USER MOD reduce.3.24.130724 H: found=0, std=0, add=779, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 777 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 86 ASN : amide:sc= -5.05! C(o=-3.8!,f=-16!) USER MOD Set 1.2: A 88 THR OG1 : rot -117:sc= 1.22 USER MOD Set 2.1: A 73 HIS : no HD1:sc= 0.353 K(o=0.77,f=-1.3) USER MOD Set 2.2: A 76 SER OG : rot 136:sc= 0.413 USER MOD Set 3.1: A 28 THR OG1 : rot 171:sc= 0.021 USER MOD Set 3.2: A 68 THR OG1 : rot 180:sc= -0.315 USER MOD Set 4.1: A 23 HIS : no HD1:sc= -0.617 K(o=-0.74,f=-1.5) USER MOD Set 4.2: A 24 ASN : amide:sc= -0.119 K(o=-0.74,f=-1.5) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 29:sc= 0.193 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= -0.0228 USER MOD Single : A 6 SER OG : rot 90:sc= -0.64 USER MOD Single : A 12 THR OG1 : rot -100:sc= 1.27 USER MOD Single : A 16 GLN : amide:sc= -0.395 X(o=-0.39,f=0) USER MOD Single : A 20 CYS SG : rot 180:sc= 0.0426 USER MOD Single : A 21 CYS SG : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot 67:sc= 1.18 USER MOD Single : A 25 ASN : amide:sc= -1.14 K(o=-1.1,f=-6.1!) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 30 SER OG : rot 54:sc= 0.728 USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 GLN : amide:sc= 0.923 K(o=0.92,f=-0.024) USER MOD Single : A 37 SER OG : rot -90:sc= -3.33! USER MOD Single : A 38 THR OG1 : rot 180:sc= 0 USER MOD Single : A 44 TYR OH : rot 110:sc= 0 USER MOD Single : A 52 ASN : amide:sc= -1.82! K(o=-1.8!,f=-0.92) USER MOD Single : A 55 GLN : amide:sc= -1.83! C(o=-1.8!,f=-2.3!) USER MOD Single : A 60 TYR OH : rot 90:sc= -0.631 USER MOD Single : A 63 LYS NZ :NH3+ -149:sc= 0 (180deg=-0.0288) USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 MET CE :methyl 144:sc= 0 (180deg=-1.86) USER MOD Single : A 67 CYS SG : rot 154:sc= 2.02 USER MOD Single : A 75 ASN : amide:sc= -0.32 K(o=-0.32,f=0.6) USER MOD Single : A 77 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 TYR OH : rot 30:sc= -1.09 USER MOD Single : A 79 ASN : amide:sc= 0.132 K(o=0.13,f=-1.5!) USER MOD Single : A 83 LYS NZ :NH3+ 160:sc= -4.56! (180deg=-6.17!) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 SER OG : rot 136:sc= 1.21 USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 SER OG : rot -80:sc= -0.117 USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 THR OG1 : rot 180:sc= 0.96 USER MOD Single : A 100 GLN : amide:sc= -4.66! C(o=-4.7!,f=-1.9!) USER MOD Single : A 101 THR OG1 : rot -95:sc= 1.36 USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 108 SER OG : rot 42:sc= 0.468 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 27.510 4.550 -8.346 1.00 0.00 N ATOM 2 CA GLY A 1 27.126 3.171 -8.108 1.00 0.00 C ATOM 3 C GLY A 1 25.724 2.866 -8.600 1.00 0.00 C ATOM 4 O GLY A 1 25.503 2.699 -9.799 1.00 0.00 O ATOM 0 H1 GLY A 1 28.475 4.708 -7.992 1.00 0.00 H new ATOM 0 H2 GLY A 1 27.479 4.748 -9.367 1.00 0.00 H new ATOM 0 H3 GLY A 1 26.852 5.184 -7.850 1.00 0.00 H new ATOM 0 HA2 GLY A 1 27.834 2.509 -8.606 1.00 0.00 H new ATOM 0 HA3 GLY A 1 27.187 2.959 -7.041 1.00 0.00 H new ATOM 8 N SER A 2 24.776 2.792 -7.672 1.00 0.00 N ATOM 9 CA SER A 2 23.390 2.500 -8.017 1.00 0.00 C ATOM 10 C SER A 2 22.434 3.142 -7.016 1.00 0.00 C ATOM 11 O SER A 2 22.764 3.304 -5.842 1.00 0.00 O ATOM 12 CB SER A 2 23.161 0.988 -8.060 1.00 0.00 C ATOM 13 OG SER A 2 23.459 0.463 -9.342 1.00 0.00 O ATOM 0 H SER A 2 24.942 2.930 -6.675 1.00 0.00 H new ATOM 0 HA SER A 2 23.191 2.919 -9.003 1.00 0.00 H new ATOM 0 HB2 SER A 2 23.785 0.501 -7.310 1.00 0.00 H new ATOM 0 HB3 SER A 2 22.125 0.767 -7.805 1.00 0.00 H new ATOM 0 HG SER A 2 24.142 1.019 -9.772 1.00 0.00 H new ATOM 19 N SER A 3 21.247 3.507 -7.492 1.00 0.00 N ATOM 20 CA SER A 3 20.244 4.136 -6.641 1.00 0.00 C ATOM 21 C SER A 3 19.396 3.084 -5.933 1.00 0.00 C ATOM 22 O SER A 3 18.232 3.321 -5.612 1.00 0.00 O ATOM 23 CB SER A 3 19.346 5.057 -7.470 1.00 0.00 C ATOM 24 OG SER A 3 20.031 6.242 -7.836 1.00 0.00 O ATOM 0 H SER A 3 20.957 3.378 -8.461 1.00 0.00 H new ATOM 0 HA SER A 3 20.763 4.728 -5.887 1.00 0.00 H new ATOM 0 HB2 SER A 3 19.012 4.534 -8.366 1.00 0.00 H new ATOM 0 HB3 SER A 3 18.453 5.311 -6.898 1.00 0.00 H new ATOM 0 HG SER A 3 19.437 6.813 -8.366 1.00 0.00 H new ATOM 30 N GLY A 4 19.989 1.918 -5.693 1.00 0.00 N ATOM 31 CA GLY A 4 19.275 0.846 -5.024 1.00 0.00 C ATOM 32 C GLY A 4 19.903 -0.511 -5.271 1.00 0.00 C ATOM 33 O GLY A 4 21.108 -0.687 -5.092 1.00 0.00 O ATOM 0 H GLY A 4 20.951 1.697 -5.950 1.00 0.00 H new ATOM 0 HA2 GLY A 4 19.252 1.043 -3.952 1.00 0.00 H new ATOM 0 HA3 GLY A 4 18.241 0.832 -5.368 1.00 0.00 H new ATOM 37 N SER A 5 19.084 -1.474 -5.682 1.00 0.00 N ATOM 38 CA SER A 5 19.565 -2.824 -5.949 1.00 0.00 C ATOM 39 C SER A 5 20.387 -3.350 -4.776 1.00 0.00 C ATOM 40 O SER A 5 21.418 -3.995 -4.965 1.00 0.00 O ATOM 41 CB SER A 5 20.408 -2.846 -7.226 1.00 0.00 C ATOM 42 OG SER A 5 19.627 -2.502 -8.358 1.00 0.00 O ATOM 0 H SER A 5 18.084 -1.344 -5.837 1.00 0.00 H new ATOM 0 HA SER A 5 18.698 -3.471 -6.083 1.00 0.00 H new ATOM 0 HB2 SER A 5 21.240 -2.149 -7.129 1.00 0.00 H new ATOM 0 HB3 SER A 5 20.838 -3.838 -7.365 1.00 0.00 H new ATOM 0 HG SER A 5 20.188 -2.521 -9.161 1.00 0.00 H new ATOM 48 N SER A 6 19.922 -3.068 -3.563 1.00 0.00 N ATOM 49 CA SER A 6 20.615 -3.508 -2.358 1.00 0.00 C ATOM 50 C SER A 6 20.745 -5.028 -2.330 1.00 0.00 C ATOM 51 O SER A 6 21.831 -5.566 -2.121 1.00 0.00 O ATOM 52 CB SER A 6 19.871 -3.025 -1.111 1.00 0.00 C ATOM 53 OG SER A 6 18.578 -3.600 -1.034 1.00 0.00 O ATOM 0 H SER A 6 19.069 -2.537 -3.389 1.00 0.00 H new ATOM 0 HA SER A 6 21.615 -3.076 -2.366 1.00 0.00 H new ATOM 0 HB2 SER A 6 20.442 -3.285 -0.220 1.00 0.00 H new ATOM 0 HB3 SER A 6 19.789 -1.938 -1.131 1.00 0.00 H new ATOM 0 HG SER A 6 18.624 -4.444 -0.537 1.00 0.00 H new ATOM 59 N GLY A 7 19.626 -5.715 -2.541 1.00 0.00 N ATOM 60 CA GLY A 7 19.634 -7.166 -2.536 1.00 0.00 C ATOM 61 C GLY A 7 18.238 -7.754 -2.561 1.00 0.00 C ATOM 62 O GLY A 7 17.566 -7.771 -3.593 1.00 0.00 O ATOM 0 H GLY A 7 18.714 -5.292 -2.715 1.00 0.00 H new ATOM 0 HA2 GLY A 7 20.192 -7.526 -3.400 1.00 0.00 H new ATOM 0 HA3 GLY A 7 20.158 -7.520 -1.648 1.00 0.00 H new ATOM 66 N PRO A 8 17.781 -8.253 -1.402 1.00 0.00 N ATOM 67 CA PRO A 8 16.451 -8.855 -1.270 1.00 0.00 C ATOM 68 C PRO A 8 15.334 -7.823 -1.379 1.00 0.00 C ATOM 69 O PRO A 8 15.575 -6.620 -1.287 1.00 0.00 O ATOM 70 CB PRO A 8 16.477 -9.468 0.133 1.00 0.00 C ATOM 71 CG PRO A 8 17.487 -8.665 0.878 1.00 0.00 C ATOM 72 CD PRO A 8 18.527 -8.267 -0.133 1.00 0.00 C ATOM 0 HA PRO A 8 16.250 -9.576 -2.062 1.00 0.00 H new ATOM 0 HB2 PRO A 8 15.498 -9.412 0.608 1.00 0.00 H new ATOM 0 HB3 PRO A 8 16.755 -10.521 0.100 1.00 0.00 H new ATOM 0 HG2 PRO A 8 17.029 -7.787 1.333 1.00 0.00 H new ATOM 0 HG3 PRO A 8 17.930 -9.248 1.685 1.00 0.00 H new ATOM 0 HD2 PRO A 8 18.954 -7.290 0.093 1.00 0.00 H new ATOM 0 HD3 PRO A 8 19.353 -8.977 -0.160 1.00 0.00 H new ATOM 80 N VAL A 9 14.109 -8.302 -1.576 1.00 0.00 N ATOM 81 CA VAL A 9 12.954 -7.421 -1.697 1.00 0.00 C ATOM 82 C VAL A 9 12.815 -6.526 -0.470 1.00 0.00 C ATOM 83 O VAL A 9 13.261 -6.861 0.627 1.00 0.00 O ATOM 84 CB VAL A 9 11.653 -8.224 -1.883 1.00 0.00 C ATOM 85 CG1 VAL A 9 11.543 -8.739 -3.310 1.00 0.00 C ATOM 86 CG2 VAL A 9 11.588 -9.371 -0.887 1.00 0.00 C ATOM 0 H VAL A 9 13.892 -9.295 -1.655 1.00 0.00 H new ATOM 0 HA VAL A 9 13.119 -6.801 -2.579 1.00 0.00 H new ATOM 0 HB VAL A 9 10.808 -7.562 -1.695 1.00 0.00 H new ATOM 0 HG11 VAL A 9 10.618 -9.304 -3.423 1.00 0.00 H new ATOM 0 HG12 VAL A 9 11.540 -7.897 -4.002 1.00 0.00 H new ATOM 0 HG13 VAL A 9 12.392 -9.386 -3.530 1.00 0.00 H new ATOM 0 HG21 VAL A 9 10.662 -9.928 -1.033 1.00 0.00 H new ATOM 0 HG22 VAL A 9 12.439 -10.035 -1.041 1.00 0.00 H new ATOM 0 HG23 VAL A 9 11.617 -8.974 0.128 1.00 0.00 H new ATOM 96 N PRO A 10 12.181 -5.359 -0.658 1.00 0.00 N ATOM 97 CA PRO A 10 11.967 -4.392 0.422 1.00 0.00 C ATOM 98 C PRO A 10 10.957 -4.887 1.452 1.00 0.00 C ATOM 99 O PRO A 10 9.801 -5.152 1.125 1.00 0.00 O ATOM 100 CB PRO A 10 11.426 -3.159 -0.307 1.00 0.00 C ATOM 101 CG PRO A 10 10.802 -3.697 -1.548 1.00 0.00 C ATOM 102 CD PRO A 10 11.623 -4.895 -1.939 1.00 0.00 C ATOM 0 HA PRO A 10 12.880 -4.204 0.987 1.00 0.00 H new ATOM 0 HB2 PRO A 10 10.697 -2.626 0.304 1.00 0.00 H new ATOM 0 HB3 PRO A 10 12.224 -2.454 -0.539 1.00 0.00 H new ATOM 0 HG2 PRO A 10 9.763 -3.976 -1.373 1.00 0.00 H new ATOM 0 HG3 PRO A 10 10.802 -2.949 -2.341 1.00 0.00 H new ATOM 0 HD2 PRO A 10 11.012 -5.663 -2.413 1.00 0.00 H new ATOM 0 HD3 PRO A 10 12.408 -4.630 -2.647 1.00 0.00 H new ATOM 110 N ALA A 11 11.402 -5.009 2.699 1.00 0.00 N ATOM 111 CA ALA A 11 10.536 -5.470 3.777 1.00 0.00 C ATOM 112 C ALA A 11 9.153 -4.835 3.680 1.00 0.00 C ATOM 113 O ALA A 11 9.026 -3.624 3.498 1.00 0.00 O ATOM 114 CB ALA A 11 11.167 -5.164 5.128 1.00 0.00 C ATOM 0 H ALA A 11 12.357 -4.795 2.987 1.00 0.00 H new ATOM 0 HA ALA A 11 10.418 -6.549 3.679 1.00 0.00 H new ATOM 0 HB1 ALA A 11 10.510 -5.514 5.924 1.00 0.00 H new ATOM 0 HB2 ALA A 11 12.129 -5.670 5.203 1.00 0.00 H new ATOM 0 HB3 ALA A 11 11.315 -4.088 5.225 1.00 0.00 H new ATOM 120 N THR A 12 8.118 -5.660 3.803 1.00 0.00 N ATOM 121 CA THR A 12 6.744 -5.179 3.728 1.00 0.00 C ATOM 122 C THR A 12 6.517 -4.012 4.683 1.00 0.00 C ATOM 123 O THR A 12 6.967 -4.020 5.828 1.00 0.00 O ATOM 124 CB THR A 12 5.739 -6.299 4.055 1.00 0.00 C ATOM 125 OG1 THR A 12 5.869 -7.366 3.109 1.00 0.00 O ATOM 126 CG2 THR A 12 4.313 -5.768 4.036 1.00 0.00 C ATOM 0 H THR A 12 8.205 -6.665 3.955 1.00 0.00 H new ATOM 0 HA THR A 12 6.582 -4.843 2.704 1.00 0.00 H new ATOM 0 HB THR A 12 5.958 -6.673 5.055 1.00 0.00 H new ATOM 0 HG1 THR A 12 5.166 -7.289 2.431 1.00 0.00 H new ATOM 0 HG21 THR A 12 3.620 -6.577 4.270 1.00 0.00 H new ATOM 0 HG22 THR A 12 4.210 -4.976 4.778 1.00 0.00 H new ATOM 0 HG23 THR A 12 4.086 -5.370 3.047 1.00 0.00 H new ATOM 134 N PRO A 13 5.801 -2.985 4.203 1.00 0.00 N ATOM 135 CA PRO A 13 5.497 -1.792 4.998 1.00 0.00 C ATOM 136 C PRO A 13 4.509 -2.082 6.123 1.00 0.00 C ATOM 137 O PRO A 13 3.643 -2.948 5.993 1.00 0.00 O ATOM 138 CB PRO A 13 4.878 -0.833 3.978 1.00 0.00 C ATOM 139 CG PRO A 13 4.318 -1.718 2.918 1.00 0.00 C ATOM 140 CD PRO A 13 5.233 -2.908 2.846 1.00 0.00 C ATOM 0 HA PRO A 13 6.384 -1.396 5.493 1.00 0.00 H new ATOM 0 HB2 PRO A 13 4.101 -0.219 4.433 1.00 0.00 H new ATOM 0 HB3 PRO A 13 5.625 -0.152 3.571 1.00 0.00 H new ATOM 0 HG2 PRO A 13 3.300 -2.023 3.162 1.00 0.00 H new ATOM 0 HG3 PRO A 13 4.275 -1.200 1.960 1.00 0.00 H new ATOM 0 HD2 PRO A 13 4.690 -3.817 2.585 1.00 0.00 H new ATOM 0 HD3 PRO A 13 6.009 -2.773 2.093 1.00 0.00 H new ATOM 148 N ILE A 14 4.644 -1.353 7.226 1.00 0.00 N ATOM 149 CA ILE A 14 3.762 -1.532 8.372 1.00 0.00 C ATOM 150 C ILE A 14 2.440 -0.799 8.169 1.00 0.00 C ATOM 151 O ILE A 14 2.389 0.431 8.199 1.00 0.00 O ATOM 152 CB ILE A 14 4.419 -1.031 9.672 1.00 0.00 C ATOM 153 CG1 ILE A 14 5.893 -1.441 9.715 1.00 0.00 C ATOM 154 CG2 ILE A 14 3.677 -1.572 10.884 1.00 0.00 C ATOM 155 CD1 ILE A 14 6.102 -2.939 9.730 1.00 0.00 C ATOM 0 H ILE A 14 5.356 -0.633 7.350 1.00 0.00 H new ATOM 0 HA ILE A 14 3.572 -2.602 8.459 1.00 0.00 H new ATOM 0 HB ILE A 14 4.363 0.057 9.694 1.00 0.00 H new ATOM 0 HG12 ILE A 14 6.405 -1.019 8.850 1.00 0.00 H new ATOM 0 HG13 ILE A 14 6.357 -1.008 10.602 1.00 0.00 H new ATOM 0 HG21 ILE A 14 4.154 -1.209 11.794 1.00 0.00 H new ATOM 0 HG22 ILE A 14 2.641 -1.234 10.857 1.00 0.00 H new ATOM 0 HG23 ILE A 14 3.704 -2.662 10.870 1.00 0.00 H new ATOM 0 HD11 ILE A 14 7.170 -3.157 9.761 1.00 0.00 H new ATOM 0 HD12 ILE A 14 5.619 -3.365 10.610 1.00 0.00 H