 1.00 0.00 H new ATOM 80 N THR A 6 6.322 -0.024 11.235 1.00 0.00 N ATOM 81 CA THR A 6 6.212 -0.591 9.900 1.00 0.00 C ATOM 82 C THR A 6 5.661 -2.009 9.980 1.00 0.00 C ATOM 83 O THR A 6 4.805 -2.398 9.194 1.00 0.00 O ATOM 84 CB THR A 6 7.568 -0.592 9.197 1.00 0.00 C ATOM 85 OG1 THR A 6 8.368 0.489 9.642 1.00 0.00 O ATOM 86 CG2 THR A 6 7.454 -0.491 7.690 1.00 0.00 C ATOM 0 H THR A 6 7.277 0.068 11.582 1.00 0.00 H new ATOM 0 HA THR A 6 5.527 0.026 9.319 1.00 0.00 H new ATOM 0 HB THR A 6 8.026 -1.548 9.451 1.00 0.00 H new ATOM 0 HG1 THR A 6 8.207 1.271 9.074 1.00 0.00 H new ATOM 0 HG21 THR A 6 8.451 -0.497 7.249 1.00 0.00 H new ATOM 0 HG22 THR A 6 6.884 -1.339 7.311 1.00 0.00 H new ATOM 0 HG23 THR A 6 6.945 0.436 7.425 1.00 0.00 H new ATOM 94 N GLU A 7 6.137 -2.775 10.952 1.00 0.00 N ATOM 95 CA GLU A 7 5.670 -4.145 11.127 1.00 0.00 C ATOM 96 C GLU A 7 4.148 -4.171 11.186 1.00 0.00 C ATOM 97 O GLU A 7 3.502 -4.986 10.527 1.00 0.00 O ATOM 98 CB GLU A 7 6.255 -4.745 12.406 1.00 0.00 C ATOM 99 CG GLU A 7 7.423 -5.687 12.154 1.00 0.00 C ATOM 100 CD GLU A 7 6.982 -7.021 11.583 1.00 0.00 C ATOM 101 OE1 GLU A 7 5.901 -7.508 11.975 1.00 0.00 O ATOM 102 OE2 GLU A 7 7.719 -7.580 10.743 1.00 0.00 O ATOM 0 H GLU A 7 6.841 -2.475 11.627 1.00 0.00 H new ATOM 0 HA GLU A 7 6.003 -4.741 10.278 1.00 0.00 H new ATOM 0 HB2 GLU A 7 6.584 -3.937 13.060 1.00 0.00 H new ATOM 0 HB3 GLU A 7 5.471 -5.285 12.937 1.00 0.00 H new ATOM 0 HG2 GLU A 7 8.124 -5.215 11.466 1.00 0.00 H new ATOM 0 HG3 GLU A 7 7.958 -5.855 13.089 1.00 0.00 H new ATOM 109 N ARG A 8 3.586 -3.257 11.964 1.00 0.00 N ATOM 110 CA ARG A 8 2.140 -3.152 12.095 1.00 0.00 C ATOM 111 C ARG A 8 1.528 -2.544 10.831 1.00 0.00 C ATOM 112 O ARG A 8 0.365 -2.790 10.513 1.00 0.00 O ATOM 113 CB ARG A 8 1.777 -2.300 13.312 1.00 0.00 C ATOM 114 CG ARG A 8 2.006 -3.007 14.639 1.00 0.00 C ATOM 115 CD ARG A 8 2.887 -2.185 15.568 1.00 0.00 C ATOM 116 NE ARG A 8 2.196 -1.000 16.070 1.00 0.00 N ATOM 117 CZ ARG A 8 2.591 -0.309 17.137 1.00 0.00 C ATOM 118 NH1 ARG A 8 3.668 -0.679 17.817 1.00 0.00 N ATOM 119 NH2 ARG A 8 1.905 0.758 17.526 1.00 0.00 N ATOM 0 H ARG A 8 4.110 -2.577 12.515 1.00 0.00 H new ATOM 0 HA ARG A 8 1.735 -4.155 12.232 1.00 0.00 H new ATOM 0 HB2 ARG A 8 2.366 -1.383 13.292 1.00 0.00 H new ATOM 0 HB3 ARG A 8 0.729 -2.008 13.241 1.00 0.00 H new ATOM 0 HG2 ARG A 8 1.047 -3.197 15.121 1.00 0.00 H new ATOM 0 HG3 ARG A 8 2.471 -3.977 14.460 1.00 0.00 H new ATOM 0 HD2 ARG A 8 3.204 -2.803 16.408 1.00 0.00 H new ATOM 0 HD3 ARG A 8 3.789 -1.881 15.037 1.00 0.00 H new ATOM 0 HE ARG A 8 1.363 -0.684 15.574 1.00 0.00 H new ATOM 0 HH11 ARG A 8 4.200 -1.498 17.523 1.00 0.00 H new ATOM 0 HH12 ARG A 8 3.964 -0.144 18.634 1.00 0.00 H new ATOM 0 HH21 ARG A 8 1.076 1.048 17.008 1.00 0.00 H new ATOM 0 HH22 ARG A 8 2.207 1.288 18.343 1.00 0.00 H new ATOM 132 N CYS A 9 2.320 -1.742 10.118 1.00 0.00 N ATOM 133 CA CYS A 9 1.857 -1.088 8.895 1.00 0.00 C ATOM 134 C CYS A 9 1.531 -2.106 7.804 1.00 0.00 C ATOM 135 O CYS A 9 0.544 -1.959 7.082 1.00 0.00 O ATOM 136 CB CYS A 9 2.907 -0.075 8.399 1.00 0.00 C ATOM 137 SG CYS A 9 4.109 -0.714 7.200 1.00 0.00 S ATOM 0 H CYS A 9 3.286 -1.530 10.367 1.00 0.00 H new ATOM 0 HA CYS A 9 0.937 -0.553 9.129 1.00 0.00 H new ATOM 0 HB2 CYS A 9 2.386 0.770 7.949 1.00 0.00 H new ATOM 0 HB3 CYS A 9 3.451 0.309 9.262 1.00 0.00 H new ATOM 0 HG CYS A 9 4.879 -1.587 7.780 1.00 0.00 H new ATOM 143 N ILE A 10 2.372 -3.127 7.676 1.00 0.00 N ATOM 144 CA ILE A 10 2.177 -4.151 6.664 1.00 0.00 C ATOM 145 C ILE A 10 1.031 -5.090 7.018 1.00 0.00 C ATOM 146 O ILE A 10 0.145 -5.330 6.203 1.00 0.00 O ATOM 147 CB ILE A 10 3.463 -4.976 6.458 1.00 0.00 C ATOM 148 CG1 ILE A 10 4.619 -4.066 6.060 1.00 0.00 C ATOM 149 CG2 ILE A 10 3.256 -6.041 5.395 1.00 0.00 C ATOM 150 CD1 ILE A 10 5.622 -3.833 7.162 1.00 0.00 C ATOM 0 H ILE A 10 3.195 -3.265 8.263 1.00 0.00 H new ATOM 0 HA ILE A 10 1.926 -3.632 5.739 1.00 0.00 H new ATOM 0 HB ILE A 10 3.704 -5.467 7.401 1.00 0.00 H new ATOM 0 HG12 ILE A 10 5.132 -4.501 5.202 1.00 0.00 H new ATOM 0 HG13 ILE A 10 4.218 -3.105 5.738 1.00 0.00 H new ATOM 0 HG21 ILE A 10 4.176 -6.611 5.267 1.00 0.00 H new ATOM 0 HG22 ILE A 10 2.454 -6.712 5.703 1.00 0.00 H new ATOM 0 HG23 ILE A 10 2.989 -5.566 4.451 1.00 0.00 H new ATOM 0 HD11 ILE A 10 6.413 -3.176 6.801 1.00 0.00 H new ATOM 0 HD12 ILE A 10 5.125 -3.369 8.014 1.00 0.00 H new ATOM 0 HD13 ILE A 10 6.053 -4.786 7.469 1.00 0.00 H new ATOM 162 N GLU A 11 1.056 -5.633 8.229 1.00 0.00 N ATOM 163 CA GLU A 11 0.021 -6.565 8.665 1.00 0.00 C ATOM 164 C GLU A 11 -1.376 -5.994 8.451 1.00 0.00 C ATOM 165 O GLU A 11 -2.338 -6.741 8.278 1.00 0.00 O ATOM 166 CB GLU A 11 0.219 -6.946 10.131 1.00 0.00 C ATOM 167 CG GLU A 11 0.213 -8.449 10.357 1.00 0.00 C ATOM 168 CD GLU A 11 -0.527 -8.848 11.618 1.00 0.00 C ATOM 169 OE1 GLU A 11 -1.756 -8.630 11.680 1.00 0.00 O ATOM 170 OE2 GLU A 11 0.122 -9.378 12.545 1.00 0.00 O ATOM 0 H GLU A 11 1.778 -5.446 8.925 1.00 0.00 H new ATOM 0 HA GLU A 11 0.112 -7.463 8.053 1.00 0.00 H new ATOM 0 HB2 GLU A 11 1.165 -6.534 10.484 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -0.570 -6.490 10.729 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -0.248 -8.939 9.500 1.00 0.00 H new ATOM 0 HG3 GLU A 11 1.241 -8.808 10.415 1.00 0.00 H new ATOM 177 N SER A 12 -1.486 -4.673 8.468 1.00 0.00 N ATOM 178 CA SER A 12 -2.773 -4.021 8.277 1.00 0.00 C ATOM 179 C SER A 12 -3.195 -4.025 6.807 1.00 0.00 C ATOM 180 O SER A 12 -4.279 -4.497 6.469 1.00 0.00 O ATOM 181 CB SER A 12 -2.712 -2.585 8.796 1.00 0.00 C ATOM 182 OG SER A 12 -3.990 -2.142 9.221 1.00 0.00 O ATOM 0 H SER A 12 -0.703 -4.035 8.611 1.00 0.00 H new ATOM 0 HA SER A 12 -3.518 -4.583 8.840 1.00 0.00 H new ATOM 0 HB2 SER A 12 -2.008 -2.524 9.626 1.00 0.00 H new ATOM 0 HB3 SER A 12 -2.338 -1.927 8.012 1.00 0.00 H new ATOM 0 HG SER A 12 -3.887 -1.379 9.827 1.00 0.00 H new ATOM 188 N LEU A 13 -2.341 -3.490 5.939 1.00 0.00 N ATOM 189 CA LEU A 13 -2.633 -3.419 4.510 1.00 0.00 C ATOM 190 C LEU A 13 -2.878 -4.799 3.899 1.00 0.00 C ATOM 191 O LEU A 13 -3.605 -4.938 2.915 1.00 0.00 O ATOM 192 CB LEU A 13 -1.499 -2.701 3.788 1.00 0.00 C ATOM 193 CG LEU A 13 -1.695 -1.192 3.662 1.00 0.00 C ATOM 194 CD1 LEU A 13 -2.944 -0.889 2.855 1.00 0.00 C ATOM 195 CD2 LEU A 13 -1.793 -0.539 5.032 1.00 0.00 C ATOM 0 H LEU A 13 -1.437 -3.097 6.202 1.00 0.00 H new ATOM 0 HA LEU A 13 -3.556 -2.853 4.386 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -0.566 -2.892 4.319 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -1.391 -3.127 2.790 1.00 0.00 H new ATOM 0 HG LEU A 13 -0.827 -0.781 3.146 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -3.071 0.190 2.773 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -2.847 -1.319 1.858 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -3.812 -1.320 3.353 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -1.932 0.536 4.914 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -2.641 -0.957 5.575 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -0.876 -0.727 5.591 1.00 0.00 H new ATOM 207 N ILE A 14 -2.286 -5.821 4.485 1.00 0.00 N ATOM 208 CA ILE A 14 -2.465 -7.174 4.005 1.00 0.00 C ATOM 209 C ILE A 14 -3.862 -7.655 4.278 1.00 0.00 C ATOM 210 O ILE A 14 -4.470 -8.362 3.479 1.00 0.00 O ATOM 211 CB ILE A 14 -1.563 -8.140 4.759 1.00 0.00 C ATOM 212 CG1 ILE A 14 -0.121 -7.699 4.709 1.00 0.00 C ATOM 213 CG2 ILE A 14 -1.733 -9.537 4.223 1.00 0.00 C ATOM 214 CD1 ILE A 14 0.665 -8.221 5.879 1.00 0.00 C ATOM 0 H ILE A 14 -1.675 -5.738 5.297 1.00 0.00 H new ATOM 0 HA ILE A 14 -2.240 -7.153 2.939 1.00 0.00 H new ATOM 0 HB ILE A 14 -1.860 -8.139 5.808 1.00 0.00 H new ATOM 0 HG12 ILE A 14 0.333 -8.048 3.782 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -0.074 -6.610 4.697 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -1.082 -10.219 4.771 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -2.770 -9.850 4.344 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -1.470 -9.555 3.165 1.00 0.00 H new ATOM 0 HD11 ILE A 14 1.698 -7.881 5.804 1.00 0.00 H new ATOM 0 HD12 ILE A 14 0.227 -7.851 6.806 1.00 0.00 H new ATOM 0 HD13 ILE A 14 0.641 -9.311 5.876 1.00 0.00 H new ATOM 226 N ALA A 15 -4.314 -7.314 5.464 1.00 0.00 N ATOM 227 CA ALA A 15 -5.591 -7.743 5.962 1.00 0.00 C ATOM 228 C ALA A 15 -6.746 -7.016 5.301 1.00 0.00 C ATOM 229 O ALA A 15 -7.775 -7.620 4.998 1.00 0.00 O ATOM 230 CB ALA A 15 -5.579 -7.580 7.460 1.00 0.00 C ATOM 0 H ALA A 15 -3.795 -6.724 6.114 1.00 0.00 H new ATOM 0 HA ALA A 15 -5.751 -8.792 5.712 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -6.538 -7.899 7.868 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -4.783 -8.190 7.886 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -5.408 -6.533 7.711 1.00 0.00 H new ATOM 236 N VAL A 16 -6.564 -5.733 5.037 1.00 0.00 N ATOM 237 CA VAL A 16 -7.584 -4.957 4.366 1.00 0.00 C ATOM 238 C VAL A 16 -7.990 -5.671 3.086 1.00 0.00 C ATOM 239 O VAL A 16 -9.150 -5.659 2.679 1.00 0.00 O ATOM 240 CB VAL A 16 -7.045 -3.568 3.992 1.00 0.00 C ATOM 241 CG1 VAL A 16 -6.535 -2.837 5.212 1.00 0.00 C ATOM 242 CG2 VAL A 16 -5.932 -3.708 2.978 1.00 0.00 C ATOM 0 H VAL A 16 -5.721 -5.211 5.278 1.00 0.00 H new ATOM 0 HA VAL A 16 -8.436 -4.847 5.037 1.00 0.00 H new ATOM 0 HB VAL A 16 -7.862 -2.988 3.562 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -6.159 -1.857 4.918 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -7.347 -2.715 5.929 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -5.730 -3.412 5.670 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -5.553 -2.720 2.716 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -5.125 -4.305 3.403 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -6.315 -4.199 2.083 1.00 0.00 H new ATOM 252 N PHE A 17 -6.987 -6.274 2.450 1.00 0.00 N ATOM 253 CA PHE A 17 -7.184 -6.983 1.193 1.00 0.00 C ATOM 254 C PHE A 17 -7.751 -8.395 1.378 1.00 0.00 C ATOM 255 O PHE A 17 -8.782 -8.725 0.795 1.00 0.00 O ATOM 256 CB PHE A 17 -5.856 -7.048 0.423 1.00 0.00 C ATOM 257 CG PHE A 17 -5.750 -8.212 -0.526 1.00 0.00 C ATOM 258 CD1 PHE A 17 -6.681 -8.387 -1.537 1.00 0.00 C ATOM 259 CD2 PHE A 17 -4.721 -9.131 -0.402 1.00 0.00 C ATOM 260 CE1 PHE A 17 -6.586 -9.458 -2.406 1.00 0.00 C ATOM 261 CE2 PHE A 17 -4.621 -10.204 -1.268 1.00 0.00 C ATOM 262 CZ PHE A 17 -5.557 -10.367 -2.272 1.00 0.00 C ATOM 0 H PHE A 17 -6.025 -6.284 2.790 1.00 0.00 H new ATOM 0 HA PHE A 17 -7.926 -6.422 0.625 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -5.729 -6.123 -0.139 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -5.036 -7.101 1.139 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -7.489 -7.679 -1.647 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -3.988 -9.008 0.381 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -7.318 -9.583 -3.190 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -3.814 -10.913 -1.160 1.00 0.00 H new ATOM 0 HZ PHE A 17 -5.483 -11.204 -2.950 1.00 0.00 H new ATOM 272 N GLN A 18 -7.059 -9.234 2.151 1.00 0.00 N ATOM 273 CA GLN A 18 -7.480 -10.621 2.352 1.00 0.00 C ATOM 274 C GLN A 18 -8.739 -10.747 3.201 1.00 0.00 C ATOM 275 O GLN A 18 -9.449 -11.746 3.105 1.00 0.00 O ATOM 276 CB GLN A 18 -6.348 -11.442 2.967 1.00 0.00 C ATOM 277 CG GLN A 18 -5.636 -10.730 4.092 1.00 0.00 C ATOM 278 CD GLN A 18 -6.116 -11.176 5.445 1.00 0.00 C ATOM 279 OE1 GLN A 18 -7.033 -10.405 6.001 1.00 0.00 O flip ATOM 280 NE2 GLN A 18 -5.674 -12.191 5.981 1.00 0.00 N flip ATOM 0 H GLN A 18 -6.206 -8.977 2.647 1.00 0.00 H new ATOM 0 HA GLN A 18 -7.723 -11.014 1.365 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -6.752 -12.383 3.340 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -5.626 -11.691 2.190 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -4.564 -10.910 4.012 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -5.787 -9.655 3.992 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -4.966 -12.751 5.507 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -6.016 -12.473 6.900 1.00 0.00 H new ATOM 289 N LYS A 19 -9.015 -9.756 4.041 1.00 0.00 N ATOM 290 CA LYS A 19 -10.196 -9.822 4.895 1.00 0.00 C ATOM 291 C LYS A 19 -11.449 -10.043 4.054 1.00 0.00 C ATOM 292 O LYS A 19 -12.210 -10.980 4.289 1.00 0.00 O ATOM 293 CB LYS A 19 -10.335 -8.538 5.715 1.00 0.00 C ATOM 294 CG LYS A 19 -11.519 -8.548 6.667 1.00 0.00 C ATOM 295 CD LYS A 19 -11.286 -9.494 7.835 1.00 0.00 C ATOM 296 CE LYS A 19 -12.021 -10.810 7.641 1.00 0.00 C ATOM 297 NZ LYS A 19 -13.407 -10.757 8.180 1.00 0.00 N ATOM 0 H LYS A 19 -8.451 -8.913 4.149 1.00 0.00 H new ATOM 0 HA LYS A 19 -10.079 -10.663 5.578 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -9.421 -8.382 6.288 1.00 0.00 H new ATOM 0 HB3 LYS A 19 -10.434 -7.692 5.035 1.00 0.00 H new ATOM 0 HG2 LYS A 19 -11.694 -7.540 7.043 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -12.418 -8.848 6.128 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -10.218 -9.685 7.943 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -11.620 -9.022 8.759 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -12.054 -11.054 6.579 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -11.470 -11.610 8.135 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -13.874 -11.674 8.028 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -13.376 -10.549 9.199 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -13.941 -10.011 7.691 1.00 0.00 H new ATOM 311 N TYR A 20 -11.629 -9.199 3.045 1.00 0.00 N ATOM 312 CA TYR A 20 -12.757 -9.330 2.135 1.00 0.00 C ATOM 313 C TYR A 20 -12.452 -10.401 1.101 1.00 0.00 C ATOM 314 O TYR A 20 -13.318 -11.177 0.697 1.00 0.00 O ATOM 315 CB TYR A 20 -13.064 -7.991 1.461 1.00 0.00 C ATOM 316 CG TYR A 20 -13.816 -7.032 2.356 1.00 0.00 C ATOM 317 CD1 TYR A 20 -13.365 -6.750 3.639 1.00 0.00 C ATOM 318 CD2 TYR A 20 -14.979 -6.412 1.919 1.00 0.00 C ATOM 319 CE1 TYR A 20 -14.052 -5.877 4.462 1.00 0.00 C ATOM 320 CE2 TYR A 20 -15.671 -5.537 2.734 1.00 0.00 C ATOM 321 CZ TYR A 20 -15.203 -5.274 4.003 1.00 0.00 C ATOM 322 OH TYR A 20 -15.891 -4.404 4.818 1.00 0.00 O ATOM 0 H TYR A 20 -11.008 -8.417 2.838 1.00 0.00 H new ATOM 0 HA TYR A 20 -13.641 -9.627 2.700 1.00 0.00 H new ATOM 0 HB2 TYR A 20 -12.129 -7.527 1.147 1.00 0.00 H new ATOM 0 HB3 TYR A 20 -13.649 -8.171 0.559 1.00 0.00 H new ATOM 0 HD1 TYR A 20 -12.462 -7.221 4.000 1.00 0.00 H new ATOM 0 HD2 TYR A 20 -15.349 -6.617 0.925 1.00 0.00 H new ATOM 0 HE1 TYR A 20 -13.689 -5.669 5.458 1.00 0.00 H new ATOM 0 HE2 TYR A 20 -16.573 -5.062 2.379 1.00 0.00 H new ATOM 0 HH TYR A 20 -16.637 -4.876 5.244 1.00 0.00 H new ATOM 332 N ALA A 21 -11.193 -10.411 0.679 1.00 0.00 N ATOM 333 CA ALA A 21 -10.696 -11.349 -0.315 1.00 0.00 C ATOM 334 C ALA A 21 -10.873 -12.796 0.135 1.00 0.00 C ATOM 335 O ALA A 21 -10.980 -13.702 -0.692 1.00 0.00 O ATOM 336 CB ALA A 21 -9.231 -11.045 -0.586 1.00 0.00 C ATOM 0 H ALA A 21 -10.484 -9.762 1.021 1.00 0.00 H new ATOM 0 HA ALA A 21 -11.275 -11.231 -1.231 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -8.846 -11.742 -1.330 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -9.134 -10.026 -0.959 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -8.661 -11.149 0.337 1.00 0.00 H new ATOM 342 N GLY A 22 -10.901 -13.009 1.445 1.00 0.00 N ATOM 343 CA GLY A 22 -11.062 -14.349 1.974 1.00 0.00 C ATOM 344 C GLY A 22 -12.477 -14.622 2.442 1.00 0.00 C ATOM 345 O GLY A 22 -13.377 -14.839 1.630 1.00 0.00 O ATOM 0 H GLY A 22 -10.815 -12.277 2.150 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -10.790 -15.074 1.207 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -10.373 -14.493 2.807 1.00 0.00 H new ATOM 349 N LYS A 23 -12.675 -14.614 3.757 1.00 0.00 N ATOM 350 CA LYS A 23 -13.991 -14.864 4.333 1.00 0.00 C ATOM 351 C LYS A 23 -14.478 -16.267 3.982 1.00 0.00 C ATOM 352 O LYS A 23 -15.374 -16.435 3.155 1.00 0.00 O ATOM 353 CB LYS A 23 -14.995 -13.821 3.839 1.00 0.00 C ATOM 354 CG LYS A 23 -16.061 -13.470 4.863 1.00 0.00 C ATOM 355 CD LYS A 23 -17.437 -13.351 4.223 1.00 0.00 C ATOM 356 CE LYS A 23 -18.144 -12.074 4.646 1.00 0.00 C ATOM 357 NZ LYS A 23 -19.570 -12.318 4.996 1.00 0.00 N ATOM 0 H LYS A 23 -11.941 -14.437 4.443 1.00 0.00 H new ATOM 0 HA LYS A 23 -13.908 -14.788 5.417 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -14.457 -12.914 3.561 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -15.479 -14.194 2.936 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -16.086 -14.234 5.640 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -15.803 -12.529 5.349 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -17.337 -13.369 3.138 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -18.044 -14.213 4.502 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -17.629 -11.641 5.503 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -18.088 -11.344 3.839 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -20.016 -11.422 5.279 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -20.068 -12.707 4.170 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -19.623 -12.995 5.784 1.00 0.00 H new ATOM 371 N ASP A 24 -13.880 -17.270 4.615 1.00 0.00 N ATOM 372 CA ASP A 24 -14.251 -18.659 4.369 1.00 0.00 C ATOM 373 C ASP A 24 -13.982 -19.043 2.917 1.00 0.00 C ATOM 374 O ASP A 24 -14.747 -19.794 2.311 1.00 0.00 O ATOM 375 CB ASP A 24 -15.728 -18.883 4.706 1.00 0.00 C ATOM 376 CG ASP A 24 -15.947 -20.129 5.540 1.00 0.00 C ATOM 377 OD1 ASP A 24 -15.252 -20.287 6.566 1.00 0.00 O ATOM 378 OD2 ASP A 24 -16.814 -20.948 5.168 1.00 0.00 O ATOM 0 H ASP A 24 -13.136 -17.147 5.302 1.00 0.00 H new ATOM 0 HA ASP A 24 -13.641 -19.293 5.013 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -16.110 -18.016 5.245 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -16.301 -18.962 3.782 1.00 0.00 H new ATOM 383 N GLY A 25 -12.889 -18.524 2.365 1.00 0.00 N ATOM 384 CA GLY A 25 -12.537 -18.823 0.990 1.00 0.00 C ATOM 385 C GLY A 25 -11.136 -18.366 0.636 1.00 0.00 C ATOM 386 O GLY A 25 -10.895 -17.174 0.442 1.00 0.00 O ATOM 0 H GLY A 25 -12.241 -17.901 2.847 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -12.618 -19.897 0.823 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -13.252 -18.342 0.323 1.00 0.00 H new ATOM 390 N HIS A 26 -10.209 -19.315 0.554 1.00 0.00 N ATOM 391 CA HIS A 26 -8.823 -19.004 0.222 1.00 0.00 C ATOM 392 C HIS A 26 -8.692 -18.594 -1.241 1.00 0.00 C ATOM 393 O HIS A 26 -9.323 -19.181 -2.120 1.00 0.00 O ATOM 394 CB HIS A 26 -7.928 -20.211 0.507 1.00 0.00 C ATOM 395 CG HIS A 26 -6.535 -19.841 0.914 1.00 0.00 C ATOM 396 ND1 HIS A 26 -6.159 -19.656 2.228 1.00 0.00 N ATOM 397 CD2 HIS A 26 -5.423 -19.623 0.171 1.00 0.00 C ATOM 398 CE1 HIS A 26 -4.877 -19.339 2.276 1.00 0.00 C ATOM 399 NE2 HIS A 26 -4.407 -19.313 1.043 1.00 0.00 N ATOM 0 H HIS A 26 -10.392 -20.306 0.713 1.00 0.00 H new ATOM 0 HA HIS A 26 -8.505 -18.167 0.844 1.00 0.00 H new ATOM 0 HB2 HIS A 26 -8.381 -20.811 1.296 1.00 0.00 H new ATOM 0 HB3 HIS A 26 -7.883 -20.838 -0.384 1.00 0.00 H new ATOM 0 HD1 HIS A 26 -6.774 -19.749 3.036 1.00 0.00 H new ATOM 0 HD2 HIS A 26 -5.349 -19.682 -0.905 1.00 0.00 H new ATOM 0 HE1 HIS A 26 -4.310 -19.136 3.172 1.00 0.00 H new ATOM 408 N SER A 27 -7.868 -17.582 -1.496 1.00 0.00 N ATOM 409 CA SER A 27 -7.654 -17.093 -2.854 1.00 0.00 C ATOM 410 C SER A 27 -6.588 -16.003 -2.880 1.00 0.00 C ATOM 411 O SER A 27 -6.217 -15.460 -1.840 1.00 0.00 O ATOM 412 CB SER A 27 -8.963 -16.558 -3.438 1.00 0.00 C ATOM 413 OG SER A 27 -9.594 -15.661 -2.539 1.00 0.00 O ATOM 0 H SER A 27 -7.338 -17.085 -0.780 1.00 0.00 H new ATOM 0 HA SER A 27 -7.307 -17.928 -3.463 1.00 0.00 H new ATOM 0 HB2 SER A 27 -8.763 -16.051 -4.382 1.00 0.00 H new ATOM 0 HB3 SER A 27 -9.633 -17.389 -3.658 1.00 0.00 H new ATOM 0 HG SER A 27 -10.427 -15.332 -2.936 1.00 0.00 H new ATOM 419 N VAL A 28 -6.097 -15.690 -4.075 1.00 0.00 N ATOM 420 CA VAL A 28 -5.073 -14.665 -4.238 1.00 0.00 C ATOM 421 C VAL A 28 -5.654 -13.403 -4.868 1.00 0.00 C ATOM 422 O VAL A 28 -4.969 -12.690 -5.601 1.00 0.00 O ATOM 423 CB VAL A 28 -3.907 -15.170 -5.108 1.00 0.00 C ATOM 424 CG1 VAL A 28 -3.152 -16.281 -4.397 1.00 0.00 C ATOM 425 CG2 VAL A 28 -4.417 -15.643 -6.461 1.00 0.00 C ATOM 0 H VAL A 28 -6.392 -16.132 -4.945 1.00 0.00 H new ATOM 0 HA VAL A 28 -4.698 -14.431 -3.242 1.00 0.00 H new ATOM 0 HB VAL A 28 -3.217 -14.343 -5.274 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -2.332 -16.625 -5.027 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -2.753 -15.905 -3.455 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -3.829 -17.111 -4.198 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -3.579 -15.996 -7.062 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -5.129 -16.456 -6.318 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -4.909 -14.816 -6.974 1.00 0.00 H new ATOM 435 N THR A 29 -6.922 -13.135 -4.574 1.00 0.00 N ATOM 436 CA THR A 29 -7.601 -11.961 -5.111 1.00 0.00 C ATOM 437 C THR A 29 -8.756 -11.544 -4.209 1.00 0.00 C ATOM 438 O THR A 29 -8.996 -12.151 -3.165 1.00 0.00 O ATOM 439 CB THR A 29 -8.120 -12.244 -6.521 1.00 0.00 C ATOM 440 OG1 THR A 29 -8.804 -13.485 -6.564 1.00 0.00 O ATOM 441 CG2 THR A 29 -7.025 -12.287 -7.564 1.00 0.00 C ATOM 0 H THR A 29 -7.501 -13.715 -3.966 1.00 0.00 H new ATOM 0 HA THR A 29 -6.880 -11.144 -5.154 1.00 0.00 H new ATOM 0 HB THR A 29 -8.789 -11.416 -6.754 1.00 0.00 H new ATOM 0 HG1 THR A 29 -8.582 -13.952 -7.396 1.00 0.00 H new ATOM 0 HG21 THR A 29 -7.461 -12.492 -8.542 1.00 0.00 H new ATOM 0 HG22 THR A 29 -6.510 -11.327 -7.591 1.00 0.00 H new ATOM 0 HG23 THR A 29 -6.314 -13.073 -7.312 1.00 0.00 H new ATOM 449 N LEU A 30 -9.467 -10.503 -4.622 1.00 0.00 N ATOM 450 CA LEU A 30 -10.598 -9.995 -3.860 1.00 0.00 C ATOM 451 C LEU A 30 -11.769 -9.674 -4.803 1.00 0.00 C ATOM 452 O LEU A 30 -12.209 -10.539 -5.559 1.00 0.00 O ATOM 453 CB LEU A 30 -10.161 -8.760 -3.054 1.00 0.00 C ATOM 454 CG LEU A 30 -10.958 -8.470 -1.775 1.00 0.00 C ATOM 455 CD1 LEU A 30 -10.940 -6.982 -1.469 1.00 0.00 C ATOM 456 CD2 LEU A 30 -12.392 -8.973 -1.886 1.00 0.00 C ATOM 0 H LEU A 30 -9.278 -9.993 -5.485 1.00 0.00 H new ATOM 0 HA LEU A 30 -10.941 -10.754 -3.158 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -9.112 -8.880 -2.784 