USER MOD reduce.3.24.130724 H: found=0, std=0, add=788, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 786 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 Single : A 1 GLY N :NH3+ 144:sc= 0.0364 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc=-0.00717 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0.0196 USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 17 THR OG1 : rot 180:sc= -0.181 USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot 32:sc= 0.844 USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 23 SER OG : rot 11:sc= 0.445 USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 35 SER OG : rot 18:sc= 0.587 USER MOD Single : A 41 TYR OH : rot 180:sc= -0.0207 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 TYR OH : rot 180:sc= 0 USER MOD Single : A 46 HIS : no HE2:sc= -0.0486 K(o=-0.049,f=-0.75) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 55 SER OG : rot 92:sc= -2.78! USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 THR OG1 : rot -107:sc= 0.812 USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 64 ASN : amide:sc= -1.03! C(o=-1!,f=-3.2!) USER MOD Single : A 72 LYS NZ :NH3+ -160:sc= -0.045 (180deg=-0.307) USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 77 TYR OH : rot 180:sc= 0 USER MOD Single : A 80 GLN : amide:sc= -0.125 X(o=-0.12,f=0) USER MOD Single : A 85 SER OG : rot 180:sc= -0.169 USER MOD Single : A 89 TYR OH : rot -52:sc= 0.429 USER MOD Single : A 94 GLN : amide:sc= 0 X(o=0,f=-0.041) USER MOD Single : A 96 HIS : no HD1:sc= -3.99! C(o=-4!,f=-3.9!) USER MOD Single : A 97 HIS : no HE2:sc= 0.202 K(o=0.2,f=-1.2) USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 99 GLN : amide:sc=-0.00282 K(o=-0.0028,f=-1.2) USER MOD Single : A 100 THR OG1 : rot -150:sc= -0.455 USER MOD Single : A 101 GLN : amide:sc= -2.82! C(o=-2.8!,f=-2.8!) USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 17.919 22.742 9.239 1.00 0.00 N ATOM 2 CA GLY A 1 17.551 21.783 8.214 1.00 0.00 C ATOM 3 C GLY A 1 18.186 20.424 8.436 1.00 0.00 C ATOM 4 O GLY A 1 19.272 20.325 9.006 1.00 0.00 O ATOM 0 H1 GLY A 1 18.019 23.685 8.812 1.00 0.00 H new ATOM 0 H2 GLY A 1 17.180 22.770 9.970 1.00 0.00 H new ATOM 0 H3 GLY A 1 18.822 22.459 9.671 1.00 0.00 H new ATOM 0 HA2 GLY A 1 16.467 21.675 8.194 1.00 0.00 H new ATOM 0 HA3 GLY A 1 17.851 22.166 7.238 1.00 0.00 H new ATOM 8 N SER A 2 17.506 19.374 7.986 1.00 0.00 N ATOM 9 CA SER A 2 18.008 18.014 8.144 1.00 0.00 C ATOM 10 C SER A 2 17.842 17.221 6.851 1.00 0.00 C ATOM 11 O SER A 2 16.909 17.453 6.083 1.00 0.00 O ATOM 12 CB SER A 2 17.278 17.308 9.287 1.00 0.00 C ATOM 13 OG SER A 2 15.874 17.353 9.101 1.00 0.00 O ATOM 0 H SER A 2 16.607 19.439 7.509 1.00 0.00 H new ATOM 0 HA SER A 2 19.070 18.070 8.382 1.00 0.00 H new ATOM 0 HB2 SER A 2 17.607 16.271 9.347 1.00 0.00 H new ATOM 0 HB3 SER A 2 17.538 17.780 10.235 1.00 0.00 H new ATOM 0 HG SER A 2 15.431 16.893 9.844 1.00 0.00 H new ATOM 19 N SER A 3 18.754 16.282 6.619 1.00 0.00 N ATOM 20 CA SER A 3 18.712 15.456 5.418 1.00 0.00 C ATOM 21 C SER A 3 17.685 14.337 5.565 1.00 0.00 C ATOM 22 O SER A 3 16.907 14.070 4.650 1.00 0.00 O ATOM 23 CB SER A 3 20.093 14.862 5.133 1.00 0.00 C ATOM 24 OG SER A 3 20.544 14.075 6.222 1.00 0.00 O ATOM 0 H SER A 3 19.531 16.074 7.247 1.00 0.00 H new ATOM 0 HA SER A 3 18.417 16.089 4.581 1.00 0.00 H new ATOM 0 HB2 SER A 3 20.051 14.251 4.231 1.00 0.00 H new ATOM 0 HB3 SER A 3 20.805 15.665 4.941 1.00 0.00 H new ATOM 0 HG SER A 3 21.428 13.705 6.015 1.00 0.00 H new ATOM 30 N GLY A 4 17.690 13.686 6.724 1.00 0.00 N ATOM 31 CA GLY A 4 16.756 12.603 6.971 1.00 0.00 C ATOM 32 C GLY A 4 17.022 11.895 8.284 1.00 0.00 C ATOM 33 O GLY A 4 18.124 11.397 8.516 1.00 0.00 O ATOM 0 H GLY A 4 18.324 13.889 7.497 1.00 0.00 H new ATOM 0 HA2 GLY A 4 15.740 12.998 6.974 1.00 0.00 H new ATOM 0 HA3 GLY A 4 16.816 11.883 6.155 1.00 0.00 H new ATOM 37 N SER A 5 16.012 11.851 9.147 1.00 0.00 N ATOM 38 CA SER A 5 16.145 11.203 10.447 1.00 0.00 C ATOM 39 C SER A 5 15.006 10.215 10.680 1.00 0.00 C ATOM 40 O SER A 5 15.236 9.055 11.019 1.00 0.00 O ATOM 41 CB SER A 5 16.163 12.250 11.562 1.00 0.00 C ATOM 42 OG SER A 5 17.441 12.852 11.675 1.00 0.00 O ATOM 0 H SER A 5 15.093 12.256 8.970 1.00 0.00 H new ATOM 0 HA SER A 5 17.087 10.654 10.458 1.00 0.00 H new ATOM 0 HB2 SER A 5 15.414 13.015 11.359 1.00 0.00 H new ATOM 0 HB3 SER A 5 15.893 11.782 12.509 1.00 0.00 H new ATOM 0 HG SER A 5 17.426 13.519 12.393 1.00 0.00 H new ATOM 48 N SER A 6 13.776 10.685 10.495 1.00 0.00 N ATOM 49 CA SER A 6 12.600 9.845 10.688 1.00 0.00 C ATOM 50 C SER A 6 12.774 8.498 9.992 1.00 0.00 C ATOM 51 O SER A 6 12.460 7.451 10.556 1.00 0.00 O ATOM 52 CB SER A 6 11.351 10.550 10.156 1.00 0.00 C ATOM 53 OG SER A 6 11.670 11.399 9.068 1.00 0.00 O ATOM 0 H SER A 6 13.568 11.643 10.212 1.00 0.00 H new ATOM 0 HA SER A 6 12.481 9.669 11.757 1.00 0.00 H new ATOM 0 HB2 SER A 6 10.618 9.808 9.840 1.00 0.00 H new ATOM 0 HB3 SER A 6 10.891 11.133 10.954 1.00 0.00 H new ATOM 0 HG SER A 6 10.855 11.837 8.745 1.00 0.00 H new ATOM 59 N GLY A 7 13.277 8.535 8.762 1.00 0.00 N ATOM 60 CA GLY A 7 13.484 7.313 8.008 1.00 0.00 C ATOM 61 C GLY A 7 13.781 7.577 6.546 1.00 0.00 C ATOM 62 O GLY A 7 14.245 8.653 6.169 1.00 0.00 O ATOM 0 H GLY A 7 13.545 9.390 8.274 1.00 0.00 H new ATOM 0 HA2 GLY A 7 14.310 6.754 8.448 1.00 0.00 H new ATOM 0 HA3 GLY A 7 12.596 6.686 8.088 1.00 0.00 H new ATOM 66 N PRO A 8 13.513 6.576 5.693 1.00 0.00 N ATOM 67 CA PRO A 8 13.748 6.681 4.250 1.00 0.00 C ATOM 68 C PRO A 8 12.781 7.647 3.574 1.00 0.00 C ATOM 69 O PRO A 8 11.805 8.104 4.169 1.00 0.00 O ATOM 70 CB PRO A 8 13.517 5.254 3.748 1.00 0.00 C ATOM 71 CG PRO A 8 12.600 4.643 4.752 1.00 0.00 C ATOM 72 CD PRO A 8 12.959 5.266 6.073 1.00 0.00 C ATOM 0 HA PRO A 8 14.741 7.070 4.026 1.00 0.00 H new ATOM 0 HB2 PRO A 8 13.073 5.252 2.753 1.00 0.00 H new ATOM 0 HB3 PRO A 8 14.454 4.702 3.680 1.00 0.00 H new ATOM 0 HG2 PRO A 8 11.558 4.838 4.499 1.00 0.00 H new ATOM 0 HG3 PRO A 8 12.723 3.560 4.785 1.00 0.00 H new ATOM 0 HD2 PRO A 8 12.087 5.370 6.718 1.00 0.00 H new ATOM 0 HD3 PRO A 8 13.687 4.664 6.616 1.00 0.00 H new ATOM 80 N PRO A 9 13.056 7.967 2.301 1.00 0.00 N ATOM 81 CA PRO A 9 12.221 8.881 1.516 1.00 0.00 C ATOM 82 C PRO A 9 10.863 8.277 1.174 1.00 0.00 C ATOM 83 O PRO A 9 10.758 7.085 0.888 1.00 0.00 O ATOM 84 CB PRO A 9 13.041 9.107 0.244 1.00 0.00 C ATOM 85 CG PRO A 9 13.894 7.892 0.122 1.00 0.00 C ATOM 86 CD PRO A 9 14.203 7.460 1.529 1.00 0.00 C ATOM 0 HA PRO A 9 11.995 9.797 2.062 1.00 0.00 H new ATOM 0 HB2 PRO A 9 12.396 9.227 -0.627 1.00 0.00 H new ATOM 0 HB3 PRO A 9 13.647 10.010 0.319 1.00 0.00 H new ATOM 0 HG2 PRO A 9 13.375 7.104 -0.423 1.00 0.00 H new ATOM 0 HG3 PRO A 9 14.809 8.111 -0.429 1.00 0.00 H new ATOM 0 HD2 PRO A 9 14.292 6.376 1.606 1.00 0.00 H new ATOM 0 HD3 PRO A 9 15.144 7.883 1.882 1.00 0.00 H new ATOM 94 N ALA A 10 9.826 9.108 1.206 1.00 0.00 N ATOM 95 CA ALA A 10 8.475 8.655 0.897 1.00 0.00 C ATOM 96 C ALA A 10 8.455 7.819 -0.378 1.00 0.00 C ATOM 97 O ALA A 10 8.972 8.236 -1.415 1.00 0.00 O ATOM 98 CB ALA A 10 7.537 9.846 0.765 1.00 0.00 C ATOM 0 H ALA A 10 9.896 10.098 1.443 1.00 0.00 H new ATOM 0 HA ALA A 10 8.132 8.026 1.718 1.00 0.00 H new ATOM 0 HB1 ALA A 10 6.532 9.494 0.534 1.00 0.00 H new ATOM 0 HB2 ALA A 10 7.520 10.402 1.703 1.00 0.00 H new ATOM 0 HB3 ALA A 10 7.886 10.497 -0.036 1.00 0.00 H new ATOM 104 N VAL A 11 7.854 6.636 -0.295 1.00 0.00 N ATOM 105 CA VAL A 11 7.766 5.741 -1.443 1.00 0.00 C ATOM 106 C VAL A 11 7.153 6.449 -2.646 1.00 0.00 C ATOM 107 O VAL A 11 6.000 6.876 -2.607 1.00 0.00 O ATOM 108 CB VAL A 11 6.929 4.490 -1.116 1.00 0.00 C ATOM 109 CG1 VAL A 11 6.859 3.564 -2.321 1.00 0.00 C ATOM 110 CG2 VAL A 11 7.505 3.765 0.091 1.00 0.00 C ATOM 0 H VAL A 11 7.421 6.275 0.555 1.00 0.00 H new ATOM 0 HA VAL A 11 8.784 5.435 -1.685 1.00 0.00 H new ATOM 0 HB VAL A 11 5.915 4.806 -0.872 1.00 0.00 H new ATOM 0 HG11 VAL A 11 6.264 2.686 -2.071 1.00 0.00 H new ATOM 0 HG12 VAL A 11 6.397 4.089 -3.157 1.00 0.00 H new ATOM 0 HG13 VAL A 11 7.866 3.253 -2.599 1.00 0.00 H new ATOM 0 HG21 VAL A 11 6.902 2.884 0.308 1.00 0.00 H new ATOM 0 HG22 VAL A 11 8.529 3.460 -0.123 1.00 0.00 H new ATOM 0 HG23 VAL A 11 7.497 4.431 0.954 1.00 0.00 H new ATOM 120 N SER A 12 7.933 6.570 -3.715 1.00 0.00 N ATOM 121 CA SER A 12 7.469 7.229 -4.930 1.00 0.00 C ATOM 122 C SER A 12 7.336 6.229 -6.075 1.00 0.00 C ATOM 123 O SER A 12 7.645 5.047 -5.920 1.00 0.00 O ATOM 124 CB SER A 12 8.431 8.350 -5.327 1.00 0.00 C ATOM 125 OG SER A 12 9.735 7.846 -5.559 1.00 0.00 O ATOM 0 H SER A 12 8.890 6.220 -3.764 1.00 0.00 H new ATOM 0 HA SER A 12 6.487 7.657 -4.728 1.00 0.00 H new ATOM 0 HB2 SER A 12 8.065 8.846 -6.226 1.00 0.00 H new ATOM 0 HB3 SER A 12 8.463 9.102 -4.538 1.00 0.00 H new ATOM 0 HG SER A 12 10.330 8.582 -5.813 1.00 0.00 H new ATOM 131 N ASP A 13 6.876 6.711 -7.223 1.00 0.00 N ATOM 132 CA ASP A 13 6.703 5.861 -8.395 1.00 0.00 C ATOM 133 C ASP A 13 6.010 4.555 -8.021 1.00 0.00 C ATOM 134 O ASP A 13 6.510 3.469 -8.318 1.00 0.00 O ATOM 135 CB ASP A 13 8.056 5.568 -9.043 1.00 0.00 C ATOM 136 CG ASP A 13 8.449 6.618 -10.064 1.00 0.00 C ATOM 137 OD1 ASP A 13 8.813 7.739 -9.651 1.00 0.00 O ATOM 138 OD2 ASP A 13 8.393 6.319 -11.275 1.00 0.00 O ATOM 0 H ASP A 13 6.616 7.687 -7.368 1.00 0.00 H new ATOM 0 HA ASP A 13 6.075 6.393 -9.110 1.00 0.00 H new ATOM 0 HB2 ASP A 13 8.822 5.513 -8.269 1.00 0.00 H new ATOM 0 HB3 ASP A 13 8.020 4.591 -9.526 1.00 0.00 H new ATOM 143 N ILE A 14 4.858 4.667 -7.368 1.00 0.00 N ATOM 144 CA ILE A 14 4.098 3.495 -6.954 1.00 0.00 C ATOM 145 C ILE A 14 3.036 3.135 -7.988 1.00 0.00 C ATOM 146 O ILE A 14 2.033 3.834 -8.131 1.00 0.00 O ATOM 147 CB ILE A 14 3.416 3.718 -5.591 1.00 0.00 C ATOM 148 CG1 ILE A 14 4.434 4.216 -4.563 1.00 0.00 C ATOM 149 CG2 ILE A 14 2.756 2.434 -5.112 1.00 0.00 C ATOM 150 CD1 ILE A 14 3.802 4.754 -3.298 1.00 0.00 C ATOM 0 H ILE A 14 4.431 5.558 -7.114 1.00 0.00 H new ATOM 0 HA ILE A 14 4.809 2.674 -6.865 1.00 0.00 H new ATOM 0 HB ILE A 14 2.644 4.478 -5.708 1.00 0.00 H new ATOM 0 HG12 ILE A 14 5.106 3.398 -4.304 1.00 0.00 H new ATOM 0 HG13 ILE A 14 5.043 4.998 -5.016 1.00 0.00 H new ATOM 0 HG21 ILE A 14 2.279 2.608 -4.148 1.00 0.00 H new ATOM 0 HG22 ILE A 14 2.006 2.118 -5.837 1.00 0.00 H new ATOM 0 HG23 ILE A 14 3.510 1.654 -5.008 1.00 0.00 H new ATOM 0 HD11 ILE A 14 4.583 5.089 -2.615 1.00 0.00 H new ATOM 0 HD12 ILE A 14 3.151 5.593 -3.545 1.00 0.00 H new ATOM 0 HD13 ILE A 14 3.216 3.968 -2.821 1.00 0.00 H new ATOM 162 N ARG A 15 3.263 2.039 -8.704 1.00 0.00 N ATOM 163 CA ARG A 15 2.326 1.585 -9.725 1.00 0.00 C ATOM 164 C ARG A 15 1.598 0.323 -9.271 1.00 0.00 C ATOM 165 O ARG A 15 2.141 -0.482 -8.515 1.00 0.00 O ATOM 166 CB ARG A 15 3.060 1.319 -11.040 1.00 0.00 C ATOM 167 CG ARG A 15 3.307 2.571 -11.865 1.00 0.00 C ATOM 168 CD ARG A 15 3.818 2.230 -13.256 1.00 0.00 C ATOM 169 NE ARG A 15 2.882 1.386 -13.991 1.00 0.00 N ATOM 170 CZ ARG A 15 3.186 0.767 -15.127 1.00 0.00 C ATOM 171 NH1 ARG A 15 4.396 0.897 -15.653 1.00 0.00 N ATOM 172 NH2 ARG A 15 2.279 0.015 -15.737 1.00 0.00 N ATOM 0 H ARG A 15 4.088 1.449 -8.596 1.00 0.00 H new ATOM 0 HA ARG A 15 1.589 2.372 -9.882 1.00 0.00 H new ATOM 0 HB2 ARG A 15 4.016 0.843 -10.822 1.00 0.00 H new ATOM 0 HB3 ARG A 15 2.480 0.612 -11.633 1.00 0.00 H new ATOM 0 HG2 ARG A 15 2.383 3.143 -11.946 1.00 0.00 H new ATOM 0 HG3 ARG A 15 4.031 3.207 -11.356 1.00 0.00 H new ATOM 0 HD2 ARG A 15 3.991 3.150 -13.814 1.00 0.00 H new ATOM 0 HD3 ARG A 15 4.778 1.721 -13.175 1.00 0.00 H new ATOM 0 HE ARG A 15 1.943 1.264 -13.612 1.00 0.00 H