new ATOM 0 HD13 ILE A 14 5.668 -3.376 8.831 1.00 0.00 H new ATOM 167 N LEU A 15 1.373 -1.563 7.962 1.00 0.00 N ATOM 168 CA LEU A 15 0.049 -0.987 7.755 1.00 0.00 C ATOM 169 C LEU A 15 -0.551 -0.512 9.075 1.00 0.00 C ATOM 170 O LEU A 15 -1.168 -1.291 9.802 1.00 0.00 O ATOM 171 CB LEU A 15 -0.878 -2.012 7.100 1.00 0.00 C ATOM 172 CG LEU A 15 -2.092 -1.444 6.363 1.00 0.00 C ATOM 173 CD1 LEU A 15 -1.660 -0.393 5.353 1.00 0.00 C ATOM 174 CD2 LEU A 15 -2.868 -2.559 5.677 1.00 0.00 C ATOM 0 H LEU A 15 1.399 -2.582 7.933 1.00 0.00 H new ATOM 0 HA LEU A 15 0.154 -0.126 7.094 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -0.293 -2.603 6.395 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -1.233 -2.696 7.871 1.00 0.00 H new ATOM 0 HG LEU A 15 -2.747 -0.968 7.093 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -2.537 -0.000 4.839 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -1.148 0.419 5.869 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -0.984 -0.843 4.626 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -3.728 -2.137 5.158 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -2.222 -3.063 4.959 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -3.210 -3.276 6.423 1.00 0.00 H new ATOM 186 N GLN A 16 -0.367 0.769 9.377 1.00 0.00 N ATOM 187 CA GLN A 16 -0.891 1.347 10.608 1.00 0.00 C ATOM 188 C GLN A 16 -1.650 2.639 10.324 1.00 0.00 C ATOM 189 O GLN A 16 -1.047 3.683 10.074 1.00 0.00 O ATOM 190 CB GLN A 16 0.246 1.616 11.595 1.00 0.00 C ATOM 191 CG GLN A 16 0.966 0.357 12.052 1.00 0.00 C ATOM 192 CD GLN A 16 0.314 -0.281 13.262 1.00 0.00 C ATOM 193 OE1 GLN A 16 0.836 -0.205 14.375 1.00 0.00 O ATOM 194 NE2 GLN A 16 -0.833 -0.916 13.052 1.00 0.00 N ATOM 0 H GLN A 16 0.141 1.426 8.786 1.00 0.00 H new ATOM 0 HA GLN A 16 -1.584 0.630 11.049 1.00 0.00 H new ATOM 0 HB2 GLN A 16 0.967 2.289 11.131 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -0.156 2.132 12.467 1.00 0.00 H new ATOM 0 HG2 GLN A 16 0.987 -0.363 11.233 1.00 0.00 H new ATOM 0 HG3 GLN A 16 2.002 0.601 12.288 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -1.230 -0.955 12.113 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -1.317 -1.365 13.829 1.00 0.00 H new ATOM 203 N LEU A 17 -2.976 2.561 10.362 1.00 0.00 N ATOM 204 CA LEU A 17 -3.818 3.725 10.108 1.00 0.00 C ATOM 205 C LEU A 17 -3.954 4.583 11.362 1.00 0.00 C ATOM 206 O LEU A 17 -4.365 4.098 12.415 1.00 0.00 O ATOM 207 CB LEU A 17 -5.201 3.283 9.626 1.00 0.00 C ATOM 208 CG LEU A 17 -5.921 4.245 8.681 1.00 0.00 C ATOM 209 CD1 LEU A 17 -7.088 3.549 7.998 1.00 0.00 C ATOM 210 CD2 LEU A 17 -6.400 5.477 9.436 1.00 0.00 C ATOM 0 H LEU A 17 -3.491 1.704 10.566 1.00 0.00 H new ATOM 0 HA LEU A 17 -3.343 4.324 9.331 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -5.098 2.321 9.124 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -5.833 3.121 10.499 1.00 0.00 H new ATOM 0 HG LEU A 17 -5.216 4.565 7.914 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -7.588 4.249 7.329 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -6.719 2.699 7.424 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -7.794 3.199 8.751 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -6.910 6.150 8.747 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -7.089 5.175 10.225 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -5.545 5.989 9.877 1.00 0.00 H new ATOM 222 N GLU A 18 -3.608 5.861 11.239 1.00 0.00 N ATOM 223 CA GLU A 18 -3.693 6.786 12.363 1.00 0.00 C ATOM 224 C GLU A 18 -5.040 7.503 12.376 1.00 0.00 C ATOM 225 O GLU A 18 -5.687 7.610 13.417 1.00 0.00 O ATOM 226 CB GLU A 18 -2.559 7.810 12.296 1.00 0.00 C ATOM 227 CG GLU A 18 -1.263 7.324 12.923 1.00 0.00 C ATOM 228 CD GLU A 18 -1.470 6.723 14.300 1.00 0.00 C ATOM 229 OE1 GLU A 18 -1.815 5.525 14.378 1.00 0.00 O ATOM 230 OE2 GLU A 18 -1.288 7.450 15.299 1.00 0.00 O ATOM 0 H GLU A 18 -3.267 6.279 10.373 1.00 0.00 H new ATOM 0 HA GLU A 18 -3.598 6.209 13.283 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -2.374 8.067 11.253 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -2.876 8.724 12.799 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -0.805 6.580 12.271 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -0.564 8.157 12.996 1.00 0.00 H new ATOM 237 N GLU A 19 -5.455 7.993 11.212 1.00 0.00 N ATOM 238 CA GLU A 19 -6.724 8.701 11.090 1.00 0.00 C ATOM 239 C GLU A 19 -7.849 7.921 11.765 1.00 0.00 C ATOM 240 O GLU A 19 -8.048 6.737 11.492 1.00 0.00 O ATOM 241 CB GLU A 19 -7.063 8.935 9.617 1.00 0.00 C ATOM 242 CG GLU A 19 -8.220 9.897 9.404 1.00 0.00 C ATOM 243 CD GLU A 19 -8.127 10.639 8.085 1.00 0.00 C ATOM 244 OE1 GLU A 19 -8.602 10.096 7.065 1.00 0.00 O ATOM 245 OE2 GLU A 19 -7.579 11.761 8.071 1.00 0.00 O ATOM 0 H GLU A 19 -4.931 7.913 10.340 1.00 0.00 H new ATOM 0 HA GLU A 19 -6.623 9.665 11.589 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -6.181 9.322 9.107 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -7.306 7.979 9.153 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -9.159 9.344 9.440 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -8.243 10.618 10.221 1.00 0.00 H new ATOM 252 N CYS A 20 -8.581 8.594 12.646 1.00 0.00 N ATOM 253 CA CYS A 20 -9.685 7.964 13.361 1.00 0.00 C ATOM 254 C CYS A 20 -11.018 8.277 12.687 1.00 0.00 C ATOM 255 O CYS A 20 -11.119 9.213 11.894 1.00 0.00 O ATOM 256 CB CYS A 20 -9.713 8.436 14.816 1.00 0.00 C ATOM 257 SG CYS A 20 -9.924 10.221 15.009 1.00 0.00 S ATOM 0 H CYS A 20 -8.430 9.575 12.882 1.00 0.00 H new ATOM 0 HA CYS A 20 -9.531 6.885 13.339 1.00 0.00 H new ATOM 0 HB2 CYS A 20 -10.524 7.927 15.336 1.00 0.00 H new ATOM 0 HB3 CYS A 20 -8.785 8.136 15.302 1.00 0.00 H new ATOM 0 HG CYS A 20 -9.938 10.522 16.274 1.00 0.00 H new ATOM 263 N CYS A 21 -12.036 7.486 13.007 1.00 0.00 N ATOM 264 CA CYS A 21 -13.362 7.676 12.430 1.00 0.00 C ATOM 265 C CYS A 21 -13.753 9.150 12.440 1.00 0.00 C ATOM 266 O CYS A 21 -14.092 9.708 13.484 1.00 0.00 O ATOM 267 CB CYS A 21 -14.398 6.856 13.200 1.00 0.00 C ATOM 268 SG CYS A 21 -14.244 5.069 12.972 1.00 0.00 S ATOM 0 H CYS A 21 -11.969 6.707 13.662 1.00 0.00 H new ATOM 0 HA CYS A 21 -13.334 7.333 11.396 1.00 0.00 H new ATOM 0 HB2 CYS A 21 -14.310 7.085 14.262 1.00 0.00 H new ATOM 0 HB3 CYS A 21 -15.395 7.166 12.889 1.00 0.00 H new ATOM 0 HG CYS A 21 -15.162 4.462 13.664 1.00 0.00 H new ATOM 274 N THR A 22 -13.701 9.779 11.269 1.00 0.00 N ATOM 275 CA THR A 22 -14.046 11.189 11.143 1.00 0.00 C ATOM 276 C THR A 22 -15.267 11.378 10.251 1.00 0.00 C ATOM 277 O THR A 22 -15.474 10.627 9.296 1.00 0.00 O ATOM 278 CB THR A 22 -12.873 12.005 10.567 1.00 0.00 C ATOM 279 OG1 THR A 22 -11.669 11.702 11.281 1.00 0.00 O ATOM 280 CG2 THR A 22 -13.158 13.497 10.654 1.00 0.00 C ATOM 0 H THR A 22 -13.423 9.333 10.395 1.00 0.00 H new ATOM 0 HA THR A 22 -14.272 11.550 12.146 1.00 0.00 H new ATOM 0 HB THR A 22 -12.751 11.735 9.518 1.00 0.00 H new ATOM 0 HG1 THR A 22 -11.411 10.773 11.108 1.00 0.00 H new ATOM 0 HG21 THR A 22 -12.316 14.053 10.242 1.00 0.00 H new ATOM 0 HG22 THR A 22 -14.059 13.729 10.086 1.00 0.00 H new ATOM 0 HG23 THR A 22 -13.303 13.779 11.697 1.00 0.00 H new ATOM 288 N HIS A 23 -16.075 12.386 10.566 1.00 0.00 N ATOM 289 CA HIS A 23 -17.276 12.675 9.791 1.00 0.00 C ATOM 290 C HIS A 23 -16.978 12.648 8.295 1.00 0.00 C ATOM 291 O HIS A 23 -17.742 12.088 7.510 1.00 0.00 O ATOM 292 CB HIS A 23 -17.847 14.037 10.185 1.00 0.00 C ATOM 293 CG HIS A 23 -16.821 15.128 10.224 1.00 0.00 C ATOM 294 ND1 HIS A 23 -16.456 15.859 9.114 1.00 0.00 N ATOM 295 CD2 HIS A 23 -16.082 15.611 11.250 1.00 0.00 C ATOM 296 CE1 HIS A 23 -15.536 16.744 9.454 1.00 0.00 C ATOM 297 NE2 HIS A 23 -15.292 16.614 10.746 1.00 0.00 N ATOM 0 H HIS A 23 -15.919 13.016 11.353 1.00 0.00 H new ATOM 0 HA HIS A 23 -18.014 11.903 10.010 1.00 0.00 H new ATOM 0 HB2 HIS A 23 -18.631 14.311 9.479 1.00 0.00 H new ATOM 0 HB3 HIS A 23 -18.316 13.955 11.166 1.00 0.00 H new ATOM 0 HD2 HIS A 23 -16.109 15.271 12.275 1.00 0.00 H new ATOM 0 HE1 HIS A 23 -15.064 17.453 8.790 1.00 0.00 H new ATOM 0 HE2 HIS A 23 -14.625 17.169 11.282 1.00 0.00 H new ATOM 306 N ASN A 24 -15.862 13.257 7.908 1.00 0.00 N ATOM 307 CA ASN A 24 -15.463 13.304 6.506 1.00 0.00 C ATOM 308 C ASN A 24 -15.263 11.897 5.951 1.00 0.00 C ATOM 309 O ASN A 24 -15.362 10.911 6.679 1.00 0.00 O ATOM 310 CB ASN A 24 -14.176 14.116 6.347 1.00 0.00 C ATOM 311 CG ASN A 24 -14.411 15.607 6.491 1.00 0.00 C ATOM 312 OD1 ASN A 24 -15.438 16.129 6.059 1.00 0.00 O ATOM 313 ND2 ASN A 24 -13.457 16.300 7.102 1.00 0.00 N ATOM 0 H ASN A 24 -15.218 13.725 8.546 1.00 0.00 H new ATOM 0 HA ASN A 24 -16.261 13.788 5.942 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -13.451 13.792 7.093 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -13.740 13.913 5.369 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -13.560 17.307 7.229 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -12.622 15.825 7.445 1.00 0.00 H new ATOM 320 N ASN A 25 -14.979 11.814 4.655 1.00 0.00 N ATOM 321 CA ASN A 25 -14.765 10.528 4.001 1.00 0.00 C ATOM 322 C ASN A 25 -13.382 10.469 3.358 1.00 0.00 C ATOM 323 O ASN A 25 -13.245 10.611 2.143 1.00 0.00 O ATOM 324 CB ASN A 25 -15.842 10.284 2.942 1.00 0.00 C ATOM 325 CG ASN A 25 -15.760 11.273 1.795 1.00 0.00 C ATOM 326 OD1 ASN A 25 -15.258 10.951 0.718 1.00 0.00 O ATOM 327 ND2 ASN A 25 -16.254 12.485 2.022 1.00 0.00 N ATOM 0 H ASN A 25 -14.892 12.621 4.038 1.00 0.00 H new ATOM 0 HA ASN A 25 -14.828 9.748 4.760 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -15.742 9.271 2.552 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -16.826 10.351 3.406 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -16.226 13.193 1.288 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -16.661 12.708 2.930 1.00 0.00 H new ATOM 334 N SER A 26 -12.361 10.258 4.182 1.00 0.00 N ATOM 335 CA SER A 26 -10.989 10.182 3.695 1.00 0.00 C ATOM 336 C SER A 26 -10.192 9.141 4.475 1.00 0.00 C ATOM 337 O SER A 26 -10.448 8.903 5.655 1.00 0.00 O ATOM 338 CB SER A 26 -10.310 11.549 3.807 1.00 0.00 C ATOM 339 OG SER A 26 -10.139 11.924 5.163 1.00 0.00 O ATOM 0 H SER A 26 -12.458 10.137 5.190 1.00 0.00 H new ATOM 0 HA SER A 26 -11.017 9.882 2.647 1.00 0.00 H new ATOM 0 HB2 SER A 26 -9.340 11.519 3.310 1.00 0.00 H new ATOM 0 HB3 SER A 26 -10.909 12.300 3.292 1.00 0.00 H new ATOM 0 HG SER A 26 -9.702 12.800 5.208 1.00 0.00 H new ATOM 345 N ALA A 27 -9.225 8.522 3.805 1.00 0.00 N ATOM 346 CA ALA A 27 -8.388 7.508 4.435 1.00 0.00 C ATOM 347 C ALA A 27 -6.913 7.887 4.359 1.00 0.00 C ATOM 348 O ALA A 27 -6.313 7.877 3.283 1.00 0.00 O ATOM 349 CB ALA A 27 -8.621 6.153 3.782 1.00 0.00 C ATOM 0 H ALA A 27 -9.002 8.705 2.827 1.00 0.00 H new ATOM 0 HA ALA A 27 -8.665 7.446 5.487 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -7.990 5.405 4.262 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -9.668 5.870 3.894 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -8.372 6.212 2.722 1.00 0.00 H new ATOM 355 N THR A 28 -6.334 8.224 5.507 1.00 0.00 N ATOM 356 CA THR A 28 -4.930 8.609 5.570 1.00 0.00 C ATOM 357 C THR A 28 -4.052 7.427 5.965 1.00 0.00 C ATOM 358 O THR A 28 -4.249 6.819 7.018 1.00 0.00 O ATOM 359 CB THR A 28 -4.707 9.757 6.573 1.00 0.00 C ATOM 360 OG1 THR A 28 -5.582 10.849 6.270 1.00 0.00 O ATOM 361 CG2 THR A 28 -3.262 10.233 6.538 1.00 0.00 C ATOM 0 H THR A 28 -6.816 8.238 6.406 1.00 0.00 H new ATOM 0 HA THR A 28 -4.651 8.948 4.572 1.00 0.00 H new ATOM 0 HB THR A 28 -4.926 9.384 7.573 1.00 0.00 H new ATOM 0 HG1 THR A 28 -5.540 11.511 6.991 1.00 0.00 H new ATOM 0 HG21 THR A 28 -3.129 11.044 