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -10.225 -7.887 -3.703 1.00 0.00 H new ATOM 0 HG LEU A 30 -10.481 -9.006 -0.955 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -11.509 -6.791 -0.559 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -9.911 -6.652 -1.329 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -11.387 -6.434 -2.299 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -12.928 -8.751 -0.963 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -12.888 -8.478 -2.721 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -12.388 -10.050 -2.053 1.00 0.00 H new ATOM 468 N SER A 31 -12.259 -8.434 -4.771 1.00 0.00 N ATOM 469 CA SER A 31 -13.355 -8.024 -5.636 1.00 0.00 C ATOM 470 C SER A 31 -13.636 -6.538 -5.464 1.00 0.00 C ATOM 471 O SER A 31 -13.770 -6.051 -4.341 1.00 0.00 O ATOM 472 CB SER A 31 -14.612 -8.838 -5.332 1.00 0.00 C ATOM 473 OG SER A 31 -15.773 -8.190 -5.822 1.00 0.00 O ATOM 0 H SER A 31 -11.911 -7.700 -4.154 1.00 0.00 H new ATOM 0 HA SER A 31 -13.065 -8.209 -6.670 1.00 0.00 H new ATOM 0 HB2 SER A 31 -14.526 -9.827 -5.783 1.00 0.00 H new ATOM 0 HB3 SER A 31 -14.701 -8.986 -4.256 1.00 0.00 H new ATOM 0 HG SER A 31 -16.562 -8.733 -5.615 1.00 0.00 H new ATOM 479 N LYS A 32 -13.719 -5.819 -6.578 1.00 0.00 N ATOM 480 CA LYS A 32 -13.980 -4.385 -6.536 1.00 0.00 C ATOM 481 C LYS A 32 -15.179 -4.087 -5.642 1.00 0.00 C ATOM 482 O LYS A 32 -15.167 -3.135 -4.861 1.00 0.00 O ATOM 483 CB LYS A 32 -14.232 -3.848 -7.947 1.00 0.00 C ATOM 484 CG LYS A 32 -15.121 -4.745 -8.795 1.00 0.00 C ATOM 485 CD LYS A 32 -15.571 -4.043 -10.065 1.00 0.00 C ATOM 486 CE LYS A 32 -17.001 -4.410 -10.428 1.00 0.00 C ATOM 487 NZ LYS A 32 -17.970 -3.364 -10.000 1.00 0.00 N ATOM 0 H LYS A 32 -13.610 -6.203 -7.517 1.00 0.00 H new ATOM 0 HA LYS A 32 -13.103 -3.888 -6.122 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -14.691 -2.862 -7.874 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -13.275 -3.718 -8.453 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -14.580 -5.655 -9.053 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -15.994 -5.046 -8.216 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -15.494 -2.964 -9.932 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -14.906 -4.312 -10.886 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -17.076 -4.555 -11.506 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -17.262 -5.359 -9.960 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -18.933 -3.653 -10.266 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -17.917 -3.243 -8.968 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -17.737 -2.464 -10.466 1.00 0.00 H new ATOM 501 N THR A 33 -16.207 -4.921 -5.759 1.00 0.00 N ATOM 502 CA THR A 33 -17.415 -4.774 -4.962 1.00 0.00 C ATOM 503 C THR A 33 -17.092 -4.920 -3.480 1.00 0.00 C ATOM 504 O THR A 33 -17.472 -4.082 -2.664 1.00 0.00 O ATOM 505 CB THR A 33 -18.454 -5.816 -5.391 1.00 0.00 C ATOM 506 OG1 THR A 33 -19.350 -5.266 -6.342 1.00 0.00 O ATOM 507 CG2 THR A 33 -19.280 -6.357 -4.245 1.00 0.00 C ATOM 0 H THR A 33 -16.225 -5.711 -6.404 1.00 0.00 H new ATOM 0 HA THR A 33 -17.829 -3.779 -5.126 1.00 0.00 H new ATOM 0 HB THR A 33 -17.876 -6.637 -5.815 1.00 0.00 H new ATOM 0 HG1 THR A 33 -20.005 -5.946 -6.606 1.00 0.00 H new ATOM 0 HG21 THR A 33 -19.993 -7.089 -4.624 1.00 0.00 H new ATOM 0 HG22 THR A 33 -18.624 -6.834 -3.517 1.00 0.00 H new ATOM 0 HG23 THR A 33 -19.819 -5.539 -3.767 1.00 0.00 H new ATOM 515 N GLU A 34 -16.381 -5.990 -3.134 1.00 0.00 N ATOM 516 CA GLU A 34 -16.008 -6.223 -1.747 1.00 0.00 C ATOM 517 C GLU A 34 -15.212 -5.037 -1.229 1.00 0.00 C ATOM 518 O GLU A 34 -15.366 -4.618 -0.082 1.00 0.00 O ATOM 519 CB GLU A 34 -15.202 -7.514 -1.612 1.00 0.00 C ATOM 520 CG GLU A 34 -15.935 -8.587 -0.829 1.00 0.00 C ATOM 521 CD GLU A 34 -15.497 -9.990 -1.204 1.00 0.00 C ATOM 522 OE1 GLU A 34 -14.941 -10.163 -2.309 1.00 0.00 O ATOM 523 OE2 GLU A 34 -15.710 -10.914 -0.392 1.00 0.00 O ATOM 0 H GLU A 34 -16.056 -6.701 -3.789 1.00 0.00 H new ATOM 0 HA GLU A 34 -16.914 -6.332 -1.150 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -14.965 -7.894 -2.606 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -14.254 -7.295 -1.120 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -15.767 -8.431 0.237 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -17.007 -8.488 -1.001 1.00 0.00 H new ATOM 530 N PHE A 35 -14.383 -4.480 -2.100 1.00 0.00 N ATOM 531 CA PHE A 35 -13.587 -3.317 -1.752 1.00 0.00 C ATOM 532 C PHE A 35 -14.488 -2.091 -1.692 1.00 0.00 C ATOM 533 O PHE A 35 -14.256 -1.169 -0.911 1.00 0.00 O ATOM 534 CB PHE A 35 -12.470 -3.104 -2.777 1.00 0.00 C ATOM 535 CG PHE A 35 -11.306 -2.298 -2.264 1.00 0.00 C ATOM 536 CD1 PHE A 35 -11.359 -1.658 -1.032 1.00 0.00 C ATOM 537 CD2 PHE A 35 -10.153 -2.179 -3.022 1.00 0.00 C ATOM 538 CE1 PHE A 35 -10.288 -0.919 -0.571 1.00 0.00 C ATOM 539 CE2 PHE A 35 -9.079 -1.440 -2.564 1.00 0.00 C ATOM 540 CZ PHE A 35 -9.146 -0.811 -1.338 1.00 0.00 C ATOM 0 H PHE A 35 -14.246 -4.817 -3.053 1.00 0.00 H new ATOM 0 HA PHE A 35 -13.127 -3.477 -0.777 1.00 0.00 H new ATOM 0 HB2 PHE A 35 -12.106 -4.077 -3.108 1.00 0.00 H new ATOM 0 HB3 PHE A 35 -12.886 -2.604 -3.652 1.00 0.00 H new ATOM 0 HD1 PHE A 35 -12.250 -1.740 -0.427 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -10.093 -2.670 -3.982 1.00 0.00 H new ATOM 0 HE1 PHE A 35 -10.344 -0.426 0.388 1.00 0.00 H new ATOM 0 HE2 PHE A 35 -8.187 -1.355 -3.166 1.00 0.00 H new ATOM 0 HZ PHE A 35 -8.306 -0.235 -0.979 1.00 0.00 H new ATOM 550 N LEU A 36 -15.534 -2.100 -2.515 1.00 0.00 N ATOM 551 CA LEU A 36 -16.488 -1.005 -2.551 1.00 0.00 C ATOM 552 C LEU A 36 -17.117 -0.813 -1.185 1.00 0.00 C ATOM 553 O LEU A 36 -17.016 0.252 -0.575 1.00 0.00 O ATOM 554 CB LEU A 36 -17.580 -1.328 -3.561 1.00 0.00 C ATOM 555 CG LEU A 36 -17.574 -0.470 -4.814 1.00 0.00 C ATOM 556 CD1 LEU A 36 -17.500 -1.354 -6.043 1.00 0.00 C ATOM 557 CD2 LEU A 36 -18.807 0.416 -4.846 1.00 0.00 C ATOM 0 H LEU A 36 -15.739 -2.858 -3.166 1.00 0.00 H new ATOM 0 HA LEU A 36 -15.969 -0.090 -2.837 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -17.484 -2.373 -3.855 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -18.548 -1.222 -3.072 1.00 0.00 H new ATOM 0 HG LEU A 36 -16.696 0.176 -4.806 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -17.496 -0.733 -6.938 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -16.587 -1.948 -6.009 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -18.364 -2.018 -6.066 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -18.793 1.027 -5.749 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -19.702 -0.206 -4.843 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -18.812 1.064 -3.969 1.00 0.00 H new ATOM 569 N SER A 37 -17.765 -1.867 -0.715 1.00 0.00 N ATOM 570 CA SER A 37 -18.419 -1.846 0.585 1.00 0.00 C ATOM 571 C SER A 37 -17.402 -1.596 1.696 1.00 0.00 C ATOM 572 O SER A 37 -17.740 -1.062 2.752 1.00 0.00 O ATOM 573 CB SER A 37 -19.154 -3.163 0.833 1.00 0.00 C ATOM 574 OG SER A 37 -18.554 -4.227 0.113 1.00 0.00 O ATOM 0 H SER A 37 -17.853 -2.751 -1.216 1.00 0.00 H new ATOM 0 HA SER A 37 -19.144 -1.032 0.589 1.00 0.00 H new ATOM 0 HB2 SER A 37 -19.147 -3.392 1.899 1.00 0.00 H new ATOM 0 HB3 SER A 37 -20.198 -3.062 0.536 1.00 0.00 H new ATOM 0 HG SER A 37 -17.583 -4.206 0.246 1.00 0.00 H new ATOM 580 N PHE A 38 -16.153 -1.984 1.447 1.00 0.00 N ATOM 581 CA PHE A 38 -15.083 -1.800 2.423 1.00 0.00 C ATOM 582 C PHE A 38 -14.935 -0.328 2.791 1.00 0.00 C ATOM 583 O PHE A 38 -14.766 0.018 3.960 1.00 0.00 O ATOM 584 CB PHE A 38 -13.760 -2.332 1.866 1.00 0.00 C ATOM 585 CG PHE A 38 -12.746 -2.660 2.925 1.00 0.00 C ATOM 586 CD1 PHE A 38 -12.279 -1.680 3.787 1.00 0.00 C ATOM 587 CD2 PHE A 38 -12.257 -3.950 3.057 1.00 0.00 C ATOM 588 CE1 PHE A 38 -11.346 -1.980 4.760 1.00 0.00 C ATOM 589 CE2 PHE A 38 -11.323 -4.256 4.028 1.00 0.00 C ATOM 590 CZ PHE A 38 -10.867 -3.270 4.881 1.00 0.00 C ATOM 0 H PHE A 38 -15.858 -2.428 0.577 1.00 0.00 H new ATOM 0 HA PHE A 38 -15.343 -2.359 3.322 1.00 0.00 H new ATOM 0 HB2 PHE A 38 -13.958 -3.227 1.276 1.00 0.00 H new ATOM 0 HB3 PHE A 38 -13.337 -1.590 1.188 1.00 0.00 H new ATOM 0 HD1 PHE A 38 -12.649 -0.670 3.697 1.00 0.00 H new ATOM 0 HD2 PHE A 38 -12.610 -4.725 2.393 1.00 0.00 H new ATOM 0 HE1 PHE A 38 -10.991 -1.207 5.426 1.00 0.00 H new ATOM 0 HE2 PHE A 38 -10.950 -5.265 4.120 1.00 0.00 H new ATOM 0 HZ PHE A 38 -10.137 -3.507 5.641 1.00 0.00 H new ATOM 600 N MET A 39 -15.003 0.537 1.786 1.00 0.00 N ATOM 601 CA MET A 39 -14.882 1.972 2.007 1.00 0.00 C ATOM 602 C MET A 39 -16.102 2.498 2.750 1.00 0.00 C ATOM 603 O MET A 39 -16.003 3.407 3.570 1.00 0.00 O ATOM 604 CB MET A 39 -14.723 2.707 0.673 1.00 0.00 C ATOM 605 CG MET A 39 -13.808 1.992 -0.311 1.00 0.00 C ATOM 606 SD MET A 39 -12.661 3.113 -1.138 1.00 0.00 S ATOM 607 CE MET A 39 -11.718 3.720 0.258 1.00 0.00 C ATOM 0 H MET A 39 -15.141 0.270 0.811 1.00 0.00 H new ATOM 0 HA MET A 39 -13.995 2.153 2.614 1.00 0.00 H new ATOM 0 HB2 MET A 39 -15.705 2.833 0.218 1.00 0.00 H new ATOM 0 HB3 MET A 39 -14.329 3.706 0.863 1.00 0.00 H new ATOM 0 HG2 MET A 39 -13.242 1.225 0.217 1.00 0.00 H new ATOM 0 HG3 MET A 39 -14.414 1.482 -1.060 1.00 0.00 H new ATOM 0 HE1 MET A 39 -10.811 4.207 -0.100 1.00 0.00 H new ATOM 0 HE2 MET A 39 -12.318 4.437 0.818 1.00 0.00 H new ATOM 0 HE3 MET A 39 -11.450 2.886 0.906 1.00 0.00 H new ATOM 617 N ASN A 40 -17.253 1.919 2.451 1.00 0.00 N ATOM 618 CA ASN A 40 -18.502 2.322 3.082 1.00 0.00 C ATOM 619 C ASN A 40 -18.589 1.842 4.532 1.00 0.00 C ATOM 620 O ASN A 40 -19.403 2.347 5.306 1.00 0.00 O ATOM 621 CB ASN A 40 -19.690 1.780 2.284 1.00 0.00 C ATOM 622 CG ASN A 40 -19.885 2.510 0.969 1.00 0.00 C ATOM 623 OD1 ASN A 40 -20.372 3.641 0.941 1.00 0.00 O ATOM 624 ND2 ASN A 40 -19.505 1.868 -0.130 1.00 0.00 N ATOM 0 H ASN A 40 -17.350 1.164 1.772 1.00 0.00 H new ATOM 0 HA ASN A 40 -18.530 3.412 3.090 1.00 0.00 H new ATOM 0 HB2 ASN A 40 -19.539 0.719 2.088 1.00 0.00 H new ATOM 0 HB3 ASN A 40 -20.597 1.867 2.883 1.00 0.00 H new ATOM 0 HD21 ASN A 40 -19.612 2.311 -1.042 1.00 0.00 H new ATOM 0 HD22 ASN A 40 -19.106 0.932 -0.062 1.00 0.00 H new ATOM 631 N THR A 41 -17.781 0.843 4.892 1.00 0.00 N ATOM 632 CA THR A 41 -17.823 0.290 6.246 1.00 0.00 C ATOM 633 C THR A 41 -16.586 0.610 7.083 1.00 0.00 C ATOM 634 O THR A 41 -16.693 0.795 8.296 1.00 0.00 O ATOM 635 CB THR A 41 -17.994 -1.229 6.187 1.00 0.00 C ATOM 636 OG1 THR A 41 -17.985 -1.787 7.489 1.00 0.00 O ATOM 637 CG2 THR A 41 -16.922 -1.929 5.382 1.00 0.00 C ATOM 0 H THR A 41 -17.098 0.405 4.274 1.00 0.00 H new ATOM 0 HA THR A 41 -18.674 0.765 6.733 1.00 0.00 H new ATOM 0 HB THR A 41 -18.953 -1.387 5.694 1.00 0.00 H new ATOM 0 HG1 THR A 41 -18.097 -2.759 7.429 1.00 0.00 H new ATOM 0 HG21 THR A 41 -17.108 -3.003 5.384 1.00 0.00 H new ATOM 0 HG22 THR A 41 -16.938 -1.560 4.356 1.00 0.00 H new ATOM 0 HG23 THR A 41 -15.946 -1.729 5.824 1.00 0.00 H new ATOM 645 N GLU A 42 -15.408 0.617 6.467 1.00 0.00 N ATOM 646 CA GLU A 42 -14.178 0.850 7.225 1.00 0.00 C ATOM 647 C GLU A 42 -13.302 1.957 6.635 1.00 0.00 C ATOM 648 O GLU A 42 -12.546 2.603 7.360 1.00 0.00 O ATOM 649 CB GLU A 42 -13.383 -0.455 7.313 1.00 0.00 C ATOM 650 CG GLU A 42 -14.256 -1.696 7.482 1.00 0.00 C ATOM 651 CD GLU A 42 -14.292 -2.191 8.915 1.00 0.00 C ATOM 652 OE1 GLU A 42 -14.459 -1.356 9.827 1.00 0.00 O ATOM 653 OE2 GLU A 42 -14.150 -3.415 9.124 1.00 0.00 O ATOM 0 H GLU A 42 -15.276 0.468 5.467 1.00 0.00 H new ATOM 0 HA GLU A 42 -14.473 1.188 8.218 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -12.782 -0.565 6.411 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -12.690 -0.392 8.152 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -15.270 -1.470 7.154 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -13.882 -2.490 6.836 1.00 0.00 H new ATOM 660 N LEU A 43 -13.403 2.179 5.333 1.00 0.00 N ATOM 661 CA LEU A 43 -12.614 3.212 4.677 1.00 0.00 C ATOM 662 C LEU A 43 -13.527 4.329 4.200 1.00 0.00 C ATOM 663 O LEU A 43 -13.408 4.823 3.079 1.00 0.00 O ATOM 664 CB LEU A 43 -11.818 2.621 3.508 1.00 0.00 C ATOM 665 CG LEU A 43 -10.325 2.413 3.777 1.00 0.00 C ATOM 666 CD1 LEU A 43 -9.608 1.988 2.504 1.00 0.00 C ATOM 667 CD2 LEU A 43 -9.706 3.682 4.347 1.00 0.00 C ATOM 0 H LEU A 43 -14.022 1.659 4.711 1.00 0.00 H new ATOM 0 HA LEU A 43 -11.902 3.623 5.392 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -12.259 1.662 3.236 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -11.928 3.278 2.645 1.00 0.00 H new ATOM 0 HG LEU A 43 -10.213 1.617 4.513 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -8.548 1.845 2.714 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -10.035 1.054 2.140 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -9.726 2.761 1.745 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -8.645 3.517 4.533 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -9.828 4.498 3.635 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -10.202 3.940 5.283 1.00 0.00 H new ATOM 679 N ALA A 44 -14.447 4.712 5.074 1.00 0.00 N ATOM 680 CA ALA A 44 -15.406 5.761 4.775 1.00 0.00 C ATOM 681 C ALA A 44 -14.770 7.136 4.921 1.00 0.00 C ATOM 682 O ALA A 44 -15.198 8.098 4.286 1.00 0.00 O ATOM 683 CB ALA A 44 -16.614 5.617 5.684 1.00 0.00 C ATOM 0 H ALA A 44 -14.548 4.306 6.004 1.00 0.00 H new ATOM 0 HA ALA A 44 -15.731 5.662 3.739 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -17.334 6.404 5.460 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -17.078 4.644 5.521 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -16.299 5.699 6.724 1.00 0.00 H new ATOM 689 N ALA A 45 -13.735 7.218 5.749 1.00 0.00 N ATOM 690 CA ALA A 45 -13.029 8.472 5.962 1.00 0.00 C ATOM 691 C ALA A 45 -12.414 8.967 4.654 1.00 0.00 C ATOM 692 O ALA A 45 -12.159 10.159 4.486 1.00 0.00 O ATOM 693 CB ALA A 45 -11.957 8.294 7.026 1.00 0.00 C ATOM 0 H ALA A 45 -13.368 6.430 6.283 1.00 0.00 H new ATOM 0 HA ALA A 45 -13.741 9.221 6.309 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -11.435 9.239 7.178 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -12.421 7.982 7.961 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -11.246 7.534 6.702 1.00 0.00 H new ATOM 699 N PHE A 46 -12.185 8.036 3.729 1.00 0.00 N ATOM 700 CA PHE A 46 -11.606 8.365 2.432 1.00 0.00 C ATOM 701 C PHE A 46 -12.695 8.785 1.451 1.00 0.00 C ATOM 702 O PHE A 46 -12.466 9.616 0.574 1.00 0.00 O ATOM 703 CB PHE A 46 -10.838 7.161 1.877 1.00 0.00 C ATOM 704 CG PHE A 46 -9.533 6.907 2.577 1.00 0.00 C ATOM 705 CD1 PHE A 46 -9.486 6.777 3.956 1.00 0.00 C ATOM 706 CD2 PHE A 46 -8.355 6.800 1.856 1.00 0.00 C ATOM 707 CE1 PHE A 46 -8.287 6.542 4.602 1.00 0.00 C ATOM 708 CE2 PHE A 46 -7.154 6.565 2.497 1.00 0.00 C ATOM 709 CZ PHE A 46 -7.121 6.437 3.873 1.00 0.00 C ATOM 0 H PHE A 46 -12.393 7.046 3.857 1.00 0.00 H new ATOM 0 HA PHE A 46 -10.915 9.198 2.563 1.00 0.00 H new ATOM 0 HB2 PHE A 46 -11.464 6.272 1.959 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -10.647 7.320 0.816 1.00 0.00 H new ATOM 0 HD1 PHE A 46 -10.396 6.860 4.532 1.00 0.00 H new ATOM 0 HD2 PHE A 46 -8.376 6.901 0.781 1.00 0.00 H new ATOM 0 HE1 PHE A 46 -8.263 6.441 5.677 1.00 0.00 H new ATOM 0 HE2 PHE A 46 -6.242 6.481 1.924 1.00 0.00 H new ATOM 0 HZ PHE A 46 -6.183 6.255 4.377 1.00 0.00 H new ATOM 719 N THR A 47 -13.879 8.200 1.605 1.00 0.00 N ATOM 720 CA THR A 47 -15.008 8.505 0.732 1.00 0.00 C ATOM 721 C THR A 47 -15.779 9.723 1.233 1.00 0.00 C ATOM 722 O THR A 47 -16.307 10.505 0.443 1.00 0.00 O ATOM 723 CB THR A 47 -15.946 7.300 0.638 1.00 0.00 C ATOM 724 OG1 THR A 47 -16.752 7.201 1.799 1.00 0.00 O ATOM 725 CG2 THR A 47 -15.218 5.984 0.472 1.00 0.00 C ATOM 0 H THR A 47 -14.082 7.510 2.328 1.00 0.00 H new ATOM 0 HA THR A 47 -14.613 8.732 -0.258 1.00 0.00 H new ATOM 0 HB THR A 47 -16.552 7.475 -0.251 1.00 0.00 H new ATOM 0 HG1 THR A 47 -16.210 7.398 2.591 1.00 0.00 H new ATOM 0 HG21 THR A 47 -15.943 5.172 0.412 1.00 0.00 H new ATOM 0 HG22 THR A 47 -14.625 6.009 -0.442 1.00 0.00 H new ATOM 0 HG23 THR A 47 -14.561 5.821 1.326 1.00 0.00 H new ATOM 733 N LYS A 48 -15.843 9.878 2.551 1.00 0.00 N ATOM 734 CA LYS A 48 -16.553 11.001 3.155 1.00 0.00 C ATOM 735 C LYS A 48 -15.972 12.329 2.681 1.00 0.00 C ATOM 736 O LYS A 48 -16.536 12.987 1.808 1.00 0.00 O ATOM 737 CB LYS A 48 -16.488 10.913 4.681 1.00 0.00 C ATOM 738 CG LYS A 48 -17.563 10.026 5.287 1.00 0.00 C ATOM 739 CD LYS A 48 -17.536 10.076 6.805 1.00 0.00 C ATOM 740 CE LYS A 48 -17.916 11.454 7.325 1.00 0.00 C ATOM 741 NZ LYS A 48 -18.110 11.458 8.800 1.00 0.00 N ATOM 0 H LYS A 48 -15.412 9.241 3.221 1.00 0.00 H new ATOM 0 HA LYS A 48 -17.596 10.951 2.842 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -15.509 10.534 4.973 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -16.579 11.916 5.098 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -18.542 10.343 4.929 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -17.419 8.998 4.953 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -18.224 9.332 7.207 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -16.540 9.814 7.161 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -17.137 12.169 7.060 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -18.833 11.785 6.838 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -18.368 12.415 9.114 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -18.870 10.795 9.052 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -17.228 11.167 9.267 1.00 0.00 H new ATOM 755 N ASN A 49 -14.840 12.715 3.261 1.00 0.00 N ATOM 756 CA ASN A 49 -14.180 13.962 2.892 1.00 0.00 C ATOM 757 C ASN A 49 -13.257 13.747 1.695 1.00 0.00 C ATOM 758 O ASN A 49 -12.063 14.039 1.754 1.00 0.00 O ATOM 759 CB ASN A 49 -13.392 14.516 4.084 1.00 0.00 C ATOM 760 CG ASN A 49 -14.033 15.757 4.674 1.00 0.00 C ATOM 761 OD1 ASN A 49 -14.791 15.679 5.640 1.00 0.00 O ATOM 762 ND2 ASN A 49 -13.729 16.913 4.094 1.00 0.00 N ATOM 0 H ASN A 49 -14.361 12.183 3.988 1.00 0.00 H new ATOM 0 HA ASN A 49 -14.942 14.688 2.610 1.00 0.00 H new ATOM 0 HB2 ASN A 49 -13.316 13.748 4.854 1.00 0.00 H new ATOM 0 HB3 ASN A 49 -12.376 14.751 3.767 1.00 0.00 H new ATOM 0 HD21 ASN A 49 -14.129 17.782 4.448 1.00 0.00 H new ATOM 0 HD22 ASN A 49 -13.096 16.932 3.295 1.00 0.00 H new ATOM 769 N GLN A 50 -13.823 13.231 0.608 1.00 0.00 N ATOM 770 CA GLN A 50 -13.055 12.971 -0.603 1.00 0.00 C ATOM 771 C GLN A 50 -12.429 14.252 -1.140 1.00 0.00 C ATOM 772 O GLN A 50 -11.233 14.296 -1.429 1.00 0.00 O ATOM 773 CB GLN A 50 -13.950 12.348 -1.677 1.00 0.00 C ATOM 774 CG GLN A 50 -14.323 10.902 -1.397 1.00 0.00 C ATOM 775 CD GLN A 50 -13.514 9.918 -2.219 1.00 0.00 C ATOM 776 OE1 GLN A 50 -14.050 9.232 -3.089 1.00 0.00 O ATOM 777 NE2 GLN A 50 -12.216 9.844 -1.946 1.00 0.00 N ATOM 0 H GLN A 50 -14.811 12.985 0.542 1.00 0.00 H new ATOM 0 HA GLN A 50 -12.257 12.274 -0.349 1.00 0.00 H new ATOM 0 HB2 GLN A 50 -14.862 12.939 -1.765 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -13.440 12.403 -2.639 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -14.175 10.692 -0.338 1.00 0.00 H new ATOM 0 HG3 GLN A 50 -15.383 10.758 -1.606 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -11.814 10.432 -1.216 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -11.621 9.199 -2.467 1.00 0.00 H new ATOM 786 N LYS A 51 -13.247 15.292 -1.284 1.00 0.00 N ATOM 787 CA LYS A 51 -12.771 16.569 -1.802 1.00 0.00 C ATOM 788 C LYS A 51 -12.121 16.381 -3.171 1.00 0.00 C ATOM 789 O LYS A 51 -11.284 17.179 -3.589 1.00 0.00 O ATOM 790 CB LYS A 51 -11.772 17.198 -0.828 1.00 0.00 C ATOM 791 CG LYS A 51 -11.976 18.692 -0.631 1.00 0.00 C ATOM 792 CD LYS A 51 -11.018 19.251 0.410 1.00 0.00 C ATOM 793 CE LYS A 51 -11.139 20.762 0.521 1.00 0.00 C ATOM 794 NZ LYS A 51 -10.205 21.320 1.538 1.00 0.00 N ATOM 0 H LYS A 51 -14.240 15.274 -1.050 1.00 0.00 H new ATOM 0 HA LYS A 51 -13.625 17.237 -1.910 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -11.853 16.698 0.137 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -10.760 17.023 -1.194 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -11.828 19.209 -1.579 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -13.004 18.883 -0.321 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -11.225 18.796 1.379 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -9.995 18.985 0.145 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -10.933 21.215 -0.449 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -12.163 21.026 0.785 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -10.318 22.353 1.584 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -10.418 20.907 2.468 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -9.226 21.090 1.273 1.00 0.00 H new ATOM 808 N ASP A 52 -12.516 15.313 -3.860 1.00 0.00 N ATOM 809 CA ASP A 52 -11.979 15.005 -5.179 1.00 0.00 C ATOM 810 C ASP A 52 -12.661 13.765 -5.759 1.00 0.00 C ATOM 811 O ASP A 52 -12.612 12.689 -5.163 1.00 0.00 O ATOM 812 CB ASP A 52 -10.467 14.774 -5.092 1.00 0.00 C ATOM 813 CG ASP A 52 -9.670 16.006 -5.472 1.00 0.00 C ATOM 814 OD1 ASP A 52 -9.661 16.362 -6.670 1.00 0.00 O ATOM 815 OD2 ASP A 52 -9.054 16.616 -4.572 1.00 0.00 O ATOM 0 H ASP A 52 -13.209 14.645 -3.523 1.00 0.00 H new ATOM 0 HA ASP A 52 -12.174 15.852 -5.837 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -10.206 14.475 -4.077 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -10.190 13.949 -5.748 1.00 0.00 H new ATOM 820 N PRO A 53 -13.311 13.896 -6.929 1.00 0.00 N ATOM 821 CA PRO A 53 -14.002 12.779 -7.576 1.00 0.00 C ATOM 822 C PRO A 53 -13.064 11.899 -8.399 1.00 0.00 C ATOM 823 O PRO A 53 -13.512 11.105 -9.226 1.00 0.00 O ATOM 824 CB PRO A 53 -15.001 13.489 -8.485 1.00 0.00 C ATOM 825 CG PRO A 53 -14.314 14.752 -8.878 1.00 0.00 C ATOM 826 CD PRO A 53 -13.432 15.141 -7.716 1.00 0.00 C ATOM 0 HA PRO A 53 -14.452 12.099 -6.853 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -15.246 12.882 -9.357 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -15.937 13.691 -7.965 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -13.723 14.607 -9.782 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -15.039 15.537 -9.094 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -12.459 15.496 -8.055 