new ATOM 0 HH11 ARG A 15 5.096 1.473 -15.186 1.00 0.00 H new ATOM 0 HH12 ARG A 15 4.627 0.421 -16.525 1.00 0.00 H new ATOM 0 HH21 ARG A 15 1.348 -0.088 -15.334 1.00 0.00 H new ATOM 0 HH22 ARG A 15 2.513 -0.460 -16.609 1.00 0.00 H new ATOM 186 N VAL A 16 0.364 0.158 -9.739 1.00 0.00 N ATOM 187 CA VAL A 16 -0.439 -1.006 -9.382 1.00 0.00 C ATOM 188 C VAL A 16 -0.689 -1.893 -10.596 1.00 0.00 C ATOM 189 O VAL A 16 -1.578 -1.624 -11.404 1.00 0.00 O ATOM 190 CB VAL A 16 -1.792 -0.589 -8.776 1.00 0.00 C ATOM 191 CG1 VAL A 16 -2.619 -1.816 -8.421 1.00 0.00 C ATOM 192 CG2 VAL A 16 -1.580 0.293 -7.555 1.00 0.00 C ATOM 0 H VAL A 16 -0.101 0.815 -10.366 1.00 0.00 H new ATOM 0 HA VAL A 16 0.127 -1.566 -8.637 1.00 0.00 H new ATOM 0 HB VAL A 16 -2.342 -0.013 -9.520 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -3.571 -1.502 -7.994 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -2.801 -2.405 -9.320 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -2.078 -2.422 -7.694 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -2.547 0.578 -7.140 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -1.010 -0.255 -6.805 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -1.031 1.189 -7.844 1.00 0.00 H new ATOM 202 N THR A 17 0.101 -2.955 -10.719 1.00 0.00 N ATOM 203 CA THR A 17 -0.033 -3.884 -11.834 1.00 0.00 C ATOM 204 C THR A 17 -0.734 -5.166 -11.401 1.00 0.00 C ATOM 205 O THR A 17 -0.901 -5.421 -10.208 1.00 0.00 O ATOM 206 CB THR A 17 1.339 -4.240 -12.437 1.00 0.00 C ATOM 207 OG1 THR A 17 1.163 -5.004 -13.636 1.00 0.00 O ATOM 208 CG2 THR A 17 2.177 -5.031 -11.444 1.00 0.00 C ATOM 0 H THR A 17 0.841 -3.193 -10.059 1.00 0.00 H new ATOM 0 HA THR A 17 -0.635 -3.383 -12.592 1.00 0.00 H new ATOM 0 HB THR A 17 1.861 -3.312 -12.671 1.00 0.00 H new ATOM 0 HG1 THR A 17 2.039 -5.225 -14.015 1.00 0.00 H new ATOM 0 HG21 THR A 17 3.141 -5.271 -11.892 1.00 0.00 H new ATOM 0 HG22 THR A 17 2.333 -4.436 -10.544 1.00 0.00 H new ATOM 0 HG23 THR A 17 1.658 -5.954 -11.184 1.00 0.00 H new ATOM 216 N ARG A 18 -1.142 -5.971 -12.377 1.00 0.00 N ATOM 217 CA ARG A 18 -1.826 -7.227 -12.095 1.00 0.00 C ATOM 218 C ARG A 18 -3.090 -6.987 -11.275 1.00 0.00 C ATOM 219 O ARG A 18 -3.296 -7.613 -10.236 1.00 0.00 O ATOM 220 CB ARG A 18 -0.894 -8.183 -11.347 1.00 0.00 C ATOM 221 CG ARG A 18 -1.259 -9.648 -11.519 1.00 0.00 C ATOM 222 CD ARG A 18 -0.630 -10.236 -12.772 1.00 0.00 C ATOM 223 NE ARG A 18 -1.088 -11.599 -13.027 1.00 0.00 N ATOM 224 CZ ARG A 18 -0.839 -12.260 -14.152 1.00 0.00 C ATOM 225 NH1 ARG A 18 -0.139 -11.687 -15.120 1.00 0.00 N ATOM 226 NH2 ARG A 18 -1.290 -13.499 -14.309 1.00 0.00 N ATOM 0 H ARG A 18 -1.011 -5.776 -13.369 1.00 0.00 H new ATOM 0 HA ARG A 18 -2.111 -7.677 -13.046 1.00 0.00 H new ATOM 0 HB2 ARG A 18 0.127 -8.028 -11.696 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -0.909 -7.936 -10.286 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -0.929 -10.211 -10.646 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -2.343 -9.750 -11.573 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -0.871 -9.606 -13.628 1.00 0.00 H new ATOM 0 HD3 ARG A 18 0.455 -10.232 -12.669 1.00 0.00 H new ATOM 0 HE ARG A 18 -1.629 -12.069 -12.301 1.00 0.00 H new ATOM 0 HH11 ARG A 18 0.210 -10.736 -15.002 1.00 0.00 H new ATOM 0 HH12 ARG A 18 0.051 -12.197 -15.983 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -1.828 -13.944 -13.565 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -1.098 -14.006 -15.173 1.00 0.00 H new ATOM 240 N SER A 19 -3.933 -6.076 -11.751 1.00 0.00 N ATOM 241 CA SER A 19 -5.175 -5.749 -11.060 1.00 0.00 C ATOM 242 C SER A 19 -6.130 -6.938 -11.069 1.00 0.00 C ATOM 243 O SER A 19 -5.994 -7.852 -11.882 1.00 0.00 O ATOM 244 CB SER A 19 -5.843 -4.538 -11.713 1.00 0.00 C ATOM 245 OG SER A 19 -6.155 -4.798 -13.071 1.00 0.00 O ATOM 0 H SER A 19 -3.779 -5.551 -12.612 1.00 0.00 H new ATOM 0 HA SER A 19 -4.934 -5.507 -10.025 1.00 0.00 H new ATOM 0 HB2 SER A 19 -6.753 -4.284 -11.170 1.00 0.00 H new ATOM 0 HB3 SER A 19 -5.181 -3.674 -11.648 1.00 0.00 H new ATOM 0 HG SER A 19 -6.583 -4.009 -13.465 1.00 0.00 H new ATOM 251 N SER A 20 -7.098 -6.919 -10.158 1.00 0.00 N ATOM 252 CA SER A 20 -8.075 -7.996 -10.057 1.00 0.00 C ATOM 253 C SER A 20 -9.314 -7.537 -9.295 1.00 0.00 C ATOM 254 O SER A 20 -9.278 -6.583 -8.518 1.00 0.00 O ATOM 255 CB SER A 20 -7.456 -9.211 -9.361 1.00 0.00 C ATOM 256 OG SER A 20 -6.754 -10.025 -10.285 1.00 0.00 O ATOM 0 H SER A 20 -7.226 -6.169 -9.479 1.00 0.00 H new ATOM 0 HA SER A 20 -8.374 -8.277 -11.067 1.00 0.00 H new ATOM 0 HB2 SER A 20 -6.777 -8.878 -8.576 1.00 0.00 H new ATOM 0 HB3 SER A 20 -8.239 -9.796 -8.878 1.00 0.00 H new ATOM 0 HG SER A 20 -6.370 -9.463 -10.990 1.00 0.00 H new ATOM 262 N PRO A 21 -10.439 -8.231 -9.523 1.00 0.00 N ATOM 263 CA PRO A 21 -11.712 -7.914 -8.868 1.00 0.00 C ATOM 264 C PRO A 21 -11.695 -8.241 -7.379 1.00 0.00 C ATOM 265 O PRO A 21 -12.249 -7.502 -6.565 1.00 0.00 O ATOM 266 CB PRO A 21 -12.719 -8.804 -9.600 1.00 0.00 C ATOM 267 CG PRO A 21 -11.911 -9.945 -10.116 1.00 0.00 C ATOM 268 CD PRO A 21 -10.555 -9.380 -10.437 1.00 0.00 C ATOM 0 HA PRO A 21 -11.945 -6.850 -8.922 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -13.505 -9.148 -8.928 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -13.207 -8.265 -10.412 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -11.837 -10.739 -9.373 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -12.372 -10.381 -11.002 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -9.764 -10.111 -10.266 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -10.485 -9.072 -11.480 1.00 0.00 H new ATOM 276 N SER A 22 -11.056 -9.353 -7.029 1.00 0.00 N ATOM 277 CA SER A 22 -10.970 -9.779 -5.638 1.00 0.00 C ATOM 278 C SER A 22 -9.521 -9.783 -5.159 1.00 0.00 C ATOM 279 O SER A 22 -9.142 -10.580 -4.301 1.00 0.00 O ATOM 280 CB SER A 22 -11.578 -11.173 -5.471 1.00 0.00 C ATOM 281 OG SER A 22 -12.901 -11.216 -5.976 1.00 0.00 O ATOM 0 H SER A 22 -10.590 -9.975 -7.690 1.00 0.00 H new ATOM 0 HA SER A 22 -11.533 -9.070 -5.031 1.00 0.00 H new ATOM 0 HB2 SER A 22 -10.963 -11.906 -5.992 1.00 0.00 H new ATOM 0 HB3 SER A 22 -11.579 -11.449 -4.417 1.00 0.00 H new ATOM 0 HG SER A 22 -13.267 -12.118 -5.859 1.00 0.00 H new ATOM 287 N SER A 23 -8.716 -8.888 -5.721 1.00 0.00 N ATOM 288 CA SER A 23 -7.308 -8.790 -5.356 1.00 0.00 C ATOM 289 C SER A 23 -6.666 -7.560 -5.991 1.00 0.00 C ATOM 290 O SER A 23 -7.099 -7.094 -7.046 1.00 0.00 O ATOM 291 CB SER A 23 -6.558 -10.051 -5.788 1.00 0.00 C ATOM 292 OG SER A 23 -6.820 -11.128 -4.906 1.00 0.00 O ATOM 0 H SER A 23 -9.015 -8.220 -6.431 1.00 0.00 H new ATOM 0 HA SER A 23 -7.246 -8.692 -4.272 1.00 0.00 H new ATOM 0 HB2 SER A 23 -6.855 -10.326 -6.800 1.00 0.00 H new ATOM 0 HB3 SER A 23 -5.487 -9.850 -5.813 1.00 0.00 H new ATOM 0 HG SER A 23 -7.558 -10.889 -4.308 1.00 0.00 H new ATOM 298 N LEU A 24 -5.632 -7.038 -5.341 1.00 0.00 N ATOM 299 CA LEU A 24 -4.929 -5.862 -5.841 1.00 0.00 C ATOM 300 C LEU A 24 -3.447 -5.919 -5.481 1.00 0.00 C ATOM 301 O LEU A 24 -3.082 -5.877 -4.307 1.00 0.00 O ATOM 302 CB LEU A 24 -5.555 -4.588 -5.271 1.00 0.00 C ATOM 303 CG LEU A 24 -6.862 -4.133 -5.922 1.00 0.00 C ATOM 304 CD1 LEU A 24 -7.710 -3.355 -4.928 1.00 0.00 C ATOM 305 CD2 LEU A 24 -6.578 -3.293 -7.158 1.00 0.00 C ATOM 0 H LEU A 24 -5.262 -7.410 -4.467 1.00 0.00 H new ATOM 0 HA LEU A 24 -5.020 -5.850 -6.927 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -5.736 -4.741 -4.207 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -4.829 -3.780 -5.358 1.00 0.00 H new ATOM 0 HG LEU A 24 -7.420 -5.017 -6.230 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -8.636 -3.039 -5.409 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -7.943 -3.990 -4.073 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -7.160 -2.477 -4.589 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -7.519 -2.978 -7.608 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -5.999 -2.414 -6.875 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -6.012 -3.884 -7.878 1.00 0.00 H new ATOM 317 N SER A 25 -2.599 -6.012 -6.501 1.00 0.00 N ATOM 318 CA SER A 25 -1.157 -6.077 -6.292 1.00 0.00 C ATOM 319 C SER A 25 -0.545 -4.679 -6.301 1.00 0.00 C ATOM 320 O SER A 25 -1.086 -3.755 -6.909 1.00 0.00 O ATOM 321 CB SER A 25 -0.502 -6.940 -7.371 1.00 0.00 C ATOM 322 OG SER A 25 0.787 -7.368 -6.969 1.00 0.00 O ATOM 0 H SER A 25 -2.885 -6.044 -7.479 1.00 0.00 H new ATOM 0 HA SER A 25 -0.975 -6.529 -5.317 1.00 0.00 H new ATOM 0 HB2 SER A 25 -1.129 -7.808 -7.577 1.00 0.00 H new ATOM 0 HB3 SER A 25 -0.427 -6.373 -8.299 1.00 0.00 H new ATOM 0 HG SER A 25 1.184 -7.919 -7.675 1.00 0.00 H new ATOM 328 N LEU A 26 0.588 -4.533 -5.623 1.00 0.00 N ATOM 329 CA LEU A 26 1.277 -3.249 -5.552 1.00 0.00 C ATOM 330 C LEU A 26 2.781 -3.427 -5.731 1.00 0.00 C ATOM 331 O LEU A 26 3.321 -4.508 -5.497 1.00 0.00 O ATOM 332 CB LEU A 26 0.989 -2.567 -4.213 1.00 0.00 C ATOM 333 CG LEU A 26 -0.486 -2.350 -3.874 1.00 0.00 C ATOM 334 CD1 LEU A 26 -0.694 -2.357 -2.367 1.00 0.00 C ATOM 335 CD2 LEU A 26 -0.985 -1.045 -4.477 1.00 0.00 C ATOM 0 H LEU A 26 1.049 -5.288 -5.115 1.00 0.00 H new ATOM 0 HA LEU A 26 0.905 -2.620 -6.361 1.00 0.00 H new ATOM 0 HB2 LEU A 26 1.439 -3.164 -3.420 1.00 0.00 H new ATOM 0 HB3 LEU A 26 1.489 -1.598 -4.206 1.00 0.00 H new ATOM 0 HG LEU A 26 -1.062 -3.169 -4.303 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -1.750 -2.201 -2.145 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -0.375 -3.317 -1.960 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -0.106 -1.558 -1.915 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -2.037 -0.907 -4.226 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -0.404 -0.214 -4.077 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -0.872 -1.078 -5.561 1.00 0.00 H new ATOM 347 N ALA A 27 3.453 -2.358 -6.147 1.00 0.00 N ATOM 348 CA ALA A 27 4.895 -2.395 -6.354 1.00 0.00 C ATOM 349 C ALA A 27 5.465 -0.989 -6.502 1.00 0.00 C ATOM 350 O ALA A 27 4.957 -0.182 -7.281 1.00 0.00 O ATOM 351 CB ALA A 27 5.232 -3.235 -7.577 1.00 0.00 C ATOM 0 H ALA A 27 3.021 -1.456 -6.347 1.00 0.00 H new ATOM 0 HA ALA A 27 5.351 -2.853 -5.476 1.00 0.00 H new ATOM 0 HB1 ALA A 27 6.313 -3.254 -7.719 1.00 0.00 H new ATOM 0 HB2 ALA A 27 4.868 -4.252 -7.432 1.00 0.00 H new ATOM 0 HB3 ALA A 27 4.758 -2.802 -8.458 1.00 0.00 H new ATOM 357 N TRP A 28 6.521 -0.701 -5.751 1.00 0.00 N ATOM 358 CA TRP A 28 7.159 0.610 -5.799 1.00 0.00 C ATOM 359 C TRP A 28 8.570 0.508 -6.367 1.00 0.00 C ATOM 360 O TRP A 28 9.106 -0.588 -6.529 1.00 0.00 O ATOM 361 CB TRP A 28 7.203 1.230 -4.401 1.00 0.00 C ATOM 362 CG TRP A 28 7.280 0.214 -3.302 1.00 0.00 C ATOM 363 CD1 TRP A 28 8.302 0.044 -2.413 1.00 0.00 C ATOM 364 CD2 TRP A 28 6.295 -0.774 -2.978 1.00 0.00 C ATOM 365 NE1 TRP A 28 8.013 -0.989 -1.555 1.00 0.00 N ATOM 366 CE2 TRP A 28 6.787 -1.507 -1.880 1.00 0.00 C ATOM 367 CE3 TRP A 28 5.046 -1.109 -3.506 1.00 0.00 C ATOM 368 CZ2 TRP A 28 6.072 -2.554 -1.305 1.00 0.00 C ATOM 369 CZ3 TRP A 28 4.338 -2.149 -2.934 1.00 0.00 C ATOM 370 CH2 TRP A 28 4.852 -2.861 -1.843 1.00 0.00 C ATOM 0 H TRP A 28 6.954 -1.357 -5.101 1.00 0.00 H new ATOM 0 HA TRP A 28 6.569 1.250 -6.455 1.00 0.00 H new ATOM 0 HB2 TRP A 28 8.065 1.894 -4.333 1.00 0.00 H new ATOM 0 HB3 TRP A 28 6.315 1.845 -4.256 1.00 0.00 H new ATOM 0 HD1 TRP A 28 9.205 0.635 -2.388 1.00 0.00 H new ATOM 0 HE1 TRP A 28 8.614 -1.317 -0.799 1.00 0.00 H new ATOM 0 HE3 TRP A 28 4.641 -0.565 -4.346 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 6.466 -3.105 -0.464 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 