7.254 1.00 0.00 H new ATOM 0 HG22 THR A 28 -2.600 9.407 6.798 1.00 0.00 H new ATOM 0 HG23 THR A 28 -3.021 10.590 5.537 1.00 0.00 H new ATOM 369 N LEU A 29 -3.084 7.105 5.115 1.00 0.00 N ATOM 370 CA LEU A 29 -2.174 5.995 5.376 1.00 0.00 C ATOM 371 C LEU A 29 -0.777 6.503 5.717 1.00 0.00 C ATOM 372 O LEU A 29 -0.231 7.359 5.021 1.00 0.00 O ATOM 373 CB LEU A 29 -2.109 5.067 4.161 1.00 0.00 C ATOM 374 CG LEU A 29 -3.099 3.901 4.153 1.00 0.00 C ATOM 375 CD1 LEU A 29 -2.679 2.837 5.155 1.00 0.00 C ATOM 376 CD2 LEU A 29 -4.507 4.395 4.455 1.00 0.00 C ATOM 0 H LEU A 29 -2.909 7.597 4.239 1.00 0.00 H new ATOM 0 HA LEU A 29 -2.556 5.438 6.232 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -2.274 5.664 3.264 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -1.100 4.661 4.093 1.00 0.00 H new ATOM 0 HG LEU A 29 -3.097 3.455 3.159 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -3.395 2.016 5.135 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -1.689 2.462 4.894 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -2.651 3.270 6.155 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -5.198 3.552 4.445 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -4.524 4.867 5.437 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -4.808 5.120 3.699 1.00 0.00 H new ATOM 388 N SER A 30 -0.204 5.969 6.790 1.00 0.00 N ATOM 389 CA SER A 30 1.129 6.369 7.224 1.00 0.00 C ATOM 390 C SER A 30 2.008 5.148 7.478 1.00 0.00 C ATOM 391 O SER A 30 2.554 4.979 8.568 1.00 0.00 O ATOM 392 CB SER A 30 1.041 7.221 8.493 1.00 0.00 C ATOM 393 OG SER A 30 0.649 6.437 9.606 1.00 0.00 O ATOM 0 H SER A 30 -0.642 5.258 7.375 1.00 0.00 H new ATOM 0 HA SER A 30 1.581 6.960 6.428 1.00 0.00 H new ATOM 0 HB2 SER A 30 2.008 7.684 8.692 1.00 0.00 H new ATOM 0 HB3 SER A 30 0.325 8.030 8.343 1.00 0.00 H new ATOM 0 HG SER A 30 1.253 5.671 9.695 1.00 0.00 H new ATOM 399 N TRP A 31 2.138 4.300 6.464 1.00 0.00 N ATOM 400 CA TRP A 31 2.950 3.094 6.576 1.00 0.00 C ATOM 401 C TRP A 31 4.408 3.443 6.855 1.00 0.00 C ATOM 402 O TRP A 31 4.851 4.561 6.590 1.00 0.00 O ATOM 403 CB TRP A 31 2.848 2.265 5.295 1.00 0.00 C ATOM 404 CG TRP A 31 3.452 2.939 4.101 1.00 0.00 C ATOM 405 CD1 TRP A 31 4.759 2.896 3.710 1.00 0.00 C ATOM 406 CD2 TRP A 31 2.771 3.759 3.144 1.00 0.00 C ATOM 407 NE1 TRP A 31 4.933 3.639 2.567 1.00 0.00 N ATOM 408 CE2 TRP A 31 3.728 4.178 2.200 1.00 0.00 C ATOM 409 CE3 TRP A 31 1.447 4.178 2.993 1.00 0.00 C ATOM 410 CZ2 TRP A 31 3.401 4.996 1.122 1.00 0.00 C ATOM 411 CZ3 TRP A 31 1.124 4.990 1.922 1.00 0.00 C ATOM 412 CH2 TRP A 31 2.097 5.391 0.998 1.00 0.00 C ATOM 0 H TRP A 31 1.692 4.425 5.555 1.00 0.00 H new ATOM 0 HA TRP A 31 2.570 2.507 7.412 1.00 0.00 H new ATOM 0 HB2 TRP A 31 3.343 1.306 5.451 1.00 0.00 H new ATOM 0 HB3 TRP A 31 1.799 2.053 5.091 1.00 0.00 H new ATOM 0 HD1 TRP A 31 5.542 2.357 4.223 1.00 0.00 H new ATOM 0 HE1 TRP A 31 5.816 3.768 2.072 1.00 0.00 H new ATOM 0 HE3 TRP A 31 0.690 3.873 3.700 1.00 0.00 H new ATOM 0 HZ2 TRP A 31 4.150 5.308 0.409 1.00 0.00 H new ATOM 0 HZ3 TRP A 31 0.104 5.321 1.796 1.00 0.00 H new ATOM 0 HH2 TRP A 31 1.812 6.025 0.171 1.00 0.00 H new ATOM 423 N LYS A 32 5.150 2.481 7.392 1.00 0.00 N ATOM 424 CA LYS A 32 6.559 2.685 7.706 1.00 0.00 C ATOM 425 C LYS A 32 7.355 1.401 7.498 1.00 0.00 C ATOM 426 O LYS A 32 6.804 0.378 7.092 1.00 0.00 O ATOM 427 CB LYS A 32 6.716 3.167 9.150 1.00 0.00 C ATOM 428 CG LYS A 32 6.367 2.111 10.185 1.00 0.00 C ATOM 429 CD LYS A 32 6.908 2.475 11.557 1.00 0.00 C ATOM 430 CE LYS A 32 6.549 1.422 12.595 1.00 0.00 C ATOM 431 NZ LYS A 32 5.206 1.667 13.191 1.00 0.00 N ATOM 0 H LYS A 32 4.798 1.551 7.619 1.00 0.00 H new ATOM 0 HA LYS A 32 6.949 3.446 7.031 1.00 0.00 H new ATOM 0 HB2 LYS A 32 7.745 3.491 9.306 1.00 0.00 H new ATOM 0 HB3 LYS A 32 6.080 4.039 9.304 1.00 0.00 H new ATOM 0 HG2 LYS A 32 5.284 1.996 10.238 1.00 0.00 H new ATOM 0 HG3 LYS A 32 6.775 1.148 9.876 1.00 0.00 H new ATOM 0 HD2 LYS A 32 7.992 2.582 11.505 1.00 0.00 H new ATOM 0 HD3 LYS A 32 6.506 3.441 11.863 1.00 0.00 H new ATOM 0 HE2 LYS A 32 6.567 0.435 12.133 1.00 0.00 H new ATOM 0 HE3 LYS A 32 7.301 1.418 13.384 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 4.998 0.929 13.893 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 5.196 2.598 13.654 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 4.485 1.646 12.442 1.00 0.00 H new ATOM 445 N GLN A 33 8.652 1.462 7.779 1.00 0.00 N ATOM 446 CA GLN A 33 9.523 0.303 7.623 1.00 0.00 C ATOM 447 C GLN A 33 9.780 -0.371 8.967 1.00 0.00 C ATOM 448 O GLN A 33 9.920 0.284 10.000 1.00 0.00 O ATOM 449 CB GLN A 33 10.850 0.717 6.985 1.00 0.00 C ATOM 450 CG GLN A 33 10.832 0.679 5.465 1.00 0.00 C ATOM 451 CD GLN A 33 12.196 0.383 4.873 1.00 0.00 C ATOM 452 OE1 GLN A 33 13.211 0.915 5.324 1.00 0.00 O ATOM 453 NE2 GLN A 33 12.228 -0.470 3.856 1.00 0.00 N ATOM 0 H GLN A 33 9.123 2.302 8.116 1.00 0.00 H new ATOM 0 HA GLN A 33 9.021 -0.411 6.970 1.00 0.00 H new ATOM 0 HB2 GLN A 33 11.102 1.726 7.312 1.00 0.00 H new ATOM 0 HB3 GLN A 33 11.639 0.058 7.347 1.00 0.00 H new ATOM 0 HG2 GLN A 33 10.123 -0.080 5.133 1.00 0.00 H new ATOM 0 HG3 GLN A 33 10.475 1.637 5.085 1.00 0.00 H new ATOM 0 HE21 GLN A 33 11.363 -0.888 3.514 1.00 0.00 H new ATOM 0 HE22 GLN A 33 13.118 -0.707 3.417 1.00 0.00 H new ATOM 462 N PRO A 34 9.842 -1.710 8.956 1.00 0.00 N ATOM 463 CA PRO A 34 10.083 -2.502 10.166 1.00 0.00 C ATOM 464 C PRO A 34 11.506 -2.341 10.691 1.00 0.00 C ATOM 465 O PRO A 34 12.467 -2.241 9.927 1.00 0.00 O ATOM 466 CB PRO A 34 9.842 -3.941 9.703 1.00 0.00 C ATOM 467 CG PRO A 34 10.111 -3.917 8.238 1.00 0.00 C ATOM 468 CD PRO A 34 9.684 -2.556 7.761 1.00 0.00 C ATOM 0 HA PRO A 34 9.440 -2.192 10.990 1.00 0.00 H new ATOM 0 HB2 PRO A 34 10.505 -4.638 10.216 1.00 0.00 H new ATOM 0 HB3 PRO A 34 8.821 -4.259 9.913 1.00 0.00 H new ATOM 0 HG2 PRO A 34 11.168 -4.089 8.032 1.00 0.00 H new ATOM 0 HG3 PRO A 34 9.555 -4.702 7.726 1.00 0.00 H new ATOM 0 HD2 PRO A 34 10.305 -2.206 6.936 1.00 0.00 H new ATOM 0 HD3 PRO A 34 8.654 -2.560 7.405 1.00 0.00 H new ATOM 476 N PRO A 35 11.647 -2.317 12.024 1.00 0.00 N ATOM 477 CA PRO A 35 12.949 -2.171 12.680 1.00 0.00 C ATOM 478 C PRO A 35 13.826 -3.407 12.511 1.00 0.00 C ATOM 479 O PRO A 35 15.036 -3.358 12.735 1.00 0.00 O ATOM 480 CB PRO A 35 12.585 -1.971 14.153 1.00 0.00 C ATOM 481 CG PRO A 35 11.255 -2.625 14.306 1.00 0.00 C ATOM 482 CD PRO A 35 10.545 -2.432 12.995 1.00 0.00 C ATOM 0 HA PRO A 35 13.529 -1.351 12.255 1.00 0.00 H new ATOM 0 HB2 PRO A 35 13.327 -2.425 14.810 1.00 0.00 H new ATOM 0 HB3 PRO A 35 12.538 -0.913 14.409 1.00 0.00 H new ATOM 0 HG2 PRO A 35 11.365 -3.684 14.538 1.00 0.00 H new ATOM 0 HG3 PRO A 35 10.692 -2.177 15.124 1.00 0.00 H new ATOM 0 HD2 PRO A 35 9.892 -3.274 12.764 1.00 0.00 H new ATOM 0 HD3 PRO A 35 9.922 -1.538 13.003 1.00 0.00 H new ATOM 490 N LEU A 36 13.208 -4.515 12.116 1.00 0.00 N ATOM 491 CA LEU A 36 13.933 -5.765 11.917 1.00 0.00 C ATOM 492 C LEU A 36 14.313 -5.946 10.451 1.00 0.00 C ATOM 493 O LEU A 36 14.516 -7.068 9.985 1.00 0.00 O ATOM 494 CB LEU A 36 13.085 -6.949 12.385 1.00 0.00 C ATOM 495 CG LEU A 36 12.531 -6.857 13.807 1.00 0.00 C ATOM 496 CD1 LEU A 36 11.445 -7.899 14.026 1.00 0.00 C ATOM 497 CD2 LEU A 36 13.648 -7.027 14.827 1.00 0.00 C ATOM 0 H LEU A 36 12.207 -4.573 11.927 1.00 0.00 H new ATOM 0 HA LEU A 36 14.848 -5.724 12.508 1.00 0.00 H new ATOM 0 HB2 LEU A 36 12.248 -7.065 11.697 1.00 0.00 H new ATOM 0 HB3 LEU A 36 13.687 -7.854 12.309 1.00 0.00 H new ATOM 0 HG LEU A 36 12.090 -5.869 13.941 1.00 0.00 H new ATOM 0 HD11 LEU A 36 11.063 -7.818 15.044 1.00 0.00 H new ATOM 0 HD12 LEU A 36 10.632 -7.732 13.319 1.00 0.00 H new ATOM 0 HD13 LEU A 36 11.860 -8.895 13.873 1.00 0.00 H new ATOM 0 HD21 LEU A 36 13.235 -6.959 15.833 1.00 0.00 H new ATOM 0 HD22 LEU A 36 14.118 -8.001 14.693 1.00 0.00 H new ATOM 0 HD23 LEU A 36 14.392 -6.243 14.686 1.00 0.00 H new ATOM 509 N SER A 37 14.411 -4.835 9.728 1.00 0.00 N ATOM 510 CA SER A 37 14.766 -4.870 8.315 1.00 0.00 C ATOM 511 C SER A 37 15.602 -3.652 7.933 1.00 0.00 C ATOM 512 O SER A 37 15.219 -2.513 8.202 1.00 0.00 O ATOM 513 CB SER A 37 13.505 -4.928 7.451 1.00 0.00 C ATOM 514 OG SER A 37 13.779 -5.501 6.184 1.00 0.00 O ATOM 0 H SER A 37 14.249 -3.899 10.099 1.00 0.00 H new ATOM 0 HA SER A 37 15.360 -5.766 8.139 1.00 0.00 H new ATOM 0 HB2 SER A 37 12.739 -5.513 7.960 1.00 0.00 H new ATOM 0 HB3 SER A 37 13.104 -3.923 7.320 1.00 0.00 H new ATOM 0 HG SER A 37 14.033 -4.795 5.554 1.00 0.00 H new ATOM 520 N THR A 38 16.747 -3.900 7.305 1.00 0.00 N ATOM 521 CA THR A 38 17.638 -2.826 6.887 1.00 0.00 C ATOM 522 C THR A 38 17.731 -2.748 5.367 1.00 0.00 C ATOM 523 O THR A 38 18.763 -2.361 4.818 1.00 0.00 O ATOM 524 CB THR A 38 19.052 -3.010 7.468 1.00 0.00 C ATOM 525 OG1 THR A 38 19.588 -4.274 7.061 1.00 0.00 O ATOM 526 CG2 THR A 38 19.027 -2.931 8.987 1.00 0.00 C ATOM 0 H THR A 38 17.079 -4.837 7.075 1.00 0.00 H new ATOM 0 HA THR A 38 17.214 -1.898 7.270 1.00 0.00 H new ATOM 0 HB THR A 38 19.684 -2.208 7.088 1.00 0.00 H new ATOM 0 HG1 THR A 38 20.488 -4.383 7.433 1.00 0.00 H new ATOM 0 HG21 THR A 38 20.037 -3.064 9.375 1.00 0.00 H new ATOM 0 HG22 THR A 38 18.645 -1.957 9.294 1.00 0.00 H new ATOM 0 HG23 THR A 38 18.381 -3.715 9.382 1.00 0.00 H new ATOM 534 N VAL A 39 16.648 -3.119 4.693 1.00 0.00 N ATOM 535 CA VAL A 39 16.607 -3.090 3.235 1.00 0.00 C ATOM 536 C VAL A 39 15.895 -1.840 2.730 1.00 0.00 C ATOM 537 O VAL A 39 14.791 -1.507 3.162 1.00 0.00 O ATOM 538 CB VAL A 39 15.900 -4.335 2.669 1.00 0.00 C ATOM 539 CG1 VAL A 39 15.872 -4.288 1.149 1.00 0.00 C ATOM 540 CG2 VAL A 39 16.582 -5.603 3.158 1.00 0.00 C ATOM 0 H VAL A 39 15.787 -3.443 5.133 1.00 0.00 H new ATOM 0 HA VAL A 39 17.641 -3.080 2.889 1.00 0.00 H new ATOM 0 HB VAL A 39 14.871 -4.342 3.028 1.00 0.00 H new ATOM 0 HG11 VAL A 39 15.369 -5.176 0.767 1.00 0.00 H new ATOM 0 HG12 VAL A 39 15.335 -3.397 0.822 1.00 0.00 H new ATOM 0 HG13 VAL A 39 16.892 -4.257 0.767 1.00 0.00 H new ATOM 0 HG21 VAL A 39 16.069 -6.473 2.748 1.00 0.00 H new ATOM 0 HG22 VAL A 39 17.622 -5.607 2.830 1.00 0.00 H new ATOM 0 HG23 VAL A 39 16.545 -5.639 4.247 1.00 0.00 H new ATOM 550 N PRO A 40 16.539 -1.130 1.793 1.00 0.00 N ATOM 551 CA PRO A 40 15.985 0.095 1.207 1.00 0.00 C ATOM 552 C PRO A 40 14.784 -0.184 0.310 1.00 0.00 C ATOM 553 O PRO A 40 14.682 -1.252 -0.292 1.00 0.00 O ATOM 554 CB PRO A 40 17.149 0.653 0.385 1.00 0.00 C ATOM 555 CG PRO A 40 17.987 -0.536 0.059 1.00 0.00 C ATOM 556 CD PRO A 40 17.858 -1.467 1.232 1.00 0.00 C ATOM 0 HA PRO A 40 15.617 0.781 1.969 1.00 0.00 H new ATOM 0 HB2 PRO A 40 16.794 1.147 -0.519 1.00 0.00 H new ATOM 0 HB3 PRO A 40 17.715 1.393 0.951 1.00 0.00 H new ATOM 0 HG2 PRO A 40 17.645 -1.015 -0.859 1.00 0.00 H new ATOM 0 HG3 PRO A 40 19.027 -0.249 -0.099 1.00 0.00 H new ATOM 0 HD2 PRO A 40 17.908 -2.511 0.923 1.00 0.00 H new ATOM 0 HD3 PRO A 40 18.655 -1.311 1.959 1.00 0.00 H new ATOM 564 N ALA A 41 13.878 0.785 0.224 1.00 0.00 N ATOM 565 CA ALA A 41 12.686 0.644 -0.602 1.00 0.00 C ATOM 566 C ALA A 41 12.587 1.774 -1.621 1.00 0.00 C ATOM 567 O ALA A 41 12.589 2.951 -1.259 1.00 0.00 O ATOM 568 CB ALA A 41 11.440 0.608 0.271 1.00 0.00 C ATOM 0 H ALA A 41 13.947 1.676 0.716 1.00 0.00 H new ATOM 0 HA ALA A 41 12.762 -0.297 -1.148 1.00 0.00 H new ATOM 0 HB1 ALA A 41 10.557 0.502 -0.359 1.00 0.00 H new ATOM 0 HB2 ALA A 41 11.500 -0.238 0.956 1.00 0.00 H new ATOM 0 HB3 ALA A 41 11.369 1.534 0.842 1.00 0.00 H new ATOM 574 N ASP A 42 12.502 1.410 -2.895 1.00 0.00 N ATOM 575 CA ASP A 42 12.403 2.394 -3.967 1.00 0.00 C ATOM 576 C ASP A 42 11.087 3.160 -3.881 1.00 