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -13.877 15.944 -7.128 1.00 0.00 H new ATOM 834 N GLY A 54 -11.762 12.039 -8.167 1.00 0.00 N ATOM 835 CA GLY A 54 -10.789 11.246 -8.893 1.00 0.00 C ATOM 836 C GLY A 54 -9.973 10.349 -7.984 1.00 0.00 C ATOM 837 O GLY A 54 -8.988 9.753 -8.413 1.00 0.00 O ATOM 0 H GLY A 54 -11.364 12.688 -7.488 1.00 0.00 H new ATOM 0 HA2 GLY A 54 -11.304 10.634 -9.634 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -10.119 11.910 -9.439 1.00 0.00 H new ATOM 841 N VAL A 55 -10.378 10.253 -6.720 1.00 0.00 N ATOM 842 CA VAL A 55 -9.670 9.419 -5.759 1.00 0.00 C ATOM 843 C VAL A 55 -10.141 7.968 -5.839 1.00 0.00 C ATOM 844 O VAL A 55 -9.374 7.070 -6.188 1.00 0.00 O ATOM 845 CB VAL A 55 -9.883 9.941 -4.325 1.00 0.00 C ATOM 846 CG1 VAL A 55 -9.155 9.066 -3.312 1.00 0.00 C ATOM 847 CG2 VAL A 55 -9.432 11.389 -4.211 1.00 0.00 C ATOM 0 H VAL A 55 -11.189 10.741 -6.341 1.00 0.00 H new ATOM 0 HA VAL A 55 -8.610 9.463 -6.007 1.00 0.00 H new ATOM 0 HB VAL A 55 -10.949 9.895 -4.102 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -9.322 9.456 -2.308 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -9.535 8.046 -3.373 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -8.087 9.069 -3.530 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -9.590 11.740 -3.191 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -8.373 11.461 -4.459 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -10.009 12.005 -4.900 1.00 0.00 H new ATOM 857 N LEU A 56 -11.408 7.750 -5.503 1.00 0.00 N ATOM 858 CA LEU A 56 -12.000 6.418 -5.522 1.00 0.00 C ATOM 859 C LEU A 56 -12.337 5.958 -6.942 1.00 0.00 C ATOM 860 O LEU A 56 -11.978 4.854 -7.352 1.00 0.00 O ATOM 861 CB LEU A 56 -13.259 6.420 -4.644 1.00 0.00 C ATOM 862 CG LEU A 56 -14.299 5.337 -4.946 1.00 0.00 C ATOM 863 CD1 LEU A 56 -13.874 4.007 -4.348 1.00 0.00 C ATOM 864 CD2 LEU A 56 -15.655 5.760 -4.409 1.00 0.00 C ATOM 0 H LEU A 56 -12.050 8.487 -5.212 1.00 0.00 H new ATOM 0 HA LEU A 56 -11.270 5.711 -5.127 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -12.951 6.317 -3.604 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -13.741 7.393 -4.739 1.00 0.00 H new ATOM 0 HG LEU A 56 -14.374 5.211 -6.026 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -14.625 3.250 -4.573 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -12.917 3.706 -4.774 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -13.774 4.109 -3.267 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -16.390 4.986 -4.627 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -15.590 5.906 -3.331 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -15.959 6.693 -4.883 1.00 0.00 H new ATOM 876 N ASP A 57 -13.060 6.802 -7.668 1.00 0.00 N ATOM 877 CA ASP A 57 -13.493 6.489 -9.028 1.00 0.00 C ATOM 878 C ASP A 57 -12.322 6.232 -9.973 1.00 0.00 C ATOM 879 O ASP A 57 -12.418 5.399 -10.871 1.00 0.00 O ATOM 880 CB ASP A 57 -14.356 7.625 -9.576 1.00 0.00 C ATOM 881 CG ASP A 57 -15.106 7.228 -10.832 1.00 0.00 C ATOM 882 OD1 ASP A 57 -15.825 6.208 -10.797 1.00 0.00 O ATOM 883 OD2 ASP A 57 -14.973 7.937 -11.853 1.00 0.00 O ATOM 0 H ASP A 57 -13.362 7.718 -7.335 1.00 0.00 H new ATOM 0 HA ASP A 57 -14.075 5.569 -8.973 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -15.070 7.936 -8.813 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -13.724 8.487 -9.791 1.00 0.00 H new ATOM 888 N ARG A 58 -11.229 6.956 -9.787 1.00 0.00 N ATOM 889 CA ARG A 58 -10.068 6.806 -10.649 1.00 0.00 C ATOM 890 C ARG A 58 -9.527 5.377 -10.632 1.00 0.00 C ATOM 891 O ARG A 58 -9.323 4.773 -11.685 1.00 0.00 O ATOM 892 CB ARG A 58 -8.981 7.791 -10.222 1.00 0.00 C ATOM 893 CG ARG A 58 -7.682 7.649 -10.990 1.00 0.00 C ATOM 894 CD ARG A 58 -7.672 8.515 -12.239 1.00 0.00 C ATOM 895 NE ARG A 58 -8.275 7.834 -13.382 1.00 0.00 N ATOM 896 CZ ARG A 58 -7.647 6.915 -14.112 1.00 0.00 C ATOM 897 NH1 ARG A 58 -6.398 6.569 -13.827 1.00 0.00 N ATOM 898 NH2 ARG A 58 -8.270 6.340 -15.132 1.00 0.00 N ATOM 0 H ARG A 58 -11.122 7.652 -9.049 1.00 0.00 H new ATOM 0 HA ARG A 58 -10.377 7.023 -11.672 1.00 0.00 H new ATOM 0 HB2 ARG A 58 -9.356 8.807 -10.348 1.00 0.00 H new ATOM 0 HB3 ARG A 58 -8.779 7.655 -9.159 1.00 0.00 H new ATOM 0 HG2 ARG A 58 -6.847 7.927 -10.347 1.00 0.00 H new ATOM 0 HG3 ARG A 58 -7.536 6.605 -11.269 1.00 0.00 H new ATOM 0 HD2 ARG A 58 -8.212 9.441 -12.042 1.00 0.00 H new ATOM 0 HD3 ARG A 58 -6.645 8.790 -12.481 1.00 0.00 H new ATOM 0 HE ARG A 58 -9.233 8.077 -13.635 1.00 0.00 H new ATOM 0 HH11 ARG A 58 -5.913 7.008 -13.044 1.00 0.00 H new ATOM 0 HH12 ARG A 58 -5.923 5.864 -14.391 1.00 0.00 H new ATOM 0 HH21 ARG A 58 -9.230 6.602 -15.357 1.00 0.00 H new ATOM 0 HH22 ARG A 58 -7.789 5.636 -15.692 1.00 0.00 H new ATOM 911 N MET A 59 -9.274 4.846 -9.441 1.00 0.00 N ATOM 912 CA MET A 59 -8.731 3.497 -9.316 1.00 0.00 C ATOM 913 C MET A 59 -9.772 2.423 -9.576 1.00 0.00 C ATOM 914 O MET A 59 -9.563 1.534 -10.397 1.00 0.00 O ATOM 915 CB MET A 59 -8.134 3.296 -7.927 1.00 0.00 C ATOM 916 CG MET A 59 -6.708 2.767 -7.971 1.00 0.00 C ATOM 917 SD MET A 59 -5.545 3.873 -7.163 1.00 0.00 S ATOM 918 CE MET A 59 -6.530 4.336 -5.748 1.00 0.00 C ATOM 0 H MET A 59 -9.434 5.324 -8.554 1.00 0.00 H new ATOM 0 HA MET A 59 -7.956 3.398 -10.076 1.00 0.00 H new ATOM 0 HB2 MET A 59 -8.149 4.244 -7.389 1.00 0.00 H new ATOM 0 HB3 MET A 59 -8.758 2.601 -7.365 1.00 0.00 H new ATOM 0 HG2 MET A 59 -6.670 1.790 -7.490 1.00 0.00 H new ATOM 0 HG3 MET A 59 -6.408 2.623 -9.009 1.00 0.00 H new ATOM 0 HE1 MET A 59 -5.881 4.483 -4.885 1.00 0.00 H new ATOM 0 HE2 MET A 59 -7.063 5.262 -5.963 1.00 0.00 H new ATOM 0 HE3 MET A 59 -7.249 3.546 -5.531 1.00 0.00 H new ATOM 928 N MET A 60 -10.879 2.492 -8.858 1.00 0.00 N ATOM 929 CA MET A 60 -11.938 1.500 -8.997 1.00 0.00 C ATOM 930 C MET A 60 -12.383 1.333 -10.448 1.00 0.00 C ATOM 931 O MET A 60 -12.811 0.251 -10.849 1.00 0.00 O ATOM 932 CB MET A 60 -13.119 1.865 -8.103 1.00 0.00 C ATOM 933 CG MET A 60 -12.893 1.479 -6.651 1.00 0.00 C ATOM 934 SD MET A 60 -13.629 -0.111 -6.239 1.00 0.00 S ATOM 935 CE MET A 60 -12.713 -1.185 -7.340 1.00 0.00 C ATOM 0 H MET A 60 -11.071 3.223 -8.173 1.00 0.00 H new ATOM 0 HA MET A 60 -11.536 0.539 -8.678 1.00 0.00 H new ATOM 0 HB2 MET A 60 -13.300 2.938 -8.166 1.00 0.00 H new ATOM 0 HB3 MET A 60 -14.016 1.368 -8.472 1.00 0.00 H new ATOM 0 HG2 MET A 60 -11.822 1.443 -6.450 1.00 0.00 H new ATOM 0 HG3 MET A 60 -13.313 2.249 -6.004 1.00 0.00 H new ATOM 0 HE1 MET A 60 -12.455 -2.107 -6.818 1.00 0.00 H new ATOM 0 HE2 MET A 60 -13.325 -1.420 -8.211 1.00 0.00 H new ATOM 0 HE3 MET A 60 -11.801 -0.683 -7.662 1.00 0.00 H new ATOM 945 N LYS A 61 -12.278 2.397 -11.233 1.00 0.00 N ATOM 946 CA LYS A 61 -12.665 2.344 -12.640 1.00 0.00 C ATOM 947 C LYS A 61 -11.581 1.675 -13.485 1.00 0.00 C ATOM 948 O LYS A 61 -11.818 0.647 -14.118 1.00 0.00 O ATOM 949 CB LYS A 61 -12.941 3.749 -13.173 1.00 0.00 C ATOM 950 CG LYS A 61 -13.893 3.772 -14.356 1.00 0.00 C ATOM 951 CD LYS A 61 -15.303 4.144 -13.923 1.00 0.00 C ATOM 952 CE LYS A 61 -16.222 2.934 -13.915 1.00 0.00 C ATOM 953 NZ LYS A 61 -17.237 3.016 -12.829 1.00 0.00 N ATOM 0 H LYS A 61 -11.930 3.304 -10.923 1.00 0.00 H new ATOM 0 HA LYS A 61 -13.576 1.749 -12.711 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -13.357 4.358 -12.370 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -11.998 4.209 -13.467 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -13.537 4.487 -15.098 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -13.904 2.793 -14.836 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -15.274 4.586 -12.927 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -15.703 4.902 -14.597 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -16.726 2.855 -14.878 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -15.629 2.028 -13.790 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -17.844 2.172 -12.857 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -16.757 3.066 -11.908 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -17.820 3.867 -12.962 1.00 0.00 H new ATOM 967 N LYS A 62 -10.393 2.277 -13.495 1.00 0.00 N ATOM 968 CA LYS A 62 -9.265 1.756 -14.268 1.00 0.00 C ATOM 969 C LYS A 62 -8.557 0.605 -13.549 1.00 0.00 C ATOM 970 O LYS A 62 -7.514 0.134 -14.003 1.00 0.00 O ATOM 971 CB LYS A 62 -8.266 2.878 -14.556 1.00 0.00 C ATOM 972 CG LYS A 62 -7.096 2.443 -15.425 1.00 0.00 C ATOM 973 CD LYS A 62 -5.841 2.216 -14.599 1.00 0.00 C ATOM 974 CE LYS A 62 -5.002 3.480 -14.498 1.00 0.00 C ATOM 975 NZ LYS A 62 -3.552 3.202 -14.696 1.00 0.00 N ATOM 0 H LYS A 62 -10.185 3.129 -12.975 1.00 0.00 H new ATOM 0 HA LYS A 62 -9.664 1.366 -15.204 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -8.787 3.700 -15.047 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -7.883 3.263 -13.611 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -7.356 1.526 -15.953 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -6.902 3.203 -16.182 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -6.118 1.882 -13.599 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -5.248 1.420 -15.049 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -5.339 4.200 -15.244 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -5.153 3.939 -13.521 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -3.015 4.089 -14.620 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -3.224 2.535 -13.969 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -3.403 2.788 -15.638 1.00 0.00 H new ATOM 989 N LEU A 63 -9.116 0.161 -12.425 1.00 0.00 N ATOM 990 CA LEU A 63 -8.525 -0.927 -11.645 1.00 0.00 C ATOM 991 C LEU A 63 -8.126 -2.109 -12.519 1.00 0.00 C ATOM 992 O LEU A 63 -7.267 -2.906 -12.141 1.00 0.00 O ATOM 993 CB LEU A 63 -9.492 -1.390 -10.550 1.00 0.00 C ATOM 994 CG LEU A 63 -10.599 -2.342 -11.012 1.00 0.00 C ATOM 995 CD1 LEU A 63 -11.494 -2.724 -9.844 1.00 0.00 C ATOM 996 CD2 LEU A 63 -11.416 -1.716 -12.132 1.00 0.00 C ATOM 0 H LEU A 63 -9.979 0.538 -12.033 1.00 0.00 H new ATOM 0 HA LEU A 63 -7.618 -0.534 -11.185 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -8.917 -1.882 -9.765 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -9.955 -0.511 -10.102 1.00 0.00 H new ATOM 0 HG LEU A 63 -10.132 -3.248 -11.399 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -12.275 -3.401 -10.190 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -10.899 -3.219 -9.076 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -11.950 -1.826 -9.427 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -12.196 -2.410 -12.445 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -11.873 -0.792 -11.777 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -10.765 -1.497 -12.978 1.00 0.00 H new ATOM 1008 N ASP A 64 -8.748 -2.220 -13.682 1.00 0.00 N ATOM 1009 CA ASP A 64 -8.454 -3.305 -14.604 1.00 0.00 C ATOM 1010 C ASP A 64 -9.104 -4.604 -14.137 1.00 0.00 C ATOM 1011 O ASP A 64 -8.441 -5.634 -14.008 1.00 0.00 O ATOM 1012 CB ASP A 64 -6.942 -3.496 -14.753 1.00 0.00 C ATOM 1013 CG ASP A 64 -6.544 -3.885 -16.164 1.00 0.00 C ATOM 1014 OD1 ASP A 64 -6.747 -3.066 -17.085 1.00 0.00 O ATOM 1015 OD2 ASP A 64 -6.028 -5.007 -16.346 1.00 0.00 O ATOM 0 H ASP A 64 -9.462 -1.570 -14.010 1.00 0.00 H new ATOM 0 HA ASP A 64 -8.868 -3.040 -15.577 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -6.433 -2.573 -14.476 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -6.606 -4.266 -14.058 1.00 0.00 H new ATOM 1020 N LEU A 65 -10.407 -4.545 -13.886 1.00 0.00 N ATOM 1021 CA LEU A 65 -11.156 -5.710 -13.434 1.00 0.00 C ATOM 1022 C LEU A 65 -12.242 -6.071 -14.447 1.00 0.00 C ATOM 1023 O LEU A 65 -13.433 -6.059 -14.132 1.00 0.00 O ATOM 1024 CB LEU A 65 -11.780 -5.438 -12.057 1.00 0.00 C ATOM 1025 CG LEU A 65 -11.107 -6.147 -10.875 1.00 0.00 C ATOM 1026 CD1 LEU A 65 -10.888 -7.622 -11.185 1.00 0.00 C ATOM 1027 CD2 LEU A 65 -9.789 -5.471 -10.521 1.00 0.00 C ATOM 0 H LEU A 65 -10.968 -3.699 -13.989 1.00 0.00 H new ATOM 0 HA LEU A 65 -10.470 -6.553 -13.347 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -11.759 -4.364 -11.874 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -12.828 -5.735 -12.087 1.00 0.00 H new ATOM 0 HG LEU A 65 -11.770 -6.075 -10.013 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -10.410 -8.106 -10.333 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -11.848 -8.099 -11.381 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -10.249 -7.718 -12.063 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -9.328 -5.990 -9.680 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -9.119 -5.507 -11.380 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -9.975 -4.432 -10.249 1.00 0.00 H new ATOM 1039 N ASN A 66 -11.821 -6.385 -15.669 1.00 0.00 N ATOM 1040 CA ASN A 66 -12.755 -6.743 -16.731 1.00 0.00 C ATOM 1041 C ASN A 66 -13.190 -8.202 -16.612 1.00 0.00 C ATOM 1042 O ASN A 66 -13.026 -8.988 -17.546 1.00 0.00 O ATOM 1043 CB ASN A 66 -12.116 -6.497 -18.100 1.00 0.00 C ATOM 1044 CG ASN A 66 -13.080 -6.751 -19.242 1.00 0.00 C ATOM 1045 OD1 ASN A 66 -14.164 -6.172 -19.295 1.00 0.00 O ATOM 1046 ND2 ASN A 66 -12.687 -7.621 -20.166 1.00 0.00 N ATOM 0 H ASN A 66 -10.840 -6.399 -15.948 1.00 0.00 H new ATOM 0 HA ASN A 66 -13.640 -6.114 -16.630 1.00 0.00 H new ATOM 0 HB2 ASN A 66 -11.759 -5.468 -18.152 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -11.245 -7.143 -18.213 1.00 0.00 H new ATOM 0 HD21 ASN A 66 -13.293 -7.831 -20.959 1.00 0.00 H new ATOM 0 HD22 ASN A 66 -11.779 -8.078 -20.082 1.00 0.00 H new ATOM 1053 N SER A 67 -13.749 -8.554 -15.458 1.00 0.00 N ATOM 1054 CA SER A 67 -14.214 -9.917 -15.210 1.00 0.00 C ATOM 1055 C SER A 67 -13.173 -10.946 -15.642 1.00 0.00 C ATOM 1056 O SER A 67 -13.514 -12.065 -16.024 1.00 0.00 O ATOM 1057 CB SER A 67 -15.532 -10.169 -15.943 1.00 0.00 C ATOM 1058 OG SER A 67 -16.642 -9.842 -15.125 1.00 0.00 O ATOM 0 H SER A 67 -13.892 -7.913 -14.677 1.00 0.00 H new ATOM 0 HA SER A 67 -14.373 -10.025 -14.137 1.00 0.00 H new ATOM 0 HB2 SER A 67 -15.563 -9.576 -16.857 1.00 0.00 H new ATOM 0 HB3 SER A 67 -15.592 -11.216 -16.241 1.00 0.00 H new ATOM 0 HG SER A 67 -17.472 -10.010 -15.618 1.00 0.00 H new ATOM 1064 N ASP A 68 -11.904 -10.560 -15.572 1.00 0.00 N ATOM 1065 CA ASP A 68 -10.816 -11.453 -15.950 1.00 0.00 C ATOM 1066 C ASP A 68 -10.236 -12.143 -14.720 1.00 0.00 C ATOM 1067 O ASP A 68 -9.063 -12.519 -14.701 1.00 0.00 O ATOM 1068 CB ASP A 68 -9.718 -10.675 -16.680 1.00 0.00 C ATOM 1069 CG ASP A 68 -9.908 -10.682 -18.184 1.00 0.00 C ATOM 1070 OD1 ASP A 68 -10.849 -10.020 -18.668 1.00 0.00 O ATOM 1071 OD2 ASP A 68 -9.113 -11.351 -18.879 1.00 0.00 O ATOM 0 H ASP A 68 -11.604 -9.637 -15.258 1.00 0.00 H new ATOM 0 HA ASP A 68 -11.216 -12.214 -16.621 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -9.707 -9.645 -16.323 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -8.747 -11.107 -16.437 1.00 0.00 H new ATOM 1076 N GLY A 69 -11.065 -12.307 -13.693 1.00 0.00 N ATOM 1077 CA GLY A 69 -10.620 -12.950 -12.473 1.00 0.00 C ATOM 1078 C GLY A 69 -11.184 -12.288 -11.229 1.00 0.00 C ATOM 1079 O GLY A 69 -12.338 -12.511 -10.868 1.00 0.00 O ATOM 0 H GLY A 69 -12.039 -12.005 -13.686 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -10.917 -13.999 -12.489 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -9.531 -12.928 -12.431 1.00 0.00 H new ATOM 1083 N GLN A 70 -10.363 -11.472 -10.578 1.00 0.00 N ATOM 1084 CA GLN A 70 -10.771 -10.770 -9.364 1.00 0.00 C ATOM 1085 C GLN A 70 -9.771 -9.666 -9.024 1.00 0.00 C ATOM 1086 O GLN A 70 -8.914 -9.326 -9.840 1.00 0.00 O ATOM 1087 CB GLN A 70 -10.880 -11.757 -8.193 1.00 0.00 C ATOM 1088 CG GLN A 70 -12.202 -12.512 -8.127 1.00 0.00 C ATOM 1089 CD GLN A 70 -13.409 -11.625 -8.379 1.00 0.00 C ATOM 1090 OE1 GLN A 70 -13.363 -10.400 -7.865 1.00 0.00 O flip ATOM 1091 NE2 GLN A 70 -14.370 -12.035 -9.029 1.00 0.00 N flip ATOM 0 H GLN A 70 -9.405 -11.279 -10.872 1.00 0.00 H new ATOM 0 HA GLN A 70 -11.747 -10.317 -9.538 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -10.067 -12.479 -8.265 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -10.740 -11.212 -7.260 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -12.191 -13.317 -8.862 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -12.299 -12.977 -7.146 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -14.364 -12.983 -9.406 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -15.173 -11.427 -9.191 1.00 0.00 H new ATOM 1100 N LEU A 71 -9.880 -9.114 -7.816 1.00 0.00 N ATOM 1101 CA LEU A 71 -8.979 -8.061 -7.368 1.00 0.00 C ATOM 1102 C LEU A 71 -7.539 -8.599 -7.320 1.00 0.00 C ATOM 1103 O LEU A 71 -7.102 -9.260 -8.261 1.00 0.00 O ATOM 1104 CB LEU A 71 -9.459 -7.534 -6.003 1.00 0.00 C ATOM 1105 CG LEU A 71 -10.160 -6.164 -6.008 1.00 0.00 C ATOM 1106 CD1 LEU A 71 -9.172 -5.056 -5.684 1.00 0.00 C ATOM 1107 CD2 LEU A 71 -10.844 -5.890 -7.339 1.00 0.00 C ATOM 0 H LEU A 71 -10.587 -9.382 -7.131 1.00 0.00 H new ATOM 0 HA LEU A 71 -8.986 -7.224 -8.067 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -10.143 -8.267 -5.575 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -8.598 -7.475 -5.337 1.00 0.00 H new ATOM 0 HG LEU A 71 -10.929 -6.186 -5.236 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -9.687 -4.095 -5.692 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -8.742 -5.229 -4.697 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -8.377 -5.048 -6.430 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -11.328 -4.914 -7.305 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -10.103 -5.900 -8.138 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -11.592 -6.660 -7.529 1.00 0.00 H new ATOM 1119 N ASP A 72 -6.799 -8.336 -6.242 1.00 0.00 N ATOM 1120 CA ASP A 72 -5.425 -8.821 -6.135 1.00 0.00 C ATOM 1121 C ASP A 72 -4.773 -8.333 -4.848 1.00 0.00 C ATOM 1122 O ASP A 72 -5.396 -7.641 -4.043 1.00 0.00 O ATOM 1123 CB ASP A 72 -4.595 -8.364 -7.338 1.00 0.00 C ATOM 1124 CG ASP A 72 -3.580 -9.407 -7.768 1.00 0.00 C ATOM 1125 OD1 ASP A 72 -3.754 -10.589 -7.407 1.00 0.00 O ATOM 1126 OD2 ASP A 72 -2.613 -9.040 -8.467 1.00 0.00 O ATOM 0 H ASP A 72 -7.124 -7.796 -5.440 1.00 0.00 H new ATOM 0 HA ASP A 72 -5.459 -9.910 -6.119 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -5.260 -8.142 -8.172 1.00 0.00 H new ATOM 0 HB3 ASP A 72 -4.077 -7.438 -7.088 1.00 0.00 H new ATOM 1131 N PHE A 73 -3.512 -8.702 -4.665 1.00 0.00 N ATOM 1132 CA PHE A 73 -2.765 -8.311 -3.478 1.00 0.00 C ATOM 1133 C PHE A 73 -2.472 -6.814 -3.475 1.00 0.00 C ATOM 1134 O PHE A 73 -2.821 -6.107 -2.526 1.00 0.00 O ATOM 1135 CB PHE A 73 -1.462 -9.108 -3.385 1.00 0.00 C ATOM 1136 CG PHE A 73 -0.507 -8.841 -4.513 1.00 0.00 C ATOM 1137 CD1 PHE A 73 -0.648 -9.490 -5.730 1.00 0.00 C ATOM 1138 CD2 PHE A 73 0.533 -7.940 -4.356 1.00 0.00 C ATOM 1139 CE1 PHE A 73 0.228 -9.244 -6.769 1.00 0.00 C ATOM 1140 CE2 PHE A 73 1.414 -7.689 -5.393 1.00 0.00 C ATOM 1141 CZ PHE A 73 1.261 -8.342 -6.600 1.00 0.00 C ATOM 0 H PHE A 73 -2.984 -9.273 -5.325 1.00 0.00 H new ATOM 0 HA PHE A 73 -3.380 -8.534 -2.606 1.00 0.00 H new ATOM 0 HB2 PHE A 73 -0.970 -8.873 -2.441 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -1.698 -10.172 -3.365 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -1.453 -10.197 -5.867 1.00 0.00 H new ATOM 0 HD2 PHE A 73 0.658 -7.428 -3.414 1.00 0.00 H new ATOM 0 HE1 PHE A 73 0.106 -9.756 -7.712 1.00 0.00 H new ATOM 0 HE2 PHE A 73 2.220 -6.983 -5.259 1.00 0.00 H new ATOM 0 HZ PHE A 73 1.948 -8.148 -7.411 1.00 0.00 H new ATOM 1151 N GLN A 74 -1.830 -6.322 -4.531 1.00 0.00 N ATOM 1152 CA GLN A 74 -1.509 -4.907 -4.601 1.00 0.00 C ATOM 1153 C GLN A 74 -2.701 -4.082 -5.046 1.00 0.00 C ATOM 1154 O GLN A 74 -2.781 -2.910 -4.708 1.00 0.00 O ATOM 1155 CB GLN A 74 -0.315 -4.633 -5.512 1.00 0.00 C ATOM 1156 CG GLN A 74 0.607 -3.551 -4.961 1.00 0.00 C ATOM 1157 CD GLN A 74 0.555 -2.257 -5.758 1.00 0.00 C ATOM 1158 OE1 GLN A 74 0.045 -1.186 -5.143 1.00 0.00 O flip ATOM 1159 NE2 GLN A 74 0.966 -2.218 -6.916 1.00 0.00 N flip ATOM 0 H GLN A 74 -1.528 -6.873 -5.334 1.00 0.00 H new ATOM 0 HA GLN A 74 -1.239 -4.606 -3.589 1.00 0.00 H new ATOM 0 HB2 GLN A 74 0.252 -5.554 -5.648 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -0.675 -4.332 -6.496 1.00 0.00 H new ATOM 0 HG2 GLN A 74 0.335 -3.344 -3.926 1.00 0.00 H new ATOM 0 HG3 GLN A 74 1.631 -3.925 -4.953 1.00 0.00 H new ATOM 0 HE21 GLN A 74 1.348 -3.058 -7.350 1.00 0.00 H new ATOM 0 HE22 GLN A 74 0.925 -1.346 -7.443 1.00 0.00 H new ATOM 1168 N GLU A 75 -3.636 -4.671 -5.798 1.00 0.00 N ATOM 1169 CA GLU A 75 -4.803 -3.910 -6.242 1.00 0.00 C ATOM 1170 C GLU A 75 -5.344 -3.100 -5.080 1.00 0.00 C ATOM 1171 O GLU A 75 -5.783 -1.970 -5.249 1.00 0.00 O ATOM 1172 CB GLU A 75 -5.903 -4.813 -6.803 1.00 0.00 C ATOM 1173 CG GLU A 75 -6.081 -4.671 -8.307 1.00 0.00 C ATOM 1174 CD GLU A 75 -6.055 -6.002 -9.031 1.00 0.00 C ATOM 1175 OE1 GLU A 75 -7.125 -6.633 -9.153 1.00 0.00 O ATOM 1176 OE2 GLU A 75 -4.964 -6.410 -9.483 1.00 0.00 O ATOM 0 H GLU A 75 -3.610 -5.644 -6.104 1.00 0.00 H new ATOM 0 HA GLU A 75 -4.485 -3.249 -7.048 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -5.668 -5.851 -6.567 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -6.845 -4.579 -6.308 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -7.028 -4.171 -8.510 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -5.292 -4.032 -8.703 1.00 0.00 H new ATOM 1183 N PHE A 76 -5.268 -3.682 -3.891 1.00 0.00 N ATOM 1184 CA PHE A 76 -5.714 -3.007 -2.687 1.00 0.00 C ATOM 1185 C PHE A 76 -4.666 -1.999 -2.249 1.00 0.00 C ATOM 1186 O PHE A 76 -4.960 -0.822 -2.081 1.00 0.00 O ATOM 1187 CB PHE A 76 -5.953 -4.016 -1.573 1.00 0.00 C ATOM 1188 CG PHE A 76 -6.986 -3.578 -0.574 1.00 0.00 C ATOM 1189 CD1 PHE A 76 -6.750 -2.496 0.257 1.00 0.00 C ATOM 1190 CD2 PHE A 76 -8.191 -4.253 -0.465 1.00 0.00 C ATOM 1191 CE1 PHE A 76 -7.697 -2.096 1.181 1.00 0.00 C ATOM 1192 CE2 PHE A 76 -9.141 -3.857 0.456 1.00 0.00 C ATOM 1193 CZ PHE A 76 -8.894 -2.777 1.281 1.00 0.00 C ATOM 0 H PHE A 76 -4.901 -4.621 -3.738 1.00 0.00 H new ATOM 0 HA PHE A 76 -6.650 -2.490 -2.899 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -6.265 -4.963 -2.013 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -5.013 -4.200 -1.053 