3.372 -2.417 -3.335 1.00 0.00 H new ATOM 0 HH2 TRP A 28 4.274 -3.668 -1.418 1.00 0.00 H new ATOM 381 N ALA A 29 9.167 1.657 -6.669 1.00 0.00 N ATOM 382 CA ALA A 29 10.517 1.696 -7.217 1.00 0.00 C ATOM 383 C ALA A 29 11.553 1.871 -6.112 1.00 0.00 C ATOM 384 O ALA A 29 11.611 2.914 -5.461 1.00 0.00 O ATOM 385 CB ALA A 29 10.638 2.815 -8.240 1.00 0.00 C ATOM 0 H ALA A 29 8.736 2.573 -6.543 1.00 0.00 H new ATOM 0 HA ALA A 29 10.710 0.744 -7.712 1.00 0.00 H new ATOM 0 HB1 ALA A 29 11.651 2.833 -8.641 1.00 0.00 H new ATOM 0 HB2 ALA A 29 9.929 2.645 -9.051 1.00 0.00 H new ATOM 0 HB3 ALA A 29 10.420 3.770 -7.762 1.00 0.00 H new ATOM 391 N VAL A 30 12.370 0.843 -5.905 1.00 0.00 N ATOM 392 CA VAL A 30 13.405 0.884 -4.879 1.00 0.00 C ATOM 393 C VAL A 30 14.010 2.278 -4.764 1.00 0.00 C ATOM 394 O VAL A 30 14.884 2.669 -5.538 1.00 0.00 O ATOM 395 CB VAL A 30 14.528 -0.128 -5.174 1.00 0.00 C ATOM 396 CG1 VAL A 30 15.654 0.013 -4.161 1.00 0.00 C ATOM 397 CG2 VAL A 30 13.979 -1.547 -5.179 1.00 0.00 C ATOM 0 H VAL A 30 12.335 -0.028 -6.434 1.00 0.00 H new ATOM 0 HA VAL A 30 12.926 0.620 -3.936 1.00 0.00 H new ATOM 0 HB VAL A 30 14.933 0.084 -6.163 1.00 0.00 H new ATOM 0 HG11 VAL A 30 16.438 -0.710 -4.386 1.00 0.00 H new ATOM 0 HG12 VAL A 30 16.065 1.021 -4.212 1.00 0.00 H new ATOM 0 HG13 VAL A 30 15.267 -0.171 -3.159 1.00 0.00 H new ATOM 0 HG21 VAL A 30 14.786 -2.249 -5.389 1.00 0.00 H new ATOM 0 HG22 VAL A 30 13.546 -1.773 -4.205 1.00 0.00 H new ATOM 0 HG23 VAL A 30 13.211 -1.637 -5.947 1.00 0.00 H new ATOM 407 N PRO A 31 13.536 3.049 -3.774 1.00 0.00 N ATOM 408 CA PRO A 31 14.017 4.413 -3.532 1.00 0.00 C ATOM 409 C PRO A 31 15.446 4.438 -3.000 1.00 0.00 C ATOM 410 O PRO A 31 16.009 3.398 -2.657 1.00 0.00 O ATOM 411 CB PRO A 31 13.044 4.951 -2.480 1.00 0.00 C ATOM 412 CG PRO A 31 12.537 3.739 -1.778 1.00 0.00 C ATOM 413 CD PRO A 31 12.494 2.649 -2.813 1.00 0.00 C ATOM 0 HA PRO A 31 14.045 5.004 -4.447 1.00 0.00 H new ATOM 0 HB2 PRO A 31 13.544 5.629 -1.788 1.00 0.00 H new ATOM 0 HB3 PRO A 31 12.230 5.510 -2.942 1.00 0.00 H new ATOM 0 HG2 PRO A 31 13.191 3.465 -0.950 1.00 0.00 H new ATOM 0 HG3 PRO A 31 11.547 3.917 -1.357 1.00 0.00 H new ATOM 0 HD2 PRO A 31 12.703 1.672 -2.377 1.00 0.00 H new ATOM 0 HD3 PRO A 31 11.515 2.583 -3.287 1.00 0.00 H new ATOM 421 N ARG A 32 16.026 5.631 -2.933 1.00 0.00 N ATOM 422 CA ARG A 32 17.390 5.791 -2.442 1.00 0.00 C ATOM 423 C ARG A 32 17.401 6.477 -1.079 1.00 0.00 C ATOM 424 O ARG A 32 17.261 7.696 -0.985 1.00 0.00 O ATOM 425 CB ARG A 32 18.221 6.601 -3.439 1.00 0.00 C ATOM 426 CG ARG A 32 19.617 6.934 -2.938 1.00 0.00 C ATOM 427 CD ARG A 32 20.611 5.839 -3.292 1.00 0.00 C ATOM 428 NE ARG A 32 21.992 6.262 -3.075 1.00 0.00 N ATOM 429 CZ ARG A 32 23.011 5.417 -2.966 1.00 0.00 C ATOM 430 NH1 ARG A 32 22.806 4.110 -3.054 1.00 0.00 N ATOM 431 NH2 ARG A 32 24.240 5.879 -2.769 1.00 0.00 N ATOM 0 H ARG A 32 15.573 6.501 -3.212 1.00 0.00 H new ATOM 0 HA ARG A 32 17.829 4.799 -2.334 1.00 0.00 H new ATOM 0 HB2 ARG A 32 18.302 6.041 -4.371 1.00 0.00 H new ATOM 0 HB3 ARG A 32 17.696 7.528 -3.669 1.00 0.00 H new ATOM 0 HG2 ARG A 32 19.945 7.879 -3.372 1.00 0.00 H new ATOM 0 HG3 ARG A 32 19.594 7.071 -1.857 1.00 0.00 H new ATOM 0 HD2 ARG A 32 20.404 4.954 -2.691 1.00 0.00 H new ATOM 0 HD3 ARG A 32 20.479 5.553 -4.336 1.00 0.00 H new ATOM 0 HE ARG A 32 22.184 7.261 -3.003 1.00 0.00 H new ATOM 0 HH11 ARG A 32 21.864 3.751 -3.206 1.00 0.00 H new ATOM 0 HH12 ARG A 32 23.591 3.464 -2.970 1.00 0.00 H new ATOM 0 HH21 ARG A 32 24.402 6.884 -2.701 1.00 0.00 H new ATOM 0 HH22 ARG A 32 25.022 5.229 -2.685 1.00 0.00 H new ATOM 445 N ALA A 33 17.566 5.684 -0.025 1.00 0.00 N ATOM 446 CA ALA A 33 17.597 6.214 1.332 1.00 0.00 C ATOM 447 C ALA A 33 18.949 6.844 1.645 1.00 0.00 C ATOM 448 O ALA A 33 19.999 6.361 1.222 1.00 0.00 O ATOM 449 CB ALA A 33 17.280 5.115 2.335 1.00 0.00 C ATOM 0 H ALA A 33 17.680 4.672 -0.085 1.00 0.00 H new ATOM 0 HA ALA A 33 16.837 6.992 1.409 1.00 0.00 H new ATOM 0 HB1 ALA A 33 17.307 5.525 3.345 1.00 0.00 H new ATOM 0 HB2 ALA A 33 16.287 4.713 2.133 1.00 0.00 H new ATOM 0 HB3 ALA A 33 18.019 4.318 2.247 1.00 0.00 H new ATOM 455 N PRO A 34 18.927 7.950 2.404 1.00 0.00 N ATOM 456 CA PRO A 34 20.143 8.670 2.791 1.00 0.00 C ATOM 457 C PRO A 34 20.990 7.886 3.787 1.00 0.00 C ATOM 458 O PRO A 34 22.219 7.941 3.751 1.00 0.00 O ATOM 459 CB PRO A 34 19.608 9.951 3.436 1.00 0.00 C ATOM 460 CG PRO A 34 18.247 9.589 3.924 1.00 0.00 C ATOM 461 CD PRO A 34 17.711 8.582 2.944 1.00 0.00 C ATOM 0 HA PRO A 34 20.799 8.848 1.939 1.00 0.00 H new ATOM 0 HB2 PRO A 34 20.248 10.279 4.255 1.00 0.00 H new ATOM 0 HB3 PRO A 34 19.566 10.769 2.717 1.00 0.00 H new ATOM 0 HG2 PRO A 34 18.291 9.170 4.929 1.00 0.00 H new ATOM 0 HG3 PRO A 34 17.603 10.467 3.973 1.00 0.00 H new ATOM 0 HD2 PRO A 34 17.062 7.854 3.431 1.00 0.00 H new ATOM 0 HD3 PRO A 34 17.123 9.058 2.159 1.00 0.00 H new ATOM 469 N SER A 35 20.324 7.155 4.675 1.00 0.00 N ATOM 470 CA SER A 35 21.016 6.361 5.684 1.00 0.00 C ATOM 471 C SER A 35 20.942 4.874 5.350 1.00 0.00 C ATOM 472 O SER A 35 19.857 4.315 5.194 1.00 0.00 O ATOM 473 CB SER A 35 20.413 6.616 7.066 1.00 0.00 C ATOM 474 OG SER A 35 19.101 6.086 7.156 1.00 0.00 O ATOM 0 H SER A 35 19.307 7.096 4.716 1.00 0.00 H new ATOM 0 HA SER A 35 22.064 6.662 5.692 1.00 0.00 H new ATOM 0 HB2 SER A 35 21.044 6.164 7.831 1.00 0.00 H new ATOM 0 HB3 SER A 35 20.390 7.688 7.264 1.00 0.00 H new ATOM 0 HG SER A 35 18.960 5.437 6.435 1.00 0.00 H new ATOM 480 N GLY A 36 22.105 4.239 5.242 1.00 0.00 N ATOM 481 CA GLY A 36 22.151 2.823 4.927 1.00 0.00 C ATOM 482 C GLY A 36 21.315 2.472 3.712 1.00 0.00 C ATOM 483 O GLY A 36 21.519 3.023 2.631 1.00 0.00 O ATOM 0 H GLY A 36 23.016 4.680 5.367 1.00 0.00 H new ATOM 0 HA2 GLY A 36 23.185 2.527 4.751 1.00 0.00 H new ATOM 0 HA3 GLY A 36 21.797 2.251 5.785 1.00 0.00 H new ATOM 487 N ALA A 37 20.374 1.551 3.889 1.00 0.00 N ATOM 488 CA ALA A 37 19.505 1.127 2.799 1.00 0.00 C ATOM 489 C ALA A 37 18.176 0.600 3.329 1.00 0.00 C ATOM 490 O ALA A 37 18.128 -0.063 4.365 1.00 0.00 O ATOM 491 CB ALA A 37 20.196 0.067 1.954 1.00 0.00 C ATOM 0 H ALA A 37 20.194 1.084 4.778 1.00 0.00 H new ATOM 0 HA ALA A 37 19.298 1.996 2.174 1.00 0.00 H new ATOM 0 HB1 ALA A 37 19.535 -0.240 1.144 1.00 0.00 H new ATOM 0 HB2 ALA A 37 21.116 0.477 1.536 1.00 0.00 H new ATOM 0 HB3 ALA A 37 20.433 -0.796 2.576 1.00 0.00 H new ATOM 497 N VAL A 38 17.097 0.899 2.611 1.00 0.00 N ATOM 498 CA VAL A 38 15.767 0.454 3.010 1.00 0.00 C ATOM 499 C VAL A 38 15.815 -0.938 3.628 1.00 0.00 C ATOM 500 O VAL A 38 16.625 -1.778 3.233 1.00 0.00 O ATOM 501 CB VAL A 38 14.798 0.439 1.812 1.00 0.00 C ATOM 502 CG1 VAL A 38 13.420 -0.037 2.245 1.00 0.00 C ATOM 503 CG2 VAL A 38 14.719 1.818 1.174 1.00 0.00 C ATOM 0 H VAL A 38 17.118 1.447 1.751 1.00 0.00 H new ATOM 0 HA VAL A 38 15.405 1.165 3.753 1.00 0.00 H new ATOM 0 HB VAL A 38 15.179 -0.260 1.067 1.00 0.00 H new ATOM 0 HG11 VAL A 38 12.750 -0.041 1.385 1.00 0.00 H new ATOM 0 HG12 VAL A 38 13.495 -1.046 2.651 1.00 0.00 H new ATOM 0 HG13 VAL A 38 13.027 0.634 3.009 1.00 0.00 H new ATOM 0 HG21 VAL A 38 14.030 1.789 0.330 1.00 0.00 H new ATOM 0 HG22 VAL A 38 14.362 2.539 1.909 1.00 0.00 H new ATOM 0 HG23 VAL A 38 15.708 2.115 0.825 1.00 0.00 H new ATOM 513 N LEU A 39 14.942 -1.178 4.601 1.00 0.00 N ATOM 514 CA LEU A 39 14.884 -2.470 5.275 1.00 0.00 C ATOM 515 C LEU A 39 13.572 -3.185 4.969 1.00 0.00 C ATOM 516 O LEU A 39 13.569 -4.303 4.453 1.00 0.00 O ATOM 517 CB LEU A 39 15.037 -2.286 6.786 1.00 0.00 C ATOM 518 CG LEU A 39 16.276 -1.517 7.246 1.00 0.00 C ATOM 519 CD1 LEU A 39 16.126 -1.083 8.696 1.00 0.00 C ATOM 520 CD2 LEU A 39 17.527 -2.365 7.068 1.00 0.00 C ATOM 0 H LEU A 39 14.265 -0.495 4.940 1.00 0.00 H new ATOM 0 HA LEU A 39 15.706 -3.083 4.904 1.00 0.00 H new ATOM 0 HB2 LEU A 39 14.153 -1.769 7.160 1.00 0.00 H new ATOM 0 HB3 LEU A 39 15.051 -3.271 7.252 1.00 0.00 H new ATOM 0 HG LEU A 39 16.376 -0.624 6.629 1.00 0.00 H new ATOM 0 HD11 LEU A 39 17.017 -0.537 9.006 1.00 0.00 H new ATOM 0 HD12 LEU A 39 15.253 -0.438 8.794 1.00 0.00 H new ATOM 0 HD13 LEU A 39 16.001 -1.962 9.328 1.00 0.00 H new ATOM 0 HD21 LEU A 39 18.399 -1.802 7.400 1.00 0.00 H new ATOM 0 HD22 LEU A 39 17.436 -3.276 7.660 1.00 0.00 H new ATOM 0 HD23 LEU A 39 17.643 -2.626 6.016 1.00 0.00 H new ATOM 532 N ASP A 40 12.460 -2.532 5.287 1.00 0.00 N ATOM 533 CA ASP A 40 11.141 -3.104 5.043 1.00 0.00 C ATOM 534 C ASP A 40 10.142 -2.019 4.651 1.00 0.00 C ATOM 535 O ASP A 40 10.481 -0.837 4.605 1.00 0.00 O ATOM 536 CB ASP A 40 10.645 -3.847 6.285 1.00 0.00 C ATOM 537 CG ASP A 40 11.049 -3.155 7.572 1.00 0.00 C ATOM 538 OD1 ASP A 40 12.259 -3.137 7.882 1.00 0.00 O ATOM 539 OD2 ASP A 40 10.155 -2.632 8.271 1.00 0.00 O ATOM 0 H ASP A 40 12.446 -1.606 5.714 1.00 0.00 H new ATOM 0 HA ASP A 40 11.226 -3.810 4.217 1.00 0.00 H new ATOM 0 HB2 ASP A 40 9.559 -3.930 6.246 1.00 0.00 H new ATOM 0 HB3 ASP A 40 11.043 -4.862 6.281 1.00 0.00 H new ATOM 544 N TYR A 41 8.911 -2.430 4.369 1.00 0.00 N ATOM 545 CA TYR A 41 7.864 -1.494 3.978 1.00 0.00 C ATOM 546 C TYR A 41 6.576 -1.763 4.751 1.00 0.00 C ATOM 547 O TYR A 41 6.442 -2.790 5.415 1.00 0.00 O ATOM 548 CB TYR A 41 7.599 -1.591 2.475 1.00 0.00 C ATOM 549 CG TYR A 41 8.853 -1.517 1.633 1.00 0.00 C ATOM 550 CD1 TYR A 41 9.622 -2.650 1.397 1.00 0.00 C ATOM 551 CD2 TYR A 41 9.270 -0.315 1.076 1.00 0.00 C ATOM 552 CE1 TYR A 41 10.769 -2.588 0.630 1.00 0.00 C ATOM 553 CE2 TYR A 41 10.415 -0.244 0.306 1.00 0.00 C ATOM 554 CZ TYR A 41 11.161 -1.383 0.086 1.00 0.00 C ATOM 555 OH TYR A 41 12.303 -1.315 -0.679 1.00 0.00 O ATOM 0 H TYR A 41 8.614 -3.405 4.404 1.00 0.00 H new ATOM 0 HA TYR A 41 8.206 -0.487 4.216 1.00 0.00 H new ATOM 0 HB2 TYR A 41 7.085 -2.529 2.265 1.00 0.00 H new ATOM 0 HB3 TYR A 41 6.926 -0.786 2.181 1.00 0.00 H new ATOM 0 HD1 TYR A 41 9.318 -3.596 1.821 1.00 0.00 H new ATOM 0 HD2 TYR A 41 8.689 0.579 1.248 1.00 0.00 H new ATOM 0 HE1 TYR A 41 11.356 -3.478 0.457 1.00 0.00 H new ATOM 0 HE2 TYR A 41 10.724 0.698 -0.121 1.00 0.00 H new ATOM 0 HH TYR A 41 12.436 -0.394 -0.987 1.00 0.00 H new ATOM 565 N GLU A 42 5.632 -0.832 4.657 1.00 0.00 N ATOM 566 CA GLU A 42 4.354 -0.969 5.347 1.00 0.00 C ATOM 567 C GLU A 42 3.210 -0.449 4.481 1.00 0.00 C ATOM 568 O GLU A 42 3.124 0.746 4.198 1.00 0.00 O ATOM 569 CB GLU A 42 4.385 -0.214 6.678 1.00 0.00 C ATOM 570 CG GLU A 42 3.396 -0.745 7.702 1.00 0.00 C ATOM 571 CD GLU A 42 3.957 -1.897 8.512 1.00 0.00 C ATOM 572 OE1 GLU A 42 4.932 -2.526 8.052 1.00 0.00 O ATOM 573 OE2 GLU A 42 3.419 -2.169 9.606 1.00 0.00 O ATOM 0 H GLU A 42 5.727 0.024 4.111 1.00 0.00 H new ATOM 0 HA GLU A 42 4.187 -2.028 5.542 1.00 0.00 H new ATOM 0 HB2 GLU A 42 5.391 -0.269 7.094 1.00 0.00 H new ATOM 0 HB3 GLU A 42 4.174 0.839 6.494 1.00 0.00 H new ATOM 0 HG2 GLU A 42 3.108 0.062 8.376 1.00 0.00 H new ATOM 0 HG3 GLU A 42 2.490 -1.072 7.191 1.00 0.00 H new ATOM 580 N VAL A 43 2.333 -1.356 4.063 1.00 0.00 N ATOM 581 CA VAL A 43 1.193 -0.991 3.230 1.00 0.00 C ATOM 582 C VAL A 43 -0.034 -0.688 4.081 1.00 0.00 C ATOM 583 O VAL A 43 -0.654 -1.591 4.643 1.00 0.00 O ATOM 584 CB VAL A 43 0.847 -2.110 2.230 1.00 0.00 C ATOM 585 CG1 VAL A 43 -0.373 -1.731 1.405 1.00 0.00 C ATOM 586 CG2 VAL A 43 2.038 -2.408 1.332 1.00 0.00 C ATOM 0 H VAL A 43 2.390 -2.349 4.288 1.00 0.00 H new ATOM 0 HA VAL A 43 1.479 -0.096 2.677 1.00 0.00 H new ATOM 0 HB VAL A 43 0.609 -3.014 2.791 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -0.602 -2.534 0.704 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -1.225 -1.573 2.067 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -0.168 -0.814 0.852 1.00 0.00 H new ATOM 0 HG21 VAL A 43 1.776 -3.201 0.632 1.00 0.00 H new ATOM 0 HG22 VAL A 43 2.310 -1.510 0.778 1.00 0.00 H new ATOM 0 HG23 VAL A 43 2.883 -2.727 1.942 1.00 0.00 H new ATOM 596 N LYS A 44 -0.383 0.591 4.172 1.00 0.00 N ATOM 597 CA LYS A 44 -1.538 1.017 4.953 1.00 0.00 C ATOM 598 C LYS A 44 -2.694 1.416 4.042 1.00 0.00 C ATOM 599 O LYS A 44 -2.619 2.418 3.331 1.00 0.00 O ATOM 600 CB LYS A 44 -1.162 2.190 5.862 1.00 0.00 C ATOM 601 CG LYS A 44 -2.348 2.802 6.587 1.00 0.00 C ATOM 602 CD LYS A 44 -1.928 3.984 7.445 1.00 0.00 C ATOM 603 CE LYS A 44 -2.984 4.319 8.487 1.00 0.00 C ATOM 604 NZ LYS A 44 -2.733 5.642 9.124 1.00 0.00 N ATOM 0 H LYS A 44 0.119 1.352 3.714 1.00 0.00 H new ATOM 0 HA LYS A 44 -1.858 0.177 5.569 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -0.433 1.850 6.598 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -0.675 2.961 5.264 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -3.093 3.126 5.860 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -2.822 2.046 7.214 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -0.984 3.758 7.941 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -1.754 4.852 6.810 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -3.968 4.322 8.019 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -2.998 3.544 9.253 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -3.474 5.834 9.828 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -1.805 5.631 9.592 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -2.745 6.385 8.397 1.00 0.00 H new ATOM 618 N TYR A 45 -3.763 0.627 4.069 1.00 0.00 N ATOM 619 CA TYR A 45 -4.934 0.898 3.244 1.00 0.00 C ATOM 620 C TYR A 45 -6.197 0.965 4.097 1.00 0.00 C ATOM 621 O TYR A 45 -6.301 0.298 5.126 1.00 0.00 O ATOM 622 CB TYR A 45 -5.087 -0.179 2.169 1.00 0.00 C ATOM 623 CG TYR A 45 -5.261 -1.573 2.729 1.00 0.00 C ATOM 624 CD1 TYR A 45 -4.181 -2.273 3.251 1.00 0.00 C ATOM 625 CD2 TYR A 45 -6.506 -2.189 2.737 1.00 0.00 C ATOM 626 CE1 TYR A 45 -4.335 -3.546 3.763 1.00 0.00 C ATOM 627 CE2 TYR A 45 -6.670 -3.462 3.248 1.00 0.00 C ATOM 628 CZ TYR A 45 -5.582 -4.137 3.759 1.00 0.00 C ATOM 629 OH TYR A 45 -5.740 -5.405 4.270 1.00 0.00 O ATOM 0 H TYR A 45 -3.842 -0.205 4.653 1.00 0.00 H new ATOM 0 HA TYR A 45 -4.791 1.865 2.762 1.00 0.00 H new ATOM 0 HB2 TYR A 45 -5.947 0.063 1.544 1.00 0.00 H new ATOM 0 HB3 TYR A 45 -4.209 -0.163 1.523 1.00 0.00 H new ATOM 0 HD1 TYR A 45 -3.204 -1.814 3.257 1.00 0.00 H new ATOM 0 HD2 TYR A 45 -7.361 -1.664 2.337 1.00 0.00 H new ATOM 0 HE1 TYR A 45 -3.484 -4.076 4.164 1.00 0.00 H new ATOM 0 HE2 TYR A 45 -7.645 -3.926 3.247 1.00 0.00 H new ATOM 0 HH TYR A 45 -6.679 -5.674 4.193 1.00 0.00 H new ATOM 639 N HIS A 46 -7.156 1.776 3.660 1.00 0.00 N ATOM 640 CA HIS A 46 -8.414 1.931 4.382 1.00 0.00 C ATOM 641 C HIS A 46 -9.499 2.494 3.468 1.00 0.00 C ATOM 642 O HIS A 46 -9.216 3.286 2.570 1.00 0.00 O ATOM 643 CB HIS A 46 -8.223 2.846 5.591 1.00 0.00 C ATOM 644 CG HIS A 46 -8.418 4.298 5.279 1.00 0.00 C ATOM 645 ND1 HIS A 46 -9.620 4.951 5.454 1.00 0.00 N ATOM 646 CD2 HIS A 46 -7.554 5.225 4.804 1.00 0.00 C ATOM 647 CE1 HIS A 46 -9.488 6.216 5.097 1.00 0.00 C ATOM 648 NE2 HIS A 46 -8.243 6.409 4.699 1.00 0.00 N ATOM 0 H HIS A 46 -7.086 2.335 2.810 1.00 0.00 H new ATOM 0 HA HIS A 46 -8.730 0.947 4.728 1.00 0.00 H new ATOM 0 HB2 HIS A 46 -8.924 2.553 6.372 1.00 0.00 H new ATOM 0 HB3 HIS A 46 -7.220 2.700 5.992 1.00 0.00 H new ATOM 0 HD1 HIS A 46 -10.477 4.524 5.804 1.00 0.00 H new ATOM 0 HD2 HIS A 46 -6.516 5.064 4.554 1.00 0.00 H new ATOM 0 HE1 HIS A 46 -10.266 6.965 5.126 1.00 0.00 H new ATOM 657 N GLU A 47 -10.739 2.078 3.704 1.00 0.00 N ATOM 658 CA GLU A 47 -11.865 2.540 2.901 1.00 0.00 C ATOM 659 C GLU A 47 -12.060 4.046 3.053 1.00 0.00 C ATOM 660 O GLU A 47 -12.164 4.561 4.167 1.00 0.00 O ATOM 661 CB GLU A 47 -13.144 1.805 3.305 1.00 0.00 C ATOM 662 CG GLU A 47 -14.201 1.777 2.214 1.00 0.00 C ATOM 663 CD GLU A 47 -15.611 1.726 2.768 1.00 0.00 C ATOM 664 OE1 GLU A 47 -16.038 0.638 3.208 1.00 0.00 O ATOM 665 OE2 GLU A 47 -16.289 2.775 2.762 1.00 0.00 O ATOM 0 H GLU A 47 -10.989 1.422 4.444 1.00 0.00 H new ATOM 0 HA GLU A 47 -11.646 2.323 1.855 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -12.893 0.781 3.582 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -13.562 2.281 4.192 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -14.093 2.662 1.586 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -14.035 0.910 1.574 1.00 0.00 H new ATOM 672 N LYS A 48 -12.109 4.747 1.926 1.00 0.00 N ATOM 673 CA LYS A 48 -12.292 6.194 1.931 1.00 0.00 C ATOM 674 C LYS A 48 -13.702 6.562 2.383 1.00 0.00 C ATOM 675 O LYS A 48 -14.571 6.850 1.562 1.00 0.00 O ATOM 676 CB LYS A 48 -12.025 6.768 0.538 1.00 0.00 C ATOM 677 CG LYS A 48 -11.487 8.188 0.558 1.00 0.00 C ATOM 678 CD LYS A 48 -11.740 8.899 -0.761 1.00 0.00 C ATOM 679 CE LYS A 48 -10.970 10.207 -0.845 1.00 0.00 C ATOM 680 NZ LYS A 48 -11.627 11.180 -1.761 1.00 0.00 N ATOM 0 H LYS A 48 -12.024 4.336 0.996 1.00 0.00 H new ATOM 0 HA LYS A 48 -11.580 6.623 2.636 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -11.313 6.126 0.020 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -12.950 6.747 -0.038 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -11.957 8.745 1.369 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -10.417 8.170 0.763 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -11.449 8.250 -1.587 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -12.806 9.096 -0.871 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -10.887 10.644 0.150 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -9.956 10.010 -1.192 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -11.071 12.059 -1.791 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -11.683 10.774 -2.717 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -12.586 11.388 -1.416 1.00 0.00 H new ATOM 694 N GLY A 49 -13.920 6.551 3.695 1.00 0.00 N ATOM 695 CA GLY A 49 -15.226 6.887 4.232 1.00 0.00 C ATOM 696 C GLY A 49 -15.626 5.989 5.386 1.00 0.00 C ATOM 697 O GLY A 49 -16.780 5.574 5.487 1.00 0.00 O ATOM 0 H GLY A 49 -13.216 6.316 4.395 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -15.222 7.924 4.567 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -15.972 6.811 3.441 1.00 0.00 H new ATOM 701 N ALA A 50 -14.670 5.686 6.258 1.00 0.00 N ATOM 702 CA ALA A 50 -14.929 4.832 7.410 1.00 0.00 C ATOM 703 C ALA A 50 -14.662 5.575 8.715 1.00 0.00 C ATOM 704 O ALA A 50 -14.163 6.700 8.708 1.00 0.00 O ATOM 705 CB ALA A 50 -14.079 3.572 7.335 1.00 0.00 C ATOM 0 H ALA A 50 -13.709 6.020 6.188 1.00 0.00 H new ATOM 0 HA ALA A 50 -15.981 4.549 7.392 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -14.283 2.943 8.202 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -14.321 3.024 6.424 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -13.024 3.845 7.325 1.00 0.00 H new ATOM 711 N GLU A 51 -14.998 4.938 9.832 1.00 0.00 N ATOM 712 CA GLU A 51 -14.796 5.541 11.145 1.00 0.00 C ATOM 713 C GLU A 51 -14.149 4.548 12.106 1.00 0.00 C ATOM 714 O GLU A 51 -13.168 4.865 12.776 1.00 0.00 O ATOM 715 CB GLU A 51 -16.128 6.029 11.718 1.00 0.00 C ATOM 716 CG GLU A 51 -15.984 7.175 12.704 1.00 0.00 C ATOM 717 CD GLU A 51 -17.075 7.180 13.757 1.00 0.00 C ATOM 718 OE1 GLU A 51 -18.226 7.525 13.415 1.00 0.00 O ATOM 719 OE2 GLU A 51 -16.780 6.840 14.921 1.00 0.00 O ATOM 0 H GLU A 51 -15.411 4.006 9.855 1.00 0.00 H new ATOM 0 HA GLU A 51 -14.127 6.393 11.026 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -16.772 6.346 10.898 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -16.628 5.196 12.213 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -15.012 7.108 13.193 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -16.003 8.120 12.162 1.00 0.00 H new ATOM 726 N GLY A 52 -14.708 3.343 12.167 1.00 0.00 N ATOM 727 CA GLY A 52 -14.174 2.321 13.049 1.00 0.00 C ATOM 728 C GLY A 52 -12.661 2.241 12.993 1.00 0.00 C ATOM 729 O GLY A 52 -12.043 2.488 11.958 1.00 0.00 O ATOM 0 H GLY A 52 -15.521 3.056 11.622 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -14.486 2.529 14.072 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -14.596 1.354 12.777 1.00 0.00 H new ATOM 733 N PRO A 53 -12.042 1.890 14.130 1.00 0.00 N ATOM 734 CA PRO A 53 -10.584 1.770 14.233 1.00 0.00 C ATOM 735 C PRO A 53 -10.044 0.576 13.454 1.00 0.00 C ATOM 736 O PRO A 53 -8.835 0.442 13.265 1.00 0.00 O ATOM 737 CB PRO A 53 -10.349 1.581 15.733 1.00 0.00 C ATOM 738 CG PRO A 53 -11.618 0.993 16.245 1.00 0.00 C ATOM 739 CD PRO A 53 -12.716 1.581 15.402 1.00 0.00 C ATOM 0 HA PRO A 53 -10.073 2.637 13.814 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -9.503 0.920 15.921 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -10.127 2.530 16.221 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -11.604 -0.094 16.166 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -11.763 1.234 17.298 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -13.536 0.876 15.261 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -13.139 2.475 15.860 1.00 0.00 H new ATOM 747 N SER A 54 -10.947 -0.289 13.003 1.00 0.00 N ATOM 748 CA SER A 54 -10.561 -1.474 12.247 1.00 0.00 C ATOM 749 C SER A 54 -10.682 -1.225 10.747 1.00 0.00 C ATOM 750 O SER A 54 -10.232 -2.033 9.934 1.00 0.00 O ATOM 751 CB SER A 54 -11.429 -2.668 12.649 1.00 0.00 C ATOM 752 OG SER A 54 -10.852 -3.887 12.217 1.00 0.00 O ATOM 0 H SER A 54 -11.952 -0.191 13.148 1.00 0.00 H new ATOM 0 HA SER A 54 -9.519 -1.698 12.478 1.00 0.00 H new ATOM 0 HB2 SER A 54 -11.552 -2.684 13.732 1.00 0.00 H new ATOM 0 HB3 SER A 54 -12.424 -2.560 12.217 1.00 0.00 H new ATOM 0 HG SER A 54 -11.425 -4.634 12.488 1.00 0.00 H new ATOM 758 N SER A 55 -11.293 -0.101 10.388 1.00 0.00 N ATOM 759 CA SER A 55 -11.477 0.255 8.985 1.00 0.00 C ATOM 760 C SER A 55 -10.159 0.162 8.223 1.00 0.00 C ATOM 761 O SER A 55 -10.119 -0.298 7.082 1.00 0.00 O ATOM 762 CB SER A 55 -12.050 1.668 8.867 1.00 0.00 C ATOM 763 OG SER A 55 -13.356 1.737 9.413 1.00 0.00 O ATOM 0 H SER A 55 -11.669 0.579 11.049 1.00 0.00 H new ATOM 0 HA SER A 55 -12.180 -0.452 8.545 1.00 0.00 H new ATOM 0 HB2 SER A 55 -11.399 2.372 9.385 1.00 0.00 H new ATOM 0 HB3 SER A 55 -12.074 1.967 7.819 1.00 0.00 H new ATOM 0 HG SER A 55 -13.302 1.989 10.359 1.00 0.00 H new ATOM 769 N VAL A 56 -9.081 0.603 8.863 1.00 0.00 N ATOM 770 CA VAL A 56 -7.759 0.570 8.248 1.00 0.00 C ATOM 771 C VAL A 56 -6.974 -0.656 8.699 1.00 0.00 C ATOM 772 O VAL A 56 -7.060 -1.071 9.855 1.00 0.00 O ATOM 773 CB VAL A 56 -6.951 1.837 8.585 1.00 0.00 C ATOM 774 CG1 VAL A 56 -6.836 2.011 10.092 1.00 0.00 C ATOM 775 CG2 VAL A 56 -5.574 1.777 7.940 1.00 0.00 C ATOM 0 H VAL A 56 -9.097 0.988 9.808 1.00 0.00 H new ATOM 0 HA VAL A 56 -7.912 0.523 7.170 1.00 0.00 H new ATOM 0 HB VAL A 56 -7.478 2.702 8.183 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -6.262 2.911 10.312 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -7.832 2.101 10.525 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -6.331 1.145 10.521 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -5.016 2.680 8.188 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -5.036 0.905 8.311 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -5.682 1.703 6.858 1.00 0.00 H new ATOM 785 N ARG A 57 -6.207 -1.233 7.779 1.00 0.00 N ATOM 786 CA ARG A 57 -5.406 -2.412 8.081 1.00 0.00 C ATOM 787 C ARG A 57 -3.916 -2.103 7.963 1.00 0.00 C ATOM 788 O ARG A 57 -3.529 -1.017 7.532 1.00 0.00 O ATOM 789 CB ARG A 57 -5.776 -3.561 7.141 1.00 0.00 C ATOM 790 CG ARG A 57 -7.004 -4.339 7.583 1.00 0.00 C ATOM 791 CD ARG A 57 -8.244 -3.458 7.601 1.00 0.00 C ATOM 792 NE ARG A 57 -9.472 -4.239 7.471 1.00 0.00 N ATOM 793 CZ ARG A 57 -10.014 -4.926 8.470 1.00 0.00 C ATOM 794 NH1 ARG A 57 -9.441 -4.929 9.666 1.00 0.00 N ATOM 795 NH2 ARG A 57 -11.133 -5.612 8.274 1.00 0.00 N ATOM 0 H ARG A 57 -6.124 -0.902 6.818 1.00 0.00 H new ATOM 0 HA ARG A 57 -5.617 -2.710 9.108 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -5.950 -3.160 6.142 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -4.931 -4.245 7.067 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -7.164 -5.181 6.910 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -6.836 -4.753 8.577 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -8.272 -2.890 8.531 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -8.187 -2.735 6.788 1.00 0.00 H new ATOM 0 HE ARG A 57 -9.938 -4.258 6.564 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -8.581 -4.403 9.821 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -9.860 -5.458 10.431 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -11.577 -5.612 7.356 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -11.549 -6.140 9.042 1.00 0.00 H new ATOM 809 N PHE A 58 -3.085 -3.065 8.350 1.00 0.00 N ATOM 810 CA PHE A 58 -1.638 -2.895 8.289 1.00 0.00 C ATOM 811 C PHE A 58 -0.961 -4.170 7.794 1.00 0.00 C ATOM 812 O PHE A 58 -1.127 -5.242 8.378 1.00 0.00 O ATOM 813 CB PHE A 58 -1.089 -2.515 9.666 1.00 0.00 C ATOM 814 CG PHE A 58 -1.048 -1.032 9.905 1.00 0.00 C ATOM 815 CD1 PHE A 58 -2.221 -0.302 10.012 1.00 0.00 C ATOM 816 CD2 PHE A 58 0.163 -0.370 10.025 1.00 0.00 C ATOM 817 CE1 PHE A 58 -2.185 1.063 10.231 1.00 0.00 C ATOM 818 CE2 PHE A 58 0.204 0.994 10.245 1.00 0.00 C ATOM 819 CZ PHE A 58 -0.971 1.711 10.350 1.00 0.00 C ATOM 0 H PHE A 58 -3.389 -3.970 8.709 1.00 0.00 H new ATOM 0 HA PHE A 58 -1.421 -2.092 7.585 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -1.704 -2.982 10.435 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -0.083 -2.920 9.772 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -3.173 -0.804 9.923 1.00 0.00 H new ATOM 0 HD2 PHE A 58 1.086 -0.926 9.946 1.00 0.00 H new ATOM 0 HE1 PHE A 58 -3.106 1.622 10.309 1.00 0.00 H new ATOM 0 HE2 PHE A 58 1.155 1.499 10.335 1.00 0.00 H new ATOM 0 HZ PHE A 58 -0.941 2.776 10.525 1.00 0.00 H new ATOM 829 N LEU A 59 -0.199 -4.047 6.713 1.00 0.00 N ATOM 830 CA LEU A 59 0.504 -5.189 6.138 1.00 0.00 C ATOM 831 C LEU A 59 2.012 -4.961 6.147 1.00 0.00 C ATOM 832 O LEU A 59 2.501 -3.945 5.652 1.00 0.00 O ATOM 833 CB LEU A 59 0.023 -5.441 4.708 1.00 0.00 C ATOM 834 CG LEU A 59 0.859 -6.419 3.882 1.00 0.00 C ATOM 835 CD1 LEU A 59 0.382 -7.846 4.101 1.00 0.00 C ATOM 836 CD2 LEU A 59 0.799 -6.056 2.405 1.00 0.00 C ATOM 0 H LEU A 59 -0.052 -3.168 6.217 1.00 0.00 H new ATOM 0 HA LEU A 59 0.284 -6.065 6.748 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -1.000 -5.814 4.751 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -0.008 -4.486 4.183 1.00 0.00 H new ATOM 0 HG LEU A 59 1.896 -6.349 4.212 1.00 0.00 H new ATOM 0 HD11 LEU A 59 0.989 -8.528 3.505 1.00 0.00 H new ATOM 0 HD12 LEU A 59 0.477 -8.103 5.156 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -0.662 -7.931 3.799 1.00 0.00 H new ATOM 0 HD21 LEU A 59 1.400 -6.762 1.832 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -0.235 -6.097 2.062 1.00 0.00 H new ATOM 0 HD23 LEU A 59 1.189 -5.048 2.262 1.00 0.00 H new ATOM 848 N LYS A 60 2.745 -5.914 6.712 1.00 0.00 N ATOM 849 CA LYS A 60 4.199 -5.821 6.783 1.00 0.00 C ATOM 850 C LYS A 60 4.854 -6.728 5.746 1.00 0.00 C ATOM 851 O LYS A 60 4.721 -7.951 5.802 1.00 0.00 O ATOM 852 CB LYS A 60 4.687 -6.196 8.184 1.00 0.00 C ATOM 853 CG LYS A 60 4.573 -5.064 9.191 1.00 0.00 C ATOM 854 CD LYS A 60 4.426 -5.591 10.608 1.00 0.00 C ATOM 855 CE LYS A 60 4.281 -4.458 11.612 1.00 0.00 C ATOM 856 NZ LYS A 60 4.262 -4.958 13.015 1.00 0.00 N ATOM 0 H LYS A 60 2.356 -6.760 7.128 1.00 0.00 H new ATOM 0 HA LYS A 60 4.482 -4.790 6.570 1.00 0.00 H new ATOM 0 HB2 LYS A 60 4.113 -7.050 8.543 1.00 0.00 H new ATOM 0 HB3 LYS A 60 5.728 -6.514 8.124 1.00 0.00 H new ATOM 0 HG2 LYS A 60 5.457 -4.429 9.128 1.00 0.00 H new ATOM 0 HG3 LYS A 60 3.714 -4.440 8.943 1.00 0.00 H new ATOM 0 HD2 LYS A 60 3.555 -6.244 10.666 1.00 0.00 H new ATOM 0 HD3 LYS A 60 5.295 -6.196 10.864 1.00 0.00 H new ATOM 0 HE2 LYS A 60 5.105 -3.756 11.488 1.00 0.00 H new ATOM 0 HE3 LYS A 60 3.361 -3.909 11.410 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 4.162 -4.155 13.668 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 3.461 -5.609 13.141 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 5.150 -5.460 13.217 1.00 0.00 H new ATOM 870 N THR A 61 5.562 -6.121 4.798 1.00 0.00 N ATOM 871 CA THR A 61 6.238 -6.873 3.749 1.00 0.00 C ATOM 872 C THR A 61 7.714 -6.502 3.670 1.00 0.00 C ATOM 873 O THR A 61 8.080 -5.337 3.823 1.00 0.00 O ATOM 874 CB THR A 61 5.585 -6.632 2.375 1.00 0.00 C ATOM 875 OG1 THR A 61 6.552 -6.811 1.335 1.00 0.00 O ATOM 876 CG2 THR A 61 4.998 -5.230 2.294 1.00 0.00 C ATOM 0 H THR A 61 5.682 -5.110 4.736 1.00 0.00 H new ATOM 0 HA THR A 61 6.145 -7.928 4.007 1.00 0.00 H new ATOM 0 HB THR A 61 4.779 -7.354 2.248 1.00 0.00 H new ATOM 0 HG1 THR A 61 6.796 -5.938 0.961 1.00 0.00 H new ATOM 0 HG21 THR A 61 4.542 -5.082 1.315 1.00 0.00 H new ATOM 0 HG22 THR A 61 4.241 -5.107 3.069 1.00 0.00 H new ATOM 0 HG23 THR A 61 5.790 -4.495 2.440 1.00 0.00 H new ATOM 884 N SER A 62 8.559 -7.500 3.428 1.00 0.00 N ATOM 885 CA SER A 62 9.997 -7.278 3.331 1.00 0.00 C ATOM 886 C SER A 62 10.427 -7.134 1.875 1.00 0.00 C ATOM 887 O SER A 62 11.609 -7.245 1.553 1.00 0.00 O ATOM 888 CB SER A 62 10.757 -8.431 3.988 1.00 0.00 C ATOM 889 OG SER A 62 10.550 -9.644 3.286 1.00 0.00 O ATOM 0 H SER A 62 8.272 -8.470 3.296 1.00 0.00 H new ATOM 0 HA SER A 62 10.233 -6.352 3.854 1.00 0.00 H new ATOM 0 HB2 SER A 62 11.822 -8.200 4.015 1.00 0.00 H new ATOM 0 HB3 SER A 62 10.429 -8.545 5.021 1.00 0.00 H new ATOM 0 HG SER A 62 11.048 -10.365 3.725 1.00 0.00 H new ATOM 895 N GLU A 63 9.458 -6.885 1.000 1.00 0.00 N ATOM 896 CA GLU A 63 9.736 -6.726 -0.423 1.00 0.00 C ATOM 897 C GLU A 63 9.063 -5.472 -0.973 1.00 0.00 C ATOM 898 O GLU A 63 8.213 -4.873 -0.316 1.00 0.00 O ATOM 899 CB GLU A 63 9.259 -7.956 -1.199 1.00 0.00 C ATOM 900 CG GLU A 63 10.253 -9.105 -1.189 1.00 0.00 C ATOM 901 CD GLU A 63 9.584 -10.456 -1.350 1.00 0.00 C ATOM 902 OE1 GLU A 63 9.019 -10.961 -0.357 1.00 0.00 O ATOM 903 OE2 GLU A 63 9.626 -11.009 -2.469 1.00 0.00 O ATOM 0 H GLU A 63 8.474 -6.789 1.251 1.00 0.00 H new ATOM 0 HA GLU A 63 10.814 -6.622 -0.547 1.00 0.00 H new ATOM 0 HB2 GLU A 63 8.315 -8.299 -0.775 1.00 0.00 H new ATOM 0 HB3 GLU A 63 9.059 -7.669 -2.231 1.00 0.00 H new ATOM 0 HG2 GLU A 63 10.975 -8.963 -1.993 1.00 0.00 H new ATOM 0 HG3 GLU A 63 10.811 -9.089 -0.253 1.00 0.00 H new ATOM 910 N ASN A 64 9.452 -5.081 -2.182 1.00 0.00 N ATOM 911 CA ASN A 64 8.888 -3.897 -2.820 1.00 0.00 C ATOM 912 C ASN A 64 7.618 -4.247 -3.590 1.00 0.00 C ATOM 913 O ASN A 64 7.224 -3.536 -4.515 1.00 0.00 O ATOM 914 CB ASN A 64 9.912 -3.264 -3.764 1.00 0.00 C ATOM 915 CG ASN A 64 9.936 -3.934 -5.125 1.00 0.00 C ATOM 916 OD1 ASN A 64 9.532 -5.088 -5.268 1.00 0.00 O ATOM 917 ND2 ASN A 64 10.410 -3.210 -6.132 1.00 0.00 N ATOM 0 H ASN A 64 10.155 -5.566 -2.739 1.00 0.00 H new ATOM 0 HA ASN A 64 8.633 -3.181 -2.039 1.00 0.00 H new ATOM 0 HB2 ASN A 64 9.683 -2.206 -3.887 1.00 0.00 H new ATOM 0 HB3 ASN A 64 10.903 -3.325 -3.314 1.00 0.00 H new ATOM 0 HD21 ASN A 64 10.450 -3.607 -7.071 1.00 0.00 H new ATOM 0 HD22 ASN A 64 10.734 -2.257 -5.967 1.00 0.00 H new ATOM 924 N ARG A 65 6.982 -5.348 -3.202 1.00 0.00 N ATOM 925 CA ARG A 65 5.757 -5.793 -3.856 1.00 0.00 C ATOM 926 C ARG A 65 4.868 -6.559 -2.881 1.00 0.00 C ATOM 927 O ARG A 65 5.310 -7.511 -2.239 1.00 0.00 O ATOM 928 CB ARG A 65 6.089 -6.675 -5.061 1.00 0.00 C ATOM 929 CG ARG A 65 7.065 -7.797 -4.744 1.00 0.00 C ATOM 930 CD ARG A 65 7.879 -8.189 -5.967 1.00 0.00 C ATOM 931 NE ARG A 65 7.042 -8.749 -7.025 1.00 0.00 N ATOM 932 CZ ARG A 65 7.386 -8.755 -8.308 1.00 0.00 C ATOM 933 NH1 ARG A 65 8.544 -8.234 -8.690 1.00 0.00 N ATOM 934 NH2 ARG A 65 6.571 -9.283 -9.212 1.00 0.00 N ATOM 0 H ARG A 65 7.295 -5.948 -2.439 1.00 0.00 H new ATOM 0 HA ARG A 65 5.216 -4.911 -4.198 1.00 0.00 H new ATOM 0 HB2 ARG A 65 5.167 -7.106 -5.450 1.00 0.00 H new ATOM 0 HB3 ARG A 65 6.508 -6.053 -5.852 1.00 0.00 H new ATOM 0 HG2 ARG A 65 7.736 -7.482 -3.945 1.00 0.00 H new ATOM 0 HG3 ARG A 65 6.517 -8.665 -4.377 1.00 0.00 H new ATOM 0 HD2 ARG A 65 8.407 -7.314 -6.347 1.00 0.00 H new ATOM 0 HD3 ARG A 65 8.637 -8.918 -5.680 1.00 0.00 H new ATOM 0 HE ARG A 65 6.145 -9.158 -6.764 1.00 0.00 H new ATOM 0 HH11 ARG A 65 9.173 -7.827 -7.998 1.00 0.00 H new ATOM 0 HH12 ARG A 65 8.805 -8.240 -9.676 1.00 0.00 H new ATOM 0 HH21 ARG A 65 5.679 -9.685 -8.922 1.00 0.00 H new ATOM 0 HH22 ARG A 65 6.836 -9.287 -10.197 1.00 0.00 H new ATOM 948 N ALA A 66 3.613 -6.135 -2.775 1.00 0.00 N ATOM 949 CA ALA A 66 2.661 -6.781 -1.880 1.00 0.00 C ATOM 950 C ALA A 66 1.363 -7.116 -2.607 1.00 0.00 C ATOM 951 O ALA A 66 0.844 -6.305 -3.374 1.00 0.00 O ATOM 952 CB ALA A 66 2.380 -5.892 -0.678 1.00 0.00 C ATOM 0 H ALA A 66 3.232 -5.347 -3.298 1.00 0.00 H new ATOM 0 HA ALA A 66 3.103 -7.715 -1.533 1.00 0.00 H new ATOM 0 HB1 ALA A 66 1.667 -6.387 -0.018 1.00 0.00 H new ATOM 0 HB2 ALA A 66 3.308 -5.708 -0.137 1.00 0.00 H new ATOM 0 HB3 ALA A 66 1.963 -4.944 -1.016 1.00 0.00 H new ATOM 958 N GLU A 67 0.846 -8.316 -2.363 1.00 0.00 N ATOM 959 CA GLU A 67 -0.391 -8.757 -2.997 1.00 0.00 C ATOM 960 C GLU A 67 -1.541 -8.771 -1.994 1.00 0.00 C ATOM 961 O GLU A 67 -1.480 -9.454 -0.971 1.00 0.00 O ATOM 962 CB GLU A 67 -0.210 -10.151 -3.602 1.00 0.00 C ATOM 963 CG GLU A 67 -1.418 -10.635 -4.386 1.00 0.00 C ATOM 964 CD GLU A 67 -1.358 -10.244 -5.850 1.00 0.00 C ATOM 965 OE1 GLU A 67 -0.321 -10.513 -6.493 1.00 0.00 O ATOM 966 OE2 GLU A 67 -2.345 -9.668 -6.352 1.00 0.00 O ATOM 0 H GLU A 67 1.264 -8.999 -1.732 1.00 0.00 H new ATOM 0 HA GLU A 67 -0.634 -8.052 -3.792 1.00 0.00 H new ATOM 0 HB2 GLU A 67 0.660 -10.143 -4.259 1.00 0.00 H new ATOM 0 HB3 GLU A 67 0.002 -10.860 -2.802 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -1.488 -11.720 -4.306 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -2.324 -10.224 -3.941 1.00 0.00 H new ATOM 973 N LEU A 68 -2.589 -8.012 -2.295 1.00 0.00 N ATOM 974 CA LEU A 68 -3.754 -7.935 -1.421 1.00 0.00 C ATOM 975 C LEU A 68 -4.899 -8.785 -1.964 1.00 0.00 C ATOM 976 O LEU A 68 -5.450 -8.496 -3.026 1.00 0.00 O ATOM 977 CB LEU A 68 -4.209 -6.483 -1.271 1.00 0.00 C ATOM 978 CG LEU A 68 -3.119 -5.471 -0.913 1.00 0.00 C ATOM 979 CD1 LEU A 68 -3.710 -4.077 -0.771 1.00 0.00 C ATOM 980 CD2 LEU A 68 -2.408 -5.884 0.367 1.00 0.00 C ATOM 0 H LEU A 68 -2.656 -7.441 -3.138 1.00 0.00 H new ATOM 0 HA LEU A 68 -3.470 -8.323 -0.443 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -4.674 -6.171 -2.206 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -4.981 -6.443 -0.502 1.00 0.00 H new ATOM 0 HG LEU A 68 -2.388 -5.452 -1.721 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -2.920 -3.371 -0.516 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -4.172 -3.780 -1.712 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -4.462 -4.079 0.018 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -1.636 -5.153 0.607 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -3.128 -5.932 1.184 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -1.950 -6.863 0.229 1.00 0.00 H new ATOM 992 N ARG A 69 -5.253 -9.832 -1.227 1.00 