0.00 C ATOM 577 O ASP A 42 11.065 4.387 -3.961 1.00 0.00 O ATOM 578 CB ASP A 42 12.520 1.709 -5.329 1.00 0.00 C ATOM 579 CG ASP A 42 12.559 2.701 -6.475 1.00 0.00 C ATOM 580 OD1 ASP A 42 11.608 3.501 -6.600 1.00 0.00 O ATOM 581 OD2 ASP A 42 13.542 2.679 -7.245 1.00 0.00 O ATOM 0 H ASP A 42 12.500 0.440 -3.211 1.00 0.00 H new ATOM 0 HA ASP A 42 13.224 3.103 -3.854 1.00 0.00 H new ATOM 0 HB2 ASP A 42 13.423 1.099 -5.349 1.00 0.00 H new ATOM 0 HB3 ASP A 42 11.676 1.033 -5.466 1.00 0.00 H new ATOM 586 N GLY A 43 9.990 2.426 -3.718 1.00 0.00 N ATOM 587 CA GLY A 43 8.684 3.053 -3.625 1.00 0.00 C ATOM 588 C GLY A 43 7.649 2.147 -2.989 1.00 0.00 C ATOM 589 O GLY A 43 7.889 0.953 -2.805 1.00 0.00 O ATOM 0 H GLY A 43 9.982 1.408 -3.649 1.00 0.00 H new ATOM 0 HA2 GLY A 43 8.766 3.971 -3.043 1.00 0.00 H new ATOM 0 HA3 GLY A 43 8.349 3.337 -4.623 1.00 0.00 H new ATOM 593 N TYR A 44 6.497 2.714 -2.650 1.00 0.00 N ATOM 594 CA TYR A 44 5.423 1.950 -2.026 1.00 0.00 C ATOM 595 C TYR A 44 4.142 2.039 -2.849 1.00 0.00 C ATOM 596 O TYR A 44 3.740 3.122 -3.276 1.00 0.00 O ATOM 597 CB TYR A 44 5.167 2.456 -0.606 1.00 0.00 C ATOM 598 CG TYR A 44 6.419 2.557 0.236 1.00 0.00 C ATOM 599 CD1 TYR A 44 7.253 3.664 0.146 1.00 0.00 C ATOM 600 CD2 TYR A 44 6.766 1.545 1.123 1.00 0.00 C ATOM 601 CE1 TYR A 44 8.398 3.760 0.913 1.00 0.00 C ATOM 602 CE2 TYR A 44 7.909 1.633 1.895 1.00 0.00 C ATOM 603 CZ TYR A 44 8.722 2.742 1.786 1.00 0.00 C ATOM 604 OH TYR A 44 9.860 2.835 2.552 1.00 0.00 O ATOM 0 H TYR A 44 6.283 3.700 -2.797 1.00 0.00 H new ATOM 0 HA TYR A 44 5.733 0.906 -1.982 1.00 0.00 H new ATOM 0 HB2 TYR A 44 4.695 3.437 -0.659 1.00 0.00 H new ATOM 0 HB3 TYR A 44 4.461 1.788 -0.113 1.00 0.00 H new ATOM 0 HD1 TYR A 44 7.002 4.464 -0.535 1.00 0.00 H new ATOM 0 HD2 TYR A 44 6.132 0.675 1.211 1.00 0.00 H new ATOM 0 HE1 TYR A 44 9.036 4.627 0.830 1.00 0.00 H new ATOM 0 HE2 TYR A 44 8.164 0.838 2.580 1.00 0.00 H new ATOM 0 HH TYR A 44 9.612 2.970 3.491 1.00 0.00 H new ATOM 614 N ILE A 45 3.505 0.894 -3.067 1.00 0.00 N ATOM 615 CA ILE A 45 2.268 0.842 -3.837 1.00 0.00 C ATOM 616 C ILE A 45 1.077 0.516 -2.942 1.00 0.00 C ATOM 617 O ILE A 45 1.095 -0.467 -2.199 1.00 0.00 O ATOM 618 CB ILE A 45 2.350 -0.203 -4.965 1.00 0.00 C ATOM 619 CG1 ILE A 45 3.509 0.124 -5.909 1.00 0.00 C ATOM 620 CG2 ILE A 45 1.037 -0.261 -5.730 1.00 0.00 C ATOM 621 CD1 ILE A 45 3.884 -1.021 -6.824 1.00 0.00 C ATOM 0 H ILE A 45 3.825 -0.011 -2.721 1.00 0.00 H new ATOM 0 HA ILE A 45 2.129 1.829 -4.278 1.00 0.00 H new ATOM 0 HB ILE A 45 2.532 -1.182 -4.521 1.00 0.00 H new ATOM 0 HG12 ILE A 45 3.241 0.990 -6.515 1.00 0.00 H new ATOM 0 HG13 ILE A 45 4.380 0.406 -5.318 1.00 0.00 H new ATOM 0 HG21 ILE A 45 1.111 -1.004 -6.524 1.00 0.00 H new ATOM 0 HG22 ILE A 45 0.231 -0.536 -5.049 1.00 0.00 H new ATOM 0 HG23 ILE A 45 0.826 0.716 -6.166 1.00 0.00 H new ATOM 0 HD11 ILE A 45 4.712 -0.718 -7.465 1.00 0.00 H new ATOM 0 HD12 ILE A 45 4.184 -1.882 -6.226 1.00 0.00 H new ATOM 0 HD13 ILE A 45 3.027 -1.289 -7.441 1.00 0.00 H new ATOM 633 N LEU A 46 0.042 1.344 -3.020 1.00 0.00 N ATOM 634 CA LEU A 46 -1.161 1.143 -2.218 1.00 0.00 C ATOM 635 C LEU A 46 -2.230 0.404 -3.016 1.00 0.00 C ATOM 636 O LEU A 46 -2.169 0.342 -4.244 1.00 0.00 O ATOM 637 CB LEU A 46 -1.707 2.488 -1.736 1.00 0.00 C ATOM 638 CG LEU A 46 -1.064 3.059 -0.471 1.00 0.00 C ATOM 639 CD1 LEU A 46 -1.215 4.572 -0.432 1.00 0.00 C ATOM 640 CD2 LEU A 46 -1.678 2.428 0.770 1.00 0.00 C ATOM 0 H LEU A 46 0.011 2.161 -3.630 1.00 0.00 H new ATOM 0 HA LEU A 46 -0.894 0.535 -1.353 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -1.588 3.215 -2.540 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -2.777 2.381 -1.559 1.00 0.00 H new ATOM 0 HG LEU A 46 -0.000 2.821 -0.487 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -0.752 4.961 0.475 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -0.728 5.009 -1.304 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -2.273 4.832 -0.439 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -1.209 2.846 1.661 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -2.748 2.635 0.792 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -1.518 1.350 0.747 1.00 0.00 H new ATOM 652 N GLU A 47 -3.209 -0.153 -2.310 1.00 0.00 N ATOM 653 CA GLU A 47 -4.292 -0.886 -2.954 1.00 0.00 C ATOM 654 C GLU A 47 -5.569 -0.812 -2.122 1.00 0.00 C ATOM 655 O GLU A 47 -5.521 -0.764 -0.892 1.00 0.00 O ATOM 656 CB GLU A 47 -3.893 -2.348 -3.166 1.00 0.00 C ATOM 657 CG GLU A 47 -2.777 -2.533 -4.182 1.00 0.00 C ATOM 658 CD GLU A 47 -1.415 -2.164 -3.626 1.00 0.00 C ATOM 659 OE1 GLU A 47 -1.301 -2.010 -2.392 1.00 0.00 O ATOM 660 OE2 GLU A 47 -0.465 -2.030 -4.424 1.00 0.00 O ATOM 0 H GLU A 47 -3.274 -0.111 -1.293 1.00 0.00 H new ATOM 0 HA GLU A 47 -4.483 -0.425 -3.923 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -3.579 -2.772 -2.212 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -4.767 -2.911 -3.493 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -2.761 -3.571 -4.513 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -2.985 -1.921 -5.060 1.00 0.00 H new ATOM 667 N LEU A 48 -6.711 -0.804 -2.801 1.00 0.00 N ATOM 668 CA LEU A 48 -8.002 -0.735 -2.126 1.00 0.00 C ATOM 669 C LEU A 48 -9.124 -1.203 -3.047 1.00 0.00 C ATOM 670 O LEU A 48 -9.092 -0.961 -4.254 1.00 0.00 O ATOM 671 CB LEU A 48 -8.278 0.694 -1.653 1.00 0.00 C ATOM 672 CG LEU A 48 -9.698 0.976 -1.162 1.00 0.00 C ATOM 673 CD1 LEU A 48 -9.836 0.614 0.308 1.00 0.00 C ATOM 674 CD2 LEU A 48 -10.061 2.436 -1.390 1.00 0.00 C ATOM 0 H LEU A 48 -6.769 -0.844 -3.819 1.00 0.00 H new ATOM 0 HA LEU A 48 -7.967 -1.397 -1.261 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -7.583 0.929 -0.847 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -8.057 1.376 -2.474 1.00 0.00 H new ATOM 0 HG LEU A 48 -10.389 0.357 -1.734 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -10.853 0.822 0.640 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -9.619 -0.446 0.444 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -9.135 1.206 0.896 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -11.075 2.619 -1.035 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -9.365 3.073 -0.845 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -10.003 2.663 -2.454 1.00 0.00 H new ATOM 686 N ASP A 49 -10.116 -1.873 -2.470 1.00 0.00 N ATOM 687 CA ASP A 49 -11.250 -2.372 -3.239 1.00 0.00 C ATOM 688 C ASP A 49 -12.388 -1.356 -3.251 1.00 0.00 C ATOM 689 O ASP A 49 -12.297 -0.300 -2.624 1.00 0.00 O ATOM 690 CB ASP A 49 -11.741 -3.700 -2.660 1.00 0.00 C ATOM 691 CG ASP A 49 -12.480 -3.522 -1.348 1.00 0.00 C ATOM 692 OD1 ASP A 49 -11.809 -3.371 -0.306 1.00 0.00 O ATOM 693 OD2 ASP A 49 -13.729 -3.534 -1.364 1.00 0.00 O ATOM 0 H ASP A 49 -10.158 -2.083 -1.473 1.00 0.00 H new ATOM 0 HA ASP A 49 -10.919 -2.532 -4.265 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -12.398 -4.186 -3.381 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -10.890 -4.363 -2.507 1.00 0.00 H new ATOM 698 N ASP A 50 -13.458 -1.682 -3.968 1.00 0.00 N ATOM 699 CA ASP A 50 -14.614 -0.798 -4.061 1.00 0.00 C ATOM 700 C ASP A 50 -15.579 -1.041 -2.905 1.00 0.00 C ATOM 701 O ASP A 50 -16.794 -0.929 -3.062 1.00 0.00 O ATOM 702 CB ASP A 50 -15.334 -1.005 -5.394 1.00 0.00 C ATOM 703 CG ASP A 50 -15.670 -2.461 -5.651 1.00 0.00 C ATOM 704 OD1 ASP A 50 -14.859 -3.333 -5.275 1.00 0.00 O ATOM 705 OD2 ASP A 50 -16.745 -2.728 -6.228 1.00 0.00 O ATOM 0 H ASP A 50 -13.549 -2.552 -4.493 1.00 0.00 H new ATOM 0 HA ASP A 50 -14.259 0.231 -4.004 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -16.251 -0.416 -5.403 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -14.707 -0.631 -6.204 1.00 0.00 H new ATOM 710 N GLY A 51 -15.028 -1.377 -1.742 1.00 0.00 N ATOM 711 CA GLY A 51 -15.854 -1.632 -0.576 1.00 0.00 C ATOM 712 C GLY A 51 -16.797 -2.801 -0.778 1.00 0.00 C ATOM 713 O GLY A 51 -17.850 -2.874 -0.147 1.00 0.00 O ATOM 0 H GLY A 51 -14.025 -1.477 -1.587 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -15.213 -1.830 0.283 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -16.433 -0.738 -0.342 1.00 0.00 H new ATOM 717 N ASN A 52 -16.419 -3.718 -1.663 1.00 0.00 N ATOM 718 CA ASN A 52 -17.240 -4.889 -1.949 1.00 0.00 C ATOM 719 C ASN A 52 -16.689 -6.125 -1.245 1.00 0.00 C ATOM 720 O ASN A 52 -17.444 -7.003 -0.829 1.00 0.00 O ATOM 721 CB ASN A 52 -17.307 -5.135 -3.458 1.00 0.00 C ATOM 722 CG ASN A 52 -18.385 -4.308 -4.132 1.00 0.00 C ATOM 723 OD1 ASN A 52 -19.384 -4.843 -4.611 1.00 0.00 O ATOM 724 ND2 ASN A 52 -18.185 -2.995 -4.171 1.00 0.00 N ATOM 0 H ASN A 52 -15.550 -3.673 -2.194 1.00 0.00 H new ATOM 0 HA ASN A 52 -18.245 -4.697 -1.574 1.00 0.00 H new ATOM 0 HB2 ASN A 52 -16.341 -4.901 -3.905 1.00 0.00 H new ATOM 0 HB3 ASN A 52 -17.496 -6.193 -3.643 1.00 0.00 H new ATOM 0 HD21 ASN A 52 -18.875 -2.387 -4.611 1.00 0.00 H new ATOM 0 HD22 ASN A 52 -17.341 -2.595 -3.761 1.00 0.00 H new ATOM 731 N GLY A 53 -15.368 -6.185 -1.114 1.00 0.00 N ATOM 732 CA GLY A 53 -14.738 -7.316 -0.459 1.00 0.00 C ATOM 733 C GLY A 53 -14.217 -8.342 -1.447 1.00 0.00 C ATOM 734 O GLY A 53 -14.284 -9.544 -1.197 1.00 0.00 O ATOM 0 H GLY A 53 -14.722 -5.470 -1.450 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -13.914 -6.961 0.160 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -15.456 -7.791 0.209 1.00 0.00 H new ATOM 738 N GLY A 54 -13.697 -7.865 -2.574 1.00 0.00 N ATOM 739 CA GLY A 54 -13.172 -8.762 -3.586 1.00 0.00 C ATOM 740 C GLY A 54 -11.683 -8.583 -3.804 1.00 0.00 C ATOM 741 O GLY A 54 -10.882 -8.854 -2.909 1.00 0.00 O ATOM 0 H GLY A 54 -13.630 -6.873 -2.804 1.00 0.00 H new ATOM 0 HA2 GLY A 54 -13.372 -9.793 -3.292 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -13.697 -8.591 -4.526 1.00 0.00 H new ATOM 745 N GLN A 55 -11.311 -8.127 -4.995 1.00 0.00 N ATOM 746 CA GLN A 55 -9.907 -7.915 -5.328 1.00 0.00 C ATOM 747 C GLN A 55 -9.489 -6.478 -5.035 1.00 0.00 C ATOM 748 O GLN A 55 -10.331 -5.587 -4.922 1.00 0.00 O ATOM 749 CB GLN A 55 -9.655 -8.242 -6.801 1.00 0.00 C ATOM 750 CG GLN A 55 -10.514 -7.434 -7.759 1.00 0.00 C ATOM 751 CD GLN A 55 -11.897 -8.028 -7.945 1.00 0.00 C ATOM 752 OE1 GLN A 55 -12.903 -7.408 -7.599 1.00 0.00 O ATOM 753 NE2 GLN A 55 -11.953 -9.236 -8.494 1.00 0.00 N ATOM 0 H GLN A 55 -11.962 -7.897 -5.746 1.00 0.00 H new ATOM 0 HA GLN A 55 -9.308 -8.582 -4.708 1.00 0.00 H new ATOM 0 HB2 GLN A 55 -8.604 -8.063 -7.030 1.00 0.00 H new ATOM 0 HB3 GLN A 55 -9.841 -9.303 -6.966 1.00 0.00 H new ATOM 0 HG2 GLN A 55 -10.608 -6.414 -7.385 1.00 0.00 H new ATOM 0 HG3 GLN A 55 -10.015 -7.374 -8.726 1.00 0.00 H new ATOM 0 HE21 GLN A 55 -11.093 -9.713 -8.766 1.00 0.00 H new ATOM 0 HE22 GLN A 55 -12.856 -9.687 -8.644 1.00 0.00 H new ATOM 762 N PHE A 56 -8.184 -6.260 -4.912 1.00 0.00 N ATOM 763 CA PHE A 56 -7.654 -4.931 -4.631 1.00 0.00 C ATOM 764 C PHE A 56 -6.867 -4.395 -5.823 1.00 0.00 C ATOM 765 O PHE A 56 -6.113 -5.129 -6.463 1.00 0.00 O ATOM 766 CB PHE A 56 -6.760 -4.967 -3.390 1.00 0.00 C ATOM 767 CG PHE A 56 -7.404 -5.630 -2.206 1.00 0.00 C ATOM 768 CD1 PHE A 56 -7.756 -6.970 -2.252 1.00 0.00 C ATOM 769 CD2 PHE A 56 -7.659 -4.914 -1.048 1.00 0.00 C ATOM 770 CE1 PHE A 56 -8.349 -7.583 -1.164 1.00 0.00 C ATOM 771 CE2 PHE A 56 -8.251 -5.522 0.043 1.00 0.00 C ATOM 772 CZ PHE A 56 -8.597 -6.858 -0.015 1.00 0.00 C ATOM 0 H PHE A 56 -7.474 -6.987 -5.003 1.00 0.00 H new ATOM 0 HA PHE A 56 -8.496 -4.264 -4.445 1.00 0.00 H new ATOM 0 HB2 PHE A 56 -5.836 -5.492 -3.633 1.00 0.00 H new ATOM 0 HB3 PHE A 56 -6.485 -3.947 -3.120 1.00 0.00 H new ATOM 0 HD1 PHE A 56 -7.565 -7.542 -3.148 1.00 0.00 