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -5.816 -1.959 0.182 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -8.390 -5.098 -1.107 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -7.501 -1.251 1.824 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -10.076 -4.391 0.531 1.00 0.00 H new ATOM 0 HZ PHE A 76 -9.635 -2.466 2.002 1.00 0.00 H new ATOM 1203 N LEU A 77 -3.430 -2.465 -2.086 1.00 0.00 N ATOM 1204 CA LEU A 77 -2.342 -1.583 -1.690 1.00 0.00 C ATOM 1205 C LEU A 77 -2.200 -0.451 -2.703 1.00 0.00 C ATOM 1206 O LEU A 77 -1.874 0.680 -2.348 1.00 0.00 O ATOM 1207 CB LEU A 77 -1.037 -2.368 -1.557 1.00 0.00 C ATOM 1208 CG LEU A 77 -0.718 -2.815 -0.130 1.00 0.00 C ATOM 1209 CD1 LEU A 77 0.364 -3.882 -0.123 1.00 0.00 C ATOM 1210 CD2 LEU A 77 -0.306 -1.621 0.710 1.00 0.00 C ATOM 0 H LEU A 77 -3.161 -3.440 -2.221 1.00 0.00 H new ATOM 0 HA LEU A 77 -2.571 -1.150 -0.716 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -1.088 -3.248 -2.199 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -0.216 -1.752 -1.925 1.00 0.00 H new ATOM 0 HG LEU A 77 -1.617 -3.253 0.305 1.00 0.00 H new ATOM 0 HD11 LEU A 77 0.572 -4.182 0.904 1.00 0.00 H new ATOM 0 HD12 LEU A 77 0.025 -4.747 -0.693 1.00 0.00 H new ATOM 0 HD13 LEU A 77 1.272 -3.483 -0.575 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -0.081 -1.950 1.724 1.00 0.00 H new ATOM 0 HD22 LEU A 77 0.579 -1.158 0.274 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -1.120 -0.896 0.736 1.00 0.00 H new ATOM 1222 N ASN A 78 -2.484 -0.765 -3.965 1.00 0.00 N ATOM 1223 CA ASN A 78 -2.428 0.216 -5.034 1.00 0.00 C ATOM 1224 C ASN A 78 -3.654 1.108 -4.943 1.00 0.00 C ATOM 1225 O ASN A 78 -3.546 2.334 -4.968 1.00 0.00 O ATOM 1226 CB ASN A 78 -2.366 -0.475 -6.410 1.00 0.00 C ATOM 1227 CG ASN A 78 -3.254 0.180 -7.452 1.00 0.00 C ATOM 1228 OD1 ASN A 78 -3.197 1.392 -7.662 1.00 0.00 O ATOM 1229 ND2 ASN A 78 -4.081 -0.623 -8.109 1.00 0.00 N ATOM 0 H ASN A 78 -2.757 -1.700 -4.269 1.00 0.00 H new ATOM 0 HA ASN A 78 -1.525 0.817 -4.926 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -1.336 -0.469 -6.766 1.00 0.00 H new ATOM 0 HB3 ASN A 78 -2.659 -1.519 -6.298 1.00 0.00 H new ATOM 0 HD21 ASN A 78 -4.704 -0.242 -8.821 1.00 0.00 H new ATOM 0 HD22 ASN A 78 -4.094 -1.622 -7.902 1.00 0.00 H new ATOM 1236 N LEU A 79 -4.827 0.485 -4.828 1.00 0.00 N ATOM 1237 CA LEU A 79 -6.054 1.242 -4.726 1.00 0.00 C ATOM 1238 C LEU A 79 -6.067 2.033 -3.426 1.00 0.00 C ATOM 1239 O LEU A 79 -6.073 3.253 -3.431 1.00 0.00 O ATOM 1240 CB LEU A 79 -7.242 0.284 -4.741 1.00 0.00 C ATOM 1241 CG LEU A 79 -7.948 0.119 -6.087 1.00 0.00 C ATOM 1242 CD1 LEU A 79 -7.082 -0.606 -7.099 1.00 0.00 C ATOM 1243 CD2 LEU A 79 -9.231 -0.639 -5.890 1.00 0.00 C ATOM 0 H LEU A 79 -4.944 -0.528 -4.804 1.00 0.00 H new ATOM 0 HA LEU A 79 -6.122 1.930 -5.569 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -6.898 -0.696 -4.410 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -7.972 0.629 -4.009 1.00 0.00 H new ATOM 0 HG LEU A 79 -8.152 1.115 -6.479 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -7.624 -0.701 -8.040 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -6.164 -0.041 -7.264 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -6.834 -1.598 -6.722 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -9.735 -0.757 -6.849 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -9.013 -1.622 -5.472 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -9.877 -0.089 -5.206 1.00 0.00 H new ATOM 1255 N ILE A 80 -6.018 1.322 -2.314 1.00 0.00 N ATOM 1256 CA ILE A 80 -5.996 1.948 -1.000 1.00 0.00 C ATOM 1257 C ILE A 80 -4.809 2.891 -0.877 1.00 0.00 C ATOM 1258 O ILE A 80 -4.952 4.022 -0.412 1.00 0.00 O ATOM 1259 CB ILE A 80 -5.991 0.902 0.141 1.00 0.00 C ATOM 1260 CG1 ILE A 80 -6.742 1.452 1.350 1.00 0.00 C ATOM 1261 CG2 ILE A 80 -4.581 0.512 0.541 1.00 0.00 C ATOM 1262 CD1 ILE A 80 -5.897 2.364 2.210 1.00 0.00 C ATOM 0 H ILE A 80 -5.992 0.303 -2.293 1.00 0.00 H new ATOM 0 HA ILE A 80 -6.913 2.528 -0.899 1.00 0.00 H new ATOM 0 HB ILE A 80 -6.491 0.006 -0.226 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -7.621 1.998 1.007 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -7.100 0.620 1.956 1.00 0.00 H new ATOM 0 HG21 ILE A 80 -4.621 -0.224 1.344 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -4.064 0.084 -0.318 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -4.043 1.395 0.885 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -6.489 2.721 3.052 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -5.032 1.815 2.582 1.00 0.00 H new ATOM 0 HD13 ILE A 80 -5.560 3.214 1.617 1.00 0.00 H new ATOM 1274 N GLY A 81 -3.643 2.438 -1.330 1.00 0.00 N ATOM 1275 CA GLY A 81 -2.473 3.288 -1.290 1.00 0.00 C ATOM 1276 C GLY A 81 -2.702 4.528 -2.121 1.00 0.00 C ATOM 1277 O GLY A 81 -2.506 5.649 -1.652 1.00 0.00 O ATOM 0 H GLY A 81 -3.491 1.508 -1.719 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -2.252 3.567 -0.260 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -1.606 2.744 -1.666 1.00 0.00 H new ATOM 1281 N GLY A 82 -3.153 4.317 -3.355 1.00 0.00 N ATOM 1282 CA GLY A 82 -3.445 5.432 -4.241 1.00 0.00 C ATOM 1283 C GLY A 82 -4.494 6.366 -3.657 1.00 0.00 C ATOM 1284 O GLY A 82 -4.372 7.587 -3.770 1.00 0.00 O ATOM 0 H GLY A 82 -3.321 3.395 -3.757 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -2.529 5.991 -4.434 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -3.794 5.050 -5.201 1.00 0.00 H new ATOM 1288 N LEU A 83 -5.518 5.801 -3.014 1.00 0.00 N ATOM 1289 CA LEU A 83 -6.565 6.616 -2.398 1.00 0.00 C ATOM 1290 C LEU A 83 -5.948 7.465 -1.301 1.00 0.00 C ATOM 1291 O LEU A 83 -6.288 8.635 -1.130 1.00 0.00 O ATOM 1292 CB LEU A 83 -7.690 5.739 -1.827 1.00 0.00 C ATOM 1293 CG LEU A 83 -8.139 4.603 -2.743 1.00 0.00 C ATOM 1294 CD1 LEU A 83 -9.158 3.704 -2.084 1.00 0.00 C ATOM 1295 CD2 LEU A 83 -8.701 5.138 -4.034 1.00 0.00 C ATOM 0 H LEU A 83 -5.644 4.794 -2.907 1.00 0.00 H new ATOM 0 HA LEU A 83 -7.006 7.259 -3.159 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -7.356 5.314 -0.880 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -8.550 6.372 -1.607 1.00 0.00 H new ATOM 0 HG LEU A 83 -7.250 4.009 -2.954 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -9.446 2.912 -2.775 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -8.727 3.262 -1.186 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -10.038 4.288 -1.815 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -9.013 4.307 -4.667 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -9.560 5.774 -3.821 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -7.937 5.720 -4.550 1.00 0.00 H new ATOM 1307 N ALA A 84 -5.012 6.862 -0.576 1.00 0.00 N ATOM 1308 CA ALA A 84 -4.304 7.551 0.495 1.00 0.00 C ATOM 1309 C ALA A 84 -3.587 8.774 -0.042 1.00 0.00 C ATOM 1310 O ALA A 84 -3.569 9.827 0.581 1.00 0.00 O ATOM 1311 CB ALA A 84 -3.283 6.625 1.131 1.00 0.00 C ATOM 0 H ALA A 84 -4.725 5.893 -0.712 1.00 0.00 H new ATOM 0 HA ALA A 84 -5.038 7.858 1.240 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -2.761 7.152 1.930 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -3.790 5.753 1.543 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -2.564 6.304 0.378 1.00 0.00 H new ATOM 1317 N VAL A 85 -2.983 8.616 -1.203 1.00 0.00 N ATOM 1318 CA VAL A 85 -2.241 9.701 -1.827 1.00 0.00 C ATOM 1319 C VAL A 85 -3.174 10.743 -2.409 1.00 0.00 C ATOM 1320 O VAL A 85 -2.767 11.866 -2.705 1.00 0.00 O ATOM 1321 CB VAL A 85 -1.271 9.213 -2.930 1.00 0.00 C ATOM 1322 CG1 VAL A 85 0.143 9.639 -2.589 1.00 0.00 C ATOM 1323 CG2 VAL A 85 -1.327 7.703 -3.125 1.00 0.00 C ATOM 0 H VAL A 85 -2.990 7.747 -1.736 1.00 0.00 H new ATOM 0 HA VAL A 85 -1.645 10.146 -1.030 1.00 0.00 H new ATOM 0 HB VAL A 85 -1.583 9.671 -3.869 1.00 0.00 H new ATOM 0 HG11 VAL A 85 0.824 9.294 -3.367 1.00 0.00 H new ATOM 0 HG12 VAL A 85 0.189 10.726 -2.521 1.00 0.00 H new ATOM 0 HG13 VAL A 85 0.434 9.203 -1.633 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -0.629 7.411 -3.909 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -1.056 7.206 -2.194 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -2.337 7.410 -3.412 1.00 0.00 H new ATOM 1333 N ALA A 86 -4.419 10.357 -2.582 1.00 0.00 N ATOM 1334 CA ALA A 86 -5.417 11.236 -3.142 1.00 0.00 C ATOM 1335 C ALA A 86 -6.430 11.670 -2.086 1.00 0.00 C ATOM 1336 O ALA A 86 -7.519 12.139 -2.413 1.00 0.00 O ATOM 1337 CB ALA A 86 -6.092 10.509 -4.272 1.00 0.00 C ATOM 0 H ALA A 86 -4.765 9.429 -2.339 1.00 0.00 H new ATOM 0 HA ALA A 86 -4.943 12.145 -3.512 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -6.853 11.151 -4.715 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -5.353 10.247 -5.029 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -6.560 9.601 -3.892 1.00 0.00 H new ATOM 1343 N CYS A 87 -6.063 11.504 -0.820 1.00 0.00 N ATOM 1344 CA CYS A 87 -6.943 11.874 0.282 1.00 0.00 C ATOM 1345 C CYS A 87 -6.166 12.050 1.588 1.00 0.00 C ATOM 1346 O CYS A 87 -6.453 12.957 2.368 1.00 0.00 O ATOM 1347 CB CYS A 87 -8.033 10.815 0.458 1.00 0.00 C ATOM 1348 SG CYS A 87 -9.416 11.346 1.494 1.00 0.00 S ATOM 0 H CYS A 87 -5.164 11.117 -0.532 1.00 0.00 H new ATOM 0 HA CYS A 87 -7.403 12.831 0.037 1.00 0.00 H new ATOM 0 HB2 CYS A 87 -8.415 10.535 -0.524 1.00 0.00 H new ATOM 0 HB3 CYS A 87 -7.589 9.920 0.894 1.00 0.00 H new ATOM 0 HG CYS A 87 -10.506 10.758 1.098 1.00 0.00 H new ATOM 1354 N HIS A 88 -5.189 11.178 1.826 1.00 0.00 N ATOM 1355 CA HIS A 88 -4.385 11.245 3.048 1.00 0.00 C ATOM 1356 C HIS A 88 -2.910 10.973 2.762 1.00 0.00 C ATOM 1357 O HIS A 88 -2.474 9.822 2.770 1.00 0.00 O ATOM 1358 CB HIS A 88 -4.901 10.226 4.063 1.00 0.00 C ATOM 1359 CG HIS A 88 -5.447 10.847 5.311 1.00 0.00 C ATOM 1360 ND1 HIS A 88 -4.703 11.004 6.462 1.00 0.00 N ATOM 1361 CD2 HIS A 88 -6.672 11.354 5.585 1.00 0.00 C ATOM 1362 CE1 HIS A 88 -5.447 11.580 7.390 1.00 0.00 C ATOM 1363 NE2 HIS A 88 -6.645 11.802 6.883 1.00 0.00 N ATOM 0 H HIS A 88 -4.934 10.419 1.193 1.00 0.00 H new ATOM 0 HA HIS A 88 -4.475 12.253 3.453 1.00 0.00 H new ATOM 0 HB2 HIS A 88 -5.680 9.623 3.596 1.00 0.00 H new ATOM 0 HB3 HIS A 88 -4.090 9.548 4.329 1.00 0.00 H new ATOM 0 HD2 HIS A 88 -7.513 11.398 4.909 1.00 0.00 H new ATOM 0 HE1 HIS A 88 -5.129 11.827 8.392 1.00 0.00 H new ATOM 0 HE2 HIS A 88 -7.425 12.236 7.376 1.00 0.00 H new ATOM 1372 N GLU A 89 -2.145 12.029 2.503 1.00 0.00 N ATOM 1373 CA GLU A 89 -0.723 11.875 2.210 1.00 0.00 C ATOM 1374 C GLU A 89 -0.057 13.228 1.975 1.00 0.00 C ATOM 1375 O GLU A 89 -0.648 14.277 2.233 1.00 0.00 O ATOM 1376 CB GLU A 89 -0.542 10.986 0.977 1.00 0.00 C ATOM 1377 CG GLU A 89 0.220 9.701 1.249 1.00 0.00 C ATOM 1378 CD GLU A 89 1.715 9.855 1.044 1.00 0.00 C ATOM 1379 OE1 GLU A 89 2.329 10.678 1.755 1.00 0.00 O ATOM 1380 OE2 GLU A 89 2.270 9.153 0.174 1.00 0.00 O ATOM 0 H GLU A 89 -2.481 12.992 2.490 1.00 0.00 H new ATOM 0 HA GLU A 89 -0.247 11.408 3.072 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -1.524 10.736 0.575 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -0.017 11.552 0.208 1.00 0.00 H new ATOM 0 HG2 GLU A 89 0.029 9.379 2.273 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -0.154 8.915 0.593 1.00 0.00 H new ATOM 1387 N SER A 90 1.176 13.190 1.477 1.00 0.00 N ATOM 1388 CA SER A 90 1.927 14.407 1.197 1.00 0.00 C ATOM 1389 C SER A 90 1.422 15.069 -0.081 1.00 0.00 C ATOM 1390 O SER A 90 1.522 16.285 -0.244 1.00 0.00 O ATOM 1391 CB SER A 90 3.418 14.093 1.069 1.00 0.00 C ATOM 1392 OG SER A 90 4.197 15.276 1.128 1.00 0.00 O ATOM 0 H SER A 90 1.675 12.328 1.259 1.00 0.00 H new ATOM 0 HA SER A 90 1.781 15.098 2.028 1.00 0.00 H new ATOM 0 HB2 SER A 90 3.720 13.415 1.868 1.00 0.00 H new ATOM 0 HB3 SER A 90 3.604 13.578 0.127 1.00 0.00 H new ATOM 0 HG SER A 90 5.146 15.047 1.045 1.00 0.00 H new ATOM 1398 N PHE A 91 0.873 14.260 -0.984 1.00 0.00 N ATOM 1399 CA PHE A 91 0.346 14.767 -2.246 1.00 0.00 C ATOM 1400 C PHE A 91 -0.715 15.833 -1.999 1.00 0.00 C ATOM 1401 O PHE A 91 -0.629 16.944 -2.521 1.00 0.00 O ATOM 1402 CB PHE A 91 -0.252 13.625 -3.071 1.00 0.00 C ATOM 1403 CG PHE A 91 0.257 13.573 -4.482 1.00 0.00 C ATOM 1404 CD1 PHE A 91 -0.327 14.349 -5.471 1.00 0.00 C ATOM 1405 CD2 PHE A 91 1.319 12.751 -4.821 1.00 0.00 C ATOM 1406 CE1 PHE A 91 0.138 14.304 -6.772 1.00 0.00 C ATOM 1407 CE2 PHE A 91 1.790 12.702 -6.119 1.00 0.00 C ATOM 1408 CZ PHE A 91 1.198 13.480 -7.096 1.00 0.00 C ATOM 0 H PHE A 91 0.782 13.251 -0.864 1.00 0.00 H new ATOM 0 HA PHE A 91 1.170 15.215 -2.801 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -0.031 12.678 -2.579 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -1.337 13.730 -3.088 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -1.155 14.996 -5.222 1.00 0.00 H new ATOM 0 HD2 PHE A 91 1.785 12.141 -4.061 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -0.327 14.912 -7.534 1.00 0.00 H new ATOM 0 HE2 PHE A 91 2.619 12.057 -6.370 1.00 0.00 H new ATOM 0 HZ PHE A 91 1.564 13.444 -8.112 1.00 0.00 H new ATOM 1418 N VAL A 92 -1.717 15.482 -1.200 1.00 0.00 N ATOM 1419 CA VAL A 92 -2.798 16.403 -0.883 1.00 0.00 C ATOM 1420 C VAL A 92 -2.406 17.347 0.252 1.00 0.00 C ATOM 1421 O VAL A 92 -2.948 18.445 0.373 1.00 0.00 O ATOM 1422 CB VAL A 92 -4.082 15.650 -0.488 1.00 0.00 C ATOM 1423 CG1 VAL A 92 -4.654 14.907 -1.685 1.00 0.00 C ATOM 1424 CG2 VAL A 92 -3.809 14.692 0.663 1.00 0.00 C ATOM 0 H VAL A 92 -1.801 14.565 -0.761 1.00 0.00 H new ATOM 0 HA VAL A 92 -2.989 16.984 -1.785 1.00 0.00 H new ATOM 0 HB VAL A 92 -4.820 16.379 -0.155 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -5.561 14.381 -1.387 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -4.891 15.619 -2.476 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -3.921 14.188 -2.051 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -4.728 14.170 0.927 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -3.053 13.967 0.361 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -3.449 15.253 1.526 1.00 0.00 H new ATOM 1434 N LYS A 93 -1.463 16.909 1.082 1.00 0.00 N ATOM 1435 CA LYS A 93 -1.000 17.714 2.208 1.00 0.00 C ATOM 1436 C LYS A 93 0.060 18.724 1.773 1.00 0.00 C ATOM 1437 O LYS A 93 0.392 19.645 2.520 1.00 0.00 O ATOM 1438 CB LYS A 93 -0.436 16.809 3.306 1.00 0.00 C ATOM 1439 CG LYS A 93 -0.088 17.552 4.586 1.00 0.00 C ATOM 1440 CD LYS A 93 1.352 18.042 4.575 1.00 0.00 C ATOM 1441 CE LYS A 93 2.183 17.363 5.652 1.00 0.00 C ATOM 1442 NZ LYS A 93 2.598 15.990 5.250 1.00 0.00 N ATOM 0 H LYS A 93 -1.005 16.002 0.996 1.00 0.00 H new ATOM 0 HA LYS A 93 -1.855 18.267 2.597 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -1.164 16.031 3.534 1.00 0.00 H new ATOM 0 HB3 LYS A 93 0.457 16.310 2.931 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -0.761 18.401 4.709 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -0.243 16.895 5.442 1.00 0.00 H new ATOM 0 HD2 LYS A 93 1.795 17.850 3.598 1.00 0.00 H new ATOM 0 HD3 LYS A 93 1.371 19.121 4.727 1.00 0.00 H new ATOM 0 HE2 LYS A 93 3.068 17.964 5.860 1.00 0.00 H new ATOM 0 HE3 LYS A 93 1.608 17.312 6.576 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 3.162 15.561 6.011 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 1.753 15.409 5.076 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 3.169 16.040 4.382 1.00 0.00 H new ATOM 1456 N ALA A 94 0.593 18.550 0.566 1.00 0.00 N ATOM 1457 CA ALA A 94 1.615 19.450 0.046 1.00 0.00 C ATOM 1458 C ALA A 94 0.991 20.709 -0.547 1.00 0.00 C ATOM 1459 O ALA A 94 1.529 21.807 -0.400 1.00 0.00 O ATOM 1460 CB ALA A 94 2.463 18.739 -0.997 1.00 0.00 C ATOM 0 H ALA A 94 0.333 17.795 -0.068 1.00 0.00 H new ATOM 0 HA ALA A 94 2.254 19.750 0.876 1.00 0.00 H new ATOM 0 HB1 ALA A 94 3.222 19.423 -1.377 1.00 0.00 H new ATOM 0 HB2 ALA A 94 2.948 17.874 -0.544 1.00 0.00 H new ATOM 0 HB3 ALA A 94 1.828 18.409 -1.819 1.00 0.00 H new ATOM 1466 N ALA A 95 -0.143 20.544 -1.219 1.00 0.00 N ATOM 1467 CA ALA A 95 -0.835 21.669 -1.836 1.00 0.00 C ATOM 1468 C ALA A 95 -2.329 21.643 -1.518 1.00 0.00 C ATOM 1469 O ALA A 95 -3.166 21.707 -2.420 1.00 0.00 O ATOM 1470 CB ALA A 95 -0.610 21.661 -3.341 1.00 0.00 C ATOM 0 H ALA A 95 -0.602 19.643 -1.350 1.00 0.00 H new ATOM 0 HA ALA A 95 -0.423 22.589 -1.422 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -1.131 22.506 -3.791 1.00 0.00 H new ATOM 0 HB2 ALA A 95 0.457 21.740 -3.550 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -0.994 20.732 -3.761 1.00 0.00 H new ATOM 1476 N PRO A 96 -2.686 21.548 -0.224 1.00 0.00 N ATOM 1477 CA PRO A 96 -4.077 21.512 0.226 1.00 0.00 C ATOM 1478 C PRO A 96 -4.978 22.486 -0.539 1.00 0.00 C ATOM 1479 O PRO A 96 -5.956 22.071 -1.160 1.00 0.00 O ATOM 1480 CB PRO A 96 -3.980 21.889 1.717 1.00 0.00 C ATOM 1481 CG PRO A 96 -2.537 22.188 1.978 1.00 0.00 C ATOM 1482 CD PRO A 96 -1.776 21.463 0.917 1.00 0.00 C ATOM 0 HA PRO A 96 -4.535 20.538 0.053 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -4.604 22.754 1.941 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -4.329 21.072 2.349 1.00 0.00 H new ATOM 0 HG2 PRO A 96 -2.345 23.260 1.934 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -2.241 21.851 2.972 1.00 0.00 H new ATOM 0 HD2 PRO A 96 -0.816 21.935 0.709 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -1.569 20.430 1.197 1.00 0.00 H new ATOM 1490 N PRO A 97 -4.664 23.795 -0.516 1.00 0.00 N ATOM 1491 CA PRO A 97 -5.461 24.805 -1.222 1.00 0.00 C ATOM 1492 C PRO A 97 -5.310 24.697 -2.735 1.00 0.00 C ATOM 1493 O PRO A 97 -6.254 24.949 -3.485 1.00 0.00 O ATOM 1494 CB PRO A 97 -4.882 26.128 -0.721 1.00 0.00 C ATOM 1495 CG PRO A 97 -3.480 25.801 -0.344 1.00 0.00 C ATOM 1496 CD PRO A 97 -3.518 24.396 0.189 1.00 0.00 C ATOM 0 HA PRO A 97 -6.528 24.694 -1.030 1.00 0.00 H new ATOM 0 HB2 PRO A 97 -4.917 26.895 -1.495 1.00 0.00 H new ATOM 0 HB3 PRO A 97 -5.444 26.510 0.132 1.00 0.00 H new ATOM 0 HG2 PRO A 97 -2.816 25.875 -1.205 1.00 0.00 H new ATOM 0 HG3 PRO A 97 -3.105 26.495 0.408 1.00 0.00 H new ATOM 0 HD2 PRO A 97 -2.592 23.861 -0.021 1.00 0.00 H new ATOM 0 HD3 PRO A 97 -3.658 24.380 1.270 1.00 0.00 H new ATOM 1504 N GLN A 98 -4.113 24.322 -3.176 1.00 0.00 N ATOM 1505 CA GLN A 98 -3.832 24.180 -4.600 1.00 0.00 C ATOM 1506 C GLN A 98 -4.379 22.859 -5.133 1.00 0.00 C ATOM 1507 O GLN A 98 -3.800 21.798 -4.904 1.00 0.00 O ATOM 1508 CB GLN A 98 -2.324 24.263 -4.852 1.00 0.00 C ATOM 1509 CG GLN A 98 -1.854 25.645 -5.276 1.00 0.00 C ATOM 1510 CD GLN A 98 -0.622 25.597 -6.157 1.00 0.00 C ATOM 1511 OE1 GLN A 98 0.428 25.099 -5.749 1.00 0.00 O ATOM 1512 NE2 GLN A 98 -0.743 26.116 -7.373 1.00 0.00 N ATOM 0 H GLN A 98 -3.322 24.111 -2.567 1.00 0.00 H new ATOM 0 HA GLN A 98 -4.327 24.995 -5.128 1.00 0.00 H new ATOM 0 HB2 GLN A 98 -1.796 23.971 -3.944 1.00 0.00 H new ATOM 0 HB3 GLN A 98 -2.053 23.543 -5.624 1.00 0.00 H new ATOM 0 HG2 GLN A 98 -2.659 26.150 -5.810 1.00 0.00 H new ATOM 0 HG3 GLN A 98 -1.638 26.240 -4.388 1.00 0.00 H new ATOM 0 HE21 GLN A 98 -1.632 26.518 -7.670 1.00 0.00 H new ATOM 0 HE22 GLN A 98 0.053 26.112 -8.011 1.00 0.00 H new ATOM 1521 N LYS A 99 -5.500 22.933 -5.843 1.00 0.00 N ATOM 1522 CA LYS A 99 -6.126 21.743 -6.408 1.00 0.00 C ATOM 1523 C LYS A 99 -6.714 22.038 -7.785 1.00 0.00 C ATOM 1524 O LYS A 99 -6.552 21.254 -8.720 1.00 0.00 O ATOM 1525 CB LYS A 99 -7.221 21.226 -5.473 1.00 0.00 C ATOM 1526 CG LYS A 99 -6.693 20.732 -4.134 1.00 0.00 C ATOM 1527 CD LYS A 99 -7.289 19.384 -3.761 1.00 0.00 C ATOM 1528 CE LYS A 99 -6.335 18.244 -4.086 1.00 0.00 C ATOM 1529 NZ LYS A 99 -6.355 17.188 -3.038 1.00 0.00 N ATOM 0 H LYS A 99 -5.993 23.804 -6.041 1.00 0.00 H new ATOM 0 HA LYS A 99 -5.359 20.976 -6.518 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -7.944 22.023 -5.298 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -7.755 20.414 -5.966 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -5.607 20.651 -4.178 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -6.927 21.461 -3.358 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -7.524 19.371 -2.697 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -8.227 19.239 -4.297 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -6.606 17.807 -5.047 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -5.323 18.635 -4.188 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -6.361 16.251 -3.489 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -5.510 17.278 -2.438 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -7.208 17.296 -2.453 1.00 0.00 H new ATOM 1543 N ARG A 100 -7.398 23.173 -7.903 1.00 0.00 N ATOM 1544 CA ARG A 100 -8.011 23.573 -9.167 1.00 0.00 C ATOM 1545 C ARG A 100 -7.003 23.510 -10.311 1.00 0.00 C ATOM 1546 O ARG A 100 -5.795 23.440 -10.085 1.00 0.00 O ATOM 1547 CB ARG A 100 -8.580 24.988 -9.053 1.00 0.00 C ATOM 1548 CG ARG A 100 -7.582 26.004 -8.522 1.00 0.00 C ATOM 1549 CD ARG A 100 -8.052 27.428 -8.769 1.00 0.00 C ATOM 1550 NE ARG A 100 -9.205 27.775 -7.943 1.00 0.00 N ATOM 1551 CZ ARG A 100 -9.584 29.025 -7.685 1.00 0.00 C ATOM 1552 NH1 ARG A 100 -8.905 30.049 -8.188 1.00 0.00 N ATOM 1553 NH2 ARG A 100 -10.646 29.253 -6.925 1.00 0.00 N ATOM 0 H ARG A 100 -7.542 23.833 -7.138 1.00 0.00 H new ATOM 0 HA ARG A 100 -8.820 22.876 -9.384 1.00 0.00 H new ATOM 0 HB2 ARG A 100 -8.927 25.311 -10.034 1.00 0.00 H new ATOM 0 HB3 ARG A 100 -9.450 24.969 -8.397 1.00 0.00 H new ATOM 0 HG2 ARG A 100 -7.436 25.848 -7.453 1.00 0.00 H new ATOM 0 HG3 ARG A 100 -6.615 25.851 -9.001 1.00 0.00 H new ATOM 0 HD2 ARG A 100 -7.236 28.120 -8.561 1.00 0.00 H new ATOM 0 HD3 ARG A 100 -8.311 27.547 -9.821 1.00 0.00 H new ATOM 0 HE ARG A 100 -9.753 27.015 -7.540 1.00 0.00 H new ATOM 0 HH11 ARG A 100 -8.088 29.880 -8.775 1.00 0.00 H new ATOM 0 HH12 ARG A 100 -9.200 31.005 -7.987 1.00 0.00 H new ATOM 0 HH21 ARG A 100 -11.173 28.471 -6.537 1.00 0.00 H new ATOM 0 HH22 ARG A 100 -10.936 30.211 -6.728 1.00 0.00 H new ATOM 1566 N PHE A 101 -7.508 23.536 -11.540 1.00 0.00 N ATOM 1567 CA PHE A 101 -6.652 23.481 -12.720 1.00 0.00 C ATOM 1568 C PHE A 101 -5.844 22.189 -12.746 1.00 0.00 C ATOM 1569 O PHE A 101 -4.771 22.149 -12.108 1.00 0.00 O ATOM 1570 CB PHE A 101 -5.710 24.687 -12.748 1.00 0.00 C ATOM 1571 CG PHE A 101 -6.373 25.957 -13.195 1.00 0.00 C ATOM 1572 CD1 PHE A 101 -6.448 26.278 -14.541 1.00 0.00 C ATOM 1573 CD2 PHE A 