0.00 N ATOM 993 CA ARG A 69 -6.333 -10.723 -1.634 1.00 0.00 C ATOM 994 C ARG A 69 -7.560 -10.530 -0.748 1.00 0.00 C ATOM 995 O ARG A 69 -7.448 -10.434 0.474 1.00 0.00 O ATOM 996 CB ARG A 69 -5.871 -12.180 -1.573 1.00 0.00 C ATOM 997 CG ARG A 69 -4.676 -12.478 -2.463 1.00 0.00 C ATOM 998 CD ARG A 69 -3.364 -12.258 -1.726 1.00 0.00 C ATOM 999 NE ARG A 69 -3.069 -13.344 -0.796 1.00 0.00 N ATOM 1000 CZ ARG A 69 -1.948 -13.421 -0.087 1.00 0.00 C ATOM 1001 NH1 ARG A 69 -1.021 -12.480 -0.203 1.00 0.00 N ATOM 1002 NH2 ARG A 69 -1.753 -14.440 0.739 1.00 0.00 N ATOM 0 H ARG A 69 -4.808 -10.084 -0.345 1.00 0.00 H new ATOM 0 HA ARG A 69 -6.605 -10.478 -2.661 1.00 0.00 H new ATOM 0 HB2 ARG A 69 -5.617 -12.429 -0.543 1.00 0.00 H new ATOM 0 HB3 ARG A 69 -6.699 -12.827 -1.862 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -4.730 -13.509 -2.813 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -4.710 -11.840 -3.346 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -2.553 -12.170 -2.449 1.00 0.00 H new ATOM 0 HD3 ARG A 69 -3.409 -11.316 -1.180 1.00 0.00 H new ATOM 0 HE ARG A 69 -3.762 -14.084 -0.684 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -1.168 -11.695 -0.838 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -0.161 -12.541 0.342 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -2.464 -15.166 0.830 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -0.892 -14.498 1.283 1.00 0.00 H new ATOM 1016 N GLY A 70 -8.732 -10.474 -1.373 1.00 0.00 N ATOM 1017 CA GLY A 70 -9.964 -10.292 -0.626 1.00 0.00 C ATOM 1018 C GLY A 70 -10.335 -8.831 -0.468 1.00 0.00 C ATOM 1019 O GLY A 70 -10.136 -8.243 0.596 1.00 0.00 O ATOM 0 H GLY A 70 -8.851 -10.551 -2.383 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -10.774 -10.817 -1.133 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -9.858 -10.746 0.359 1.00 0.00 H new ATOM 1023 N LEU A 71 -10.875 -8.242 -1.529 1.00 0.00 N ATOM 1024 CA LEU A 71 -11.274 -6.839 -1.504 1.00 0.00 C ATOM 1025 C LEU A 71 -12.516 -6.611 -2.360 1.00 0.00 C ATOM 1026 O LEU A 71 -13.048 -7.543 -2.963 1.00 0.00 O ATOM 1027 CB LEU A 71 -10.130 -5.954 -2.001 1.00 0.00 C ATOM 1028 CG LEU A 71 -8.769 -6.184 -1.342 1.00 0.00 C ATOM 1029 CD1 LEU A 71 -7.648 -5.713 -2.255 1.00 0.00 C ATOM 1030 CD2 LEU A 71 -8.700 -5.473 0.001 1.00 0.00 C ATOM 0 H LEU A 71 -11.047 -8.714 -2.417 1.00 0.00 H new ATOM 0 HA LEU A 71 -11.511 -6.573 -0.474 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -10.021 -6.104 -3.075 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -10.412 -4.912 -1.852 1.00 0.00 H new ATOM 0 HG LEU A 71 -8.645 -7.253 -1.171 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -6.687 -5.884 -1.770 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -7.685 -6.268 -3.193 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -7.767 -4.649 -2.458 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -7.725 -5.648 0.455 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -8.845 -4.403 -0.146 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -9.480 -5.858 0.657 1.00 0.00 H new ATOM 1042 N LYS A 72 -12.973 -5.364 -2.410 1.00 0.00 N ATOM 1043 CA LYS A 72 -14.151 -5.011 -3.194 1.00 0.00 C ATOM 1044 C LYS A 72 -13.751 -4.329 -4.499 1.00 0.00 C ATOM 1045 O LYS A 72 -12.867 -3.472 -4.517 1.00 0.00 O ATOM 1046 CB LYS A 72 -15.070 -4.092 -2.387 1.00 0.00 C ATOM 1047 CG LYS A 72 -15.646 -4.748 -1.144 1.00 0.00 C ATOM 1048 CD LYS A 72 -16.576 -3.806 -0.397 1.00 0.00 C ATOM 1049 CE LYS A 72 -17.535 -4.569 0.504 1.00 0.00 C ATOM 1050 NZ LYS A 72 -18.543 -5.334 -0.281 1.00 0.00 N ATOM 0 H LYS A 72 -12.545 -4.581 -1.916 1.00 0.00 H new ATOM 0 HA LYS A 72 -14.686 -5.930 -3.433 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -14.513 -3.202 -2.093 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -15.889 -3.760 -3.025 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -16.190 -5.650 -1.426 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -14.834 -5.058 -0.486 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -15.987 -3.111 0.202 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -17.143 -3.210 -1.112 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -16.971 -5.254 1.137 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -18.045 -3.870 1.167 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -19.359 -5.555 0.324 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -18.858 -4.763 -1.092 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -18.117 -6.218 -0.625 1.00 0.00 H new ATOM 1064 N ARG A 73 -14.408 -4.714 -5.588 1.00 0.00 N ATOM 1065 CA ARG A 73 -14.120 -4.139 -6.897 1.00 0.00 C ATOM 1066 C ARG A 73 -15.006 -2.925 -7.163 1.00 0.00 C ATOM 1067 O ARG A 73 -15.143 -2.482 -8.303 1.00 0.00 O ATOM 1068 CB ARG A 73 -14.327 -5.185 -7.994 1.00 0.00 C ATOM 1069 CG ARG A 73 -15.785 -5.555 -8.215 1.00 0.00 C ATOM 1070 CD ARG A 73 -16.214 -6.696 -7.306 1.00 0.00 C ATOM 1071 NE ARG A 73 -17.263 -7.513 -7.910 1.00 0.00 N ATOM 1072 CZ ARG A 73 -17.797 -8.577 -7.321 1.00 0.00 C ATOM 1073 NH1 ARG A 73 -17.383 -8.951 -6.119 1.00 0.00 N ATOM 1074 NH2 ARG A 73 -18.749 -9.269 -7.936 1.00 0.00 N ATOM 0 H ARG A 73 -15.143 -5.421 -5.590 1.00 0.00 H new ATOM 0 HA ARG A 73 -13.079 -3.817 -6.904 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -13.911 -4.807 -8.928 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -13.768 -6.084 -7.737 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -16.414 -4.685 -8.030 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -15.935 -5.841 -9.256 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -15.352 -7.323 -7.080 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -16.571 -6.291 -6.359 1.00 0.00 H new ATOM 0 HE ARG A 73 -17.604 -7.252 -8.835 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -16.652 -8.421 -5.644 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -17.795 -9.769 -5.669 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -19.070 -8.983 -8.861 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -19.159 -10.086 -7.483 1.00 0.00 H new ATOM 1088 N GLY A 74 -15.604 -2.391 -6.103 1.00 0.00 N ATOM 1089 CA GLY A 74 -16.469 -1.234 -6.243 1.00 0.00 C ATOM 1090 C GLY A 74 -16.435 -0.334 -5.024 1.00 0.00 C ATOM 1091 O GLY A 74 -17.480 0.058 -4.505 1.00 0.00 O ATOM 0 H GLY A 74 -15.505 -2.739 -5.149 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -16.167 -0.663 -7.121 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -17.492 -1.568 -6.416 1.00 0.00 H new ATOM 1095 N ALA A 75 -15.232 -0.006 -4.566 1.00 0.00 N ATOM 1096 CA ALA A 75 -15.067 0.854 -3.400 1.00 0.00 C ATOM 1097 C ALA A 75 -13.691 1.512 -3.394 1.00 0.00 C ATOM 1098 O ALA A 75 -12.667 0.833 -3.471 1.00 0.00 O ATOM 1099 CB ALA A 75 -15.278 0.056 -2.122 1.00 0.00 C ATOM 0 H ALA A 75 -14.357 -0.322 -4.984 1.00 0.00 H new ATOM 0 HA ALA A 75 -15.818 1.642 -3.451 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -15.152 0.710 -1.259 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -16.285 -0.362 -2.116 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -14.549 -0.753 -2.074 1.00 0.00 H new ATOM 1105 N SER A 76 -13.675 2.838 -3.303 1.00 0.00 N ATOM 1106 CA SER A 76 -12.425 3.588 -3.292 1.00 0.00 C ATOM 1107 C SER A 76 -11.507 3.098 -2.176 1.00 0.00 C ATOM 1108 O SER A 76 -11.926 2.966 -1.026 1.00 0.00 O ATOM 1109 CB SER A 76 -12.704 5.082 -3.119 1.00 0.00 C ATOM 1110 OG SER A 76 -13.305 5.627 -4.281 1.00 0.00 O ATOM 0 H SER A 76 -14.514 3.415 -3.236 1.00 0.00 H new ATOM 0 HA SER A 76 -11.925 3.427 -4.247 1.00 0.00 H new ATOM 0 HB2 SER A 76 -13.359 5.236 -2.261 1.00 0.00 H new ATOM 0 HB3 SER A 76 -11.772 5.607 -2.907 1.00 0.00 H new ATOM 0 HG SER A 76 -13.475 6.582 -4.144 1.00 0.00 H new ATOM 1116 N TYR A 77 -10.254 2.831 -2.524 1.00 0.00 N ATOM 1117 CA TYR A 77 -9.276 2.353 -1.553 1.00 0.00 C ATOM 1118 C TYR A 77 -7.981 3.154 -1.646 1.00 0.00 C ATOM 1119 O TYR A 77 -7.248 3.061 -2.632 1.00 0.00 O ATOM 1120 CB TYR A 77 -8.988 0.868 -1.777 1.00 0.00 C ATOM 1121 CG TYR A 77 -9.956 -0.051 -1.068 1.00 0.00 C ATOM 1122 CD1 TYR A 77 -9.948 -0.164 0.317 1.00 0.00 C ATOM 1123 CD2 TYR A 77 -10.879 -0.806 -1.782 1.00 0.00 C ATOM 1124 CE1 TYR A 77 -10.831 -1.003 0.970 1.00 0.00 C ATOM 1125 CE2 TYR A 77 -11.766 -1.646 -1.137 1.00 0.00 C ATOM 1126 CZ TYR A 77 -11.738 -1.741 0.239 1.00 0.00 C ATOM 1127 OH TYR A 77 -12.619 -2.578 0.884 1.00 0.00 O ATOM 0 H TYR A 77 -9.891 2.937 -3.471 1.00 0.00 H new ATOM 0 HA TYR A 77 -9.695 2.488 -0.556 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -9.018 0.658 -2.846 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -7.976 0.648 -1.437 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -9.240 0.413 0.893 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -10.903 -0.735 -2.859 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -10.811 -1.080 2.047 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -12.477 -2.225 -1.707 1.00 0.00 H new ATOM 0 HH TYR A 77 -13.190 -3.023 0.224 1.00 0.00 H new ATOM 1137 N LEU A 78 -7.704 3.940 -0.611 1.00 0.00 N ATOM 1138 CA LEU A 78 -6.497 4.758 -0.573 1.00 0.00 C ATOM 1139 C LEU A 78 -5.341 3.994 0.066 1.00 0.00 C ATOM 1140 O LEU A 78 -5.248 3.898 1.290 1.00 0.00 O ATOM 1141 CB LEU A 78 -6.757 6.051 0.201 1.00 0.00 C ATOM 1142 CG LEU A 78 -7.372 7.200 -0.600 1.00 0.00 C ATOM 1143 CD1 LEU A 78 -8.863 6.975 -0.797 1.00 0.00 C ATOM 1144 CD2 LEU A 78 -7.119 8.530 0.096 1.00 0.00 C ATOM 0 H LEU A 78 -8.299 4.028 0.213 1.00 0.00 H new ATOM 0 HA LEU A 78 -6.223 5.004 -1.599 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -7.417 5.824 1.038 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -5.813 6.394 0.624 1.00 0.00 H new ATOM 0 HG LEU A 78 -6.897 7.229 -1.581 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -9.283 7.802 -1.369 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -9.022 6.042 -1.338 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -9.354 6.919 0.175 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -7.563 9.336 -0.488 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -7.567 8.512 1.090 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -6.045 8.696 0.185 1.00 0.00 H new ATOM 1156 N VAL A 79 -4.462 3.452 -0.771 1.00 0.00 N ATOM 1157 CA VAL A 79 -3.311 2.699 -0.288 1.00 0.00 C ATOM 1158 C VAL A 79 -2.087 3.596 -0.148 1.00 0.00 C ATOM 1159 O VAL A 79 -1.874 4.502 -0.954 1.00 0.00 O ATOM 1160 CB VAL A 79 -2.971 1.528 -1.230 1.00 0.00 C ATOM 1161 CG1 VAL A 79 -1.849 0.682 -0.647 1.00 0.00 C ATOM 1162 CG2 VAL A 79 -4.206 0.681 -1.494 1.00 0.00 C ATOM 0 H VAL A 79 -4.525 3.520 -1.787 1.00 0.00 H new ATOM 0 HA VAL A 79 -3.580 2.302 0.691 1.00 0.00 H new ATOM 0 HB VAL A 79 -2.629 1.937 -2.181 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -1.623 -0.140 -1.326 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -0.960 1.298 -0.514 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -2.160 0.281 0.318 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -3.947 -0.141 -2.161 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -4.580 0.280 -0.552 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -4.977 1.296 -1.958 1.00 0.00 H new ATOM 1172 N GLN A 80 -1.284 3.338 0.880 1.00 0.00 N ATOM 1173 CA GLN A 80 -0.081 4.123 1.125 1.00 0.00 C ATOM 1174 C GLN A 80 1.074 3.228 1.561 1.00 0.00 C ATOM 1175 O GLN A 80 1.004 2.568 2.599 1.00 0.00 O ATOM 1176 CB GLN A 80 -0.349 5.186 2.192 1.00 0.00 C ATOM 1177 CG GLN A 80 -1.110 6.394 1.670 1.00 0.00 C ATOM 1178 CD GLN A 80 -1.658 7.264 2.783 1.00 0.00 C ATOM 1179 OE1 GLN A 80 -2.803 7.104 3.206 1.00 0.00 O ATOM 1180 NE2 GLN