USER MOD reduce.3.24.130724 H: found=0, std=0, add=1081, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 1080 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 NoAdj-H: A 46 HIS HD1 : A 46 HIS ND1 : A 155 CU1CU :(H bumps) USER MOD NoAdj-H: A 48 HIS HE2 : A 48 HIS NE2 : A 155 CU1CU :(H bumps) USER MOD NoAdj-H: A 63 HIS HD1 : A 63 HIS ND1 : A 154 ZNZN :(H bumps) USER MOD NoAdj-H: A 71 HIS HD1 : A 71 HIS ND1 : A 154 ZNZN :(H bumps) USER MOD NoAdj-H: A 80 HIS HD1 : A 80 HIS ND1 : A 154 ZNZN :(H bumps) USER MOD NoAdj-H: A 120 HIS HE2 : A 120 HIS NE2 : A 155 CU1CU :(H bumps) USER MOD Set 1.1: A 133 GLN : amide:sc= -0.248 K(o=1.2,f=-0.65) USER MOD Set 1.2: A 137 THR OG1 : rot -61:sc= 1.4 USER MOD Set 2.1: A 22 GLN : amide:sc= 0.744 K(o=1.8,f=-3.7!) USER MOD Set 2.2: A 105 SER OG : rot 31:sc= 1.06 USER MOD Set 3.1: A 39 THR OG1 : rot 180:sc= 0.101 USER MOD Set 3.2: A 43 HIS : no HE2:sc= -3.42! C(o=-3.3!,f=-12!) USER MOD Single : A 1 ALA N :NH3+ -161:sc= 1.34 (180deg=1.19) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0.125 USER MOD Single : A 3 LYS NZ :NH3+ -115:sc= 1.11 (180deg=-1.46!) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 GLN : amide:sc= -0.498 X(o=-0.5,f=-0.66) USER MOD Single : A 19 ASN : amide:sc= 0.246 K(o=0.25,f=-2.3!) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 26 ASN : amide:sc= 0 X(o=0,f=-0.31) USER MOD Single : A 30 LYS NZ :NH3+ 178:sc= 1.17 (180deg=1.12) USER MOD Single : A 34 SER OG : rot 93:sc= 1.29 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 ASN : amide:sc= -0.427 X(o=-0.43,f=0) USER MOD Single : A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 65 ASN : amide:sc= -0.991 K(o=-0.99,f=-0.13) USER MOD Single : A 68 SER OG : rot -170:sc= -0.165 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 ASN : amide:sc= 1.14 K(o=1.1,f=-0.51) USER MOD Single : A 88 THR OG1 : rot 180:sc= -0.187 USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 102 SER OG : rot 180:sc= 0.0262 USER MOD Single : A 107 SER OG : rot 180:sc= -0.452 USER MOD Single : A 110 HIS : no HD1:sc= -0.0904 X(o=-0.09,f=-0.23) USER MOD Single : A 111 SER OG : rot 105:sc= 0.988 USER MOD Single : A 116 THR OG1 : rot -170:sc= -0.386 USER MOD Single : A 122 LYS NZ :NH3+ 158:sc= -0.0113 (180deg=-0.672) USER MOD Single : A 128 LYS NZ :NH3+ 168:sc=-0.00928 (180deg=-0.194) USER MOD Single : A 131 ASN : amide:sc= -4.13! K(o=-4.1!,f=-0.66) USER MOD Single : A 134 SER OG : rot 133:sc= 1.29 USER MOD Single : A 135 THR OG1 : rot -63:sc= 1.08 USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 ASN : amide:sc= 0.597 K(o=0.6,f=-0.11) USER MOD Single : A 142 SER OG : rot 180:sc= -0.043 USER MOD Single : A 153 GLN : amide:sc= 0 X(o=0,f=-0.045) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 17.806 5.834 10.815 1.00 0.00 N ATOM 2 CA ALA A 1 17.775 7.149 10.148 1.00 0.00 C ATOM 3 C ALA A 1 16.319 7.569 10.091 1.00 0.00 C ATOM 4 O ALA A 1 15.555 7.095 10.930 1.00 0.00 O ATOM 5 CB ALA A 1 18.589 8.220 10.892 1.00 0.00 C ATOM 0 H1 ALA A 1 18.766 5.646 11.167 1.00 0.00 H new ATOM 0 H2 ALA A 1 17.138 5.833 11.612 1.00 0.00 H new ATOM 0 H3 ALA A 1 17.535 5.094 10.136 1.00 0.00 H new ATOM 0 HA ALA A 1 18.226 7.059 9.160 1.00 0.00 H new ATOM 0 HB1 ALA A 1 18.527 9.165 10.352 1.00 0.00 H new ATOM 0 HB2 ALA A 1 18.187 8.350 11.897 1.00 0.00 H new ATOM 0 HB3 ALA A 1 19.631 7.906 10.956 1.00 0.00 H new ATOM 13 N THR A 2 15.939 8.434 9.151 1.00 0.00 N ATOM 14 CA THR A 2 14.561 8.845 8.957 1.00 0.00 C ATOM 15 C THR A 2 13.668 7.606 8.803 1.00 0.00 C ATOM 16 O THR A 2 13.814 6.877 7.815 1.00 0.00 O ATOM 17 CB THR A 2 14.513 9.753 7.721 1.00 0.00 C ATOM 18 OG1 THR A 2 15.712 10.505 7.655 1.00 0.00 O ATOM 19 CG2 THR A 2 13.302 10.686 7.755 1.00 0.00 C ATOM 0 H THR A 2 16.591 8.870 8.499 1.00 0.00 H new ATOM 0 HA THR A 2 14.186 9.400 9.817 1.00 0.00 H new ATOM 0 HB THR A 2 14.416 9.129 6.833 1.00 0.00 H new ATOM 0 HG1 THR A 2 15.690 11.087 6.867 1.00 0.00 H new ATOM 0 HG21 THR A 2 13.301 11.314 6.864 1.00 0.00 H new ATOM 0 HG22 THR A 2 12.387 10.094 7.782 1.00 0.00 H new ATOM 0 HG23 THR A 2 13.353 11.316 8.643 1.00 0.00 H new ATOM 27 N LYS A 3 12.795 7.375 9.794 1.00 0.00 N ATOM 28 CA LYS A 3 11.933 6.208 9.912 1.00 0.00 C ATOM 29 C LYS A 3 10.483 6.637 10.168 1.00 0.00 C ATOM 30 O LYS A 3 10.228 7.602 10.891 1.00 0.00 O ATOM 31 CB LYS A 3 12.438 5.269 11.024 1.00 0.00 C ATOM 32 CG LYS A 3 12.610 5.946 12.399 1.00 0.00 C ATOM 33 CD LYS A 3 12.501 4.950 13.568 1.00 0.00 C ATOM 34 CE LYS A 3 13.808 4.767 14.347 1.00 0.00 C ATOM 35 NZ LYS A 3 13.604 3.912 15.536 1.00 0.00 N ATOM 0 H LYS A 3 12.671 8.031 10.566 1.00 0.00 H new ATOM 0 HA LYS A 3 11.963 5.658 8.971 1.00 0.00 H new ATOM 0 HB2 LYS A 3 11.740 4.438 11.126 1.00 0.00 H new ATOM 0 HB3 LYS A 3 13.395 4.846 10.719 1.00 0.00 H new ATOM 0 HG2 LYS A 3 13.581 6.440 12.437 1.00 0.00 H new ATOM 0 HG3 LYS A 3 11.853 6.721 12.515 1.00 0.00 H new ATOM 0 HD2 LYS A 3 11.725 5.291 14.253 1.00 0.00 H new ATOM 0 HD3 LYS A 3 12.181 3.983 13.181 1.00 0.00 H new ATOM 0 HE2 LYS A 3 14.562 4.320 13.699 1.00 0.00 H new ATOM 0 HE3 LYS A 3 14.190 5.740 14.656 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 13.768 4.471 16.398 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 12.629 3.549 15.539 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 14.271 3.114 15.508 1.00 0.00 H new ATOM 49 N ALA A 4 9.530 5.903 9.595 1.00 0.00 N ATOM 50 CA ALA A 4 8.103 6.135 9.735 1.00 0.00 C ATOM 51 C ALA A 4 7.388 4.811 9.946 1.00 0.00 C ATOM 52 O ALA A 4 7.945 3.754 9.654 1.00 0.00 O ATOM 53 CB ALA A 4 7.582 6.834 8.487 1.00 0.00 C ATOM 0 H ALA A 4 9.744 5.103 9.000 1.00 0.00 H new ATOM 0 HA ALA A 4 7.914 6.771 10.600 1.00 0.00 H new ATOM 0 HB1 ALA A 4 6.511 7.010 8.589 1.00 0.00 H new ATOM 0 HB2 ALA A 4 8.096 7.787 8.362 1.00 0.00 H new ATOM 0 HB3 ALA A 4 7.765 6.206 7.615 1.00 0.00 H new ATOM 59 N VAL A 5 6.159 4.886 10.452 1.00 0.00 N ATOM 60 CA VAL A 5 5.296 3.768 10.772 1.00 0.00 C ATOM 61 C VAL A 5 3.887 4.115 10.291 1.00 0.00 C ATOM 62 O VAL A 5 3.520 5.291 10.291 1.00 0.00 O ATOM 63 CB VAL A 5 5.364 3.481 12.288 1.00 0.00 C ATOM 64 CG1 VAL A 5 4.901 4.676 13.134 1.00 0.00 C ATOM 65 CG2 VAL A 5 4.570 2.238 12.708 1.00 0.00 C ATOM 0 H VAL A 5 5.720 5.783 10.659 1.00 0.00 H new ATOM 0 HA VAL A 5 5.613 2.854 10.270 1.00 0.00 H new ATOM 0 HB VAL A 5 6.420 3.293 12.480 1.00 0.00 H new ATOM 0 HG11 VAL A 5 4.969 4.421 14.192 1.00 0.00 H new ATOM 0 HG12 VAL A 5 5.537 5.537 12.927 1.00 0.00 H new ATOM 0 HG13 VAL A 5 3.868 4.920 12.885 1.00 0.00 H new ATOM 0 HG21 VAL A 5 4.661 2.095 13.785 1.00 0.00 H new ATOM 0 HG22 VAL A 5 3.520 2.371 12.447 1.00 0.00 H new ATOM 0 HG23 VAL A 5 4.964 1.363 12.191 1.00 0.00 H new ATOM 75 N ALA A 6 3.097 3.115 9.890 1.00 0.00 N ATOM 76 CA ALA A 6 1.655 3.284 9.760 1.00 0.00 C ATOM 77 C ALA A 6 0.960 2.075 10.361 1.00 0.00 C ATOM 78 O ALA A 6 1.163 0.953 9.900 1.00 0.00 O ATOM 79 CB ALA A 6 1.236 3.496 8.305 1.00 0.00 C ATOM 0 H ALA A 6 3.435 2.183 9.651 1.00 0.00 H new ATOM 0 HA ALA A 6 1.356 4.182 10.302 1.00 0.00 H new ATOM 0 HB1 ALA A 6 0.154 3.618 8.252 1.00 0.00 H new ATOM 0 HB2 ALA A 6 1.721 4.390 7.913 1.00 0.00 H new ATOM 0 HB3 ALA A 6 1.533 2.632 7.711 1.00 0.00 H new ATOM 85 N VAL A 7 0.166 2.297 11.408 1.00 0.00 N ATOM 86 CA VAL A 7 -0.636 1.264 12.014 1.00 0.00 C ATOM 87 C VAL A 7 -1.972 1.169 11.265 1.00 0.00 C ATOM 88 O VAL A 7 -2.905 1.932 11.504 1.00 0.00 O ATOM 89 CB VAL A 7 -0.716 1.453 13.536 1.00 0.00 C ATOM 90 CG1 VAL A 7 0.661 1.795 14.124 1.00 0.00 C ATOM 91 CG2 VAL A 7 -1.738 2.482 14.043 1.00 0.00 C ATOM 0 H VAL A 7 0.069 3.209 11.854 1.00 0.00 H new ATOM 0 HA VAL A 7 -0.174 0.282 11.910 1.00 0.00 H new ATOM 0 HB VAL A 7 -1.073 0.484 13.886 1.00 0.00 H new ATOM 0 HG11 VAL A 7 0.574 1.923 15.203 1.00 0.00 H new ATOM 0 HG12 VAL A 7 1.359 0.986 13.910 1.00 0.00 H new ATOM 0 HG13 VAL A 7 1.028 2.719 13.677 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -1.701 2.526 15.131 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -1.501 3.463 13.632 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -2.738 2.188 13.726 1.00 0.00 H new ATOM 101 N LEU A 8 -2.053 0.244 10.312 1.00 0.00 N ATOM 102 CA LEU A 8 -3.296 -0.156 9.684 1.00 0.00 C ATOM 103 C LEU A 8 -4.250 -0.684 10.749 1.00 0.00 C ATOM 104 O LEU A 8 -3.811 -1.406 11.646 1.00 0.00 O ATOM 105 CB LEU A 8 -3.014 -1.209 8.601 1.00 0.00 C ATOM 106 CG LEU A 8 -2.910 -0.544 7.222 1.00 0.00 C ATOM 107 CD1 LEU A 8 -1.744 0.445 7.190 1.00 0.00 C ATOM 108 CD2 LEU A 8 -2.711 -1.640 6.177 1.00 0.00 C ATOM 0 H LEU A 8 -1.238 -0.254 9.953 1.00 0.00 H new ATOM 0 HA LEU A 8 -3.767 0.700 9.200 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -2.087 -1.735 8.829 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -3.810 -1.954 8.593 1.00 0.00 H new ATOM 0 HG LEU A 8 -3.822 0.013 7.008 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -1.686 0.907 6.204 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -1.901 1.217 7.944 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -0.813 -0.083 7.399 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -2.634 -1.190 5.187 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -1.796 -2.191 6.397 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -3.560 -2.323 6.200 1.00 0.00 H new ATOM 120 N LYS A 9 -5.536 -0.332 10.646 1.00 0.00 N ATOM 121 CA LYS A 9 -6.592 -0.829 11.510 1.00 0.00 C ATOM 122 C LYS A 9 -7.907 -0.776 10.729 1.00 0.00 C ATOM 123 O LYS A 9 -8.099 0.142 9.932 1.00 0.00 O ATOM 124 CB LYS A 9 -6.613 0.015 12.794 1.00 0.00 C ATOM 125 CG LYS A 9 -7.082 -0.781 14.020 1.00 0.00 C ATOM 126 CD LYS A 9 -6.395 -0.214 15.269 1.00 0.00 C ATOM 127 CE LYS A 9 -6.829 -0.975 16.528 1.00 0.00 C ATOM 128 NZ LYS A 9 -6.001 -0.618 17.699 1.00 0.00 N ATOM 0 H LYS A 9 -5.871 0.323 9.939 1.00 0.00 H new ATOM 0 HA LYS A 9 -6.429 -1.864 11.811 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -5.614 0.408 12.982 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -7.271 0.872 12.649 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -8.165 -0.714 14.122 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -6.838 -1.837 13.901 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -5.313 -0.280 15.155 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -6.641 0.843 15.376 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -7.875 -0.756 16.742 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -6.759 -2.047 16.347 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -6.325 -1.153 18.530 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -5.006 -0.850 17.504 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -6.088 0.401 17.888 1.00 0.00 H new ATOM 142 N GLY A 10 -8.780 -1.774 10.880 1.00 0.00 N ATOM 143 CA GLY A 10 -10.055 -1.820 10.184 1.00 0.00 C ATOM 144 C GLY A 10 -11.215 -1.938 11.160 1.00 0.00 C ATOM 145 O GLY A 10 -11.053 -1.738 12.362 1.00 0.00 O ATOM 0 H GLY A 10 -8.616 -2.573 11.492 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -10.175 -0.920 9.581 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -10.067 -2.667 9.498 1.00 0.00 H new ATOM 149 N ASP A 11 -12.383 -2.283 10.614 1.00 0.00 N ATOM 150 CA ASP A 11 -13.579 -2.577 11.381 1.00 0.00 C ATOM 151 C ASP A 11 -13.316 -3.749 12.330 1.00 0.00 C ATOM 152 O ASP A 11 -13.669 -3.705 13.507 1.00 0.00 O ATOM 153 CB ASP A 11 -14.711 -2.907 10.401 1.00 0.00 C ATOM 154 CG ASP A 11 -16.027 -3.149 11.128 1.00 0.00 C ATOM 155 OD1 ASP A 11 -16.190 -4.279 11.634 1.00 0.00 O ATOM 156 OD2 ASP A 11 -16.846 -2.206 11.142 1.00 0.00 O ATOM 0 H ASP A 11 -12.519 -2.365 9.606 1.00 0.00 H new ATOM 0 HA ASP A 11 -13.864 -1.717 11.987 1.00 0.00 H new ATOM 0 HB2 ASP A 11 -14.831 -2.087 9.693 1.00 0.00 H new ATOM 0 HB3 ASP A 11 -14.446 -3.792 9.822 1.00 0.00 H new ATOM 161 N GLY A 12 -12.658 -4.793 11.810 1.00 0.00 N ATOM 162 CA GLY A 12 -12.400 -6.008 12.548 1.00 0.00 C ATOM 163 C GLY A 12 -10.984 -5.969 13.108 1.00 0.00 C ATOM 164 