101 -6.923 26.830 -12.269 1.00 0.00 C ATOM 1574 CE1 PHE A 101 -7.057 27.447 -14.955 1.00 0.00 C ATOM 1575 CE2 PHE A 101 -7.534 28.000 -12.678 1.00 0.00 C ATOM 1576 CZ PHE A 101 -7.602 28.310 -14.023 1.00 0.00 C ATOM 1577 OXT PHE A 101 -6.290 21.225 -13.405 1.00 0.00 O ATOM 0 H PHE A 101 -8.505 23.595 -11.745 1.00 0.00 H new ATOM 0 HA PHE A 101 -7.290 23.506 -13.603 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -5.294 24.836 -11.752 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -4.874 24.469 -13.413 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -6.026 25.607 -15.274 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -6.873 26.593 -11.216 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -7.107 27.686 -16.007 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -7.958 28.672 -11.947 1.00 0.00 H new ATOM 0 HZ PHE A 101 -8.079 29.224 -14.345 1.00 0.00 H new TER 1587 PHE A 101 ATOM 1588 N SER B 1 -16.050 7.504 14.004 1.00 0.00 N ATOM 1589 CA SER B 1 -15.060 6.583 13.387 1.00 0.00 C ATOM 1590 C SER B 1 -13.740 7.297 13.111 1.00 0.00 C ATOM 1591 O SER B 1 -13.723 8.466 12.726 1.00 0.00 O ATOM 1592 CB SER B 1 -15.649 6.040 12.083 1.00 0.00 C ATOM 1593 OG SER B 1 -16.595 6.941 11.535 1.00 0.00 O ATOM 0 H1 SER B 1 -16.518 7.027 14.801 1.00 0.00 H new ATOM 0 H2 SER B 1 -15.564 8.357 14.347 1.00 0.00 H new ATOM 0 H3 SER B 1 -16.762 7.773 13.296 1.00 0.00 H new ATOM 0 HA SER B 1 -14.852 5.765 14.077 1.00 0.00 H new ATOM 0 HB2 SER B 1 -14.849 5.867 11.364 1.00 0.00 H new ATOM 0 HB3 SER B 1 -16.125 5.077 12.269 1.00 0.00 H new ATOM 0 HG SER B 1 -16.955 6.571 10.702 1.00 0.00 H new ATOM 1601 N ARG B 2 -12.635 6.583 13.308 1.00 0.00 N ATOM 1602 CA ARG B 2 -11.307 7.145 13.079 1.00 0.00 C ATOM 1603 C ARG B 2 -10.216 6.115 13.368 1.00 0.00 C ATOM 1604 O ARG B 2 -9.317 5.914 12.556 1.00 0.00 O ATOM 1605 CB ARG B 2 -11.093 8.390 13.945 1.00 0.00 C ATOM 1606 CG ARG B 2 -10.205 9.439 13.293 1.00 0.00 C ATOM 1607 CD ARG B 2 -11.010 10.395 12.424 1.00 0.00 C ATOM 1608 NE ARG B 2 -10.548 10.393 11.038 1.00 0.00 N ATOM 1609 CZ ARG B 2 -10.776 11.384 10.178 1.00 0.00 C ATOM 1610 NH1 ARG B 2 -11.461 12.457 10.554 1.00 0.00 N ATOM 1611 NH2 ARG B 2 -10.317 11.301 8.937 1.00 0.00 N ATOM 0 H ARG B 2 -12.633 5.614 13.626 1.00 0.00 H new ATOM 0 HA ARG B 2 -11.243 7.429 12.029 1.00 0.00 H new ATOM 0 HB2 ARG B 2 -12.062 8.836 14.172 1.00 0.00 H new ATOM 0 HB3 ARG B 2 -10.650 8.090 14.895 1.00 0.00 H new ATOM 0 HG2 ARG B 2 -9.680 10.002 14.065 1.00 0.00 H new ATOM 0 HG3 ARG B 2 -9.445 8.947 12.686 1.00 0.00 H new ATOM 0 HD2 ARG B 2 -12.063 10.115 12.456 1.00 0.00 H new ATOM 0 HD3 ARG B 2 -10.936 11.404 12.830 1.00 0.00 H new ATOM 0 HE ARG B 2 -10.020 9.585 10.710 1.00 0.00 H new ATOM 0 HH11 ARG B 2 -11.817 12.527 11.507 1.00 0.00 H new ATOM 0 HH12 ARG B 2 -11.632 13.212 9.890 1.00 0.00 H new ATOM 0 HH21 ARG B 2 -9.790 10.479 8.642 1.00 0.00 H new ATOM 0 HH22 ARG B 2 -10.491 12.059 8.277 1.00 0.00 H new ATOM 1624 N PRO B 3 -10.271 5.456 14.540 1.00 0.00 N ATOM 1625 CA PRO B 3 -9.280 4.451 14.951 1.00 0.00 C ATOM 1626 C PRO B 3 -9.474 3.094 14.269 1.00 0.00 C ATOM 1627 O PRO B 3 -8.987 2.075 14.759 1.00 0.00 O ATOM 1628 CB PRO B 3 -9.544 4.305 16.459 1.00 0.00 C ATOM 1629 CG PRO B 3 -10.445 5.437 16.812 1.00 0.00 C ATOM 1630 CD PRO B 3 -11.274 5.638 15.591 1.00 0.00 C ATOM 0 HA PRO B 3 -8.269 4.760 14.685 1.00 0.00 H new ATOM 0 HB2 PRO B 3 -10.010 3.346 16.686 1.00 0.00 H new ATOM 0 HB3 PRO B 3 -8.615 4.350 17.027 1.00 0.00 H new ATOM 0 HG2 PRO B 3 -11.063 5.199 17.678 1.00 0.00 H new ATOM 0 HG3 PRO B 3 -9.878 6.334 17.061 1.00 0.00 H new ATOM 0 HD2 PRO B 3 -12.084 4.912 15.518 1.00 0.00 H new ATOM 0 HD3 PRO B 3 -11.729 6.628 15.560 1.00 0.00 H new ATOM 1638 N THR B 4 -10.191 3.076 13.152 1.00 0.00 N ATOM 1639 CA THR B 4 -10.445 1.830 12.436 1.00 0.00 C ATOM 1640 C THR B 4 -9.151 1.198 11.957 1.00 0.00 C ATOM 1641 O THR B 4 -8.205 1.885 11.573 1.00 0.00 O ATOM 1642 CB THR B 4 -11.421 2.033 11.264 1.00 0.00 C ATOM 1643 OG1 THR B 4 -11.305 0.977 10.329 1.00 0.00 O ATOM 1644 CG2 THR B 4 -11.232 3.330 10.506 1.00 0.00 C ATOM 0 H THR B 4 -10.605 3.904 12.724 1.00 0.00 H new ATOM 0 HA THR B 4 -10.917 1.146 13.141 1.00 0.00 H new ATOM 0 HB THR B 4 -12.405 2.058 11.732 1.00 0.00 H new ATOM 0 HG1 THR B 4 -11.934 1.122 9.592 1.00 0.00 H new ATOM 0 HG21 THR B 4 -11.962 3.389 9.698 1.00 0.00 H new ATOM 0 HG22 THR B 4 -11.373 4.172 11.184 1.00 0.00 H new ATOM 0 HG23 THR B 4 -10.225 3.364 10.089 1.00 0.00 H new ATOM 1652 N GLU B 5 -9.124 -0.129 12.004 1.00 0.00 N ATOM 1653 CA GLU B 5 -7.961 -0.905 11.600 1.00 0.00 C ATOM 1654 C GLU B 5 -7.373 -0.384 10.293 1.00 0.00 C ATOM 1655 O GLU B 5 -6.156 -0.272 10.152 1.00 0.00 O ATOM 1656 CB GLU B 5 -8.361 -2.369 11.455 1.00 0.00 C ATOM 1657 CG GLU B 5 -7.340 -3.339 12.027 1.00 0.00 C ATOM 1658 CD GLU B 5 -7.934 -4.703 12.323 1.00 0.00 C ATOM 1659 OE1 GLU B 5 -8.482 -5.326 11.392 1.00 0.00 O ATOM 1660 OE2 GLU B 5 -7.850 -5.146 13.488 1.00 0.00 O ATOM 0 H GLU B 5 -9.909 -0.696 12.324 1.00 0.00 H new ATOM 0 HA GLU B 5 -7.193 -0.808 12.367 1.00 0.00 H new ATOM 0 HB2 GLU B 5 -9.318 -2.526 11.953 1.00 0.00 H new ATOM 0 HB3 GLU B 5 -8.511 -2.593 10.399 1.00 0.00 H new ATOM 0 HG2 GLU B 5 -6.516 -3.451 11.322 1.00 0.00 H new ATOM 0 HG3 GLU B 5 -6.922 -2.922 12.943 1.00 0.00 H new ATOM 1667 N THR B 6 -8.242 -0.053 9.346 1.00 0.00 N ATOM 1668 CA THR B 6 -7.793 0.471 8.067 1.00 0.00 C ATOM 1669 C THR B 6 -7.274 1.893 8.240 1.00 0.00 C ATOM 1670 O THR B 6 -6.245 2.261 7.686 1.00 0.00 O ATOM 1671 CB THR B 6 -8.925 0.444 7.041 1.00 0.00 C ATOM 1672 OG1 THR B 6 -9.816 -0.625 7.303 1.00 0.00 O ATOM 1673 CG2 THR B 6 -8.431 0.294 5.618 1.00 0.00 C ATOM 0 H THR B 6 -9.254 -0.138 9.440 1.00 0.00 H new ATOM 0 HA THR B 6 -6.985 -0.162 7.700 1.00 0.00 H new ATOM 0 HB THR B 6 -9.429 1.406 7.137 1.00 0.00 H new ATOM 0 HG1 THR B 6 -9.518 -1.425 6.821 1.00 0.00 H new ATOM 0 HG21 THR B 6 -9.282 0.281 4.937 1.00 0.00 H new ATOM 0 HG22 THR B 6 -7.779 1.131 5.369 1.00 0.00 H new ATOM 0 HG23 THR B 6 -7.876 -0.639 5.522 1.00 0.00 H new ATOM 1681 N GLU B 7 -7.980 2.688 9.032 1.00 0.00 N ATOM 1682 CA GLU B 7 -7.567 4.065 9.277 1.00 0.00 C ATOM 1683 C GLU B 7 -6.111 4.099 9.721 1.00 0.00 C ATOM 1684 O GLU B 7 -5.314 4.895 9.223 1.00 0.00 O ATOM 1685 CB GLU B 7 -8.456 4.704 10.344 1.00 0.00 C ATOM 1686 CG GLU B 7 -9.517 5.631 9.773 1.00 0.00 C ATOM 1687 CD GLU B 7 -8.940 6.948 9.290 1.00 0.00 C ATOM 1688 OE1 GLU B 7 -7.992 7.451 9.930 1.00 0.00 O ATOM 1689 OE2 GLU B 7 -9.435 7.477 8.273 1.00 0.00 O ATOM 0 H GLU B 7 -8.835 2.407 9.513 1.00 0.00 H new ATOM 0 HA GLU B 7 -7.670 4.632 8.352 1.00 0.00 H new ATOM 0 HB2 GLU B 7 -8.944 3.917 10.919 1.00 0.00 H new ATOM 0 HB3 GLU B 7 -7.831 5.265 11.039 1.00 0.00 H new ATOM 0 HG2 GLU B 7 -10.021 5.134 8.945 1.00 0.00 H new ATOM 0 HG3 GLU B 7 -10.272 5.826 10.535 1.00 0.00 H new ATOM 1696 N ARG B 8 -5.769 3.213 10.644 1.00 0.00 N ATOM 1697 CA ARG B 8 -4.404 3.117 11.143 1.00 0.00 C ATOM 1698 C ARG B 8 -3.493 2.472 10.098 1.00 0.00 C ATOM 1699 O ARG B 8 -2.285 2.711 10.080 1.00 0.00 O ATOM 1700 CB ARG B 8 -4.367 2.308 12.441 1.00 0.00 C ATOM 1701 CG ARG B 8 -4.924 3.055 13.641 1.00 0.00 C ATOM 1702 CD ARG B 8 -6.016 2.261 14.341 1.00 0.00 C ATOM 1703 NE ARG B 8 -5.481 1.094 15.040 1.00 0.00 N ATOM 1704 CZ ARG B 8 -6.137 0.437 15.994 1.00 0.00 C ATOM 1705 NH1 ARG B 8 -7.352 0.825 16.364 1.00 0.00 N ATOM 1706 NH2 ARG B 8 -5.578 -0.615 16.579 1.00 0.00 N ATOM 0 H ARG B 8 -6.419 2.548 11.064 1.00 0.00 H new ATOM 0 HA ARG B 8 -4.043 4.125 11.345 1.00 0.00 H new ATOM 0 HB2 ARG B 8 -4.934 1.388 12.302 1.00 0.00 H new ATOM 0 HB3 ARG B 8 -3.337 2.019 12.650 1.00 0.00 H new ATOM 0 HG2 ARG B 8 -4.119 3.265 14.345 1.00 0.00 H new ATOM 0 HG3 ARG B 8 -5.323 4.016 13.318 1.00 0.00 H new ATOM 0 HD2 ARG B 8 -6.533 2.905 15.053 1.00 0.00 H new ATOM 0 HD3 ARG B 8 -6.755 1.938 13.608 1.00 0.00 H new ATOM 0 HE ARG B 8 -4.551 0.764 14.782 1.00 0.00 H new ATOM 0 HH11 ARG B 8 -7.788 1.631 15.916 1.00 0.00 H new ATOM 0 HH12 ARG B 8 -7.849 0.317 17.096 1.00 0.00 H new ATOM 0 HH21 ARG B 8 -4.646 -0.920 16.298 1.00 0.00 H new ATOM 0 HH22 ARG B 8 -6.080 -1.119 17.310 1.00 0.00 H new ATOM 1719 N CYS B 9 -4.082 1.644 9.233 1.00 0.00 N ATOM 1720 CA CYS B 9 -3.325 0.953 8.191 1.00 0.00 C ATOM 1721 C CYS B 9 -2.726 1.936 7.185 1.00 0.00 C ATOM 1722 O CYS B 9 -1.588 1.770 6.745 1.00 0.00 O ATOM 1723 CB CYS B 9 -4.217 -0.079 7.475 1.00 0.00 C ATOM 1724 SG CYS B 9 -5.071 0.516 5.990 1.00 0.00 S ATOM 0 H CYS B 9 -5.081 1.437 9.235 1.00 0.00 H new ATOM 0 HA CYS B 9 -2.498 0.430 8.672 1.00 0.00 H new ATOM 0 HB2 CYS B 9 -3.601 -0.935 7.199 1.00 0.00 H new ATOM 0 HB3 CYS B 9 -4.964 -0.439 8.182 1.00 0.00 H new ATOM 0 HG CYS B 9 -5.974 1.388 6.329 1.00 0.00 H new ATOM 1730 N ILE B 10 -3.501 2.949 6.815 1.00 0.00 N ATOM 1731 CA ILE B 10 -3.052 3.941 5.853 1.00 0.00 C ATOM 1732 C ILE B 10 -2.030 4.897 6.459 1.00 0.00 C ATOM 1733 O ILE B 10 -0.965 5.113 5.889 1.00 0.00 O ATOM 1734 CB ILE B 10 -4.239 4.754 5.300 1.00 0.00 C ATOM 1735 CG1 ILE B 10 -5.260 3.827 4.650 1.00 0.00 C ATOM 1736 CG2 ILE B 10 -3.764 5.785 4.292 1.00 0.00 C ATOM 1737 CD1 ILE B 10 -6.510 3.626 5.467 1.00 0.00 C ATOM 0 H ILE B 10 -4.445 3.103 7.169 1.00 0.00 H new ATOM 0 HA ILE B 10 -2.577 3.393 5.039 1.00 0.00 H new ATOM 0 HB ILE B 10 -4.710 5.274 6.134 1.00 0.00 H new ATOM 0 HG12 ILE B 10 -5.536 4.232 3.676 1.00 0.00 H new ATOM 0 HG13 ILE B 10 -4.794 2.858 4.472 1.00 0.00 H new ATOM 0 HG21 ILE B 10 -4.619 6.347 3.915 1.00 0.00 H new ATOM 0 HG22 ILE B 10 -3.064 6.469 4.773 1.00 0.00 H new ATOM 0 HG23 ILE B 10 -3.267 5.281 3.463 1.00 0.00 H new ATOM 0 HD11 ILE B 10 -7.186 2.955 4.938 1.00 0.00 H new ATOM 0 HD12 ILE B 10 -6.248 3.191 6.432 1.00 0.00 H new ATOM 0 HD13 ILE B 10 -7.001 4.587 5.623 1.00 0.00 H new ATOM 1749 N GLU B 11 -2.361 5.478 7.606 1.00 0.00 N ATOM 1750 CA GLU B 11 -1.467 6.427 8.259 1.00 0.00 C ATOM 1751 C GLU B 11 -0.063 5.856 8.427 1.00 0.00 C ATOM 1752 O GLU B 11 0.915 6.601 8.481 1.00 0.00 O ATOM 1753 CB GLU B 11 -2.029 6.855 9.614 1.00 0.00 C ATOM 1754 CG GLU B 11 -2.075 8.364 9.785 1.00 0.00 C ATOM 1755 CD GLU B 11 -1.679 8.806 11.180 1.00 0.00 C ATOM 1756 OE1 GLU B 11 -0.508 8.596 11.560 1.00 0.00 O ATOM 1757 OE2 GLU B 11 -2.541 9.363 11.893 1.00 0.00 O ATOM 0 H GLU B 11 -3.237 5.310 8.101 1.00 0.00 H new ATOM 0 HA GLU B 11 -1.396 7.303 7.614 1.00 0.00 H new ATOM 0 HB2 GLU B 11 -3.035 6.451 9.729 1.00 0.00 H new ATOM 0 HB3 GLU B 11 -1.419 6.423 10.407 1.00 0.00 H new ATOM 0 HG2 GLU B 11 -1.409 8.829 9.058 1.00 0.00 H new ATOM 0 HG3 GLU B 11 -3.082 8.720 9.567 1.00 0.00 H new ATOM 1764 N SER B 12 0.033 4.537 8.513 1.00 0.00 N ATOM 1765 CA SER B 12 1.324 3.884 8.680 1.00 0.00 C ATOM 1766 C SER B 12 2.107 3.843 7.365 1.00 0.00 C ATOM 1767 O SER B 12 3.242 4.308 7.300 1.00 0.00 O ATOM 1768 CB SER B 12 1.127 2.466 9.211 1.00 0.00 C ATOM 1769 OG SER B 12 2.251 2.041 9.962 1.00 0.00 O ATOM 0 H SER B 12 -0.763 3.900 8.470 1.00 0.00 H new ATOM 0 HA SER B 12 1.902 4.466 9.398 1.00 0.00 H new ATOM 0 HB2 SER B 12 0.234 2.429 9.835 1.00 0.00 H new ATOM 0 HB3 SER B 12 0.963 1.782 8.378 1.00 0.00 H new ATOM 0 HG SER B 12 1.993 1.297 10.545 1.00 0.00 H new ATOM 1775 N LEU B 13 1.499 3.276 6.326 1.00 0.00 N ATOM 1776 CA LEU B 13 2.146 3.160 5.022 1.00 0.00 C ATOM 1777 C LEU B 13 2.545 4.522 4.449 1.00 0.00 C ATOM 1778 O LEU B 13 3.498 4.631 3.679 1.00 0.00 O ATOM 1779 CB LEU B 13 1.230 2.415 4.058 1.00 0.00 C ATOM 1780 CG LEU B 13 1.445 0.903 4.035 1.00 0.00 C ATOM 1781 CD1 LEU B 13 2.857 0.579 3.583 1.00 0.00 C ATOM 1782 CD2 LEU B 13 1.189 0.296 5.405 1.00 0.00 C ATOM 0 H LEU B 13 0.556 2.889 6.362 1.00 0.00 H new ATOM 0 HA LEU B 13 3.068 2.594 5.156 1.00 0.00 H new ATOM 0 HB2 LEU B 13 0.194 2.620 4.327 1.00 0.00 H new ATOM 0 HB3 LEU B 13 1.382 2.808 3.053 1.00 0.00 H new ATOM 0 HG LEU B 13 0.735 0.472 3.329 1.00 0.00 H new ATOM 0 HD11 LEU B 13 2.996 -0.502 3.571 1.00 0.00 H new ATOM 0 HD12 LEU B 13 3.019 0.977 2.581 1.00 0.00 H new ATOM 0 HD13 LEU B 13 3.572 1.029 4.272 1.00 0.00 H new ATOM 0 HD21 LEU B 13 1.349 -0.781 5.361 1.00 0.00 H new ATOM 0 HD22 LEU B 13 1.873 0.735 6.131 1.00 0.00 H new ATOM 0 HD23 LEU B 13 0.161 0.498 5.706 1.00 0.00 H new ATOM 1794 N ILE B 14 1.827 5.560 4.832 1.00 0.00 N ATOM 1795 CA ILE B 14 2.128 6.896 4.371 1.00 0.00 C ATOM 1796 C ILE B 14 3.411 7.393 4.974 1.00 0.00 C ATOM 1797 O ILE B 14 4.207 8.076 4.334 1.00 0.00 O ATOM 1798 CB ILE B 14 1.067 7.882 4.839 1.00 0.00 C ATOM 1799 CG1 ILE B 14 -0.317 7.433 4.436 1.00 0.00 C ATOM 1800 CG2 ILE B 14 1.373 9.263 4.318 1.00 0.00 C ATOM 1801 CD1 ILE B 14 -1.373 7.990 5.350 1.00 0.00 C ATOM 0 H ILE B 14 1.029 5.500 5.464 1.00 0.00 H new ATOM 0 HA ILE B 14 2.182 6.839 3.284 1.00 0.00 H new ATOM 0 HB ILE B 14 1.087 7.916 5.928 1.00 0.00 H new ATOM 0 HG12 ILE B 14 -0.518 7.750 3.413 1.00 0.00 H new ATOM 0 HG13 ILE B 14 -0.364 6.344 4.448 1.00 0.00 H new ATOM 0 HG21 ILE B 14 0.607 9.959 4.660 1.00 0.00 H new ATOM 0 HG22 ILE B 14 2.346 9.584 4.689 1.00 0.00 H new ATOM 0 HG23 ILE B 14 1.387 9.246 3.228 1.00 0.00 H new ATOM 0 HD11 ILE B 14 -2.354 7.643 5.026 1.00 0.00 H new ATOM 0 HD12 ILE B 14 -1.187 7.652 6.369 1.00 0.00 H new ATOM 0 HD13 ILE B 14 -1.344 9.079 5.318 1.00 0.00 H new ATOM 1813 N ALA B 15 3.544 7.091 6.247 1.00 0.00 N ATOM 1814 CA ALA B 15 4.655 7.541 7.039 1.00 0.00 C ATOM 1815 C ALA B 15 5.936 6.797 6.718 1.00 0.00 C ATOM 1816 O ALA B 15 7.010 7.395 6.669 1.00 0.00 O ATOM 1817 CB ALA B 15 4.260 7.426 8.490 1.00 0.00 C ATOM 0 H ALA B 15 2.874 6.520 6.762 1.00 0.00 H new ATOM 0 HA ALA B 15 4.880 8.581 6.804 1.00 0.00 H new ATOM 0 HB1 ALA B 15 5.085 7.761 9.119 1.00 0.00 H new ATOM 0 HB2 ALA B 15 3.384 8.047 8.679 1.00 0.00 H new ATOM 0 HB3 ALA B 15 4.026 6.387 8.722 1.00 0.00 H new ATOM 1823 N VAL B 16 5.822 5.506 6.459 1.00 0.00 N ATOM 1824 CA VAL B 16 6.976 4.714 6.095 1.00 0.00 C ATOM 1825 C VAL B 16 7.697 5.388 4.939 1.00 0.00 C ATOM 1826 O VAL B 16 8.924 5.367 4.841 1.00 0.00 O ATOM 1827 CB VAL B 16 6.545 3.311 5.641 1.00 0.00 C ATOM 1828 CG1 VAL B 16 5.737 2.617 6.714 1.00 0.00 C ATOM 1829 CG2 VAL B 16 5.727 3.414 4.373 1.00 0.00 C ATOM 0 H VAL B 16 4.944 4.988 6.495 1.00 0.00 H new ATOM 0 HA VAL B 16 7.629 4.630 6.964 1.00 0.00 H new ATOM 0 HB VAL B 16 7.442 2.721 5.453 1.00 0.00 H new ATOM 0 HG11 VAL B 16 5.445 1.626 6.366 1.00 0.00 H new ATOM 0 HG12 VAL B 16 6.339 2.522 7.618 1.00 0.00 H new ATOM 0 HG13 VAL B 16 4.844 3.202 6.933 1.00 0.00 H new ATOM 0 HG21 VAL B 16 5.423 2.417 4.054 1.00 0.00 H new ATOM 0 HG22 VAL B 16 4.841 4.021 4.560 1.00 0.00 H new ATOM 0 HG23 VAL B 16 6.326 3.878 3.590 1.00 0.00 H new ATOM 1839 N PHE B 17 6.893 5.966 4.050 1.00 0.00 N ATOM 1840 CA PHE B 17 7.406 6.636 2.862 1.00 0.00 C ATOM 1841 C PHE B 17 7.914 8.054 3.140 1.00 0.00 C ATOM 1842 O PHE B 17 9.060 8.369 2.828 1.00 0.00 O ATOM 1843 CB PHE B 17 6.320 6.669 1.777 1.00 0.00 C ATOM 1844 CG PHE B 17 6.463 7.802 0.796 1.00 0.00 C ATOM 1845 CD1 PHE B 17 7.622 7.948 0.050 1.00 0.00 C ATOM 1846 CD2 PHE B 17 5.440 8.720 0.624 1.00 0.00 C ATOM 1847 CE1 PHE B 17 7.758 8.990 -0.848 1.00 0.00 C ATOM 1848 CE2 PHE B 17 5.570 9.764 -0.273 1.00 0.00 C ATOM 1849 CZ PHE B 17 6.730 9.898 -1.011 1.00 0.00 C ATOM 0 H PHE B 17 5.877 5.983 4.133 1.00 0.00 H new ATOM 0 HA PHE B 17 8.266 6.060 2.519 1.00 0.00 H new ATOM 0 HB2 PHE B 17 6.339 5.726 1.231 1.00 0.00 H new ATOM 0 HB3 PHE B 17 5.344 6.740 2.257 1.00 0.00 H new ATOM 0 HD1 PHE B 17 8.428 7.240 0.172 1.00 0.00 H new ATOM 0 HD2 PHE B 17 4.530 8.619 1.197 1.00 0.00 H new ATOM 0 HE1 PHE B 17 8.667 9.094 -1.422 1.00 0.00 H new ATOM 0 HE2 PHE B 17 4.766 10.474 -0.397 1.00 0.00 H new ATOM 0 HZ PHE B 17 6.833 10.711 -1.714 1.00 0.00 H new ATOM 1859 N GLN B 18 7.051 8.915 3.682 1.00 0.00 N ATOM 1860 CA GLN B 18 7.412 10.309 3.939 1.00 0.00 C ATOM 1861 C GLN B 18 8.414 10.468 5.077 1.00 0.00 C ATOM 1862 O GLN B 18 9.130 11.466 5.134 1.00 0.00 O ATOM 1863 CB GLN B 18 6.165 11.145 4.219 1.00 0.00 C ATOM 1864 CG GLN B 18 5.187 10.466 5.148 1.00 0.00 C ATOM 1865 CD GLN B 18 5.308 10.956 6.563 1.00 0.00 C ATOM 1866 OE1 GLN B 18 6.050 10.209 7.360 1.00 0.00 O flip ATOM 1867 NE2 GLN B 18 4.748 11.987 6.936 1.00 0.00 N flip ATOM 0 H GLN B 18 6.098 8.671 3.951 1.00 0.00 H new ATOM 0 HA GLN B 18 7.900 10.671 3.034 1.00 0.00 H new ATOM 0 HB2 GLN B 18 6.465 12.099 4.653 1.00 0.00 H new ATOM 0 HB3 GLN B 18 5.666 11.367 3.276 1.00 0.00 H new ATOM 0 HG2 GLN B 18 4.171 10.639 4.792 1.00 0.00 H new ATOM 0 HG3 GLN B 18 5.354 9.389 5.124 1.00 0.00 H new ATOM 0 HE21 GLN B 18 4.186 12.528 6.279 1.00 0.00 H new ATOM 0 HE22 GLN B 18 4.847 12.300 7.902 1.00 0.00 H new ATOM 1876 N LYS B 19 8.463 9.506 5.991 1.00 0.00 N ATOM 1877 CA LYS B 19 9.388 9.604 7.116 1.00 0.00 C ATOM 1878 C LYS B 19 10.814 9.802 6.615 1.00 0.00 C ATOM 1879 O LYS B 19 11.495 10.750 7.007 1.00 0.00 O ATOM 1880 CB LYS B 19 9.307 8.347 7.984 1.00 0.00 C ATOM 1881 CG LYS B 19 10.210 8.394 9.207 1.00 0.00 C ATOM 1882 CD LYS B 19 9.691 9.375 10.246 1.00 0.00 C ATOM 1883 CE LYS B 19 10.456 10.687 10.203 1.00 0.00 C ATOM 1884 NZ LYS B 19 11.659 10.657 11.080 1.00 0.00 N ATOM 0 H LYS B 19 7.886 8.665 5.979 1.00 0.00 H new ATOM 0 HA LYS B 19 9.105 10.466 7.720 1.00 0.00 H new ATOM 0 HB2 LYS B 19 8.276 8.205 8.309 1.00 0.00 H new ATOM 0 HB3 LYS B 19 9.573 7.480 7.379 1.00 0.00 H new ATOM 0 HG2 LYS B 19 10.280 7.399 9.647 1.00 0.00 H new ATOM 0 HG3 LYS B 19 11.218 8.681 8.906 1.00 0.00 H new ATOM 0 HD2 LYS B 19 8.632 9.564 10.072 1.00 0.00 H new ATOM 0 HD3 LYS B 19 9.777 8.934 11.239 1.00 0.00 H new ATOM 0 HE2 LYS B 19 10.760 10.897 9.177 1.00 0.00 H new ATOM 0 HE3 LYS B 19 9.800 11.500 10.514 1.00 0.00 H new ATOM 0 HZ1 LYS B 19 12.153 11.570 11.023 1.00 0.00 H new ATOM 0 HZ2 LYS B 19 11.368 10.482 12.063 1.00 0.00 H new ATOM 0 HZ3 LYS B 19 12.297 9.898 10.768 1.00 0.00 H new ATOM 1898 N TYR B 20 11.242 8.928 5.714 1.00 0.00 N ATOM 1899 CA TYR B 20 12.566 9.033 5.118 1.00 0.00 C ATOM 1900 C TYR B 20 12.539 10.069 4.006 1.00 0.00 C ATOM 1901 O TYR B 20 13.482 10.836 3.811 1.00 0.00 O ATOM 1902 CB TYR B 20 13.028 7.676 4.588 1.00 0.00 C ATOM 1903 CG TYR B 20 13.523 6.748 5.674 1.00 0.00 C ATOM 1904 CD1 TYR B 20 12.759 6.506 6.809 1.00 0.00 C ATOM 1905 CD2 TYR B 20 14.757 6.119 5.568 1.00 0.00 C ATOM 1906 CE1 TYR B 20 13.210 5.663 7.807 1.00 0.00 C ATOM 1907 CE2 TYR B 20 15.214 5.274 6.561 1.00 0.00 C ATOM 1908 CZ TYR B 20 14.438 5.050 7.678 1.00 0.00 C ATOM 1909 OH TYR B 20 14.891 4.210 8.669 1.00 0.00 O ATOM 0 H TYR B 20 10.690 8.138 5.380 1.00 0.00 H new ATOM 0 HA TYR B 20 13.278 9.350 5.880 1.00 0.00 H new ATOM 0 HB2 TYR B 20 12.202 7.199 4.061 1.00 0.00 H new ATOM 0 HB3 TYR B 20 13.824 7.830 3.860 1.00 0.00 H new ATOM 0 HD1 TYR B 20 11.797 6.985 6.913 1.00 0.00 H new ATOM 0 HD2 TYR B 20 15.369 6.293 4.695 1.00 0.00 H new ATOM 0 HE1 TYR B 20 12.604 5.485 8.683 1.00 0.00 H new ATOM 0 HE2 TYR B 20 16.175 4.791 6.462 1.00 0.00 H new ATOM 0 HH TYR B 20 15.428 4.720 9.310 1.00 0.00 H new ATOM 1919 N ALA B 21 11.429 10.061 3.277 1.00 0.00 N ATOM 1920 CA ALA B 21 11.206 10.964 2.159 1.00 0.00 C ATOM 1921 C ALA B 21 11.268 12.426 2.592 1.00 0.00 C ATOM 1922 O ALA B 21 11.587 13.305 1.792 1.00 0.00 O ATOM 1923 CB ALA B 21 9.857 10.646 1.533 1.00 0.00 C ATOM 0 H ALA B 21 10.653 9.421 3.448 1.00 0.00 H new ATOM 0 HA ALA B 21 11.999 10.818 1.426 1.00 0.00 H new ATOM 0 HB1 ALA B 21 9.678 11.317 0.693 1.00 0.00 H new ATOM 0 HB2 ALA B 21 9.854 9.615 1.181 1.00 0.00 H new ATOM 0 HB3 ALA B 21 9.071 10.778 2.276 1.00 0.00 H new ATOM 1929 N GLY B 22 10.962 12.680 3.859 1.00 0.00 N ATOM 1930 CA GLY B 22 10.989 14.038 4.369 1.00 0.00 C ATOM 1931 C GLY B 22 12.238 14.332 5.173 1.00 0.00 C ATOM 1932 O GLY B 22 13.316 14.526 4.610 1.00 0.00 O ATOM 0 H GLY B 22 10.696 11.970 4.542 1.00 0.00 H new ATOM 0 HA2 GLY B 22 10.925 14.737 3.535 1.00 0.00 H new ATOM 0 HA3 GLY B 22 10.111 14.205 4.993 1.00 0.00 H new ATOM 1936 N LYS B 23 12.095 14.367 6.493 1.00 0.00 N ATOM 1937 CA LYS B 23 13.221 14.641 7.378 1.00 0.00 C ATOM 1938 C LYS B 23 13.788 16.033 7.118 1.00 0.00 C ATOM 1939 O LYS B 23 14.866 16.178 6.541 1.00 0.00 O ATOM 1940 CB LYS B 23 14.314 13.587 7.189 1.00 0.00 C ATOM 1941 CG LYS B 23 15.083 13.273 8.463 1.00 0.00 C ATOM 1942 CD LYS B 23 16.576 13.140 8.198 1.00 0.00 C ATOM 1943 CE LYS B 23 17.146 11.880 8.829 1.00 0.00 C ATOM 1944 NZ LYS B 23 18.437 12.140 9.522 1.00 0.00 N ATOM 0 H LYS B 23 11.210 14.209 6.974 1.00 0.00 H new ATOM 0 HA LYS B 23 12.863 14.600 8.407 1.00 0.00 H new ATOM 0 HB2 LYS B 23 13.861 12.670 6.812 1.00 0.00 H new ATOM 0 HB3 LYS B 23 15.014 13.933 6.428 1.00 0.00 H new ATOM 0 HG2 LYS B 23 14.912 14.062 9.196 1.00 0.00 H new ATOM 0 HG3 LYS B 23 14.706 12.347 8.897 1.00 0.00 H new ATOM 0 HD2 LYS B 23 16.755 13.122 7.123 1.00 0.00 H new ATOM 0 HD3 LYS B 23 17.096 14.013 8.593 1.00 0.00 H new ATOM 0 HE2 LYS B 23 16.427 11.474 9.541 1.00 0.00 H new ATOM 0 HE3 LYS B 23 17.294 11.123 8.058 1.00 0.00 H new ATOM 0 HZ1 LYS B 23 18.792 11.256 9.938 1.00 0.00 H new ATOM 0 HZ2 LYS B 23 19.131 12.503 8.838 1.00 0.00 H new ATOM 0 HZ3 LYS B 23 18.292 12.843 10.275 1.00 0.00 H new ATOM 1958 N ASP B 24 13.052 17.054 7.544 1.00 0.00 N ATOM 1959 CA ASP B 24 13.480 18.436 7.356 1.00 0.00 C ATOM 1960 C ASP B 24 13.591 18.772 5.872 1.00 0.00 C ATOM 1961 O ASP B 24 14.488 19.506 5.457 1.00 0.00 O ATOM 1962 CB ASP B 24 14.823 18.676 8.052 1.00 0.00 C ATOM 1963 CG ASP B 24 14.828 19.949 8.874 1.00 0.00 C ATOM 1964 OD1 ASP B 24 13.895 20.138 9.683 1.00 0.00 O ATOM 1965 OD2 ASP B 24 15.763 20.759 8.709 1.00 0.00 O ATOM 0 H ASP B 24 12.157 16.951 8.022 1.00 0.00 H new ATOM 0 HA ASP B 24 12.729 19.089 7.802 1.00 0.00 H new ATOM 0 HB2 ASP B 24 15.051 17.828 8.698 1.00 0.00 H new ATOM 0 HB3 ASP B 24 15.613 18.727 7.303 1.00 0.00 H new ATOM 1970 N GLY B 25 12.673 18.231 5.078 1.00 0.00 N ATOM 1971 CA GLY B 25 12.686 18.485 3.649 1.00 0.00 C ATOM 1972 C GLY B 25 11.418 18.010 2.965 1.00 0.00 C ATOM 1973 O GLY B 25 11.230 16.811 2.754 1.00 0.00 O ATOM 0 H GLY B 25 11.920 17.621 5.398 1.00 0.00 H new ATOM 0 HA2 GLY B 25 12.811 19.554 3.474 1.00 0.00 H new ATOM 0 HA3 GLY B 25 13.546 17.986 3.202 1.00 0.00 H new ATOM 1977 N HIS B 26 10.547 18.952 2.618 