H new ATOM 0 HD2 PHE A 56 -7.392 -3.869 -0.997 1.00 0.00 H new ATOM 0 HE1 PHE A 56 -8.618 -8.628 -1.213 1.00 0.00 H new ATOM 0 HE2 PHE A 56 -8.443 -4.953 0.940 1.00 0.00 H new ATOM 0 HZ PHE A 56 -9.060 -7.335 0.836 1.00 0.00 H new ATOM 782 N ARG A 57 -7.048 -3.112 -6.116 1.00 0.00 N ATOM 783 CA ARG A 57 -6.356 -2.478 -7.232 1.00 0.00 C ATOM 784 C ARG A 57 -5.472 -1.334 -6.745 1.00 0.00 C ATOM 785 O ARG A 57 -5.730 -0.741 -5.697 1.00 0.00 O ATOM 786 CB ARG A 57 -7.367 -1.955 -8.255 1.00 0.00 C ATOM 787 CG ARG A 57 -8.298 -0.889 -7.702 1.00 0.00 C ATOM 788 CD ARG A 57 -9.577 -1.500 -7.149 1.00 0.00 C ATOM 789 NE ARG A 57 -10.400 -2.091 -8.200 1.00 0.00 N ATOM 790 CZ ARG A 57 -11.687 -2.384 -8.049 1.00 0.00 C ATOM 791 NH1 ARG A 57 -12.294 -2.141 -6.895 1.00 0.00 N ATOM 792 NH2 ARG A 57 -12.369 -2.920 -9.052 1.00 0.00 N ATOM 0 H ARG A 57 -7.668 -2.491 -5.596 1.00 0.00 H new ATOM 0 HA ARG A 57 -5.722 -3.227 -7.707 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -6.828 -1.546 -9.110 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -7.963 -2.790 -8.624 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -7.789 -0.332 -6.915 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -8.544 -0.176 -8.489 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -9.325 -2.264 -6.413 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -10.150 -0.732 -6.629 1.00 0.00 H new ATOM 0 HE ARG A 57 -9.963 -2.290 -9.100 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -11.773 -1.728 -6.121 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -13.282 -2.367 -6.781 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -11.906 -3.108 -9.941 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -13.357 -3.144 -8.935 1.00 0.00 H new ATOM 806 N GLU A 58 -4.430 -1.030 -7.511 1.00 0.00 N ATOM 807 CA GLU A 58 -3.507 0.042 -7.156 1.00 0.00 C ATOM 808 C GLU A 58 -4.243 1.372 -7.028 1.00 0.00 C ATOM 809 O GLU A 58 -4.994 1.768 -7.920 1.00 0.00 O ATOM 810 CB GLU A 58 -2.398 0.158 -8.204 1.00 0.00 C ATOM 811 CG GLU A 58 -1.301 -0.882 -8.048 1.00 0.00 C ATOM 812 CD GLU A 58 -1.618 -2.177 -8.770 1.00 0.00 C ATOM 813 OE1 GLU A 58 -2.665 -2.786 -8.466 1.00 0.00 O ATOM 814 OE2 GLU A 58 -0.819 -2.580 -9.641 1.00 0.00 O ATOM 0 H GLU A 58 -4.203 -1.511 -8.382 1.00 0.00 H new ATOM 0 HA GLU A 58 -3.061 -0.201 -6.192 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -2.837 0.064 -9.197 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -1.955 1.152 -8.144 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -0.364 -0.477 -8.431 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -1.149 -1.089 -6.989 1.00 0.00 H new ATOM 821 N VAL A 59 -4.022 2.059 -5.911 1.00 0.00 N ATOM 822 CA VAL A 59 -4.662 3.345 -5.665 1.00 0.00 C ATOM 823 C VAL A 59 -3.650 4.484 -5.723 1.00 0.00 C ATOM 824 O VAL A 59 -3.992 5.616 -6.065 1.00 0.00 O ATOM 825 CB VAL A 59 -5.367 3.369 -4.296 1.00 0.00 C ATOM 826 CG1 VAL A 59 -6.521 2.379 -4.272 1.00 0.00 C ATOM 827 CG2 VAL A 59 -4.375 3.070 -3.182 1.00 0.00 C ATOM 0 H VAL A 59 -3.404 1.746 -5.162 1.00 0.00 H new ATOM 0 HA VAL A 59 -5.405 3.483 -6.451 1.00 0.00 H new ATOM 0 HB VAL A 59 -5.773 4.367 -4.133 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -7.007 2.410 -3.297 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -7.242 2.642 -5.045 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -6.142 1.374 -4.456 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -4.890 3.091 -2.221 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -3.939 2.084 -3.339 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -3.585 3.821 -3.187 1.00 0.00 H new ATOM 837 N TYR A 60 -2.402 4.176 -5.388 1.00 0.00 N ATOM 838 CA TYR A 60 -1.339 5.173 -5.400 1.00 0.00 C ATOM 839 C TYR A 60 0.030 4.510 -5.518 1.00 0.00 C ATOM 840 O TYR A 60 0.265 3.440 -4.956 1.00 0.00 O ATOM 841 CB TYR A 60 -1.397 6.026 -4.131 1.00 0.00 C ATOM 842 CG TYR A 60 -0.046 6.534 -3.681 1.00 0.00 C ATOM 843 CD1 TYR A 60 0.775 5.759 -2.871 1.00 0.00 C ATOM 844 CD2 TYR A 60 0.410 7.789 -4.065 1.00 0.00 C ATOM 845 CE1 TYR A 60 2.010 6.219 -2.456 1.00 0.00 C ATOM 846 CE2 TYR A 60 1.644 8.257 -3.656 1.00 0.00 C ATOM 847 CZ TYR A 60 2.440 7.469 -2.852 1.00 0.00 C ATOM 848 OH TYR A 60 3.669 7.932 -2.442 1.00 0.00 O ATOM 0 H TYR A 60 -2.102 3.243 -5.105 1.00 0.00 H new ATOM 0 HA TYR A 60 -1.488 5.814 -6.269 1.00 0.00 H new ATOM 0 HB2 TYR A 60 -2.056 6.877 -4.305 1.00 0.00 H new ATOM 0 HB3 TYR A 60 -1.841 5.438 -3.328 1.00 0.00 H new ATOM 0 HD1 TYR A 60 0.442 4.780 -2.560 1.00 0.00 H new ATOM 0 HD2 TYR A 60 -0.211 8.410 -4.694 1.00 0.00 H new ATOM 0 HE1 TYR A 60 2.635 5.604 -1.826 1.00 0.00 H new ATOM 0 HE2 TYR A 60 1.983 9.235 -3.964 1.00 0.00 H new ATOM 0 HH TYR A 60 4.352 7.669 -3.094 1.00 0.00 H new ATOM 858 N VAL A 61 0.931 5.153 -6.254 1.00 0.00 N ATOM 859 CA VAL A 61 2.277 4.628 -6.446 1.00 0.00 C ATOM 860 C VAL A 61 3.309 5.750 -6.451 1.00 0.00 C ATOM 861 O VAL A 61 3.201 6.704 -7.220 1.00 0.00 O ATOM 862 CB VAL A 61 2.389 3.837 -7.763 1.00 0.00 C ATOM 863 CG1 VAL A 61 3.827 3.407 -8.007 1.00 0.00 C ATOM 864 CG2 VAL A 61 1.459 2.633 -7.741 1.00 0.00 C ATOM 0 H VAL A 61 0.753 6.039 -6.727 1.00 0.00 H new ATOM 0 HA VAL A 61 2.477 3.958 -5.610 1.00 0.00 H new ATOM 0 HB VAL A 61 2.086 4.486 -8.584 1.00 0.00 H new ATOM 0 HG11 VAL A 61 3.886 2.850 -8.942 1.00 0.00 H new ATOM 0 HG12 VAL A 61 4.465 4.289 -8.069 1.00 0.00 H new ATOM 0 HG13 VAL A 61 4.162 2.774 -7.185 1.00 0.00 H new ATOM 0 HG21 VAL A 61 1.551 2.085 -8.679 1.00 0.00 H new ATOM 0 HG22 VAL A 61 1.729 1.980 -6.911 1.00 0.00 H new ATOM 0 HG23 VAL A 61 0.430 2.970 -7.617 1.00 0.00 H new ATOM 874 N GLY A 62 4.312 5.629 -5.585 1.00 0.00 N ATOM 875 CA GLY A 62 5.350 6.640 -5.506 1.00 0.00 C ATOM 876 C GLY A 62 6.444 6.272 -4.524 1.00 0.00 C ATOM 877 O GLY A 62 6.737 5.094 -4.322 1.00 0.00 O ATOM 0 H GLY A 62 4.423 4.849 -4.937 1.00 0.00 H new ATOM 0 HA2 GLY A 62 5.787 6.786 -6.494 1.00 0.00 H new ATOM 0 HA3 GLY A 62 4.905 7.590 -5.211 1.00 0.00 H new ATOM 881 N LYS A 63 7.050 7.283 -3.911 1.00 0.00 N ATOM 882 CA LYS A 63 8.119 7.062 -2.943 1.00 0.00 C ATOM 883 C LYS A 63 7.909 7.914 -1.696 1.00 0.00 C ATOM 884 O LYS A 63 8.849 8.519 -1.182 1.00 0.00 O ATOM 885 CB LYS A 63 9.477 7.383 -3.571 1.00 0.00 C ATOM 886 CG LYS A 63 9.619 8.832 -4.005 1.00 0.00 C ATOM 887 CD LYS A 63 11.067 9.290 -3.954 1.00 0.00 C ATOM 888 CE LYS A 63 11.811 8.931 -5.231 1.00 0.00 C ATOM 889 NZ LYS A 63 12.416 7.572 -5.157 1.00 0.00 N ATOM 0 H LYS A 63 6.819 8.264 -4.067 1.00 0.00 H new ATOM 0 HA LYS A 63 8.100 6.012 -2.651 1.00 0.00 H new ATOM 0 HB2 LYS A 63 10.264 7.148 -2.854 1.00 0.00 H new ATOM 0 HB3 LYS A 63 9.630 6.737 -4.435 1.00 0.00 H new ATOM 0 HG2 LYS A 63 9.235 8.948 -5.018 1.00 0.00 H new ATOM 0 HG3 LYS A 63 9.013 9.467 -3.359 1.00 0.00 H new ATOM 0 HD2 LYS A 63 11.103 10.369 -3.802 1.00 0.00 H new ATOM 0 HD3 LYS A 63 11.565 8.831 -3.100 1.00 0.00 H new ATOM 0 HE2 LYS A 63 11.125 8.977 -6.076 1.00 0.00 H new ATOM 0 HE3 LYS A 63 12.593 9.667 -5.415 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 13.286 7.548 -5.726 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 12.643 7.346 -4.167 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 11.742 6.871 -5.526 1.00 0.00 H new ATOM 903 N GLU A 64 6.670 7.955 -1.215 1.00 0.00 N ATOM 904 CA GLU A 64 6.339 8.733 -0.027 1.00 0.00 C ATOM 905 C GLU A 64 6.083 7.819 1.169 1.00 0.00 C ATOM 906 O GLU A 64 5.999 6.599 1.026 1.00 0.00 O ATOM 907 CB GLU A 64 5.109 9.605 -0.288 1.00 0.00 C ATOM 908 CG GLU A 64 5.183 10.389 -1.588 1.00 0.00 C ATOM 909 CD GLU A 64 3.999 11.317 -1.778 1.00 0.00 C ATOM 910 OE1 GLU A 64 3.418 11.753 -0.763 1.00 0.00 O ATOM 911 OE2 GLU A 64 3.655 11.607 -2.943 1.00 0.00 O ATOM 0 H GLU A 64 5.880 7.459 -1.629 1.00 0.00 H new ATOM 0 HA GLU A 64 7.189 9.375 0.204 1.00 0.00 H new ATOM 0 HB2 GLU A 64 4.222 8.972 -0.306 1.00 0.00 H new ATOM 0 HB3 GLU A 64 4.986 10.302 0.541 1.00 0.00 H new ATOM 0 HG2 GLU A 64 6.103 10.973 -1.604 1.00 0.00 H new ATOM 0 HG3 GLU A 64 5.232 9.693 -2.425 1.00 0.00 H new ATOM 918 N THR A 65 5.961 8.419 2.349 1.00 0.00 N ATOM 919 CA THR A 65 5.717 7.661 3.570 1.00 0.00 C ATOM 920 C THR A 65 4.342 7.975 4.146 1.00 0.00 C ATOM 921 O THR A 65 4.059 7.669 5.304 1.00 0.00 O ATOM 922 CB THR A 65 6.788 7.955 4.637 1.00 0.00 C ATOM 923 OG1 THR A 65 6.653 9.299 5.110 1.00 0.00 O ATOM 924 CG2 THR A 65 8.186 7.749 4.072 1.00 0.00 C ATOM 0 H THR A 65 6.027 9.428 2.485 1.00 0.00 H new ATOM 0 HA THR A 65 5.763 6.606 3.302 1.00 0.00 H new ATOM 0 HB THR A 65 6.642 7.262 5.466 1.00 0.00 H new ATOM 0 HG1 THR A 65 7.337 9.477 5.789 1.00 0.00 H new ATOM 0 HG21 THR A 65 8.925 7.963 4.844 1.00 0.00 H new ATOM 0 HG22 THR A 65 8.296 6.717 3.740 1.00 0.00 H new ATOM 0 HG23 THR A 65 8.339 8.420 3.227 1.00 0.00 H new ATOM 932 N MET A 66 3.489 8.587 3.331 1.00 0.00 N ATOM 933 CA MET A 66 2.141 8.940 3.761 1.00 0.00 C ATOM 934 C MET A 66 1.292 9.388 2.575 1.00 0.00 C ATOM 935 O MET A 66 1.661 10.312 1.850 1.00 0.00 O ATOM 936 CB MET A 66 2.193 10.049 4.813 1.00 0.00 C ATOM 937 CG MET A 66 0.822 10.503 5.286 1.00 0.00 C ATOM 938 SD MET A 66 0.834 11.095 6.989 1.00 0.00 S ATOM 939 CE MET A 66 -0.454 12.338 6.926 1.00 0.00 C ATOM 0 H MET A 66 3.707 8.849 2.370 1.00 0.00 H new ATOM 0 HA MET A 66 1.682 8.054 4.200 1.00 0.00 H new ATOM 0 HB2 MET A 66 2.766 9.698 5.671 1.00 0.00 H new ATOM 0 HB3 MET A 66 2.728 10.905 4.401 1.00 0.00 H new ATOM 0 HG2 MET A 66 0.461 11.297 4.632 1.00 0.00 H new ATOM 0 HG3 MET A 66 0.119 9.674 5.199 1.00 0.00 H new ATOM 0 HE1 MET A 66 -1.005 12.339 7.867 1.00 0.00 H new ATOM 0 HE2 MET A 66 -0.006 13.319 6.767 1.00 0.00 H new ATOM 0 HE3 MET A 66 -1.137 12.114 6.106 1.00 0.00 H new ATOM 949 N CYS A 67 0.156 8.726 2.384 1.00 0.00 N ATOM 950 CA CYS A 67 -0.745 9.056 1.285 1.00 0.00 C ATOM 951 C CYS A 67 -2.200 8.986 1.735 1.00 0.00 C ATOM 952 O CYS A 67 -2.580 8.110 2.513 1.00 0.00 O ATOM 953 CB CYS A 67 -0.516 8.106 0.108 1.00 0.00 C ATOM 954 SG CYS A 67 -1.535 8.468 -1.341 1.00 0.00 S ATOM 0 H CYS A 67 -0.163 7.958 2.975 1.00 0.00 H new ATOM 0 HA CYS A 67 -0.531 10.076 0.966 1.00 0.00 H new ATOM 0 HB2 CYS A 67 0.534 8.148 -0.180 1.00 0.00 H new ATOM 0 HB3 CYS A 67 -0.716 7.085 0.434 1.00 0.00 H new ATOM 0 HG CYS A 67 -0.936 8.036 -2.411 1.00 0.00 H new ATOM 960 N THR A 68 -3.012 9.917 1.243 1.00 0.00 N ATOM 961 CA THR A 68 -4.425 9.963 1.597 1.00 0.00 C ATOM 962 C THR A 68 -5.305 9.920 0.352 1.00 0.00 C ATOM 963 O THR A 68 -4.964 10.495 -0.681 1.00 0.00 O ATOM 964 CB THR A 68 -4.761 11.230 2.405 1.00 0.00 C ATOM 965 OG1 THR A 68 -3.792 11.421 3.442 1.00 0.00 O ATOM 966 CG2 THR A 68 -6.151 11.131 3.015 1.00 0.00 C ATOM 0 H THR A 68 -2.715 10.649 0.598 1.00 0.00 H new ATOM 0 HA THR A 68 -4.626 9.085 2.212 1.00 0.00 H new ATOM 0 HB THR A 68 -4.740 12.083 1.726 1.00 0.00 H new ATOM 0 HG1 THR A 68 -4.012 12.230 3.950 1.00 0.00 H new ATOM 0 HG21 THR A 68 -6.365 12.038 3.581 1.00 0.00 H new ATOM 0 HG22 THR A 68 -6.889 11.015 2.221 1.00 0.00 H new ATOM 0 HG23 THR A 68 -6.196 10.269 3.680 1.00 0.00 H new ATOM 974 N VAL A 69 -6.439 9.234 0.459 1.00 0.00 N ATOM 975 CA VAL A 69 -7.369 9.117 -0.658 1.00 0.00 C ATOM 976 C VAL A 69 -8.625 9.947 -0.416 1.00 0.00 C ATOM 977 O VAL A 69 -9.100 10.058 0.714 1.00 0.00 O ATOM 978 CB VAL A 69 -7.774 7.651 -0.900 1.00 0.00 C ATOM 979 CG1 VAL A 69 -8.483 7.085 0.321 1.00 0.00 C ATOM 980 CG2 VAL A 69 -8.653 7.539 -2.136 1.00 0.00 C ATOM 0 H VAL A 69 -6.735 8.751 1.307 1.00 0.00 H new ATOM 0 HA VAL A 69 -6.853 9.494 -1.541 1.00 0.00 H new ATOM 0 HB VAL A 69 -6.870 7.065 -1.070 