O GLY A 12 -10.377 -4.905 13.222 1.00 0.00 O ATOM 0 H GLY A 12 -12.293 -4.805 10.858 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -13.121 -6.114 13.359 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -12.522 -6.874 11.898 1.00 0.00 H new ATOM 168 N PRO A 13 -10.413 -7.139 13.416 1.00 0.00 N ATOM 169 CA PRO A 13 -9.091 -7.235 13.999 1.00 0.00 C ATOM 170 C PRO A 13 -7.995 -7.010 12.955 1.00 0.00 C ATOM 171 O PRO A 13 -6.824 -6.962 13.327 1.00 0.00 O ATOM 172 CB PRO A 13 -9.033 -8.636 14.609 1.00 0.00 C ATOM 173 CG PRO A 13 -9.936 -9.453 13.683 1.00 0.00 C ATOM 174 CD PRO A 13 -10.995 -8.451 13.212 1.00 0.00 C ATOM 0 HA PRO A 13 -8.917 -6.465 14.751 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -8.015 -9.026 14.627 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -9.396 -8.644 15.637 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -9.377 -9.866 12.843 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -10.389 -10.294 14.208 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -11.245 -8.610 12.163 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -11.919 -8.562 13.780 1.00 0.00 H new ATOM 182 N VAL A 14 -8.372 -6.859 11.675 1.00 0.00 N ATOM 183 CA VAL A 14 -7.515 -6.407 10.592 1.00 0.00 C ATOM 184 C VAL A 14 -6.685 -5.227 11.078 1.00 0.00 C ATOM 185 O VAL A 14 -7.192 -4.108 11.174 1.00 0.00 O ATOM 186 CB VAL A 14 -8.354 -6.008 9.361 1.00 0.00 C ATOM 187 CG1 VAL A 14 -7.416 -5.868 8.158 1.00 0.00 C ATOM 188 CG2 VAL A 14 -9.444 -7.027 9.002 1.00 0.00 C ATOM 0 H VAL A 14 -9.323 -7.059 11.365 1.00 0.00 H new ATOM 0 HA VAL A 14 -6.853 -7.220 10.293 1.00 0.00 H new ATOM 0 HB VAL A 14 -8.856 -5.073 9.610 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -7.993 -5.586 7.277 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -6.671 -5.100 8.365 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -6.915 -6.819 7.974 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -9.993 -6.679 8.127 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -8.983 -7.990 8.783 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -10.131 -7.136 9.841 1.00 0.00 H new ATOM 198 N GLN A 15 -5.415 -5.488 11.384 1.00 0.00 N ATOM 199 CA GLN A 15 -4.471 -4.462 11.773 1.00 0.00 C ATOM 200 C GLN A 15 -3.208 -4.671 10.953 1.00 0.00 C ATOM 201 O GLN A 15 -3.035 -5.739 10.376 1.00 0.00 O ATOM 202 CB GLN A 15 -4.241 -4.527 13.293 1.00 0.00 C ATOM 203 CG GLN A 15 -3.421 -5.766 13.696 1.00 0.00 C ATOM 204 CD GLN A 15 -3.569 -6.194 15.156 1.00 0.00 C ATOM 205 OE1 GLN A 15 -3.197 -7.307 15.516 1.00 0.00 O ATOM 206 NE2 GLN A 15 -4.083 -5.325 16.024 1.00 0.00 N ATOM 0 H GLN A 15 -5.017 -6.427 11.366 1.00 0.00 H new ATOM 0 HA GLN A 15 -4.842 -3.457 11.570 1.00 0.00 H new ATOM 0 HB2 GLN A 15 -3.723 -3.626 13.621 1.00 0.00 H new ATOM 0 HB3 GLN A 15 -5.203 -4.546 13.805 1.00 0.00 H new ATOM 0 HG2 GLN A 15 -3.714 -6.600 13.058 1.00 0.00 H new ATOM 0 HG3 GLN A 15 -2.368 -5.566 13.497 1.00 0.00 H new ATOM 0 HE21 GLN A 15 -4.386 -4.405 15.705 1.00 0.00 H new ATOM 0 HE22 GLN A 15 -4.173 -5.579 17.008 1.00 0.00 H new ATOM 215 N GLY A 16 -2.314 -3.690 10.885 1.00 0.00 N ATOM 216 CA GLY A 16 -0.987 -3.957 10.358 1.00 0.00 C ATOM 217 C GLY A 16 0.022 -2.914 10.778 1.00 0.00 C ATOM 218 O GLY A 16 -0.284 -1.732 10.766 1.00 0.00 O ATOM 0 H GLY A 16 -2.480 -2.728 11.181 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -0.655 -4.938 10.699 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -1.033 -3.996 9.270 1.00 0.00 H new ATOM 222 N ILE A 17 1.229 -3.344 11.130 1.00 0.00 N ATOM 223 CA ILE A 17 2.334 -2.456 11.421 1.00 0.00 C ATOM 224 C ILE A 17 3.125 -2.323 10.120 1.00 0.00 C ATOM 225 O ILE A 17 3.796 -3.267 9.703 1.00 0.00 O ATOM 226 CB ILE A 17 3.146 -3.038 12.592 1.00 0.00 C ATOM 227 CG1 ILE A 17 2.279 -3.100 13.868 1.00 0.00 C ATOM 228 CG2 ILE A 17 4.399 -2.199 12.871 1.00 0.00 C ATOM 229 CD1 ILE A 17 2.358 -4.478 14.530 1.00 0.00 C ATOM 0 H ILE A 17 1.464 -4.332 11.221 1.00 0.00 H new ATOM 0 HA ILE A 17 2.024 -1.461 11.742 1.00 0.00 H new ATOM 0 HB ILE A 17 3.455 -4.045 12.310 1.00 0.00 H new ATOM 0 HG12 ILE A 17 2.610 -2.337 14.572 1.00 0.00 H new ATOM 0 HG13 ILE A 17 1.243 -2.874 13.617 1.00 0.00 H new ATOM 0 HG21 ILE A 17 4.951 -2.635 13.703 1.00 0.00 H new ATOM 0 HG22 ILE A 17 5.032 -2.184 11.984 1.00 0.00 H new ATOM 0 HG23 ILE A 17 4.106 -1.180 13.125 1.00 0.00 H new ATOM 0 HD11 ILE A 17 1.736 -4.488 15.425 1.00 0.00 H new ATOM 0 HD12 ILE A 17 2.003 -5.237 13.833 1.00 0.00 H new ATOM 0 HD13 ILE A 17 3.391 -4.692 14.803 1.00 0.00 H new ATOM 241 N ILE A 18 3.002 -1.174 9.452 1.00 0.00 N ATOM 242 CA ILE A 18 3.851 -0.790 8.333 1.00 0.00 C ATOM 243 C ILE A 18 5.017 -0.006 8.902 1.00 0.00 C ATOM 244 O ILE A 18 4.796 0.787 9.816 1.00 0.00 O ATOM 245 CB ILE A 18 3.062 0.094 7.356 1.00 0.00 C ATOM 246 CG1 ILE A 18 1.783 -0.597 6.874 1.00 0.00 C ATOM 247 CG2 ILE A 18 3.900 0.560 6.159 1.00 0.00 C ATOM 248 CD1 ILE A 18 2.075 -1.966 6.275 1.00 0.00 C ATOM 0 H ILE A 18 2.295 -0.475 9.681 1.00 0.00 H new ATOM 0 HA ILE A 18 4.199 -1.671 7.794 1.00 0.00 H new ATOM 0 HB ILE A 18 2.785 0.984 7.921 1.00 0.00 H new ATOM 0 HG12 ILE A 18 1.091 -0.705 7.709 1.00 0.00 H new ATOM 0 HG13 ILE A 18 1.290 0.028 6.130 1.00 0.00 H new ATOM 0 HG21 ILE A 18 3.287 1.181 5.505 1.00 0.00 H new ATOM 0 HG22 ILE A 18 4.752 1.139 6.515 1.00 0.00 H new ATOM 0 HG23 ILE A 18 4.257 -0.308 5.605 1.00 0.00 H new ATOM 0 HD11 ILE A 18 1.143 -2.425 5.945 1.00 0.00 H new ATOM 0 HD12 ILE A 18 2.747 -1.855 5.424 1.00 0.00 H new ATOM 0 HD13 ILE A 18 2.545 -2.600 7.027 1.00 0.00 H new ATOM 260 N ASN A 19 6.219 -0.181 8.350 1.00 0.00 N ATOM 261 CA ASN A 19 7.339 0.708 8.601 1.00 0.00 C ATOM 262 C ASN A 19 7.942 1.125 7.270 1.00 0.00 C ATOM 263 O ASN A 19 7.958 0.357 6.308 1.00 0.00 O ATOM 264 CB ASN A 19 8.426 0.091 9.487 1.00 0.00 C ATOM 265 CG ASN A 19 7.929 -0.800 10.621 1.00 0.00 C ATOM 266 OD1 ASN A 19 8.170 -2.005 10.621 1.00 0.00 O ATOM 267 ND2 ASN A 19 7.270 -0.220 11.619 1.00 0.00 N ATOM 0 H ASN A 19 6.437 -0.949 7.715 1.00 0.00 H new ATOM 0 HA ASN A 19 6.950 1.568 9.147 1.00 0.00 H new ATOM 0 HB2 ASN A 19 9.094 -0.495 8.856 1.00 0.00 H new ATOM 0 HB3 ASN A 19 9.020 0.898 9.917 1.00 0.00 H new ATOM 0 HD21 ASN A 19 6.950 -0.777 12.411 1.00 0.00 H new ATOM 0 HD22 ASN A 19 7.084 0.783 11.593 1.00 0.00 H new ATOM 274 N PHE A 20 8.460 2.347 7.238 1.00 0.00 N ATOM 275 CA PHE A 20 9.210 2.871 6.113 1.00 0.00 C ATOM 276 C PHE A 20 10.523 3.416 6.664 1.00 0.00 C ATOM 277 O PHE A 20 10.472 4.180 7.627 1.00 0.00 O ATOM 278 CB PHE A 20 8.412 3.984 5.424 1.00 0.00 C ATOM 279 CG PHE A 20 6.929 3.709 5.238 1.00 0.00 C ATOM 280 CD1 PHE A 20 6.014 4.026 6.259 1.00 0.00 C ATOM 281 CD2 PHE A 20 6.450 3.250 3.999 1.00 0.00 C ATOM 282 CE1 PHE A 20 4.633 3.927 6.025 1.00 0.00 C ATOM 283 CE2 PHE A 20 5.068 3.175 3.753 1.00 0.00 C ATOM 284 CZ PHE A 20 4.159 3.547 4.758 1.00 0.00 C ATOM 0 H PHE A 20 8.367 3.009 8.008 1.00 0.00 H new ATOM 0 HA PHE A 20 9.400 2.094 5.373 1.00 0.00 H new ATOM 0 HB2 PHE A 20 8.524 4.900 6.005 1.00 0.00 H new ATOM 0 HB3 PHE A 20 8.854 4.171 4.445 1.00 0.00 H new ATOM 0 HD1 PHE A 20 6.375 4.346 7.225 1.00 0.00 H new ATOM 0 HD2 PHE A 20 7.148 2.953 3.231 1.00 0.00 H new ATOM 0 HE1 PHE A 20 3.934 4.143 6.820 1.00 0.00 H new ATOM 0 HE2 PHE A 20 4.706 2.833 2.795 1.00 0.00 H new ATOM 0 HZ PHE A 20 3.098 3.541 4.557 1.00 0.00 H new ATOM 294 N GLU A 21 11.669 3.068 6.070 1.00 0.00 N ATOM 295 CA GLU A 21 12.927 3.776 6.329 1.00 0.00 C ATOM 296 C GLU A 21 13.469 4.367 5.031 1.00 0.00 C ATOM 297 O GLU A 21 13.291 3.796 3.952 1.00 0.00 O ATOM 298 CB GLU A 21 14.009 2.907 7.011 1.00 0.00 C ATOM 299 CG GLU A 21 14.319 3.349 8.460 1.00 0.00 C ATOM 300 CD GLU A 21 15.762 3.077 8.906 1.00 0.00 C ATOM 301 OE1 GLU A 21 16.236 1.953 8.637 1.00 0.00 O ATOM 302 OE2 GLU A 21 16.394 4.015 9.463 1.00 0.00 O ATOM 0 H GLU A 21 11.751 2.299 5.405 1.00 0.00 H new ATOM 0 HA GLU A 21 12.689 4.570 7.037 1.00 0.00 H new ATOM 0 HB2 GLU A 21 13.681 1.868 7.017 1.00 0.00 H new ATOM 0 HB3 GLU A 21 14.925 2.949 6.421 1.00 0.00 H new ATOM 0 HG2 GLU A 21 14.117 4.416 8.553 1.00 0.00 H new ATOM 0 HG3 GLU A 21 13.638 2.835 9.138 1.00 0.00 H new ATOM 309 N GLN A 22 14.159 5.503 5.176 1.00 0.00 N ATOM 310 CA GLN A 22 14.861 6.193 4.105 1.00 0.00 C ATOM 311 C GLN A 22 16.355 6.229 4.430 1.00 0.00 C ATOM 312 O GLN A 22 17.171 5.685 3.693 1.00 0.00 O ATOM 313 CB GLN A 22 14.265 7.602 3.969 1.00 0.00 C ATOM 314 CG GLN A 22 15.006 8.529 3.001 1.00 0.00 C ATOM 315 CD GLN A 22 14.816 8.165 1.537 1.00 0.00 C ATOM 316 OE1 GLN A 22 15.075 7.037 1.145 1.00 0.00 O ATOM 317 NE2 GLN A 22 14.408 9.123 0.715 1.00 0.00 N ATOM 0 H GLN A 22 14.243 5.978 6.075 1.00 0.00 H new ATOM 0 HA GLN A 22 14.743 5.676 3.152 1.00 0.00 H new ATOM 0 HB2 GLN A 22 13.230 7.512 3.641 1.00 0.00 H new ATOM 0 HB3 GLN A 22 14.248 8.069 4.954 1.00 0.00 H new ATOM 0 HG2 GLN A 22 14.664 9.552 3.159 1.00 0.00 H new ATOM 0 HG3 GLN A 22 16.070 8.509 3.236 1.00 0.00 H new ATOM 0 HE21 GLN A 22 14.201 10.053 1.079 1.00 0.00 H new ATOM 0 HE22 GLN A 22 14.301 8.929 -0.281 1.00 0.00 H new ATOM 326 N LYS A 23 16.718 6.911 5.523 1.00 0.00 N ATOM 327 CA LYS A 23 18.092 7.136 5.980 1.00 0.00 C ATOM 328 C LYS A 23 18.850 8.122 5.079 1.00 0.00 C ATOM 329 O LYS A 23 19.386 9.108 5.576 1.00 0.00 O ATOM 330 CB LYS A 23 18.873 5.826 6.193 1.00 0.00 C ATOM 331 CG LYS A 23 18.082 4.761 6.977 1.00 0.00 C ATOM 332 CD LYS A 23 18.006 3.446 6.193 1.00 0.00 C ATOM 333 CE LYS A 23 19.308 2.649 6.324 1.00 0.00 C ATOM 334 NZ LYS A 23 19.352 1.535 5.360 1.00 0.00 N ATOM 0 H LYS A 23 16.029 7.340 6.140 1.00 0.00 H new ATOM 0 HA LYS A 23 18.011 7.604 6.961 1.00 0.00 H new ATOM 0 HB2 LYS A 23 19.154 5.417 5.222 1.00 0.00 H new ATOM 0 HB3 LYS A 23 19.798 6.046 6.726 1.00 0.00 H new ATOM 0 HG2 LYS A 23 18.558 4.586 7.942 1.00 0.00 H new ATOM 0 HG3 LYS A 23 17.075 5.126 7.180 1.00 0.00 H new ATOM 0 HD2 LYS A 23 17.172 2.848 6.560 1.00 0.00 H new ATOM 0 HD3 LYS A 23 17.809 3.657 5.142 1.00 0.00 H new ATOM 0 HE2 LYS A 23 20.159 3.309 6.159 1.00 0.00 H new ATOM 0 HE3 LYS A 23 19.398 2.259 7.338 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 20.245 1.014 5.472 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 18.552 0.893 5.534 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 19.290 1.911 4.392 1.00 0.00 H new ATOM 348 N GLU A 24 18.837 7.902 3.761 1.00 0.00 N ATOM 349 CA GLU A 24 19.482 8.745 2.756 1.00 0.00 C ATOM 350 C GLU A 24 18.897 10.162 2.704 1.00 0.00 C ATOM 351 O GLU A 24 19.418 11.032 2.010 1.00 0.00 O ATOM 352 CB GLU A 24 19.325 8.052 1.395 1.00 0.00 C ATOM 353 CG GLU A 24 20.504 8.323 0.451 1.00 0.00 C ATOM 354 CD GLU A 24 21.610 7.299 0.667 1.00 0.00 C ATOM 355 OE1 GLU A 24 21.521 6.236 0.015 1.00 0.00 O ATOM 356 OE2 GLU A 24 22.492 7.579 1.505 1.00 0.00 O ATOM 0 H GLU A 24 18.358 7.100 3.351 1.00 0.00 H new ATOM 0 HA GLU A 24 20.533 8.863 3.021 1.00 0.00 H new ATOM 0 HB2 GLU A 24 19.228 6.977 1.549 1.00 0.00 H new ATOM 0 HB3 GLU A 24 18.403 8.391 0.924 1.00 0.00 H new ATOM 0 HG2 GLU A 24 20.164 8.286 -0.584 1.00 0.00 H new ATOM 0 HG3 GLU A 24 20.892 9.327 0.624 1.00 0.00 H new ATOM 363 N SER A 25 17.764 10.393 3.373 1.00 0.00 N ATOM 364 CA SER A 25 16.944 11.588 3.264 1.00 0.00 C ATOM 365 C SER A 25 16.242 11.643 1.901 1.00 0.00 C ATOM 366 O SER A 25 15.013 11.637 1.839 1.00 0.00 O ATOM 367 CB SER A 25 17.760 12.852 3.591 1.00 0.00 C ATOM 368 OG SER A 25 16.941 13.812 4.229 1.00 0.00 O ATOM 0 H SER A 25 17.382 9.717 4.034 1.00 0.00 H new ATOM 0 HA SER A 25 16.152 11.545 4.012 1.00 0.00 H new ATOM 0 HB2 SER A 25 18.600 12.594 4.236 1.00 0.00 H new ATOM 0 HB3 SER A 25 18.178 13.271 2.675 1.00 0.00 H new ATOM 0 HG SER A 25 17.471 14.610 4.433 1.00 0.00 H new ATOM 374 N ASN A 26 17.011 11.636 0.809 1.00 0.00 N ATOM 375 CA ASN A 26 16.498 11.851 -0.544 1.00 0.00 C ATOM 376 C ASN A 26 16.912 10.702 -1.461 1.00 0.00 C ATOM 377 O ASN A 26 17.236 10.924 -2.625 1.00 0.00 O ATOM 378 CB