USER MOD reduce.3.24.130724 H: found=0, std=0, add=775, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 773 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 37 GLN : amide:sc= -0.448 K(o=-1.5,f=-3.6!) USER MOD Set 1.2: A 53 SER OG : rot 140:sc= -1.09 USER MOD Set 2.1: A 25 GLN :FLIP amide:sc= 0.0953 F(o=-3.8,f=-1.9) USER MOD Set 2.2: A 77 GLN : amide:sc= -1.98 K(o=-1.9,f=-8.1!) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 60:sc= 1.2 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 57:sc= 0.849 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 THR OG1 : rot 31:sc= 1.22 USER MOD Single : A 13 ASN : amide:sc= -2.93! C(o=-2.9!,f=-5.2!) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 15 SER OG : rot 180:sc= -0.433 USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 23 TYR OH : rot 23:sc= -2.53! USER MOD Single : A 24 GLN : amide:sc= -0.0115 X(o=-0.012,f=0) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 46 ASN : amide:sc= 0.441 X(o=0.44,f=-0.044) USER MOD Single : A 48 THR OG1 : rot 180:sc= 0.0285 USER MOD Single : A 49 GLN : amide:sc= 0 K(o=0,f=-0.95) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 SER OG : rot 180:sc= 0.0384 USER MOD Single : A 67 GLN : amide:sc= -0.023 X(o=-0.023,f=0) USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 72 ASN : amide:sc= -0.0641 K(o=-0.064,f=-2.8!) USER MOD Single : A 76 MET CE :methyl 161:sc= -7.08! (180deg=-7.53!) USER MOD Single : A 78 ASN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 81 ASN : amide:sc= -0.143 K(o=-0.14,f=-1.5!) USER MOD Single : A 91 TYR OH : rot 70:sc= 0.608! USER MOD Single : A 92 GLN : amide:sc= 0 X(o=0,f=0.45) USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 20.208 -22.556 -28.148 1.00 0.00 N ATOM 2 CA GLY A 1 19.628 -21.587 -27.235 1.00 0.00 C ATOM 3 C GLY A 1 19.256 -20.296 -27.968 1.00 0.00 C ATOM 4 O GLY A 1 20.091 -19.702 -28.648 1.00 0.00 O ATOM 0 H1 GLY A 1 20.451 -23.422 -27.626 1.00 0.00 H new ATOM 0 H2 GLY A 1 19.521 -22.783 -28.895 1.00 0.00 H new ATOM 0 H3 GLY A 1 21.067 -22.157 -28.577 1.00 0.00 H new ATOM 0 HA2 GLY A 1 18.741 -22.011 -26.765 1.00 0.00 H new ATOM 0 HA3 GLY A 1 20.336 -21.365 -26.437 1.00 0.00 H new ATOM 8 N SER A 2 18.002 -19.901 -27.805 1.00 0.00 N ATOM 9 CA SER A 2 17.510 -18.692 -28.443 1.00 0.00 C ATOM 10 C SER A 2 16.582 -17.937 -27.489 1.00 0.00 C ATOM 11 O SER A 2 15.953 -18.542 -26.621 1.00 0.00 O ATOM 12 CB SER A 2 16.779 -19.016 -29.748 1.00 0.00 C ATOM 13 OG SER A 2 15.843 -20.079 -29.585 1.00 0.00 O ATOM 0 H SER A 2 17.312 -20.397 -27.240 1.00 0.00 H new ATOM 0 HA SER A 2 18.365 -18.061 -28.684 1.00 0.00 H new ATOM 0 HB2 SER A 2 16.259 -18.126 -30.103 1.00 0.00 H new ATOM 0 HB3 SER A 2 17.506 -19.287 -30.513 1.00 0.00 H new ATOM 0 HG SER A 2 15.396 -20.255 -30.439 1.00 0.00 H new ATOM 19 N SER A 3 16.527 -16.628 -27.681 1.00 0.00 N ATOM 20 CA SER A 3 15.687 -15.784 -26.848 1.00 0.00 C ATOM 21 C SER A 3 15.857 -14.317 -27.249 1.00 0.00 C ATOM 22 O SER A 3 16.751 -13.982 -28.024 1.00 0.00 O ATOM 23 CB SER A 3 16.017 -15.971 -25.365 1.00 0.00 C ATOM 24 OG SER A 3 15.147 -16.911 -24.739 1.00 0.00 O ATOM 0 H SER A 3 17.050 -16.130 -28.401 1.00 0.00 H new ATOM 0 HA SER A 3 14.649 -16.078 -27.001 1.00 0.00 H new ATOM 0 HB2 SER A 3 17.049 -16.308 -25.263 1.00 0.00 H new ATOM 0 HB3 SER A 3 15.943 -15.011 -24.853 1.00 0.00 H new ATOM 0 HG SER A 3 15.227 -17.779 -25.186 1.00 0.00 H new ATOM 30 N GLY A 4 14.985 -13.483 -26.702 1.00 0.00 N ATOM 31 CA GLY A 4 15.028 -12.060 -26.993 1.00 0.00 C ATOM 32 C GLY A 4 13.778 -11.354 -26.464 1.00 0.00 C ATOM 33 O GLY A 4 13.300 -11.664 -25.373 1.00 0.00 O ATOM 0 H GLY A 4 14.245 -13.765 -26.059 1.00 0.00 H new ATOM 0 HA2 GLY A 4 15.917 -11.620 -26.542 1.00 0.00 H new ATOM 0 HA3 GLY A 4 15.108 -11.908 -28.069 1.00 0.00 H new ATOM 37 N SER A 5 13.283 -10.419 -27.261 1.00 0.00 N ATOM 38 CA SER A 5 12.097 -9.667 -26.887 1.00 0.00 C ATOM 39 C SER A 5 12.397 -8.787 -25.672 1.00 0.00 C ATOM 40 O SER A 5 13.145 -9.187 -24.781 1.00 0.00 O ATOM 41 CB SER A 5 10.923 -10.602 -26.588 1.00 0.00 C ATOM 42 OG SER A 5 9.683 -9.902 -26.540 1.00 0.00 O ATOM 0 H SER A 5 13.682 -10.165 -28.165 1.00 0.00 H new ATOM 0 HA SER A 5 11.816 -9.032 -27.727 1.00 0.00 H new ATOM 0 HB2 SER A 5 10.873 -11.377 -27.353 1.00 0.00 H new ATOM 0 HB3 SER A 5 11.093 -11.105 -25.636 1.00 0.00 H new ATOM 0 HG SER A 5 8.958 -10.533 -26.349 1.00 0.00 H new ATOM 48 N SER A 6 11.798 -7.605 -25.675 1.00 0.00 N ATOM 49 CA SER A 6 11.992 -6.666 -24.583 1.00 0.00 C ATOM 50 C SER A 6 11.208 -5.380 -24.854 1.00 0.00 C ATOM 51 O SER A 6 10.880 -5.079 -26.001 1.00 0.00 O ATOM 52 CB SER A 6 13.476 -6.350 -24.385 1.00 0.00 C ATOM 53 OG SER A 6 14.044 -7.104 -23.317 1.00 0.00 O ATOM 0 H SER A 6 11.179 -7.276 -26.416 1.00 0.00 H new ATOM 0 HA SER A 6 11.621 -7.125 -23.667 1.00 0.00 H new ATOM 0 HB2 SER A 6 14.018 -6.562 -25.307 1.00 0.00 H new ATOM 0 HB3 SER A 6 13.596 -5.286 -24.182 1.00 0.00 H new ATOM 0 HG SER A 6 13.911 -8.060 -23.485 1.00 0.00 H new ATOM 59 N GLY A 7 10.931 -4.656 -23.780 1.00 0.00 N ATOM 60 CA GLY A 7 10.192 -3.410 -23.887 1.00 0.00 C ATOM 61 C GLY A 7 10.110 -2.703 -22.533 1.00 0.00 C ATOM 62 O GLY A 7 10.506 -3.262 -21.511 1.00 0.00 O ATOM 0 H GLY A 7 11.205 -4.909 -22.831 1.00 0.00 H new ATOM 0 HA2 GLY A 7 10.676 -2.757 -24.613 1.00 0.00 H new ATOM 0 HA3 GLY A 7 9.187 -3.610 -24.258 1.00 0.00 H new ATOM 66 N LYS A 8 9.593 -1.483 -22.569 1.00 0.00 N ATOM 67 CA LYS A 8 9.454 -0.694 -21.357 1.00 0.00 C ATOM 68 C LYS A 8 8.248 0.238 -21.496 1.00 0.00 C ATOM 69 O LYS A 8 8.030 0.823 -22.556 1.00 0.00 O ATOM 70 CB LYS A 8 10.761 0.036 -21.039 1.00 0.00 C ATOM 71 CG LYS A 8 11.620 -0.777 -20.068 1.00 0.00 C ATOM 72 CD LYS A 8 12.711 -1.547 -20.815 1.00 0.00 C ATOM 73 CE LYS A 8 13.306 -2.647 -19.933 1.00 0.00 C ATOM 74 NZ LYS A 8 13.698 -3.814 -20.755 1.00 0.00 N ATOM 0 H LYS A 8 9.266 -1.022 -23.418 1.00 0.00 H new ATOM 0 HA LYS A 8 9.261 -1.341 -20.502 1.00 0.00 H new ATOM 0 HB2 LYS A 8 11.316 0.214 -21.960 1.00 0.00 H new ATOM 0 HB3 LYS A 8 10.541 1.012 -20.606 1.00 0.00 H new ATOM 0 HG2 LYS A 8 12.076 -0.111 -19.335 1.00 0.00 H new ATOM 0 HG3 LYS A 8 10.990 -1.475 -19.516 1.00 0.00 H new ATOM 0 HD2 LYS A 8 12.295 -1.987 -21.721 1.00 0.00 H new ATOM 0 HD3 LYS A 8 13.498 -0.860 -21.127 1.00 0.00 H new ATOM 0 HE2 LYS A 8 14.175 -2.263 -19.398 1.00 0.00 H new ATOM 0 HE3 LYS A 8 12.578 -2.952 -19.181 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 14.100 -4.551 -20.142 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 12.862 -4.190 -21.246 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 14.408 -3.522 -21.456 1.00 0.00 H new ATOM 88 N PRO A 9 7.476 0.349 -20.382 1.00 0.00 N ATOM 89 CA PRO A 9 6.298 1.200 -20.369 1.00 0.00 C ATOM 90 C PRO A 9 6.689 2.677 -20.288 1.00 0.00 C ATOM 91 O PRO A 9 7.866 3.017 -20.389 1.00 0.00 O ATOM 92 CB PRO A 9 5.489 0.733 -19.170 1.00 0.00 C ATOM 93 CG PRO A 9 6.456 -0.040 -18.289 1.00 0.00 C ATOM 94 CD PRO A 9 7.704 -0.329 -19.109 1.00 0.00 C ATOM 0 HA PRO A 9 5.711 1.120 -21.284 1.00 0.00 H new ATOM 0 HB2 PRO A 9 5.063 1.580 -18.632 1.00 0.00 H new ATOM 0 HB3 PRO A 9 4.656 0.103 -19.482 1.00 0.00 H new ATOM 0 HG2 PRO A 9 6.709 0.538 -17.400 1.00 0.00 H new ATOM 0 HG3 PRO A 9 6.001 -0.969 -17.946 1.00 0.00 H new ATOM 0 HD2 PRO A 9 8.599 0.048 -18.614 1.00 0.00 H new ATOM 0 HD3 PRO A 9 7.845 -1.400 -19.251 1.00 0.00 H new ATOM 102 N GLU A 10 5.678 3.514 -20.108 1.00 0.00 N ATOM 103 CA GLU A 10 5.901 4.947 -20.012 1.00 0.00 C ATOM 104 C GLU A 10 5.341 5.485 -18.694 1.00 0.00 C ATOM 105 O GLU A 10 4.375 4.944 -18.159 1.00 0.00 O ATOM 106 CB GLU A 10 5.287 5.678 -21.208 1.00 0.00 C ATOM 107 CG GLU A 10 6.319 5.872 -22.321 1.00 0.00 C ATOM 108 CD GLU A 10 6.607 4.551 -23.037 1.00 0.00 C ATOM 109 OE1 GLU A 10 5.635 3.965 -23.560 1.00 0.00 O ATOM 110 OE2 GLU A 10 7.793 4.157 -23.045 1.00 0.00 O ATOM 0 H GLU A 10 4.702 3.228 -20.026 1.00 0.00 H new ATOM 0 HA GLU A 10 6.975 5.130 -20.028 1.00 0.00 H new ATOM 0 HB2 GLU A 10 4.438 5.110 -21.589 1.00 0.00 H new ATOM 0 HB3 GLU A 10 4.904 6.647 -20.889 1.00 0.00 H new ATOM 0 HG2 GLU A 10 5.952 6.606 -23.038 1.00 0.00 H new ATOM 0 HG3 GLU A 10 7.242 6.271 -21.901 1.00 0.00 H new ATOM 117 N PRO A 11 5.990 6.571 -18.195 1.00 0.00 N ATOM 118 CA PRO A 11 5.567 7.188 -16.949 1.00 0.00 C ATOM 119 C PRO A 11 4.286 8.001 -17.147 1.00 0.00 C ATOM 120 O PRO A 11 4.217 8.852 -18.032 1.00 0.00 O ATOM 121 CB PRO A 11 6.748 8.038 -16.510 1.00 0.00 C ATOM 122 CG PRO A 11 7.604 8.234 -17.751 1.00 0.00 C ATOM 123 CD PRO A 11 7.139 7.238 -18.800 1.00 0.00 C ATOM 0 HA PRO A 11 5.313 6.456 -16.182 1.00 0.00 H new ATOM 0 HB2 PRO A 11 6.413 8.996 -16.111 1.00 0.00 H new ATOM 0 HB3 PRO A 11 7.313 7.543 -15.720 1.00 0.00 H new ATOM 0 HG2 PRO A 11 7.508 9.254 -18.124 1.00 0.00 H new ATOM 0 HG3 PRO A 11 8.657 8.078 -17.517 1.00 0.00 H new ATOM 0 HD2 PRO A 11 6.862 7.740 -19.727 1.00 0.00 H new ATOM 0 HD3 PRO A 11 7.926 6.525 -19.046 1.00 0.00 H new ATOM 131 N THR A 12 3.302 7.709 -16.308 1.00 0.00 N ATOM 132 CA THR A 12 2.027 8.402 -16.380 1.00 0.00 C ATOM 133 C THR A 12 1.256 8.237 -15.069 1.00 0.00 C ATOM 134 O THR A 12 1.027 7.116 -14.616 1.00 0.00 O ATOM 135 CB THR A 12 1.270 7.874 -17.600 1.00 0.00 C ATOM 136 OG1 THR A 12 1.649 8.758 -18.652 1.00 0.00 O ATOM 137 CG2 THR A 12 -0.243 8.066 -17.479 1.00 0.00 C ATOM 0 H THR A 12 3.362 7.002 -15.575 1.00 0.00 H new ATOM 0 HA THR A 12 2.167 9.476 -16.506 1.00 0.00 H new ATOM 0 HB THR A 12 1.491 6.815 -17.734 1.00 0.00 H new ATOM 0 HG1 THR A 12 2.559 9.085 -18.493 1.00 0.00 H new ATOM 0 HG21 THR A 12 -0.732 7.674 -18.371 1.00 0.00 H new ATOM 0 HG22 THR A 12 -0.608 7.533 -16.601 1.00 0.00 H new ATOM 0 HG23 THR A 12 -0.468 9.128 -17.378 1.00 0.00 H new ATOM 145 N ASN A 13 0.877 9.369 -14.496 1.00 0.00 N ATOM 146 CA ASN A 13 0.136 9.365 -13.246 1.00 0.00 C ATOM 147 C ASN A 13 -0.998 10.388 -13.326 1.00 0.00 C ATOM 148 O ASN A 13 -0.844 11.444 -13.938 1.00 0.00 O ATOM 149 CB ASN A 13 1.037 9.748 -12.070 1.00 0.00 C ATOM 150 CG ASN A 13 2.330 8.930 -12.080 1.00 0.00 C ATOM 151 OD1 ASN A 13 2.456 7.929 -12.766 1.00 0.00 O ATOM 152 ND2 ASN A 13 3.280 9.410 -11.283 1.00 0.00 N ATOM 0 H ASN A 13 1.069 10.296 -14.874 1.00 0.00 H new ATOM 0 HA ASN A 13 -0.254 8.359 -13.089 1.00 0.00 H new ATOM 0 HB2 ASN A 13 1.274 10.811 -12.120 1.00 0.00 H new ATOM 0 HB3 ASN A 13 0.506 9.584 -11.132 1.00 0.00 H new ATOM 0 HD21 ASN A 13 4.180 8.935 -11.219 1.00 0.00 H new ATOM 0 HD22 ASN A 13 3.108 10.253 -10.735 1.00 0.00 H new ATOM 159 N SER A 14 -2.112 10.040 -12.698 1.00 0.00 N ATOM 160 CA SER A 14 -3.271 10.916 -12.691 1.00 0.00 C ATOM 161 C SER A 14 -4.433 10.239 -11.961 1.00 0.00 C ATOM 162 O SER A 14 -5.228 9.529 -12.576 1.00 0.00 O ATOM 163 CB SER A 14 -3.686 11.292 -14.115 1.00 0.00 C ATOM 164 OG SER A 14 -4.108 12.651 -14.206 1.00 0.00 O ATOM 0 H SER A 14 -2.236 9.164 -12.191 1.00 0.00 H new ATOM 0 HA SER A 14 -3.004 11.833 -12.165 1.00 0.00 H new ATOM 0 HB2 SER A 14 -2.849 11.126 -14.793 1.00 0.00 H new ATOM 0 HB3 SER A 14 -4.495 10.638 -14.442 1.00 0.00 H new ATOM 0 HG SER A 14 -4.363 12.853 -15.130 1.00 0.00 H new ATOM 170 N SER A 15 -4.496 10.483 -10.660 1.00 0.00 N ATOM 171 CA SER A 15 -5.547 9.906 -9.840 1.00 0.00 C ATOM 172 C SER A 