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -8.762 6.048 0.132 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -7.816 7.130 1.182 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -9.380 7.670 0.525 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -8.930 6.496 -2.292 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -9.554 8.137 -1.997 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -8.106 7.903 -3.006 1.00 0.00 H new ATOM 990 N ASP A 70 -9.158 10.528 -1.485 1.00 0.00 N ATOM 991 CA ASP A 70 -10.360 11.348 -1.390 1.00 0.00 C ATOM 992 C ASP A 70 -11.487 10.758 -2.232 1.00 0.00 C ATOM 993 O ASP A 70 -11.249 10.190 -3.297 1.00 0.00 O ATOM 994 CB ASP A 70 -10.065 12.779 -1.841 1.00 0.00 C ATOM 995 CG ASP A 70 -11.275 13.453 -2.458 1.00 0.00 C ATOM 996 OD1 ASP A 70 -11.566 13.182 -3.642 1.00 0.00 O ATOM 997 OD2 ASP A 70 -11.931 14.251 -1.756 1.00 0.00 O ATOM 0 H ASP A 70 -8.777 10.446 -2.427 1.00 0.00 H new ATOM 0 HA ASP A 70 -10.678 11.363 -0.348 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -9.724 13.363 -0.986 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -9.250 12.768 -2.565 1.00 0.00 H new ATOM 1002 N GLY A 71 -12.717 10.897 -1.747 1.00 0.00 N ATOM 1003 CA GLY A 71 -13.863 10.373 -2.466 1.00 0.00 C ATOM 1004 C GLY A 71 -14.103 8.903 -2.182 1.00 0.00 C ATOM 1005 O GLY A 71 -13.971 8.061 -3.071 1.00 0.00 O ATOM 0 H GLY A 71 -12.940 11.364 -0.868 1.00 0.00 H new ATOM 0 HA2 GLY A 71 -14.751 10.943 -2.192 1.00 0.00 H new ATOM 0 HA3 GLY A 71 -13.712 10.513 -3.536 1.00 0.00 H new ATOM 1009 N LEU A 72 -14.455 8.593 -0.939 1.00 0.00 N ATOM 1010 CA LEU A 72 -14.712 7.214 -0.539 1.00 0.00 C ATOM 1011 C LEU A 72 -16.194 6.999 -0.249 1.00 0.00 C ATOM 1012 O LEU A 72 -16.853 7.854 0.344 1.00 0.00 O ATOM 1013 CB LEU A 72 -13.883 6.857 0.696 1.00 0.00 C ATOM 1014 CG LEU A 72 -12.365 6.859 0.509 1.00 0.00 C ATOM 1015 CD1 LEU A 72 -11.661 6.783 1.855 1.00 0.00 C ATOM 1016 CD2 LEU A 72 -11.937 5.705 -0.385 1.00 0.00 C ATOM 0 H LEU A 72 -14.569 9.277 -0.191 1.00 0.00 H new ATOM 0 HA LEU A 72 -14.423 6.563 -1.364 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -14.132 7.559 1.491 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -14.186 5.867 1.038 1.00 0.00 H new ATOM 0 HG LEU A 72 -12.079 7.793 0.025 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -10.582 6.785 1.702 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -11.943 7.643 2.462 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -11.953 5.866 2.367 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -10.854 5.722 -0.507 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -12.236 4.761 0.071 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -12.414 5.804 -1.360 1.00 0.00 H new ATOM 1028 N HIS A 73 -16.714 5.850 -0.671 1.00 0.00 N ATOM 1029 CA HIS A 73 -18.118 5.520 -0.454 1.00 0.00 C ATOM 1030 C HIS A 73 -18.482 5.637 1.023 1.00 0.00 C ATOM 1031 O HIS A 73 -17.608 5.640 1.890 1.00 0.00 O ATOM 1032 CB HIS A 73 -18.415 4.106 -0.954 1.00 0.00 C ATOM 1033 CG HIS A 73 -19.856 3.882 -1.296 1.00 0.00 C ATOM 1034 ND1 HIS A 73 -20.711 3.142 -0.506 1.00 0.00 N ATOM 1035 CD2 HIS A 73 -20.593 4.307 -2.349 1.00 0.00 C ATOM 1036 CE1 HIS A 73 -21.910 3.121 -1.060 1.00 0.00 C ATOM 1037 NE2 HIS A 73 -21.865 3.821 -2.179 1.00 0.00 N ATOM 0 H HIS A 73 -16.184 5.132 -1.165 1.00 0.00 H new ATOM 0 HA HIS A 73 -18.723 6.231 -1.017 1.00 0.00 H new ATOM 0 HB2 HIS A 73 -17.806 3.906 -1.835 1.00 0.00 H new ATOM 0 HB3 HIS A 73 -18.116 3.389 -0.190 1.00 0.00 H new ATOM 0 HD2 HIS A 73 -20.245 4.916 -3.170 1.00 0.00 H new ATOM 0 HE1 HIS A 73 -22.780 2.617 -0.665 1.00 0.00 H new ATOM 0 HE2 HIS A 73 -22.648 3.975 -2.814 1.00 0.00 H new ATOM 1046 N PHE A 74 -19.778 5.734 1.302 1.00 0.00 N ATOM 1047 CA PHE A 74 -20.257 5.853 2.674 1.00 0.00 C ATOM 1048 C PHE A 74 -20.993 4.588 3.105 1.00 0.00 C ATOM 1049 O PHE A 74 -21.451 3.808 2.270 1.00 0.00 O ATOM 1050 CB PHE A 74 -21.181 7.065 2.811 1.00 0.00 C ATOM 1051 CG PHE A 74 -20.447 8.374 2.867 1.00 0.00 C ATOM 1052 CD1 PHE A 74 -20.049 9.011 1.703 1.00 0.00 C ATOM 1053 CD2 PHE A 74 -20.156 8.969 4.084 1.00 0.00 C ATOM 1054 CE1 PHE A 74 -19.373 10.216 1.752 1.00 0.00 C ATOM 1055 CE2 PHE A 74 -19.480 10.173 4.140 1.00 0.00 C ATOM 1056 CZ PHE A 74 -19.089 10.798 2.972 1.00 0.00 C ATOM 0 H PHE A 74 -20.515 5.733 0.596 1.00 0.00 H new ATOM 0 HA PHE A 74 -19.392 5.988 3.323 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -21.873 7.081 1.969 1.00 0.00 H new ATOM 0 HB3 PHE A 74 -21.781 6.955 3.715 1.00 0.00 H new ATOM 0 HD1 PHE A 74 -20.269 8.561 0.746 1.00 0.00 H new ATOM 0 HD2 PHE A 74 -20.461 8.486 5.000 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -19.067 10.702 0.837 1.00 0.00 H new ATOM 0 HE2 PHE A 74 -19.258 10.625 5.096 1.00 0.00 H new ATOM 0 HZ PHE A 74 -18.562 11.740 3.013 1.00 0.00 H new ATOM 1066 N ASN A 75 -21.103 4.390 4.415 1.00 0.00 N ATOM 1067 CA ASN A 75 -21.782 3.219 4.957 1.00 0.00 C ATOM 1068 C ASN A 75 -21.364 1.955 4.213 1.00 0.00 C ATOM 1069 O ASN A 75 -22.206 1.147 3.819 1.00 0.00 O ATOM 1070 CB ASN A 75 -23.299 3.398 4.870 1.00 0.00 C ATOM 1071 CG ASN A 75 -24.037 2.603 5.930 1.00 0.00 C ATOM 1072 OD1 ASN A 75 -24.128 1.377 5.851 1.00 0.00 O ATOM 1073 ND2 ASN A 75 -24.568 3.298 6.929 1.00 0.00 N ATOM 0 H ASN A 75 -20.731 5.026 5.120 1.00 0.00 H new ATOM 0 HA ASN A 75 -21.495 3.115 6.003 1.00 0.00 H new ATOM 0 HB2 ASN A 75 -23.544 4.455 4.976 1.00 0.00 H new ATOM 0 HB3 ASN A 75 -23.643 3.089 3.883 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -25.076 2.817 7.671 1.00 0.00 H new ATOM 0 HD22 ASN A 75 -24.468 4.313 6.954 1.00 0.00 H new ATOM 1080 N SER A 76 -20.059 1.789 4.025 1.00 0.00 N ATOM 1081 CA SER A 76 -19.529 0.625 3.326 1.00 0.00 C ATOM 1082 C SER A 76 -18.121 0.293 3.812 1.00 0.00 C ATOM 1083 O SER A 76 -17.239 1.152 3.831 1.00 0.00 O ATOM 1084 CB SER A 76 -19.514 0.873 1.816 1.00 0.00 C ATOM 1085 OG SER A 76 -20.769 0.564 1.236 1.00 0.00 O ATOM 0 H SER A 76 -19.349 2.447 4.347 1.00 0.00 H new ATOM 0 HA SER A 76 -20.178 -0.223 3.541 1.00 0.00 H new ATOM 0 HB2 SER A 76 -19.265 1.916 1.618 1.00 0.00 H new ATOM 0 HB3 SER A 76 -18.736 0.266 1.352 1.00 0.00 H new ATOM 0 HG SER A 76 -21.016 1.266 0.598 1.00 0.00 H new ATOM 1091 N THR A 77 -17.918 -0.961 4.205 1.00 0.00 N ATOM 1092 CA THR A 77 -16.619 -1.407 4.693 1.00 0.00 C ATOM 1093 C THR A 77 -15.599 -1.470 3.562 1.00 0.00 C ATOM 1094 O THR A 77 -15.877 -2.008 2.491 1.00 0.00 O ATOM 1095 CB THR A 77 -16.716 -2.793 5.359 1.00 0.00 C ATOM 1096 OG1 THR A 77 -17.623 -2.742 6.466 1.00 0.00 O ATOM 1097 CG2 THR A 77 -15.349 -3.259 5.838 1.00 0.00 C ATOM 0 H THR A 77 -18.636 -1.685 4.195 1.00 0.00 H new ATOM 0 HA THR A 77 -16.291 -0.677 5.434 1.00 0.00 H new ATOM 0 HB THR A 77 -17.086 -3.503 4.619 1.00 0.00 H new ATOM 0 HG1 THR A 77 -17.680 -3.627 6.883 1.00 0.00 H new ATOM 0 HG21 THR A 77 -15.442 -4.240 6.305 1.00 0.00 H new ATOM 0 HG22 THR A 77 -14.669 -3.324 4.989 1.00 0.00 H new ATOM 0 HG23 THR A 77 -14.956 -2.547 6.564 1.00 0.00 H new ATOM 1105 N TYR A 78 -14.416 -0.917 3.808 1.00 0.00 N ATOM 1106 CA TYR A 78 -13.354 -0.908 2.809 1.00 0.00 C ATOM 1107 C TYR A 78 -12.143 -1.698 3.295 1.00 0.00 C ATOM 1108 O TYR A 78 -11.923 -1.841 4.497 1.00 0.00 O ATOM 1109 CB TYR A 78 -12.943 0.528 2.483 1.00 0.00 C ATOM 1110 CG TYR A 78 -13.724 1.137 1.340 1.00 0.00 C ATOM 1111 CD1 TYR A 78 -13.386 0.867 0.020 1.00 0.00 C ATOM 1112 CD2 TYR A 78 -14.801 1.982 1.580 1.00 0.00 C ATOM 1113 CE1 TYR A 78 -14.095 1.421 -1.027 1.00 0.00 C ATOM 1114 CE2 TYR A 78 -15.517 2.539 0.539 1.00 0.00 C ATOM 1115 CZ TYR A 78 -15.161 2.256 -0.763 1.00 0.00 C ATOM 1116 OH TYR A 78 -15.871 2.810 -1.803 1.00 0.00 O ATOM 0 H TYR A 78 -14.169 -0.469 4.691 1.00 0.00 H new ATOM 0 HA TYR A 78 -13.736 -1.383 1.905 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -13.075 1.145 3.372 1.00 0.00 H new ATOM 0 HB3 TYR A 78 -11.881 0.546 2.237 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -12.554 0.212 -0.191 1.00 0.00 H new ATOM 0 HD2 TYR A 78 -15.083 2.207 2.598 1.00 0.00 H new ATOM 0 HE1 TYR A 78 -13.817 1.202 -2.047 1.00 0.00 H new ATOM 0 HE2 TYR A 78 -16.352 3.193 0.743 1.00 0.00 H new ATOM 0 HH TYR A 78 -15.848 2.205 -2.574 1.00 0.00 H new ATOM 1126 N ASN A 79 -11.359 -2.207 2.350 1.00 0.00 N ATOM 1127 CA ASN A 79 -10.168 -2.983 2.681 1.00 0.00 C ATOM 1128 C ASN A 79 -8.964 -2.498 1.880 1.00 0.00 C ATOM 1129 O ASN A 79 -8.930 -2.621 0.655 1.00 0.00 O ATOM 1130 CB ASN A 79 -10.411 -4.469 2.411 1.00 0.00 C ATOM 1131 CG ASN A 79 -11.745 -4.945 2.952 1.00 0.00 C ATOM 1132 OD1 ASN A 79 -11.839 -5.391 4.096 1.00 0.00 O ATOM 1133 ND2 ASN A 79 -12.784 -4.852 2.131 1.00 0.00 N ATOM 0 H ASN A 79 -11.526 -2.097 1.350 1.00 0.00 H new ATOM 0 HA ASN A 79 -9.956 -2.844 3.741 1.00 0.00 H new ATOM 0 HB2 ASN A 79 -10.372 -4.651 1.337 1.00 0.00 H new ATOM 0 HB3 ASN A 79 -9.610 -5.053 2.863 1.00 0.00 H new ATOM 0 HD21 ASN A 79 -13.707 -5.157 2.440 1.00 0.00 H new ATOM 0 HD22 ASN A 79 -12.659 -4.476 1.191 1.00 0.00 H new ATOM 1140 N ALA A 80 -7.977 -1.949 2.579 1.00 0.00 N ATOM 1141 CA ALA A 80 -6.769 -1.448 1.934 1.00 0.00 C ATOM 1142 C ALA A 80 -5.554 -2.285 2.319 1.00 0.00 C ATOM 1143 O ALA A 80 -5.618 -3.105 3.235 1.00 0.00 O ATOM 1144 CB ALA A 80 -6.544 0.012 2.296 1.00 0.00 C ATOM 0 H ALA A 80 -7.990 -1.840 3.593 1.00 0.00 H new ATOM 0 HA ALA A 80 -6.904 -1.526 0.855 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -5.639 0.373 1.807 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -7.396 0.605 1.964 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -6.435 0.106 3.376 1.00 0.00 H new ATOM 1150 N ARG A 81 -4.448 -2.073 1.614 1.00 0.00 N ATOM 1151 CA ARG A 81 -3.218 -2.809 1.882 1.00 0.00 C ATOM 1152 C ARG A 81 -2.051 -2.224 1.092 1.00 0.00 C ATOM 1153 O ARG A 81 -2.102 -2.131 -0.134 1.00 0.00 O ATOM 1154 CB ARG A 81 -3.396 -4.287 1.529 1.00 0.00 C ATOM 1155 CG ARG A 81 -3.235 -4.583 0.047 1.00 0.00 C ATOM 1156 CD ARG A 81 -3.725 -5.981 -0.298 1.00 0.00 C ATOM 1157 NE ARG A 81 -3.590 -6.901 0.827 1.00 0.00 N ATOM 1158 CZ ARG A 81 -4.544 -7.103 1.730 1.00 0.00 C ATOM 1159 NH1 ARG A 81 -5.696 -6.453 1.638 1.00 0.00 N ATOM 1160 NH2 ARG A 81 -4.346 -7.958 2.726 1.00 0.00 N ATOM 0 H ARG A 81 -4.378 -1.398 0.853 1.00 0.00 H new ATOM 0 HA ARG A 81 -2.996 -2.720 2.945 1.00 0.00 H new ATOM 0 HB2 ARG A 81 -2.670 -4.876 2.089 1.00 0.00 H new ATOM 0 HB3 ARG A 81 -4.386 -4.612 1.850 1.00 0.00 H new ATOM 0 HG2 ARG A 81 -3.791 -3.848 -0.535 1.00 0.00 H new ATOM 0 HG3 ARG A 81 -2.186 -4.484 -0.233 1.00 0.00 H new ATOM 0 HD2 ARG A 81 -4.770 -5.934 -0.604 1.00 0.00 H new ATOM 0 HD3 ARG A 81 -3.161 -6.363 -1.149 1.00 0.00 H new ATOM 0 HE ARG A 81 -2.716 -7.417 0.926 1.00 0.00 H new ATOM 0 HH11 ARG A 81 -5.851 -5.796 0.873 1.00 0.00 H new ATOM 0 HH12 ARG A 81 -6.427 -6.610 2.332 1.00 0.00 H new ATOM 0 HH21 ARG A 81 -3.461 -8.460 2.799 1.00 0.00 H new ATOM 0 HH22 ARG A 81 -5.079 -8.113 3.419 1.00 0.00 H new ATOM 1174 N VAL A 82 -1.000 -1.829 1.804 1.00 0.00 N ATOM 1175 CA VAL A 82 0.180 -1.253 1.171 1.00 0.00 C ATOM 1176 C VAL A 82 1.332 -2.251 1.145 1.00 0.00 C ATOM 1177 O VAL A 82 1.438 -3.117 2.013 1.00 0.00 O ATOM 1178 CB VAL A 82 0.639 0.026 1.896 1.00 0.00 C ATOM 1179 CG1 VAL A 82 1.291 -0.319 3.226 1.00 0.00 C ATOM 1180 CG2 VAL A 82 1.590 0.824 1.018 1.00 0.00 C ATOM 0 H VAL A 82 -0.942 -1.898 2.820 1.00 0.00 H new ATOM 0 HA VAL A 82 -0.101 -1.000 0.149 1.00 0.00 H new ATOM 0 HB VAL A 82 -0.237 0.643 2.097 1.00 0.00 H new ATOM 0 HG11 VAL A 82 1.609 0.597 3.724 1.00 0.00 H new ATOM 0 HG12 VAL A 82 0.574 -0.845 3.857 1.00 0.00 H new ATOM 0 HG13 VAL A 