ASN A 26 17.006 13.199 -1.081 1.00 0.00 C ATOM 379 CG ASN A 26 16.543 14.376 -0.229 1.00 0.00 C ATOM 380 OD1 ASN A 26 17.207 14.757 0.728 1.00 0.00 O ATOM 381 ND2 ASN A 26 15.405 14.978 -0.567 1.00 0.00 N ATOM 0 H ASN A 26 18.018 11.479 0.841 1.00 0.00 H new ATOM 0 HA ASN A 26 15.409 11.877 -0.516 1.00 0.00 H new ATOM 0 HB2 ASN A 26 18.095 13.186 -1.116 1.00 0.00 H new ATOM 0 HB3 ASN A 26 16.656 13.335 -2.104 1.00 0.00 H new ATOM 0 HD21 ASN A 26 15.069 15.774 -0.025 1.00 0.00 H new ATOM 0 HD22 ASN A 26 14.869 14.643 -1.368 1.00 0.00 H new ATOM 388 N GLY A 27 16.911 9.474 -0.935 1.00 0.00 N ATOM 389 CA GLY A 27 17.252 8.271 -1.685 1.00 0.00 C ATOM 390 C GLY A 27 16.048 7.341 -1.830 1.00 0.00 C ATOM 391 O GLY A 27 14.908 7.794 -1.701 1.00 0.00 O ATOM 0 H GLY A 27 16.669 9.289 0.039 1.00 0.00 H new ATOM 0 HA2 GLY A 27 17.619 8.549 -2.673 1.00 0.00 H new ATOM 0 HA3 GLY A 27 18.062 7.744 -1.180 1.00 0.00 H new ATOM 395 N PRO A 28 16.290 6.052 -2.117 1.00 0.00 N ATOM 396 CA PRO A 28 15.242 5.064 -2.277 1.00 0.00 C ATOM 397 C PRO A 28 14.683 4.681 -0.906 1.00 0.00 C ATOM 398 O PRO A 28 15.409 4.153 -0.064 1.00 0.00 O ATOM 399 CB PRO A 28 15.904 3.882 -2.992 1.00 0.00 C ATOM 400 CG PRO A 28 17.362 3.960 -2.537 1.00 0.00 C ATOM 401 CD PRO A 28 17.602 5.459 -2.341 1.00 0.00 C ATOM 0 HA PRO A 28 14.394 5.429 -2.857 1.00 0.00 H new ATOM 0 HB2 PRO A 28 15.446 2.934 -2.709 1.00 0.00 H new ATOM 0 HB3 PRO A 28 15.816 3.968 -4.075 1.00 0.00 H new ATOM 0 HG2 PRO A 28 17.523 3.405 -1.613 1.00 0.00 H new ATOM 0 HG3 PRO A 28 18.037 3.541 -3.283 1.00 0.00 H new ATOM 0 HD2 PRO A 28 18.262 5.640 -1.493 1.00 0.00 H new ATOM 0 HD3 PRO A 28 18.082 5.895 -3.217 1.00 0.00 H new ATOM 409 N VAL A 29 13.387 4.918 -0.685 1.00 0.00 N ATOM 410 CA VAL A 29 12.726 4.511 0.541 1.00 0.00 C ATOM 411 C VAL A 29 12.518 3.005 0.449 1.00 0.00 C ATOM 412 O VAL A 29 12.116 2.523 -0.608 1.00 0.00 O ATOM 413 CB VAL A 29 11.399 5.288 0.723 1.00 0.00 C ATOM 414 CG1 VAL A 29 10.197 4.406 1.083 1.00 0.00 C ATOM 415 CG2 VAL A 29 11.554 6.318 1.844 1.00 0.00 C ATOM 0 H VAL A 29 12.777 5.394 -1.350 1.00 0.00 H new ATOM 0 HA VAL A 29 13.327 4.742 1.421 1.00 0.00 H new ATOM 0 HB VAL A 29 11.200 5.748 -0.245 1.00 0.00 H new ATOM 0 HG11 VAL A 29 9.309 5.028 1.192 1.00 0.00 H new ATOM 0 HG12 VAL A 29 10.032 3.675 0.292 1.00 0.00 H new ATOM 0 HG13 VAL A 29 10.394 3.887 2.021 1.00 0.00 H new ATOM 0 HG21 VAL A 29 10.618 6.863 1.969 1.00 0.00 H new ATOM 0 HG22 VAL A 29 11.805 5.808 2.774 1.00 0.00 H new ATOM 0 HG23 VAL A 29 12.350 7.017 1.588 1.00 0.00 H new ATOM 425 N LYS A 30 12.748 2.287 1.551 1.00 0.00 N ATOM 426 CA LYS A 30 12.303 0.917 1.734 1.00 0.00 C ATOM 427 C LYS A 30 10.979 0.970 2.496 1.00 0.00 C ATOM 428 O LYS A 30 10.922 1.513 3.601 1.00 0.00 O ATOM 429 CB LYS A 30 13.362 0.097 2.488 1.00 0.00 C ATOM 430 CG LYS A 30 14.113 -0.857 1.547 1.00 0.00 C ATOM 431 CD LYS A 30 15.088 -1.732 2.349 1.00 0.00 C ATOM 432 CE LYS A 30 15.600 -2.936 1.543 1.00 0.00 C ATOM 433 NZ LYS A 30 16.315 -2.539 0.314 1.00 0.00 N ATOM 0 H LYS A 30 13.260 2.656 2.353 1.00 0.00 H new ATOM 0 HA LYS A 30 12.159 0.422 0.774 1.00 0.00 H new ATOM 0 HB2 LYS A 30 14.072 0.771 2.967 1.00 0.00 H new ATOM 0 HB3 LYS A 30 12.882 -0.476 3.281 1.00 0.00 H new ATOM 0 HG2 LYS A 30 13.402 -1.487 1.013 1.00 0.00 H new ATOM 0 HG3 LYS A 30 14.659 -0.285 0.797 1.00 0.00 H new ATOM 0 HD2 LYS A 30 15.936 -1.126 2.668 1.00 0.00 H new ATOM 0 HD3 LYS A 30 14.592 -2.088 3.252 1.00 0.00 H new ATOM 0 HE2 LYS A 30 16.265 -3.530 2.169 1.00 0.00 H new ATOM 0 HE3 LYS A 30 14.757 -3.575 1.278 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 16.667 -3.388 -0.172 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 15.666 -2.024 -0.315 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 17.117 -1.924 0.562 1.00 0.00 H new ATOM 447 N VAL A 31 9.933 0.411 1.885 1.00 0.00 N ATOM 448 CA VAL A 31 8.604 0.219 2.440 1.00 0.00 C ATOM 449 C VAL A 31 8.533 -1.229 2.897 1.00 0.00 C ATOM 450 O VAL A 31 8.916 -2.123 2.145 1.00 0.00 O ATOM 451 CB VAL A 31 7.563 0.446 1.328 1.00 0.00 C ATOM 452 CG1 VAL A 31 6.149 0.027 1.754 1.00 0.00 C ATOM 453 CG2 VAL A 31 7.558 1.898 0.849 1.00 0.00 C ATOM 0 H VAL A 31 10.002 0.060 0.930 1.00 0.00 H new ATOM 0 HA VAL A 31 8.408 0.908 3.262 1.00 0.00 H new ATOM 0 HB VAL A 31 7.863 -0.194 0.498 1.00 0.00 H new ATOM 0 HG11 VAL A 31 5.454 0.208 0.934 1.00 0.00 H new ATOM 0 HG12 VAL A 31 6.144 -1.033 2.007 1.00 0.00 H new ATOM 0 HG13 VAL A 31 5.844 0.609 2.624 1.00 0.00 H new ATOM 0 HG21 VAL A 31 6.811 2.020 0.065 1.00 0.00 H new ATOM 0 HG22 VAL A 31 7.318 2.556 1.684 1.00 0.00 H new ATOM 0 HG23 VAL A 31 8.542 2.155 0.456 1.00 0.00 H new ATOM 463 N TRP A 32 7.993 -1.492 4.083 1.00 0.00 N ATOM 464 CA TRP A 32 7.716 -2.859 4.473 1.00 0.00 C ATOM 465 C TRP A 32 6.615 -2.838 5.508 1.00 0.00 C ATOM 466 O TRP A 32 6.257 -1.782 6.026 1.00 0.00 O ATOM 467 CB TRP A 32 8.985 -3.562 4.984 1.00 0.00 C ATOM 468 CG TRP A 32 9.510 -3.117 6.310 1.00 0.00 C ATOM 469 CD1 TRP A 32 9.025 -3.501 7.512 1.00 0.00 C ATOM 470 CD2 TRP A 32 10.637 -2.241 6.592 1.00 0.00 C ATOM 471 NE1 TRP A 32 9.766 -2.919 8.515 1.00 0.00 N ATOM 472 CE2 TRP A 32 10.796 -2.154 8.006 1.00 0.00 C ATOM 473 CE3 TRP A 32 11.538 -1.504 5.797 1.00 0.00 C ATOM 474 CZ2 TRP A 32 11.793 -1.370 8.602 1.00 0.00 C ATOM 475 CZ3 TRP A 32 12.557 -0.730 6.382 1.00 0.00 C ATOM 476 CH2 TRP A 32 12.689 -0.667 7.781 1.00 0.00 C ATOM 0 H TRP A 32 7.744 -0.786 4.776 1.00 0.00 H new ATOM 0 HA TRP A 32 7.384 -3.437 3.610 1.00 0.00 H new ATOM 0 HB2 TRP A 32 8.783 -4.632 5.040 1.00 0.00 H new ATOM 0 HB3 TRP A 32 9.772 -3.425 4.243 1.00 0.00 H new ATOM 0 HD1 TRP A 32 8.185 -4.163 7.662 1.00 0.00 H new ATOM 0 HE1 TRP A 32 9.578 -3.038 9.510 1.00 0.00 H new ATOM 0 HE3 TRP A 32 11.445 -1.534 4.721 1.00 0.00 H new ATOM 0 HZ2 TRP A 32 11.871 -1.307 9.677 1.00 0.00 H new ATOM 0 HZ3 TRP A 32 13.242 -0.181 5.753 1.00 0.00 H new ATOM 0 HH2 TRP A 32 13.479 -0.078 8.223 1.00 0.00 H new ATOM 487 N GLY A 33 6.062 -3.996 5.829 1.00 0.00 N ATOM 488 CA GLY A 33 5.078 -4.037 6.886 1.00 0.00 C ATOM 489 C GLY A 33 4.605 -5.443 7.117 1.00 0.00 C ATOM 490 O GLY A 33 5.104 -6.349 6.458 1.00 0.00 O ATOM 0 H GLY A 33 6.271 -4.891 5.387 1.00 0.00 H new ATOM 0 HA2 GLY A 33 5.507 -3.637 7.805 1.00 0.00 H new ATOM 0 HA3 GLY A 33 4.231 -3.401 6.626 1.00 0.00 H new ATOM 494 N SER A 34 3.643 -5.617 8.024 1.00 0.00 N ATOM 495 CA SER A 34 3.113 -6.919 8.351 1.00 0.00 C ATOM 496 C SER A 34 1.693 -6.681 8.830 1.00 0.00 C ATOM 497 O SER A 34 1.477 -6.037 9.862 1.00 0.00 O ATOM 498 CB SER A 34 3.989 -7.603 9.400 1.00 0.00 C ATOM 499 OG SER A 34 3.674 -8.975 9.497 1.00 0.00 O ATOM 0 H SER A 34 3.217 -4.852 8.547 1.00 0.00 H new ATOM 0 HA SER A 34 3.108 -7.594 7.495 1.00 0.00 H new ATOM 0 HB2 SER A 34 5.040 -7.484 9.137 1.00 0.00 H new ATOM 0 HB3 SER A 34 3.847 -7.123 10.368 1.00 0.00 H new ATOM 0 HG SER A 34 4.261 -9.488 8.903 1.00 0.00 H new ATOM 505 N ILE A 35 0.734 -7.116 8.018 1.00 0.00 N ATOM 506 CA ILE A 35 -0.675 -7.092 8.387 1.00 0.00 C ATOM 507 C ILE A 35 -0.957 -8.232 9.353 1.00 0.00 C ATOM 508 O ILE A 35 -0.135 -9.122 9.531 1.00 0.00 O ATOM 509 CB ILE A 35 -1.572 -7.091 7.128 1.00 0.00 C ATOM 510 CG1 ILE A 35 -2.432 -5.815 7.031 1.00 0.00 C ATOM 511 CG2 ILE A 35 -2.471 -8.322 6.942 1.00 0.00 C ATOM 512 CD1 ILE A 35 -2.328 -5.210 5.635 1.00 0.00 C ATOM 0 H ILE A 35 0.913 -7.494 7.088 1.00 0.00 H new ATOM 0 HA ILE A 35 -0.919 -6.167 8.910 1.00 0.00 H new ATOM 0 HB ILE A 35 -0.846 -7.124 6.315 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -3.472 -6.052 7.255 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -2.103 -5.089 7.775 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -3.054 -8.212 6.028 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -1.853 -9.217 6.872 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -3.145 -8.412 7.794 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -2.941 -4.310 5.582 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -1.289 -4.955 5.425 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -2.680 -5.932 4.898 1.00 0.00 H new ATOM 524 N LYS A 36 -2.139 -8.219 9.953 1.00 0.00 N ATOM 525 CA LYS A 36 -2.670 -9.324 10.705 1.00 0.00 C ATOM 526 C LYS A 36 -4.179 -9.146 10.725 1.00 0.00 C ATOM 527 O LYS A 36 -4.711 -8.326 11.470 1.00 0.00 O ATOM 528 CB LYS A 36 -2.042 -9.362 12.101 1.00 0.00 C ATOM 529 CG LYS A 36 -2.247 -10.733 12.756 1.00 0.00 C ATOM 530 CD LYS A 36 -1.188 -10.978 13.835 1.00 0.00 C ATOM 531 CE LYS A 36 -1.349 -10.031 15.031 1.00 0.00 C ATOM 532 NZ LYS A 36 -0.370 -10.332 16.095 1.00 0.00 N ATOM 0 H LYS A 36 -2.764 -7.413 9.923 1.00 0.00 H new ATOM 0 HA LYS A 36 -2.431 -10.288 10.255 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -0.976 -9.144 12.031 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -2.486 -8.586 12.725 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -3.242 -10.786 13.197 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -2.191 -11.516 11.999 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -1.255 -12.010 14.179 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -0.195 -10.850 13.403 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -1.223 -9.000 14.700 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -2.360 -10.116 15.430 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -0.506 -9.674 16.888 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -0.507 -11.308 16.427 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 0.594 -10.227 15.720 1.00 0.00 H new ATOM 546 N GLY A 37 -4.853 -9.887 9.854 1.00 0.00 N ATOM 547 CA GLY A 37 -6.296 -10.065 9.907 1.00 0.00 C ATOM 548 C GLY A 37 -6.939 -10.194 8.527 1.00 0.00 C ATOM 549 O GLY A 37 -8.141 -10.432 8.436 1.00 0.00 O ATOM 0 H GLY A 37 -4.407 -10.386 9.084 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -6.524 -10.956 10.491 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -6.741 -9.218 10.430 1.00 0.00 H new ATOM 553 N LEU A 38 -6.162 -10.028 7.452 1.00 0.00 N ATOM 554 CA LEU A 38 -6.642 -10.302 6.111 1.00 0.00 C ATOM 555 C LEU A 38 -6.824 -11.809 5.915 1.00 0.00 C ATOM 556 O LEU A 38 -6.558 -12.611 6.800 1.00 0.00 O ATOM 557 CB LEU A 38 -5.651 -9.730 5.077 1.00 0.00 C ATOM 558 CG LEU A 38 -5.901 -8.277 4.642 1.00 0.00 C ATOM 559 CD1 LEU A 38 -7.372 -7.973 4.356 1.00 0.00 C ATOM 560 CD2 LEU A 38 -5.388 -7.235 5.633 1.00 0.00 C ATOM 0 H LEU A 38 -5.196 -9.704 7.494 1.00 0.00 H new ATOM 0 HA LEU A 38 -7.610 -9.821 5.968 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -4.645 -9.797 5.491 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -5.674 -10.364 4.190 1.00 0.00 H new ATOM 0 HG LEU A 38 -5.327 -8.198 3.719 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -7.476 -6.931 4.054 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -7.728 -8.620 3.554 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -7.962 -8.151 5.255 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -5.602 -6.236 5.254 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -5.883 -7.372 6.594 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -4.312 -7.352 5.759 1.00 0.00 H new ATOM 572 N THR A 39 -7.271 -12.187 4.723 1.00 0.00 N ATOM 573 CA THR A 39 -7.356 -13.552 4.238 1.00 0.00 C ATOM 574 C THR A 39 -6.192 -13.811 3.289 1.00 0.00 C ATOM 575 O THR A 39 -5.695 -12.867 2.668 1.00 0.00 O ATOM 576 CB THR A 39 -8.682 -13.687 3.495 1.00 0.00 C ATOM 577 OG1 THR A 39 -8.929 -12.495 2.767 1.00 0.00 O ATOM 578 CG2 THR A 39 -9.789 -13.902 4.527 1.00 0.00 C ATOM 0 H THR A 39 -7.601 -11.510 4.035 1.00 0.00 H new ATOM 0 HA THR A 39 -7.307 -14.271 5.055 1.00 0.00 H new ATOM 0 HB THR A 39 -8.651 -14.528 2.803 1.00 0.00 H new ATOM 0 HG1 THR A 39 -9.779 -12.576 2.286 1.00 0.00 H new ATOM 0 HG21 THR A 39 -10.747 -14.001 4.017 1.00 0.00 H new ATOM 0 HG22 THR A 39 -9.585 -14.809 5.096 1.00 0.00 H new ATOM 0 HG23 THR A 39 -9.825 -13.049 5.205 1.00 0.00 H new ATOM 586 N GLU A 40 -5.783 -15.078 3.176 1.00 0.00 N ATOM 587 CA GLU A 40 -4.720 -15.528 2.295 1.00 0.00 C ATOM 588 C GLU A 40 -4.945 -15.079 0.851 1.00 0.00 C ATOM 589 O GLU A 40 -6.080 -14.834 0.438 1.00 0.00 O ATOM 590 CB GLU A 40 -4.587 -17.052 2.412 1.00 0.00 C ATOM 591 CG GLU A 40 -5.858 -17.830 2.015 1.00 0.00 C ATOM 592 CD GLU A 40 -5.751 -18.499 0.645 1.00 0.00 C ATOM 593 OE1 GLU A 40 -5.111 -17.896 -0.243 1.00 0.00 O ATOM 594 OE2 GLU A 40 -6.310 -19.609 0.518 1.00 0.00 O ATOM 0 H GLU A 40 -6.200 -15.837 3.715 1.00 0.00 H new ATOM 0 HA GLU A 40 -3.782 -15.067 2.605 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -3.761 -17.383 1.783 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -4.326 -17.305 3.440 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -6.061 -18.591 2.769 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -6.708 -17.148 2.014 1.00 0.00 H new ATOM 601 N GLY A 41 -3.853 -14.925 0.101 1.00 0.00 N ATOM 602 CA GLY A 41 -3.917 -14.615 -1.308 1.00 0.00 C ATOM 603 C GLY A 41 -3.191 -13.304 -1.450 1.00 0.00 C ATOM 604 O GLY A 41 -1.987 -13.278 -1.243 1.00 0.00 O ATOM 0 H GLY A 41 -2.904 -15.014 0.464 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -3.445 -15.395 -1.906 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -4.949 -14.534 -1.648 1.00 0.00 H new ATOM 608 N LEU A 42 -3.900 -12.216 -1.740 1.00 0.00 N ATOM 609 CA LEU A 42 -3.291 -10.946 -2.078 1.00 0.00 C ATOM 610 C LEU A 42 -4.341 -9.848 -1.957 1.00 0.00 C ATOM 611 O LEU A 42 -5.536 -10.117 -2.065 1.00 0.00 O ATOM 612 CB LEU A 42 -2.637 -11.012 -3.469 1.00 0.00 C ATOM 613 CG LEU A 42 -3.594 -11.273 -4.633 1.00 0.00 C ATOM 614 CD1 LEU A 42 -2.823 -11.162 -5.956 1.00 0.00 C ATOM 615 CD2 LEU A 42 -4.291 -12.642 -4.629 1.00 0.00 C ATOM 0 H LEU A 42 -4.920 -12.198 -1.745 1.00 0.00 H new ATOM 0 HA LEU A 42 -2.486 -10.711 -1.382 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -2.117 -10.072 -3.652 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -1.881 -11.797 -3.459 1.00 0.00 H new ATOM 0 HG LEU A 42 -4.376 -10.522 -4.519 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -3.501 -11.347 -6.789 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -2.400 -10.162 -6.048 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -2.019 -11.898 -5.972 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -4.945 -12.720 -5.497 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -3.541 -13.432 -4.668 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -4.882 -12.747 -3.719 1.00 0.00 H new ATOM 627 N HIS A 43 -3.887 -8.630 -1.654 1.00 0.00 N ATOM 628 CA HIS A 43 -4.734 -7.502 -1.302 1.00 0.00 C ATOM 629 C HIS A 43 -4.124 -6.227 -1.866 1.00 0.00 C ATOM 630 O HIS A 43 -2.914 -6.058 -1.753 1.00 0.00 O ATOM 631 CB HIS A 43 -4.817 -7.417 0.227 1.00 0.00 C ATOM 632 CG HIS A 43 -5.652 -8.508 0.844 1.00 0.00 C ATOM 633 ND1 HIS A 43 -7.020 -8.462 0.977 1.00 0.00 N ATOM 634 CD2 HIS A 43 -5.231 -9.735 1.282 1.00 0.00 C ATOM 635 CE1 HIS A 43 -7.441 -9.637 1.467 1.00 0.00 C ATOM 636 NE2 HIS A 43 -6.371 -10.412 1.676 1.00 0.00 N ATOM 0 H HIS A 43 -2.893 -8.401 -1.648 1.00 0.00 H new ATOM 0 HA HIS A 43 -5.734 -7.628 -1.716 1.00 0.00 H new ATOM 0 HB2 HIS A 43 -3.810 -7.463 0.641 1.00 0.00 H new ATOM 0 HB3 HIS A 43 -5.233 -6.449 0.507 1.00 0.00 H new ATOM 0 HD1 HIS A 43 -7.615 -7.667 0.742 1.00 0.00 H new ATOM 0 HD2 HIS A 43 -4.215 -10.100 1.313 1.00 0.00 H new ATOM 0 HE1 HIS A 43 -8.468 -9.911 1.660 1.00 0.00 H new ATOM 645 N GLY A 44 -4.934 -5.351 -2.470 1.00 0.00 N ATOM 646 CA GLY A 44 -4.478 -4.074 -2.997 1.00 0.00 C ATOM 647 C GLY A 44 -3.900 -3.222 -1.871 1.00 0.00 C ATOM 648 O GLY A 44 -4.432 -3.262 -0.759 1.00 0.00 O ATOM 0 H GLY A 44 -5.932 -5.516 -2.605 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -3.722 -4.237 -3.765 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -5.307 -3.550 -3.472 1.00 0.00 H new ATOM 652 N PHE A 45 -2.828 -2.474 -2.158 1.00 0.00 N ATOM 653 CA PHE A 45 -2.056 -1.711 -1.185 1.00 0.00 C ATOM 654 C PHE A 45 -1.743 -0.336 -1.755 1.00 0.00 C ATOM 655 O PHE A 45 -0.954 -0.234 -2.696 1.00 0.00 O ATOM 656 CB PHE A 45 -0.747 -2.458 -0.878 1.00 0.00 C ATOM 657 CG PHE A 45 -0.534 -2.684 0.599 1.00 0.00 C ATOM 658 CD1 PHE A 45 -1.437 -3.505 1.291 1.00 0.00 C ATOM 659 CD2 PHE A 45 0.472 -1.993 1.302 1.00 0.00 C ATOM 660 CE1 PHE A 45 -1.393 -3.569 2.690 1.00 0.00 C ATOM 661 CE2 PHE A 45 0.493 -2.032 2.707 1.00 0.00 C ATOM 662 CZ PHE A 45 -0.461 -2.798 3.400 1.00 0.00 C ATOM 0 H PHE A 45 -2.467 -2.384 -3.108 1.00 0.00 H new ATOM 0 HA PHE A 45 -2.631 -1.596 -0.266 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -0.754 -3.420 -1.391 1.00 0.00 H new ATOM 0 HB3 PHE A 45 0.093 -1.890 -1.279 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -2.165 -4.087 0.746 1.00 0.00 H new ATOM 0 HD2 PHE A 45 1.224 -1.435 0.764 1.00 0.00 H new ATOM 0 HE1 PHE A 45 -2.078 -4.213 3.222 1.00 0.00 H new ATOM 0 HE2 PHE A 45 1.240 -1.475 3.253 1.00 0.00 H new ATOM 0 HZ PHE A 45 -0.476 -2.793 4.480 1.00 0.00 H new ATOM 672 N HIS A 46 -2.358 0.727 -1.224 1.00 0.00 N ATOM 673 CA HIS A 46 -2.114 2.056 -1.778 1.00 0.00 C ATOM 674 C HIS A 46 -2.276 3.153 -0.747 1.00 0.00 C ATOM 675 O HIS A 46 -2.949 2.975 0.269 1.00 0.00 O ATOM 676 CB HIS A 46 -3.044 2.373 -2.960 1.00 0.00 C ATOM 677 CG HIS A 46 -3.655 1.171 -3.599 1.00 0.00 C ATOM 678 ND1 HIS A 46 -4.885 0.609 -3.260 1.00 0.00 N ATOM 679 CD2 HIS A 46 -3.109 0.423 -4.595 1.00 0.00 C ATOM 680 CE1 HIS A 46 -5.062 -0.464 -4.062 1.00 0.00 C ATOM 681 NE2 HIS A 46 -4.000 -0.556 -4.873 1.00 0.00 N ATOM 0 H HIS A 46 -3.007 0.694 -0.438 1.00 0.00 H new ATOM 0 HA HIS A 46 -1.080 2.032 -2.121 1.00 0.00 H new ATOM 0 HB2 HIS A 46 -3.841 3.031 -2.614 1.00 0.00 H new ATOM 0 HB3 HIS A 46 -2.481 2.924 -3.713 1.00 0.00 H new ATOM 0 HD2 HIS A 46 -2.152 0.580 -5.071 1.00 0.00 H new ATOM 0 HE1 HIS A 46 -5.911 -1.131 -4.051 1.00 0.00 H new ATOM 0 HE2 HIS A 46 -3.880 -1.264 -5.597 1.00 0.00 H new ATOM 689 N VAL A 47 -1.702 4.310 -1.075 1.00 0.00 N ATOM 690 CA VAL A 47 -1.905 5.540 -0.337 1.00 0.00 C ATOM 691 C VAL A 47 -3.128 6.271 -0.888 1.00 0.00 C ATOM 692 O VAL A 47 -3.153 6.647 -2.061 1.00 0.00 O ATOM 693 CB VAL A 47 -0.639 6.399 -0.403 1.00 0.00 C ATOM 694 CG1 VAL A 47 -0.926 7.788 0.158 1.00 0.00 C ATOM 695 CG2 VAL A 47 0.482 5.745 0.416 1.00 0.00 C ATOM 0 H VAL A 47 -1.075 4.413 -1.873 1.00 0.00 H new ATOM 0 HA VAL A 47 -2.096 5.321 0.713 1.00 0.00 H new ATOM 0 HB VAL A 47 -0.326 6.483 -1.444 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -0.022 8.394 0.108 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -1.713 8.262 -0.428 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -1.249 7.702 1.196 1.00 0.00 H new ATOM 0 HG21 VAL A 47 1.379 6.363 0.364 1.00 0.00 H new ATOM 0 HG22 VAL A 47 0.166 5.651 1.455 1.00 0.00 H new ATOM 0 HG23 VAL A 47 0.698 4.756 0.012 1.00 0.00 H new ATOM 705 N HIS A 48 -4.130 6.481 -0.032 1.00 0.00 N ATOM 706 CA HIS A 48 -5.305 7.283 -0.317 1.00 0.00 C ATOM 707 C HIS A 48 -5.043 8.726 0.090 1.00 0.00 C ATOM 708 O HIS A 48 -4.632 8.994 1.219 1.00 0.00 O ATOM 709 CB HIS A 48 -6.513 6.703 0.417 1.00 0.00 C ATOM 710 CG HIS A 48 -6.928 5.395 -0.200 1.00 0.00 C ATOM 711 ND1 HIS A 48 -8.065 5.202 -0.921 1.00 0.00 N ATOM 712 CD2 HIS A 48 -6.126 4.298 -0.311 1.00 0.00 C ATOM 713 CE1 HIS A 48 -8.006 3.981 -1.460 1.00 0.00 C ATOM 714 NE2 HIS A 48 -6.821 3.430 -1.150 1.00 0.00 N ATOM 0 H HIS A 48 -4.139 6.082 0.907 1.00 0.00 H new ATOM 0 HA HIS A 48 -5.521 7.265 -1.385 1.00 0.00 H new ATOM 0 HB2 HIS A 48 -6.269 6.554 1.469 1.00 0.00 H new ATOM 0 HB3 HIS A 48 -7.342 7.409 0.379 1.00 0.00 H new ATOM 0 HD1 HIS A 48 -8.827 5.871 -1.031 1.00 0.00 H new ATOM 0 HD2 HIS A 48 -5.163 4.137 0.150 1.00 0.00 H new ATOM 0 HE1 HIS A 48 -8.783 3.514 -2.048 1.00 0.00 H new ATOM 722 N GLU A 49 -5.271 9.644 -0.847 1.00 0.00 N ATOM 723 CA GLU A 49 -5.083 11.069 -0.632 1.00 0.00 C ATOM 724 C GLU A 49 -6.304 11.599 0.127 1.00 0.00 C ATOM 725 O GLU A 49 -7.401 11.525 -0.413 1.00 0.00 O ATOM 726 CB GLU A 49 -4.882 11.723 -2.008 1.00 0.00 C ATOM 727 CG GLU A 49 -4.310 13.142 -1.947 1.00 0.00 C ATOM 728 CD GLU A 49 -5.384 14.178 -1.662 1.00 0.00 C ATOM 729 OE1 GLU A 49 -6.112 14.504 -2.624 1.00 0.00 O ATOM 730 OE2 GLU A 49 -5.446 14.608 -0.492 1.00 0.00 O ATOM 0 H GLU A 49 -5.595 9.412 -1.786 1.00 0.00 H new ATOM 0 HA GLU A 49 -4.206 11.300 -0.028 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -4.214 11.099 -2.601 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -5.839 11.750 -2.529 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -3.545 13.191 -1.173 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -3.822 13.377 -2.893 1.00 0.00 H new ATOM 737 N GLU A 50 -6.104 12.034 1.378 1.00 0.00 N ATOM 738 CA GLU A 50 -7.047 12.716 2.272 1.00 0.00 C ATOM 739 C GLU A 50 -6.500 12.666 3.699 1.00 0.00 C ATOM 740 O GLU A 50 -6.511 13.668 4.409 1.00 0.00 O ATOM 741 CB GLU A 50 -8.475 12.126 2.266 1.00 0.00 C ATOM 742 CG GLU A 50 -9.441 12.837 1.299 1.00 0.00 C ATOM 743 CD GLU A 50 -10.808 13.084 1.923 1.00 0.00 C ATOM 744 OE1 GLU A 50 -11.407 12.084 2.369 1.00 0.00 O ATOM 745 OE2 GLU A 50 -11.230 14.260 1.941 1.00 0.00 O ATOM 0 H GLU A 50 -5.198 11.906 1.829 1.00 0.00 H new ATOM 0 HA GLU A 50 -7.135 13.737 1.900 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -8.420 11.071 1.999 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -8.883 12.178 3.275 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -9.008 13.789 0.991 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -9.559 12.234 0.399 1.00 0.00 H new ATOM 752 N GLU A 51 -6.053 11.477 4.122 1.00 0.00 N ATOM 753 CA GLU A 51 -5.656 11.164 5.493 1.00 0.00 C ATOM 754 C GLU A 51 -6.874 11.163 6.427 1.00 0.00 C ATOM 755 O GLU A 51 -7.279 10.103 6.905 1.00 0.00 O ATOM 756 CB GLU A 51 -4.485 12.048 5.964 1.00 0.00 C ATOM 757 CG GLU A 51 -3.888 11.597 7.305 1.00 0.00 C ATOM 758 CD GLU A 51 -4.529 12.284 8.505 1.00 0.00 C ATOM 759 OE1 GLU A 51 -4.325 13.510 8.625 1.00 0.00 O ATOM 760 OE2 GLU A 51 -5.184 11.563 9.288 1.00 0.00 O ATOM 0 H GLU A 51 -5.956 10.680 3.493 1.00 0.00 H new ATOM 0 HA GLU A 51 -5.262 10.148 5.524 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -3.703 12.039 5.204 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -4.830 13.078 6.055 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -4.007 10.518 7.405 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -2.817 11.801 7.306 1.00 0.00 H new ATOM 767 N ASP A 52 -7.467 12.336 6.654 1.00 0.00 N ATOM 768 CA ASP A 52 -8.462 12.553 7.693 1.00 0.00 C ATOM 769 C ASP A 52 -9.714 11.690 7.471 1.00 0.00 C ATOM 770 O ASP A 52 -10.558 11.995 6.628 1.00 0.00 O ATOM 771 CB ASP A 52 -8.805 14.046 7.771 1.00 0.00 C ATOM 772 CG ASP A 52 -9.479 14.408 9.089 1.00 0.00 C ATOM 773 OD1 ASP A 52 -9.900 13.468 9.802 1.00 0.00 O ATOM 774 OD2 ASP A 52 -9.586 15.626 9.355 1.00 0.00 O ATOM 0 H ASP A 52 -7.262 13.173 6.109 1.00 0.00 H new ATOM 0 HA ASP A 52 -8.042 12.242 8.650 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -7.894 14.634 7.656 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -9.462 14.311 6.943 1.00 0.00 H new ATOM 779 N ASN A 53 -9.848 10.584 8.208 1.00 0.00 N ATOM 780 CA ASN A 53 -10.854 9.547 7.962 1.00 0.00 C ATOM 781 C ASN A 53 -12.232 9.916 8.526 1.00 0.00 C ATOM 782 O ASN A 53 -12.935 9.061 9.072 1.00 0.00 O ATOM 783 CB ASN A 53 -10.343 8.204 8.524 1.00 0.00 C ATOM 784 CG ASN A 53 -9.236 7.554 7.695 1.00 0.00 C ATOM 785 OD1 ASN A 53 -8.287 7.003 8.244 1.00 0.00 O ATOM 786 ND2 ASN A 53 -9.361 7.552 6.370 1.00 0.00 N ATOM 0 H ASN A 53 -9.249 10.380 9.008 1.00 0.00 H new ATOM 0 HA ASN A 53 -10.997 9.454 6.885 1.00 0.00 H new ATOM 0 HB2 ASN A 53 -9.975 8.364 9.537 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -11.181 7.511 8.595 1.00 0.00 H new ATOM 0 HD21 ASN A 53 -8.661 7.087 5.792 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -10.157 8.016 5.932 1.00 0.00 H new ATOM 793 N THR A 54 -12.645 11.170 8.338 