1.00 0.00 N ATOM 1978 CA HIS B 26 9.291 18.625 1.954 1.00 0.00 C ATOM 1979 C HIS B 26 9.535 18.167 0.520 1.00 0.00 C ATOM 1980 O HIS B 26 10.371 18.729 -0.188 1.00 0.00 O ATOM 1981 CB HIS B 26 8.356 19.837 1.962 1.00 0.00 C ATOM 1982 CG HIS B 26 6.905 19.474 2.012 1.00 0.00 C ATOM 1983 ND1 HIS B 26 6.205 19.330 3.193 1.00 0.00 N ATOM 1984 CD2 HIS B 26 6.017 19.228 1.019 1.00 0.00 C ATOM 1985 CE1 HIS B 26 4.951 19.009 2.923 1.00 0.00 C ATOM 1986 NE2 HIS B 26 4.812 18.942 1.612 1.00 0.00 N ATOM 0 H HIS B 26 10.688 19.948 2.786 1.00 0.00 H new ATOM 0 HA HIS B 26 8.822 17.808 2.502 1.00 0.00 H new ATOM 0 HB2 HIS B 26 8.595 20.464 2.821 1.00 0.00 H new ATOM 0 HB3 HIS B 26 8.542 20.435 1.070 1.00 0.00 H new ATOM 0 HD1 HIS B 26 6.594 19.452 4.128 1.00 0.00 H new ATOM 0 HD2 HIS B 26 6.219 19.252 -0.042 1.00 0.00 H new ATOM 0 HE1 HIS B 26 4.173 18.832 3.651 1.00 0.00 H new ATOM 1995 N SER B 27 8.798 17.144 0.096 1.00 0.00 N ATOM 1996 CA SER B 27 8.936 16.612 -1.255 1.00 0.00 C ATOM 1997 C SER B 27 7.906 15.517 -1.516 1.00 0.00 C ATOM 1998 O SER B 27 7.280 15.005 -0.588 1.00 0.00 O ATOM 1999 CB SER B 27 10.347 16.063 -1.468 1.00 0.00 C ATOM 2000 OG SER B 27 10.725 15.198 -0.410 1.00 0.00 O ATOM 0 H SER B 27 8.100 16.668 0.668 1.00 0.00 H new ATOM 0 HA SER B 27 8.761 17.426 -1.959 1.00 0.00 H new ATOM 0 HB2 SER B 27 10.392 15.525 -2.415 1.00 0.00 H new ATOM 0 HB3 SER B 27 11.055 16.889 -1.537 1.00 0.00 H new ATOM 0 HG SER B 27 11.630 14.860 -0.572 1.00 0.00 H new ATOM 2006 N VAL B 28 7.736 15.163 -2.786 1.00 0.00 N ATOM 2007 CA VAL B 28 6.782 14.129 -3.172 1.00 0.00 C ATOM 2008 C VAL B 28 7.499 12.850 -3.592 1.00 0.00 C ATOM 2009 O VAL B 28 7.022 12.111 -4.453 1.00 0.00 O ATOM 2010 CB VAL B 28 5.879 14.601 -4.326 1.00 0.00 C ATOM 2011 CG1 VAL B 28 4.971 15.731 -3.867 1.00 0.00 C ATOM 2012 CG2 VAL B 28 6.719 15.033 -5.519 1.00 0.00 C ATOM 0 H VAL B 28 8.247 15.577 -3.566 1.00 0.00 H new ATOM 0 HA VAL B 28 6.164 13.926 -2.298 1.00 0.00 H new ATOM 0 HB VAL B 28 5.251 13.766 -4.636 1.00 0.00 H new ATOM 0 HG11 VAL B 28 4.341 16.051 -4.697 1.00 0.00 H new ATOM 0 HG12 VAL B 28 4.343 15.383 -3.047 1.00 0.00 H new ATOM 0 HG13 VAL B 28 5.578 16.570 -3.528 1.00 0.00 H new ATOM 0 HG21 VAL B 28 6.064 15.363 -6.325 1.00 0.00 H new ATOM 0 HG22 VAL B 28 7.374 15.853 -5.225 1.00 0.00 H new ATOM 0 HG23 VAL B 28 7.322 14.193 -5.863 1.00 0.00 H new ATOM 2022 N THR B 29 8.650 12.597 -2.977 1.00 0.00 N ATOM 2023 CA THR B 29 9.438 11.408 -3.284 1.00 0.00 C ATOM 2024 C THR B 29 10.324 11.027 -2.105 1.00 0.00 C ATOM 2025 O THR B 29 10.292 11.667 -1.055 1.00 0.00 O ATOM 2026 CB THR B 29 10.301 11.649 -4.524 1.00 0.00 C ATOM 2027 OG1 THR B 29 10.977 12.890 -4.431 1.00 0.00 O ATOM 2028 CG2 THR B 29 9.508 11.653 -5.812 1.00 0.00 C ATOM 0 H THR B 29 9.058 13.200 -2.263 1.00 0.00 H new ATOM 0 HA THR B 29 8.749 10.587 -3.482 1.00 0.00 H new ATOM 0 HB THR B 29 11.005 10.818 -4.552 1.00 0.00 H new ATOM 0 HG1 THR B 29 10.976 13.329 -5.307 1.00 0.00 H new ATOM 0 HG21 THR B 29 10.180 11.829 -6.652 1.00 0.00 H new ATOM 0 HG22 THR B 29 9.014 10.690 -5.938 1.00 0.00 H new ATOM 0 HG23 THR B 29 8.758 12.443 -5.775 1.00 0.00 H new ATOM 2036 N LEU B 30 11.111 9.975 -2.289 1.00 0.00 N ATOM 2037 CA LEU B 30 12.009 9.497 -1.248 1.00 0.00 C ATOM 2038 C LEU B 30 13.380 9.149 -1.850 1.00 0.00 C ATOM 2039 O LEU B 30 14.003 9.991 -2.497 1.00 0.00 O ATOM 2040 CB LEU B 30 11.376 8.287 -0.540 1.00 0.00 C ATOM 2041 CG LEU B 30 11.819 8.041 0.907 1.00 0.00 C ATOM 2042 CD1 LEU B 30 11.717 6.563 1.246 1.00 0.00 C ATOM 2043 CD2 LEU B 30 13.237 8.545 1.149 1.00 0.00 C ATOM 0 H LEU B 30 11.145 9.435 -3.154 1.00 0.00 H new ATOM 0 HA LEU B 30 12.166 10.281 -0.507 1.00 0.00 H new ATOM 0 HB2 LEU B 30 10.293 8.412 -0.550 1.00 0.00 H new ATOM 0 HB3 LEU B 30 11.599 7.394 -1.123 1.00 0.00 H new ATOM 0 HG LEU B 30 11.151 8.601 1.561 1.00 0.00 H new ATOM 0 HD11 LEU B 30 12.035 6.403 2.276 1.00 0.00 H new ATOM 0 HD12 LEU B 30 10.685 6.233 1.129 1.00 0.00 H new ATOM 0 HD13 LEU B 30 12.358 5.991 0.576 1.00 0.00 H new ATOM 0 HD21 LEU B 30 13.519 8.355 2.185 1.00 0.00 H new ATOM 0 HD22 LEU B 30 13.926 8.025 0.484 1.00 0.00 H new ATOM 0 HD23 LEU B 30 13.281 9.616 0.952 1.00 0.00 H new ATOM 2055 N SER B 31 13.842 7.914 -1.655 1.00 0.00 N ATOM 2056 CA SER B 31 15.120 7.481 -2.198 1.00 0.00 C ATOM 2057 C SER B 31 15.341 6.003 -1.912 1.00 0.00 C ATOM 2058 O SER B 31 15.182 5.552 -0.777 1.00 0.00 O ATOM 2059 CB SER B 31 16.261 8.309 -1.610 1.00 0.00 C ATOM 2060 OG SER B 31 17.506 7.650 -1.766 1.00 0.00 O ATOM 0 H SER B 31 13.346 7.198 -1.124 1.00 0.00 H new ATOM 0 HA SER B 31 15.105 7.631 -3.277 1.00 0.00 H new ATOM 0 HB2 SER B 31 16.298 9.282 -2.100 1.00 0.00 H new ATOM 0 HB3 SER B 31 16.073 8.492 -0.552 1.00 0.00 H new ATOM 0 HG SER B 31 18.219 8.202 -1.382 1.00 0.00 H new ATOM 2066 N LYS B 32 15.701 5.249 -2.945 1.00 0.00 N ATOM 2067 CA LYS B 32 15.937 3.818 -2.793 1.00 0.00 C ATOM 2068 C LYS B 32 16.869 3.552 -1.613 1.00 0.00 C ATOM 2069 O LYS B 32 16.653 2.628 -0.831 1.00 0.00 O ATOM 2070 CB LYS B 32 16.539 3.236 -4.075 1.00 0.00 C ATOM 2071 CG LYS B 32 17.618 4.109 -4.695 1.00 0.00 C ATOM 2072 CD LYS B 32 18.374 3.368 -5.786 1.00 0.00 C ATOM 2073 CE LYS B 32 19.851 3.730 -5.783 1.00 0.00 C ATOM 2074 NZ LYS B 32 20.675 2.701 -5.089 1.00 0.00 N ATOM 0 H LYS B 32 15.835 5.603 -3.892 1.00 0.00 H new ATOM 0 HA LYS B 32 14.980 3.333 -2.601 1.00 0.00 H new ATOM 0 HB2 LYS B 32 16.960 2.255 -3.855 1.00 0.00 H new ATOM 0 HB3 LYS B 32 15.743 3.085 -4.804 1.00 0.00 H new ATOM 0 HG2 LYS B 32 17.165 5.009 -5.111 1.00 0.00 H new ATOM 0 HG3 LYS B 32 18.316 4.432 -3.922 1.00 0.00 H new ATOM 0 HD2 LYS B 32 18.261 2.293 -5.643 1.00 0.00 H new ATOM 0 HD3 LYS B 32 17.941 3.608 -6.757 1.00 0.00 H new ATOM 0 HE2 LYS B 32 20.199 3.842 -6.810 1.00 0.00 H new ATOM 0 HE3 LYS B 32 19.987 4.694 -5.294 1.00 0.00 H new ATOM 0 HZ1 LYS B 32 21.675 2.986 -5.109 1.00 0.00 H new ATOM 0 HZ2 LYS B 32 20.360 2.612 -4.102 1.00 0.00 H new ATOM 0 HZ3 LYS B 32 20.566 1.786 -5.571 1.00 0.00 H new ATOM 2088 N THR B 33 17.895 4.387 -1.490 1.00 0.00 N ATOM 2089 CA THR B 33 18.859 4.271 -0.408 1.00 0.00 C ATOM 2090 C THR B 33 18.169 4.464 0.938 1.00 0.00 C ATOM 2091 O THR B 33 18.326 3.653 1.851 1.00 0.00 O ATOM 2092 CB THR B 33 19.978 5.302 -0.591 1.00 0.00 C ATOM 2093 OG1 THR B 33 21.084 4.728 -1.263 1.00 0.00 O ATOM 2094 CG2 THR B 33 20.486 5.884 0.710 1.00 0.00 C ATOM 0 H THR B 33 18.079 5.157 -2.133 1.00 0.00 H new ATOM 0 HA THR B 33 19.297 3.273 -0.430 1.00 0.00 H new ATOM 0 HB THR B 33 19.530 6.105 -1.176 1.00 0.00 H new ATOM 0 HG1 THR B 33 21.787 5.402 -1.372 1.00 0.00 H new ATOM 0 HG21 THR B 33 21.276 6.605 0.502 1.00 0.00 H new ATOM 0 HG22 THR B 33 19.668 6.382 1.230 1.00 0.00 H new ATOM 0 HG23 THR B 33 20.881 5.084 1.337 1.00 0.00 H new ATOM 2102 N GLU B 34 17.398 5.540 1.057 1.00 0.00 N ATOM 2103 CA GLU B 34 16.685 5.816 2.294 1.00 0.00 C ATOM 2104 C GLU B 34 15.778 4.646 2.631 1.00 0.00 C ATOM 2105 O GLU B 34 15.634 4.263 3.791 1.00 0.00 O ATOM 2106 CB GLU B 34 15.877 7.109 2.178 1.00 0.00 C ATOM 2107 CG GLU B 34 16.391 8.208 3.086 1.00 0.00 C ATOM 2108 CD GLU B 34 16.069 9.597 2.569 1.00 0.00 C ATOM 2109 OE1 GLU B 34 15.814 9.733 1.353 1.00 0.00 O ATOM 2110 OE2 GLU B 34 16.071 10.548 3.378 1.00 0.00 O ATOM 0 H GLU B 34 17.253 6.228 0.318 1.00 0.00 H new ATOM 0 HA GLU B 34 17.410 5.947 3.098 1.00 0.00 H new ATOM 0 HB2 GLU B 34 15.903 7.456 1.145 1.00 0.00 H new ATOM 0 HB3 GLU B 34 14.834 6.903 2.419 1.00 0.00 H new ATOM 0 HG2 GLU B 34 15.957 8.085 4.079 1.00 0.00 H new ATOM 0 HG3 GLU B 34 17.471 8.107 3.195 1.00 0.00 H new ATOM 2117 N PHE B 35 15.196 4.057 1.594 1.00 0.00 N ATOM 2118 CA PHE B 35 14.333 2.902 1.765 1.00 0.00 C ATOM 2119 C PHE B 35 15.184 1.683 2.093 1.00 0.00 C ATOM 2120 O PHE B 35 14.756 0.785 2.818 1.00 0.00 O ATOM 2121 CB PHE B 35 13.514 2.652 0.498 1.00 0.00 C ATOM 2122 CG PHE B 35 12.254 1.858 0.722 1.00 0.00 C ATOM 2123 CD1 PHE B 35 11.989 1.258 1.947 1.00 0.00 C ATOM 2124 CD2 PHE B 35 11.331 1.709 -0.301 1.00 0.00 C ATOM 2125 CE1 PHE B 35 10.832 0.530 2.143 1.00 0.00 C ATOM 2126 CE2 PHE B 35 10.173 0.982 -0.108 1.00 0.00 C ATOM 2127 CZ PHE B 35 9.923 0.392 1.115 1.00 0.00 C ATOM 0 H PHE B 35 15.308 4.362 0.627 1.00 0.00 H new ATOM 0 HA PHE B 35 13.640 3.091 2.585 1.00 0.00 H new ATOM 0 HB2 PHE B 35 13.251 3.612 0.054 1.00 0.00 H new ATOM 0 HB3 PHE B 35 14.137 2.126 -0.226 1.00 0.00 H new ATOM 0 HD1 PHE B 35 12.697 1.362 2.756 1.00 0.00 H new ATOM 0 HD2 PHE B 35 11.520 2.167 -1.261 1.00 0.00 H new ATOM 0 HE1 PHE B 35 10.639 0.069 3.100 1.00 0.00 H new ATOM 0 HE2 PHE B 35 9.462 0.875 -0.914 1.00 0.00 H new ATOM 0 HZ PHE B 35 9.017 -0.177 1.266 1.00 0.00 H new ATOM 2137 N LEU B 36 16.405 1.670 1.564 1.00 0.00 N ATOM 2138 CA LEU B 36 17.332 0.578 1.807 1.00 0.00 C ATOM 2139 C LEU B 36 17.592 0.432 3.294 1.00 0.00 C ATOM 2140 O LEU B 36 17.334 -0.613 3.892 1.00 0.00 O ATOM 2141 CB LEU B 36 18.648 0.872 1.100 1.00 0.00 C ATOM 2142 CG LEU B 36 18.958 -0.025 -0.086 1.00 0.00 C ATOM 2143 CD1 LEU B 36 19.203 0.819 -1.320 1.00 0.00 C ATOM 2144 CD2 LEU B 36 20.155 -0.907 0.227 1.00 0.00 C ATOM 0 H LEU B 36 16.772 2.408 0.963 1.00 0.00 H new ATOM 0 HA LEU B 36 16.898 -0.347 1.427 1.00 0.00 H new ATOM 0 HB2 LEU B 36 18.636 1.907 0.759 1.00 0.00 H new ATOM 0 HB3 LEU B 36 19.459 0.784 1.824 1.00 0.00 H new ATOM 0 HG LEU B 36 18.105 -0.674 -0.283 1.00 0.00 H new ATOM 0 HD11 LEU B 36 19.425 0.170 -2.167 1.00 0.00 H new ATOM 0 HD12 LEU B 36 18.314 1.410 -1.539 1.00 0.00 H new ATOM 0 HD13 LEU B 36 20.047 1.486 -1.143 1.00 0.00 H new ATOM 0 HD21 LEU B 36 20.370 -1.547 -0.629 1.00 0.00 H new ATOM 0 HD22 LEU B 36 21.022 -0.282 0.439 1.00 0.00 H new ATOM 0 HD23 LEU B 36 19.933 -1.526 1.096 1.00 0.00 H new ATOM 2156 N SER B 37 18.103 1.504 3.879 1.00 0.00 N ATOM 2157 CA SER B 37 18.404 1.526 5.303 1.00 0.00 C ATOM 2158 C SER B 37 17.136 1.308 6.125 1.00 0.00 C ATOM 2159 O SER B 37 17.191 0.811 7.250 1.00 0.00 O ATOM 2160 CB SER B 37 19.057 2.856 5.688 1.00 0.00 C ATOM 2161 OG SER B 37 18.664 3.892 4.805 1.00 0.00 O ATOM 0 H SER B 37 18.319 2.372 3.389 1.00 0.00 H new ATOM 0 HA SER B 37 19.100 0.715 5.518 1.00 0.00 H new ATOM 0 HB2 SER B 37 18.779 3.119 6.709 1.00 0.00 H new ATOM 0 HB3 SER B 37 20.142 2.751 5.670 1.00 0.00 H new ATOM 0 HG SER B 37 17.691 3.870 4.688 1.00 0.00 H new ATOM 2167 N PHE B 38 15.993 1.683 5.554 1.00 0.00 N ATOM 2168 CA PHE B 38 14.710 1.527 6.230 1.00 0.00 C ATOM 2169 C PHE B 38 14.466 0.066 6.596 1.00 0.00 C ATOM 2170 O PHE B 38 14.003 -0.242 7.694 1.00 0.00 O ATOM 2171 CB PHE B 38 13.575 2.035 5.338 1.00 0.00 C ATOM 2172 CG PHE B 38 12.326 2.392 6.092 1.00 0.00 C ATOM 2173 CD1 PHE B 38 11.650 1.439 6.837 1.00 0.00 C ATOM 2174 CD2 PHE B 38 11.824 3.685 6.053 1.00 0.00 C ATOM 2175 CE1 PHE B 38 10.500 1.767 7.530 1.00 0.00 C ATOM 2176 CE2 PHE B 38 10.675 4.018 6.744 1.00 0.00 C ATOM 2177 CZ PHE B 38 10.013 3.057 7.483 1.00 0.00 C ATOM 0 H PHE B 38 15.931 2.097 4.624 1.00 0.00 H new ATOM 0 HA PHE B 38 14.735 2.116 7.147 1.00 0.00 H new ATOM 0 HB2 PHE B 38 13.921 2.911 4.790 1.00 0.00 H new ATOM 0 HB3 PHE B 38 13.336 1.270 4.599 1.00 0.00 H new ATOM 0 HD1 PHE B 38 12.026 0.427 6.877 1.00 0.00 H new ATOM 0 HD2 PHE B 38 12.337 4.440 5.476 1.00 0.00 H new ATOM 0 HE1 PHE B 38 9.983 1.015 8.107 1.00 0.00 H new ATOM 0 HE2 PHE B 38 10.295 5.028 6.706 1.00 0.00 H new ATOM 0 HZ PHE B 38 9.115 3.315 8.024 1.00 0.00 H new ATOM 2187 N MET B 39 14.785 -0.831 5.670 1.00 0.00 N ATOM 2188 CA MET B 39 14.605 -2.257 5.899 1.00 0.00 C ATOM 2189 C MET B 39 15.594 -2.755 6.945 1.00 0.00 C ATOM 2190 O MET B 39 15.284 -3.637 7.742 1.00 0.00 O ATOM 2191 CB MET B 39 14.789 -3.035 4.593 1.00 0.00 C ATOM 2192 CG MET B 39 14.158 -2.358 3.386 1.00 0.00 C ATOM 2193 SD MET B 39 13.255 -3.508 2.330 1.00 0.00 S ATOM 2194 CE MET B 39 11.984 -4.075 3.458 1.00 0.00 C ATOM 0 H MET B 39 15.169 -0.595 4.755 1.00 0.00 H new ATOM 0 HA MET B 39 13.592 -2.421 6.266 1.00 0.00 H new ATOM 0 HB2 MET B 39 15.855 -3.170 4.407 1.00 0.00 H new ATOM 0 HB3 MET B 39 14.357 -4.029 4.708 1.00 0.00 H new ATOM 0 HG2 MET B 39 13.479 -1.576 3.727 1.00 0.00 H new ATOM 0 HG3 MET B 39 14.937 -1.870 2.801 1.00 0.00 H new ATOM 0 HE1 MET B 39 11.147 -4.481 2.889 1.00 0.00 H new ATOM 0 HE2 MET B 39 12.392 -4.850 4.106 1.00 0.00 H new ATOM 0 HE3 MET B 39 11.638 -3.239 4.066 1.00 0.00 H new ATOM 2204 N ASN B 40 16.786 -2.180 6.932 1.00 0.00 N ATOM 2205 CA ASN B 40 17.830 -2.557 7.872 1.00 0.00 C ATOM 2206 C ASN B 40 17.547 -2.031 9.280 1.00 0.00 C ATOM 2207 O ASN B 40 18.134 -2.507 10.252 1.00 0.00 O ATOM 2208 CB ASN B 40 19.184 -2.037 7.386 1.00 0.00 C ATOM 2209 CG ASN B 40 19.705 -2.809 6.189 1.00 0.00 C ATOM 2210 OD1 ASN B 40 20.178 -3.938 6.322 1.00 0.00 O ATOM 2211 ND2 ASN B 40 19.621 -2.203 5.009 1.00 0.00 N ATOM 0 H ASN B 40 17.056 -1.446 6.277 1.00 0.00 H new ATOM 0 HA ASN B 40 17.850 -3.646 7.922 1.00 0.00 H new ATOM 0 HB2 ASN B 40 19.092 -0.983 7.123 1.00 0.00 H new ATOM 0 HB3 ASN B 40 19.907 -2.101 8.199 1.00 0.00 H new ATOM 0 HD21 ASN B 40 19.956 -2.674 4.169 1.00 0.00 H new ATOM 0 HD22 ASN B 40 19.222 -1.267 4.944 1.00 0.00 H new ATOM 2218 N THR B 41 16.678 -1.025 9.390 1.00 0.00 N ATOM 2219 CA THR B 41 16.376 -0.428 10.691 1.00 0.00 C ATOM 2220 C THR B 41 14.964 -0.725 11.195 1.00 0.00 C ATOM 2221 O THR B 41 14.758 -0.871 12.400 1.00 0.00 O ATOM 2222 CB THR B 41 16.563 1.089 10.629 1.00 0.00 C ATOM 2223 OG1 THR B 41 16.224 1.688 11.867 1.00 0.00 O ATOM 2224 CG2 THR B 41 15.734 1.758 9.555 1.00 0.00 C ATOM 0 H THR B 41 16.177 -0.611 8.604 1.00 0.00 H new ATOM 0 HA THR B 41 17.073 -0.884 11.394 1.00 0.00 H new ATOM 0 HB THR B 41 17.617 1.236 10.392 1.00 0.00 H new ATOM 0 HG1 THR B 41 16.352 2.658 11.807 1.00 0.00 H new ATOM 0 HG21 THR B 41 15.918 2.832 9.570 1.00 0.00 H new ATOM 0 HG22 THR B 41 16.009 1.356 8.580 1.00 0.00 H new ATOM 0 HG23 THR B 41 14.677 1.568 9.740 1.00 0.00 H new ATOM 2232 N GLU B 42 13.981 -0.758 10.299 1.00 0.00 N ATOM 2233 CA GLU B 42 12.599 -0.971 10.726 1.00 0.00 C ATOM 2234 C GLU B 42 11.898 -2.100 9.969 1.00 0.00 C ATOM 2235 O GLU B 42 10.979 -2.725 10.497 1.00 0.00 O ATOM 2236 CB GLU B 42 11.813 0.333 10.566 1.00 0.00 C ATOM 2237 CG GLU B 42 12.619 1.583 10.912 1.00 0.00 C ATOM 2238 CD GLU B 42 12.290 2.123 12.289 1.00 0.00 C ATOM 2239 OE1 GLU B 42 12.216 1.317 13.242 1.00 0.00 O ATOM 2240 OE2 GLU B 42 12.106 3.352 12.416 1.00 0.00 O ATOM 0 H GLU B 42 14.109 -0.643 9.294 1.00 0.00 H new ATOM 0 HA GLU B 42 12.630 -1.275 11.772 1.00 0.00 H new ATOM 0 HB2 GLU B 42 11.462 0.411 9.537 1.00 0.00 H new ATOM 0 HB3 GLU B 42 10.929 0.294 11.202 1.00 0.00 H new ATOM 0 HG2 GLU B 42 13.683 1.351 10.861 1.00 0.00 H new ATOM 0 HG3 GLU B 42 12.425 2.354 10.167 1.00 0.00 H new ATOM 2247 N LEU B 43 12.326 -2.363 8.743 1.00 0.00 N ATOM 2248 CA LEU B 43 11.726 -3.421 7.940 1.00 0.00 C ATOM 2249 C LEU B 43 12.726 -4.549 7.749 1.00 0.00 C ATOM 2250 O LEU B 43 12.894 -5.078 6.651 1.00 0.00 O ATOM 2251 CB LEU B 43 11.257 -2.871 6.589 1.00 0.00 C ATOM 2252 CG LEU B 43 9.746 -2.660 6.463 1.00 0.00 C ATOM 2253 CD1 LEU B 43 9.378 -2.279 5.036 1.00 0.00 C ATOM 2254 CD2 LEU B 43 8.997 -3.912 6.896 1.00 0.00 C ATOM 0 H LEU B 43 13.085 -1.860 8.282 1.00 0.00 H new ATOM 0 HA LEU B 43 10.853 -3.813 8.462 1.00 0.00 H new ATOM 0 HB2 LEU B 43 11.757 -1.920 6.408 1.00 0.00 H new ATOM 0 HB3 LEU B 43 11.579 -3.555 5.804 1.00 0.00 H new ATOM 0 HG LEU B 43 9.454 -1.841 7.121 1.00 0.00 H new ATOM 0 HD11 LEU B 43 8.300 -2.133 4.965 1.00 0.00 H new ATOM 0 HD12 LEU B 43 9.888 -1.355 4.763 1.00 0.00 H new ATOM 0 HD13 LEU B 43 9.682 -3.076 4.357 1.00 0.00 H new ATOM 0 HD21 LEU B 43 7.924 -3.745 6.800 1.00 0.00 H new ATOM 0 HD22 LEU B 43 9.292 -4.749 6.264 1.00 0.00 H new ATOM 0 HD23 LEU B 43 9.238 -4.139 7.935 1.00 0.00 H new ATOM 2266 N ALA B 44 13.392 -4.899 8.840 1.00 0.00 N ATOM 2267 CA ALA B 44 14.390 -5.953 8.830 1.00 0.00 C ATOM 2268 C ALA B 44 13.732 -7.326 8.853 1.00 0.00 C ATOM 2269 O ALA B 44 14.304 -8.306 8.379 1.00 0.00 O ATOM 2270 CB ALA B 44 15.327 -5.776 10.011 1.00 0.00 C ATOM 0 H ALA B 44 13.255 -4.462 9.751 1.00 0.00 H new ATOM 0 HA ALA B 44 14.969 -5.885 7.909 1.00 0.00 H new ATOM 0 HB1 ALA B 44 16.076 -6.568 10.003 1.00 0.00 H new ATOM 0 HB2 ALA B 44 15.822 -4.807 9.941 1.00 0.00 H new ATOM 0 HB3 ALA B 44 14.757 -5.826 10.939 1.00 0.00 H new ATOM 2276 N ALA B 45 12.521 -7.385 9.392 1.00 0.00 N ATOM 2277 CA ALA B 45 11.778 -8.635 9.458 1.00 0.00 C ATOM 2278 C ALA B 45 11.515 -9.174 8.054 1.00 0.00 C ATOM 2279 O ALA B 45 11.306 -10.372 7.864 1.00 0.00 O ATOM 2280 CB ALA B 45 10.471 -8.426 10.206 1.00 0.00 C ATOM 0 H ALA B 45 12.033 -6.582 9.789 1.00 0.00 H new ATOM 0 HA ALA B 45 12.374 -9.370 9.999 1.00 0.00 H new ATOM 0 HB1 ALA B 45 9.922 -9.367 10.250 1.00 0.00 H new ATOM 0 HB2 ALA B 45 10.682 -8.081 11.218 1.00 0.00 H new ATOM 0 HB3 ALA B 45 9.870 -7.680 9.687 1.00 0.00 H new ATOM 2286 N PHE B 46 11.533 -8.275 7.071 1.00 0.00 N ATOM 2287 CA PHE B 46 11.303 -8.646 5.681 1.00 0.00 C ATOM 2288 C PHE B 46 12.603 -9.094 5.022 1.00 0.00 C ATOM 2289 O PHE B 46 12.602 -9.954 4.144 1.00 0.00 O ATOM 2290 CB PHE B 46 10.706 -7.465 4.909 1.00 0.00 C ATOM 2291 CG PHE B 46 9.268 -7.194 5.245 1.00 0.00 C ATOM 2292 CD1 PHE B 46 8.870 -7.019 6.561 1.00 0.00 C ATOM 2293 CD2 PHE B 46 8.312 -7.114 4.245 1.00 0.00 C ATOM 2294 CE1 PHE B 46 7.548 -6.769 6.873 1.00 0.00 C ATOM 2295 CE2 PHE B 46 6.988 -6.865 4.551 1.00 0.00 C ATOM 2296 CZ PHE B 46 6.607 -6.692 5.867 1.00 0.00 C ATOM 0 H PHE B 46 11.706 -7.280 7.216 1.00 0.00 H new ATOM 0 HA PHE B 46 10.598 -9.477 5.661 1.00 0.00 H new ATOM 0 HB2 PHE B 46 11.294 -6.571 5.117 1.00 0.00 H new ATOM 0 HB3 PHE B 46 10.790 -7.660 3.840 1.00 0.00 H new ATOM 0 HD1 PHE B 46 9.603 -7.079 7.352 1.00 0.00 H new ATOM 0 HD2 PHE B 46 8.605 -7.248 3.214 1.00 0.00 H new ATOM 0 HE1 PHE B 46 7.251 -6.634 7.903 1.00 0.00 H new ATOM 0 HE2 PHE B 46 6.252 -6.806 3.763 1.00 0.00 H new ATOM 0 HZ PHE B 46 5.573 -6.496 6.109 1.00 0.00 H new ATOM 2306 N THR B 47 13.711 -8.499 5.455 1.00 0.00 N ATOM 2307 CA THR B 47 15.025 -8.828 4.909 1.00 0.00 C ATOM 2308 C THR B 47 15.637 -10.026 5.629 1.00 0.00 C ATOM 2309 O THR B 47 16.347 -10.830 5.024 1.00 0.00 O ATOM 2310 CB THR B 47 15.960 -7.623 5.019 1.00 0.00 C ATOM 2311 OG1 THR B 47 16.443 -7.484 6.344 1.00 0.00 O ATOM 2312 CG2 THR B 47 15.305 -6.315 4.631 1.00 0.00 C ATOM 0 H THR B 47 13.725 -7.785 6.184 1.00 0.00 H new ATOM 0 HA THR B 47 14.896 -9.089 3.859 1.00 0.00 H new ATOM 0 HB THR B 47 16.771 -7.824 4.319 1.00 0.00 H new ATOM 0 HG1 THR B 47 15.716 -7.658 6.977 1.00 0.00 H new ATOM 0 HG21 THR B 47 16.025 -5.503 4.733 1.00 0.00 H new ATOM 0 HG22 THR B 47 14.965 -6.371 3.597 1.00 0.00 H new ATOM 0 HG23 THR B 47 14.452 -6.127 5.284 1.00 0.00 H new ATOM 2320 N LYS B 48 15.363 -10.139 6.925 1.00 0.00 N ATOM 2321 CA LYS B 48 15.891 -11.237 7.725 1.00 0.00 C ATOM 2322 C LYS B 48 15.443 -12.583 7.162 1.00 0.00 C ATOM 2323 O LYS B 48 16.208 -13.267 6.481 1.00 0.00 O ATOM 2324 CB LYS B 48 15.438 -11.101 9.181 1.00 0.00 C ATOM 2325 CG LYS B 48 16.328 -10.191 10.011 1.00 0.00 C ATOM 2326 CD LYS B 48 15.914 -10.192 11.473 1.00 0.00 C ATOM 2327 CE LYS B 48 16.143 -11.551 12.116 1.00 0.00 C ATOM 2328 NZ LYS B 48 15.955 -11.507 13.592 1.00 0.00 N ATOM 0 H LYS B 48 14.778 -9.483 7.443 1.00 0.00 H new ATOM 0 HA LYS B 48 16.979 -11.192 7.687 1.00 0.00 H new ATOM 0 HB2 LYS B 48 14.419 -10.716 9.201 1.00 0.00 H new ATOM 0 HB3 LYS B 48 15.414 -12.090 9.640 1.00 0.00 H new ATOM 0 HG2 LYS B 48 17.365 -10.517 9.925 1.00 0.00 H new ATOM 0 HG3 LYS B 48 16.279 -9.175 9.618 1.00 0.00 H new ATOM 0 HD2 LYS B 48 16.480 -9.433 12.013 1.00 0.00 H new ATOM 0 HD3 LYS B 48 14.861 -9.923 11.554 1.00 0.00 H new ATOM 0 HE2 LYS B 48 15.454 -12.277 11.684 1.00 0.00 H new ATOM 0 HE3 LYS B 48 17.152 -11.894 11.889 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 16.120 -12.453 13.991 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 16.629 -10.833 14.008 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 14.984 -11.204 13.809 1.00 0.00 H new ATOM 2342 N ASN B 49 14.200 -12.955 7.446 1.00 0.00 N ATOM 2343 CA ASN B 49 13.651 -14.216 6.962 1.00 0.00 C ATOM 2344 C ASN B 49 13.064 -14.044 5.562 1.00 0.00 C ATOM 2345 O ASN B 49 11.893 -14.337 5.324 1.00 0.00 O ATOM 2346 CB ASN B 49 12.582 -14.735 7.929 1.00 0.00 C ATOM 2347 CG ASN B 49 13.047 -15.953 8.703 1.00 0.00 C ATOM 2348 OD1 ASN B 49 13.534 -15.841 9.828 1.00 0.00 O ATOM 2349 ND2 ASN B 49 12.896 -17.128 8.103 1.00 0.00 N ATOM 0 H ASN B 49 13.554 -12.402 8.009 1.00 0.00 H new ATOM 0 HA ASN B 49 14.458 -14.947 6.908 1.00 0.00 H new ATOM 0 HB2 ASN B 49 12.314 -13.944 8.629 1.00 0.00 H new ATOM 0 HB3 ASN B 49 11.680 -14.985 7.370 1.00 0.00 H new ATOM 0 HD21 ASN B 49 13.189 -17.983 8.576 1.00 0.00 H new ATOM 0 HD22 ASN B 49 12.487 -17.175 7.170 1.00 0.00 H new ATOM 2356 N GLN B 50 13.891 -13.560 4.640 1.00 0.00 N ATOM 2357 CA GLN B 50 13.459 -13.343 3.264 1.00 0.00 C ATOM 2358 C GLN B 50 12.985 -14.643 2.626 1.00 0.00 C ATOM 2359 O GLN B 50 11.902 -14.701 2.044 1.00 0.00 O ATOM 2360 CB GLN B 50 14.599 -12.750 2.435 1.00 0.00 C ATOM 2361 CG GLN B 50 14.895 -11.295 2.755 1.00 0.00 C ATOM 2362 CD GLN B 50 14.327 -10.341 1.722 1.00 0.00 C ATOM 2363 OE1 GLN B 50 15.068 -9.681 0.995 1.00 0.00 O ATOM 2364 NE2 GLN B 50 13.003 -10.264 1.652 1.00 0.00 N ATOM 0 H GLN B 50 14.863 -13.311 4.821 1.00 0.00 H new ATOM 0 HA GLN B 50 12.625 -12.642 3.284 1.00 0.00 H new ATOM 0 HB2 GLN B 50 15.501 -13.340 2.600 1.00 0.00 H new ATOM 0 HB3 GLN B 50 14.350 -12.837 1.377 1.00 0.00 H new ATOM 0 HG2 GLN B 50 14.482 -11.051 3.734 1.00 0.00 H new ATOM 0 HG3 GLN B 50 15.974 -11.154 2.820 1.00 0.00 H new ATOM 0 HE21 GLN B 50 12.426 -10.830 2.274 1.00 0.00 H new ATOM 0 HE22 GLN B 50 12.564 -9.639 0.976 1.00 0.00 H new ATOM 2373 N LYS B 51 13.807 -15.682 2.730 1.00 0.00 N ATOM 2374 CA LYS B 51 13.473 -16.977 2.149 1.00 0.00 C ATOM 2375 C LYS B 51 13.196 -16.836 0.655 1.00 0.00 C ATOM 2376 O LYS B 51 12.489 -17.652 0.062 1.00 0.00 O ATOM 2377 CB LYS B 51 12.257 -17.580 2.856 1.00 0.00 C ATOM 2378 CG LYS B 51 12.397 -19.066 3.147 1.00 0.00 C ATOM 2379 CD LYS B 51 11.204 -19.595 3.925 1.00 0.00 C ATOM 2380 CE LYS B 51 11.285 -21.101 