A 80 -0.841 8.193 3.266 1.00 0.00 N ATOM 0 H GLN A 80 -1.445 2.591 1.556 1.00 0.00 H new ATOM 0 HA GLN A 80 0.197 4.615 0.193 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -0.915 4.736 3.008 1.00 0.00 H new ATOM 0 HB3 GLN A 80 0.602 5.518 2.609 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -0.450 6.990 1.040 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -1.933 6.056 1.040 1.00 0.00 H new ATOM 0 HE21 GLN A 80 0.101 8.291 2.886 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -1.155 8.808 4.017 1.00 0.00 H new ATOM 1189 N VAL A 81 2.136 3.209 0.763 1.00 0.00 N ATOM 1190 CA VAL A 81 3.307 2.394 1.067 1.00 0.00 C ATOM 1191 C VAL A 81 4.452 3.253 1.592 1.00 0.00 C ATOM 1192 O VAL A 81 4.787 4.284 1.008 1.00 0.00 O ATOM 1193 CB VAL A 81 3.789 1.619 -0.174 1.00 0.00 C ATOM 1194 CG1 VAL A 81 5.013 0.780 0.162 1.00 0.00 C ATOM 1195 CG2 VAL A 81 2.670 0.747 -0.724 1.00 0.00 C ATOM 0 H VAL A 81 2.210 3.749 -0.099 1.00 0.00 H new ATOM 0 HA VAL A 81 3.007 1.683 1.836 1.00 0.00 H new ATOM 0 HB VAL A 81 4.071 2.338 -0.943 1.00 0.00 H new ATOM 0 HG11 VAL A 81 5.339 0.240 -0.727 1.00 0.00 H new ATOM 0 HG12 VAL A 81 5.817 1.431 0.506 1.00 0.00 H new ATOM 0 HG13 VAL A 81 4.761 0.068 0.948 1.00 0.00 H new ATOM 0 HG21 VAL A 81 3.027 0.206 -1.600 1.00 0.00 H new ATOM 0 HG22 VAL A 81 2.356 0.034 0.039 1.00 0.00 H new ATOM 0 HG23 VAL A 81 1.824 1.375 -1.005 1.00 0.00 H new ATOM 1205 N ARG A 82 5.049 2.821 2.698 1.00 0.00 N ATOM 1206 CA ARG A 82 6.157 3.550 3.303 1.00 0.00 C ATOM 1207 C ARG A 82 7.370 2.642 3.487 1.00 0.00 C ATOM 1208 O ARG A 82 7.235 1.424 3.592 1.00 0.00 O ATOM 1209 CB ARG A 82 5.735 4.135 4.652 1.00 0.00 C ATOM 1210 CG ARG A 82 5.600 3.094 5.751 1.00 0.00 C ATOM 1211 CD ARG A 82 5.591 3.737 7.129 1.00 0.00 C ATOM 1212 NE ARG A 82 5.049 2.842 8.148 1.00 0.00 N ATOM 1213 CZ ARG A 82 4.524 3.263 9.293 1.00 0.00 C ATOM 1214 NH1 ARG A 82 4.470 4.560 9.563 1.00 0.00 N ATOM 1215 NH2 ARG A 82 4.052 2.387 10.170 1.00 0.00 N ATOM 0 H ARG A 82 4.784 1.970 3.193 1.00 0.00 H new ATOM 0 HA ARG A 82 6.432 4.364 2.632 1.00 0.00 H new ATOM 0 HB2 ARG A 82 6.466 4.883 4.959 1.00 0.00 H new ATOM 0 HB3 ARG A 82 4.782 4.651 4.533 1.00 0.00 H new ATOM 0 HG2 ARG A 82 4.680 2.528 5.606 1.00 0.00 H new ATOM 0 HG3 ARG A 82 6.425 2.384 5.685 1.00 0.00 H new ATOM 0 HD2 ARG A 82 6.607 4.024 7.402 1.00 0.00 H new ATOM 0 HD3 ARG A 82 4.999 4.652 7.098 1.00 0.00 H new ATOM 0 HE ARG A 82 5.075 1.838 7.970 1.00 0.00 H new ATOM 0 HH11 ARG A 82 4.832 5.236 8.891 1.00 0.00 H new ATOM 0 HH12 ARG A 82 4.066 4.881 10.443 1.00 0.00 H new ATOM 0 HH21 ARG A 82 4.092 1.389 9.965 1.00 0.00 H new ATOM 0 HH22 ARG A 82 3.649 2.712 11.049 1.00 0.00 H new ATOM 1229 N ALA A 83 8.554 3.245 3.524 1.00 0.00 N ATOM 1230 CA ALA A 83 9.789 2.492 3.697 1.00 0.00 C ATOM 1231 C ALA A 83 10.398 2.744 5.073 1.00 0.00 C ATOM 1232 O ALA A 83 10.083 3.738 5.728 1.00 0.00 O ATOM 1233 CB ALA A 83 10.784 2.852 2.604 1.00 0.00 C ATOM 0 H ALA A 83 8.683 4.253 3.436 1.00 0.00 H new ATOM 0 HA ALA A 83 9.552 1.431 3.622 1.00 0.00 H new ATOM 0 HB1 ALA A 83 11.702 2.282 2.746 1.00 0.00 H new ATOM 0 HB2 ALA A 83 10.356 2.615 1.630 1.00 0.00 H new ATOM 0 HB3 ALA A 83 11.008 3.918 2.652 1.00 0.00 H new ATOM 1239 N ARG A 84 11.270 1.839 5.504 1.00 0.00 N ATOM 1240 CA ARG A 84 11.921 1.963 6.802 1.00 0.00 C ATOM 1241 C ARG A 84 13.437 1.847 6.664 1.00 0.00 C ATOM 1242 O ARG A 84 13.938 1.111 5.814 1.00 0.00 O ATOM 1243 CB ARG A 84 11.403 0.890 7.761 1.00 0.00 C ATOM 1244 CG ARG A 84 11.896 1.059 9.189 1.00 0.00 C ATOM 1245 CD ARG A 84 11.989 -0.278 9.908 1.00 0.00 C ATOM 1246 NE ARG A 84 10.733 -0.636 10.561 1.00 0.00 N ATOM 1247 CZ ARG A 84 10.636 -1.560 11.510 1.00 0.00 C ATOM 1248 NH1 ARG A 84 11.715 -2.215 11.916 1.00 0.00 N ATOM 1249 NH2 ARG A 84 9.457 -1.830 12.057 1.00 0.00 N ATOM 0 H ARG A 84 11.542 1.012 4.973 1.00 0.00 H new ATOM 0 HA ARG A 84 11.684 2.947 7.206 1.00 0.00 H new ATOM 0 HB2 ARG A 84 10.313 0.907 7.758 1.00 0.00 H new ATOM 0 HB3 ARG A 84 11.707 -0.090 7.394 1.00 0.00 H new ATOM 0 HG2 ARG A 84 12.875 1.539 9.183 1.00 0.00 H new ATOM 0 HG3 ARG A 84 11.220 1.720 9.733 1.00 0.00 H new ATOM 0 HD2 ARG A 84 12.261 -1.055 9.194 1.00 0.00 H new ATOM 0 HD3 ARG A 84 12.785 -0.235 10.651 1.00 0.00 H new ATOM 0 HE ARG A 84 9.884 -0.150 10.273 1.00 0.00 H new ATOM 0 HH11 ARG A 84 12.623 -2.010 11.499 1.00 0.00 H new ATOM 0 HH12 ARG A 84 11.637 -2.924 12.645 1.00 0.00 H new ATOM 0 HH21 ARG A 84 8.625 -1.328 11.748 1.00 0.00 H new ATOM 0 HH22 ARG A 84 9.383 -2.540 12.786 1.00 0.00 H new ATOM 1263 N SER A 85 14.160 2.580 7.504 1.00 0.00 N ATOM 1264 CA SER A 85 15.618 2.564 7.473 1.00 0.00 C ATOM 1265 C SER A 85 16.189 2.378 8.875 1.00 0.00 C ATOM 1266 O SER A 85 15.467 2.465 9.867 1.00 0.00 O ATOM 1267 CB SER A 85 16.151 3.861 6.861 1.00 0.00 C ATOM 1268 OG SER A 85 15.867 4.972 7.693 1.00 0.00 O ATOM 0 H SER A 85 13.760 3.193 8.215 1.00 0.00 H new ATOM 0 HA SER A 85 15.934 1.723 6.856 1.00 0.00 H new ATOM 0 HB2 SER A 85 17.228 3.781 6.711 1.00 0.00 H new ATOM 0 HB3 SER A 85 15.703 4.014 5.879 1.00 0.00 H new ATOM 0 HG SER A 85 16.219 5.788 7.280 1.00 0.00 H new ATOM 1274 N GLU A 86 17.492 2.121 8.947 1.00 0.00 N ATOM 1275 CA GLU A 86 18.160 1.921 10.228 1.00 0.00 C ATOM 1276 C GLU A 86 17.559 2.824 11.302 1.00 0.00 C ATOM 1277 O GLU A 86 17.335 2.395 12.433 1.00 0.00 O ATOM 1278 CB GLU A 86 19.659 2.198 10.094 1.00 0.00 C ATOM 1279 CG GLU A 86 20.396 1.167 9.255 1.00 0.00 C ATOM 1280 CD GLU A 86 21.889 1.161 9.518 1.00 0.00 C ATOM 1281 OE1 GLU A 86 22.522 2.228 9.375 1.00 0.00 O ATOM 1282 OE2 GLU A 86 22.425 0.088 9.866 1.00 0.00 O ATOM 0 H GLU A 86 18.105 2.047 8.135 1.00 0.00 H new ATOM 0 HA GLU A 86 18.014 0.883 10.527 1.00 0.00 H new ATOM 0 HB2 GLU A 86 19.800 3.183 9.650 1.00 0.00 H new ATOM 0 HB3 GLU A 86 20.104 2.230 11.088 1.00 0.00 H new ATOM 0 HG2 GLU A 86 19.990 0.177 9.463 1.00 0.00 H new ATOM 0 HG3 GLU A 86 20.218 1.369 8.199 1.00 0.00 H new ATOM 1289 N ALA A 87 17.302 4.076 10.938 1.00 0.00 N ATOM 1290 CA ALA A 87 16.726 5.038 11.869 1.00 0.00 C ATOM 1291 C ALA A 87 15.323 4.619 12.295 1.00 0.00 C ATOM 1292 O ALA A 87 15.050 4.444 13.481 1.00 0.00 O ATOM 1293 CB ALA A 87 16.697 6.425 11.243 1.00 0.00 C ATOM 0 H ALA A 87 17.484 4.447 10.006 1.00 0.00 H new ATOM 0 HA ALA A 87 17.354 5.065 12.759 1.00 0.00 H new ATOM 0 HB1 ALA A 87 16.264 7.134 11.949 1.00 0.00 H new ATOM 0 HB2 ALA A 87 17.713 6.734 10.995 1.00 0.00 H new ATOM 0 HB3 ALA A 87 16.093 6.402 10.336 1.00 0.00 H new ATOM 1299 N GLY A 88 14.436 4.459 11.317 1.00 0.00 N ATOM 1300 CA GLY A 88 13.071 4.062 11.612 1.00 0.00 C ATOM 1301 C GLY A 88 12.160 4.179 10.406 1.00 0.00 C ATOM 1302 O GLY A 88 12.629 4.306 9.275 1.00 0.00 O ATOM 0 H GLY A 88 14.638 4.597 10.327 1.00 0.00 H new ATOM 0 HA2 GLY A 88 13.065 3.032 11.970 1.00 0.00 H new ATOM 0 HA3 GLY A 88 12.682 4.683 12.419 1.00 0.00 H new ATOM 1306 N TYR A 89 10.855 4.136 10.646 1.00 0.00 N ATOM 1307 CA TYR A 89 9.875 4.234 9.570 1.00 0.00 C ATOM 1308 C TYR A 89 9.889 5.626 8.947 1.00 0.00 C ATOM 1309 O TYR A 89 10.106 6.624 9.633 1.00 0.00 O ATOM 1310 CB TYR A 89 8.475 3.912 10.096 1.00 0.00 C ATOM 1311 CG TYR A 89 8.123 2.443 10.018 1.00 0.00 C ATOM 1312 CD1 TYR A 89 8.216 1.748 8.819 1.00 0.00 C ATOM 1313 CD2 TYR A 89 7.696 1.751 11.145 1.00 0.00 C ATOM 1314 CE1 TYR A 89 7.894 0.407 8.743 1.00 0.00 C ATOM 1315 CE2 TYR A 89 7.373 0.409 11.079 1.00 0.00 C ATOM 1316 CZ TYR A 89 7.473 -0.258 9.876 1.00 0.00 C ATOM 1317 OH TYR A 89 7.153 -1.594 9.805 1.00 0.00 O ATOM 0 H TYR A 89 10.450 4.034 11.577 1.00 0.00 H new ATOM 0 HA TYR A 89 10.142 3.509 8.801 1.00 0.00 H new ATOM 0 HB2 TYR A 89 8.401 4.240 11.133 1.00 0.00 H new ATOM 0 HB3 TYR A 89 7.742 4.484 9.527 1.00 0.00 H new ATOM 0 HD1 TYR A 89 8.546 2.265 7.930 1.00 0.00 H new ATOM 0 HD2 TYR A 89 7.615 2.271 12.088 1.00 0.00 H new ATOM 0 HE1 TYR A 89 7.971 -0.118 7.802 1.00 0.00 H new ATOM 0 HE2 TYR A 89 7.044 -0.115 11.964 1.00 0.00 H new ATOM 0 HH TYR A 89 6.505 -1.737 9.084 1.00 0.00 H new ATOM 1327 N GLY A 90 9.654 5.684 7.639 1.00 0.00 N ATOM 1328 CA GLY A 90 9.643 6.958 6.944 1.00 0.00 C ATOM 1329 C GLY A 90 8.239 7.434 6.628 1.00 0.00 C ATOM 1330 O GLY A 90 7.253 6.748 6.898 1.00 0.00 O ATOM 0 H GLY A 90 9.471 4.872 7.049 1.00 0.00 H new ATOM 0 HA2 GLY A 90 10.148 7.706 7.555 1.00 0.00 H new ATOM 0 HA3 GLY A 90 10.210 6.868 6.017 1.00 0.00 H new ATOM 1334 N PRO A 91 8.135 8.636 6.043 1.00 0.00 N ATOM 1335 CA PRO A 91 6.845 9.231 5.679 1.00 0.00 C ATOM 1336 C PRO A 91 6.177 8.500 4.519 1.00 0.00 C ATOM 1337 O PRO A 91 6.844 8.063 3.581 1.00 0.00 O ATOM 1338 CB PRO A 91 7.216 10.658 5.270 1.00 0.00 C ATOM 1339 CG PRO A 91 8.638 10.571 4.835 1.00 0.00 C ATOM 1340 CD PRO A 91 9.268 9.508 5.693 1.00 0.00 C ATOM 0 HA PRO A 91 6.127 9.181 6.497 1.00 0.00 H new ATOM 0 HB2 PRO A 91 6.577 11.017 4.464 1.00 0.00 H new ATOM 0 HB3 PRO A 91 7.099 11.351 6.103 1.00 0.00 H new ATOM 0 HG2 PRO A 91 8.708 10.312 3.778 1.00 0.00 H new ATOM 0 HG3 PRO A 91 9.145 11.527 4.963 1.00 0.00 H new ATOM 0 HD2 PRO A 91 10.043 8.963 5.154 1.00 0.00 H new ATOM 0 HD3 PRO A 91 9.737 9.933 6.580 1.00 0.00 H new ATOM 1348 N PHE A 92 4.857 8.372 4.589 1.00 0.00 N ATOM 1349 CA PHE A 92 4.098 7.694 3.544 1.00 0.00 C ATOM 1350 C PHE A 92 4.273 8.398 2.201 1.00 0.00 C ATOM 1351 O PHE A 92 4.486 9.608 2.146 1.00 0.00 O ATOM 1352 CB PHE A 92 2.615 7.639 3.915 1.00 0.00 C ATOM 1353 CG PHE A 92 2.255 6.460 4.773 1.00 0.00 C ATOM 1354 CD1 PHE A 92 2.295 5.174 4.259 1.00 0.00 C ATOM 1355 CD2 PHE A 92 1.875 6.638 6.093 1.00 0.00 C ATOM 1356 CE1 PHE A 92 1.965 4.087 5.046 1.00 0.00 C ATOM 1357 CE2 PHE A 92 1.543 5.555 6.885 1.00 0.00 C ATOM 1358 CZ PHE A 92 1.587 4.278 6.360 1.00 0.00 C ATOM 0 H PHE A 92 4.290 8.729 5.358 1.00 0.00 H new ATOM 0 HA PHE A 92 4.480 6.677 3.454 1.00 0.00 H new ATOM 0 HB2 PHE A 92 2.346 8.556 4.440 1.00 0.00 H new ATOM 0 HB3 PHE A 92 2.021 7.608 3.002 1.00 0.00 H new ATOM 0 HD1 PHE A 92 2.588 5.019 3.231 1.00 0.00 H new ATOM 0 HD2 PHE A 92 1.838 7.634 6.508 1.00 0.00 H new ATOM 0 HE1 PHE A 92 2.003 3.090 4.634 1.00 0.00 H new ATOM 0 HE2 PHE A 92 1.250 5.707 7.913 1.00 0.00 H new ATOM 0 HZ PHE A 92 1.326 3.430 6.976 1.00 0.00 H new ATOM 1368 N GLY A 93 4.181 7.629 1.120 1.00 0.00 N ATOM 1369 CA GLY A 93 4.332 8.195 -0.207 1.00 0.00 C ATOM 1370 C GLY A 93 3.075 8.893 -0.686 1.00 0.00 C ATOM 1371 O GLY A 93 2.031 8.818 -0.039 1.00 0.00 O ATOM 0 H GLY A 93 4.005 6.625 1.140 1.00 0.00 H new ATOM 0 HA2 GLY A 93 5.159 8.905 -0.204 1.00 0.00 H new ATOM 0 HA3 GLY A 93 4.594 7.403 -0.909 1.00 0.00 H new ATOM 1375 N GLN A 94 3.175 9.576 -1.822 1.00 0.00 N ATOM 1376 CA GLN A 94 2.037 10.292 -2.385 1.00 0.00 C ATOM 1377 C GLN A 94 0.795 9.408 -2.410 1.00 0.00 C ATOM 1378 O GLN A 94 0.770 8.376 -3.079 1.00 0.00 O ATOM 1379 CB GLN A 94 2.361 10.776 -3.800 1.00 0.00 C ATOM 1380 CG GLN A 94 1.288 11.673 -4.396 1.00 0.00 C ATOM 1381 CD GLN A 94 1.457 11.871 -5.890 1.00 0.00 C ATOM 1382 OE1 GLN A 94 1.469 10.908 -6.658 1.00 0.00 O ATOM 1383 NE2 GLN A 94 1.589 13.123 -6.311 1.00 0.00 N ATOM 0 H GLN A 94 4.032 9.648 -2.370 1.00 0.00 H new ATOM 0 HA GLN A 94 1.834 11.155 -1.751 1.00 0.00 H new ATOM 0 HB2 GLN A 94 3.307 11.317 -3.782 1.00 0.00 H new ATOM 0 HB3 GLN A 94 2.501 9.911 -4.448 1.00 0.00 H new ATOM 0 HG2 GLN A 94 0.307 11.240 -4.199 1.00 0.00 H new ATOM 0 HG3 GLN A 94 1.314 12.643 -3.899 1.00 0.00 H new ATOM 0 HE21 GLN A 94 1.573 13.891 -5.640 1.00 0.00 H new ATOM 0 HE22 GLN A 94 1.706 13.317 -7.306 1.00 0.00 H new ATOM 1392 N GLU A 95 -0.234 9.820 -1.674 1.00 0.00 N ATOM 1393 CA GLU A 95 -1.479 9.063 -1.611 