15 -5.789 8.451 -10.247 1.00 0.00 C ATOM 173 O SER A 15 -6.756 8.150 -10.945 1.00 0.00 O ATOM 174 CB SER A 15 -6.842 10.712 -9.958 1.00 0.00 C ATOM 175 OG SER A 15 -7.096 11.487 -8.789 1.00 0.00 O ATOM 0 H SER A 15 -3.836 11.073 -10.154 1.00 0.00 H new ATOM 0 HA SER A 15 -5.225 9.937 -8.799 1.00 0.00 H new ATOM 0 HB2 SER A 15 -6.781 11.371 -10.824 1.00 0.00 H new ATOM 0 HB3 SER A 15 -7.677 10.033 -10.132 1.00 0.00 H new ATOM 0 HG SER A 15 -7.930 11.988 -8.904 1.00 0.00 H new ATOM 181 N VAL A 16 -4.894 7.586 -9.793 1.00 0.00 N ATOM 182 CA VAL A 16 -4.998 6.170 -10.101 1.00 0.00 C ATOM 183 C VAL A 16 -6.181 5.572 -9.337 1.00 0.00 C ATOM 184 O VAL A 16 -6.780 6.237 -8.493 1.00 0.00 O ATOM 185 CB VAL A 16 -3.673 5.469 -9.794 1.00 0.00 C ATOM 186 CG1 VAL A 16 -2.538 6.048 -10.642 1.00 0.00 C ATOM 187 CG2 VAL A 16 -3.341 5.552 -8.303 1.00 0.00 C ATOM 0 H VAL A 16 -4.093 7.839 -9.214 1.00 0.00 H new ATOM 0 HA VAL A 16 -5.190 6.024 -11.164 1.00 0.00 H new ATOM 0 HB VAL A 16 -3.783 4.416 -10.054 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -1.607 5.533 -10.405 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -2.768 5.913 -11.699 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -2.429 7.111 -10.427 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -2.395 5.046 -8.112 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -3.260 6.598 -8.006 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -4.132 5.072 -7.727 1.00 0.00 H new ATOM 197 N GLU A 17 -6.483 4.323 -9.661 1.00 0.00 N ATOM 198 CA GLU A 17 -7.584 3.628 -9.017 1.00 0.00 C ATOM 199 C GLU A 17 -7.108 2.965 -7.723 1.00 0.00 C ATOM 200 O GLU A 17 -5.913 2.949 -7.433 1.00 0.00 O ATOM 201 CB GLU A 17 -8.212 2.602 -9.961 1.00 0.00 C ATOM 202 CG GLU A 17 -9.537 3.117 -10.529 1.00 0.00 C ATOM 203 CD GLU A 17 -10.714 2.682 -9.654 1.00 0.00 C ATOM 204 OE1 GLU A 17 -10.933 1.455 -9.566 1.00 0.00 O ATOM 205 OE2 GLU A 17 -11.369 3.587 -9.094 1.00 0.00 O ATOM 0 H GLU A 17 -5.984 3.775 -10.361 1.00 0.00 H new ATOM 0 HA GLU A 17 -8.353 4.359 -8.766 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -7.523 2.384 -10.777 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -8.380 1.667 -9.427 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -9.510 4.205 -10.595 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -9.674 2.740 -11.542 1.00 0.00 H new ATOM 212 N VAL A 18 -8.068 2.433 -6.980 1.00 0.00 N ATOM 213 CA VAL A 18 -7.762 1.769 -5.725 1.00 0.00 C ATOM 214 C VAL A 18 -8.569 0.473 -5.627 1.00 0.00 C ATOM 215 O VAL A 18 -9.757 0.453 -5.945 1.00 0.00 O ATOM 216 CB VAL A 18 -8.016 2.721 -4.554 1.00 0.00 C ATOM 217 CG1 VAL A 18 -8.080 1.957 -3.230 1.00 0.00 C ATOM 218 CG2 VAL A 18 -6.954 3.822 -4.502 1.00 0.00 C ATOM 0 H VAL A 18 -9.058 2.449 -7.224 1.00 0.00 H new ATOM 0 HA VAL A 18 -6.707 1.498 -5.684 1.00 0.00 H new ATOM 0 HB VAL A 18 -8.984 3.197 -4.713 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -8.261 2.657 -2.414 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -8.889 1.228 -3.269 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -7.135 1.441 -3.062 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -7.158 4.485 -3.661 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -5.969 3.372 -4.379 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -6.978 4.395 -5.429 1.00 0.00 H new ATOM 228 N SER A 19 -7.892 -0.577 -5.186 1.00 0.00 N ATOM 229 CA SER A 19 -8.532 -1.873 -5.043 1.00 0.00 C ATOM 230 C SER A 19 -9.155 -1.999 -3.652 1.00 0.00 C ATOM 231 O SER A 19 -8.716 -1.341 -2.709 1.00 0.00 O ATOM 232 CB SER A 19 -7.534 -3.009 -5.283 1.00 0.00 C ATOM 233 OG SER A 19 -7.857 -3.766 -6.446 1.00 0.00 O ATOM 0 H SER A 19 -6.907 -0.556 -4.923 1.00 0.00 H new ATOM 0 HA SER A 19 -9.318 -1.951 -5.794 1.00 0.00 H new ATOM 0 HB2 SER A 19 -6.531 -2.595 -5.387 1.00 0.00 H new ATOM 0 HB3 SER A 19 -7.518 -3.667 -4.415 1.00 0.00 H new ATOM 0 HG SER A 19 -7.196 -4.480 -6.566 1.00 0.00 H new ATOM 239 N PRO A 20 -10.195 -2.870 -3.564 1.00 0.00 N ATOM 240 CA PRO A 20 -10.883 -3.090 -2.303 1.00 0.00 C ATOM 241 C PRO A 20 -10.038 -3.950 -1.361 1.00 0.00 C ATOM 242 O PRO A 20 -10.224 -3.912 -0.145 1.00 0.00 O ATOM 243 CB PRO A 20 -12.201 -3.745 -2.683 1.00 0.00 C ATOM 244 CG PRO A 20 -12.006 -4.289 -4.089 1.00 0.00 C ATOM 245 CD PRO A 20 -10.742 -3.666 -4.659 1.00 0.00 C ATOM 0 HA PRO A 20 -11.057 -2.166 -1.752 1.00 0.00 H new ATOM 0 HB2 PRO A 20 -12.455 -4.544 -1.987 1.00 0.00 H new ATOM 0 HB3 PRO A 20 -13.018 -3.024 -2.653 1.00 0.00 H new ATOM 0 HG2 PRO A 20 -11.921 -5.375 -4.069 1.00 0.00 H new ATOM 0 HG3 PRO A 20 -12.866 -4.048 -4.714 1.00 0.00 H new ATOM 0 HD2 PRO A 20 -10.036 -4.430 -4.984 1.00 0.00 H new ATOM 0 HD3 PRO A 20 -10.963 -3.046 -5.528 1.00 0.00 H new ATOM 253 N ASP A 21 -9.128 -4.706 -1.957 1.00 0.00 N ATOM 254 CA ASP A 21 -8.254 -5.574 -1.186 1.00 0.00 C ATOM 255 C ASP A 21 -6.955 -4.831 -0.869 1.00 0.00 C ATOM 256 O ASP A 21 -5.986 -5.435 -0.410 1.00 0.00 O ATOM 257 CB ASP A 21 -7.898 -6.836 -1.973 1.00 0.00 C ATOM 258 CG ASP A 21 -9.059 -7.468 -2.743 1.00 0.00 C ATOM 259 OD1 ASP A 21 -10.136 -7.615 -2.126 1.00 0.00 O ATOM 260 OD2 ASP A 21 -8.843 -7.790 -3.932 1.00 0.00 O ATOM 0 H ASP A 21 -8.977 -4.736 -2.965 1.00 0.00 H new ATOM 0 HA ASP A 21 -8.778 -5.855 -0.272 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -7.103 -6.594 -2.679 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -7.495 -7.576 -1.281 1.00 0.00 H new ATOM 265 N ILE A 22 -6.975 -3.532 -1.128 1.00 0.00 N ATOM 266 CA ILE A 22 -5.811 -2.700 -0.876 1.00 0.00 C ATOM 267 C ILE A 22 -5.219 -3.058 0.489 1.00 0.00 C ATOM 268 O ILE A 22 -4.003 -3.023 0.671 1.00 0.00 O ATOM 269 CB ILE A 22 -6.168 -1.220 -1.023 1.00 0.00 C ATOM 270 CG1 ILE A 22 -4.988 -0.329 -0.628 1.00 0.00 C ATOM 271 CG2 ILE A 22 -7.432 -0.880 -0.232 1.00 0.00 C ATOM 272 CD1 ILE A 22 -4.074 -0.066 -1.826 1.00 0.00 C ATOM 0 H ILE A 22 -7.780 -3.035 -1.510 1.00 0.00 H new ATOM 0 HA ILE A 22 -5.037 -2.892 -1.619 1.00 0.00 H new ATOM 0 HB ILE A 22 -6.382 -1.023 -2.073 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -5.358 0.617 -0.234 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -4.419 -0.806 0.170 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -7.664 0.178 -0.354 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -8.265 -1.479 -0.602 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -7.270 -1.097 0.824 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -3.244 0.570 -1.518 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -3.686 -1.013 -2.202 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -4.640 0.433 -2.613 1.00 0.00 H new ATOM 284 N TYR A 23 -6.107 -3.394 1.413 1.00 0.00 N ATOM 285 CA TYR A 23 -5.688 -3.758 2.756 1.00 0.00 C ATOM 286 C TYR A 23 -4.909 -5.075 2.750 1.00 0.00 C ATOM 287 O TYR A 23 -3.760 -5.123 3.185 1.00 0.00 O ATOM 288 CB TYR A 23 -6.974 -3.943 3.563 1.00 0.00 C ATOM 289 CG TYR A 23 -8.017 -2.848 3.332 1.00 0.00 C ATOM 290 CD1 TYR A 23 -7.846 -1.601 3.899 1.00 0.00 C ATOM 291 CD2 TYR A 23 -9.130 -3.107 2.558 1.00 0.00 C ATOM 292 CE1 TYR A 23 -8.828 -0.571 3.682 1.00 0.00 C ATOM 293 CE2 TYR A 23 -10.112 -2.076 2.340 1.00 0.00 C ATOM 294 CZ TYR A 23 -9.912 -0.859 2.913 1.00 0.00 C ATOM 295 OH TYR A 23 -10.839 0.115 2.708 1.00 0.00 O ATOM 0 H TYR A 23 -7.115 -3.422 1.258 1.00 0.00 H new ATOM 0 HA TYR A 23 -5.037 -2.991 3.176 1.00 0.00 H new ATOM 0 HB2 TYR A 23 -7.413 -4.908 3.311 1.00 0.00 H new ATOM 0 HB3 TYR A 23 -6.724 -3.974 4.623 1.00 0.00 H new ATOM 0 HD1 TYR A 23 -6.976 -1.398 4.505 1.00 0.00 H new ATOM 0 HD2 TYR A 23 -9.265 -4.083 2.116 1.00 0.00 H new ATOM 0 HE1 TYR A 23 -8.707 0.409 4.120 1.00 0.00 H new ATOM 0 HE2 TYR A 23 -10.987 -2.265 1.736 1.00 0.00 H new ATOM 0 HH TYR A 23 -10.426 0.993 2.843 1.00 0.00 H new ATOM 305 N GLN A 24 -5.567 -6.111 2.251 1.00 0.00 N ATOM 306 CA GLN A 24 -4.951 -7.426 2.183 1.00 0.00 C ATOM 307 C GLN A 24 -3.698 -7.379 1.306 1.00 0.00 C ATOM 308 O GLN A 24 -2.776 -8.172 1.492 1.00 0.00 O ATOM 309 CB GLN A 24 -5.943 -8.470 1.667 1.00 0.00 C ATOM 310 CG GLN A 24 -5.394 -9.886 1.850 1.00 0.00 C ATOM 311 CD GLN A 24 -5.786 -10.454 3.215 1.00 0.00 C ATOM 312 OE1 GLN A 24 -4.974 -10.595 4.115 1.00 0.00 O ATOM 313 NE2 GLN A 24 -7.073 -10.771 3.319 1.00 0.00 N ATOM 0 H GLN A 24 -6.520 -6.067 1.890 1.00 0.00 H new ATOM 0 HA GLN A 24 -4.656 -7.721 3.190 1.00 0.00 H new ATOM 0 HB2 GLN A 24 -6.889 -8.372 2.199 1.00 0.00 H new ATOM 0 HB3 GLN A 24 -6.150 -8.290 0.612 1.00 0.00 H new ATOM 0 HG2 GLN A 24 -5.776 -10.533 1.060 1.00 0.00 H new ATOM 0 HG3 GLN A 24 -4.308 -9.874 1.755 1.00 0.00 H new ATOM 0 HE21 GLN A 24 -7.699 -10.628 2.527 1.00 0.00 H new ATOM 0 HE22 GLN A 24 -7.434 -11.158 4.191 1.00 0.00 H new ATOM 322 N GLN A 25 -3.705 -6.443 0.368 1.00 0.00 N ATOM 323 CA GLN A 25 -2.581 -6.283 -0.538 1.00 0.00 C ATOM 324 C GLN A 25 -1.348 -5.798 0.226 1.00 0.00 C ATOM 325 O GLN A 25 -0.262 -6.358 0.080 1.00 0.00 O ATOM 326 CB GLN A 25 -2.929 -5.327 -1.681 1.00 0.00 C ATOM 327 CG GLN A 25 -3.878 -5.990 -2.681 1.00 0.00 C ATOM 328 CD GLN A 25 -3.594 -5.511 -4.106 1.00 0.00 C ATOM 329 OE1 GLN A 25 -4.267 -4.418 -4.454 1.00 0.00 O flip ATOM 330 NE2 GLN A 25 -2.815 -6.095 -4.841 1.00 0.00 N flip ATOM 0 H GLN A 25 -4.472 -5.788 0.216 1.00 0.00 H new ATOM 0 HA GLN A 25 -2.353 -7.254 -0.977 1.00 0.00 H new ATOM 0 HB2 GLN A 25 -3.391 -4.426 -1.278 1.00 0.00 H new ATOM 0 HB3 GLN A 25 -2.017 -5.017 -2.191 1.00 0.00 H new ATOM 0 HG2 GLN A 25 -3.768 -7.073 -2.629 1.00 0.00 H new ATOM 0 HG3 GLN A 25 -4.910 -5.761 -2.415 1.00 0.00 H new ATOM 0 HE21 GLN A 25 -2.330 -6.930 -4.511 1.00 0.00 H new ATOM 0 HE22 GLN A 25 -2.648 -5.749 -5.786 1.00 0.00 H new ATOM 339 N VAL A 26 -1.556 -4.763 1.026 1.00 0.00 N ATOM 340 CA VAL A 26 -0.475 -4.196 1.814 1.00 0.00 C ATOM 341 C VAL A 26 0.153 -5.295 2.674 1.00 0.00 C ATOM 342 O VAL A 26 1.351 -5.558 2.575 1.00 0.00 O ATOM 343 CB VAL A 26 -0.991 -3.014 2.637 1.00 0.00 C ATOM 344 CG1 VAL A 26 0.105 -2.463 3.551 1.00 0.00 C ATOM 345 CG2 VAL A 26 -1.551 -1.917 1.730 1.00 0.00 C ATOM 0 H VAL A 26 -2.458 -4.302 1.146 1.00 0.00 H new ATOM 0 HA VAL A 26 0.307 -3.804 1.164 1.00 0.00 H new ATOM 0 HB VAL A 26 -1.804 -3.374 3.268 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -0.288 -1.624 4.125 1.00 0.00 H new ATOM 0 HG12 VAL A 26 0.437 -3.245 4.233 1.00 0.00 H new ATOM 0 HG13 VAL A 26 0.948 -2.127 2.947 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -1.911 -1.089 2.340 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -0.766 -1.561 1.062 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -2.375 -2.318 1.140 1.00 0.00 H new ATOM 355 N ARG A 27 -0.683 -5.907 3.500 1.00 0.00 N ATOM 356 CA ARG A 27 -0.225 -6.971 4.377 1.00 0.00 C ATOM 357 C ARG A 27 0.634 -7.968 3.597 1.00 0.00 C ATOM 358 O ARG A 27 1.680 -8.402 4.078 1.00 0.00 O ATOM 359 CB ARG A 27 -1.405 -7.710 5.009 1.00 0.00 C ATOM 360 CG ARG A 27 -2.248 -6.765 5.867 1.00 0.00 C ATOM 361 CD ARG A 27 -3.691 -7.263 5.976 1.00 0.00 C ATOM 362 NE ARG A 27 -4.341 -6.674 7.169 1.00 0.00 N ATOM 363 CZ ARG A 27 -5.624 -6.872 7.499 1.00 0.00 C ATOM 364 NH1 ARG A 27 -6.403 -7.643 6.729 1.00 0.00 N ATOM 365 NH2 ARG A 27 -6.129 -6.298 8.600 1.00 0.00 N ATOM 0 H ARG A 27 -1.676 -5.686 3.580 1.00 0.00 H new ATOM 0 HA ARG A 27 0.369 -6.515 5.169 1.00 0.00 H new ATOM 0 HB2 ARG A 27 -2.025 -8.148 4.227 1.00 0.00 H new ATOM 0 HB3 ARG A 27 -1.037 -8.533 5.622 1.00 0.00 H new ATOM 0 HG2 ARG A 27 -1.811 -6.685 6.862 1.00 0.00 H new ATOM 0 HG3 ARG A 27 -2.236 -5.766 5.432 1.00 0.00 H new ATOM 0 HD2 ARG A 27 -4.247 -6.992 5.078 1.00 0.00 H new ATOM 0 HD3 ARG A 27 -3.705 -8.351 6.044 1.00 0.00 H new ATOM 0 HE ARG A 27 -3.777 -6.081 7.777 1.00 0.00 H new ATOM 0 HH11 ARG A 27 -6.019 -8.080 5.891 1.00 0.00 H new ATOM 0 HH12 ARG A 27 -7.380 -7.793 6.981 1.00 0.00 H new ATOM 0 HH21 ARG A 27 -5.536 -5.710 9.186 1.00 0.00 H new ATOM 0 HH22 ARG A 27 -7.106 -6.449 8.851 1.00 0.00 H new ATOM 379 N ASP A 28 0.161 -8.303 2.405 1.00 0.00 N ATOM 380 CA ASP A 28 0.873 -9.241 1.554 1.00 0.00 C ATOM 381 C ASP A 28 2.189 -8.610 1.095 1.00 0.00 C ATOM 382 O ASP A 28 3.212 -9.288 1.015 1.00 0.00 O ATOM 383 CB ASP A 28 0.054 -9.586 0.309 1.00 0.00 C ATOM 384 CG ASP A 28 0.744 -10.530 -0.678 1.00 0.00 C ATOM 385 OD1 ASP A 28 1.918 -10.869 -0.413 1.00 0.00 O ATOM 386 OD2 ASP A 28 0.083 -10.890 -1.676 1.00 0.00 O ATOM 0 H ASP A 28 -0.707 -7.941 2.009 1.00 0.00 H new ATOM 0 HA ASP A 28 1.053 -10.149 2.130 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -0.886 -10.039 0.625 1.00 0.00 H new ATOM 0 HB3 ASP A 28 -0.196 -8.661 -0.211 1.00 0.00 H new ATOM 391 N GLU A 29 2.120 -7.319 0.806 1.00 0.00 N ATOM 392 CA GLU A 29 3.293 -6.588 0.357 1.00 0.00 C ATOM 393 C GLU A 29 4.371 -6.597 1.443 1.00 0.00 C ATOM 394 O GLU A 29 5.539 -6.861 1.160 1.00 0.00 O ATOM 395 CB GLU A 29 2.928 -5.157 -0.041 1.00 0.00 C ATOM 396 CG GLU A 29 3.991 -4.556 -0.963 1.00 0.00 C ATOM 397 CD GLU A 29 4.032 -5.292 -2.304 1.00 0.00 C ATOM 398 OE1 GLU A 29 4.677 -6.362 -2.345 1.00 0.00 O ATOM 399 OE2 GLU A 29 3.418 -4.767 -3.258 1.00 0.00 O ATOM 0 H GLU A 29 1.270 -6.760 0.874 1.00 0.00 H new ATOM 0 HA GLU A 29 3.691 -7.086 -0.527 1.00 0.00 H new ATOM 0 HB2 GLU A 29 1.961 -5.151 -0.543 1.00 0.00 H new ATOM 0 HB3 GLU A 29 2.827 -4.542 0.853 1.00 0.00 H new ATOM 0 HG2 GLU A 29 3.778 -3.500 -1.130 1.00 0.00 H new ATOM 0 HG3 GLU A 29 4.968 -4.612 -0.483 1.00 0.00 H new ATOM 406 N LEU A 30 3.941 -6.306 2.662 1.00 0.00 N ATOM 407 CA LEU A 30 4.856 -6.277 3.791 1.00 0.00 C ATOM 408 C LEU A 30 5.434 -7.677 4.008 1.00 0.00 C ATOM 409 O LEU A 30 6.626 -7.825 4.277 1.00 0.00 O ATOM 410 CB LEU A 30 4.163 -5.699 5.026 1.00 0.00 C ATOM 411 CG LEU A 30 3.384 -4.400 4.812 1.00 0.00 C ATOM 412 CD1 LEU A 30 2.514 -4.076 6.029 1.00 0.00 C ATOM 413 CD2 LEU A 30 4.326 -3.248 4.458 1.00 0.00 C ATOM 0 H LEU A 30 2.972 -6.088 2.893 1.00 0.00 H new ATOM 0 HA LEU A 30 5.696 -5.613 3.585 1.00 0.00 H new ATOM 0 HB2 LEU A 30 3.477 -6.450 5.418 1.00 0.00 H new ATOM 0 HB3 LEU A 30 4.917 -5.525 5.793 1.00 0.00 H new ATOM 0 HG LEU A 30 2.713 -4.539 3.964 1.00 0.00 H new ATOM 0 HD11 LEU A 30 1.971 -3.148 5.851 1.00 0.00 H new ATOM 0 HD12 LEU A 30 1.804 -4.886 6.195 1.00 0.00 H new ATOM 0 HD13 LEU A 30 3.147 -3.963 6.909 1.00 0.00 H new ATOM 0 HD21 LEU A 30 3.747 -2.336 4.311 1.00 0.00 H new ATOM 0 HD22 LEU A 30 5.039 -3.098 5.269 1.00 0.00 H new ATOM 0 HD23 LEU A 30 4.865 -3.487 3.541 1.00 0.00 H new ATOM 425 N LYS A 31 4.564 -8.668 3.884 1.00 0.00 N ATOM 426 CA LYS A 31 4.974 -10.051 4.064 1.00 0.00 C ATOM 427 C LYS A 31 5.852 -10.475 2.886 1.00 0.00 C ATOM 428 O LYS A 31 6.475 -11.535 2.921 1.00 0.00 O ATOM 429 CB LYS A 31 3.753 -10.948 4.275 1.00 0.00 C ATOM 430 CG LYS A 31 4.157 -12.287 4.897 1.00 0.00 C ATOM 431 CD LYS A 31 3.621 -13.458 4.072 1.00 0.00 C ATOM 432 CE LYS A 31 2.490 -14.177 4.811 1.00 0.00 C ATOM 433 NZ LYS A 31 2.606 -15.642 4.637 1.00 0.00 N ATOM 0 H LYS A 31 3.577 -8.541 3.661 1.00 0.00 H new ATOM 0 HA LYS A 31 5.577 -10.156 4.966 1.00 0.00 H new ATOM 0 HB2 LYS A 31 3.035 -10.444 4.922 1.00 0.00 H new ATOM 0 HB3 LYS A 31 3.256 -11.122 3.321 1.00 0.00 H new ATOM 0 HG2 LYS A 31 5.243 -12.349 4.961 1.00 0.00 H new ATOM 0 HG3 LYS A 31 3.774 -12.349 5.916 1.00 0.00 H new ATOM 0 HD2 LYS A 31 3.259 -13.094 3.111 1.00 0.00 H new ATOM 0 HD3 LYS A 31 4.428 -14.160 3.863 1.00 0.00 H new ATOM 0 HE2 LYS A 31 2.524 -13.927 5.871 1.00 0.00 H new ATOM 0 HE3 LYS A 31 1.526 -13.835 4.434 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 1.831 -16.114 5.145 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 2.551 -15.877 3.625 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 3.518 -15.966 5.018 1.00 0.00 H new ATOM 447 N ARG A 32 5.874 -9.625 1.869 1.00 0.00 N ATOM 448 CA ARG A 32 6.666 -9.899 0.682 1.00 0.00 C ATOM 449 C ARG A 32 8.054 -9.268 0.813 1.00 0.00 C ATOM 450 O ARG A 32 9.066 -9.938 0.612 1.00 0.00 O ATOM 451 CB ARG A 32 5.982 -9.356 -0.574 1.00 0.00 C ATOM 452 CG ARG A 32 6.037 -10.375 -1.713 1.00 0.00 C ATOM 453 CD ARG A 32 4.688 -11.076 -1.888 1.00 0.00 C ATOM 454 NE ARG A 32 4.768 -12.462 -1.375 1.00 0.00 N ATOM 455 CZ ARG A 32 3.878 -13.421 -1.663 1.00 0.00 C ATOM 456 NH1 ARG A 32 2.836 -13.151 -2.461 1.00 0.00 N ATOM 457 NH2 ARG A 32 4.030 -14.651 -1.153 1.00 0.00 N ATOM 0 H ARG A 32 5.356 -8.747 1.843 1.00 0.00 H new ATOM 0 HA ARG A 32 6.762 -10.981 0.590 1.00 0.00 H new ATOM 0 HB2 ARG A 32 4.944 -9.112 -0.350 1.00 0.00 H new ATOM 0 HB3 ARG A 32 6.467 -8.431 -0.885 1.00 0.00 H new ATOM 0 HG2 ARG A 32 6.313 -9.874 -2.641 1.00 0.00 H new ATOM 0 HG3 ARG A 32 6.811 -11.114 -1.507 1.00 0.00 H new ATOM 0 HD2 ARG A 32 3.912 -10.527 -1.356 1.00 0.00 H new ATOM 0 HD3 ARG A 32 4.407 -11.085 -2.941 1.00 0.00 H new ATOM 0 HE ARG A 32 5.549 -12.702 -0.764 1.00 0.00 H new ATOM 0 HH11 ARG A 32 2.720 -12.215 -2.849 1.00 0.00 H new ATOM 0 HH12 ARG A 32 2.159 -13.881 -2.680 1.00 0.00 H new ATOM 0 HH21 ARG A 32 4.823 -14.857 -0.546 1.00 0.00 H new ATOM 0 HH22 ARG A 32 3.352 -15.381 -1.372 1.00 0.00 H new ATOM 471 N ALA A 33 8.057 -7.986 1.148 1.00 0.00 N ATOM 472 CA ALA A 33 9.303 -7.257 1.308 1.00 0.00 C ATOM 473 C ALA A 33 9.790 -7.397 2.752 1.00 0.00 C ATOM 474 O ALA A 33 10.878 -6.935 3.091 1.00 0.00 O ATOM 475 CB ALA A 33 9.096 -5.797 0.902 1.00 0.00 C ATOM 0 H ALA A 33 7.216 -7.434 1.313 1.00 0.00 H new ATOM 0 HA ALA A 33 10.075 -7.670 0.659 1.00 0.00 H new ATOM 0 HB1 ALA A 33 10.031 -5.250 1.022 1.00 0.00 H new ATOM 0 HB2 ALA A 33 8.780 -5.750 -0.140 1.00 0.00 H new ATOM 0 HB3 ALA A 33 8.330 -5.349 1.534 1.00 0.00 H new ATOM 481 N SER A 34 8.960 -8.037 3.563 1.00 0.00 N ATOM 482 CA SER A 34 9.292 -8.244 4.962 1.00 0.00 C ATOM 483 C SER A 34 9.695 -6.916 5.606 1.00 0.00 C ATOM 484 O SER A 34 10.681 -6.851 6.338 1.00 0.00 O ATOM 485 CB SER A 34 10.417 -9.270 5.115 1.00 0.00 C ATOM 486 OG SER A 34 10.342 -9.963 6.358 1.00 0.00 O ATOM 0 H SER A 34 8.058 -8.419 3.278 1.00 0.00 H new ATOM 0 HA SER A 34 8.409 -8.634 5.469 1.00 0.00 H new ATOM 0 HB2 SER A 34 10.367 -9.988 4.296 1.00 0.00 H new ATOM 0 HB3 SER A 34 11.380 -8.766 5.039 1.00 0.00 H new ATOM 0 HG SER A 34 11.076 -10.610 6.417 1.00 0.00 H new ATOM 492 N VAL A 35 8.909 -5.890 5.311 1.00 0.00 N ATOM 493 CA VAL A 35 9.171 -4.568 5.853 1.00 0.00 C ATOM 494 C VAL A 35 8.133 -4.248 6.930 1.00 0.00 C ATOM 495 O VAL A 35 7.167 -4.988 7.106 1.00 0.00 O ATOM 496 CB VAL A 35 9.198 -3.536 4.723 1.00 0.00 C ATOM 497 CG1 VAL A 35 9.200 -4.220 3.355 1.00 0.00 C ATOM 498 CG2 VAL A 35 8.027 -2.559 4.846 1.00 0.00 C ATOM 0 H VAL A 35 8.091 -5.948 4.704 1.00 0.00 H new ATOM 0 HA VAL A 35 10.152 -4.537 6.328 1.00 0.00 H new ATOM 0 HB VAL A 35 10.122 -2.965 4.813 1.00 0.00 H new ATOM 0 HG11 VAL A 35 9.219 -3.464 2.570 1.00 0.00 H new ATOM 0 HG12 VAL A 35 10.081 -4.856 3.268 1.00 0.00 H new ATOM 0 HG13 VAL A 35 8.301 -4.828 3.251 1.00 0.00 H new ATOM 0 HG21 VAL A 35 8.069 -1.836 4.031 1.00 0.00 H new ATOM 0 HG22 VAL A 35 7.087 -3.109 4.795 1.00 0.00 H new ATOM 0 HG23 VAL A 35 8.089 -2.035 5.800 1.00 0.00 H new ATOM 508 N SER A 36 8.368 -3.144 7.624 1.00 0.00 N ATOM 509 CA SER A 36 7.466 -2.717 8.680 1.00 0.00 C ATOM 510 C SER A 36 6.442 -1.725 8.124 1.00 0.00 C ATOM 511 O SER A 36 6.782 -0.867 7.310 1.00 0.00 O ATOM 512 CB SER A 36 8.236 -2.088 9.842 1.00 0.00 C ATOM 513 OG SER A 36 8.440 -3.011 10.909 1.00 0.00 O ATOM 0 H SER A 36 9.170 -2.532 7.475 1.00 0.00 H new ATOM 0 HA SER A 36 6.944 -3.595 9.059 1.00 0.00 H new ATOM 0 HB2 SER A 36 9.201 -1.728 9.485 1.00 0.00 H new ATOM 0 HB3 SER A 36 7.689 -1.221 10.212 1.00 0.00 H new ATOM 0 HG SER A 36 8.937 -2.572 11.631 1.00 0.00 H new ATOM 519 N GLN A 37 5.209 -1.876 8.584 1.00 0.00 N ATOM 520 CA GLN A 37 4.134 -1.004 8.143 1.00 0.00 C ATOM 521 C GLN A 37 4.639 0.434 8.003 1.00 0.00 C ATOM 522 O GLN A 37 4.257 1.142 7.073 1.00 0.00 O ATOM 523 CB GLN A 37 2.942 -1.075 9.100 1.00 0.00 C ATOM 524 CG GLN A 37 2.030 -2.253 8.753 1.00 0.00 C ATOM 525 CD GLN A 37 0.922 -2.415 9.797 1.00 0.00 C ATOM 526 OE1 GLN A 37 0.686 -1.553 10.627 1.00 0.00 O ATOM 527 NE2 GLN A 37 0.260 -3.565 9.708 1.00 0.00 N ATOM 0 H GLN A 37 4.930 -2.589 9.258 1.00 0.00 H new ATOM 0 HA GLN A 37 3.794 -1.346 7.165 1.00 0.00 H new ATOM 0 HB2 GLN A 37 3.299 -1.177 10.125 1.00 0.00 H new ATOM 0 HB3 GLN A 37 2.376 -0.145 9.051 1.00 0.00 H new ATOM 0 HG2 GLN A 37 1.588 -2.097 7.769 1.00 0.00 H new ATOM 0 HG3 GLN A 37 2.618 -3.169 8.697 1.00 0.00 H new ATOM 0 HE21 GLN A 37 0.510 -4.243 8.988 1.00 0.00 H new ATOM 0 HE22 GLN A 37 -0.498 -3.769 10.360 1.00 0.00 H new ATOM 536 N ALA A 38 5.491 0.821 8.941 1.00 0.00 N ATOM 537 CA ALA A 38 6.053 2.162 8.934 1.00 0.00 C ATOM 538 C ALA A 38 6.879 2.357 7.661 1.00 0.00 C ATOM 539 O ALA A 38 6.520 3.160 6.801 1.00 0.00 O ATOM 540 CB ALA A 38 6.879 2.376 10.204 1.00 0.00 C ATOM 0 H ALA A 38 5.806 0.230 9.711 1.00 0.00 H new ATOM 0 HA ALA A 38 5.261 2.911 8.931 1.00 0.00 H new ATOM 0 HB1 ALA A 38 7.300 3.381 10.199 1.00 0.00 H new ATOM 0 HB2 ALA A 38 6.240 2.255 11.079 1.00 0.00 H new ATOM 0 HB3 ALA A 38 7.686 1.644 10.241 1.00 0.00 H new ATOM 546 N VAL A 39 7.969 1.608 7.580 1.00 0.00 N ATOM 547 CA VAL A 39 8.849 1.689 6.427 1.00 0.00 C ATOM 548 C VAL A 39 8.006 1.815 5.156 1.00 0.00 C ATOM 549 O VAL A 39 8.233 2.709 4.343 1.00 0.00 O ATOM 550 CB VAL A 39 9.791 0.484 6.402 1.00 0.00 C ATOM 551 CG1 VAL A 39 10.473 0.349 5.039 1.00 0.00 C ATOM 552 CG2 VAL A 39 10.825 0.573 7.526 1.00 0.00 C ATOM 0 H VAL A 39 8.263 0.942 8.295 1.00 0.00 H new ATOM 0 HA VAL A 39 9.479 2.576 6.489 1.00 0.00 H new ATOM 0 HB VAL A 39 9.193 -0.412 6.567 1.00 0.00 H new ATOM 0 HG11 VAL A 39 11.137 -0.515 5.048 1.00 0.00 H new ATOM 0 HG12 VAL A 39 9.717 0.217 4.265 1.00 0.00 H new ATOM 0 HG13 VAL A 39 11.052 1.249 4.831 1.00 0.00 H new ATOM 0 HG21 VAL A 39 11.482 -0.296 7.486 1.00 0.00 H new ATOM 0 HG22 VAL A 39 11.416 1.481 7.406 1.00 0.00 H new ATOM 0 HG23 VAL A 39 10.315 0.597 8.489 1.00 0.00 H new ATOM 562 N PHE A 40 7.051 0.906 5.025 1.00 0.00 N ATOM 563 CA PHE A 40 6.174 0.904 3.867 1.00 0.00 C ATOM 564 C PHE A 40 5.341 2.186 3.808 1.00 0.00 C ATOM 565 O PHE A 40 5.420 2.938 2.838 1.00 0.00 O ATOM 566 CB PHE A 40 5.234 -0.294 4.019 1.00 0.00 C ATOM 567 CG PHE A 40 4.124 -0.352 2.968 1.00 0.00 C ATOM 568 CD1 PHE A 40 3.012 0.418 3.110 1.00 0.00 C ATOM 569 CD2 PHE A 40 4.250 -1.173 1.891 1.00 0.00 C ATOM 570 CE1 PHE A 40 1.982 0.364 2.134 1.00 0.00 C ATOM 571 CE2 PHE A 40 3.220 -1.227 0.915 1.00 0.00 C ATOM 572 CZ PHE A 40 2.108 -0.458 1.057 1.00 0.00 C ATOM 0 H PHE A 40 6.866 0.166 5.702 1.00 0.00 H new ATOM 0 HA PHE A 