1.00 0.00 N ATOM 794 CA THR A 54 -13.805 11.788 8.977 1.00 0.00 C ATOM 795 C THR A 54 -15.091 11.007 8.728 1.00 0.00 C ATOM 796 O THR A 54 -15.897 10.811 9.635 1.00 0.00 O ATOM 797 CB THR A 54 -13.967 13.225 8.461 1.00 0.00 C ATOM 798 OG1 THR A 54 -14.054 13.196 7.048 1.00 0.00 O ATOM 799 CG2 THR A 54 -12.783 14.101 8.860 1.00 0.00 C ATOM 0 H THR A 54 -12.159 11.809 7.709 1.00 0.00 H new ATOM 0 HA THR A 54 -13.627 11.787 10.052 1.00 0.00 H new ATOM 0 HB THR A 54 -14.870 13.646 8.902 1.00 0.00 H new ATOM 0 HG1 THR A 54 -14.159 14.109 6.708 1.00 0.00 H new ATOM 0 HG21 THR A 54 -12.932 15.111 8.478 1.00 0.00 H new ATOM 0 HG22 THR A 54 -12.704 14.132 9.947 1.00 0.00 H new ATOM 0 HG23 THR A 54 -11.866 13.686 8.441 1.00 0.00 H new ATOM 807 N ALA A 55 -15.265 10.545 7.489 1.00 0.00 N ATOM 808 CA ALA A 55 -16.408 9.755 7.058 1.00 0.00 C ATOM 809 C ALA A 55 -16.578 8.458 7.858 1.00 0.00 C ATOM 810 O ALA A 55 -17.619 7.813 7.760 1.00 0.00 O ATOM 811 CB ALA A 55 -16.216 9.414 5.586 1.00 0.00 C ATOM 0 H ALA A 55 -14.594 10.717 6.741 1.00 0.00 H new ATOM 0 HA ALA A 55 -17.308 10.347 7.225 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -17.061 8.821 5.237 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -16.154 10.334 5.005 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -15.296 8.843 5.462 1.00 0.00 H new ATOM 817 N GLY A 56 -15.548 8.046 8.604 1.00 0.00 N ATOM 818 CA GLY A 56 -15.543 6.820 9.386 1.00 0.00 C ATOM 819 C GLY A 56 -14.746 5.752 8.651 1.00 0.00 C ATOM 820 O GLY A 56 -15.233 4.644 8.444 1.00 0.00 O ATOM 0 H GLY A 56 -14.678 8.573 8.678 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -15.106 7.004 10.367 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -16.564 6.477 9.551 1.00 0.00 H new ATOM 824 N CYS A 57 -13.514 6.096 8.254 1.00 0.00 N ATOM 825 CA CYS A 57 -12.568 5.157 7.637 1.00 0.00 C ATOM 826 C CYS A 57 -13.167 4.506 6.380 1.00 0.00 C ATOM 827 O CYS A 57 -12.863 3.366 6.040 1.00 0.00 O ATOM 828 CB CYS A 57 -12.086 4.148 8.699 1.00 0.00 C ATOM 829 SG CYS A 57 -10.297 3.860 8.840 1.00 0.00 S ATOM 0 H CYS A 57 -13.143 7.041 8.353 1.00 0.00 H new ATOM 0 HA CYS A 57 -11.687 5.692 7.282 1.00 0.00 H new ATOM 0 HB2 CYS A 57 -12.449 4.484 9.670 1.00 0.00 H new ATOM 0 HB3 CYS A 57 -12.565 3.191 8.494 1.00 0.00 H new ATOM 834 N THR A 58 -14.003 5.278 5.676 1.00 0.00 N ATOM 835 CA THR A 58 -14.728 4.928 4.463 1.00 0.00 C ATOM 836 C THR A 58 -14.579 6.124 3.527 1.00 0.00 C ATOM 837 O THR A 58 -14.292 7.226 3.990 1.00 0.00 O ATOM 838 CB THR A 58 -16.196 4.635 4.819 1.00 0.00 C ATOM 839 OG1 THR A 58 -16.256 3.367 5.435 1.00 0.00 O ATOM 840 CG2 THR A 58 -17.142 4.605 3.613 1.00 0.00 C ATOM 0 H THR A 58 -14.201 6.235 5.967 1.00 0.00 H new ATOM 0 HA THR A 58 -14.343 4.031 3.978 1.00 0.00 H new ATOM 0 HB THR A 58 -16.525 5.447 5.468 1.00 0.00 H new ATOM 0 HG1 THR A 58 -17.185 3.162 5.672 1.00 0.00 H new ATOM 0 HG21 THR A 58 -18.156 4.392 3.951 1.00 0.00 H new ATOM 0 HG22 THR A 58 -17.122 5.572 3.111 1.00 0.00 H new ATOM 0 HG23 THR A 58 -16.821 3.829 2.918 1.00 0.00 H new ATOM 848 N SER A 59 -14.730 5.905 2.218 1.00 0.00 N ATOM 849 CA SER A 59 -14.404 6.881 1.189 1.00 0.00 C ATOM 850 C SER A 59 -12.925 7.252 1.244 1.00 0.00 C ATOM 851 O SER A 59 -12.149 6.733 0.435 1.00 0.00 O ATOM 852 CB SER A 59 -15.350 8.090 1.201 1.00 0.00 C ATOM 853 OG SER A 59 -16.626 7.644 0.780 1.00 0.00 O ATOM 0 H SER A 59 -15.089 5.027 1.843 1.00 0.00 H new ATOM 0 HA SER A 59 -14.571 6.415 0.218 1.00 0.00 H new ATOM 0 HB2 SER A 59 -15.406 8.521 2.200 1.00 0.00 H new ATOM 0 HB3 SER A 59 -14.980 8.871 0.537 1.00 0.00 H new ATOM 0 HG SER A 59 -17.252 8.398 0.780 1.00 0.00 H new ATOM 859 N ALA A 60 -12.556 8.132 2.177 1.00 0.00 N ATOM 860 CA ALA A 60 -11.372 8.961 2.073 1.00 0.00 C ATOM 861 C ALA A 60 -11.341 9.552 0.653 1.00 0.00 C ATOM 862 O ALA A 60 -12.396 9.865 0.096 1.00 0.00 O ATOM 863 CB ALA A 60 -10.129 8.152 2.471 1.00 0.00 C ATOM 0 H ALA A 60 -13.085 8.285 3.036 1.00 0.00 H new ATOM 0 HA ALA A 60 -11.387 9.800 2.768 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -9.243 8.782 2.390 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -10.235 7.805 3.499 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -10.025 7.294 1.807 1.00 0.00 H new ATOM 869 N GLY A 61 -10.171 9.574 0.015 1.00 0.00 N ATOM 870 CA GLY A 61 -10.030 9.863 -1.403 1.00 0.00 C ATOM 871 C GLY A 61 -9.487 8.636 -2.133 1.00 0.00 C ATOM 872 O GLY A 61 -9.227 7.600 -1.511 1.00 0.00 O ATOM 0 H GLY A 61 -9.283 9.388 0.481 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -10.995 10.149 -1.822 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -9.357 10.709 -1.545 1.00 0.00 H new ATOM 876 N PRO A 62 -9.341 8.719 -3.461 1.00 0.00 N ATOM 877 CA PRO A 62 -8.818 7.641 -4.284 1.00 0.00 C ATOM 878 C PRO A 62 -7.295 7.517 -4.126 1.00 0.00 C ATOM 879 O PRO A 62 -6.687 8.191 -3.293 1.00 0.00 O ATOM 880 CB PRO A 62 -9.248 8.006 -5.711 1.00 0.00 C ATOM 881 CG PRO A 62 -9.268 9.535 -5.693 1.00 0.00 C ATOM 882 CD PRO A 62 -9.724 9.864 -4.272 1.00 0.00 C ATOM 0 HA PRO A 62 -9.201 6.661 -3.999 1.00 0.00 H new ATOM 0 HB2 PRO A 62 -8.548 7.622 -6.453 1.00 0.00 H new ATOM 0 HB3 PRO A 62 -10.227 7.594 -5.954 1.00 0.00 H new ATOM 0 HG2 PRO A 62 -8.284 9.953 -5.907 1.00 0.00 H new ATOM 0 HG3 PRO A 62 -9.954 9.937 -6.439 1.00 0.00 H new ATOM 0 HD2 PRO A 62 -9.250 10.776 -3.910 1.00 0.00 H new ATOM 0 HD3 PRO A 62 -10.801 10.028 -4.234 1.00 0.00 H new ATOM 890 N HIS A 63 -6.684 6.636 -4.931 1.00 0.00 N ATOM 891 CA HIS A 63 -5.234 6.478 -4.985 1.00 0.00 C ATOM 892 C HIS A 63 -4.581 7.841 -5.215 1.00 0.00 C ATOM 893 O HIS A 63 -4.967 8.550 -6.142 1.00 0.00 O ATOM 894 CB HIS A 63 -4.830 5.567 -6.155 1.00 0.00 C ATOM 895 CG HIS A 63 -5.134 4.093 -6.029 1.00 0.00 C ATOM 896 ND1 HIS A 63 -4.600 3.064 -6.813 1.00 0.00 N ATOM 897 CD2 HIS A 63 -5.987 3.504 -5.144 1.00 0.00 C ATOM 898 CE1 HIS A 63 -5.142 1.895 -6.413 1.00 0.00 C ATOM 899 NE2 HIS A 63 -5.985 2.169 -5.406 1.00 0.00 N ATOM 0 H HIS A 63 -7.188 6.014 -5.563 1.00 0.00 H new ATOM 0 HA HIS A 63 -4.907 6.039 -4.042 1.00 0.00 H new ATOM 0 HB2 HIS A 63 -5.323 5.936 -7.054 1.00 0.00 H new ATOM 0 HB3 HIS A 63 -3.757 5.677 -6.312 1.00 0.00 H new ATOM 0 HD2 HIS A 63 -6.559 4.005 -4.377 1.00 0.00 H new ATOM 0 HE1 HIS A 63 -4.935 0.919 -6.827 1.00 0.00 H new ATOM 0 HE2 HIS A 63 -6.544 1.476 -4.908 1.00 0.00 H new ATOM 907 N PHE A 64 -3.576 8.186 -4.408 1.00 0.00 N ATOM 908 CA PHE A 64 -2.844 9.434 -4.568 1.00 0.00 C ATOM 909 C PHE A 64 -2.166 9.453 -5.944 1.00 0.00 C ATOM 910 O PHE A 64 -1.166 8.771 -6.179 1.00 0.00 O ATOM 911 CB PHE A 64 -1.864 9.622 -3.398 1.00 0.00 C ATOM 912 CG PHE A 64 -1.413 11.043 -3.077 1.00 0.00 C ATOM 913 CD1 PHE A 64 -1.366 12.055 -4.058 1.00 0.00 C ATOM 914 CD2 PHE A 64 -1.117 11.376 -1.740 1.00 0.00 C ATOM 915 CE1 PHE A 64 -0.983 13.363 -3.714 1.00 0.00 C ATOM 916 CE2 PHE A 64 -0.732 12.683 -1.395 1.00 0.00 C ATOM 917 CZ PHE A 64 -0.660 13.676 -2.384 1.00 0.00 C ATOM 0 H PHE A 64 -3.252 7.609 -3.632 1.00 0.00 H new ATOM 0 HA PHE A 64 -3.523 10.286 -4.537 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -2.326 9.206 -2.503 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -0.975 9.026 -3.605 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -1.626 11.824 -5.080 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -1.187 10.619 -0.973 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -0.937 14.129 -4.474 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -0.492 12.923 -0.370 1.00 0.00 H new ATOM 0 HZ PHE A 64 -0.357 14.679 -2.123 1.00 0.00 H new ATOM 927 N ASN A 65 -2.748 10.231 -6.859 1.00 0.00 N ATOM 928 CA ASN A 65 -2.304 10.421 -8.228 1.00 0.00 C ATOM 929 C ASN A 65 -2.271 11.907 -8.539 1.00 0.00 C ATOM 930 O ASN A 65 -3.290 12.460 -8.941 1.00 0.00 O ATOM 931 CB ASN A 65 -3.307 9.763 -9.164 1.00 0.00 C ATOM 932 CG ASN A 65 -3.043 10.068 -10.631 1.00 0.00 C ATOM 933 OD1 ASN A 65 -3.926 10.511 -11.355 1.00 0.00 O ATOM 934 ND2 ASN A 65 -1.834 9.786 -11.098 1.00 0.00 N ATOM 0 H ASN A 65 -3.586 10.771 -6.646 1.00 0.00 H new ATOM 0 HA ASN A 65 -1.313 9.985 -8.357 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -3.282 8.684 -9.013 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -4.311 10.098 -8.904 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -1.620 9.937 -12.084 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -1.118 9.418 -10.471 1.00 0.00 H new ATOM 941 N PRO A 66 -1.124 12.568 -8.366 1.00 0.00 N ATOM 942 CA PRO A 66 -1.013 13.958 -8.725 1.00 0.00 C ATOM 943 C PRO A 66 -0.840 14.128 -10.223 1.00 0.00 C ATOM 944 O PRO A 66 -1.528 14.923 -10.853 1.00 0.00 O ATOM 945 CB PRO A 66 0.142 14.507 -7.889 1.00 0.00 C ATOM 946 CG PRO A 66 1.025 13.283 -7.618 1.00 0.00 C ATOM 947 CD PRO A 66 0.083 12.078 -7.731 1.00 0.00 C ATOM 0 HA PRO A 66 -1.919 14.523 -8.507 1.00 0.00 H new ATOM 0 HB2 PRO A 66 0.689 15.282 -8.426 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -0.215 14.954 -6.961 1.00 0.00 H new ATOM 0 HG2 PRO A 66 1.839 13.216 -8.340 1.00 0.00 H new ATOM 0 HG3 PRO A 66 1.480 13.336 -6.629 1.00 0.00 H new ATOM 0 HD2 PRO A 66 0.538 11.282 -8.321 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -0.136 11.661 -6.748 1.00 0.00 H new ATOM 955 N LEU A 67 0.083 13.347 -10.769 1.00 0.00 N ATOM 956 CA LEU A 67 0.528 13.372 -12.155 1.00 0.00 C ATOM 957 C LEU A 67 1.197 12.042 -12.493 1.00 0.00 C ATOM 958 O LEU A 67 1.939 11.947 -13.467 1.00 0.00 O ATOM 959 CB LEU A 67 1.484 14.566 -12.367 1.00 0.00 C ATOM 960 CG LEU A 67 0.729 15.833 -12.803 1.00 0.00 C ATOM 961 CD1 LEU A 67 1.031 17.012 -11.874 1.00 0.00 C ATOM 962 CD2 LEU A 67 1.076 16.195 -14.251 1.00 0.00 C ATOM 0 H LEU A 67 0.570 12.637 -10.222 1.00 0.00 H new ATOM 0 HA LEU A 67 -0.321 13.502 -12.826 1.00 0.00 H new ATOM 0 HB2 LEU A 67 2.026 14.766 -11.443 1.00 0.00 H new ATOM 0 HB3 LEU A 67 2.226 14.307 -13.122 1.00 0.00 H new ATOM 0 HG LEU A 67 -0.338 15.620 -12.739 1.00 0.00 H new ATOM 0 HD11 LEU A 67 0.481 17.891 -12.211 1.00 0.00 H new ATOM 0 HD12 LEU A 67 0.727 16.762 -10.858 1.00 0.00 H new ATOM 0 HD13 LEU A 67 2.100 17.224 -11.891 1.00 0.00 H new ATOM 0 HD21 LEU A 67 0.532 17.094 -14.542 1.00 0.00 H new ATOM 0 HD22 LEU A 67 2.148 16.376 -14.334 1.00 0.00 H new ATOM 0 HD23 LEU A 67 0.795 15.373 -14.909 1.00 0.00 H new ATOM 974 N SER A 68 0.912 10.989 -11.715 1.00 0.00 N ATOM 975 CA SER A 68 1.500 9.676 -11.949 1.00 0.00 C ATOM 976 C SER A 68 0.566 8.766 -12.746 1.00 0.00 C ATOM 977 O SER A 68 0.393 7.593 -12.450 1.00 0.00 O ATOM 978 CB SER A 68 2.051 9.070 -10.661 1.00 0.00 C ATOM 979 OG SER A 68 3.160 9.836 -10.237 1.00 0.00 O ATOM 0 H SER A 68 0.276 11.028 -10.918 1.00 0.00 H new ATOM 0 HA SER A 68 2.371 9.798 -12.593 1.00 0.00 H new ATOM 0 HB2 SER A 68 1.282 9.060 -9.889 1.00 0.00 H new ATOM 0 HB3 SER A 68 2.349 8.035 -10.828 1.00 0.00 H new ATOM 0 HG SER A 68 3.618 9.372 -9.506 1.00 0.00 H new ATOM 985 N ARG A 69 -0.018 9.342 -13.789 1.00 0.00 N ATOM 986 CA ARG A 69 -0.690 8.637 -14.875 1.00 0.00 C ATOM 987 C ARG A 69 -1.971 7.989 -14.339 1.00 0.00 C ATOM 988 O ARG A 69 -2.541 8.513 -13.384 1.00 0.00 O ATOM 989 CB ARG A 69 0.284 7.638 -15.525 1.00 0.00 C ATOM 990 CG ARG A 69 1.620 8.272 -15.954 1.00 0.00 C ATOM 991 CD ARG A 69 2.720 7.198 -15.958 1.00 0.00 C ATOM 992 NE ARG A 69 3.887 7.612 -16.754 1.00 0.00 N ATOM 993 CZ ARG A 69 5.083 6.996 -16.765 1.00 0.00 C ATOM 994 NH1 ARG A 69 5.319 5.943 -15.981 1.00 0.00 N ATOM 995 NH2 ARG A 69 6.054 7.431 -17.574 1.00 0.00 N ATOM 0 H ARG A 69 -0.038 10.355 -13.907 1.00 0.00 H new ATOM 0 HA ARG A 69 -0.992 9.327 -15.663 1.00 0.00 H new ATOM 0 HB2 ARG A 69 0.484 6.829 -14.823 1.00 0.00 H new ATOM 0 HB3 ARG A 69 -0.194 7.192 -16.397 1.00 0.00 H new ATOM 0 HG2 ARG A 69 1.524 8.712 -16.946 1.00 0.00 H new ATOM 0 HG3 ARG A 69 1.887 9.079 -15.272 1.00 0.00 H new ATOM 0 HD2 ARG A 69 3.033 6.994 -14.934 1.00 0.00 H new ATOM 0 HD3 ARG A 69 2.318 6.268 -16.359 1.00 0.00 H new ATOM 0 HE ARG A 69 3.780 