82 2.158 -0.957 3.052 1.00 0.00 H new ATOM 0 HG21 VAL A 82 1.904 1.724 1.546 1.00 0.00 H new ATOM 0 HG22 VAL A 82 2.465 0.217 0.784 1.00 0.00 H new ATOM 0 HG23 VAL A 82 1.084 1.104 0.094 1.00 0.00 H new ATOM 1190 N LYS A 83 2.195 -2.123 0.143 1.00 0.00 N ATOM 1191 CA LYS A 83 3.343 -3.012 0.003 1.00 0.00 C ATOM 1192 C LYS A 83 4.550 -2.260 -0.548 1.00 0.00 C ATOM 1193 O LYS A 83 4.434 -1.114 -0.981 1.00 0.00 O ATOM 1194 CB LYS A 83 2.996 -4.186 -0.916 1.00 0.00 C ATOM 1195 CG LYS A 83 2.535 -3.759 -2.300 1.00 0.00 C ATOM 1196 CD LYS A 83 2.864 -4.811 -3.346 1.00 0.00 C ATOM 1197 CE LYS A 83 2.796 -4.238 -4.753 1.00 0.00 C ATOM 1198 NZ LYS A 83 4.073 -3.581 -5.147 1.00 0.00 N ATOM 0 H LYS A 83 2.121 -1.412 -0.585 1.00 0.00 H new ATOM 0 HA LYS A 83 3.597 -3.395 0.991 1.00 0.00 H new ATOM 0 HB2 LYS A 83 3.870 -4.829 -1.016 1.00 0.00 H new ATOM 0 HB3 LYS A 83 2.213 -4.783 -0.449 1.00 0.00 H new ATOM 0 HG2 LYS A 83 1.460 -3.581 -2.288 1.00 0.00 H new ATOM 0 HG3 LYS A 83 3.011 -2.816 -2.568 1.00 0.00 H new ATOM 0 HD2 LYS A 83 3.862 -5.209 -3.162 1.00 0.00 H new ATOM 0 HD3 LYS A 83 2.167 -5.644 -3.257 1.00 0.00 H new ATOM 0 HE2 LYS A 83 2.565 -5.036 -5.459 1.00 0.00 H new ATOM 0 HE3 LYS A 83 1.982 -3.515 -4.812 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 4.121 -3.508 -6.183 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 4.117 -2.629 -4.730 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 4.875 -4.147 -4.803 1.00 0.00 H new ATOM 1212 N ALA A 84 5.707 -2.914 -0.531 1.00 0.00 N ATOM 1213 CA ALA A 84 6.934 -2.308 -1.033 1.00 0.00 C ATOM 1214 C ALA A 84 7.375 -2.962 -2.338 1.00 0.00 C ATOM 1215 O ALA A 84 7.002 -4.098 -2.632 1.00 0.00 O ATOM 1216 CB ALA A 84 8.037 -2.410 0.010 1.00 0.00 C ATOM 0 H ALA A 84 5.820 -3.863 -0.175 1.00 0.00 H new ATOM 0 HA ALA A 84 6.735 -1.255 -1.234 1.00 0.00 H new ATOM 0 HB1 ALA A 84 8.948 -1.954 -0.378 1.00 0.00 H new ATOM 0 HB2 ALA A 84 7.729 -1.891 0.917 1.00 0.00 H new ATOM 0 HB3 ALA A 84 8.226 -3.459 0.239 1.00 0.00 H new ATOM 1222 N PHE A 85 8.170 -2.237 -3.118 1.00 0.00 N ATOM 1223 CA PHE A 85 8.661 -2.746 -4.394 1.00 0.00 C ATOM 1224 C PHE A 85 9.868 -1.944 -4.871 1.00 0.00 C ATOM 1225 O PHE A 85 9.958 -0.740 -4.638 1.00 0.00 O ATOM 1226 CB PHE A 85 7.552 -2.697 -5.447 1.00 0.00 C ATOM 1227 CG PHE A 85 7.420 -1.359 -6.116 1.00 0.00 C ATOM 1228 CD1 PHE A 85 6.704 -0.336 -5.513 1.00 0.00 C ATOM 1229 CD2 PHE A 85 8.011 -1.122 -7.346 1.00 0.00 C ATOM 1230 CE1 PHE A 85 6.580 0.896 -6.127 1.00 0.00 C ATOM 1231 CE2 PHE A 85 7.891 0.108 -7.964 1.00 0.00 C ATOM 1232 CZ PHE A 85 7.175 1.119 -7.353 1.00 0.00 C ATOM 0 H PHE A 85 8.488 -1.295 -2.889 1.00 0.00 H new ATOM 0 HA PHE A 85 8.970 -3.781 -4.250 1.00 0.00 H new ATOM 0 HB2 PHE A 85 7.748 -3.456 -6.205 1.00 0.00 H new ATOM 0 HB3 PHE A 85 6.603 -2.954 -4.976 1.00 0.00 H new ATOM 0 HD1 PHE A 85 6.238 -0.504 -4.553 1.00 0.00 H new ATOM 0 HD2 PHE A 85 8.573 -1.908 -7.828 1.00 0.00 H new ATOM 0 HE1 PHE A 85 6.018 1.684 -5.648 1.00 0.00 H new ATOM 0 HE2 PHE A 85 8.356 0.279 -8.924 1.00 0.00 H new ATOM 0 HZ PHE A 85 7.081 2.082 -7.833 1.00 0.00 H new ATOM 1242 N ASN A 86 10.794 -2.623 -5.541 1.00 0.00 N ATOM 1243 CA ASN A 86 11.997 -1.974 -6.051 1.00 0.00 C ATOM 1244 C ASN A 86 12.661 -2.829 -7.127 1.00 0.00 C ATOM 1245 O ASN A 86 12.142 -3.877 -7.510 1.00 0.00 O ATOM 1246 CB ASN A 86 12.983 -1.713 -4.911 1.00 0.00 C ATOM 1247 CG ASN A 86 13.514 -2.996 -4.300 1.00 0.00 C ATOM 1248 OD1 ASN A 86 13.606 -4.024 -4.971 1.00 0.00 O ATOM 1249 ND2 ASN A 86 13.867 -2.941 -3.021 1.00 0.00 N ATOM 0 H ASN A 86 10.735 -3.621 -5.743 1.00 0.00 H new ATOM 0 HA ASN A 86 11.706 -1.022 -6.496 1.00 0.00 H new ATOM 0 HB2 ASN A 86 13.817 -1.119 -5.285 1.00 0.00 H new ATOM 0 HB3 ASN A 86 12.492 -1.122 -4.138 1.00 0.00 H new ATOM 0 HD21 ASN A 86 14.232 -3.773 -2.556 1.00 0.00 H new ATOM 0 HD22 ASN A 86 13.774 -2.067 -2.503 1.00 0.00 H new ATOM 1256 N LYS A 87 13.812 -2.373 -7.610 1.00 0.00 N ATOM 1257 CA LYS A 87 14.549 -3.094 -8.640 1.00 0.00 C ATOM 1258 C LYS A 87 14.444 -4.601 -8.430 1.00 0.00 C ATOM 1259 O LYS A 87 14.133 -5.349 -9.358 1.00 0.00 O ATOM 1260 CB LYS A 87 16.019 -2.669 -8.637 1.00 0.00 C ATOM 1261 CG LYS A 87 16.656 -2.670 -10.016 1.00 0.00 C ATOM 1262 CD LYS A 87 16.531 -1.313 -10.688 1.00 0.00 C ATOM 1263 CE LYS A 87 17.618 -1.106 -11.732 1.00 0.00 C ATOM 1264 NZ LYS A 87 17.851 0.338 -12.012 1.00 0.00 N ATOM 0 H LYS A 87 14.255 -1.506 -7.304 1.00 0.00 H new ATOM 0 HA LYS A 87 14.108 -2.848 -9.606 1.00 0.00 H new ATOM 0 HB2 LYS A 87 16.098 -1.669 -8.210 1.00 0.00 H new ATOM 0 HB3 LYS A 87 16.581 -3.339 -7.986 1.00 0.00 H new ATOM 0 HG2 LYS A 87 17.709 -2.940 -9.931 1.00 0.00 H new ATOM 0 HG3 LYS A 87 16.181 -3.430 -10.637 1.00 0.00 H new ATOM 0 HD2 LYS A 87 15.552 -1.228 -11.159 1.00 0.00 H new ATOM 0 HD3 LYS A 87 16.593 -0.526 -9.936 1.00 0.00 H new ATOM 0 HE2 LYS A 87 18.545 -1.563 -11.386 1.00 0.00 H new ATOM 0 HE3 LYS A 87 17.337 -1.614 -12.655 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 18.599 0.437 -12.728 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 16.973 0.769 -12.366 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 18.144 0.818 -11.137 1.00 0.00 H new ATOM 1278 N THR A 88 14.704 -5.043 -7.203 1.00 0.00 N ATOM 1279 CA THR A 88 14.639 -6.460 -6.871 1.00 0.00 C ATOM 1280 C THR A 88 13.375 -7.099 -7.435 1.00 0.00 C ATOM 1281 O THR A 88 13.437 -7.905 -8.363 1.00 0.00 O ATOM 1282 CB THR A 88 14.676 -6.682 -5.347 1.00 0.00 C ATOM 1283 OG1 THR A 88 15.851 -6.081 -4.793 1.00 0.00 O ATOM 1284 CG2 THR A 88 14.654 -8.167 -5.016 1.00 0.00 C ATOM 0 H THR A 88 14.962 -4.439 -6.423 1.00 0.00 H new ATOM 0 HA THR A 88 15.513 -6.931 -7.321 1.00 0.00 H new ATOM 0 HB THR A 88 13.792 -6.216 -4.912 1.00 0.00 H new ATOM 0 HG1 THR A 88 16.416 -6.775 -4.394 1.00 0.00 H new ATOM 0 HG21 THR A 88 14.681 -8.299 -3.934 1.00 0.00 H new ATOM 0 HG22 THR A 88 13.743 -8.615 -5.414 1.00 0.00 H new ATOM 0 HG23 THR A 88 15.522 -8.652 -5.462 1.00 0.00 H new ATOM 1292 N GLY A 89 12.229 -6.734 -6.870 1.00 0.00 N ATOM 1293 CA GLY A 89 10.966 -7.281 -7.331 1.00 0.00 C ATOM 1294 C GLY A 89 9.775 -6.672 -6.618 1.00 0.00 C ATOM 1295 O GLY A 89 9.402 -5.530 -6.882 1.00 0.00 O ATOM 0 H GLY A 89 12.152 -6.069 -6.101 1.00 0.00 H new ATOM 0 HA2 GLY A 89 10.870 -7.110 -8.403 1.00 0.00 H new ATOM 0 HA3 GLY A 89 10.964 -8.360 -7.178 1.00 0.00 H new ATOM 1299 N VAL A 90 9.175 -7.438 -5.712 1.00 0.00 N ATOM 1300 CA VAL A 90 8.018 -6.967 -4.959 1.00 0.00 C ATOM 1301 C VAL A 90 7.850 -7.752 -3.663 1.00 0.00 C ATOM 1302 O VAL A 90 8.286 -8.898 -3.558 1.00 0.00 O ATOM 1303 CB VAL A 90 6.725 -7.082 -5.787 1.00 0.00 C ATOM 1304 CG1 VAL A 90 6.463 -5.792 -6.550 1.00 0.00 C ATOM 1305 CG2 VAL A 90 6.805 -8.266 -6.739 1.00 0.00 C ATOM 0 H VAL A 90 9.471 -8.387 -5.482 1.00 0.00 H new ATOM 0 HA VAL A 90 8.198 -5.918 -4.725 1.00 0.00 H new ATOM 0 HB VAL A 90 5.891 -7.249 -5.105 1.00 0.00 H new ATOM 0 HG11 VAL A 90 5.545 -5.892 -7.129 1.00 0.00 H new ATOM 0 HG12 VAL A 90 6.359 -4.967 -5.845 1.00 0.00 H new ATOM 0 HG13 VAL A 90 7.297 -5.591 -7.223 1.00 0.00 H new ATOM 0 HG21 VAL A 90 5.883 -8.332 -7.316 1.00 0.00 H new ATOM 0 HG22 VAL A 90 7.648 -8.132 -7.417 1.00 0.00 H new ATOM 0 HG23 VAL A 90 6.942 -9.184 -6.167 1.00 0.00 H new ATOM 1315 N SER A 91 7.215 -7.126 -2.677 1.00 0.00 N ATOM 1316 CA SER A 91 6.991 -7.765 -1.385 1.00 0.00 C ATOM 1317 C SER A 91 5.507 -8.044 -1.166 1.00 0.00 C ATOM 1318 O SER A 91 4.638 -7.464 -1.818 1.00 0.00 O ATOM 1319 CB SER A 91 7.528 -6.882 -0.257 1.00 0.00 C ATOM 1320 OG SER A 91 8.882 -7.186 0.028 1.00 0.00 O ATOM 0 H SER A 91 6.847 -6.177 -2.748 1.00 0.00 H new ATOM 0 HA SER A 91 7.525 -8.715 -1.379 1.00 0.00 H new ATOM 0 HB2 SER A 91 7.439 -5.833 -0.539 1.00 0.00 H new ATOM 0 HB3 SER A 91 6.924 -7.024 0.639 1.00 0.00 H new ATOM 0 HG SER A 91 9.390 -6.354 0.127 1.00 0.00 H new ATOM 1326 N PRO A 92 5.209 -8.953 -0.227 1.00 0.00 N ATOM 1327 CA PRO A 92 3.831 -9.330 0.101 1.00 0.00 C ATOM 1328 C PRO A 92 3.076 -8.209 0.807 1.00 0.00 C ATOM 1329 O PRO A 92 3.646 -7.477 1.617 1.00 0.00 O ATOM 1330 CB PRO A 92 4.004 -10.530 1.036 1.00 0.00 C ATOM 1331 CG PRO A 92 5.352 -10.345 1.644 1.00 0.00 C ATOM 1332 CD PRO A 92 6.195 -9.683 0.589 1.00 0.00 C ATOM 0 HA PRO A 92 3.245 -9.549 -0.792 1.00 0.00 H new ATOM 0 HB2 PRO A 92 3.226 -10.553 1.799 1.00 0.00 H new ATOM 0 HB3 PRO A 92 3.942 -11.471 0.489 1.00 0.00 H new ATOM 0 HG2 PRO A 92 5.294 -9.728 2.541 1.00 0.00 H new ATOM 0 HG3 PRO A 92 5.780 -11.302 1.942 1.00 0.00 H new ATOM 0 HD2 PRO A 92 6.932 -9.009 1.027 1.00 0.00 H new ATOM 0 HD3 PRO A 92 6.745 -10.414 -0.004 1.00 0.00 H new ATOM 1340 N TYR A 93 1.791 -8.080 0.495 1.00 0.00 N ATOM 1341 CA TYR A 93 0.958 -7.047 1.099 1.00 0.00 C ATOM 1342 C TYR A 93 0.987 -7.143 2.621 1.00 0.00 C ATOM 1343 O TYR A 93 1.485 -8.119 3.183 1.00 0.00 O ATOM 1344 CB TYR A 93 -0.482 -7.166 0.597 1.00 0.00 C ATOM 1345 CG TYR A 93 -0.633 -6.889 -0.882 1.00 0.00 C ATOM 1346 CD1 TYR A 93 -0.277 -5.657 -1.418 1.00 0.00 C ATOM 1347 CD2 TYR A 93 -1.132 -7.858 -1.743 1.00 0.00 C ATOM 1348 CE1 TYR A 93 -0.413 -5.399 -2.768 1.00 0.00 C ATOM 1349 CE2 TYR A 93 -1.270 -7.609 -3.095 1.00 0.00 C ATOM 1350 CZ TYR A 93 -0.910 -6.378 -3.603 1.00 0.00 C ATOM 1351 OH TYR A 93 -1.048 -6.126 -4.948 1.00 0.00 O ATOM 0 H TYR A 93 1.304 -8.678 -0.173 1.00 0.00 H new ATOM 0 HA TYR A 93 1.359 -6.076 0.807 1.00 0.00 H new ATOM 0 HB2 TYR A 93 -0.850 -8.170 0.809 1.00 0.00 H new ATOM 0 HB3 TYR A 93 -1.111 -6.471 1.154 1.00 0.00 H new ATOM 0 HD1 TYR A 93 0.113 -4.888 -0.767 1.00 0.00 H new ATOM 0 HD2 TYR A 93 -1.417 -8.822 -1.349 1.00 0.00 H new ATOM 0 HE1 TYR A 93 -0.132 -4.436 -3.168 1.00 0.00 H new ATOM 0 HE2 TYR A 93 -1.658 -8.374 -3.751 1.00 0.00 H new ATOM 0 HH TYR A 93 -1.410 -6.920 -5.394 1.00 0.00 H new ATOM 1361 N SER A 94 0.450 -6.123 3.282 1.00 0.00 N ATOM 1362 CA SER A 94 0.416 -6.090 4.740 1.00 0.00 C ATOM 1363 C SER A 94 -0.907 -6.638 5.266 1.00 0.00 C ATOM 1364 O SER A 94 -1.799 -6.988 4.492 1.00 0.00 O ATOM 1365 CB SER A 94 0.625 -4.660 5.243 1.00 0.00 C ATOM 1366 OG SER A 94 -0.037 -3.724 4.411 1.00 0.00 O ATOM 0 H SER A 94 0.033 -5.309 2.832 1.00 0.00 H new ATOM 0 HA SER A 94 1.223 -6.721 5.112 1.00 0.00 H new ATOM 0 HB2 SER A 94 0.252 -4.572 6.263 1.00 0.00 H new ATOM 0 HB3 SER A 94 1.691 -4.434 5.273 1.00 0.00 H new ATOM 0 HG SER A 94 0.507 -3.553 3.614 1.00 0.00 H new ATOM 1372 N LYS A 95 -1.027 -6.708 6.587 1.00 0.00 N ATOM 1373 CA LYS A 95 -2.241 -7.212 7.219 1.00 0.00 C ATOM 1374 C LYS A 95 -3.463 -6.425 6.755 1.00 0.00 C ATOM 1375 O LYS A 95 -3.562 -5.219 6.984 1.00 0.00 O ATOM 1376 CB LYS A 95 -2.118 -7.132 8.743 1.00 0.00 C ATOM 1377 CG LYS A 95 -3.358 -7.608 9.479 1.00 0.00 C ATOM 1378 CD LYS A 95 -3.352 -9.116 9.664 1.00 0.00 C ATOM 1379 CE LYS A 95 -4.436 -9.563 10.634 1.00 0.00 C ATOM 1380 NZ LYS A 95 -4.014 -9.396 12.052 1.00 0.00 N ATOM 0 H LYS A 95 -0.299 -6.422 7.241 1.00 0.00 H new ATOM 0 HA LYS A 95 -2.368 -8.254 6.925 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -1.264 -7.730 9.062 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -1.910 -6.101 9.029 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -3.414 -7.121 10.453 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -4.248 -7.312 8.924 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -3.502 -9.602 8.700 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -2.377 -9.434 10.034 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -5.344 -8.987 10.455 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -4.681 -10.609 10.449 