40 6.765 0.844 2.953 1.00 0.00 H new ATOM 0 HB2 PHE A 40 5.820 -1.212 3.965 1.00 0.00 H new ATOM 0 HB3 PHE A 40 4.781 -0.264 5.010 1.00 0.00 H new ATOM 0 HD1 PHE A 40 2.912 1.070 3.965 1.00 0.00 H new ATOM 0 HD2 PHE A 40 5.133 -1.784 1.778 1.00 0.00 H new ATOM 0 HE1 PHE A 40 1.099 0.975 2.246 1.00 0.00 H new ATOM 0 HE2 PHE A 40 3.320 -1.879 0.060 1.00 0.00 H new ATOM 0 HZ PHE A 40 1.324 -0.500 0.315 1.00 0.00 H new ATOM 582 N ALA A 41 4.562 2.396 4.859 1.00 0.00 N ATOM 583 CA ALA A 41 3.715 3.575 4.939 1.00 0.00 C ATOM 584 C ALA A 41 4.543 4.816 4.600 1.00 0.00 C ATOM 585 O ALA A 41 4.003 5.818 4.133 1.00 0.00 O ATOM 586 CB ALA A 41 3.084 3.656 6.330 1.00 0.00 C ATOM 0 H ALA A 41 4.499 1.770 5.662 1.00 0.00 H new ATOM 0 HA ALA A 41 2.902 3.514 4.216 1.00 0.00 H new ATOM 0 HB1 ALA A 41 2.449 4.540 6.391 1.00 0.00 H new ATOM 0 HB2 ALA A 41 2.483 2.764 6.509 1.00 0.00 H new ATOM 0 HB3 ALA A 41 3.870 3.722 7.083 1.00 0.00 H new ATOM 592 N ARG A 42 5.840 4.709 4.849 1.00 0.00 N ATOM 593 CA ARG A 42 6.748 5.811 4.577 1.00 0.00 C ATOM 594 C ARG A 42 7.048 5.893 3.079 1.00 0.00 C ATOM 595 O ARG A 42 7.208 6.984 2.533 1.00 0.00 O ATOM 596 CB ARG A 42 8.061 5.645 5.344 1.00 0.00 C ATOM 597 CG ARG A 42 8.931 6.898 5.219 1.00 0.00 C ATOM 598 CD ARG A 42 8.150 8.150 5.624 1.00 0.00 C ATOM 599 NE ARG A 42 8.989 9.013 6.485 1.00 0.00 N ATOM 600 CZ ARG A 42 10.138 9.578 6.089 1.00 0.00 C ATOM 601 NH1 ARG A 42 10.592 9.374 4.845 1.00 0.00 N ATOM 602 NH2 ARG A 42 10.834 10.347 6.939 1.00 0.00 N ATOM 0 H ARG A 42 6.284 3.876 5.236 1.00 0.00 H new ATOM 0 HA ARG A 42 6.262 6.730 4.905 1.00 0.00 H new ATOM 0 HB2 ARG A 42 7.850 5.448 6.395 1.00 0.00 H new ATOM 0 HB3 ARG A 42 8.604 4.781 4.960 1.00 0.00 H new ATOM 0 HG2 ARG A 42 9.814 6.796 5.849 1.00 0.00 H new ATOM 0 HG3 ARG A 42 9.282 7.000 4.192 1.00 0.00 H new ATOM 0 HD2 ARG A 42 7.841 8.700 4.735 1.00 0.00 H new ATOM 0 HD3 ARG A 42 7.241 7.866 6.155 1.00 0.00 H new ATOM 0 HE ARG A 42 8.673 9.189 7.439 1.00 0.00 H new ATOM 0 HH11 ARG A 42 10.063 8.788 4.199 1.00 0.00 H new ATOM 0 HH12 ARG A 42 11.467 9.804 4.544 1.00 0.00 H new ATOM 0 HH21 ARG A 42 10.489 10.502 7.886 1.00 0.00 H new ATOM 0 HH22 ARG A 42 11.709 10.777 6.638 1.00 0.00 H new ATOM 616 N VAL A 43 7.115 4.725 2.456 1.00 0.00 N ATOM 617 CA VAL A 43 7.393 4.652 1.032 1.00 0.00 C ATOM 618 C VAL A 43 6.090 4.387 0.275 1.00 0.00 C ATOM 619 O VAL A 43 6.106 4.147 -0.931 1.00 0.00 O ATOM 620 CB VAL A 43 8.466 3.595 0.762 1.00 0.00 C ATOM 621 CG1 VAL A 43 9.689 3.816 1.654 1.00 0.00 C ATOM 622 CG2 VAL A 43 7.904 2.184 0.942 1.00 0.00 C ATOM 0 H VAL A 43 6.982 3.822 2.912 1.00 0.00 H new ATOM 0 HA VAL A 43 7.791 5.601 0.672 1.00 0.00 H new ATOM 0 HB VAL A 43 8.784 3.698 -0.275 1.00 0.00 H new ATOM 0 HG11 VAL A 43 10.437 3.052 1.442 1.00 0.00 H new ATOM 0 HG12 VAL A 43 10.111 4.801 1.455 1.00 0.00 H new ATOM 0 HG13 VAL A 43 9.392 3.753 2.701 1.00 0.00 H new ATOM 0 HG21 VAL A 43 8.687 1.452 0.744 1.00 0.00 H new ATOM 0 HG22 VAL A 43 7.544 2.063 1.964 1.00 0.00 H new ATOM 0 HG23 VAL A 43 7.079 2.029 0.246 1.00 0.00 H new ATOM 632 N ALA A 44 4.992 4.439 1.015 1.00 0.00 N ATOM 633 CA ALA A 44 3.683 4.207 0.429 1.00 0.00 C ATOM 634 C ALA A 44 2.977 5.549 0.222 1.00 0.00 C ATOM 635 O ALA A 44 2.586 5.882 -0.895 1.00 0.00 O ATOM 636 CB ALA A 44 2.882 3.260 1.325 1.00 0.00 C ATOM 0 H ALA A 44 4.982 4.638 2.015 1.00 0.00 H new ATOM 0 HA ALA A 44 3.779 3.730 -0.546 1.00 0.00 H new ATOM 0 HB1 ALA A 44 1.900 3.086 0.885 1.00 0.00 H new ATOM 0 HB2 ALA A 44 3.411 2.312 1.417 1.00 0.00 H new ATOM 0 HB3 ALA A 44 2.763 3.707 2.312 1.00 0.00 H new ATOM 642 N PHE A 45 2.836 6.283 1.316 1.00 0.00 N ATOM 643 CA PHE A 45 2.185 7.581 1.269 1.00 0.00 C ATOM 644 C PHE A 45 2.763 8.523 2.326 1.00 0.00 C ATOM 645 O PHE A 45 2.076 9.428 2.798 1.00 0.00 O ATOM 646 CB PHE A 45 0.702 7.348 1.566 1.00 0.00 C ATOM 647 CG PHE A 45 0.439 6.254 2.603 1.00 0.00 C ATOM 648 CD1 PHE A 45 0.653 4.949 2.284 1.00 0.00 C ATOM 649 CD2 PHE A 45 -0.008 6.586 3.843 1.00 0.00 C ATOM 650 CE1 PHE A 45 0.410 3.934 3.246 1.00 0.00 C ATOM 651 CE2 PHE A 45 -0.252 5.571 4.806 1.00 0.00 C ATOM 652 CZ PHE A 45 -0.038 4.266 4.487 1.00 0.00 C ATOM 0 H PHE A 45 3.162 6.003 2.241 1.00 0.00 H new ATOM 0 HA PHE A 45 2.337 8.039 0.292 1.00 0.00 H new ATOM 0 HB2 PHE A 45 0.262 8.281 1.918 1.00 0.00 H new ATOM 0 HB3 PHE A 45 0.193 7.085 0.639 1.00 0.00 H new ATOM 0 HD1 PHE A 45 1.008 4.685 1.299 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -0.178 7.622 4.096 1.00 0.00 H new ATOM 0 HE1 PHE A 45 0.581 2.898 2.993 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -0.607 5.835 5.791 1.00 0.00 H new ATOM 0 HZ PHE A 45 -0.224 3.494 5.219 1.00 0.00 H new ATOM 662 N ASN A 46 4.020 8.280 2.666 1.00 0.00 N ATOM 663 CA ASN A 46 4.698 9.096 3.659 1.00 0.00 C ATOM 664 C ASN A 46 3.864 9.130 4.941 1.00 0.00 C ATOM 665 O ASN A 46 3.365 10.184 5.333 1.00 0.00 O ATOM 666 CB ASN A 46 4.867 10.535 3.166 1.00 0.00 C ATOM 667 CG ASN A 46 5.964 11.257 3.951 1.00 0.00 C ATOM 668 OD1 ASN A 46 7.117 11.306 3.555 1.00 0.00 O ATOM 669 ND2 ASN A 46 5.543 11.814 5.083 1.00 0.00 N ATOM 0 H ASN A 46 4.587 7.529 2.271 1.00 0.00 H new ATOM 0 HA ASN A 46 5.680 8.659 3.841 1.00 0.00 H new ATOM 0 HB2 ASN A 46 5.115 10.533 2.105 1.00 0.00 H new ATOM 0 HB3 ASN A 46 3.925 11.073 3.272 1.00 0.00 H new ATOM 0 HD21 ASN A 46 6.200 12.319 5.678 1.00 0.00 H new ATOM 0 HD22 ASN A 46 4.563 11.736 5.356 1.00 0.00 H new ATOM 676 N ARG A 47 3.739 7.964 5.558 1.00 0.00 N ATOM 677 CA ARG A 47 2.974 7.848 6.788 1.00 0.00 C ATOM 678 C ARG A 47 3.694 6.928 7.776 1.00 0.00 C ATOM 679 O ARG A 47 4.706 6.317 7.436 1.00 0.00 O ATOM 680 CB ARG A 47 1.574 7.294 6.515 1.00 0.00 C ATOM 681 CG ARG A 47 0.546 8.424 6.425 1.00 0.00 C ATOM 682 CD ARG A 47 0.325 9.075 7.792 1.00 0.00 C ATOM 683 NE ARG A 47 -0.497 10.297 7.643 1.00 0.00 N ATOM 684 CZ ARG A 47 -0.795 11.128 8.651 1.00 0.00 C ATOM 685 NH1 ARG A 47 -0.342 10.874 9.886 1.00 0.00 N ATOM 686 NH2 ARG A 47 -1.548 12.214 8.423 1.00 0.00 N ATOM 0 H ARG A 47 4.154 7.092 5.229 1.00 0.00 H new ATOM 0 HA ARG A 47 2.881 8.846 7.216 1.00 0.00 H new ATOM 0 HB2 ARG A 47 1.579 6.726 5.584 1.00 0.00 H new ATOM 0 HB3 ARG A 47 1.291 6.602 7.309 1.00 0.00 H new ATOM 0 HG2 ARG A 47 0.887 9.174 5.712 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -0.399 8.032 6.048 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -0.170 8.373 8.463 1.00 0.00 H new ATOM 0 HD3 ARG A 47 1.285 9.325 8.244 1.00 0.00 H new ATOM 0 HE ARG A 47 -0.859 10.520 6.716 1.00 0.00 H new ATOM 0 HH11 ARG A 47 0.230 10.048 10.059 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -0.569 11.507 10.653 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -1.893 12.407 7.483 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -1.775 12.847 9.190 1.00 0.00 H new ATOM 700 N THR A 48 3.145 6.860 8.980 1.00 0.00 N ATOM 701 CA THR A 48 3.723 6.025 10.020 1.00 0.00 C ATOM 702 C THR A 48 3.033 4.660 10.053 1.00 0.00 C ATOM 703 O THR A 48 2.350 4.282 9.102 1.00 0.00 O ATOM 704 CB THR A 48 3.627 6.786 11.344 1.00 0.00 C ATOM 705 OG1 THR A 48 2.238 7.074 11.480 1.00 0.00 O ATOM 706 CG2 THR A 48 4.288 8.164 11.276 1.00 0.00 C ATOM 0 H THR A 48 2.306 7.369 9.259 1.00 0.00 H new ATOM 0 HA THR A 48 4.775 5.818 9.822 1.00 0.00 H new ATOM 0 HB THR A 48 4.093 6.198 12.135 1.00 0.00 H new ATOM 0 HG1 THR A 48 2.086 7.565 12.314 1.00 0.00 H new ATOM 0 HG21 THR A 48 4.192 8.662 12.241 1.00 0.00 H new ATOM 0 HG22 THR A 48 5.344 8.049 11.031 1.00 0.00 H new ATOM 0 HG23 THR A 48 3.800 8.764 10.508 1.00 0.00 H new ATOM 714 N GLN A 49 3.237 3.956 11.157 1.00 0.00 N ATOM 715 CA GLN A 49 2.643 2.641 11.326 1.00 0.00 C ATOM 716 C GLN A 49 1.296 2.754 12.042 1.00 0.00 C ATOM 717 O GLN A 49 0.270 2.332 11.512 1.00 0.00 O ATOM 718 CB GLN A 49 3.589 1.706 12.082 1.00 0.00 C ATOM 719 CG GLN A 49 2.875 0.415 12.489 1.00 0.00 C ATOM 720 CD GLN A 49 3.817 -0.514 13.258 1.00 0.00 C ATOM 721 OE1 GLN A 49 4.875 -0.122 13.721 1.00 0.00 O ATOM 722 NE2 GLN A 49 3.374 -1.763 13.367 1.00 0.00 N ATOM 0 H GLN A 49 3.805 4.272 11.943 1.00 0.00 H new ATOM 0 HA GLN A 49 2.472 2.212 10.339 1.00 0.00 H new ATOM 0 HB2 GLN A 49 4.449 1.468 11.455 1.00 0.00 H new ATOM 0 HB3 GLN A 49 3.971 2.210 12.970 1.00 0.00 H new ATOM 0 HG2 GLN A 49 2.009 0.653 13.107 1.00 0.00 H new ATOM 0 HG3 GLN A 49 2.502 -0.094 11.600 1.00 0.00 H new ATOM 0 HE21 GLN A 49 2.478 -2.024 12.955 1.00 0.00 H new ATOM 0 HE22 GLN A 49 3.930 -2.460 13.862 1.00 0.00 H new ATOM 731 N GLY A 50 1.343 3.327 13.236 1.00 0.00 N ATOM 732 CA GLY A 50 0.139 3.501 14.030 1.00 0.00 C ATOM 733 C GLY A 50 -1.056 3.858 13.144 1.00 0.00 C ATOM 734 O GLY A 50 -2.185 3.463 13.429 1.00 0.00 O ATOM 0 H GLY A 50 2.196 3.677 13.672 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -0.073 2.585 14.581 1.00 0.00 H new ATOM 0 HA3 GLY A 50 0.297 4.287 14.768 1.00 0.00 H new ATOM 738 N LEU A 51 -0.766 4.600 12.085 1.00 0.00 N ATOM 739 CA LEU A 51 -1.802 5.014 11.155 1.00 0.00 C ATOM 740 C LEU A 51 -2.135 3.851 10.218 1.00 0.00 C ATOM 741 O LEU A 51 -3.224 3.283 10.291 1.00 0.00 O ATOM 742 CB LEU A 51 -1.387 6.293 10.424 1.00 0.00 C ATOM 743 CG LEU A 51 -2.257 6.697 9.232 1.00 0.00 C ATOM 744 CD1 LEU A 51 -1.770 6.026 7.946 1.00 0.00 C ATOM 745 CD2 LEU A 51 -3.733 6.405 9.507 1.00 0.00 C ATOM 0 H LEU A 51 0.172 4.925 11.851 1.00 0.00 H new ATOM 0 HA LEU A 51 -2.717 5.264 11.692 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -1.385 7.113 11.142 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -0.361 6.172 10.075 1.00 0.00 H new ATOM 0 HG LEU A 51 -2.163 7.774 9.089 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -2.405 6.330 7.114 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -0.742 6.326 7.746 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -1.816 4.943 8.061 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -4.329 6.701 8.644 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -3.865 5.339 9.690 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -4.058 6.967 10.383 1.00 0.00 H new ATOM 757 N LEU A 52 -1.178 3.531 9.360 1.00 0.00 N ATOM 758 CA LEU A 52 -1.356 2.446 8.410 1.00 0.00 C ATOM 759 C LEU A 52 -2.036 1.268 9.110 1.00 0.00 C ATOM 760 O LEU A 52 -2.880 0.594 8.521 1.00 0.00 O ATOM 761 CB LEU A 52 -0.022 2.085 7.754 1.00 0.00 C ATOM 762 CG LEU A 52 -0.010 0.801 6.921 1.00 0.00 C ATOM 763 CD1 LEU A 52 -0.974 0.906 5.738 1.00 0.00 C ATOM 764 CD2 LEU A 52 1.410 0.450 6.474 1.00 0.00 C ATOM 0 H LEU A 52 -0.276 4.004 9.303 1.00 0.00 H new ATOM 0 HA LEU A 52 -2.012 2.755 7.596 1.00 0.00 H new ATOM 0 HB2 LEU A 52 0.281 2.913 7.113 1.00 0.00 H new ATOM 0 HB3 LEU A 52 0.732 1.994 8.536 1.00 0.00 H new ATOM 0 HG LEU A 52 -0.360 -0.017 7.550 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -0.946 -0.019 5.163 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -1.986 1.074 6.107 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -0.678 1.739 5.100 1.00 0.00 H new ATOM 0 HD21 LEU A 52 1.390 -0.466 5.884 1.00 0.00 H new ATOM 0 HD22 LEU A 52 1.812 1.262 5.869 1.00 0.00 H new ATOM 0 HD23 LEU A 52 2.042 0.303 7.350 1.00 0.00 H new ATOM 776 N SER A 53 -1.644 1.055 10.358 1.00 0.00 N ATOM 777 CA SER A 53 -2.205 -0.030 11.144 1.00 0.00 C ATOM 778 C SER A 53 -3.726 0.117 11.228 1.00 