8.435 -17.347 1.00 0.00 H new ATOM 0 HH11 ARG A 69 4.587 5.594 -15.362 1.00 0.00 H new ATOM 0 HH12 ARG A 69 6.231 5.487 -16.001 1.00 0.00 H new ATOM 0 HH21 ARG A 69 5.889 8.231 -18.184 1.00 0.00 H new ATOM 0 HH22 ARG A 69 6.960 6.963 -17.581 1.00 0.00 H new ATOM 1009 N LYS A 70 -2.445 6.886 -14.924 1.00 0.00 N ATOM 1010 CA LYS A 70 -3.575 6.137 -14.398 1.00 0.00 C ATOM 1011 C LYS A 70 -3.094 5.035 -13.446 1.00 0.00 C ATOM 1012 O LYS A 70 -1.915 4.966 -13.099 1.00 0.00 O ATOM 1013 CB LYS A 70 -4.381 5.615 -15.591 1.00 0.00 C ATOM 1014 CG LYS A 70 -5.500 6.598 -15.953 1.00 0.00 C ATOM 1015 CD LYS A 70 -5.971 6.360 -17.391 1.00 0.00 C ATOM 1016 CE LYS A 70 -7.335 7.030 -17.603 1.00 0.00 C ATOM 1017 NZ LYS A 70 -7.694 7.119 -19.033 1.00 0.00 N ATOM 0 H LYS A 70 -2.051 6.491 -15.778 1.00 0.00 H new ATOM 0 HA LYS A 70 -4.229 6.768 -13.796 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -3.723 5.472 -16.448 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -4.808 4.641 -15.351 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -6.336 6.477 -15.264 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -5.143 7.622 -15.845 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -5.243 6.764 -18.094 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -6.045 5.290 -17.588 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -8.102 6.466 -17.072 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -7.318 8.031 -17.171 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -8.622 7.578 -19.130 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -6.977 7.679 -19.537 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -7.736 6.163 -19.440 1.00 0.00 H new ATOM 1031 N HIS A 71 -4.026 4.215 -12.947 1.00 0.00 N ATOM 1032 CA HIS A 71 -3.684 3.120 -12.054 1.00 0.00 C ATOM 1033 C HIS A 71 -2.846 2.088 -12.802 1.00 0.00 C ATOM 1034 O HIS A 71 -2.977 1.939 -14.014 1.00 0.00 O ATOM 1035 CB HIS A 71 -4.956 2.475 -11.483 1.00 0.00 C ATOM 1036 CG HIS A 71 -4.683 1.453 -10.414 1.00 0.00 C ATOM 1037 ND1 HIS A 71 -3.804 1.577 -9.344 1.00 0.00 N ATOM 1038 CD2 HIS A 71 -5.177 0.186 -10.342 1.00 0.00 C ATOM 1039 CE1 HIS A 71 -3.577 0.346 -8.855 1.00 0.00 C ATOM 1040 NE2 HIS A 71 -4.506 -0.456 -9.349 1.00 0.00 N ATOM 0 H HIS A 71 -5.022 4.295 -13.151 1.00 0.00 H new ATOM 0 HA HIS A 71 -3.100 3.510 -11.221 1.00 0.00 H new ATOM 0 HB2 HIS A 71 -5.597 3.256 -11.073 1.00 0.00 H new ATOM 0 HB3 HIS A 71 -5.509 2.002 -12.294 1.00 0.00 H new ATOM 0 HD2 HIS A 71 -5.958 -0.232 -10.960 1.00 0.00 H new ATOM 0 HE1 HIS A 71 -2.781 0.063 -8.182 1.00 0.00 H new ATOM 0 HE2 HIS A 71 -4.690 -1.408 -9.034 1.00 0.00 H new ATOM 1048 N GLY A 72 -2.019 1.353 -12.066 1.00 0.00 N ATOM 1049 CA GLY A 72 -1.244 0.247 -12.579 1.00 0.00 C ATOM 1050 C GLY A 72 -0.364 -0.246 -11.440 1.00 0.00 C ATOM 1051 O GLY A 72 -0.611 0.127 -10.292 1.00 0.00 O ATOM 0 H GLY A 72 -1.871 1.521 -11.071 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -1.897 -0.550 -12.934 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -0.636 0.563 -13.427 1.00 0.00 H new ATOM 1055 N GLY A 73 0.636 -1.081 -11.727 1.00 0.00 N ATOM 1056 CA GLY A 73 1.502 -1.648 -10.701 1.00 0.00 C ATOM 1057 C GLY A 73 2.935 -1.196 -10.929 1.00 0.00 C ATOM 1058 O GLY A 73 3.287 -0.812 -12.038 1.00 0.00 O ATOM 0 H GLY A 73 0.865 -1.380 -12.675 1.00 0.00 H new ATOM 0 HA2 GLY A 73 1.165 -1.334 -9.713 1.00 0.00 H new ATOM 0 HA3 GLY A 73 1.446 -2.736 -10.726 1.00 0.00 H new ATOM 1062 N PRO A 74 3.794 -1.274 -9.906 1.00 0.00 N ATOM 1063 CA PRO A 74 5.167 -0.803 -9.997 1.00 0.00 C ATOM 1064 C PRO A 74 5.984 -1.576 -11.039 1.00 0.00 C ATOM 1065 O PRO A 74 7.034 -1.098 -11.459 1.00 0.00 O ATOM 1066 CB PRO A 74 5.731 -0.937 -8.579 1.00 0.00 C ATOM 1067 CG PRO A 74 4.896 -2.059 -7.962 1.00 0.00 C ATOM 1068 CD PRO A 74 3.524 -1.856 -8.604 1.00 0.00 C ATOM 0 HA PRO A 74 5.215 0.229 -10.345 1.00 0.00 H new ATOM 0 HB2 PRO A 74 6.792 -1.188 -8.592 1.00 0.00 H new ATOM 0 HB3 PRO A 74 5.630 -0.008 -8.018 1.00 0.00 H new ATOM 0 HG2 PRO A 74 5.308 -3.042 -8.191 1.00 0.00 H new ATOM 0 HG3 PRO A 74 4.850 -1.978 -6.876 1.00 0.00 H new ATOM 0 HD2 PRO A 74 2.990 -2.802 -8.699 1.00 0.00 H new ATOM 0 HD3 PRO A 74 2.900 -1.197 -8.000 1.00 0.00 H new ATOM 1076 N LYS A 75 5.513 -2.757 -11.464 1.00 0.00 N ATOM 1077 CA LYS A 75 6.149 -3.516 -12.537 1.00 0.00 C ATOM 1078 C LYS A 75 5.727 -3.053 -13.941 1.00 0.00 C ATOM 1079 O LYS A 75 6.324 -3.495 -14.922 1.00 0.00 O ATOM 1080 CB LYS A 75 5.887 -5.015 -12.345 1.00 0.00 C ATOM 1081 CG LYS A 75 4.393 -5.366 -12.261 1.00 0.00 C ATOM 1082 CD LYS A 75 4.116 -6.781 -12.788 1.00 0.00 C ATOM 1083 CE LYS A 75 4.102 -6.797 -14.327 1.00 0.00 C ATOM 1084 NZ LYS A 75 3.925 -8.155 -14.874 1.00 0.00 N ATOM 0 H LYS A 75 4.685 -3.206 -11.073 1.00 0.00 H new ATOM 0 HA LYS A 75 7.220 -3.326 -12.472 1.00 0.00 H new ATOM 0 HB2 LYS A 75 6.336 -5.564 -13.173 1.00 0.00 H new ATOM 0 HB3 LYS A 75 6.383 -5.350 -11.434 1.00 0.00 H new ATOM 0 HG2 LYS A 75 4.058 -5.290 -11.226 1.00 0.00 H new ATOM 0 HG3 LYS A 75 3.816 -4.643 -12.837 1.00 0.00 H new ATOM 0 HD2 LYS A 75 4.879 -7.467 -12.419 1.00 0.00 H new ATOM 0 HD3 LYS A 75 3.158 -7.135 -12.407 1.00 0.00 H new ATOM 0 HE2 LYS A 75 3.297 -6.156 -14.687 1.00 0.00 H new ATOM 0 HE3 LYS A 75 5.036 -6.377 -14.700 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 3.922 -8.113 -15.913 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 4.706 -8.763 -14.554 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 3.022 -8.548 -14.541 1.00 0.00 H new ATOM 1098 N ASP A 76 4.695 -2.212 -14.046 1.00 0.00 N ATOM 1099 CA ASP A 76 4.169 -1.695 -15.304 1.00 0.00 C ATOM 1100 C ASP A 76 4.592 -0.242 -15.475 1.00 0.00 C ATOM 1101 O ASP A 76 5.072 0.410 -14.546 1.00 0.00 O ATOM 1102 CB ASP A 76 2.643 -1.862 -15.361 1.00 0.00 C ATOM 1103 CG ASP A 76 2.259 -3.322 -15.558 1.00 0.00 C ATOM 1104 OD1 ASP A 76 2.239 -4.048 -14.542 1.00 0.00 O ATOM 1105 OD2 ASP A 76 2.020 -3.703 -16.724 1.00 0.00 O ATOM 0 H ASP A 76 4.190 -1.864 -13.231 1.00 0.00 H new ATOM 0 HA ASP A 76 4.582 -2.267 -16.135 1.00 0.00 H new ATOM 0 HB2 ASP A 76 2.198 -1.487 -14.439 1.00 0.00 H new ATOM 0 HB3 ASP A 76 2.239 -1.263 -16.177 1.00 0.00 H new ATOM 1110 N GLU A 77 4.412 0.265 -16.694 1.00 0.00 N ATOM 1111 CA GLU A 77 4.707 1.653 -17.018 1.00 0.00 C ATOM 1112 C GLU A 77 3.731 2.569 -16.281 1.00 0.00 C ATOM 1113 O GLU A 77 4.092 3.675 -15.875 1.00 0.00 O ATOM 1114 CB GLU A 77 4.653 1.886 -18.537 1.00 0.00 C ATOM 1115 CG GLU A 77 6.049 1.757 -19.167 1.00 0.00 C ATOM 1116 CD GLU A 77 6.043 2.069 -20.659 1.00 0.00 C ATOM 1117 OE1 GLU A 77 5.267 2.969 -21.048 1.00 0.00 O ATOM 1118 OE2 GLU A 77 6.833 1.419 -21.376 1.00 0.00 O ATOM 0 H GLU A 77 4.058 -0.278 -17.482 1.00 0.00 H new ATOM 0 HA GLU A 77 5.720 1.887 -16.691 1.00 0.00 H new ATOM 0 HB2 GLU A 77 3.976 1.165 -18.995 1.00 0.00 H new ATOM 0 HB3 GLU A 77 4.248 2.877 -18.742 1.00 0.00 H new ATOM 0 HG2 GLU A 77 6.738 2.433 -18.660 1.00 0.00 H new ATOM 0 HG3 GLU A 77 6.423 0.745 -19.011 1.00 0.00 H new ATOM 1125 N GLU A 78 2.489 2.117 -16.118 1.00 0.00 N ATOM 1126 CA GLU A 78 1.456 2.898 -15.461 1.00 0.00 C ATOM 1127 C GLU A 78 1.371 2.458 -13.998 1.00 0.00 C ATOM 1128 O GLU A 78 1.528 1.273 -13.718 1.00 0.00 O ATOM 1129 CB GLU A 78 0.147 2.788 -16.263 1.00 0.00 C ATOM 1130 CG GLU A 78 -0.586 4.134 -16.254 1.00 0.00 C ATOM 1131 CD GLU A 78 -1.586 4.306 -17.386 1.00 0.00 C ATOM 1132 OE1 GLU A 78 -2.169 3.292 -17.822 1.00 0.00 O ATOM 1133 OE2 GLU A 78 -1.757 5.485 -17.767 1.00 0.00 O ATOM 0 H GLU A 78 2.176 1.201 -16.439 1.00 0.00 H new ATOM 0 HA GLU A 78 1.687 3.963 -15.440 1.00 0.00 H new ATOM 0 HB2 GLU A 78 0.363 2.489 -17.289 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -0.489 2.015 -15.833 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -1.108 4.245 -15.303 1.00 0.00 H new ATOM 0 HG3 GLU A 78 0.150 4.936 -16.309 1.00 0.00 H new ATOM 1140 N ARG A 79 1.198 3.420 -13.083 1.00 0.00 N ATOM 1141 CA ARG A 79 1.260 3.287 -11.625 1.00 0.00 C ATOM 1142 C ARG A 79 1.261 4.692 -11.021 1.00 0.00 C ATOM 1143 O ARG A 79 2.120 5.506 -11.357 1.00 0.00 O ATOM 1144 CB ARG A 79 2.466 2.456 -11.151 1.00 0.00 C ATOM 1145 CG ARG A 79 3.856 2.991 -11.538 1.00 0.00 C ATOM 1146 CD ARG A 79 4.543 3.472 -10.253 1.00 0.00 C ATOM 1147 NE ARG A 79 5.896 4.014 -10.463 1.00 0.00 N ATOM 1148 CZ ARG A 79 6.709 4.323 -9.434 1.00 0.00 C ATOM 1149 NH1 ARG A 79 6.262 4.151 -8.189 1.00 0.00 N ATOM 1150 NH2 ARG A 79 7.944 4.796 -9.633 1.00 0.00 N ATOM 0 H ARG A 79 0.997 4.380 -13.364 1.00 0.00 H new ATOM 0 HA ARG A 79 0.386 2.734 -11.281 1.00 0.00 H new ATOM 0 HB2 ARG A 79 2.420 2.375 -10.065 1.00 0.00 H new ATOM 0 HB3 ARG A 79 2.364 1.447 -11.550 1.00 0.00 H new ATOM 0 HG2 ARG A 79 4.446 2.211 -12.019 1.00 0.00 H new ATOM 0 HG3 ARG A 79 3.766 3.809 -12.253 1.00 0.00 H new ATOM 0 HD2 ARG A 79 3.924 4.239 -9.788 1.00 0.00 H new ATOM 0 HD3 ARG A 79 4.601 2.640 -9.551 1.00 0.00 H new ATOM 0 HE ARG A 79 6.228 4.160 -11.416 1.00 0.00 H new ATOM 0 HH11 ARG A 79 5.321 3.792 -8.030 1.00 0.00 H new ATOM 0 HH12 ARG A 79 6.862 4.379 -7.396 1.00 0.00 H new ATOM 0 HH21 ARG A 79 8.292 4.931 -10.582 1.00 0.00 H new ATOM 0 HH22 ARG A 79 8.538 5.022 -8.835 1.00 0.00 H new ATOM 1164 N HIS A 80 0.299 4.984 -10.141 1.00 0.00 N ATOM 1165 CA HIS A 80 0.224 6.265 -9.452 1.00 0.00 C ATOM 1166 C HIS A 80 1.385 6.408 -8.448 1.00 0.00 C ATOM 1167 O HIS A 80 2.212 5.506 -8.320 1.00 0.00 O ATOM 1168 CB HIS A 80 -1.133 6.443 -8.763 1.00 0.00 C ATOM 1169 CG HIS A 80 -2.360 5.983 -9.517 1.00 0.00 C ATOM 1170 ND1 HIS A 80 -3.344 5.084 -9.085 1.00 0.00 N ATOM 1171 CD2 HIS A 80 -2.882 6.616 -10.605 1.00 0.00 C ATOM 1172 CE1 HIS A 80 -4.465 5.353 -9.774 1.00 0.00 C ATOM 1173 NE2 HIS A 80 -4.176 6.222 -10.743 1.00 0.00 N ATOM 0 H HIS A 80 -0.447 4.336 -9.890 1.00 0.00 H new ATOM 0 HA HIS A 80 0.320 7.058 -10.194 1.00 0.00 H new ATOM 0 HB2 HIS A 80 -1.101 5.909 -7.813 1.00 0.00 H new ATOM 0 HB3 HIS A 80 -1.257 7.501 -8.531 1.00 0.00 H new ATOM 0 HD2 HIS A 80 -2.359 7.310 -11.246 1.00 0.00 H new ATOM 0 HE1 HIS A 80 -5.441 4.934 -9.576 1.00 0.00 H new ATOM 0 HE2 HIS A 80 -4.819 6.539 -11.468 1.00 0.00 H new ATOM 1181 N VAL A 81 1.436 7.519 -7.697 1.00 0.00 N ATOM 1182 CA VAL A 81 2.525 7.783 -6.754 1.00 0.00 C ATOM 1183 C VAL A 81 2.617 6.653 -5.734 1.00 0.00 C ATOM 1184 O VAL A 81 3.627 5.963 -5.655 1.00 0.00 O ATOM 1185 CB VAL A 81 2.338 9.173 -6.100 1.00 0.00 C ATOM 1186 CG1 VAL A 81 3.084 9.353 -4.774 1.00 0.00 C ATOM 1187 CG2 VAL A 81 2.872 10.257 -7.039 1.00 0.00 C ATOM 0 H VAL A 81 0.728 8.252 -7.728 1.00 0.00 H new ATOM 0 HA VAL A 81 3.477 7.810 -7.284 1.00 0.00 H new ATOM 0 HB VAL A 81 1.268 9.254 -5.909 1.00 0.00 H new ATOM 0 HG11 VAL A 81 2.898 10.354 -4.385 1.00 0.00 H new ATOM 0 HG12 VAL A 81 2.732 8.613 -4.055 1.00 0.00 H new ATOM 0 HG13 VAL A 81 4.153 9.220 -4.937 1.00 0.00 H new ATOM 0 HG21 VAL A 81 2.740 11.236 -6.577 1.00 0.00 H new ATOM 0 HG22 VAL A 81 3.932 10.085 -7.228 1.00 0.00 H new ATOM 0 HG23 VAL A 81 2.325 10.224 -7.981 1.00 0.00 H new ATOM 1197 N GLY A 82 1.557 6.462 -4.950 1.00 0.00 N ATOM 1198 CA GLY A 82 1.549 5.475 -3.880 1.00 0.00 C ATOM 1199 C GLY A 82 0.779 4.230 -4.299 1.00 0.00 C ATOM 1200 O GLY A 82 -0.124 3.813 -3.574 1.00 0.00 O ATOM 0 H GLY A 82 0.686 6.985 -5.040 1.00 0.00 H new ATOM 0 HA2 GLY A 82 2.573 5.205 -3.621 1.00 0.00 H new ATOM 0 HA3 GLY A 82 1.096 5.904 -2.986 1.00 0.00 H new ATOM 1204 N ASP A 83 1.107 3.683 -5.475 1.00 0.00 N ATOM 1205 CA ASP A 83 0.375 2.615 -6.111 1.00 0.00 C ATOM 1206 C ASP A 83 1.171 1.322 -6.035 1.00 0.00 C ATOM 1207 O ASP A 83 1.685 0.804 -7.028 1.00 0.00 O ATOM 1208 CB ASP A 83 0.184 3.079 -7.557 1.00 0.00 C ATOM 1209 CG ASP A 83 -1.109 2.602 -8.157 1.00 0.00 C ATOM 1210 OD1 ASP A 83 -1.972 2.172 -7.361 1.00 0.00 O ATOM 1211 OD2 ASP A 83 -1.311 2.835 -9.367 1.00 0.00 O ATOM 0 H ASP A 83 1.916 3.990 -6.016 1.00 0.00 H new ATOM 0 HA ASP A 83 -0.582 2.411 -5.632 1.00 0.00 H new ATOM 0 HB2 ASP A 83 