1.00 0.00 C ATOM 1394 C GLU A 95 -1.818 8.461 -2.972 1.00 0.00 C ATOM 1395 O GLU A 95 -1.568 9.069 -4.013 1.00 0.00 O ATOM 1396 CB GLU A 95 -2.624 9.961 -1.138 1.00 0.00 C ATOM 1397 CG GLU A 95 -2.600 11.351 -1.750 1.00 0.00 C ATOM 1398 CD GLU A 95 -3.398 11.436 -3.037 1.00 0.00 C ATOM 1399 OE1 GLU A 95 -4.625 11.214 -2.990 1.00 0.00 O ATOM 1400 OE2 GLU A 95 -2.793 11.726 -4.091 1.00 0.00 O ATOM 0 H GLU A 95 -0.230 10.673 -1.114 1.00 0.00 H new ATOM 0 HA GLU A 95 -1.346 8.251 -0.897 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -3.573 9.483 -1.380 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -2.580 10.050 -0.053 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -2.999 12.067 -1.032 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -1.567 11.639 -1.947 1.00 0.00 H new ATOM 1407 N HIS A 96 -2.391 7.261 -2.955 1.00 0.00 N ATOM 1408 CA HIS A 96 -2.765 6.576 -4.187 1.00 0.00 C ATOM 1409 C HIS A 96 -4.209 6.086 -4.119 1.00 0.00 C ATOM 1410 O HIS A 96 -4.796 5.999 -3.039 1.00 0.00 O ATOM 1411 CB HIS A 96 -1.827 5.397 -4.445 1.00 0.00 C ATOM 1412 CG HIS A 96 -2.385 4.385 -5.398 1.00 0.00 C ATOM 1413 ND1 HIS A 96 -3.234 3.371 -5.008 1.00 0.00 N ATOM 1414 CD2 HIS A 96 -2.211 4.235 -6.732 1.00 0.00 C ATOM 1415 CE1 HIS A 96 -3.558 2.641 -6.060 1.00 0.00 C ATOM 1416 NE2 HIS A 96 -2.950 3.145 -7.119 1.00 0.00 N ATOM 0 H HIS A 96 -2.606 6.744 -2.103 1.00 0.00 H new ATOM 0 HA HIS A 96 -2.678 7.286 -5.009 1.00 0.00 H new ATOM 0 HB2 HIS A 96 -0.883 5.774 -4.839 1.00 0.00 H new ATOM 0 HB3 HIS A 96 -1.603 4.907 -3.497 1.00 0.00 H new ATOM 0 HD2 HIS A 96 -1.604 4.857 -7.373 1.00 0.00 H new ATOM 0 HE1 HIS A 96 -4.209 1.779 -6.055 1.00 0.00 H new ATOM 0 HE2 HIS A 96 -3.019 2.783 -8.070 1.00 0.00 H new ATOM 1425 N HIS A 97 -4.777 5.769 -5.278 1.00 0.00 N ATOM 1426 CA HIS A 97 -6.152 5.288 -5.349 1.00 0.00 C ATOM 1427 C HIS A 97 -6.306 4.245 -6.452 1.00 0.00 C ATOM 1428 O HIS A 97 -6.246 4.568 -7.638 1.00 0.00 O ATOM 1429 CB HIS A 97 -7.110 6.454 -5.597 1.00 0.00 C ATOM 1430 CG HIS A 97 -6.520 7.546 -6.435 1.00 0.00 C ATOM 1431 ND1 HIS A 97 -6.262 7.405 -7.783 1.00 0.00 N ATOM 1432 CD2 HIS A 97 -6.138 8.804 -6.111 1.00 0.00 C ATOM 1433 CE1 HIS A 97 -5.746 8.528 -8.250 1.00 0.00 C ATOM 1434 NE2 HIS A 97 -5.661 9.393 -7.256 1.00 0.00 N ATOM 0 H HIS A 97 -4.307 5.836 -6.181 1.00 0.00 H new ATOM 0 HA HIS A 97 -6.398 4.822 -4.395 1.00 0.00 H new ATOM 0 HB2 HIS A 97 -8.009 6.078 -6.086 1.00 0.00 H new ATOM 0 HB3 HIS A 97 -7.419 6.870 -4.638 1.00 0.00 H new ATOM 0 HD1 HIS A 97 -6.442 6.565 -8.333 1.00 0.00 H new ATOM 0 HD2 HIS A 97 -6.197 9.260 -5.134 1.00 0.00 H new ATOM 0 HE1 HIS A 97 -5.445 8.708 -9.271 1.00 0.00 H new ATOM 1443 N SER A 98 -6.505 2.993 -6.052 1.00 0.00 N ATOM 1444 CA SER A 98 -6.664 1.902 -7.006 1.00 0.00 C ATOM 1445 C SER A 98 -7.880 2.132 -7.897 1.00 0.00 C ATOM 1446 O SER A 98 -8.780 2.897 -7.552 1.00 0.00 O ATOM 1447 CB SER A 98 -6.802 0.568 -6.269 1.00 0.00 C ATOM 1448 OG SER A 98 -7.919 0.581 -5.397 1.00 0.00 O ATOM 0 H SER A 98 -6.560 2.709 -5.074 1.00 0.00 H new ATOM 0 HA SER A 98 -5.775 1.871 -7.636 1.00 0.00 H new ATOM 0 HB2 SER A 98 -6.910 -0.241 -6.992 1.00 0.00 H new ATOM 0 HB3 SER A 98 -5.894 0.368 -5.700 1.00 0.00 H new ATOM 0 HG SER A 98 -7.987 -0.283 -4.939 1.00 0.00 H new ATOM 1454 N GLN A 99 -7.899 1.463 -9.046 1.00 0.00 N ATOM 1455 CA GLN A 99 -9.004 1.595 -9.988 1.00 0.00 C ATOM 1456 C GLN A 99 -9.621 0.235 -10.297 1.00 0.00 C ATOM 1457 O GLN A 99 -9.205 -0.450 -11.233 1.00 0.00 O ATOM 1458 CB GLN A 99 -8.524 2.256 -11.281 1.00 0.00 C ATOM 1459 CG GLN A 99 -9.653 2.633 -12.227 1.00 0.00 C ATOM 1460 CD GLN A 99 -9.150 3.098 -13.579 1.00 0.00 C ATOM 1461 OE1 GLN A 99 -8.026 2.790 -13.976 1.00 0.00 O ATOM 1462 NE2 GLN A 99 -9.982 3.846 -14.295 1.00 0.00 N ATOM 0 H GLN A 99 -7.162 0.825 -9.346 1.00 0.00 H new ATOM 0 HA GLN A 99 -9.767 2.224 -9.529 1.00 0.00 H new ATOM 0 HB2 GLN A 99 -7.955 3.152 -11.032 1.00 0.00 H new ATOM 0 HB3 GLN A 99 -7.842 1.578 -11.794 1.00 0.00 H new ATOM 0 HG2 GLN A 99 -10.310 1.774 -12.364 1.00 0.00 H new ATOM 0 HG3 GLN A 99 -10.252 3.423 -11.775 1.00 0.00 H new ATOM 0 HE21 GLN A 99 -10.905 4.077 -13.927 1.00 0.00 H new ATOM 0 HE22 GLN A 99 -9.698 4.189 -15.213 1.00 0.00 H new ATOM 1471 N THR A 100 -10.616 -0.153 -9.505 1.00 0.00 N ATOM 1472 CA THR A 100 -11.289 -1.431 -9.693 1.00 0.00 C ATOM 1473 C THR A 100 -12.457 -1.301 -10.664 1.00 0.00 C ATOM 1474 O THR A 100 -13.520 -1.883 -10.451 1.00 0.00 O ATOM 1475 CB THR A 100 -11.808 -1.995 -8.356 1.00 0.00 C ATOM 1476 OG1 THR A 100 -12.816 -1.131 -7.819 1.00 0.00 O ATOM 1477 CG2 THR A 100 -10.673 -2.143 -7.354 1.00 0.00 C ATOM 0 H THR A 100 -10.973 0.401 -8.727 1.00 0.00 H new ATOM 0 HA THR A 100 -10.551 -2.118 -10.107 1.00 0.00 H new ATOM 0 HB THR A 100 -12.236 -2.980 -8.544 1.00 0.00 H new ATOM 0 HG1 THR A 100 -12.805 -1.184 -6.840 1.00 0.00 H new ATOM 0 HG21 THR A 100 -11.064 -2.543 -6.418 1.00 0.00 H new ATOM 0 HG22 THR A 100 -9.921 -2.824 -7.754 1.00 0.00 H new ATOM 0 HG23 THR A 100 -10.220 -1.169 -7.171 1.00 0.00 H new ATOM 1485 N GLN A 101 -12.251 -0.533 -11.729 1.00 0.00 N ATOM 1486 CA GLN A 101 -13.288 -0.327 -12.733 1.00 0.00 C ATOM 1487 C GLN A 101 -14.426 0.521 -12.174 1.00 0.00 C ATOM 1488 O GLN A 101 -15.592 0.317 -12.515 1.00 0.00 O ATOM 1489 CB GLN A 101 -13.831 -1.672 -13.220 1.00 0.00 C ATOM 1490 CG GLN A 101 -14.491 -1.602 -14.588 1.00 0.00 C ATOM 1491 CD GLN A 101 -15.972 -1.288 -14.506 1.00 0.00 C ATOM 1492 OE1 GLN A 101 -16.741 -2.024 -13.888 1.00 0.00 O ATOM 1493 NE2 GLN A 101 -16.380 -0.189 -15.130 1.00 0.00 N ATOM 0 H GLN A 101 -11.376 -0.044 -11.919 1.00 0.00 H new ATOM 0 HA GLN A 101 -12.843 0.204 -13.575 1.00 0.00 H new ATOM 0 HB2 GLN A 101 -13.014 -2.393 -13.256 1.00 0.00 H new ATOM 0 HB3 GLN A 101 -14.554 -2.046 -12.496 1.00 0.00 H new ATOM 0 HG2 GLN A 101 -13.994 -0.839 -15.188 1.00 0.00 H new ATOM 0 HG3 GLN A 101 -14.353 -2.553 -15.103 1.00 0.00 H new ATOM 0 HE21 GLN A 101 -15.708 0.393 -15.631 1.00 0.00 H new ATOM 0 HE22 GLN A 101 -17.365 0.074 -15.109 1.00 0.00 H new ATOM 1502 N LEU A 102 -14.080 1.473 -11.314 1.00 0.00 N ATOM 1503 CA LEU A 102 -15.072 2.353 -10.707 1.00 0.00 C ATOM 1504 C LEU A 102 -15.736 3.234 -11.760 1.00 0.00 C ATOM 1505 O LEU A 102 -16.962 3.293 -11.852 1.00 0.00 O ATOM 1506 CB LEU A 102 -14.420 3.225 -9.633 1.00 0.00 C ATOM 1507 CG LEU A 102 -14.085 2.528 -8.314 1.00 0.00 C ATOM 1508 CD1 LEU A 102 -12.933 3.233 -7.616 1.00 0.00 C ATOM 1509 CD2 LEU A 102 -15.308 2.478 -7.411 1.00 0.00 C ATOM 0 H LEU A 102 -13.120 1.655 -11.022 1.00 0.00 H new ATOM 0 HA LEU A 102 -15.839 1.731 -10.245 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -13.501 3.644 -10.043 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -15.085 4.062 -9.420 1.00 0.00 H new ATOM 0 HG LEU A 102 -13.779 1.505 -8.533 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -12.708 2.723 -6.679 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -12.053 3.216 -8.259 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -13.211 4.267 -7.409 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -15.051 1.978 -6.477 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -15.645 3.493 -7.199 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -16.106 1.927 -7.909 1.00 0.00 H new ATOM 1521 N ASP A 103 -14.918 3.916 -12.554 1.00 0.00 N ATOM 1522 CA ASP A 103 -15.425 4.792 -13.604 1.00 0.00 C ATOM 1523 C ASP A 103 -14.398 4.953 -14.721 1.00 0.00 C ATOM 1524 O ASP A 103 -13.192 4.950 -14.474 1.00 0.00 O ATOM 1525 CB ASP A 103 -15.786 6.161 -13.025 1.00 0.00 C ATOM 1526 CG ASP A 103 -17.200 6.204 -12.480 1.00 0.00 C ATOM 1527 OD1 ASP A 103 -18.137 6.413 -13.278 1.00 0.00 O ATOM 1528 OD2 ASP A 103 -17.369 6.029 -11.255 1.00 0.00 O ATOM 0 H ASP A 103 -13.901 3.879 -12.491 1.00 0.00 H new ATOM 0 HA ASP A 103 -16.322 4.335 -14.023 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -15.085 6.412 -12.229 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -15.675 6.920 -13.799 1.00 0.00 H new ATOM 1533 N SER A 104 -14.885 5.092 -15.950 1.00 0.00 N ATOM 1534 CA SER A 104 -14.009 5.249 -17.105 1.00 0.00 C ATOM 1535 C SER A 104 -13.556 6.698 -17.250 1.00 0.00 C ATOM 1536 O SER A 104 -14.029 7.583 -16.538 1.00 0.00 O ATOM 1537 CB SER A 104 -14.725 4.797 -18.380 1.00 0.00 C ATOM 1538 OG SER A 104 -13.796 4.435 -19.386 1.00 0.00 O ATOM 0 H SER A 104 -15.881 5.099 -16.171 1.00 0.00 H new ATOM 0 HA SER A 104 -13.129 4.625 -16.950 1.00 0.00 H new ATOM 0 HB2 SER A 104 -15.372 3.949 -18.156 1.00 0.00 H new ATOM 0 HB3 SER A 104 -15.366 5.600 -18.745 1.00 0.00 H new ATOM 0 HG SER A 104 -14.279 4.148 -20.189 1.00 0.00 H new ATOM 1544 N GLY A 105 -12.635 6.934 -18.180 1.00 0.00 N ATOM 1545 CA GLY A 105 -12.132 8.277 -18.402 1.00 0.00 C ATOM 1546 C GLY A 105 -10.637 8.382 -18.171 1.00 0.00 C ATOM 1547 O GLY A 105 -10.176 8.640 -17.059 1.00 0.00 O ATOM 0 H GLY A 105 -12.229 6.219 -18.783 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -12.361 8.583 -19.423 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -12.649 8.970 -17.738 1.00 0.00 H new ATOM 1551 N PRO A 106 -9.853 8.177 -19.240 1.00 0.00 N ATOM 1552 CA PRO A 106 -8.390 8.244 -19.174 1.00 0.00 C ATOM 1553 C PRO A 106 -7.885 9.665 -18.953 1.00 0.00 C ATOM 1554 O PRO A 106 -8.636 10.630 -19.091 1.00 0.00 O ATOM 1555 CB PRO A 106 -7.949 7.726 -20.545 1.00 0.00 C ATOM 1556 CG PRO A 106 -9.102 8.008 -21.445 1.00 0.00 C ATOM 1557 CD PRO A 106 -10.335 7.865 -20.597 1.00 0.00 C ATOM 0 HA PRO A 106 -7.992 7.668 -18.338 1.00 0.00 H new ATOM 0 HB2 PRO A 106 -7.046 8.232 -20.888 1.00 0.00 H new ATOM 0 HB3 PRO A 106 -7.724 6.660 -20.512 1.00 0.00 H new ATOM 0 HG2 PRO A 106 -9.032 9.011 -21.866 1.00 0.00 H new ATOM 0 HG3 PRO A 106 -9.122 7.311 -22.283 1.00 0.00 H new ATOM 0 HD2 PRO A 106 -11.121 8.551 -20.912 1.00 0.00 H new ATOM 0 HD3 PRO A 106 -10.748 6.858 -20.655 1.00 0.00 H new ATOM 1565 N SER A 107 -6.606 9.786 -18.609 1.00 0.00 N ATOM 1566 CA SER A 107 -6.001 11.090 -18.365 1.00 0.00 C ATOM 1567 C SER A 107 -5.443 11.681 -19.657 1.00 0.00 C ATOM 1568 O SER A 107 -5.227 10.966 -20.636 1.00 0.00 O ATOM 1569 CB SER A 107 -4.887 10.973 -17.323 1.00 0.00 C ATOM 1570 OG SER A 107 -4.705 12.196 -16.631 1.00 0.00 O ATOM 0 H SER A 107 -5.970 8.997 -18.493 1.00 0.00 H new ATOM 0 HA SER A 107 -6.776 11.756 -17.985 1.00 0.00 H new ATOM 0 HB2 SER A 107 -5.131 10.183 -16.613 1.00 0.00 H new ATOM 0 HB3 SER A 107 -3.956 10.686 -17.812 1.00 0.00 H new ATOM 0 HG SER A 107 -3.989 12.094 -15.970 1.00 0.00 H new ATOM 1576 N SER A 108 -5.213 12.990 -19.651 1.00 0.00 N ATOM 1577 CA SER A 108 -4.685 13.678 -20.823 1.00 0.00 C ATOM 1578 C SER A 108 -3.520 14.587 -20.440 1.00 0.00 C ATOM 1579 O SER A 108 -3.251 14.805 -19.260 1.00 0.00 O ATOM 1580 CB SER A 108 -5.785 14.498 -21.499 1.00 0.00 C ATOM 1581 OG SER A 108 -5.426 14.837 -22.827 1.00 0.00 O ATOM 0 H SER A 108 -5.384 13.595 -18.848 1.00 0.00 H new ATOM 0 HA SER A 108 -4.322 12.925 -21.522 1.00 0.00 H new ATOM 0 HB2 SER A 108 -6.715 13.930 -21.504 1.00 0.00 H new ATOM 0 HB3 SER A 108 -5.970 15.407 -20.926 1.00 0.00 H new ATOM 0 HG SER A 108 -6.146 15.359 -23.237 1.00 0.00 H new ATOM 1587 N GLY A 109 -2.833 15.114 -21.449 1.00 0.00 N ATOM 1588 CA GLY A 109 -1.705 15.993 -21.198 1.00 0.00 C ATOM 1589 C GLY A 109 -0.552 15.742 -22.150 1.00 0.00 C ATOM 1590 O GLY A 109 0.520 15.303 -21.734 1.00 0.00 O ATOM 0 H GLY A 109 -3.037 14.948 -22.435 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -2.029 17.030 -21.290 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -1.362 15.855 -20.173 1.00 0.00 H new TER 1594 GLY A 109