0.00 C ATOM 779 O SER A 53 -4.461 -0.822 10.928 1.00 0.00 O ATOM 780 CB SER A 53 -1.597 -0.065 12.548 1.00 0.00 C ATOM 781 OG SER A 53 -1.499 -1.393 13.054 1.00 0.00 O ATOM 0 H SER A 53 -0.944 1.616 10.844 1.00 0.00 H new ATOM 0 HA SER A 53 -1.964 -0.971 10.649 1.00 0.00 H new ATOM 0 HB2 SER A 53 -0.606 0.388 12.525 1.00 0.00 H new ATOM 0 HB3 SER A 53 -2.207 0.536 13.222 1.00 0.00 H new ATOM 0 HG SER A 53 -0.650 -1.499 13.531 1.00 0.00 H new ATOM 787 N GLU A 54 -4.152 1.303 11.638 1.00 0.00 N ATOM 788 CA GLU A 54 -5.572 1.585 11.765 1.00 0.00 C ATOM 789 C GLU A 54 -6.269 1.418 10.414 1.00 0.00 C ATOM 790 O GLU A 54 -7.434 1.029 10.356 1.00 0.00 O ATOM 791 CB GLU A 54 -5.804 2.986 12.333 1.00 0.00 C ATOM 792 CG GLU A 54 -6.026 4.002 11.211 1.00 0.00 C ATOM 793 CD GLU A 54 -5.778 5.429 11.706 1.00 0.00 C ATOM 794 OE1 GLU A 54 -4.826 5.597 12.498 1.00 0.00 O ATOM 795 OE2 GLU A 54 -6.546 6.319 11.281 1.00 0.00 O ATOM 0 H GLU A 54 -3.539 2.079 11.886 1.00 0.00 H new ATOM 0 HA GLU A 54 -6.004 0.869 12.465 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -6.670 2.975 12.995 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -4.946 3.285 12.935 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -5.358 3.781 10.378 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -7.045 3.916 10.834 1.00 0.00 H new ATOM 802 N ILE A 55 -5.526 1.722 9.359 1.00 0.00 N ATOM 803 CA ILE A 55 -6.059 1.611 8.012 1.00 0.00 C ATOM 804 C ILE A 55 -6.239 0.133 7.659 1.00 0.00 C ATOM 805 O ILE A 55 -7.041 -0.209 6.792 1.00 0.00 O ATOM 806 CB ILE A 55 -5.177 2.376 7.023 1.00 0.00 C ATOM 807 CG1 ILE A 55 -5.163 3.872 7.344 1.00 0.00 C ATOM 808 CG2 ILE A 55 -5.608 2.104 5.580 1.00 0.00 C ATOM 809 CD1 ILE A 55 -4.121 4.605 6.496 1.00 0.00 C ATOM 0 H ILE A 55 -4.560 2.045 9.410 1.00 0.00 H new ATOM 0 HA ILE A 55 -7.043 2.075 7.952 1.00 0.00 H new ATOM 0 HB ILE A 55 -4.154 2.014 7.128 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -6.150 4.296 7.160 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -4.945 4.019 8.402 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -4.965 2.660 4.897 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -5.524 1.038 5.370 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -6.642 2.421 5.443 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -4.132 5.666 6.744 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -3.132 4.195 6.700 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -4.356 4.477 5.439 1.00 0.00 H new ATOM 821 N LEU A 56 -5.479 -0.704 8.351 1.00 0.00 N ATOM 822 CA LEU A 56 -5.545 -2.137 8.122 1.00 0.00 C ATOM 823 C LEU A 56 -6.503 -2.768 9.134 1.00 0.00 C ATOM 824 O LEU A 56 -6.986 -3.881 8.928 1.00 0.00 O ATOM 825 CB LEU A 56 -4.143 -2.748 8.140 1.00 0.00 C ATOM 826 CG LEU A 56 -3.144 -2.164 7.138 1.00 0.00 C ATOM 827 CD1 LEU A 56 -1.705 -2.478 7.552 1.00 0.00 C ATOM 828 CD2 LEU A 56 -3.450 -2.643 5.717 1.00 0.00 C ATOM 0 H LEU A 56 -4.815 -0.417 9.070 1.00 0.00 H new ATOM 0 HA LEU A 56 -5.946 -2.345 7.130 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -3.731 -2.633 9.143 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -4.232 -3.818 7.953 1.00 0.00 H new ATOM 0 HG LEU A 56 -3.250 -1.079 7.142 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -1.016 -2.052 6.823 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -1.507 -2.048 8.534 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -1.566 -3.558 7.594 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -2.726 -2.214 5.025 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -3.388 -3.731 5.678 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -4.454 -2.326 5.435 1.00 0.00 H new ATOM 840 N ARG A 57 -6.751 -2.030 10.206 1.00 0.00 N ATOM 841 CA ARG A 57 -7.642 -2.502 11.251 1.00 0.00 C ATOM 842 C ARG A 57 -9.090 -2.130 10.923 1.00 0.00 C ATOM 843 O ARG A 57 -9.990 -2.960 11.042 1.00 0.00 O ATOM 844 CB ARG A 57 -7.265 -1.906 12.609 1.00 0.00 C ATOM 845 CG ARG A 57 -5.968 -2.521 13.136 1.00 0.00 C ATOM 846 CD ARG A 57 -5.902 -2.437 14.663 1.00 0.00 C ATOM 847 NE ARG A 57 -4.655 -1.759 15.080 1.00 0.00 N ATOM 848 CZ ARG A 57 -3.456 -2.356 15.132 1.00 0.00 C ATOM 849 NH1 ARG A 57 -3.335 -3.647 14.794 1.00 0.00 N ATOM 850 NH2 ARG A 57 -2.378 -1.661 15.522 1.00 0.00 N ATOM 0 H ARG A 57 -6.350 -1.107 10.373 1.00 0.00 H new ATOM 0 HA ARG A 57 -7.545 -3.586 11.304 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -7.148 -0.826 12.517 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -8.070 -2.080 13.323 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -5.902 -3.563 12.822 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -5.113 -2.002 12.702 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -6.766 -1.892 15.043 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -5.942 -3.438 15.092 1.00 0.00 H new ATOM 0 HE ARG A 57 -4.711 -0.776 15.345 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -4.155 -4.175 14.497 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -2.423 -4.101 14.834 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -2.470 -0.678 15.779 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -1.465 -2.115 15.562 1.00 0.00 H new ATOM 864 N LYS A 58 -9.268 -0.882 10.516 1.00 0.00 N ATOM 865 CA LYS A 58 -10.591 -0.390 10.169 1.00 0.00 C ATOM 866 C LYS A 58 -10.895 -0.740 8.711 1.00 0.00 C ATOM 867 O LYS A 58 -12.030 -1.070 8.372 1.00 0.00 O ATOM 868 CB LYS A 58 -10.705 1.104 10.479 1.00 0.00 C ATOM 869 CG LYS A 58 -10.562 1.365 11.980 1.00 0.00 C ATOM 870 CD LYS A 58 -10.066 2.788 12.244 1.00 0.00 C ATOM 871 CE LYS A 58 -9.627 2.954 13.701 1.00 0.00 C ATOM 872 NZ LYS A 58 -10.569 3.834 14.428 1.00 0.00 N ATOM 0 H LYS A 58 -8.519 -0.197 10.419 1.00 0.00 H new ATOM 0 HA LYS A 58 -11.351 -0.878 10.779 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -9.935 1.652 9.936 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -11.668 1.479 10.131 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -11.523 1.214 12.472 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -9.865 0.647 12.413 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -9.231 3.015 11.581 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -10.858 3.501 12.015 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -9.582 1.979 14.187 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -8.623 3.376 13.739 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -10.257 3.936 15.415 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -10.592 4.769 13.973 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -11.521 3.416 14.407 1.00 0.00 H new ATOM 886 N GLU A 59 -9.860 -0.657 7.888 1.00 0.00 N ATOM 887 CA GLU A 59 -10.002 -0.961 6.474 1.00 0.00 C ATOM 888 C GLU A 59 -11.068 -0.064 5.843 1.00 0.00 C ATOM 889 O GLU A 59 -11.916 -0.538 5.089 1.00 0.00 O ATOM 890 CB GLU A 59 -10.334 -2.440 6.262 1.00 0.00 C ATOM 891 CG GLU A 59 -9.135 -3.326 6.605 1.00 0.00 C ATOM 892 CD GLU A 59 -9.293 -4.721 5.998 1.00 0.00 C ATOM 893 OE1 GLU A 59 -10.444 -5.208 5.986 1.00 0.00 O ATOM 894 OE2 GLU A 59 -8.258 -5.269 5.559 1.00 0.00 O ATOM 0 H GLU A 59 -8.920 -0.384 8.173 1.00 0.00 H new ATOM 0 HA GLU A 59 -9.050 -0.762 5.982 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -11.185 -2.718 6.883 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -10.628 -2.605 5.226 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -8.220 -2.865 6.233 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -9.035 -3.406 7.687 1.00 0.00 H new ATOM 901 N GLU A 60 -10.990 1.217 6.174 1.00 0.00 N ATOM 902 CA GLU A 60 -11.938 2.185 5.649 1.00 0.00 C ATOM 903 C GLU A 60 -12.107 1.997 4.140 1.00 0.00 C ATOM 904 O GLU A 60 -11.232 2.376 3.362 1.00 0.00 O ATOM 905 CB GLU A 60 -11.501 3.614 5.978 1.00 0.00 C ATOM 906 CG GLU A 60 -12.403 4.229 7.050 1.00 0.00 C ATOM 907 CD GLU A 60 -12.733 5.686 6.719 1.00 0.00 C ATOM 908 OE1 GLU A 60 -11.819 6.375 6.217 1.00 0.00 O ATOM 909 OE2 GLU A 60 -13.892 6.078 6.977 1.00 0.00 O ATOM 0 H GLU A 60 -10.285 1.607 6.799 1.00 0.00 H new ATOM 0 HA GLU A 60 -12.903 2.016 6.127 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -10.468 3.612 6.325 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -11.533 4.225 5.076 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -13.325 3.653 7.129 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -11.909 4.176 8.020 1.00 0.00 H new ATOM 916 N ASP A 61 -13.237 1.413 3.771 1.00 0.00 N ATOM 917 CA ASP A 61 -13.532 1.170 2.369 1.00 0.00 C ATOM 918 C ASP A 61 -13.167 2.412 1.554 1.00 0.00 C ATOM 919 O ASP A 61 -13.424 3.537 1.980 1.00 0.00 O ATOM 920 CB ASP A 61 -15.021 0.889 2.160 1.00 0.00 C ATOM 921 CG ASP A 61 -15.347 -0.512 1.638 1.00 0.00 C ATOM 922 OD1 ASP A 61 -14.441 -1.113 1.021 1.00 0.00 O ATOM 923 OD2 ASP A 61 -16.496 -0.950 1.866 1.00 0.00 O ATOM 0 H ASP A 61 -13.960 1.101 4.419 1.00 0.00 H new ATOM 0 HA ASP A 61 -12.953 0.304 2.047 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -15.540 1.038 3.107 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -15.419 1.623 1.460 1.00 0.00 H new ATOM 928 N PRO A 62 -12.557 2.160 0.364 1.00 0.00 N ATOM 929 CA PRO A 62 -12.154 3.244 -0.515 1.00 0.00 C ATOM 930 C PRO A 62 -13.364 3.853 -1.225 1.00 0.00 C ATOM 931 O PRO A 62 -13.226 4.809 -1.987 1.00 0.00 O ATOM 932 CB PRO A 62 -11.153 2.622 -1.474 1.00 0.00 C ATOM 933 CG PRO A 62 -11.380 1.121 -1.397 1.00 0.00 C ATOM 934 CD PRO A 62 -12.236 0.841 -0.173 1.00 0.00 C ATOM 0 HA PRO A 62 -11.703 4.077 0.024 1.00 0.00 H new ATOM 0 HB2 PRO A 62 -11.305 2.988 -2.489 1.00 0.00 H new ATOM 0 HB3 PRO A 62 -10.131 2.878 -1.192 1.00 0.00 H new ATOM 0 HG2 PRO A 62 -11.876 0.763 -2.299 1.00 0.00 H new ATOM 0 HG3 PRO A 62 -10.428 0.594 -1.326 1.00 0.00 H new ATOM 0 HD2 PRO A 62 -13.139 0.291 -0.439 1.00 0.00 H new ATOM 0 HD3 PRO A 62 -11.698 0.236 0.557 1.00 0.00 H new ATOM 942 N ARG A 63 -14.524 3.274 -0.952 1.00 0.00 N ATOM 943 CA ARG A 63 -15.758 3.747 -1.555 1.00 0.00 C ATOM 944 C ARG A 63 -16.399 4.825 -0.678 1.00 0.00 C ATOM 945 O ARG A 63 -17.061 5.729 -1.184 1.00 0.00 O ATOM 946 CB ARG A 63 -16.752 2.600 -1.749 1.00 0.00 C ATOM 947 CG ARG A 63 -16.068 1.382 -2.374 1.00 0.00 C ATOM 948 CD ARG A 63 -16.782 0.951 -3.657 1.00 0.00 C ATOM 949 NE ARG A 63 -16.615 -0.505 -3.864 1.00 0.00 N ATOM 950 CZ ARG A 63 -15.484 -1.076 -4.300 1.00 0.00 C ATOM 951 NH1 ARG A 63 -14.414 -0.319 -4.577 1.00 0.00 N ATOM 952 NH2 ARG A 63 -15.422 -2.406 -4.459 1.00 0.00 N ATOM 0 H ARG A 63 -14.635 2.481 -0.321 1.00 0.00 H new ATOM 0 HA ARG A 63 -15.510 4.167 -2.530 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -17.187 2.324 -0.788 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -17.572 2.929 -2.387 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -15.027 1.618 -2.595 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -16.064 0.557 -1.661 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -17.842 1.199 -3.594 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -16.377 1.497 -4.509 1.00 0.00 H new ATOM 0 HE ARG A 63 -17.410 -1.111 -3.662 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -14.460 0.693 -4.456 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -13.553 -0.754 -4.909 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -16.236 -2.983 -4.248 