0.215 4.168 -7.591 1.00 0.00 H new ATOM 0 HB3 ASP A 83 1.015 2.717 -8.162 1.00 0.00 H new ATOM 1216 N LEU A 84 1.286 0.786 -4.824 1.00 0.00 N ATOM 1217 CA LEU A 84 2.152 -0.347 -4.534 1.00 0.00 C ATOM 1218 C LEU A 84 1.379 -1.634 -4.816 1.00 0.00 C ATOM 1219 O LEU A 84 1.270 -2.490 -3.943 1.00 0.00 O ATOM 1220 CB LEU A 84 2.643 -0.226 -3.083 1.00 0.00 C ATOM 1221 CG LEU A 84 3.233 1.161 -2.771 1.00 0.00 C ATOM 1222 CD1 LEU A 84 3.681 1.196 -1.310 1.00 0.00 C ATOM 1223 CD2 LEU A 84 4.411 1.510 -3.689 1.00 0.00 C ATOM 0 H LEU A 84 0.776 1.130 -4.011 1.00 0.00 H new ATOM 0 HA LEU A 84 3.038 -0.364 -5.169 1.00 0.00 H new ATOM 0 HB2 LEU A 84 1.813 -0.425 -2.405 1.00 0.00 H new ATOM 0 HB3 LEU A 84 3.398 -0.989 -2.894 1.00 0.00 H new ATOM 0 HG LEU A 84 2.457 1.906 -2.948 1.00 0.00 H new ATOM 0 HD11 LEU A 84 4.100 2.176 -1.081 1.00 0.00 H new ATOM 0 HD12 LEU A 84 2.825 1.008 -0.662 1.00 0.00 H new ATOM 0 HD13 LEU A 84 4.438 0.430 -1.143 1.00 0.00 H new ATOM 0 HD21 LEU A 84 4.794 2.497 -3.431 1.00 0.00 H new ATOM 0 HD22 LEU A 84 5.202 0.770 -3.563 1.00 0.00 H new ATOM 0 HD23 LEU A 84 4.076 1.511 -4.726 1.00 0.00 H new ATOM 1235 N GLY A 85 0.841 -1.725 -6.042 1.00 0.00 N ATOM 1236 CA GLY A 85 -0.120 -2.713 -6.509 1.00 0.00 C ATOM 1237 C GLY A 85 -0.874 -3.409 -5.373 1.00 0.00 C ATOM 1238 O GLY A 85 -1.800 -2.841 -4.784 1.00 0.00 O ATOM 0 H GLY A 85 1.088 -1.061 -6.776 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -0.839 -2.227 -7.168 1.00 0.00 H new ATOM 0 HA3 GLY A 85 0.401 -3.464 -7.103 1.00 0.00 H new ATOM 1242 N ASN A 86 -0.454 -4.643 -5.079 1.00 0.00 N ATOM 1243 CA ASN A 86 -1.032 -5.523 -4.072 1.00 0.00 C ATOM 1244 C ASN A 86 0.059 -6.300 -3.326 1.00 0.00 C ATOM 1245 O ASN A 86 1.225 -6.221 -3.704 1.00 0.00 O ATOM 1246 CB ASN A 86 -2.030 -6.464 -4.753 1.00 0.00 C ATOM 1247 CG ASN A 86 -1.397 -7.212 -5.919 1.00 0.00 C ATOM 1248 OD1 ASN A 86 -0.799 -8.263 -5.731 1.00 0.00 O ATOM 1249 ND2 ASN A 86 -1.520 -6.679 -7.132 1.00 0.00 N ATOM 0 H ASN A 86 0.336 -5.071 -5.562 1.00 0.00 H new ATOM 0 HA ASN A 86 -1.557 -4.928 -3.325 1.00 0.00 H new ATOM 0 HB2 ASN A 86 -2.409 -7.181 -4.024 1.00 0.00 H new ATOM 0 HB3 ASN A 86 -2.885 -5.890 -5.110 1.00 0.00 H new ATOM 0 HD21 ASN A 86 -1.109 -7.148 -7.939 1.00 0.00 H new ATOM 0 HD22 ASN A 86 -2.025 -5.801 -7.255 1.00 0.00 H new ATOM 1256 N VAL A 87 -0.318 -7.018 -2.256 1.00 0.00 N ATOM 1257 CA VAL A 87 0.613 -7.720 -1.365 1.00 0.00 C ATOM 1258 C VAL A 87 0.340 -9.222 -1.431 1.00 0.00 C ATOM 1259 O VAL A 87 -0.245 -9.689 -2.402 1.00 0.00 O ATOM 1260 CB VAL A 87 0.542 -7.146 0.067 1.00 0.00 C ATOM 1261 CG1 VAL A 87 0.934 -5.669 0.052 1.00 0.00 C ATOM 1262 CG2 VAL A 87 -0.839 -7.289 0.720 1.00 0.00 C ATOM 0 H VAL A 87 -1.295 -7.127 -1.983 1.00 0.00 H new ATOM 0 HA VAL A 87 1.639 -7.561 -1.696 1.00 0.00 H new ATOM 0 HB VAL A 87 1.240 -7.732 0.665 1.00 0.00 H new ATOM 0 HG11 VAL A 87 0.882 -5.269 1.064 1.00 0.00 H new ATOM 0 HG12 VAL A 87 1.951 -5.566 -0.327 1.00 0.00 H new ATOM 0 HG13 VAL A 87 0.249 -5.117 -0.592 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -0.813 -6.864 1.723 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -1.581 -6.761 0.121 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -1.106 -8.344 0.780 1.00 0.00 H new ATOM 1272 N THR A 88 0.735 -10.008 -0.426 1.00 0.00 N ATOM 1273 CA THR A 88 0.437 -11.435 -0.398 1.00 0.00 C ATOM 1274 C THR A 88 0.277 -11.876 1.051 1.00 0.00 C ATOM 1275 O THR A 88 1.264 -11.960 1.777 1.00 0.00 O ATOM 1276 CB THR A 88 1.516 -12.225 -1.157 1.00 0.00 C ATOM 1277 OG1 THR A 88 1.806 -11.588 -2.388 1.00 0.00 O ATOM 1278 CG2 THR A 88 1.054 -13.652 -1.469 1.00 0.00 C ATOM 0 H THR A 88 1.264 -9.675 0.380 1.00 0.00 H new ATOM 0 HA THR A 88 -0.502 -11.641 -0.912 1.00 0.00 H new ATOM 0 HB THR A 88 2.398 -12.261 -0.517 1.00 0.00 H new ATOM 0 HG1 THR A 88 2.495 -12.096 -2.865 1.00 0.00 H new ATOM 0 HG21 THR A 88 1.842 -14.180 -2.006 1.00 0.00 H new ATOM 0 HG22 THR A 88 0.835 -14.175 -0.538 1.00 0.00 H new ATOM 0 HG23 THR A 88 0.156 -13.617 -2.085 1.00 0.00 H new ATOM 1286 N ALA A 89 -0.967 -12.100 1.484 1.00 0.00 N ATOM 1287 CA ALA A 89 -1.245 -12.570 2.829 1.00 0.00 C ATOM 1288 C ALA A 89 -1.020 -14.075 2.943 1.00 0.00 C ATOM 1289 O ALA A 89 -1.396 -14.831 2.044 1.00 0.00 O ATOM 1290 CB ALA A 89 -2.673 -12.219 3.229 1.00 0.00 C ATOM 0 H ALA A 89 -1.799 -11.960 0.911 1.00 0.00 H new ATOM 0 HA ALA A 89 -0.555 -12.071 3.509 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -2.866 -12.578 4.240 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -2.805 -11.137 3.197 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -3.371 -12.690 2.537 1.00 0.00 H new ATOM 1296 N ASP A 90 -0.444 -14.479 4.077 1.00 0.00 N ATOM 1297 CA ASP A 90 -0.259 -15.862 4.484 1.00 0.00 C ATOM 1298 C ASP A 90 -1.600 -16.508 4.808 1.00 0.00 C ATOM 1299 O ASP A 90 -2.622 -15.846 4.984 1.00 0.00 O ATOM 1300 CB ASP A 90 0.652 -15.947 5.733 1.00 0.00 C ATOM 1301 CG ASP A 90 2.018 -16.576 5.491 1.00 0.00 C ATOM 1302 OD1 ASP A 90 2.093 -17.488 4.637 1.00 0.00 O ATOM 1303 OD2 ASP A 90 2.934 -16.232 6.262 1.00 0.00 O ATOM 0 H ASP A 90 -0.080 -13.817 4.763 1.00 0.00 H new ATOM 0 HA ASP A 90 0.211 -16.392 3.655 1.00 0.00 H new ATOM 0 HB2 ASP A 90 0.796 -14.941 6.128 1.00 0.00 H new ATOM 0 HB3 ASP A 90 0.136 -16.521 6.503 1.00 0.00 H new ATOM 1308 N LYS A 91 -1.529 -17.818 5.024 1.00 0.00 N ATOM 1309 CA LYS A 91 -2.569 -18.676 5.563 1.00 0.00 C ATOM 1310 C LYS A 91 -3.122 -18.163 6.902 1.00 0.00 C ATOM 1311 O LYS A 91 -4.250 -18.476 7.270 1.00 0.00 O ATOM 1312 CB LYS A 91 -1.957 -20.079 5.685 1.00 0.00 C ATOM 1313 CG LYS A 91 -0.954 -20.201 6.848 1.00 0.00 C ATOM 1314 CD LYS A 91 0.233 -21.120 6.528 1.00 0.00 C ATOM 1315 CE LYS A 91 1.285 -20.362 5.697 1.00 0.00 C ATOM 1316 NZ LYS A 91 2.559 -21.097 5.584 1.00 0.00 N ATOM 0 H LYS A 91 -0.680 -18.342 4.810 1.00 0.00 H new ATOM 0 HA LYS A 91 -3.434 -18.689 4.899 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -2.756 -20.807 5.824 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -1.455 -20.332 4.751 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -0.579 -19.209 7.102 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -1.473 -20.581 7.728 1.00 0.00 H new ATOM 0 HD2 LYS A 91 0.682 -21.482 7.453 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -0.113 -21.995 5.978 1.00 0.00 H new ATOM 0 HE2 LYS A 91 0.888 -20.175 4.699 1.00 0.00 H new ATOM 0 HE3 LYS A 91 1.471 -19.390 6.153 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 3.230 -20.543 5.015 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 2.955 -21.253 6.533 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 2.391 -22.014 5.124 1.00 0.00 H new ATOM 1330 N ASP A 92 -2.306 -17.386 7.624 1.00 0.00 N ATOM 1331 CA ASP A 92 -2.600 -16.831 8.938 1.00 0.00 C ATOM 1332 C ASP A 92 -3.222 -15.441 8.793 1.00 0.00 C ATOM 1333 O ASP A 92 -3.658 -14.839 9.771 1.00 0.00 O ATOM 1334 CB ASP A 92 -1.295 -16.756 9.752 1.00 0.00 C ATOM 1335 CG ASP A 92 -1.453 -17.413 11.115 1.00 0.00 C ATOM 1336 OD1 ASP A 92 -1.381 -18.660 11.142 1.00 0.00 O ATOM 1337 OD2 ASP A 92 -1.630 -16.662 12.099 1.00 0.00 O ATOM 0 H ASP A 92 -1.381 -17.118 7.287 1.00 0.00 H new ATOM 0 HA ASP A 92 -3.313 -17.471 9.458 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -0.492 -17.246 9.201 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -1.004 -15.714 9.880 1.00 0.00 H new ATOM 1342 N GLY A 93 -3.241 -14.910 7.566 1.00 0.00 N ATOM 1343 CA GLY A 93 -3.822 -13.612 7.290 1.00 0.00 C ATOM 1344 C GLY A 93 -2.858 -12.464 7.579 1.00 0.00 C ATOM 1345 O GLY A 93 -3.289 -11.367 7.948 1.00 0.00 O ATOM 0 H GLY A 93 -2.853 -15.374 6.745 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -4.128 -13.570 6.245 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -4.722 -13.486 7.891 1.00 0.00 H new ATOM 1349 N VAL A 94 -1.560 -12.726 7.393 1.00 0.00 N ATOM 1350 CA VAL A 94 -0.458 -11.796 7.604 1.00 0.00 C ATOM 1351 C VAL A 94 0.169 -11.509 6.242 1.00 0.00 C ATOM 1352 O VAL A 94 0.671 -12.434 5.612 1.00 0.00 O ATOM 1353 CB VAL A 94 0.558 -12.419 8.578 1.00 0.00 C ATOM 1354 CG1 VAL A 94 1.869 -11.616 8.634 1.00 0.00 C ATOM 1355 CG2 VAL A 94 -0.050 -12.524 9.984 1.00 0.00 C ATOM 0 H VAL A 94 -1.239 -13.640 7.075 1.00 0.00 H new ATOM 0 HA VAL A 94 -0.802 -10.861 8.046 1.00 0.00 H new ATOM 0 HB VAL A 94 0.795 -13.416 8.207 1.00 0.00 H new ATOM 0 HG11 VAL A 94 2.557 -12.091 9.333 1.00 0.00 H new ATOM 0 HG12 VAL A 94 2.321 -11.588 7.643 1.00 0.00 H new ATOM 0 HG13 VAL A 94 1.659 -10.599 8.966 1.00 0.00 H new ATOM 0 HG21 VAL A 94 0.679 -12.966 10.663 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -0.320 -11.529 10.339 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -0.941 -13.151 9.949 1.00 0.00 H new ATOM 1365 N ALA A 95 0.117 -10.263 5.758 1.00 0.00 N ATOM 1366 CA ALA A 95 0.776 -9.864 4.523 1.00 0.00 C ATOM 1367 C ALA A 95 2.028 -9.093 4.897 1.00 0.00 C ATOM 1368 O ALA A 95 1.922 -7.959 5.367 1.00 0.00 O ATOM 1369 CB ALA A 95 -0.149 -9.029 3.629 1.00 0.00 C ATOM 0 H ALA A 95 -0.387 -9.505 6.218 1.00 0.00 H new ATOM 0 HA ALA A 95 1.038 -10.748 3.942 1.00 0.00 H new ATOM 0 HB1 ALA A 95 0.380 -8.751 2.717 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -1.032 -9.614 3.372 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -0.453 -8.128 4.161 1.00 0.00 H new ATOM 1375 N ASP A 96 3.185 -9.727 4.700 1.00 0.00 N ATOM 1376 CA ASP A 96 4.481 -9.114 4.911 1.00 0.00 C ATOM 1377 C ASP A 96 4.844 -8.318 3.661 1.00 0.00 C ATOM 1378 O ASP A 96 5.167 -8.892 2.623 1.00 0.00 O ATOM 1379 CB ASP A 96 5.535 -10.170 5.260 1.00 0.00 C ATOM 1380 CG ASP A 96 5.305 -10.750 6.651 1.00 0.00 C ATOM 1381 OD1 ASP A 96 5.241 -9.945 7.607 1.00 0.00 O ATOM 1382 OD2 ASP A 96 5.185 -11.988 6.736 1.00 0.00 O ATOM 0 H ASP A 96 3.240 -10.695 4.385 1.00 0.00 H new ATOM 0 HA ASP A 96 4.445 -8.433 5.761 1.00 0.00 H new ATOM 0 HB2 ASP A 96 5.507 -10.971 4.521 1.00 0.00 H new ATOM 0 HB3 ASP A 96 6.529 -9.724 5.210 1.00 0.00 H new ATOM 1387 N VAL A 97 4.757 -6.991 3.743 1.00 0.00 N ATOM 1388 CA VAL A 97 5.135 -6.105 2.653 1.00 0.00 C ATOM 1389 C VAL A 97 6.640 -5.907 2.744 1.00 0.00 C ATOM 1390 O VAL A 97 7.171 -5.851 3.851 1.00 0.00 O ATOM 1391 CB VAL A 97 4.394 -4.757 2.747 1.00 0.00 C ATOM 1392 CG1 VAL A 97 4.423 -4.030 1.397 1.00 0.00 C ATOM 1393 CG2 VAL A 97 2.947 -4.959 3.202 1.00 0.00 C ATOM 0 H VAL A 97 4.420 -6.502 4.573 1.00 0.00 H new ATOM 0 HA VAL A 97 4.860 -6.542 1.693 1.00 0.00 H new ATOM 0 HB VAL A 97 4.907 -4.144 3.488 1.00 0.00 H new ATOM 0 HG11 VAL A 97 3.895 -3.080 1.484 1.00 0.00 H new ATOM 0 HG12 VAL A 97 5.457 -3.845 1.106 1.00 0.00 H new ATOM 0 HG13 VAL A 97 3.938 -4.647 0.641 1.00 0.00 H new ATOM 0 HG21 VAL A 97 2.446 -3.993 3.260 1.00 0.00 H new ATOM 0 HG22 VAL A 97 2.426 -5.595 2.487 1.00 0.00 H new ATOM 0 HG23 VAL A 97 2.937 -5.433 4.184 1.00 0.00 H new ATOM 1403 N SER A 98 7.311 -5.785 1.599 1.00 0.00 N ATOM 1404 CA SER A 98 8.737 -5.508 1.507 1.00 0.00 C ATOM 1405 C SER A 98 9.043 -5.068 0.073 1.00 0.00 C ATOM 1406 O SER A 98 9.111 -5.906 -0.825 1.00 0.00 O ATOM 1407 CB SER A 98 9.547 -6.748 1.918 1.00 0.00 C ATOM 1408 OG SER A 98 10.899 -6.395 2.138 1.00 0.00 O ATOM 0 H SER A 98 6.862 -5.879 0.688 1.00 0.00 H new ATOM 0 HA SER A 98 9.022 -4.708 2.190 1.00 0.00 H new ATOM 0 HB2 SER A 98 9.125 -7.184 2.824 1.00 0.00 H new ATOM 0 HB3 SER A 98 9.484 -7.508 1.139 1.00 0.00 H new ATOM 0 HG SER A 98 11.406 -7.191 2.401 1.00 0.00 H new ATOM 1414 N ILE A 99 9.161 -3.759 -0.158 1.00 0.00 N ATOM 1415 CA ILE A 99 9.453 -3.168 -1.460 1.00 0.00 C ATOM 1416 C ILE A 99 10.214 -1.853 -1.239 1.00 0.00 C ATOM 1417 O ILE A 99 10.455 -1.470 -0.096 1.00 0.00 O ATOM 1418 CB ILE A 99 8.131 -3.019 -2.248 1.00 0.00 C ATOM 1419 CG1 ILE A 99 8.371 -2.715 -3.735 1.00 0.00 C ATOM 1420 CG2 ILE A 99 7.198 -1.970 -1.626 1.00 0.00 C ATOM 1421 CD1 ILE A 99 7.181 -3.103 -4.617 1.00 0.00 C ATOM 0 H ILE A 99 9.052 -3.063 0.579 1.00 0.00 H new ATOM 0 HA ILE A 99 