4.113 1.00 0.00 C ATOM 2381 NZ LYS B 51 10.120 -21.630 4.874 1.00 0.00 N ATOM 0 H LYS B 51 14.707 -15.653 3.210 1.00 0.00 H new ATOM 0 HA LYS B 51 14.324 -17.645 2.284 1.00 0.00 H new ATOM 0 HB2 LYS B 51 12.092 -17.049 3.793 1.00 0.00 H new ATOM 0 HB3 LYS B 51 11.373 -17.421 2.239 1.00 0.00 H new ATOM 0 HG2 LYS B 51 12.494 -19.614 2.210 1.00 0.00 H new ATOM 0 HG3 LYS B 51 13.310 -19.242 3.715 1.00 0.00 H new ATOM 0 HD2 LYS B 51 11.158 -19.108 4.899 1.00 0.00 H new ATOM 0 HD3 LYS B 51 10.284 -19.342 3.398 1.00 0.00 H new ATOM 0 HE2 LYS B 51 11.332 -21.586 3.138 1.00 0.00 H new ATOM 0 HE3 LYS B 51 12.206 -21.352 4.639 1.00 0.00 H new ATOM 0 HZ1 LYS B 51 10.214 -22.660 4.980 1.00 0.00 H new ATOM 0 HZ2 LYS B 51 10.089 -21.186 5.814 1.00 0.00 H new ATOM 0 HZ3 LYS B 51 9.242 -21.413 4.360 1.00 0.00 H new ATOM 2395 N ASP B 52 13.757 -15.790 0.055 1.00 0.00 N ATOM 2396 CA ASP B 52 13.575 -15.527 -1.366 1.00 0.00 C ATOM 2397 C ASP B 52 14.387 -14.305 -1.793 1.00 0.00 C ATOM 2398 O ASP B 52 14.193 -13.209 -1.264 1.00 0.00 O ATOM 2399 CB ASP B 52 12.093 -15.300 -1.676 1.00 0.00 C ATOM 2400 CG ASP B 52 11.414 -16.547 -2.206 1.00 0.00 C ATOM 2401 OD1 ASP B 52 11.708 -16.940 -3.354 1.00 0.00 O ATOM 2402 OD2 ASP B 52 10.587 -17.129 -1.474 1.00 0.00 O ATOM 0 H ASP B 52 14.344 -15.108 0.535 1.00 0.00 H new ATOM 0 HA ASP B 52 13.927 -16.395 -1.924 1.00 0.00 H new ATOM 0 HB2 ASP B 52 11.582 -14.969 -0.772 1.00 0.00 H new ATOM 0 HB3 ASP B 52 11.997 -14.498 -2.408 1.00 0.00 H new ATOM 2407 N PRO B 53 15.314 -14.470 -2.755 1.00 0.00 N ATOM 2408 CA PRO B 53 16.152 -13.372 -3.239 1.00 0.00 C ATOM 2409 C PRO B 53 15.457 -12.522 -4.301 1.00 0.00 C ATOM 2410 O PRO B 53 16.106 -11.753 -5.012 1.00 0.00 O ATOM 2411 CB PRO B 53 17.346 -14.105 -3.840 1.00 0.00 C ATOM 2412 CG PRO B 53 16.776 -15.383 -4.354 1.00 0.00 C ATOM 2413 CD PRO B 53 15.625 -15.739 -3.444 1.00 0.00 C ATOM 0 HA PRO B 53 16.407 -12.668 -2.447 1.00 0.00 H new ATOM 0 HB2 PRO B 53 17.807 -13.525 -4.640 1.00 0.00 H new ATOM 0 HB3 PRO B 53 18.118 -14.287 -3.092 1.00 0.00 H new ATOM 0 HG2 PRO B 53 16.435 -15.269 -5.383 1.00 0.00 H new ATOM 0 HG3 PRO B 53 17.529 -16.171 -4.353 1.00 0.00 H new ATOM 0 HD2 PRO B 53 14.769 -16.108 -4.008 1.00 0.00 H new ATOM 0 HD3 PRO B 53 15.902 -16.521 -2.737 1.00 0.00 H new ATOM 2421 N GLY B 54 14.139 -12.660 -4.404 1.00 0.00 N ATOM 2422 CA GLY B 54 13.388 -11.895 -5.380 1.00 0.00 C ATOM 2423 C GLY B 54 12.370 -10.973 -4.738 1.00 0.00 C ATOM 2424 O GLY B 54 11.529 -10.395 -5.424 1.00 0.00 O ATOM 0 H GLY B 54 13.578 -13.288 -3.828 1.00 0.00 H new ATOM 0 HA2 GLY B 54 14.078 -11.305 -5.983 1.00 0.00 H new ATOM 0 HA3 GLY B 54 12.877 -12.579 -6.058 1.00 0.00 H new ATOM 2428 N VAL B 55 12.440 -10.834 -3.417 1.00 0.00 N ATOM 2429 CA VAL B 55 11.515 -9.973 -2.696 1.00 0.00 C ATOM 2430 C VAL B 55 11.996 -8.522 -2.698 1.00 0.00 C ATOM 2431 O VAL B 55 11.347 -7.640 -3.261 1.00 0.00 O ATOM 2432 CB VAL B 55 11.353 -10.446 -1.238 1.00 0.00 C ATOM 2433 CG1 VAL B 55 10.394 -9.543 -0.474 1.00 0.00 C ATOM 2434 CG2 VAL B 55 10.882 -11.892 -1.197 1.00 0.00 C ATOM 0 H VAL B 55 13.126 -11.306 -2.828 1.00 0.00 H new ATOM 0 HA VAL B 55 10.554 -10.030 -3.207 1.00 0.00 H new ATOM 0 HB VAL B 55 12.326 -10.387 -0.751 1.00 0.00 H new ATOM 0 HG11 VAL B 55 10.298 -9.899 0.552 1.00 0.00 H new ATOM 0 HG12 VAL B 55 10.780 -8.524 -0.469 1.00 0.00 H new ATOM 0 HG13 VAL B 55 9.417 -9.559 -0.957 1.00 0.00 H new ATOM 0 HG21 VAL B 55 10.773 -12.210 -0.160 1.00 0.00 H new ATOM 0 HG22 VAL B 55 9.922 -11.976 -1.705 1.00 0.00 H new ATOM 0 HG23 VAL B 55 11.614 -12.527 -1.696 1.00 0.00 H new ATOM 2444 N LEU B 56 13.136 -8.289 -2.058 1.00 0.00 N ATOM 2445 CA LEU B 56 13.720 -6.955 -1.969 1.00 0.00 C ATOM 2446 C LEU B 56 14.408 -6.540 -3.271 1.00 0.00 C ATOM 2447 O LEU B 56 14.171 -5.451 -3.794 1.00 0.00 O ATOM 2448 CB LEU B 56 14.712 -6.924 -0.800 1.00 0.00 C ATOM 2449 CG LEU B 56 15.799 -5.847 -0.861 1.00 0.00 C ATOM 2450 CD1 LEU B 56 15.241 -4.499 -0.434 1.00 0.00 C ATOM 2451 CD2 LEU B 56 16.973 -6.246 0.017 1.00 0.00 C ATOM 0 H LEU B 56 13.679 -9.014 -1.589 1.00 0.00 H new ATOM 0 HA LEU B 56 12.918 -6.237 -1.797 1.00 0.00 H new ATOM 0 HB2 LEU B 56 14.149 -6.790 0.123 1.00 0.00 H new ATOM 0 HB3 LEU B 56 15.198 -7.898 -0.738 1.00 0.00 H new ATOM 0 HG LEU B 56 16.147 -5.756 -1.890 1.00 0.00 H new ATOM 0 HD11 LEU B 56 16.028 -3.747 -0.484 1.00 0.00 H new ATOM 0 HD12 LEU B 56 14.426 -4.215 -1.099 1.00 0.00 H new ATOM 0 HD13 LEU B 56 14.868 -4.567 0.588 1.00 0.00 H new ATOM 0 HD21 LEU B 56 17.742 -5.475 -0.032 1.00 0.00 H new ATOM 0 HD22 LEU B 56 16.635 -6.357 1.047 1.00 0.00 H new ATOM 0 HD23 LEU B 56 17.385 -7.192 -0.334 1.00 0.00 H new ATOM 2463 N ASP B 57 15.290 -7.404 -3.760 1.00 0.00 N ATOM 2464 CA ASP B 57 16.056 -7.133 -4.974 1.00 0.00 C ATOM 2465 C ASP B 57 15.166 -6.911 -6.194 1.00 0.00 C ATOM 2466 O ASP B 57 15.491 -6.107 -7.065 1.00 0.00 O ATOM 2467 CB ASP B 57 17.025 -8.283 -5.247 1.00 0.00 C ATOM 2468 CG ASP B 57 18.073 -7.922 -6.284 1.00 0.00 C ATOM 2469 OD1 ASP B 57 18.763 -6.899 -6.098 1.00 0.00 O ATOM 2470 OD2 ASP B 57 18.201 -8.664 -7.280 1.00 0.00 O ATOM 0 H ASP B 57 15.495 -8.306 -3.331 1.00 0.00 H new ATOM 0 HA ASP B 57 16.608 -6.209 -4.803 1.00 0.00 H new ATOM 0 HB2 ASP B 57 17.520 -8.566 -4.318 1.00 0.00 H new ATOM 0 HB3 ASP B 57 16.465 -9.154 -5.588 1.00 0.00 H new ATOM 2475 N ARG B 58 14.059 -7.633 -6.271 1.00 0.00 N ATOM 2476 CA ARG B 58 13.157 -7.517 -7.404 1.00 0.00 C ATOM 2477 C ARG B 58 12.635 -6.090 -7.571 1.00 0.00 C ATOM 2478 O ARG B 58 12.708 -5.521 -8.661 1.00 0.00 O ATOM 2479 CB ARG B 58 11.992 -8.492 -7.237 1.00 0.00 C ATOM 2480 CG ARG B 58 10.932 -8.379 -8.316 1.00 0.00 C ATOM 2481 CD ARG B 58 11.238 -9.285 -9.496 1.00 0.00 C ATOM 2482 NE ARG B 58 12.115 -8.638 -10.469 1.00 0.00 N ATOM 2483 CZ ARG B 58 11.699 -7.746 -11.365 1.00 0.00 C ATOM 2484 NH1 ARG B 58 10.419 -7.397 -11.418 1.00 0.00 N ATOM 2485 NH2 ARG B 58 12.563 -7.202 -12.210 1.00 0.00 N ATOM 0 H ARG B 58 13.764 -8.305 -5.562 1.00 0.00 H new ATOM 0 HA ARG B 58 13.716 -7.767 -8.306 1.00 0.00 H new ATOM 0 HB2 ARG B 58 12.382 -9.510 -7.231 1.00 0.00 H new ATOM 0 HB3 ARG B 58 11.527 -8.323 -6.266 1.00 0.00 H new ATOM 0 HG2 ARG B 58 9.959 -8.639 -7.900 1.00 0.00 H new ATOM 0 HG3 ARG B 58 10.867 -7.346 -8.657 1.00 0.00 H new ATOM 0 HD2 ARG B 58 11.707 -10.201 -9.138 1.00 0.00 H new ATOM 0 HD3 ARG B 58 10.306 -9.573 -9.983 1.00 0.00 H new ATOM 0 HE ARG B 58 13.105 -8.884 -10.461 1.00 0.00 H new ATOM 0 HH11 ARG B 58 9.750 -7.813 -10.770 1.00 0.00 H new ATOM 0 HH12 ARG B 58 10.105 -6.713 -12.106 1.00 0.00 H new ATOM 0 HH21 ARG B 58 13.547 -7.467 -12.174 1.00 0.00 H new ATOM 0 HH22 ARG B 58 12.244 -6.518 -12.896 1.00 0.00 H new ATOM 2498 N MET B 59 12.088 -5.522 -6.502 1.00 0.00 N ATOM 2499 CA MET B 59 11.537 -4.172 -6.564 1.00 0.00 C ATOM 2500 C MET B 59 12.615 -3.102 -6.584 1.00 0.00 C ATOM 2501 O MET B 59 12.627 -2.242 -7.459 1.00 0.00 O ATOM 2502 CB MET B 59 10.607 -3.929 -5.379 1.00 0.00 C ATOM 2503 CG MET B 59 9.241 -3.407 -5.802 1.00 0.00 C ATOM 2504 SD MET B 59 7.906 -4.490 -5.282 1.00 0.00 S ATOM 2505 CE MET B 59 8.496 -4.905 -3.649 1.00 0.00 C ATOM 0 H MET B 59 12.014 -5.970 -5.589 1.00 0.00 H new ATOM 0 HA MET B 59 10.982 -4.101 -7.500 1.00 0.00 H new ATOM 0 HB2 MET B 59 10.480 -4.859 -4.825 1.00 0.00 H new ATOM 0 HB3 MET B 59 11.070 -3.214 -4.699 1.00 0.00 H new ATOM 0 HG2 MET B 59 9.087 -2.415 -5.378 1.00 0.00 H new ATOM 0 HG3 MET B 59 9.216 -3.298 -6.886 1.00 0.00 H new ATOM 0 HE1 MET B 59 7.649 -5.009 -2.971 1.00 0.00 H new ATOM 0 HE2 MET B 59 9.046 -5.845 -3.689 1.00 0.00 H new ATOM 0 HE3 MET B 59 9.154 -4.115 -3.288 1.00 0.00 H new ATOM 2515 N MET B 60 13.502 -3.144 -5.605 1.00 0.00 N ATOM 2516 CA MET B 60 14.565 -2.152 -5.501 1.00 0.00 C ATOM 2517 C MET B 60 15.367 -2.029 -6.796 1.00 0.00 C ATOM 2518 O MET B 60 15.887 -0.960 -7.109 1.00 0.00 O ATOM 2519 CB MET B 60 15.477 -2.483 -4.325 1.00 0.00 C ATOM 2520 CG MET B 60 14.891 -2.052 -2.992 1.00 0.00 C ATOM 2521 SD MET B 60 15.505 -0.446 -2.456 1.00 0.00 S ATOM 2522 CE MET B 60 14.904 0.588 -3.789 1.00 0.00 C ATOM 0 H MET B 60 13.510 -3.852 -4.871 1.00 0.00 H new ATOM 0 HA MET B 60 14.098 -1.183 -5.326 1.00 0.00 H new ATOM 0 HB2 MET B 60 15.663 -3.557 -4.306 1.00 0.00 H new ATOM 0 HB3 MET B 60 16.441 -1.995 -4.469 1.00 0.00 H new ATOM 0 HG2 MET B 60 13.805 -2.014 -3.072 1.00 0.00 H new ATOM 0 HG3 MET B 60 15.129 -2.800 -2.235 1.00 0.00 H new ATOM 0 HE1 MET B 60 14.641 1.571 -3.397 1.00 0.00 H new ATOM 0 HE2 MET B 60 15.682 0.695 -4.545 1.00 0.00 H new ATOM 0 HE3 MET B 60 14.023 0.128 -4.237 1.00 0.00 H new ATOM 2532 N LYS B 61 15.461 -3.119 -7.547 1.00 0.00 N ATOM 2533 CA LYS B 61 16.193 -3.110 -8.810 1.00 0.00 C ATOM 2534 C LYS B 61 15.364 -2.473 -9.925 1.00 0.00 C ATOM 2535 O LYS B 61 15.759 -1.465 -10.509 1.00 0.00 O ATOM 2536 CB LYS B 61 16.591 -4.530 -9.209 1.00 0.00 C ATOM 2537 CG LYS B 61 17.813 -4.588 -10.108 1.00 0.00 C ATOM 2538 CD LYS B 61 19.064 -4.940 -9.319 1.00 0.00 C ATOM 2539 CE LYS B 61 19.956 -3.726 -9.116 1.00 0.00 C ATOM 2540 NZ LYS B 61 20.661 -3.769 -7.805 1.00 0.00 N ATOM 0 H LYS B 61 15.042 -4.017 -7.306 1.00 0.00 H new ATOM 0 HA LYS B 61 17.094 -2.513 -8.666 1.00 0.00 H new ATOM 0 HB2 LYS B 61 16.785 -5.111 -8.307 1.00 0.00 H new ATOM 0 HB3 LYS B 61 15.752 -5.004 -9.719 1.00 0.00 H new ATOM 0 HG2 LYS B 61 17.655 -5.328 -10.892 1.00 0.00 H new ATOM 0 HG3 LYS B 61 17.950 -3.626 -10.601 1.00 0.00 H new ATOM 0 HD2 LYS B 61 18.780 -5.350 -8.350 1.00 0.00 H new ATOM 0 HD3 LYS B 61 19.620 -5.717 -9.844 1.00 0.00 H new ATOM 0 HE2 LYS B 61 20.689 -3.675 -9.921 1.00 0.00 H new ATOM 0 HE3 LYS B 61 19.354 -2.819 -9.175 1.00 0.00 H new ATOM 0 HZ1 LYS B 61 21.259 -2.924 -7.705 1.00 0.00 H new ATOM 0 HZ2 LYS B 61 19.962 -3.792 -7.035 1.00 0.00 H new ATOM 0 HZ3 LYS B 61 21.255 -4.621 -7.758 1.00 0.00 H new ATOM 2554 N LYS B 62 14.216 -3.080 -10.217 1.00 0.00 N ATOM 2555 CA LYS B 62 13.324 -2.589 -11.268 1.00 0.00 C ATOM 2556 C LYS B 62 12.460 -1.418 -10.792 1.00 0.00 C ATOM 2557 O LYS B 62 11.571 -0.966 -11.510 1.00 0.00 O ATOM 2558 CB LYS B 62 12.426 -3.724 -11.765 1.00 0.00 C ATOM 2559 CG LYS B 62 11.519 -3.322 -12.918 1.00 0.00 C ATOM 2560 CD LYS B 62 10.095 -3.073 -12.447 1.00 0.00 C ATOM 2561 CE LYS B 62 9.253 -4.337 -12.522 1.00 0.00 C ATOM 2562 NZ LYS B 62 7.902 -4.072 -13.092 1.00 0.00 N ATOM 0 H LYS B 62 13.879 -3.916 -9.739 1.00 0.00 H new ATOM 0 HA LYS B 62 13.951 -2.227 -12.083 1.00 0.00 H new ATOM 0 HB2 LYS B 62 13.051 -4.560 -12.080 1.00 0.00 H new ATOM 0 HB3 LYS B 62 11.812 -4.079 -10.937 1.00 0.00 H new ATOM 0 HG2 LYS B 62 11.909 -2.421 -13.392 1.00 0.00 H new ATOM 0 HG3 LYS B 62 11.521 -4.107 -13.674 1.00 0.00 H new ATOM 0 HD2 LYS B 62 10.109 -2.705 -11.421 1.00 0.00 H new ATOM 0 HD3 LYS B 62 9.639 -2.294 -13.059 1.00 0.00 H new ATOM 0 HE2 LYS B 62 9.766 -5.079 -13.134 1.00 0.00 H new ATOM 0 HE3 LYS B 62 9.149 -4.763 -11.524 1.00 0.00 H new ATOM 0 HZ1 LYS B 62 7.360 -4.959 -13.126 1.00 0.00 H new ATOM 0 HZ2 LYS B 62 7.402 -3.383 -12.494 1.00 0.00 H new ATOM 0 HZ3 LYS B 62 8.000 -3.689 -14.054 1.00 0.00 H new ATOM 2576 N LEU B 63 12.717 -0.935 -9.577 1.00 0.00 N ATOM 2577 CA LEU B 63 11.951 0.175 -9.009 1.00 0.00 C ATOM 2578 C LEU B 63 11.792 1.326 -9.993 1.00 0.00 C ATOM 2579 O LEU B 63 10.869 2.131 -9.871 1.00 0.00 O ATOM 2580 CB LEU B 63 12.610 0.677 -7.719 1.00 0.00 C ATOM 2581 CG LEU B 63 13.800 1.618 -7.914 1.00 0.00 C ATOM 2582 CD1 LEU B 63 14.370 2.041 -6.569 1.00 0.00 C ATOM 2583 CD2 LEU B 63 14.874 0.960 -8.767 1.00 0.00 C ATOM 0 H LEU B 63 13.450 -1.295 -8.966 1.00 0.00 H new ATOM 0 HA LEU B 63 10.955 -0.206 -8.783 1.00 0.00 H new ATOM 0 HB2 LEU B 63 11.856 1.191 -7.122 1.00 0.00 H new ATOM 0 HB3 LEU B 63 12.941 -0.186 -7.141 1.00 0.00 H new ATOM 0 HG LEU B 63 13.450 2.508 -8.436 1.00 0.00 H new ATOM 0 HD11 LEU B 63 15.216 2.710 -6.727 1.00 0.00 H new ATOM 0 HD12 LEU B 63 13.601 2.557 -5.994 1.00 0.00 H new ATOM 0 HD13 LEU B 63 14.702 1.159 -6.021 1.00 0.00 H new ATOM 0 HD21 LEU B 63 15.711 1.647 -8.893 1.00 0.00 H new ATOM 0 HD22 LEU B 63 15.222 0.051 -8.277 1.00 0.00 H new ATOM 0 HD23 LEU B 63 14.460 0.710 -9.744 1.00 0.00 H new ATOM 2595 N ASP B 64 12.690 1.401 -10.962 1.00 0.00 N ATOM 2596 CA ASP B 64 12.646 2.455 -11.963 1.00 0.00 C ATOM 2597 C ASP B 64 13.161 3.771 -11.387 1.00 0.00 C ATOM 2598 O ASP B 64 12.492 4.802 -11.466 1.00 0.00 O ATOM 2599 CB ASP B 64 11.223 2.634 -12.499 1.00 0.00 C ATOM 2600 CG ASP B 64 11.199 2.977 -13.976 1.00 0.00 C ATOM 2601 OD1 ASP B 64 11.628 2.131 -14.788 1.00 0.00 O ATOM 2602 OD2 ASP B 64 10.752 4.091 -14.320 1.00 0.00 O ATOM 0 H ASP B 64 13.460 0.743 -11.077 1.00 0.00 H new ATOM 0 HA ASP B 64 13.294 2.161 -12.789 1.00 0.00 H new ATOM 0 HB2 ASP B 64 10.657 1.717 -12.333 1.00 0.00 H new ATOM 0 HB3 ASP B 64 10.723 3.423 -11.938 1.00 0.00 H new ATOM 2607 N LEU B 65 14.357 3.725 -10.810 1.00 0.00 N ATOM 2608 CA LEU B 65 14.972 4.908 -10.220 1.00 0.00 C ATOM 2609 C LEU B 65 16.280 5.240 -10.934 1.00 0.00 C ATOM 2610 O LEU B 65 17.352 5.244 -10.326 1.00 0.00 O ATOM 2611 CB LEU B 65 15.222 4.683 -8.722 1.00 0.00 C ATOM 2612 CG LEU B 65 14.273 5.428 -7.775 1.00 0.00 C ATOM 2613 CD1 LEU B 65 14.147 6.891 -8.176 1.00 0.00 C ATOM 2614 CD2 LEU B 65 12.905 4.757 -7.746 1.00 0.00 C ATOM 0 H LEU B 65 14.921 2.878 -10.738 1.00 0.00 H new ATOM 0 HA LEU B 65 14.291 5.751 -10.338 1.00 0.00 H new ATOM 0 HB2 LEU B 65 15.149 3.615 -8.516 1.00 0.00 H new ATOM 0 HB3 LEU B 65 16.245 4.983 -8.493 1.00 0.00 H new ATOM 0 HG LEU B 65 14.695 5.387 -6.771 1.00 0.00 H new ATOM 0 HD11 LEU B 65 13.469 7.399 -7.490 1.00 0.00 H new ATOM 0 HD12 LEU B 65 15.128 7.365 -8.135 1.00 0.00 H new ATOM 0 HD13 LEU B 65 13.754 6.958 -9.191 1.00 0.00 H new ATOM 0 HD21 LEU B 65 12.247 5.301 -7.068 1.00 0.00 H new ATOM 0 HD22 LEU B 65 12.477 4.761 -8.748 1.00 0.00 H new ATOM 0 HD23 LEU B 65 13.011 3.729 -7.401 1.00 0.00 H new ATOM 2626 N ASN B 66 16.187 5.514 -12.232 1.00 0.00 N ATOM 2627 CA ASN B 66 17.361 5.841 -13.033 1.00 0.00 C ATOM 2628 C ASN B 66 17.758 7.304 -12.854 1.00 0.00 C ATOM 2629 O ASN B 66 17.842 8.059 -13.822 1.00 0.00 O ATOM 2630 CB ASN B 66 17.092 5.548 -14.511 1.00 0.00 C ATOM 2631 CG ASN B 66 18.316 5.770 -15.377 1.00 0.00 C ATOM 2632 OD1 ASN B 66 19.376 5.193 -15.133 1.00 0.00 O ATOM 2633 ND2 ASN B 66 18.175 6.608 -16.397 1.00 0.00 N ATOM 0 H ASN B 66 15.309 5.516 -12.752 1.00 0.00 H new ATOM 0 HA ASN B 66 18.187 5.219 -12.690 1.00 0.00 H new ATOM 0 HB2 ASN B 66 16.757 4.517 -14.619 1.00 0.00 H new ATOM 0 HB3 ASN B 66 16.281 6.185 -14.863 1.00 0.00 H new ATOM 0 HD21 ASN B 66 18.964 6.796 -17.016 1.00 0.00 H new ATOM 0 HD22 ASN B 66 17.278 7.064 -16.562 1.00 0.00 H new ATOM 2640 N SER B 67 18.006 7.697 -11.606 1.00 0.00 N ATOM 2641 CA SER B 67 18.398 9.068 -11.293 1.00 0.00 C ATOM 2642 C SER B 67 17.507 10.079 -12.009 1.00 0.00 C ATOM 2643 O SER B 67 17.938 11.186 -12.327 1.00 0.00 O ATOM 2644 CB SER B 67 19.861 9.302 -11.674 1.00 0.00 C ATOM 2645 OG SER B 67 20.724 9.006 -10.589 1.00 0.00 O ATOM 0 H SER B 67 17.942 7.083 -10.794 1.00 0.00 H new ATOM 0 HA SER B 67 18.278 9.210 -10.219 1.00 0.00 H new ATOM 0 HB2 SER B 67 20.121 8.680 -12.530 1.00 0.00 H new ATOM 0 HB3 SER B 67 19.999 10.339 -11.980 1.00 0.00 H new ATOM 0 HG SER B 67 21.653 9.162 -10.858 1.00 0.00 H new ATOM 2651 N ASP B 68 16.260 9.690 -12.253 1.00 0.00 N ATOM 2652 CA ASP B 68 15.307 10.565 -12.923 1.00 0.00 C ATOM 2653 C ASP B 68 14.436 11.293 -11.905 1.00 0.00 C ATOM 2654 O ASP B 68 13.299 11.664 -12.198 1.00 0.00 O ATOM 2655 CB ASP B 68 14.429 9.760 -13.884 1.00 0.00 C ATOM 2656 CG ASP B 68 14.996 9.720 -15.290 1.00 0.00 C ATOM 2657 OD1 ASP B 68 16.027 9.045 -15.495 1.00 0.00 O ATOM 2658 OD2 ASP B 68 14.408 10.362 -16.186 1.00 0.00 O ATOM 0 H ASP B 68 15.887 8.776 -11.997 1.00 0.00 H new ATOM 0 HA ASP B 68 15.867 11.306 -13.493 1.00 0.00 H new ATOM 0 HB2 ASP B 68 14.323 8.742 -13.509 1.00 0.00 H new ATOM 0 HB3 ASP B 68 13.430 10.195 -13.910 1.00 0.00 H new ATOM 2663 N GLY B 69 14.978 11.493 -10.706 1.00 0.00 N ATOM 2664 CA GLY B 69 14.239 12.173 -9.661 1.00 0.00 C ATOM 2665 C GLY B 69 14.464 11.554 -8.295 1.00 0.00 C ATOM 2666 O GLY B 69 15.489 11.793 -7.658 1.00 0.00 O ATOM 0 H GLY B 69 15.917 11.195 -10.442 1.00 0.00 H new ATOM 0 HA2 GLY B 69 14.535 13.222 -9.634 1.00 0.00 H new ATOM 0 HA3 GLY B 69 13.175 12.148 -9.897 1.00 0.00 H new ATOM 2670 N GLN B 70 13.501 10.755 -7.848 1.00 0.00 N ATOM 2671 CA GLN B 70 13.583 10.095 -6.548 1.00 0.00 C ATOM 2672 C GLN B 70 12.524 8.999 -6.439 1.00 0.00 C ATOM 2673 O GLN B 70 11.902 8.628 -7.434 1.00 0.00 O ATOM 2674 CB GLN B 70 13.393 11.120 -5.420 1.00 0.00 C ATOM 2675 CG GLN B 70 14.658 11.881 -5.044 1.00 0.00 C ATOM 2676 CD GLN B 70 15.885 10.991 -4.952 1.00 0.00 C ATOM 2677 OE1 GLN B 70 15.705 9.784 -4.426 1.00 0.00 O flip ATOM 2678 NE2 GLN B 70 16.982 11.385 -5.348 1.00 0.00 N flip ATOM 0 H GLN B 70 12.649 10.547 -8.370 1.00 0.00 H new ATOM 0 HA GLN B 70 14.569 9.641 -6.453 1.00 0.00 H new ATOM 0 HB2 GLN B 70 12.628 11.836 -5.721 1.00 0.00 H new ATOM 0 HB3 GLN B 70 13.017 10.605 -4.536 1.00 0.00 H new ATOM 0 HG2 GLN B 70 14.838 12.662 -5.783 1.00 0.00 H new ATOM 0 HG3 GLN B 70 14.504 12.378 -4.086 1.00 0.00 H new ATOM 0 HE21 GLN B 70 17.075 12.320 -5.745 1.00 0.00 H new ATOM 0 HE22 GLN B 70 17.798 10.777 -5.279 1.00 0.00 H new ATOM 2687 N LEU B 71 12.319 8.487 -5.226 1.00 0.00 N ATOM 2688 CA LEU B 71 11.330 7.444 -4.990 1.00 0.00 C ATOM 2689 C LEU B 71 9.927 7.978 -5.327 1.00 0.00 C ATOM 2690 O LEU B 71 9.748 8.606 -6.369 1.00 0.00 O ATOM 2691 CB LEU B 71 11.444 6.963 -3.530 1.00 0.00 C ATOM 2692 CG LEU B 71 12.117 5.597 -3.313 1.00 0.00 C ATOM 2693 CD1 LEU B 71 11.073 4.495 -3.216 1.00 0.00 C ATOM 2694 CD2 LEU B 71 13.117 5.283 -4.416 1.00 0.00 C ATOM 0 H LEU B 71 12.827 8.780 -4.392 1.00 0.00 H new ATOM 0 HA LEU B 71 11.512 6.586 -5.637 1.00 0.00 H new ATOM 0 HB2 LEU B 71 12.000 7.712 -2.966 1.00 0.00 H new ATOM 0 HB3 LEU B 71 10.442 6.922 -3.104 1.00 0.00 H new ATOM 0 HG LEU B 71 12.665 5.647 -2.372 1.00 0.00 H new ATOM 0 HD11 LEU B 71 11.569 3.537 -3.063 1.00 0.00 H new ATOM 0 HD12 LEU B 71 10.407 4.697 -2.377 1.00 0.00 H new ATOM 0 HD13 LEU B 71 10.494 4.460 -4.139 1.00 0.00 H new ATOM 0 HD21 LEU B 71 13.572 4.310 -4.229 1.00 0.00 H new ATOM 0 HD22 LEU B 71 12.604 5.264 -5.378 1.00 0.00 H new ATOM 0 HD23 LEU B 71 13.892 6.049 -4.433 1.00 0.00 H new ATOM 2706 N ASP B 72 8.935 7.747 -4.466 1.00 0.00 N ATOM 2707 CA ASP B 72 7.582 8.228 -4.727 1.00 0.00 C ATOM 2708 C ASP B 72 6.621 7.780 -3.635 1.00 0.00 C ATOM 2709 O ASP B 72 7.016 7.117 -2.676 1.00 0.00 O ATOM 2710 CB ASP B 72 7.084 7.731 -6.088 1.00 0.00 C ATOM 2711 CG ASP B 72 6.217 8.754 -6.795 1.00 0.00 C ATOM 2712 OD1 ASP B 72 6.298 9.949 -6.439 1.00 0.00 O ATOM 2713 OD2 ASP B 72 5.458 8.361 -7.705 1.00 0.00 O ATOM 0 H ASP B 72 9.043 7.235 -3.591 1.00 0.00 H new ATOM 0 HA ASP B 72 7.616 9.317 -4.736 1.00 0.00 H new ATOM 0 HB2 ASP B 72 7.939 7.487 -6.718 1.00 0.00 H new ATOM 0 HB3 ASP B 72 6.516 6.811 -5.950 1.00 0.00 H new ATOM 2718 N PHE B 73 5.357 8.150 -3.791 1.00 0.00 N ATOM 2719 CA PHE B 73 4.330 7.794 -2.823 1.00 0.00 C ATOM 2720 C PHE B 73 4.040 6.296 -2.845 1.00 0.00 C ATOM 2721 O PHE B 73 4.133 5.623 -1.816 1.00 0.00 O ATOM 2722 CB PHE B 73 3.049 8.587 -3.091 1.00 0.00 C ATOM 2723 CG PHE B 73 2.413 8.281 -4.415 1.00 0.00 C ATOM 2724 CD1 PHE B 73 2.863 8.890 -5.576 1.00 0.00 C ATOM 2725 CD2 PHE B 73 1.363 7.380 -4.499 1.00 0.00 C ATOM 2726 CE1 PHE B 73 2.279 8.607 -6.796 1.00 0.00 C ATOM 2727 CE2 PHE B 73 0.775 7.093 -5.717 1.00 0.00 C ATOM 2728 CZ PHE B 73 1.233 7.707 -6.866 1.00 0.00 C ATOM 0 H PHE B 73 5.018 8.698 -4.582 1.00 0.00 H new ATOM 0 HA PHE B 73 4.703 8.048 -1.831 1.00 0.00 H new ATOM 0 HB2 PHE B 73 2.331 8.379 -2.297 1.00 0.00 H new ATOM 0 HB3 PHE B 73 3.276 9.652 -3.045 1.00 0.00 H new ATOM 0 HD1 PHE B 73 3.680 9.594 -5.526 1.00 0.00 H new ATOM 0 HD2 PHE B 73 1.000 6.897 -3.604 1.00 0.00 H new ATOM 0 HE1 PHE B 73 2.639 9.088 -7.693 1.00 0.00 H new ATOM 0 HE2 PHE B 73 -0.042 6.389 -5.770 1.00 0.00 H new ATOM 0 HZ PHE B 73 0.774 7.484 -7.818 1.00 0.00 H new ATOM 2738 N GLN B 74 3.685 5.767 -4.014 1.00 0.00 N ATOM 2739 CA GLN B 74 3.387 4.351 -4.118 1.00 0.00 C ATOM 2740 C GLN B 74 4.649 3.515 -4.218 1.00 0.00 C ATOM 2741 O GLN B 74 4.636 2.357 -3.832 1.00 0.00 O ATOM 2742 CB GLN B 74 2.465 4.041 -5.294 1.00 0.00 C ATOM 2743 CG GLN B 74 1.427 2.974 -4.962 1.00 0.00 C ATOM 2744 CD GLN B 74 1.676 1.656 -5.676 1.00 0.00 C ATOM 2745 OE1 GLN B 74 2.007 0.606 -4.917 1.00 0.00 O flip ATOM 2746 NE2 GLN B 74 1.573 1.577 -6.900 1.00 0.00 N flip ATOM 0 H GLN B 74 3.599 6.291 -4.885 1.00 0.00 H new ATOM 0 HA GLN B 74 2.866 4.084 -3.198 1.00 0.00 H new ATOM 0 HB2 GLN B 74 1.956 4.954 -5.602 1.00 0.00 H new ATOM 0 HB3 GLN B 74 3.064 3.708 -6.142 1.00 0.00 H new ATOM 0 HG2 GLN B 74 1.423 2.802 -3.886 1.00 0.00 H new ATOM 0 HG3 GLN B 74 0.437 3.343 -5.229 1.00 0.00 H new ATOM 0 HE21 GLN B 74 1.318 2.401 -7.445 1.00 0.00 H new ATOM 0 HE22 GLN B 74 1.742 0.688 -7.370 1.00 0.00 H new ATOM 2755 N GLU B 75 5.748 4.084 -4.725 1.00 0.00 N ATOM 2756 CA GLU B 75 6.986 3.314 -4.832 1.00 0.00 C ATOM 2757 C GLU B 75 7.211 2.543 -3.545 1.00 0.00 C ATOM 2758 O GLU B 75 7.673 1.411 -3.560 1.00 0.00 O ATOM 2759 CB GLU B 75 8.198 4.203 -5.123 1.00 0.00 C ATOM 2760 CG GLU B 75 8.752 4.015 -6.525 1.00 0.00 C ATOM 2761 CD GLU B 75 8.917 5.320 -7.276 1.00 0.00 C ATOM 2762 OE1 GLU B 75 9.986 5.952 -7.140 1.00 0.00 O ATOM 2763 OE2 GLU B 75 7.979 5.710 -8.004 1.00 0.00 O ATOM 0 H GLU B 75 5.805 5.046 -5.058 1.00 0.00 H new ATOM 0 HA GLU B 75 6.879 2.627 -5.671 1.00 0.00 H new ATOM 0 HB2 GLU B 75 7.916 5.247 -4.987 1.00 0.00 H new ATOM 0 HB3 GLU B 75 8.982 3.987 -4.397 1.00 0.00 H new ATOM 0 HG2 GLU B 75 9.717 3.513 -6.464 1.00 0.00 H new ATOM 0 HG3 GLU B 75 8.087 3.360 -7.088 1.00 0.00 H new ATOM 2770 N PHE B 76 6.837 3.162 -2.433 1.00 0.00 N ATOM 2771 CA PHE B 76 6.957 2.530 -1.134 1.00 0.00 C ATOM 2772 C PHE B 76 5.828 1.532 -0.946 1.00 0.00 C ATOM 2773 O PHE B 76 6.064 0.362 -0.671 1.00 0.00 O ATOM 2774 CB PHE B 76 6.910 3.574 -0.030 1.00 0.00 C ATOM 2775 CG PHE B 76 7.652 3.174 1.213 1.00 0.00 C ATOM 2776 CD1 PHE B 76 7.207 2.118 