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -14.561 -2.840 -4.791 1.00 0.00 H new ATOM 966 N THR A 64 -16.178 4.693 0.622 1.00 0.00 N ATOM 967 CA THR A 64 -16.726 5.644 1.574 1.00 0.00 C ATOM 968 C THR A 64 -15.601 6.438 2.241 1.00 0.00 C ATOM 969 O THR A 64 -15.821 7.550 2.719 1.00 0.00 O ATOM 970 CB THR A 64 -17.596 4.871 2.567 1.00 0.00 C ATOM 971 OG1 THR A 64 -17.576 5.675 3.744 1.00 0.00 O ATOM 972 CG2 THR A 64 -16.954 3.553 3.005 1.00 0.00 C ATOM 0 H THR A 64 -15.627 3.942 1.038 1.00 0.00 H new ATOM 0 HA THR A 64 -17.354 6.384 1.078 1.00 0.00 H new ATOM 0 HB THR A 64 -18.568 4.669 2.118 1.00 0.00 H new ATOM 0 HG1 THR A 64 -18.117 5.249 4.441 1.00 0.00 H new ATOM 0 HG21 THR A 64 -17.612 3.044 3.709 1.00 0.00 H new ATOM 0 HG22 THR A 64 -16.795 2.918 2.133 1.00 0.00 H new ATOM 0 HG23 THR A 64 -15.997 3.756 3.485 1.00 0.00 H new ATOM 980 N ALA A 65 -14.421 5.837 2.251 1.00 0.00 N ATOM 981 CA ALA A 65 -13.261 6.474 2.852 1.00 0.00 C ATOM 982 C ALA A 65 -13.278 7.968 2.523 1.00 0.00 C ATOM 983 O ALA A 65 -13.850 8.379 1.515 1.00 0.00 O ATOM 984 CB ALA A 65 -11.987 5.783 2.360 1.00 0.00 C ATOM 0 H ALA A 65 -14.243 4.915 1.852 1.00 0.00 H new ATOM 0 HA ALA A 65 -13.287 6.375 3.937 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -11.117 6.261 2.811 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -12.011 4.731 2.644 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -11.925 5.865 1.275 1.00 0.00 H new ATOM 990 N SER A 66 -12.645 8.740 3.394 1.00 0.00 N ATOM 991 CA SER A 66 -12.581 10.180 3.209 1.00 0.00 C ATOM 992 C SER A 66 -11.391 10.540 2.317 1.00 0.00 C ATOM 993 O SER A 66 -10.420 9.788 2.237 1.00 0.00 O ATOM 994 CB SER A 66 -12.475 10.904 4.553 1.00 0.00 C ATOM 995 OG SER A 66 -11.195 11.503 4.737 1.00 0.00 O ATOM 0 H SER A 66 -12.172 8.396 4.230 1.00 0.00 H new ATOM 0 HA SER A 66 -13.502 10.504 2.724 1.00 0.00 H new ATOM 0 HB2 SER A 66 -13.247 11.672 4.613 1.00 0.00 H new ATOM 0 HB3 SER A 66 -12.664 10.198 5.361 1.00 0.00 H new ATOM 0 HG SER A 66 -11.168 11.956 5.605 1.00 0.00 H new ATOM 1001 N GLN A 67 -11.504 11.690 1.669 1.00 0.00 N ATOM 1002 CA GLN A 67 -10.450 12.159 0.786 1.00 0.00 C ATOM 1003 C GLN A 67 -9.090 12.046 1.477 1.00 0.00 C ATOM 1004 O GLN A 67 -8.102 11.661 0.852 1.00 0.00 O ATOM 1005 CB GLN A 67 -10.715 13.595 0.330 1.00 0.00 C ATOM 1006 CG GLN A 67 -11.225 13.627 -1.112 1.00 0.00 C ATOM 1007 CD GLN A 67 -11.721 15.025 -1.488 1.00 0.00 C ATOM 1008 OE1 GLN A 67 -11.001 16.007 -1.414 1.00 0.00 O ATOM 1009 NE2 GLN A 67 -12.987 15.059 -1.893 1.00 0.00 N ATOM 0 H GLN A 67 -12.310 12.311 1.738 1.00 0.00 H new ATOM 0 HA GLN A 67 -10.439 11.527 -0.102 1.00 0.00 H new ATOM 0 HB2 GLN A 67 -11.448 14.060 0.989 1.00 0.00 H new ATOM 0 HB3 GLN A 67 -9.799 14.180 0.409 1.00 0.00 H new ATOM 0 HG2 GLN A 67 -10.427 13.326 -1.790 1.00 0.00 H new ATOM 0 HG3 GLN A 67 -12.034 12.906 -1.231 1.00 0.00 H new ATOM 0 HE21 GLN A 67 -13.534 14.199 -1.931 1.00 0.00 H new ATOM 0 HE22 GLN A 67 -13.412 15.945 -2.165 1.00 0.00 H new ATOM 1018 N SER A 68 -9.081 12.387 2.757 1.00 0.00 N ATOM 1019 CA SER A 68 -7.859 12.328 3.540 1.00 0.00 C ATOM 1020 C SER A 68 -7.253 10.926 3.459 1.00 0.00 C ATOM 1021 O SER A 68 -6.045 10.777 3.276 1.00 0.00 O ATOM 1022 CB SER A 68 -8.119 12.711 4.998 1.00 0.00 C ATOM 1023 OG SER A 68 -7.192 13.688 5.467 1.00 0.00 O ATOM 0 H SER A 68 -9.902 12.706 3.272 1.00 0.00 H new ATOM 0 HA SER A 68 -7.152 13.047 3.125 1.00 0.00 H new ATOM 0 HB2 SER A 68 -9.134 13.097 5.096 1.00 0.00 H new ATOM 0 HB3 SER A 68 -8.055 11.821 5.624 1.00 0.00 H new ATOM 0 HG SER A 68 -7.392 13.907 6.401 1.00 0.00 H new ATOM 1029 N LEU A 69 -8.119 9.933 3.601 1.00 0.00 N ATOM 1030 CA LEU A 69 -7.684 8.547 3.546 1.00 0.00 C ATOM 1031 C LEU A 69 -7.422 8.156 2.090 1.00 0.00 C ATOM 1032 O LEU A 69 -6.324 7.721 1.749 1.00 0.00 O ATOM 1033 CB LEU A 69 -8.693 7.641 4.255 1.00 0.00 C ATOM 1034 CG LEU A 69 -8.109 6.428 4.981 1.00 0.00 C ATOM 1035 CD1 LEU A 69 -9.137 5.812 5.933 1.00 0.00 C ATOM 1036 CD2 LEU A 69 -7.564 5.402 3.986 1.00 0.00 C ATOM 0 H LEU A 69 -9.119 10.060 3.754 1.00 0.00 H new ATOM 0 HA LEU A 69 -6.744 8.421 4.084 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -9.245 8.241 4.978 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -9.414 7.286 3.518 1.00 0.00 H new ATOM 0 HG LEU A 69 -7.269 6.766 5.587 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -8.697 4.951 6.437 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -9.436 6.553 6.675 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -10.012 5.492 5.367 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -7.155 4.550 4.529 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -8.370 5.064 3.334 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -6.779 5.860 3.385 1.00 0.00 H new ATOM 1048 N LEU A 70 -8.450 8.326 1.272 1.00 0.00 N ATOM 1049 CA LEU A 70 -8.345 7.996 -0.140 1.00 0.00 C ATOM 1050 C LEU A 70 -7.014 8.517 -0.683 1.00 0.00 C ATOM 1051 O LEU A 70 -6.350 7.838 -1.465 1.00 0.00 O ATOM 1052 CB LEU A 70 -9.566 8.513 -0.903 1.00 0.00 C ATOM 1053 CG LEU A 70 -10.751 7.551 -1.004 1.00 0.00 C ATOM 1054 CD1 LEU A 70 -12.031 8.297 -1.387 1.00 0.00 C ATOM 1055 CD2 LEU A 70 -10.446 6.404 -1.969 1.00 0.00 C ATOM 0 H LEU A 70 -9.359 8.688 1.559 1.00 0.00 H new ATOM 0 HA LEU A 70 -8.345 6.915 -0.280 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -9.908 9.430 -0.423 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -9.253 8.779 -1.912 1.00 0.00 H new ATOM 0 HG LEU A 70 -10.917 7.109 -0.021 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -12.858 7.590 -1.452 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -12.255 9.049 -0.630 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -11.893 8.784 -2.352 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -11.305 5.735 -2.022 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -10.239 6.808 -2.960 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -9.577 5.851 -1.613 1.00 0.00 H new ATOM 1067 N VAL A 71 -6.662 9.718 -0.247 1.00 0.00 N ATOM 1068 CA VAL A 71 -5.422 10.338 -0.680 1.00 0.00 C ATOM 1069 C VAL A 71 -4.262 9.368 -0.445 1.00 0.00 C ATOM 1070 O VAL A 71 -3.394 9.213 -1.302 1.00 0.00 O ATOM 1071 CB VAL A 71 -5.232 11.680 0.030 1.00 0.00 C ATOM 1072 CG1 VAL A 71 -3.750 12.051 0.113 1.00 0.00 C ATOM 1073 CG2 VAL A 71 -6.036 12.784 -0.660 1.00 0.00 C ATOM 0 H VAL A 71 -7.215 10.278 0.402 1.00 0.00 H new ATOM 0 HA VAL A 71 -5.455 10.552 -1.748 1.00 0.00 H new ATOM 0 HB VAL A 71 -5.609 11.577 1.048 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -3.643 13.009 0.622 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -3.213 11.282 0.669 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -3.337 12.126 -0.893 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -5.883 13.727 -0.136 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -5.703 12.885 -1.693 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -7.095 12.527 -0.644 1.00 0.00 H new ATOM 1083 N ASN A 72 -4.287 8.738 0.721 1.00 0.00 N ATOM 1084 CA ASN A 72 -3.248 7.787 1.080 1.00 0.00 C ATOM 1085 C ASN A 72 -3.454 6.493 0.290 1.00 0.00 C ATOM 1086 O ASN A 72 -2.516 5.976 -0.315 1.00 0.00 O ATOM 1087 CB ASN A 72 -3.305 7.446 2.570 1.00 0.00 C ATOM 1088 CG ASN A 72 -2.755 8.596 3.417 1.00 0.00 C ATOM 1089 OD1 ASN A 72 -1.729 9.185 3.119 1.00 0.00 O ATOM 1090 ND2 ASN A 72 -3.493 8.881 4.486 1.00 0.00 N ATOM 0 H ASN A 72 -5.010 8.867 1.429 1.00 0.00 H new ATOM 0 HA ASN A 72 -2.283 8.238 0.850 1.00 0.00 H new ATOM 0 HB2 ASN A 72 -4.335 7.236 2.860 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -2.729 6.541 2.762 1.00 0.00 H new ATOM 0 HD21 ASN A 72 -3.211 9.633 5.115 1.00 0.00 H new ATOM 0 HD22 ASN A 72 -4.341 8.348 4.677 1.00 0.00 H new ATOM 1097 N LEU A 73 -4.686 6.007 0.322 1.00 0.00 N ATOM 1098 CA LEU A 73 -5.026 4.783 -0.383 1.00 0.00 C ATOM 1099 C LEU A 73 -4.471 4.848 -1.807 1.00 0.00 C ATOM 1100 O LEU A 73 -3.741 3.955 -2.234 1.00 0.00 O ATOM 1101 CB LEU A 73 -6.534 4.531 -0.321 1.00 0.00 C ATOM 1102 CG LEU A 73 -7.155 4.512 1.077 1.00 0.00 C ATOM 1103 CD1 LEU A 73 -8.671 4.323 1.001 1.00 0.00 C ATOM 1104 CD2 LEU A 73 -6.488 3.454 1.959 1.00 0.00 C ATOM 0 H LEU A 73 -5.461 6.439 0.825 1.00 0.00 H new ATOM 0 HA LEU A 73 -4.562 3.923 0.101 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -7.035 5.300 -0.909 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -6.743 3.576 -0.802 1.00 0.00 H new ATOM 0 HG LEU A 73 -6.975 5.480 1.544 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -9.087 4.313 2.008 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -9.112 5.143 0.434 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -8.896 3.378 0.506 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -6.948 3.461 2.947 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -6.615 2.470 1.507 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -5.425 3.676 2.052 1.00 0.00 H new ATOM 1116 N ARG A 74 -4.838 5.915 -2.503 1.00 0.00 N ATOM 1117 CA ARG A 74 -4.386 6.108 -3.870 1.00 0.00 C ATOM 1118 C ARG A 74 -2.869 5.930 -3.957 1.00 0.00 C ATOM 1119 O ARG A 74 -2.376 5.194 -4.811 1.00 0.00 O ATOM 1120 CB ARG A 74 -4.759 7.501 -4.381 1.00 0.00 C ATOM 1121 CG ARG A 74 -6.089 7.470 -5.137 1.00 0.00 C ATOM 1122 CD ARG A 74 -6.813 8.814 -5.028 1.00 0.00 C ATOM 1123 NE ARG A 74 -7.647 9.038 -6.230 1.00 0.00 N ATOM 1124 CZ ARG A 74 -8.456 10.093 -6.396 1.00 0.00 C ATOM 1125 NH1 ARG A 74 -8.546 11.026 -5.439 1.00 0.00 N ATOM 1126 NH2 ARG A 74 -9.176 10.215 -7.520 1.00 0.00 N ATOM 0 H ARG A 74 -5.443 6.654 -2.145 1.00 0.00 H new ATOM 0 HA ARG A 74 -4.879 5.361 -4.492 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -4.830 8.193 -3.542 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -3.972 7.874 -5.037 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -5.910 7.233 -6.186 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -6.722 6.678 -4.735 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -7.437 8.829 -4.134 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -6.087 9.620 -4.923 1.00 0.00 H new ATOM 0 HE ARG A 74 -7.603 8.346 -6.978 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -7.998 10.933 -4.583 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -9.162 11.829 -5.566 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -9.108 9.505 -8.249 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -9.792 11.018 -7.646 1.00 0.00 H new ATOM 1140 N ALA A 75 -2.172 6.615 -3.063 1.00 0.00 N ATOM 1141 CA ALA A 75 -0.721 6.541 -3.029 1.00 0.00 C ATOM 1142 C ALA A 75 -0.293 5.080 -2.880 1.00 0.00 C ATOM 1143 O ALA A 75 0.480 4.571 -3.690 1.00 0.00 O ATOM 1144 CB ALA A 75 -0.192 7.423 -1.896 1.00 0.00 C ATOM 0 H ALA A 75 -2.585 7.224 -2.357 1.00 0.00 H new ATOM 0 HA ALA A 75 -0.295 6.916 -3.960 1.00 0.00 H new ATOM 0 HB1 ALA A 75 0.896 7.368 -1.870 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -0.499 8.455 -2.065 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -0.596 7.075 -0.945 1.00 0.00 H new ATOM 1150 N MET A 76 -0.813 4.447 -1.839 1.00 0.00 N ATOM 1151 CA MET A 76 -0.494 3.055 -1.573 1.00 0.00 C ATOM 1152 C MET A 76 -0.622 2.211 -2.843 1.00 0.00 C ATOM 1153 O MET A 76 0.369 1.677 -3.339 1.00 0.00 O ATOM 1154 CB MET A 76 -1.440 2.510 -0.500 1.00 0.00 C