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -4.779 -9.711 12.681 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -3.162 -9.966 12.230 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -3.805 -8.394 12.236 1.00 0.00 H new ATOM 1394 N THR A 96 -4.393 -7.116 6.103 1.00 0.00 N ATOM 1395 CA THR A 96 -5.608 -6.482 5.607 1.00 0.00 C ATOM 1396 C THR A 96 -6.094 -5.400 6.565 1.00 0.00 C ATOM 1397 O THR A 96 -6.315 -5.658 7.749 1.00 0.00 O ATOM 1398 CB THR A 96 -6.735 -7.512 5.401 1.00 0.00 C ATOM 1399 OG1 THR A 96 -6.228 -8.661 4.713 1.00 0.00 O ATOM 1400 CG2 THR A 96 -7.883 -6.906 4.609 1.00 0.00 C ATOM 0 H THR A 96 -4.328 -8.115 5.906 1.00 0.00 H new ATOM 0 HA THR A 96 -5.359 -6.029 4.647 1.00 0.00 H new ATOM 0 HB THR A 96 -7.108 -7.811 6.381 1.00 0.00 H new ATOM 0 HG1 THR A 96 -6.950 -9.312 4.587 1.00 0.00 H new ATOM 0 HG21 THR A 96 -8.667 -7.652 4.476 1.00 0.00 H new ATOM 0 HG22 THR A 96 -8.285 -6.049 5.149 1.00 0.00 H new ATOM 0 HG23 THR A 96 -7.521 -6.582 3.633 1.00 0.00 H new ATOM 1408 N LEU A 97 -6.259 -4.188 6.046 1.00 0.00 N ATOM 1409 CA LEU A 97 -6.719 -3.065 6.856 1.00 0.00 C ATOM 1410 C LEU A 97 -8.161 -2.704 6.514 1.00 0.00 C ATOM 1411 O LEU A 97 -8.457 -2.269 5.401 1.00 0.00 O ATOM 1412 CB LEU A 97 -5.813 -1.852 6.642 1.00 0.00 C ATOM 1413 CG LEU A 97 -6.400 -0.497 7.042 1.00 0.00 C ATOM 1414 CD1 LEU A 97 -6.285 -0.288 8.544 1.00 0.00 C ATOM 1415 CD2 LEU A 97 -5.704 0.628 6.290 1.00 0.00 C ATOM 0 H LEU A 97 -6.081 -3.958 5.068 1.00 0.00 H new ATOM 0 HA LEU A 97 -6.676 -3.362 7.904 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -4.893 -2.007 7.205 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -5.539 -1.810 5.588 1.00 0.00 H new ATOM 0 HG LEU A 97 -7.457 -0.487 6.775 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -6.708 0.681 8.810 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -6.829 -1.076 9.064 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -5.235 -0.319 8.836 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -6.134 1.585 6.587 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -4.640 0.620 6.526 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -5.839 0.487 5.218 1.00 0.00 H new ATOM 1427 N VAL A 98 -9.056 -2.884 7.481 1.00 0.00 N ATOM 1428 CA VAL A 98 -10.467 -2.574 7.284 1.00 0.00 C ATOM 1429 C VAL A 98 -10.811 -1.200 7.849 1.00 0.00 C ATOM 1430 O VAL A 98 -10.314 -0.808 8.905 1.00 0.00 O ATOM 1431 CB VAL A 98 -11.371 -3.630 7.947 1.00 0.00 C ATOM 1432 CG1 VAL A 98 -12.835 -3.337 7.656 1.00 0.00 C ATOM 1433 CG2 VAL A 98 -10.994 -5.026 7.475 1.00 0.00 C ATOM 0 H VAL A 98 -8.829 -3.243 8.408 1.00 0.00 H new ATOM 0 HA VAL A 98 -10.645 -2.577 6.209 1.00 0.00 H new ATOM 0 HB VAL A 98 -11.223 -3.584 9.026 1.00 0.00 H new ATOM 0 HG11 VAL A 98 -13.459 -4.093 8.132 1.00 0.00 H new ATOM 0 HG12 VAL A 98 -13.094 -2.353 8.048 1.00 0.00 H new ATOM 0 HG13 VAL A 98 -13.002 -3.354 6.579 1.00 0.00 H new ATOM 0 HG21 VAL A 98 -11.643 -5.759 7.954 1.00 0.00 H new ATOM 0 HG22 VAL A 98 -11.112 -5.088 6.393 1.00 0.00 H new ATOM 0 HG23 VAL A 98 -9.957 -5.232 7.740 1.00 0.00 H new ATOM 1443 N LEU A 99 -11.665 -0.472 7.138 1.00 0.00 N ATOM 1444 CA LEU A 99 -12.077 0.860 7.567 1.00 0.00 C ATOM 1445 C LEU A 99 -13.594 1.007 7.507 1.00 0.00 C ATOM 1446 O LEU A 99 -14.182 1.025 6.426 1.00 0.00 O ATOM 1447 CB LEU A 99 -11.415 1.927 6.694 1.00 0.00 C ATOM 1448 CG LEU A 99 -11.103 1.517 5.254 1.00 0.00 C ATOM 1449 CD1 LEU A 99 -11.101 2.734 4.341 1.00 0.00 C ATOM 1450 CD2 LEU A 99 -9.767 0.792 5.183 1.00 0.00 C ATOM 0 H LEU A 99 -12.086 -0.782 6.262 1.00 0.00 H new ATOM 0 HA LEU A 99 -11.758 0.996 8.600 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -12.065 2.802 6.669 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -10.485 2.234 7.173 1.00 0.00 H new ATOM 0 HG LEU A 99 -11.882 0.835 4.914 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -10.877 2.423 3.321 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -12.081 3.211 4.368 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -10.344 3.441 4.679 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -9.562 0.508 4.151 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -8.976 1.450 5.542 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -9.805 -0.102 5.805 1.00 0.00 H new ATOM 1462 N GLN A 100 -14.220 1.112 8.674 1.00 0.00 N ATOM 1463 CA GLN A 100 -15.669 1.259 8.753 1.00 0.00 C ATOM 1464 C GLN A 100 -16.078 2.718 8.586 1.00 0.00 C ATOM 1465 O GLN A 100 -15.592 3.597 9.299 1.00 0.00 O ATOM 1466 CB GLN A 100 -16.185 0.721 10.089 1.00 0.00 C ATOM 1467 CG GLN A 100 -16.044 -0.786 10.233 1.00 0.00 C ATOM 1468 CD GLN A 100 -14.684 -1.197 10.760 1.00 0.00 C ATOM 1469 OE1 GLN A 100 -14.463 -1.247 11.970 1.00 0.00 O ATOM 1470 NE2 GLN A 100 -13.762 -1.494 9.851 1.00 0.00 N ATOM 0 H GLN A 100 -13.747 1.098 9.578 1.00 0.00 H new ATOM 0 HA GLN A 100 -16.113 0.682 7.942 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -15.644 1.207 10.901 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -17.235 0.992 10.199 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -16.817 -1.157 10.906 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -16.212 -1.257 9.264 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -13.989 -1.439 8.858 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -12.828 -1.777 10.146 1.00 0.00 H new ATOM 1479 N THR A 101 -16.977 2.972 7.639 1.00 0.00 N ATOM 1480 CA THR A 101 -17.450 4.325 7.378 1.00 0.00 C ATOM 1481 C THR A 101 -18.832 4.550 7.981 1.00 0.00 C ATOM 1482 O THR A 101 -19.594 3.604 8.180 1.00 0.00 O ATOM 1483 CB THR A 101 -17.508 4.617 5.866 1.00 0.00 C ATOM 1484 OG1 THR A 101 -18.228 3.578 5.193 1.00 0.00 O ATOM 1485 CG2 THR A 101 -16.108 4.731 5.283 1.00 0.00 C ATOM 0 H THR A 101 -17.392 2.258 7.041 1.00 0.00 H new ATOM 0 HA THR A 101 -16.738 5.005 7.845 1.00 0.00 H new ATOM 0 HB THR A 101 -18.023 5.567 5.721 1.00 0.00 H new ATOM 0 HG1 THR A 101 -17.596 2.914 4.847 1.00 0.00 H new ATOM 0 HG21 THR A 101 -16.174 4.937 4.215 1.00 0.00 H new ATOM 0 HG22 THR A 101 -15.573 5.542 5.777 1.00 0.00 H new ATOM 0 HG23 THR A 101 -15.572 3.795 5.439 1.00 0.00 H new ATOM 1493 N SER A 102 -19.150 5.808 8.268 1.00 0.00 N ATOM 1494 CA SER A 102 -20.440 6.156 8.852 1.00 0.00 C ATOM 1495 C SER A 102 -21.411 6.634 7.777 1.00 0.00 C ATOM 1496 O SER A 102 -21.003 7.207 6.767 1.00 0.00 O ATOM 1497 CB SER A 102 -20.266 7.241 9.916 1.00 0.00 C ATOM 1498 OG SER A 102 -19.366 6.823 10.928 1.00 0.00 O ATOM 0 H SER A 102 -18.532 6.603 8.106 1.00 0.00 H new ATOM 0 HA SER A 102 -20.853 5.262 9.319 1.00 0.00 H new ATOM 0 HB2 SER A 102 -19.896 8.155 9.451 1.00 0.00 H new ATOM 0 HB3 SER A 102 -21.233 7.478 10.360 1.00 0.00 H new ATOM 0 HG SER A 102 -19.270 7.535 11.595 1.00 0.00 H new ATOM 1504 N GLU A 103 -22.699 6.393 8.002 1.00 0.00 N ATOM 1505 CA GLU A 103 -23.729 6.797 7.052 1.00 0.00 C ATOM 1506 C GLU A 103 -23.417 8.170 6.463 1.00 0.00 C ATOM 1507 O GLU A 103 -22.977 9.076 7.170 1.00 0.00 O ATOM 1508 CB GLU A 103 -25.100 6.821 7.731 1.00 0.00 C ATOM 1509 CG GLU A 103 -25.175 7.770 8.916 1.00 0.00 C ATOM 1510 CD GLU A 103 -26.493 7.670 9.660 1.00 0.00 C ATOM 1511 OE1 GLU A 103 -26.670 6.699 10.425 1.00 0.00 O ATOM 1512 OE2 GLU A 103 -27.346 8.563 9.478 1.00 0.00 O ATOM 0 H GLU A 103 -23.054 5.920 8.833 1.00 0.00 H new ATOM 0 HA GLU A 103 -23.746 6.068 6.242 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -25.854 7.108 6.998 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -25.348 5.814 8.066 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -24.357 7.553 9.603 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -25.036 8.793 8.567 1.00 0.00 H new ATOM 1519 N GLY A 104 -23.648 8.316 5.162 1.00 0.00 N ATOM 1520 CA GLY A 104 -23.386 9.580 4.499 1.00 0.00 C ATOM 1521 C GLY A 104 -24.248 10.706 5.035 1.00 0.00 C ATOM 1522 O GLY A 104 -23.739 11.661 5.621 1.00 0.00 O ATOM 0 H GLY A 104 -24.012 7.581 4.555 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -22.335 9.841 4.623 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -23.563 9.469 3.429 1.00 0.00 H new ATOM 1526 N SER A 105 -25.557 10.594 4.833 1.00 0.00 N ATOM 1527 CA SER A 105 -26.491 11.614 5.295 1.00 0.00 C ATOM 1528 C SER A 105 -26.744 11.479 6.794 1.00 0.00 C ATOM 1529 O SER A 105 -27.448 10.573 7.237 1.00 0.00 O ATOM 1530 CB SER A 105 -27.813 11.508 4.532 1.00 0.00 C ATOM 1531 OG SER A 105 -28.766 12.430 5.032 1.00 0.00 O ATOM 0 H SER A 105 -25.994 9.808 4.353 1.00 0.00 H new ATOM 0 HA SER A 105 -26.047 12.591 5.105 1.00 0.00 H new ATOM 0 HB2 SER A 105 -27.641 11.697 3.472 1.00 0.00 H new ATOM 0 HB3 SER A 105 -28.205 10.494 4.616 1.00 0.00 H new ATOM 0 HG SER A 105 -29.601 12.343 4.527 1.00 0.00 H new ATOM 1537 N GLY A 106 -26.163 12.389 7.570 1.00 0.00 N ATOM 1538 CA GLY A 106 -26.336 12.355 9.010 1.00 0.00 C ATOM 1539 C GLY A 106 -27.459 13.258 9.480 1.00 0.00 C ATOM 1540 O GLY A 106 -27.562 14.417 9.078 1.00 0.00 O ATOM 0 H GLY A 106 -25.576 13.149 7.227 1.00 0.00 H new ATOM 0 HA2 GLY A 106 -26.541 11.332 9.324 1.00 0.00 H new ATOM 0 HA3 GLY A 106 -25.406 12.656 9.492 1.00 0.00 H new ATOM 1544 N PRO A 107 -28.328 12.724 10.352 1.00 0.00 N ATOM 1545 CA PRO A 107 -29.465 13.472 10.895 1.00 0.00 C ATOM 1546 C PRO A 107 -29.029 14.574 11.855 1.00 0.00 C ATOM 1547 O PRO A 107 -28.288 14.325 12.805 1.00 0.00 O ATOM 1548 CB PRO A 107 -30.270 12.403 11.638 1.00 0.00 C ATOM 1549 CG PRO A 107 -29.273 11.354 11.991 1.00 0.00 C ATOM 1550 CD PRO A 107 -28.265 11.349 10.874 1.00 0.00 C ATOM 0 HA PRO A 107 -30.028 13.983 10.114 1.00 0.00 H new ATOM 0 HB2 PRO A 107 -30.745 12.813 12.529 1.00 0.00 H new ATOM 0 HB3 PRO A 107 -31.065 11.999 11.011 1.00 0.00 H new ATOM 0 HG2 PRO A 107 -28.796 11.574 12.946 1.00 0.00 H new ATOM 0 HG3 PRO A 107 -29.750 10.379 12.090 1.00 0.00 H new ATOM 0 HD2 PRO A 107 -27.267 11.101 11.235 1.00 0.00 H new ATOM 0 HD3 PRO A 107 -28.518 10.616 10.108 1.00 0.00 H new ATOM 1558 N SER A 108 -29.495 15.792 11.600 1.00 0.00 N ATOM 1559 CA SER A 108 -29.150 16.933 12.440 1.00 0.00 C ATOM 1560 C SER A 108 -29.494 16.656 13.901 1.00 0.00 C ATOM 1561 O SER A 108 -30.658 16.714 14.298 1.00 0.00 O ATOM 1562 CB SER A 108 -29.885 18.187 11.961 1.00 0.00 C ATOM 1563 OG SER A 108 -31.280 17.958 11.873 1.00 0.00 O ATOM 0 H SER A 108 -30.112 16.014 10.819 1.00 0.00 H new ATOM 0 HA SER A 108 -28.075 17.098 12.362 1.00 0.00 H new ATOM 0 HB2 SER A 108 -29.691 19.011 12.648 1.00 0.00 H new ATOM 0 HB3 SER A 108 -29.500 18.488 10.986 1.00 0.00 H new ATOM 0 HG SER A 108 -31.576 17.440 12.650 1.00 0.00 H new ATOM 1569 N SER A 109 -28.472 16.354 14.695 1.00 0.00 N ATOM 1570 CA SER A 109 -28.665 16.064 16.111 1.00 0.00 C ATOM 1571 C SER A 109 -28.733 17.353 16.926 1.00 0.00 C ATOM 1572 O SER A 109 -28.428 18.434 16.425 1.00 0.00 O ATOM 1573 CB SER A 109 -27.531 15.178 16.631 1.00 0.00 C ATOM 1574 OG SER A 109 -27.468 13.958 15.914 1.00 0.00 O ATOM 0 H SER A 109 -27.502 16.304 14.382 1.00 0.00 H new ATOM 0 HA SER A 109 -29.611 15.534 16.222 1.00 0.00 H new ATOM 0 HB2 SER A 109 -26.582 15.706 16.540 1.00 0.00 H new ATOM 0 HB3 SER A 109 -27.682 14.973 17.691 1.00 0.00 H new ATOM 0 HG SER A 109 -26.734 13.410 16.264 1.00 0.00 H new ATOM 1580 N GLY A 110 -29.136 17.228 18.187 1.00 0.00 N ATOM 1581 CA GLY A 110 -29.238 18.389 19.051 1.00 0.00 C ATOM 1582 C GLY A 110 -30.672 18.716 19.417 1.00 0.00 C ATOM 1583 O GLY A 110 -31.605 18.291 18.736 1.00 0.00 O ATOM 0 H GLY A 110 -29.393 16.344 18.625 1.00 0.00 H new ATOM 0 HA2 GLY A 110 -28.665 18.212 19.961 1.00 0.00 H new ATOM 0 HA3 GLY A 110 -28.788 19.248 18.554 1.00 0.00 H new TER 1587 GLY A 110