1.991 1.00 0.00 C ATOM 2777 CD2 PHE B 76 8.791 3.856 1.604 1.00 0.00 C ATOM 2778 CE1 PHE B 76 7.885 1.752 3.138 1.00 0.00 C ATOM 2779 CE2 PHE B 76 9.475 3.495 2.749 1.00 0.00 C ATOM 2780 CZ PHE B 76 9.020 2.441 3.517 1.00 0.00 C ATOM 0 H PHE B 76 6.447 4.104 -2.409 1.00 0.00 H new ATOM 0 HA PHE B 76 7.914 2.010 -1.083 1.00 0.00 H new ATOM 0 HB2 PHE B 76 7.328 4.507 -0.407 1.00 0.00 H new ATOM 0 HB3 PHE B 76 5.869 3.771 0.227 1.00 0.00 H new ATOM 0 HD1 PHE B 76 6.321 1.575 1.698 1.00 0.00 H new ATOM 0 HD2 PHE B 76 9.150 4.681 1.006 1.00 0.00 H new ATOM 0 HE1 PHE B 76 7.528 0.928 3.737 1.00 0.00 H new ATOM 0 HE2 PHE B 76 10.363 4.035 3.043 1.00 0.00 H new ATOM 0 HZ PHE B 76 9.551 2.156 4.413 1.00 0.00 H new ATOM 2790 N LEU B 77 4.594 1.998 -1.118 1.00 0.00 N ATOM 2791 CA LEU B 77 3.437 1.125 -0.986 1.00 0.00 C ATOM 2792 C LEU B 77 3.554 -0.040 -1.964 1.00 0.00 C ATOM 2793 O LEU B 77 3.143 -1.160 -1.667 1.00 0.00 O ATOM 2794 CB LEU B 77 2.145 1.908 -1.214 1.00 0.00 C ATOM 2795 CG LEU B 77 1.475 2.399 0.068 1.00 0.00 C ATOM 2796 CD1 LEU B 77 0.430 3.462 -0.234 1.00 0.00 C ATOM 2797 CD2 LEU B 77 0.858 1.232 0.814 1.00 0.00 C ATOM 0 H LEU B 77 4.373 2.967 -1.347 1.00 0.00 H new ATOM 0 HA LEU B 77 3.407 0.724 0.027 1.00 0.00 H new ATOM 0 HB2 LEU B 77 2.361 2.767 -1.849 1.00 0.00 H new ATOM 0 HB3 LEU B 77 1.443 1.277 -1.759 1.00 0.00 H new ATOM 0 HG LEU B 77 2.236 2.854 0.702 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -0.031 3.794 0.696 1.00 0.00 H new ATOM 0 HD12 LEU B 77 0.906 4.310 -0.726 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -0.335 3.045 -0.889 1.00 0.00 H new ATOM 0 HD21 LEU B 77 0.383 1.593 1.726 1.00 0.00 H new ATOM 0 HD22 LEU B 77 0.111 0.750 0.183 1.00 0.00 H new ATOM 0 HD23 LEU B 77 1.635 0.512 1.070 1.00 0.00 H new ATOM 2809 N ASN B 78 4.150 0.236 -3.121 1.00 0.00 N ATOM 2810 CA ASN B 78 4.366 -0.780 -4.137 1.00 0.00 C ATOM 2811 C ASN B 78 5.523 -1.664 -3.707 1.00 0.00 C ATOM 2812 O ASN B 78 5.419 -2.890 -3.721 1.00 0.00 O ATOM 2813 CB ASN B 78 4.658 -0.134 -5.506 1.00 0.00 C ATOM 2814 CG ASN B 78 5.781 -0.819 -6.264 1.00 0.00 C ATOM 2815 OD1 ASN B 78 6.751 -0.035 -6.714 1.00 0.00 O flip ATOM 2816 ND2 ASN B 78 5.774 -2.037 -6.443 1.00 0.00 N flip ATOM 0 H ASN B 78 4.493 1.162 -3.376 1.00 0.00 H new ATOM 0 HA ASN B 78 3.464 -1.382 -4.243 1.00 0.00 H new ATOM 0 HB2 ASN B 78 3.752 -0.158 -6.112 1.00 0.00 H new ATOM 0 HB3 ASN B 78 4.915 0.915 -5.358 1.00 0.00 H new ATOM 0 HD21 ASN B 78 5.007 -2.602 -6.079 1.00 0.00 H new ATOM 0 HD22 ASN B 78 6.536 -2.482 -6.956 1.00 0.00 H new ATOM 2823 N LEU B 79 6.632 -1.033 -3.317 1.00 0.00 N ATOM 2824 CA LEU B 79 7.788 -1.782 -2.882 1.00 0.00 C ATOM 2825 C LEU B 79 7.466 -2.530 -1.597 1.00 0.00 C ATOM 2826 O LEU B 79 7.468 -3.749 -1.561 1.00 0.00 O ATOM 2827 CB LEU B 79 8.945 -0.819 -2.625 1.00 0.00 C ATOM 2828 CG LEU B 79 9.972 -0.694 -3.750 1.00 0.00 C ATOM 2829 CD1 LEU B 79 9.395 -0.006 -4.973 1.00 0.00 C ATOM 2830 CD2 LEU B 79 11.165 0.075 -3.258 1.00 0.00 C ATOM 0 H LEU B 79 6.744 -0.019 -3.297 1.00 0.00 H new ATOM 0 HA LEU B 79 8.065 -2.497 -3.656 1.00 0.00 H new ATOM 0 HB2 LEU B 79 8.532 0.170 -2.425 1.00 0.00 H new ATOM 0 HB3 LEU B 79 9.463 -1.137 -1.720 1.00 0.00 H new ATOM 0 HG LEU B 79 10.266 -1.702 -4.044 1.00 0.00 H new ATOM 0 HD11 LEU B 79 10.159 0.061 -5.747 1.00 0.00 H new ATOM 0 HD12 LEU B 79 8.548 -0.581 -5.348 1.00 0.00 H new ATOM 0 HD13 LEU B 79 9.062 0.996 -4.704 1.00 0.00 H new ATOM 0 HD21 LEU B 79 11.897 0.164 -4.061 1.00 0.00 H new ATOM 0 HD22 LEU B 79 10.851 1.070 -2.941 1.00 0.00 H new ATOM 0 HD23 LEU B 79 11.613 -0.450 -2.414 1.00 0.00 H new ATOM 2842 N ILE B 80 7.138 -1.783 -0.557 1.00 0.00 N ATOM 2843 CA ILE B 80 6.780 -2.367 0.727 1.00 0.00 C ATOM 2844 C ILE B 80 5.597 -3.311 0.574 1.00 0.00 C ATOM 2845 O ILE B 80 5.611 -4.426 1.095 1.00 0.00 O ATOM 2846 CB ILE B 80 6.489 -1.285 1.795 1.00 0.00 C ATOM 2847 CG1 ILE B 80 6.903 -1.793 3.171 1.00 0.00 C ATOM 2848 CG2 ILE B 80 5.024 -0.888 1.809 1.00 0.00 C ATOM 2849 CD1 ILE B 80 5.863 -2.679 3.817 1.00 0.00 C ATOM 0 H ILE B 80 7.112 -0.764 -0.576 1.00 0.00 H new ATOM 0 HA ILE B 80 7.639 -2.940 1.077 1.00 0.00 H new ATOM 0 HB ILE B 80 7.070 -0.399 1.540 1.00 0.00 H new ATOM 0 HG12 ILE B 80 7.837 -2.347 3.080 1.00 0.00 H new ATOM 0 HG13 ILE B 80 7.100 -0.941 3.822 1.00 0.00 H new ATOM 0 HG21 ILE B 80 4.861 -0.127 2.572 1.00 0.00 H new ATOM 0 HG22 ILE B 80 4.746 -0.490 0.833 1.00 0.00 H new ATOM 0 HG23 ILE B 80 4.412 -1.762 2.032 1.00 0.00 H new ATOM 0 HD11 ILE B 80 6.220 -3.006 4.793 1.00 0.00 H new ATOM 0 HD12 ILE B 80 4.934 -2.121 3.938 1.00 0.00 H new ATOM 0 HD13 ILE B 80 5.684 -3.549 3.186 1.00 0.00 H new ATOM 2861 N GLY B 81 4.587 -2.877 -0.176 1.00 0.00 N ATOM 2862 CA GLY B 81 3.441 -3.729 -0.408 1.00 0.00 C ATOM 2863 C GLY B 81 3.870 -4.995 -1.113 1.00 0.00 C ATOM 2864 O GLY B 81 3.556 -6.101 -0.675 1.00 0.00 O ATOM 0 H GLY B 81 4.544 -1.960 -0.621 1.00 0.00 H new ATOM 0 HA2 GLY B 81 2.963 -3.975 0.540 1.00 0.00 H new ATOM 0 HA3 GLY B 81 2.701 -3.201 -1.010 1.00 0.00 H new ATOM 2868 N GLY B 82 4.621 -4.821 -2.199 1.00 0.00 N ATOM 2869 CA GLY B 82 5.124 -5.964 -2.943 1.00 0.00 C ATOM 2870 C GLY B 82 5.985 -6.875 -2.083 1.00 0.00 C ATOM 2871 O GLY B 82 5.892 -8.098 -2.184 1.00 0.00 O ATOM 0 H GLY B 82 4.889 -3.912 -2.576 1.00 0.00 H new ATOM 0 HA2 GLY B 82 4.285 -6.532 -3.344 1.00 0.00 H new ATOM 0 HA3 GLY B 82 5.707 -5.613 -3.794 1.00 0.00 H new ATOM 2875 N LEU B 83 6.815 -6.285 -1.217 1.00 0.00 N ATOM 2876 CA LEU B 83 7.667 -7.075 -0.329 1.00 0.00 C ATOM 2877 C LEU B 83 6.787 -7.892 0.602 1.00 0.00 C ATOM 2878 O LEU B 83 7.066 -9.055 0.890 1.00 0.00 O ATOM 2879 CB LEU B 83 8.613 -6.176 0.482 1.00 0.00 C ATOM 2880 CG LEU B 83 9.285 -5.068 -0.326 1.00 0.00 C ATOM 2881 CD1 LEU B 83 10.106 -4.144 0.542 1.00 0.00 C ATOM 2882 CD2 LEU B 83 10.154 -5.642 -1.413 1.00 0.00 C ATOM 0 H LEU B 83 6.913 -5.275 -1.114 1.00 0.00 H new ATOM 0 HA LEU B 83 8.285 -7.740 -0.932 1.00 0.00 H new ATOM 0 HB2 LEU B 83 8.051 -5.723 1.298 1.00 0.00 H new ATOM 0 HB3 LEU B 83 9.386 -6.798 0.934 1.00 0.00 H new ATOM 0 HG LEU B 83 8.482 -4.484 -0.776 1.00 0.00 H new ATOM 0 HD11 LEU B 83 10.564 -3.373 -0.078 1.00 0.00 H new ATOM 0 HD12 LEU B 83 9.462 -3.676 1.286 1.00 0.00 H new ATOM 0 HD13 LEU B 83 10.886 -4.715 1.045 1.00 0.00 H new ATOM 0 HD21 LEU B 83 10.620 -4.831 -1.973 1.00 0.00 H new ATOM 0 HD22 LEU B 83 10.928 -6.267 -0.968 1.00 0.00 H new ATOM 0 HD23 LEU B 83 9.544 -6.244 -2.087 1.00 0.00 H new ATOM 2894 N ALA B 84 5.700 -7.269 1.044 1.00 0.00 N ATOM 2895 CA ALA B 84 4.739 -7.926 1.920 1.00 0.00 C ATOM 2896 C ALA B 84 4.176 -9.169 1.259 1.00 0.00 C ATOM 2897 O ALA B 84 3.997 -10.201 1.890 1.00 0.00 O ATOM 2898 CB ALA B 84 3.594 -6.985 2.245 1.00 0.00 C ATOM 0 H ALA B 84 5.462 -6.305 0.808 1.00 0.00 H new ATOM 0 HA ALA B 84 5.258 -8.206 2.837 1.00 0.00 H new ATOM 0 HB1 ALA B 84 2.884 -7.489 2.900 1.00 0.00 H new ATOM 0 HB2 ALA B 84 3.983 -6.098 2.745 1.00 0.00 H new ATOM 0 HB3 ALA B 84 3.092 -6.691 1.323 1.00 0.00 H new ATOM 2904 N VAL B 85 3.889 -9.050 -0.022 1.00 0.00 N ATOM 2905 CA VAL B 85 3.327 -10.158 -0.780 1.00 0.00 C ATOM 2906 C VAL B 85 4.372 -11.215 -1.071 1.00 0.00 C ATOM 2907 O VAL B 85 4.051 -12.349 -1.424 1.00 0.00 O ATOM 2908 CB VAL B 85 2.672 -9.710 -2.109 1.00 0.00 C ATOM 2909 CG1 VAL B 85 1.216 -10.130 -2.125 1.00 0.00 C ATOM 2910 CG2 VAL B 85 2.783 -8.206 -2.332 1.00 0.00 C ATOM 0 H VAL B 85 4.035 -8.198 -0.563 1.00 0.00 H new ATOM 0 HA VAL B 85 2.547 -10.580 -0.147 1.00 0.00 H new ATOM 0 HB VAL B 85 3.211 -10.197 -2.922 1.00 0.00 H new ATOM 0 HG11 VAL B 85 0.756 -9.814 -3.061 1.00 0.00 H new ATOM 0 HG12 VAL B 85 1.149 -11.214 -2.036 1.00 0.00 H new ATOM 0 HG13 VAL B 85 0.694 -9.664 -1.289 1.00 0.00 H new ATOM 0 HG21 VAL B 85 2.309 -7.942 -3.277 1.00 0.00 H new ATOM 0 HG22 VAL B 85 2.286 -7.680 -1.517 1.00 0.00 H new ATOM 0 HG23 VAL B 85 3.834 -7.919 -2.361 1.00 0.00 H new ATOM 2920 N ALA B 86 5.623 -10.828 -0.934 1.00 0.00 N ATOM 2921 CA ALA B 86 6.727 -11.722 -1.190 1.00 0.00 C ATOM 2922 C ALA B 86 7.435 -12.117 0.100 1.00 0.00 C ATOM 2923 O ALA B 86 8.569 -12.592 0.077 1.00 0.00 O ATOM 2924 CB ALA B 86 7.671 -11.029 -2.136 1.00 0.00 C ATOM 0 H ALA B 86 5.900 -9.890 -0.644 1.00 0.00 H new ATOM 0 HA ALA B 86 6.359 -12.646 -1.636 1.00 0.00 H new ATOM 0 HB1 ALA B 86 8.518 -11.682 -2.349 1.00 0.00 H new ATOM 0 HB2 ALA B 86 7.150 -10.797 -3.065 1.00 0.00 H new ATOM 0 HB3 ALA B 86 8.030 -10.106 -1.681 1.00 0.00 H new ATOM 2930 N CYS B 87 6.758 -11.912 1.226 1.00 0.00 N ATOM 2931 CA CYS B 87 7.327 -12.243 2.526 1.00 0.00 C ATOM 2932 C CYS B 87 6.241 -12.380 3.596 1.00 0.00 C ATOM 2933 O CYS B 87 6.316 -13.261 4.453 1.00 0.00 O ATOM 2934 CB CYS B 87 8.341 -11.174 2.941 1.00 0.00 C ATOM 2935 SG CYS B 87 9.412 -11.666 4.312 1.00 0.00 S ATOM 0 H CYS B 87 5.817 -11.519 1.263 1.00 0.00 H new ATOM 0 HA CYS B 87 7.831 -13.205 2.436 1.00 0.00 H new ATOM 0 HB2 CYS B 87 8.962 -10.924 2.081 1.00 0.00 H new ATOM 0 HB3 CYS B 87 7.804 -10.268 3.221 1.00 0.00 H new ATOM 0 HG CYS B 87 10.562 -11.070 4.200 1.00 0.00 H new ATOM 2941 N HIS B 88 5.239 -11.504 3.549 1.00 0.00 N ATOM 2942 CA HIS B 88 4.151 -11.535 4.527 1.00 0.00 C ATOM 2943 C HIS B 88 2.799 -11.278 3.866 1.00 0.00 C ATOM 2944 O HIS B 88 2.380 -10.129 3.726 1.00 0.00 O ATOM 2945 CB HIS B 88 4.395 -10.483 5.608 1.00 0.00 C ATOM 2946 CG HIS B 88 4.602 -11.062 6.972 1.00 0.00 C ATOM 2947 ND1 HIS B 88 3.589 -11.185 7.900 1.00 0.00 N ATOM 2948 CD2 HIS B 88 5.715 -11.554 7.566 1.00 0.00 C ATOM 2949 CE1 HIS B 88 4.070 -11.726 9.005 1.00 0.00 C ATOM 2950 NE2 HIS B 88 5.356 -11.960 8.828 1.00 0.00 N ATOM 0 H HIS B 88 5.157 -10.767 2.848 1.00 0.00 H new ATOM 0 HA HIS B 88 4.131 -12.529 4.973 1.00 0.00 H new ATOM 0 HB2 HIS B 88 5.270 -9.892 5.337 1.00 0.00 H new ATOM 0 HB3 HIS B 88 3.546 -9.801 5.637 1.00 0.00 H new ATOM 0 HD2 HIS B 88 6.701 -11.616 7.129 1.00 0.00 H new ATOM 0 HE1 HIS B 88 3.506 -11.940 9.901 1.00 0.00 H new ATOM 0 HE2 HIS B 88 5.983 -12.375 9.517 1.00 0.00 H new ATOM 2959 N GLU B 89 2.120 -12.345 3.455 1.00 0.00 N ATOM 2960 CA GLU B 89 0.821 -12.208 2.804 1.00 0.00 C ATOM 2961 C GLU B 89 0.231 -13.570 2.451 1.00 0.00 C ATOM 2962 O GLU B 89 0.731 -14.607 2.885 1.00 0.00 O ATOM 2963 CB GLU B 89 0.965 -11.360 1.538 1.00 0.00 C ATOM 2964 CG GLU B 89 0.163 -10.070 1.565 1.00 0.00 C ATOM 2965 CD GLU B 89 -1.231 -10.236 0.991 1.00 0.00 C ATOM 2966 OE1 GLU B 89 -2.009 -11.039 1.548 1.00 0.00 O ATOM 2967 OE2 GLU B 89 -1.543 -9.565 -0.014 1.00 0.00 O ATOM 0 H GLU B 89 2.444 -13.306 3.560 1.00 0.00 H new ATOM 0 HA GLU B 89 0.142 -11.716 3.500 1.00 0.00 H new ATOM 0 HB2 GLU B 89 2.018 -11.118 1.392 1.00 0.00 H new ATOM 0 HB3 GLU B 89 0.652 -11.953 0.678 1.00 0.00 H new ATOM 0 HG2 GLU B 89 0.088 -9.715 2.593 1.00 0.00 H new ATOM 0 HG3 GLU B 89 0.695 -9.304 1.001 1.00 0.00 H new ATOM 2974 N SER B 90 -0.834 -13.554 1.655 1.00 0.00 N ATOM 2975 CA SER B 90 -1.494 -14.782 1.232 1.00 0.00 C ATOM 2976 C SER B 90 -0.683 -15.482 0.146 1.00 0.00 C ATOM 2977 O SER B 90 -0.744 -16.702 0.003 1.00 0.00 O ATOM 2978 CB SER B 90 -2.903 -14.478 0.717 1.00 0.00 C ATOM 2979 OG SER B 90 -3.675 -15.661 0.613 1.00 0.00 O ATOM 0 H SER B 90 -1.258 -12.701 1.290 1.00 0.00 H new ATOM 0 HA SER B 90 -1.567 -15.445 2.094 1.00 0.00 H new ATOM 0 HB2 SER B 90 -3.396 -13.777 1.390 1.00 0.00 H new ATOM 0 HB3 SER B 90 -2.841 -13.994 -0.258 1.00 0.00 H new ATOM 0 HG SER B 90 -4.571 -15.439 0.283 1.00 0.00 H new ATOM 2985 N PHE B 91 0.082 -14.700 -0.612 1.00 0.00 N ATOM 2986 CA PHE B 91 0.911 -15.246 -1.681 1.00 0.00 C ATOM 2987 C PHE B 91 1.869 -16.298 -1.139 1.00 0.00 C ATOM 2988 O PHE B 91 1.915 -17.427 -1.629 1.00 0.00 O ATOM 2989 CB PHE B 91 1.704 -14.127 -2.363 1.00 0.00 C ATOM 2990 CG PHE B 91 1.572 -14.124 -3.859 1.00 0.00 C ATOM 2991 CD1 PHE B 91 2.386 -14.928 -4.641 1.00 0.00 C ATOM 2992 CD2 PHE B 91 0.635 -13.316 -4.483 1.00 0.00 C ATOM 2993 CE1 PHE B 91 2.266 -14.928 -6.017 1.00 0.00 C ATOM 2994 CE2 PHE B 91 0.511 -13.312 -5.860 1.00 0.00 C ATOM 2995 CZ PHE B 91 1.328 -14.119 -6.628 1.00 0.00 C ATOM 0 H PHE B 91 0.144 -13.688 -0.505 1.00 0.00 H new ATOM 0 HA PHE B 91 0.254 -15.716 -2.412 1.00 0.00 H new ATOM 0 HB2 PHE B 91 1.368 -13.166 -1.975 1.00 0.00 H new ATOM 0 HB3 PHE B 91 2.757 -14.226 -2.099 1.00 0.00 H new ATOM 0 HD1 PHE B 91 3.122 -15.562 -4.169 1.00 0.00 H new ATOM 0 HD2 PHE B 91 -0.005 -12.682 -3.887 1.00 0.00 H new ATOM 0 HE1 PHE B 91 2.905 -15.560 -6.615 1.00 0.00 H new ATOM 0 HE2 PHE B 91 -0.224 -12.679 -6.335 1.00 0.00 H new ATOM 0 HZ PHE B 91 1.233 -14.117 -7.704 1.00 0.00 H new ATOM 3005 N VAL B 92 2.636 -15.918 -0.122 1.00 0.00 N ATOM 3006 CA VAL B 92 3.596 -16.825 0.490 1.00 0.00 C ATOM 3007 C VAL B 92 2.924 -17.732 1.516 1.00 0.00 C ATOM 3008 O VAL B 92 3.413 -18.824 1.807 1.00 0.00 O ATOM 3009 CB VAL B 92 4.740 -16.053 1.174 1.00 0.00 C ATOM 3010 CG1 VAL B 92 5.603 -15.346 0.139 1.00 0.00 C ATOM 3011 CG2 VAL B 92 4.187 -15.060 2.186 1.00 0.00 C ATOM 0 H VAL B 92 2.610 -14.987 0.295 1.00 0.00 H new ATOM 0 HA VAL B 92 4.008 -17.436 -0.313 1.00 0.00 H new ATOM 0 HB VAL B 92 5.366 -16.768 1.707 1.00 0.00 H new ATOM 0 HG11 VAL B 92 6.405 -14.806 0.642 1.00 0.00 H new ATOM 0 HG12 VAL B 92 6.031 -16.082 -0.541 1.00 0.00 H new ATOM 0 HG13 VAL B 92 4.991 -14.643 -0.426 1.00 0.00 H new ATOM 0 HG21 VAL B 92 5.011 -14.525 2.658 1.00 0.00 H new ATOM 0 HG22 VAL B 92 3.535 -14.348 1.679 1.00 0.00 H new ATOM 0 HG23 VAL B 92 3.618 -15.595 2.947 1.00 0.00 H new ATOM 3021 N LYS B 93 1.803 -17.272 2.064 1.00 0.00 N ATOM 3022 CA LYS B 93 1.065 -18.042 3.060 1.00 0.00 C ATOM 3023 C LYS B 93 0.145 -19.071 2.403 1.00 0.00 C ATOM 3024 O LYS B 93 -0.369 -19.968 3.070 1.00 0.00 O ATOM 3025 CB LYS B 93 0.243 -17.105 3.949 1.00 0.00 C ATOM 3026 CG LYS B 93 -0.422 -17.807 5.122 1.00 0.00 C ATOM 3027 CD LYS B 93 -1.814 -18.304 4.759 1.00 0.00 C ATOM 3028 CE LYS B 93 -2.889 -17.594 5.567 1.00 0.00 C ATOM 3029 NZ LYS B 93 -3.183 -16.237 5.028 1.00 0.00 N ATOM 0 H LYS B 93 1.386 -16.370 1.835 1.00 0.00 H new ATOM 0 HA LYS B 93 1.792 -18.578 3.670 1.00 0.00 H new ATOM 0 HB2 LYS B 93 0.892 -16.316 4.329 1.00 0.00 H new ATOM 0 HB3 LYS B 93 -0.524 -16.623 3.343 1.00 0.00 H new ATOM 0 HG2 LYS B 93 0.194 -18.648 5.441 1.00 0.00 H new ATOM 0 HG3 LYS B 93 -0.488 -17.122 5.967 1.00 0.00 H new ATOM 0 HD2 LYS B 93 -1.992 -18.145 3.696 1.00 0.00 H new ATOM 0 HD3 LYS B 93 -1.875 -19.378 4.935 1.00 0.00 H new ATOM 0 HE2 LYS B 93 -3.801 -18.192 5.563 1.00 0.00 H new ATOM 0 HE3 LYS B 93 -2.567 -17.511 6.605 1.00 0.00 H new ATOM 0 HZ1 LYS B 93 -3.921 -15.786 5.606 1.00 0.00 H new ATOM 0 HZ2 LYS B 93 -2.319 -15.658 5.055 1.00 0.00 H new ATOM 0 HZ3 LYS B 93 -3.514 -16.318 4.046 1.00 0.00 H new ATOM 3043 N ALA B 94 -0.061 -18.936 1.095 1.00 0.00 N ATOM 3044 CA ALA B 94 -0.920 -19.858 0.361 1.00 0.00 C ATOM 3045 C ALA B 94 -0.172 -21.133 -0.013 1.00 0.00 C ATOM 3046 O ALA B 94 -0.734 -22.228 0.027 1.00 0.00 O ATOM 3047 CB ALA B 94 -1.471 -19.184 -0.887 1.00 0.00 C ATOM 0 H ALA B 94 0.354 -18.199 0.524 1.00 0.00 H new ATOM 0 HA ALA B 94 -1.750 -20.134 1.011 1.00 0.00 H new ATOM 0 HB1 ALA B 94 -2.111 -19.883 -1.426 1.00 0.00 H new ATOM 0 HB2 ALA B 94 -2.052 -18.307 -0.601 1.00 0.00 H new ATOM 0 HB3 ALA B 94 -0.646 -18.878 -1.530 1.00 0.00 H new ATOM 3053 N ALA B 95 1.097 -20.985 -0.379 1.00 0.00 N ATOM 3054 CA ALA B 95 1.919 -22.126 -0.762 1.00 0.00 C ATOM 3055 C ALA B 95 3.282 -22.084 -0.075 1.00 0.00 C ATOM 3056 O ALA B 95 4.322 -22.173 -0.731 1.00 0.00 O ATOM 3057 CB ALA B 95 2.085 -22.167 -2.275 1.00 0.00 C ATOM 0 H ALA B 95 1.578 -20.086 -0.418 1.00 0.00 H new ATOM 0 HA ALA B 95 1.412 -23.034 -0.436 1.00 0.00 H new ATOM 0 HB1 ALA B 95 2.701 -23.023 -2.550 1.00 0.00 H new ATOM 0 HB2 ALA B 95 1.106 -22.257 -2.746 1.00 0.00 H new ATOM 0 HB3 ALA B 95 2.567 -21.250 -2.613 1.00 0.00 H new ATOM 3063 N PRO B 96 3.299 -21.946 1.264 1.00 0.00 N ATOM 3064 CA PRO B 96 4.528 -21.889 2.051 1.00 0.00 C ATOM 3065 C PRO B 96 5.591 -22.884 1.574 1.00 0.00 C ATOM 3066 O PRO B 96 6.697 -22.485 1.209 1.00 0.00 O ATOM 3067 CB PRO B 96 4.053 -22.218 3.480 1.00 0.00 C ATOM 3068 CG PRO B 96 2.590 -22.516 3.374 1.00 0.00 C ATOM 3069 CD PRO B 96 2.128 -21.828 2.132 1.00 0.00 C ATOM 0 HA PRO B 96 5.018 -20.919 1.968 1.00 0.00 H new ATOM 0 HB2 PRO B 96 4.596 -23.072 3.884 1.00 0.00 H new ATOM 0 HB3 PRO B 96 4.232 -21.379 4.153 1.00 0.00 H new ATOM 0 HG2 PRO B 96 2.412 -23.590 3.316 1.00 0.00 H new ATOM 0 HG3 PRO B 96 2.051 -22.150 4.248 1.00 0.00 H new ATOM 0 HD2 PRO B 96 1.251 -22.310 1.701 1.00 0.00 H new ATOM 0 HD3 PRO B 96 1.861 -20.788 2.317 1.00 0.00 H new ATOM 3077 N PRO B 97 5.277 -24.193 1.558 1.00 0.00 N ATOM 3078 CA PRO B 97 6.223 -25.221 1.111 1.00 0.00 C ATOM 3079 C PRO B 97 6.463 -25.164 -0.393 1.00 0.00 C ATOM 3080 O PRO B 97 7.565 -25.435 -0.869 1.00 0.00 O ATOM 3081 CB PRO B 97 5.529 -26.531 1.489 1.00 0.00 C ATOM 3082 CG PRO B 97 4.079 -26.197 1.488 1.00 0.00 C ATOM 3083 CD PRO B 97 3.986 -24.774 1.967 1.00 0.00 C ATOM 0 HA PRO B 97 7.206 -25.098 1.565 1.00 0.00 H new ATOM 0 HB2 PRO B 97 5.755 -27.321 0.773 1.00 0.00 H new ATOM 0 HB3 PRO B 97 5.854 -26.885 2.467 1.00 0.00 H new ATOM 0 HG2 PRO B 97 3.654 -26.302 0.490 1.00 0.00 H new ATOM 0 HG3 PRO B 97 3.523 -26.867 2.143 1.00 0.00 H new ATOM 0 HD2 PRO B 97 3.146 -24.250 1.510 1.00 0.00 H new ATOM 0 HD3 PRO B 97 3.845 -24.721 3.047 1.00 0.00 H new ATOM 3091 N GLN B 98 5.420 -24.808 -1.137 1.00 0.00 N ATOM 3092 CA GLN B 98 5.511 -24.713 -2.588 1.00 0.00 C ATOM 3093 C GLN B 98 6.182 -23.407 -3.006 1.00 0.00 C ATOM 3094 O GLN B 98 5.567 -22.341 -2.967 1.00 0.00 O ATOM 3095 CB GLN B 98 4.118 -24.810 -3.214 1.00 0.00 C ATOM 3096 CG GLN B 98 3.765 -26.206 -3.699 1.00 0.00 C ATOM 3097 CD GLN B 98 2.798 -26.192 -4.866 1.00 0.00 C ATOM 3098 OE1 GLN B 98 1.681 -25.686 -4.756 1.00 0.00 O ATOM 3099 NE2 GLN B 98 3.223 -26.749 -5.994 1.00 0.00 N ATOM 0 H GLN B 98 4.501 -24.580 -0.757 1.00 0.00 H new ATOM 0 HA GLN B 98 6.120 -25.543 -2.946 1.00 0.00 H new ATOM 0 HB2 GLN B 98 3.377 -24.491 -2.482 1.00 0.00 H new ATOM 0 HB3 GLN B 98 4.057 -24.117 -4.053 1.00 0.00 H new ATOM 0 HG2 GLN B 98 4.677 -26.725 -3.994 1.00 0.00 H new ATOM 0 HG3 GLN B 98 3.328 -26.772 -2.877 1.00 0.00 H new ATOM 0 HE21 GLN B 98 4.157 -27.157 -6.041 1.00 0.00 H new ATOM 0 HE22 GLN B 98 2.616 -26.769 -6.813 1.00 0.00 H new ATOM 3108 N LYS B 99 7.446 -23.499 -3.405 1.00 0.00 N ATOM 3109 CA LYS B 99 8.201 -22.326 -3.830 1.00 0.00 C ATOM 3110 C LYS B 99 9.119 -22.662 -5.001 1.00 0.00 C ATOM 3111 O LYS B 99 9.204 -21.908 -5.971 1.00 0.00 O ATOM 3112 CB LYS B 99 9.023 -21.774 -2.664 1.00 0.00 C ATOM 3113 CG LYS B 99 8.174 -21.239 -1.521 1.00 0.00 C ATOM 3114 CD LYS B 99 8.660 -19.877 -1.052 1.00 0.00 C ATOM 3115 CE LYS B 99 7.826 -18.753 -1.645 1.00 0.00 C ATOM 3116 NZ LYS B 99 7.581 -17.663 -0.661 1.00 0.00 N ATOM 0 H LYS B 99 7.969 -24.374 -3.443 1.00 0.00 H new ATOM 0 HA LYS B 99 7.490 -21.567 -4.157 1.00 0.00 H new ATOM 0 HB2 LYS B 99 9.674 -22.561 -2.284 1.00 0.00 H new ATOM 0 HB3 LYS B 99 9.668 -20.976 -3.031 1.00 0.00 H new ATOM 0 HG2 LYS B 99 7.135 -21.164 -1.843 1.00 0.00 H new ATOM 0 HG3 LYS B 99 8.200 -21.942 -0.688 1.00 0.00 H new ATOM 0 HD2 LYS B 99 8.616 -19.829 0.036 1.00 0.00 H new ATOM 0 HD3 LYS B 99 9.704 -19.745 -1.335 1.00 0.00 H new ATOM 0 HE2 LYS B 99 8.335 -18.346 -2.518 1.00 0.00 H new ATOM 0 HE3 LYS B 99 6.872 -19.152 -1.989 1.00 0.00 H new ATOM 0 HZ1 LYS B 99 7.555 -16.748 -1.155 1.00 0.00 H new ATOM 0 HZ2 LYS B 99 6.671 -17.825 -0.183 1.00 0.00 H new ATOM 0 HZ3 LYS B 99 8.345 -17.653 0.044 1.00 0.00 H new ATOM 3130 N ARG B 100 9.806 -23.797 -4.904 1.00 0.00 N ATOM 3131 CA ARG B 100 10.719 -24.235 -5.957 1.00 0.00 C ATOM 3132 C ARG B 100 10.036 -24.214 -7.321 1.00 0.00 C ATOM 3133 O ARG B 100 8.810 -24.141 -7.412 1.00 0.00 O ATOM 3134 CB ARG B 100 11.235 -25.644 -5.656 1.00 0.00 C ATOM 3135 CG ARG B 100 10.129 -26.646 -5.365 1.00 0.00 C ATOM 3136 CD ARG B 100 10.640 -28.076 -5.438 1.00 0.00 C ATOM 3137 NE ARG B 100 11.543 -28.392 -4.334 1.00 0.00 N ATOM 3138 CZ ARG B 100 11.839 -29.631 -3.949 1.00 0.00 C ATOM 3139 NH1 ARG B 100 11.306 -30.673 -4.575 1.00 0.00 N ATOM 3140 NH2 ARG B 100 12.671 -29.829 -2.935 1.00 0.00 N ATOM 0 H ARG B 100 9.748 -24.431 -4.107 1.00 0.00 H new ATOM 0 HA ARG B 100 11.559 -23.541 -5.984 1.00 0.00 H new ATOM 0 HB2 ARG B 100 11.820 -25.997 -6.505 1.00 0.00 H new ATOM 0 HB3 ARG B 100 11.909 -25.600 -4.801 1.00 0.00 H new ATOM 0 HG2 ARG B 100 9.716 -26.456 -4.374 1.00 0.00 H new ATOM 0 HG3 ARG B 100 9.317 -26.512 -6.080 1.00 0.00 H new ATOM 0 HD2 ARG B 100 9.795 -28.764 -5.423 1.00 0.00 H new ATOM 0 HD3 ARG B 100 11.158 -28.228 -6.385 1.00 0.00 H new ATOM 0 HE ARG B 100 11.972 -27.617 -3.828 1.00 0.00 H new ATOM 0 HH11 ARG B 100 10.666 -30.526 -5.356 1.00 0.00 H new ATOM 0 HH12 ARG B 100 11.537 -31.620 -4.276 1.00 0.00 H new ATOM 0 HH21 ARG B 100 13.084 -29.032 -2.451 1.00 0.00 H new ATOM 0 HH22 ARG B 100 12.898 -30.778 -2.640 1.00 0.00 H new ATOM 3153 N PHE B 101 10.837 -24.277 -8.379 1.00 0.00 N ATOM 3154 CA PHE B 101 10.311 -24.263 -9.739 1.00 0.00 C ATOM 3155 C PHE B 101 9.542 -22.976 -10.012 1.00 0.00 C ATOM 3156 O PHE B 101 8.342 -22.920 -9.671 1.00 0.00 O ATOM 3157 CB PHE B 101 9.401 -25.472 -9.969 1.00 0.00 C ATOM 3158 CG PHE B 101 10.153 -26.755 -10.190 1.00 0.00 C ATOM 3159 CD1 PHE B 101 10.566 -27.119 -11.462 1.00 0.00 C ATOM 3160 CD2 PHE B 101 10.443 -27.595 -9.128 1.00 0.00 C ATOM 3161 CE1 PHE B 101 11.257 -28.298 -11.669 1.00 0.00 C ATOM 3162 CE2 PHE B 101 11.134 -28.775 -9.329 1.00 0.00 C ATOM 3163 CZ PHE B 101 11.541 -29.127 -10.601 1.00 0.00 C ATOM 3164 OXT PHE B 101 10.146 -22.032 -10.566 1.00 0.00 O ATOM 0 H PHE B 101 11.853 -24.338 -8.321 1.00 0.00 H new ATOM 0 HA PHE B 101 11.154 -24.314 -10.428 1.00 0.00 H new ATOM 0 HB2 PHE B 101 8.742 -25.590 -9.109 1.00 0.00 H new ATOM 0 HB3 PHE B 101 8.765 -25.279 -10.833 1.00 0.00 H new ATOM 0 HD1 PHE B 101 10.346 -26.475 -12.300 1.00 0.00 H new ATOM 0 HD2 PHE B 101 10.126 -27.325 -8.132 1.00 0.00 H new ATOM 0 HE1 PHE B 101 11.575 -28.571 -12.665 1.00 0.00 H new ATOM 0 HE2 PHE B 101 11.355 -29.421 -8.492 1.00 0.00 H new ATOM 0 HZ PHE B 101 12.080 -30.049 -10.760 1.00 0.00 H new TER 3174 PHE B 101