ATOM 1155 CG MET A 76 -1.028 2.995 0.891 1.00 0.00 C ATOM 1156 SD MET A 76 -2.137 2.331 2.122 1.00 0.00 S ATOM 1157 CE MET A 76 -3.113 3.783 2.475 1.00 0.00 C ATOM 0 H MET A 76 -1.454 4.873 -1.169 1.00 0.00 H new ATOM 0 HA MET A 76 0.537 2.998 -1.224 1.00 0.00 H new ATOM 0 HB2 MET A 76 -2.460 2.829 -0.713 1.00 0.00 H new ATOM 0 HB3 MET A 76 -1.435 1.420 -0.525 1.00 0.00 H new ATOM 0 HG2 MET A 76 -0.005 2.684 1.105 1.00 0.00 H new ATOM 0 HG3 MET A 76 -1.044 4.084 0.925 1.00 0.00 H new ATOM 0 HE1 MET A 76 -4.047 3.486 2.953 1.00 0.00 H new ATOM 0 HE2 MET A 76 -2.557 4.442 3.142 1.00 0.00 H new ATOM 0 HE3 MET A 76 -3.332 4.309 1.546 1.00 0.00 H new ATOM 1167 N GLN A 77 -1.849 2.118 -3.332 1.00 0.00 N ATOM 1168 CA GLN A 77 -2.119 1.349 -4.535 1.00 0.00 C ATOM 1169 C GLN A 77 -1.171 1.771 -5.659 1.00 0.00 C ATOM 1170 O GLN A 77 -0.775 0.948 -6.483 1.00 0.00 O ATOM 1171 CB GLN A 77 -3.580 1.497 -4.964 1.00 0.00 C ATOM 1172 CG GLN A 77 -3.847 0.743 -6.268 1.00 0.00 C ATOM 1173 CD GLN A 77 -4.636 -0.542 -6.006 1.00 0.00 C ATOM 1174 OE1 GLN A 77 -5.694 -0.777 -6.566 1.00 0.00 O ATOM 1175 NE2 GLN A 77 -4.064 -1.358 -5.126 1.00 0.00 N ATOM 0 H GLN A 77 -2.668 2.562 -2.917 1.00 0.00 H new ATOM 0 HA GLN A 77 -1.944 0.296 -4.316 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -4.234 1.116 -4.179 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -3.819 2.552 -5.094 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -4.403 1.382 -6.955 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -2.901 0.501 -6.753 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -3.177 -1.101 -4.693 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -4.512 -2.242 -4.883 1.00 0.00 H new ATOM 1184 N ASN A 78 -0.835 3.052 -5.656 1.00 0.00 N ATOM 1185 CA ASN A 78 0.059 3.594 -6.666 1.00 0.00 C ATOM 1186 C ASN A 78 1.478 3.082 -6.411 1.00 0.00 C ATOM 1187 O ASN A 78 2.234 2.846 -7.352 1.00 0.00 O ATOM 1188 CB ASN A 78 0.090 5.122 -6.611 1.00 0.00 C ATOM 1189 CG ASN A 78 0.809 5.700 -7.832 1.00 0.00 C ATOM 1190 OD1 ASN A 78 0.995 5.044 -8.843 1.00 0.00 O ATOM 1191 ND2 ASN A 78 1.202 6.962 -7.681 1.00 0.00 N ATOM 0 H ASN A 78 -1.165 3.731 -4.970 1.00 0.00 H new ATOM 0 HA ASN A 78 -0.303 3.276 -7.644 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -0.928 5.509 -6.567 1.00 0.00 H new ATOM 0 HB3 ASN A 78 0.594 5.447 -5.700 1.00 0.00 H new ATOM 0 HD21 ASN A 78 1.691 7.438 -8.439 1.00 0.00 H new ATOM 0 HD22 ASN A 78 1.014 7.454 -6.807 1.00 0.00 H new ATOM 1198 N PHE A 79 1.797 2.927 -5.135 1.00 0.00 N ATOM 1199 CA PHE A 79 3.112 2.447 -4.745 1.00 0.00 C ATOM 1200 C PHE A 79 3.232 0.937 -4.962 1.00 0.00 C ATOM 1201 O PHE A 79 4.301 0.440 -5.309 1.00 0.00 O ATOM 1202 CB PHE A 79 3.274 2.751 -3.254 1.00 0.00 C ATOM 1203 CG PHE A 79 4.429 2.000 -2.588 1.00 0.00 C ATOM 1204 CD1 PHE A 79 5.708 2.427 -2.762 1.00 0.00 C ATOM 1205 CD2 PHE A 79 4.176 0.904 -1.823 1.00 0.00 C ATOM 1206 CE1 PHE A 79 6.780 1.730 -2.144 1.00 0.00 C ATOM 1207 CE2 PHE A 79 5.247 0.207 -1.205 1.00 0.00 C ATOM 1208 CZ PHE A 79 6.527 0.634 -1.378 1.00 0.00 C ATOM 0 H PHE A 79 1.167 3.125 -4.357 1.00 0.00 H new ATOM 0 HA PHE A 79 3.880 2.935 -5.346 1.00 0.00 H new ATOM 0 HB2 PHE A 79 3.429 3.822 -3.127 1.00 0.00 H new ATOM 0 HB3 PHE A 79 2.346 2.500 -2.740 1.00 0.00 H new ATOM 0 HD1 PHE A 79 5.909 3.296 -3.370 1.00 0.00 H new ATOM 0 HD2 PHE A 79 3.160 0.564 -1.686 1.00 0.00 H new ATOM 0 HE1 PHE A 79 7.796 2.070 -2.282 1.00 0.00 H new ATOM 0 HE2 PHE A 79 5.046 -0.663 -0.597 1.00 0.00 H new ATOM 0 HZ PHE A 79 7.342 0.104 -0.908 1.00 0.00 H new ATOM 1218 N LEU A 80 2.119 0.251 -4.747 1.00 0.00 N ATOM 1219 CA LEU A 80 2.086 -1.192 -4.915 1.00 0.00 C ATOM 1220 C LEU A 80 2.197 -1.531 -6.403 1.00 0.00 C ATOM 1221 O LEU A 80 2.419 -2.685 -6.765 1.00 0.00 O ATOM 1222 CB LEU A 80 0.845 -1.781 -4.241 1.00 0.00 C ATOM 1223 CG LEU A 80 0.723 -1.541 -2.735 1.00 0.00 C ATOM 1224 CD1 LEU A 80 -0.702 -1.817 -2.250 1.00 0.00 C ATOM 1225 CD2 LEU A 80 1.759 -2.360 -1.963 1.00 0.00 C ATOM 0 H LEU A 80 1.234 0.667 -4.458 1.00 0.00 H new ATOM 0 HA LEU A 80 2.940 -1.653 -4.418 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -0.039 -1.368 -4.727 1.00 0.00 H new ATOM 0 HB3 LEU A 80 0.834 -2.856 -4.420 1.00 0.00 H new ATOM 0 HG LEU A 80 0.933 -0.490 -2.539 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -0.762 -1.639 -1.176 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -1.397 -1.155 -2.767 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -0.964 -2.854 -2.461 1.00 0.00 H new ATOM 0 HD21 LEU A 80 1.650 -2.171 -0.895 1.00 0.00 H new ATOM 0 HD22 LEU A 80 1.605 -3.421 -2.161 1.00 0.00 H new ATOM 0 HD23 LEU A 80 2.761 -2.073 -2.282 1.00 0.00 H new ATOM 1237 N ASN A 81 2.037 -0.504 -7.224 1.00 0.00 N ATOM 1238 CA ASN A 81 2.116 -0.678 -8.665 1.00 0.00 C ATOM 1239 C ASN A 81 3.585 -0.683 -9.093 1.00 0.00 C ATOM 1240 O ASN A 81 3.936 -1.275 -10.113 1.00 0.00 O ATOM 1241 CB ASN A 81 1.414 0.466 -9.398 1.00 0.00 C ATOM 1242 CG ASN A 81 -0.104 0.274 -9.388 1.00 0.00 C ATOM 1243 OD1 ASN A 81 -0.615 -0.831 -9.312 1.00 0.00 O ATOM 1244 ND2 ASN A 81 -0.793 1.409 -9.467 1.00 0.00 N ATOM 0 H ASN A 81 1.853 0.452 -6.919 1.00 0.00 H new ATOM 0 HA ASN A 81 1.629 -1.620 -8.918 1.00 0.00 H new ATOM 0 HB2 ASN A 81 1.667 1.415 -8.925 1.00 0.00 H new ATOM 0 HB3 ASN A 81 1.771 0.517 -10.427 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -1.813 1.388 -9.466 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -0.302 2.301 -9.528 1.00 0.00 H new ATOM 1251 N LEU A 82 4.404 -0.018 -8.293 1.00 0.00 N ATOM 1252 CA LEU A 82 5.827 0.062 -8.576 1.00 0.00 C ATOM 1253 C LEU A 82 6.366 -1.342 -8.860 1.00 0.00 C ATOM 1254 O LEU A 82 5.717 -2.336 -8.539 1.00 0.00 O ATOM 1255 CB LEU A 82 6.560 0.785 -7.444 1.00 0.00 C ATOM 1256 CG LEU A 82 6.552 2.313 -7.508 1.00 0.00 C ATOM 1257 CD1 LEU A 82 7.473 2.911 -6.443 1.00 0.00 C ATOM 1258 CD2 LEU A 82 6.907 2.805 -8.913 1.00 0.00 C ATOM 0 H LEU A 82 4.109 0.471 -7.448 1.00 0.00 H new ATOM 0 HA LEU A 82 6.004 0.659 -9.471 1.00 0.00 H new ATOM 0 HB2 LEU A 82 6.116 0.479 -6.497 1.00 0.00 H new ATOM 0 HB3 LEU A 82 7.596 0.447 -7.435 1.00 0.00 H new ATOM 0 HG LEU A 82 5.541 2.658 -7.291 1.00 0.00 H new ATOM 0 HD11 LEU A 82 7.449 3.999 -6.510 1.00 0.00 H new ATOM 0 HD12 LEU A 82 7.135 2.601 -5.454 1.00 0.00 H new ATOM 0 HD13 LEU A 82 8.492 2.560 -6.605 1.00 0.00 H new ATOM 0 HD21 LEU A 82 6.894 3.895 -8.931 1.00 0.00 H new ATOM 0 HD22 LEU A 82 7.901 2.449 -9.183 1.00 0.00 H new ATOM 0 HD23 LEU A 82 6.179 2.422 -9.628 1.00 0.00 H new ATOM 1270 N PRO A 83 7.578 -1.379 -9.475 1.00 0.00 N ATOM 1271 CA PRO A 83 8.211 -2.644 -9.805 1.00 0.00 C ATOM 1272 C PRO A 83 8.786 -3.313 -8.554 1.00 0.00 C ATOM 1273 O PRO A 83 9.452 -2.664 -7.749 1.00 0.00 O ATOM 1274 CB PRO A 83 9.275 -2.296 -10.834 1.00 0.00 C ATOM 1275 CG PRO A 83 9.512 -0.800 -10.698 1.00 0.00 C ATOM 1276 CD PRO A 83 8.376 -0.222 -9.870 1.00 0.00 C ATOM 0 HA PRO A 83 7.508 -3.372 -10.209 1.00 0.00 H new ATOM 0 HB2 PRO A 83 10.193 -2.855 -10.651 1.00 0.00 H new ATOM 0 HB3 PRO A 83 8.942 -2.549 -11.841 1.00 0.00 H new ATOM 0 HG2 PRO A 83 10.471 -0.608 -10.217 1.00 0.00 H new ATOM 0 HG3 PRO A 83 9.547 -0.328 -11.680 1.00 0.00 H new ATOM 0 HD2 PRO A 83 8.754 0.314 -8.999 1.00 0.00 H new ATOM 0 HD3 PRO A 83 7.785 0.487 -10.449 1.00 0.00 H new ATOM 1284 N GLU A 84 8.508 -4.602 -8.431 1.00 0.00 N ATOM 1285 CA GLU A 84 8.989 -5.366 -7.292 1.00 0.00 C ATOM 1286 C GLU A 84 10.461 -5.047 -7.023 1.00 0.00 C ATOM 1287 O GLU A 84 10.876 -4.942 -5.870 1.00 0.00 O ATOM 1288 CB GLU A 84 8.784 -6.866 -7.512 1.00 0.00 C ATOM 1289 CG GLU A 84 9.179 -7.662 -6.266 1.00 0.00 C ATOM 1290 CD GLU A 84 8.368 -8.955 -6.161 1.00 0.00 C ATOM 1291 OE1 GLU A 84 7.131 -8.863 -6.318 1.00 0.00 O ATOM 1292 OE2 GLU A 84 9.003 -10.006 -5.927 1.00 0.00 O ATOM 0 H GLU A 84 7.956 -5.137 -9.101 1.00 0.00 H new ATOM 0 HA GLU A 84 8.409 -5.079 -6.415 1.00 0.00 H new ATOM 0 HB2 GLU A 84 7.740 -7.062 -7.757 1.00 0.00 H new ATOM 0 HB3 GLU A 84 9.379 -7.197 -8.363 1.00 0.00 H new ATOM 0 HG2 GLU A 84 10.243 -7.898 -6.303 1.00 0.00 H new ATOM 0 HG3 GLU A 84 9.018 -7.054 -5.376 1.00 0.00 H new ATOM 1299 N VAL A 85 11.210 -4.903 -8.106 1.00 0.00 N ATOM 1300 CA VAL A 85 12.626 -4.599 -8.001 1.00 0.00 C ATOM 1301 C VAL A 85 12.806 -3.276 -7.254 1.00 0.00 C ATOM 1302 O VAL A 85 13.725 -3.133 -6.450 1.00 0.00 O ATOM 1303 CB VAL A 85 13.264 -4.591 -9.392 1.00 0.00 C ATOM 1304 CG1 VAL A 85 12.624 -5.647 -10.295 1.00 0.00 C ATOM 1305 CG2 VAL A 85 13.177 -3.201 -10.027 1.00 0.00 C ATOM 0 H VAL A 85 10.862 -4.991 -9.061 1.00 0.00 H new ATOM 0 HA VAL A 85 13.140 -5.369 -7.426 1.00 0.00 H new ATOM 0 HB VAL A 85 14.319 -4.842 -9.278 1.00 0.00 H new ATOM 0 HG11 VAL A 85 13.096 -5.620 -11.277 1.00 0.00 H new ATOM 0 HG12 VAL A 85 12.761 -6.634 -9.854 1.00 0.00 H new ATOM 0 HG13 VAL A 85 11.559 -5.440 -10.398 1.00 0.00 H new ATOM 0 HG21 VAL A 85 13.638 -3.223 -11.015 1.00 0.00 H new ATOM 0 HG22 VAL A 85 12.131 -2.909 -10.121 1.00 0.00 H new ATOM 0 HG23 VAL A 85 13.700 -2.480 -9.398 1.00 0.00 H new ATOM 1315 N GLU A 86 11.912 -2.342 -7.545 1.00 0.00 N ATOM 1316 CA GLU A 86 11.960 -1.036 -6.911 1.00 0.00 C ATOM 1317 C GLU A 86 11.563 -1.147 -5.437 1.00 0.00 C ATOM 1318 O GLU A 86 12.343 -0.796 -4.553 1.00 0.00 O ATOM 1319 CB GLU A 86 11.065 -0.037 -7.646 1.00 0.00 C ATOM 1320 CG GLU A 86 11.890 0.865 -8.567 1.00 0.00 C ATOM 1321 CD GLU A 86 13.025 1.542 -7.797 1.00 0.00 C ATOM 1322 OE1 GLU A 86 12.703 2.263 -6.828 1.00 0.00 O ATOM 1323 OE2 GLU A 86 14.190 1.324 -8.195 1.00 0.00 O ATOM 0 H GLU A 86 11.150 -2.464 -8.212 1.00 0.00 H new ATOM 0 HA GLU A 86 12.983 -0.665 -6.965 1.00 0.00 H new ATOM 0 HB2 GLU A 86 10.318 -0.574 -8.231 1.00 0.00 H new ATOM 0 HB3 GLU A 86 10.525 0.573 -6.922 1.00 0.00 H new ATOM 0 HG2 GLU A 86 12.302 0.275 -9.386 1.00 0.00 H new ATOM 0 HG3 GLU A 86 11.246 1.623 -9.013 1.00 0.00 H new ATOM 1330 N ARG A 87 10.352 -1.637 -5.219 1.00 0.00 N ATOM 1331 CA ARG A 87 9.843 -1.799 -3.867 1.00 0.00 C ATOM 1332 C ARG A 87 10.902 -2.448 -2.975 1.00 0.00 C ATOM 1333 O ARG A 87 11.112 -2.018 -1.842 1.00 0.00 O ATOM 1334 CB ARG A 87 8.578 -2.660 -3.855 1.00 0.00 C ATOM 1335 CG ARG A 87 7.581 -2.186 -4.914 1.00 0.00 C ATOM 1336 CD ARG A 87 6.142 -2.319 -4.411 1.00 0.00 C ATOM 1337 NE ARG A 87 5.520 -3.539 -4.972 1.00 0.00 N ATOM 1338 CZ ARG A 87 5.710 -4.772 -4.482 1.00 0.00 C ATOM 1339 NH1 ARG A 87 6.505 -4.955 -3.419 1.00 0.00 N ATOM 1340 NH2 ARG A 87 5.105 -5.821 -5.055 1.00 0.00 N ATOM 0 H ARG A 87 9.708 -1.927 -5.955 1.00 0.00 H new ATOM 0 HA ARG A 87 9.599 -0.808 -3.484 1.00 0.00 H new ATOM 0 HB2 ARG A 87 8.841 -3.702 -4.039 1.00 0.00 H new ATOM 0 HB3 ARG A 87 8.114 -2.618 -2.869 1.00 0.00 H new ATOM 0 HG2 ARG A 87 7.785 -1.147 -5.172 1.00 0.00 H new ATOM 0 HG3 ARG A 87 7.707 -2.771 -5.825 1.00 0.00 H new ATOM 0 HD2 ARG A 87 6.131 -2.363 -3.322 1.00 0.00 H new ATOM 0 HD3 ARG A 87 5.565 -1.441 -4.700 1.00 0.00 H new ATOM 0 HE ARG A 87 4.909 -3.435 -5.782 1.00 0.00 H new ATOM 0 HH11 ARG A 87 6.965 -4.156 -2.983 1.00 0.00 H new ATOM 0 HH12 ARG A 87 6.650 -5.893 -3.046 1.00 0.00 H new ATOM 0 HH21 ARG A 87 4.500 -5.681 -5.864 1.00 0.00 H new ATOM 0 HH22 ARG A 87 5.250 -6.759 -4.682 1.00 0.00 H new ATOM 1354 N ASP A 88 11.542 -3.472 -3.519 1.00 0.00 N ATOM 1355 CA ASP A 88 12.575 -4.184 -2.787 1.00 0.00 C ATOM 1356 C ASP A 88 13.672 -3.201 -2.375 1.00 0.00 C ATOM 1357 O ASP A 88 14.151 -3.238 -1.242 1.00 0.00 O ATOM 1358 CB ASP A 88 13.215 -5.271 -3.652 1.00 0.00 C ATOM 1359 CG ASP A 88 13.183 -6.678 -3.053 1.00 0.00 C ATOM 1360 OD1 ASP A 88 14.092 -6.973 -2.247 1.00 0.00 O ATOM 1361 OD2 ASP A 88 12.249 -7.428 -3.413 1.00 0.00 O ATOM 0 H ASP A 88 11.365 -3.826 -4.459 1.00 0.00 H new ATOM 0 HA ASP A 88 12.112 -4.644 -1.914 1.00 0.00 H new ATOM 0 HB2 ASP A 88 12.708 -5.292 -4.617 1.00 0.00 H new ATOM 0 HB3 ASP A 88 14.253 -4.998 -3.843 1.00 0.00 H new ATOM 1366 N ARG A 89 14.039 -2.344 -3.317 1.00 0.00 N ATOM 1367 CA ARG A 89 15.071 -1.353 -3.066 1.00 0.00 C ATOM 1368 C ARG A 89 14.525 -0.230 -2.181 1.00 0.00 C ATOM 1369 O ARG A 89 15.115 0.097 -1.153 1.00 0.00 O ATOM 1370 CB ARG A 89 15.589 -0.754 -4.375 1.00 0.00 C ATOM 1371 CG ARG A 89 17.047 -1.150 -4.620 1.00 0.00 C ATOM 1372 CD ARG A 89 17.246 -1.651 -6.051 1.00 0.00 C ATOM 1373 NE ARG A 89 18.448 -2.511 -6.124 1.00 0.00 N ATOM 1374 CZ ARG A 89 18.701 -3.366 -7.125 1.00 0.00 C ATOM 1375 NH1 ARG A 89 17.837 -3.480 -8.143 1.00 0.00 N ATOM 1376 NH2 ARG A 89 19.818 -4.106 -7.107 1.00 0.00 N ATOM 0 H ARG A 89 13.640 -2.316 -4.255 1.00 0.00 H new ATOM 0 HA ARG A 89 15.895 -1.854 -2.557 1.00 0.00 H new ATOM 0 HB2 ARG A 89 14.971 -1.096 -5.205 1.00 0.00 H new ATOM 0 HB3 ARG A 89 15.504 0.332 -4.341 1.00 0.00 H new ATOM 0 HG2 ARG A 89 17.696 -0.293 -4.437 1.00 0.00 H new ATOM 0 HG3 ARG A 89 17.340 -1.928 -3.915 1.00 0.00 H new ATOM 0 HD2 ARG A 89 16.368 -2.211 -6.374 1.00 0.00 H new ATOM 0 HD3 ARG A 89 17.352 -0.805 -6.730 1.00 0.00 H new ATOM 0 HE ARG A 89 19.127 -2.449 -5.365 1.00 0.00 H new ATOM 0 HH11 ARG A 89 16.987 -2.916 -8.156 1.00 0.00 H new ATOM 0 HH12 ARG A 89 18.029 -4.130 -8.905 1.00 0.00 H new ATOM 0 HH21 ARG A 89 20.475 -4.019 -6.332 1.00 0.00 H new ATOM 0 HH22 ARG A 89 20.011 -4.757 -7.868 1.00 0.00 H new ATOM 1390 N ILE A 90 13.404 0.328 -2.613 1.00 0.00 N ATOM 1391 CA ILE A 90 12.771 1.407 -1.873 1.00 0.00 C ATOM 1392 C ILE A 90 12.806 1.083 -0.378 1.00 0.00 C ATOM 1393 O ILE A 90 13.236 1.905 0.429 1.00 0.00 O ATOM 1394 CB ILE A 90 11.365 1.674 -2.412 1.00 0.00 C ATOM 1395 CG1 ILE A 90 11.417 2.172 -3.858 1.00 0.00 C ATOM 1396 CG2 ILE A 90 10.602 2.638 -1.501 1.00 0.00 C ATOM 1397 CD1 ILE A 90 10.026 2.152 -4.495 1.00 0.00 C ATOM 0 H ILE A 90 12.917 0.053 -3.466 1.00 0.00 H new ATOM 0 HA ILE A 90 13.321 2.338 -2.011 1.00 0.00 H new ATOM 0 HB ILE A 90 10.816 0.732 -2.415 1.00 0.00 H new ATOM 0 HG12 ILE A 90 11.818 3.185 -3.883 1.00 0.00 H new ATOM 0 HG13 ILE A 90 12.095 1.546 -4.438 1.00 0.00 H new ATOM 0 HG21 ILE A 90 9.605 2.811 -1.907 1.00 0.00 H new ATOM 0 HG22 ILE A 90 10.517 2.206 -0.504 1.00 0.00 H new ATOM 0 HG23 ILE A 90 11.139 3.585 -1.442 1.00 0.00 H new ATOM 0 HD11 ILE A 90 10.091 2.511 -5.522 1.00 0.00 H new ATOM 0 HD12 ILE A 90 9.638 1.133 -4.490 1.00 0.00 H new ATOM 0 HD13 ILE A 90 9.356 2.798 -3.927 1.00 0.00 H new ATOM 1409 N TYR A 91 12.347 -0.117 -0.055 1.00 0.00 N ATOM 1410 CA TYR A 91 12.320 -0.560 1.329 1.00 0.00 C ATOM 1411 C TYR A 91 13.727 -0.567 1.930 1.00 0.00 C ATOM 1412 O TYR A 91 13.935 -0.069 3.036 1.00 0.00 O ATOM 1413 CB TYR A 91 11.783 -1.993 1.302 1.00 0.00 C ATOM 1414 CG TYR A 91 10.317 -2.100 0.878 1.00 0.00 C ATOM 1415 CD1 TYR A 91 9.409 -1.146 1.286 1.00 0.00 C ATOM 1416 CD2 TYR A 91 9.904 -3.152 0.086 1.00 0.00 C ATOM 1417 CE1 TYR A 91 8.029 -1.247 0.886 1.00 0.00 C ATOM 1418 CE2 TYR A 91 8.524 -3.254 -0.314 1.00 0.00 C ATOM 1419 CZ TYR A 91 7.655 -2.296 0.106 1.00 0.00 C ATOM 1420 OH TYR A 91 6.352 -2.392 -0.272 1.00 0.00 O ATOM 0 H TYR A 91 11.991 -0.796 -0.727 1.00 0.00 H new ATOM 0 HA TYR A 91 11.705 0.106 1.934 1.00 0.00 H new ATOM 0 HB2 TYR A 91 12.392 -2.586 0.619 1.00 0.00 H new ATOM 0 HB3 TYR A 91 11.897 -2.432 2.293 1.00 0.00 H new ATOM 0 HD1 TYR A 91 9.733 -0.323 1.906 1.00 0.00 H new ATOM 0 HD2 TYR A 91 10.616 -3.899 -0.234 1.00 0.00 H new ATOM 0 HE1 TYR A 91 7.308 -0.506 1.199 1.00 0.00 H new ATOM 0 HE2 TYR A 91 8.187 -4.072 -0.933 1.00 0.00 H new ATOM 0 HH TYR A 91 6.145 -1.682 -0.915 1.00 0.00 H new ATOM 1430 N GLN A 92 14.656 -1.135 1.176 1.00 0.00 N ATOM 1431 CA GLN A 92 16.037 -1.213 1.621 1.00 0.00 C ATOM 1432 C GLN A 92 16.572 0.185 1.938 1.00 0.00 C ATOM 1433 O GLN A 92 17.204 0.392 2.972 1.00 0.00 O ATOM 1434 CB GLN A 92 16.911 -1.910 0.576 1.00 0.00 C ATOM 1435 CG GLN A 92 18.396 -1.741 0.903 1.00 0.00 C ATOM 1436 CD GLN A 92 18.791 -2.588 2.114 1.00 0.00 C ATOM 1437 OE1 GLN A 92 18.711 -2.161 3.255 1.00 0.00 O ATOM 1438 NE2 GLN A 92 19.221 -3.807 1.805 1.00 0.00 N ATOM 0 H GLN A 92 14.480 -1.546 0.259 1.00 0.00 H new ATOM 0 HA GLN A 92 16.072 -1.810 2.533 1.00 0.00 H new ATOM 0 HB2 GLN A 92 16.662 -2.970 0.537 1.00 0.00 H new ATOM 0 HB3 GLN A 92 16.703 -1.497 -0.411 1.00 0.00 H new ATOM 0 HG2 GLN A 92 18.997 -2.030 0.041 1.00 0.00 H new ATOM 0 HG3 GLN A 92 18.611 -0.691 1.103 1.00 0.00 H new ATOM 0 HE21 GLN A 92 19.263 -4.101 0.829 1.00 0.00 H new ATOM 0 HE22 GLN A 92 19.509 -4.449 2.544 1.00 0.00 H new ATOM 1447 N ASP A 93 16.298 1.109 1.028 1.00 0.00 N ATOM 1448 CA ASP A 93 16.744 2.482 1.198 1.00 0.00 C ATOM 1449 C ASP A 93 16.134 3.056 2.478 1.00 0.00 C ATOM 1450 O ASP A 93 16.783 3.823 3.189 1.00 0.00 O ATOM 1451 CB ASP A 93 16.294 3.356 0.026 1.00 0.00 C ATOM 1452 CG ASP A 93 17.392 4.223 -0.594 1.00 0.00 C ATOM 1453 OD1 ASP A 93 17.891 5.110 0.132 1.00 0.00 O ATOM 1454 OD2 ASP A 93 17.707 3.978 -1.778 1.00 0.00 O ATOM 0 H ASP A 93 15.773 0.934 0.171 1.00 0.00 H new ATOM 0 HA ASP A 93 17.833 2.480 1.248 1.00 0.00 H new ATOM 0 HB2 ASP A 93 15.879 2.712 -0.750 1.00 0.00 H new ATOM 0 HB3 ASP A 93 15.487 4.006 0.366 1.00 0.00 H new ATOM 1459 N GLU A 94 14.895 2.664 2.733 1.00 0.00 N ATOM 1460 CA GLU A 94 14.191 3.131 3.915 1.00 0.00 C ATOM 1461 C GLU A 94 14.989 2.795 5.176 1.00 0.00 C ATOM 1462 O GLU A 94 15.475 3.692 5.864 1.00 0.00 O ATOM 1463 CB GLU A 94 12.782 2.537 3.985 1.00 0.00 C ATOM 1464 CG GLU A 94 11.779 3.566 4.509 1.00 0.00 C ATOM 1465 CD GLU A 94 11.855 3.680 6.033 1.00 0.00 C ATOM 1466 OE1 GLU A 94 12.766 3.043 6.604 1.00 0.00 O ATOM 1467 OE2 GLU A 94 11.001 4.401 6.592 1.00 0.00 O ATOM 0 H GLU A 94 14.360 2.028 2.141 1.00 0.00 H new ATOM 0 HA GLU A 94 14.091 4.214 3.849 1.00 0.00 H new ATOM 0 HB2 GLU A 94 12.477 2.198 2.995 1.00 0.00 H new ATOM 0 HB3 GLU A 94 12.784 1.662 4.635 1.00 0.00 H new ATOM 0 HG2 GLU A 94 11.980 4.538 4.058 1.00 0.00 H new ATOM 0 HG3 GLU A 94 10.770 3.279 4.212 1.00 0.00 H new ATOM 1474 N ARG A 95 15.101 1.502 5.441 1.00 0.00 N ATOM 1475 CA ARG A 95 15.832 1.037 6.607 1.00 0.00 C ATOM 1476 C ARG A 95 17.318 1.374 6.471 1.00 0.00 C ATOM 1477 O ARG A 95 17.909 1.968 7.372 1.00 0.00 O ATOM 1478 CB ARG A 95 15.674 -0.474 6.790 1.00 0.00 C ATOM 1479 CG ARG A 95 14.235 -0.833 7.167 1.00 0.00 C ATOM 1480 CD ARG A 95 13.712 -1.981 6.301 1.00 0.00 C ATOM 1481 NE ARG A 95 12.623 -2.692 7.007 1.00 0.00 N ATOM 1482 CZ ARG A 95 12.801 -3.436 8.107 1.00 0.00 C ATOM 1483 NH1 ARG A 95 14.026 -3.570 8.634 1.00 0.00 N ATOM 1484 NH2 ARG A 95 11.754 -4.044 8.681 1.00 0.00 N ATOM 0 H ARG A 95 14.697 0.761 4.868 1.00 0.00 H new ATOM 0 HA ARG A 95 15.419 1.543 7.480 1.00 0.00 H new ATOM 0 HB2 ARG A 95 15.951 -0.986 5.869 1.00 0.00 H new ATOM 0 HB3 ARG A 95 16.355 -0.823 7.566 1.00 0.00 H new ATOM 0 HG2 ARG A 95 14.191 -1.116 8.219 1.00 0.00 H new ATOM 0 HG3 ARG A 95 13.594 0.040 7.045 1.00 0.00 H new ATOM 0 HD2 ARG A 95 13.347 -1.593 5.350 1.00 0.00 H new ATOM 0 HD3 ARG A 95 14.522 -2.674 6.073 1.00 0.00 H new ATOM 0 HE ARG A 95 11.678 -2.611 6.633 1.00 0.00 H new ATOM 0 HH11 ARG A 95 14.822 -3.106 8.198 1.00 0.00 H new ATOM 0 HH12 ARG A 95 14.162 -4.136 9.471 1.00 0.00 H new ATOM 0 HH21 ARG A 95 10.822 -3.940 8.281 1.00 0.00 H new ATOM 0 HH22 ARG A 95 11.889 -4.610 9.518 1.00 0.00 H new ATOM 1498 N SER A 96 17.880 0.981 5.337 1.00 0.00 N ATOM 1499 CA SER A 96 19.286 1.234 5.071 1.00 0.00 C ATOM 1500 C SER A 96 20.151 0.541 6.125 1.00 0.00 C ATOM 1501 O SER A 96 19.753 0.426 7.283 1.00 0.00 O ATOM 1502 CB SER A 96 19.580 2.736 5.047 1.00 0.00 C ATOM 1503 OG SER A 96 20.305 3.119 3.881 1.00 0.00 O ATOM 0 H SER A 96 17.387 0.489 4.592 1.00 0.00 H new ATOM 0 HA SER A 96 19.527 0.828 4.089 1.00 0.00 H new ATOM 0 HB2 SER A 96 18.642 3.290 5.089 1.00 0.00 H new ATOM 0 HB3 SER A 96 20.151 3.008 5.935 1.00 0.00 H new ATOM 0 HG SER A 96 20.472 4.085 3.902 1.00 0.00 H new ATOM 1509 N GLY A 97 21.319 0.096 5.686 1.00 0.00 N ATOM 1510 CA GLY A 97 22.244 -0.583 6.577 1.00 0.00 C ATOM 1511 C GLY A 97 22.355 -2.068 6.225 1.00 0.00 C ATOM 1512 O GLY A 97 21.772 -2.521 5.241 1.00 0.00 O ATOM 0 H GLY A 97 21.646 0.192 4.725 1.00 0.00 H new ATOM 0 HA2 GLY A 97 23.227 -0.116 6.512 1.00 0.00 H new ATOM 0 HA3 GLY A 97 21.907 -0.474 7.608 1.00 0.00 H new ATOM 1516 N PRO A 98 23.127 -2.803 7.069 1.00 0.00 N ATOM 1517 CA PRO A 98 23.321 -4.228 6.857 1.00 0.00 C ATOM 1518 C PRO A 98 22.072 -5.017 7.255 1.00 0.00 C ATOM 1519 O PRO A 98 21.593 -5.854 6.492 1.00 0.00 O ATOM 1520 CB PRO A 98 24.541 -4.587 7.689 1.00 0.00 C ATOM 1521 CG PRO A 98 24.705 -3.460 8.696 1.00 0.00 C ATOM 1522 CD PRO A 98 23.832 -2.300 8.244 1.00 0.00 C ATOM 0 HA PRO A 98 23.483 -4.479 5.809 1.00 0.00 H new ATOM 0 HB2 PRO A 98 24.403 -5.544 8.193 1.00 0.00 H new ATOM 0 HB3 PRO A 98 25.427 -4.682 7.062 1.00 0.00 H new ATOM 0 HG2 PRO A 98 24.412 -3.792 9.692 1.00 0.00 H new ATOM 0 HG3 PRO A 98 25.749 -3.151 8.757 1.00 0.00 H new ATOM 0 HD2 PRO A 98 23.135 -2.001 9.026 1.00 0.00 H new ATOM 0 HD3 PRO A 98 24.433 -1.424 8.000 1.00 0.00 H new ATOM 1530 N SER A 99 21.581 -4.722 8.450 1.00 0.00 N ATOM 1531 CA SER A 99 20.397 -5.393 8.959 1.00 0.00 C ATOM 1532 C SER A 99 19.257 -5.285 7.944 1.00 0.00 C ATOM 1533 O SER A 99 18.975 -4.201 7.435 1.00 0.00 O ATOM 1534 CB SER A 99 19.967 -4.806 10.305 1.00 0.00 C ATOM 1535 OG SER A 99 20.519 -5.528 11.403 1.00 0.00 O ATOM 0 H SER A 99 21.982 -4.027 9.080 1.00 0.00 H new ATOM 0 HA SER A 99 20.639 -6.445 9.113 1.00 0.00 H new ATOM 0 HB2 SER A 99 20.280 -3.763 10.362 1.00 0.00 H new ATOM 0 HB3 SER A 99 18.879 -4.817 10.374 1.00 0.00 H new ATOM 0 HG SER A 99 20.223 -5.121 12.244 1.00 0.00 H new ATOM 1541 N SER A 100 18.632 -6.423 7.681 1.00 0.00 N ATOM 1542 CA SER A 100 17.529 -6.470 6.736 1.00 0.00 C ATOM 1543 C SER A 100 16.888 -7.859 6.749 1.00 0.00 C ATOM 1544 O SER A 100 15.695 -7.993 7.016 1.00 0.00 O ATOM 1545 CB SER A 100 17.998 -6.115 5.324 1.00 0.00 C ATOM 1546 OG SER A 100 17.129 -5.178 4.692 1.00 0.00 O ATOM 0 H SER A 100 18.868 -7.320 8.106 1.00 0.00 H new ATOM 0 HA SER A 100 16.787 -5.731 7.039 1.00 0.00 H new ATOM 0 HB2 SER A 100 19.005 -5.701 5.370 1.00 0.00 H new ATOM 0 HB3 SER A 100 18.053 -7.022 4.722 1.00 0.00 H new ATOM 0 HG SER A 100 17.464 -4.976 3.793 1.00 0.00 H new ATOM 1552 N GLY A 101 17.708 -8.857 6.456 1.00 0.00 N ATOM 1553 CA GLY A 101 17.236 -10.231 6.431 1.00 0.00 C ATOM 1554 C GLY A 101 16.782 -10.629 5.025 1.00 0.00 C ATOM 1555 O GLY A 101 17.167 -11.681 4.519 1.00 0.00 O ATOM 0 H GLY A 101 18.697 -8.742 6.234 1.00 0.00 H new ATOM 0 HA2 GLY A 101 18.031 -10.899 6.763 1.00 0.00 H new ATOM 0 HA3 GLY A 101 16.409 -10.348 7.131 1.00 0.00 H new TER 1559 GLY A 101