10.099 -3.801 -2.068 1.00 0.00 H new ATOM 0 HB ILE A 99 7.633 -3.987 -2.183 1.00 0.00 H new ATOM 0 HG12 ILE A 99 8.576 -1.651 -3.856 1.00 0.00 H new ATOM 0 HG13 ILE A 99 9.258 -3.251 -4.073 1.00 0.00 H new ATOM 0 HG21 ILE A 99 6.283 -1.902 -2.215 1.00 0.00 H new ATOM 0 HG22 ILE A 99 6.951 -2.262 -0.605 1.00 0.00 H new ATOM 0 HG23 ILE A 99 7.696 -1.000 -1.616 1.00 0.00 H new ATOM 0 HD11 ILE A 99 7.406 -2.866 -5.657 1.00 0.00 H new ATOM 0 HD12 ILE A 99 6.991 -4.172 -4.522 1.00 0.00 H new ATOM 0 HD13 ILE A 99 6.298 -2.548 -4.301 1.00 0.00 H new ATOM 1433 N GLU A 100 10.606 -1.151 -2.300 1.00 0.00 N ATOM 1434 CA GLU A 100 11.254 0.146 -2.217 1.00 0.00 C ATOM 1435 C GLU A 100 10.823 0.988 -3.415 1.00 0.00 C ATOM 1436 O GLU A 100 10.382 0.431 -4.422 1.00 0.00 O ATOM 1437 CB GLU A 100 12.774 -0.044 -2.141 1.00 0.00 C ATOM 1438 CG GLU A 100 13.365 -0.997 -3.189 1.00 0.00 C ATOM 1439 CD GLU A 100 14.840 -1.228 -2.910 1.00 0.00 C ATOM 1440 OE1 GLU A 100 15.124 -1.726 -1.798 1.00 0.00 O ATOM 1441 OE2 GLU A 100 15.666 -0.895 -3.783 1.00 0.00 O ATOM 0 H GLU A 100 10.477 -1.478 -3.257 1.00 0.00 H new ATOM 0 HA GLU A 100 10.955 0.677 -1.313 1.00 0.00 H new ATOM 0 HB2 GLU A 100 13.252 0.930 -2.248 1.00 0.00 H new ATOM 0 HB3 GLU A 100 13.029 -0.417 -1.149 1.00 0.00 H new ATOM 0 HG2 GLU A 100 12.830 -1.947 -3.171 1.00 0.00 H new ATOM 0 HG3 GLU A 100 13.237 -0.578 -4.187 1.00 0.00 H new ATOM 1448 N ASP A 101 10.929 2.316 -3.297 1.00 0.00 N ATOM 1449 CA ASP A 101 10.659 3.253 -4.383 1.00 0.00 C ATOM 1450 C ASP A 101 11.600 4.444 -4.230 1.00 0.00 C ATOM 1451 O ASP A 101 12.079 4.726 -3.134 1.00 0.00 O ATOM 1452 CB ASP A 101 9.189 3.700 -4.376 1.00 0.00 C ATOM 1453 CG ASP A 101 8.714 4.369 -5.669 1.00 0.00 C ATOM 1454 OD1 ASP A 101 9.542 4.873 -6.463 1.00 0.00 O ATOM 1455 OD2 ASP A 101 7.485 4.387 -5.872 1.00 0.00 O ATOM 0 H ASP A 101 11.209 2.773 -2.429 1.00 0.00 H new ATOM 0 HA ASP A 101 10.834 2.767 -5.343 1.00 0.00 H new ATOM 0 HB2 ASP A 101 8.561 2.831 -4.181 1.00 0.00 H new ATOM 0 HB3 ASP A 101 9.039 4.393 -3.549 1.00 0.00 H new ATOM 1460 N SER A 102 11.854 5.123 -5.342 1.00 0.00 N ATOM 1461 CA SER A 102 12.625 6.343 -5.455 1.00 0.00 C ATOM 1462 C SER A 102 11.720 7.579 -5.481 1.00 0.00 C ATOM 1463 O SER A 102 12.192 8.675 -5.193 1.00 0.00 O ATOM 1464 CB SER A 102 13.500 6.259 -6.710 1.00 0.00 C ATOM 1465 OG SER A 102 12.743 5.818 -7.824 1.00 0.00 O ATOM 0 H SER A 102 11.501 4.810 -6.246 1.00 0.00 H new ATOM 0 HA SER A 102 13.264 6.448 -4.578 1.00 0.00 H new ATOM 0 HB2 SER A 102 13.933 7.237 -6.923 1.00 0.00 H new ATOM 0 HB3 SER A 102 14.330 5.574 -6.535 1.00 0.00 H new ATOM 0 HG SER A 102 13.320 5.773 -8.615 1.00 0.00 H new ATOM 1471 N VAL A 103 10.442 7.427 -5.852 1.00 0.00 N ATOM 1472 CA VAL A 103 9.533 8.555 -5.996 1.00 0.00 C ATOM 1473 C VAL A 103 9.098 9.051 -4.615 1.00 0.00 C ATOM 1474 O VAL A 103 9.450 10.156 -4.209 1.00 0.00 O ATOM 1475 CB VAL A 103 8.360 8.160 -6.912 1.00 0.00 C ATOM 1476 CG1 VAL A 103 7.288 9.255 -6.970 1.00 0.00 C ATOM 1477 CG2 VAL A 103 8.878 7.912 -8.335 1.00 0.00 C ATOM 0 H VAL A 103 10.018 6.522 -6.058 1.00 0.00 H new ATOM 0 HA VAL A 103 10.033 9.395 -6.478 1.00 0.00 H new ATOM 0 HB VAL A 103 7.913 7.256 -6.498 1.00 0.00 H new ATOM 0 HG11 VAL A 103 6.478 8.937 -7.627 1.00 0.00 H new ATOM 0 HG12 VAL A 103 6.895 9.433 -5.969 1.00 0.00 H new ATOM 0 HG13 VAL A 103 7.728 10.175 -7.356 1.00 0.00 H new ATOM 0 HG21 VAL A 103 8.046 7.633 -8.981 1.00 0.00 H new ATOM 0 HG22 VAL A 103 9.344 8.821 -8.716 1.00 0.00 H new ATOM 0 HG23 VAL A 103 9.612 7.106 -8.320 1.00 0.00 H new ATOM 1487 N ILE A 104 8.308 8.258 -3.885 1.00 0.00 N ATOM 1488 CA ILE A 104 7.882 8.621 -2.552 1.00 0.00 C ATOM 1489 C ILE A 104 9.077 8.631 -1.596 1.00 0.00 C ATOM 1490 O ILE A 104 10.091 7.988 -1.860 1.00 0.00 O ATOM 1491 CB ILE A 104 6.719 7.716 -2.118 1.00 0.00 C ATOM 1492 CG1 ILE A 104 6.931 6.191 -2.155 1.00 0.00 C ATOM 1493 CG2 ILE A 104 5.489 8.039 -2.969 1.00 0.00 C ATOM 1494 CD1 ILE A 104 7.922 5.675 -1.111 1.00 0.00 C ATOM 0 H ILE A 104 7.955 7.357 -4.207 1.00 0.00 H new ATOM 0 HA ILE A 104 7.493 9.639 -2.534 1.00 0.00 H new ATOM 0 HB ILE A 104 6.607 7.949 -1.059 1.00 0.00 H new ATOM 0 HG12 ILE A 104 5.971 5.697 -2.005 1.00 0.00 H new ATOM 0 HG13 ILE A 104 7.283 5.907 -3.147 1.00 0.00 H new ATOM 0 HG21 ILE A 104 4.659 7.400 -2.666 1.00 0.00 H new ATOM 0 HG22 ILE A 104 5.213 9.084 -2.827 1.00 0.00 H new ATOM 0 HG23 ILE A 104 5.718 7.863 -4.020 1.00 0.00 H new ATOM 0 HD11 ILE A 104 8.016 4.593 -1.202 1.00 0.00 H new ATOM 0 HD12 ILE A 104 8.895 6.139 -1.273 1.00 0.00 H new ATOM 0 HD13 ILE A 104 7.562 5.925 -0.113 1.00 0.00 H new ATOM 1506 N SER A 105 8.994 9.398 -0.504 1.00 0.00 N ATOM 1507 CA SER A 105 10.077 9.547 0.454 1.00 0.00 C ATOM 1508 C SER A 105 9.490 10.074 1.756 1.00 0.00 C ATOM 1509 O SER A 105 8.280 10.270 1.856 1.00 0.00 O ATOM 1510 CB SER A 105 11.198 10.429 -0.120 1.00 0.00 C ATOM 1511 OG SER A 105 12.019 9.709 -1.019 1.00 0.00 O ATOM 0 H SER A 105 8.161 9.936 -0.264 1.00 0.00 H new ATOM 0 HA SER A 105 10.549 8.587 0.662 1.00 0.00 H new ATOM 0 HB2 SER A 105 10.761 11.286 -0.632 1.00 0.00 H new ATOM 0 HB3 SER A 105 11.807 10.821 0.695 1.00 0.00 H new ATOM 0 HG SER A 105 11.485 9.025 -1.473 1.00 0.00 H new ATOM 1517 N LEU A 106 10.348 10.304 2.749 1.00 0.00 N ATOM 1518 CA LEU A 106 10.016 10.947 4.011 1.00 0.00 C ATOM 1519 C LEU A 106 10.482 12.407 3.962 1.00 0.00 C ATOM 1520 O LEU A 106 10.851 12.976 4.985 1.00 0.00 O ATOM 1521 CB LEU A 106 10.679 10.153 5.153 1.00 0.00 C ATOM 1522 CG LEU A 106 10.153 8.708 5.243 1.00 0.00 C ATOM 1523 CD1 LEU A 106 11.040 7.850 6.152 1.00 0.00 C ATOM 1524 CD2 LEU A 106 8.732 8.699 5.809 1.00 0.00 C ATOM 0 H LEU A 106 11.330 10.036 2.690 1.00 0.00 H new ATOM 0 HA LEU A 106 8.940 10.953 4.188 1.00 0.00 H new ATOM 0 HB2 LEU A 106 11.758 10.136 5.001 1.00 0.00 H new ATOM 0 HB3 LEU A 106 10.498 10.663 6.099 1.00 0.00 H new ATOM 0 HG LEU A 106 10.163 8.293 4.235 1.00 0.00 H new ATOM 0 HD11 LEU A 106 10.643 6.836 6.195 1.00 0.00 H new ATOM 0 HD12 LEU A 106 12.054 7.826 5.753 1.00 0.00 H new ATOM 0 HD13 LEU A 106 11.054 8.277 7.155 1.00 0.00 H new ATOM 0 HD21 LEU A 106 8.370 7.672 5.868 1.00 0.00 H new ATOM 0 HD22 LEU A 106 8.734 9.141 6.805 1.00 0.00 H new ATOM 0 HD23 LEU A 106 8.077 9.277 5.157 1.00 0.00 H new ATOM 1536 N SER A 107 10.495 12.989 2.754 1.00 0.00 N ATOM 1537 CA SER A 107 11.031 14.318 2.487 1.00 0.00 C ATOM 1538 C SER A 107 10.087 15.441 2.944 1.00 0.00 C ATOM 1539 O SER A 107 9.534 15.369 4.038 1.00 0.00 O ATOM 1540 CB SER A 107 11.420 14.393 1.004 1.00 0.00 C ATOM 1541 OG SER A 107 12.050 13.183 0.637 1.00 0.00 O ATOM 0 H SER A 107 10.123 12.533 1.921 1.00 0.00 H new ATOM 0 HA SER A 107 11.928 14.481 3.085 1.00 0.00 H new ATOM 0 HB2 SER A 107 10.535 14.559 0.390 1.00 0.00 H new ATOM 0 HB3 SER A 107 12.090 15.235 0.832 1.00 0.00 H new ATOM 0 HG SER A 107 12.301 13.219 -0.310 1.00 0.00 H new ATOM 1547 N GLY A 108 9.889 16.475 2.116 1.00 0.00 N ATOM 1548 CA GLY A 108 8.936 17.551 2.366 1.00 0.00 C ATOM 1549 C GLY A 108 7.732 17.368 1.447 1.00 0.00 C ATOM 1550 O GLY A 108 6.680 16.914 1.882 1.00 0.00 O ATOM 0 H GLY A 108 10.399 16.584 1.239 1.00 0.00 H new ATOM 0 HA2 GLY A 108 8.619 17.539 3.409 1.00 0.00 H new ATOM 0 HA3 GLY A 108 9.404 18.519 2.186 1.00 0.00 H new ATOM 1554 N ASP A 109 7.912 17.666 0.159 1.00 0.00 N ATOM 1555 CA ASP A 109 6.885 17.458 -0.853 1.00 0.00 C ATOM 1556 C ASP A 109 6.487 15.976 -0.898 1.00 0.00 C ATOM 1557 O ASP A 109 5.343 15.592 -0.643 1.00 0.00 O ATOM 1558 CB ASP A 109 7.432 17.950 -2.199 1.00 0.00 C ATOM 1559 CG ASP A 109 6.363 17.873 -3.278 1.00 0.00 C ATOM 1560 OD1 ASP A 109 6.039 16.729 -3.662 1.00 0.00 O ATOM 1561 OD2 ASP A 109 5.897 18.956 -3.689 1.00 0.00 O ATOM 0 H ASP A 109 8.778 18.059 -0.209 1.00 0.00 H new ATOM 0 HA ASP A 109 5.983 18.022 -0.615 1.00 0.00 H new ATOM 0 HB2 ASP A 109 7.782 18.978 -2.100 1.00 0.00 H new ATOM 0 HB3 ASP A 109 8.292 17.347 -2.489 1.00 0.00 H new ATOM 1566 N HIS A 110 7.477 15.120 -1.167 1.00 0.00 N ATOM 1567 CA HIS A 110 7.248 13.691 -1.317 1.00 0.00 C ATOM 1568 C HIS A 110 6.964 12.965 0.001 1.00 0.00 C ATOM 1569 O HIS A 110 6.498 11.827 -0.068 1.00 0.00 O ATOM 1570 CB HIS A 110 8.373 13.025 -2.127 1.00 0.00 C ATOM 1571 CG HIS A 110 7.959 12.773 -3.556 1.00 0.00 C ATOM 1572 ND1 HIS A 110 6.866 12.034 -3.949 1.00 0.00 N ATOM 1573 CD2 HIS A 110 8.529 13.296 -4.685 1.00 0.00 C ATOM 1574 CE1 HIS A 110 6.770 12.129 -5.284 1.00 0.00 C ATOM 1575 NE2 HIS A 110 7.766 12.878 -5.782 1.00 0.00 N ATOM 0 H HIS A 110 8.450 15.401 -1.285 1.00 0.00 H new ATOM 0 HA HIS A 110 6.326 13.593 -1.890 1.00 0.00 H new ATOM 0 HB2 HIS A 110 9.258 13.661 -2.111 1.00 0.00 H new ATOM 0 HB3 HIS A 110 8.650 12.082 -1.657 1.00 0.00 H new ATOM 0 HD2 HIS A 110 9.410 13.920 -4.723 1.00 0.00 H new ATOM 0 HE1 HIS A 110 5.996 11.665 -5.877 1.00 0.00 H new ATOM 0 HE2 HIS A 110 7.934 13.099 -6.764 1.00 0.00 H new ATOM 1583 N SER A 111 7.221 13.596 1.159 1.00 0.00 N ATOM 1584 CA SER A 111 6.921 13.052 2.483 1.00 0.00 C ATOM 1585 C SER A 111 5.623 12.244 2.521 1.00 0.00 C ATOM 1586 O SER A 111 4.539 12.786 2.299 1.00 0.00 O ATOM 1587 CB SER A 111 6.840 14.144 3.560 1.00 0.00 C ATOM 1588 OG SER A 111 7.507 13.696 4.726 1.00 0.00 O ATOM 0 H SER A 111 7.653 14.519 1.195 1.00 0.00 H new ATOM 0 HA SER A 111 7.757 12.386 2.698 1.00 0.00 H new ATOM 0 HB2 SER A 111 7.296 15.065 3.197 1.00 0.00 H new ATOM 0 HB3 SER A 111 5.798 14.372 3.787 1.00 0.00 H new ATOM 0 HG SER A 111 8.375 14.146 4.800 1.00 0.00 H new ATOM 1594 N ILE A 112 5.735 10.954 2.835 1.00 0.00 N ATOM 1595 CA ILE A 112 4.586 10.086 3.063 1.00 0.00 C ATOM 1596 C ILE A 112 3.998 10.277 4.466 1.00 0.00 C ATOM 1597 O ILE A 112 2.870 9.863 4.732 1.00 0.00 O ATOM 1598 CB ILE A 112 4.952 8.625 2.763 1.00 0.00 C ATOM 1599 CG1 ILE A 112 6.072 8.107 3.676 1.00 0.00 C ATOM 1600 CG2 ILE A 112 5.348 8.494 1.286 1.00 0.00 C ATOM 1601 CD1 ILE A 112 6.137 6.580 3.682 1.00 0.00 C ATOM 0 H ILE A 112 6.633 10.481 2.938 1.00 0.00 H new ATOM 0 HA ILE A 112 3.795 10.371 2.370 1.00 0.00 H new ATOM 0 HB ILE A 112 4.077 8.008 2.964 1.00 0.00 H new ATOM 0 HG12 ILE A 112 7.028 8.510 3.343 1.00 0.00 H new ATOM 0 HG13 ILE A 112 5.910 8.468 4.692 1.00 0.00 H new ATOM 0 HG21 ILE A 112 5.608 7.458 1.070 1.00 0.00 H new ATOM 0 HG22 ILE A 112 4.511 8.797 0.657 1.00 0.00 H new ATOM 0 HG23 ILE A 112 6.206 9.134 1.081 1.00 0.00 H new ATOM 0 HD11 ILE A 112 6.942 6.253 4.340 1.00 0.00 H new ATOM 0 HD12 ILE A 112 5.190 6.177 4.040 1.00 0.00 H new ATOM 0 HD13 ILE A 112 6.326 6.220 2.671 1.00 0.00 H new ATOM 1613 N ILE A 113 4.756 10.922 5.357 1.00 0.00 N ATOM 1614 CA ILE A 113 4.282 11.350 6.657 1.00 0.00 C ATOM 1615 C ILE A 113 3.050 12.209 6.416 1.00 0.00 C ATOM 1616 O ILE A 113 3.109 13.193 5.682 1.00 0.00 O ATOM 1617 CB ILE A 113 5.375 12.128 7.417 1.00 0.00 C ATOM 1618 CG1 ILE A 113 6.601 11.260 7.741 1.00 0.00 C ATOM 1619 CG2 ILE A 113 4.815 12.749 8.708 1.00 0.00 C ATOM 1620 CD1 ILE A 113 6.250 9.972 8.486 1.00 0.00 C ATOM 0 H ILE A 113 5.732 11.161 5.183 1.00 0.00 H new ATOM 0 HA ILE A 113 4.031 10.492 7.281 1.00 0.00 H new ATOM 0 HB ILE A 113 5.704 12.925 6.750 1.00 0.00 H new ATOM 0 HG12 ILE A 113 7.114 11.007 6.813 1.00 0.00 H new ATOM 0 HG13 ILE A 113 7.300 11.841 8.343 1.00 0.00 H new ATOM 0 HG21 ILE A 113 5.607 13.292 9.224 1.00 0.00 H new ATOM 0 HG22 ILE A 113 4.006 13.436 8.460 1.00 0.00 H new ATOM 0 HG23 ILE A 113 4.434 11.960 9.356 1.00 0.00 H new ATOM 0 HD11 ILE A 113 7.161 9.406 8.684 1.00 0.00 H new ATOM 0 HD12 ILE A 113 5.764 10.219 9.430 1.00 0.00 H new ATOM 0 HD13 ILE A 113 5.575 9.371 7.876 1.00 0.00 H new ATOM 1632 N GLY A 114 1.935 11.806 7.012 1.00 0.00 N ATOM 1633 CA GLY A 114 0.689 12.525 6.894 1.00 0.00 C ATOM 1634 C GLY A 114 -0.173 12.061 5.720 1.00 0.00 C ATOM 1635 O GLY A 114 -1.125 12.746 5.359 1.00 0.00 O ATOM 0 H GLY A 114 1.877 10.968 7.591 1.00 0.00 H new ATOM 0 HA2 GLY A 114 0.123 12.409 7.818 1.00 0.00 H new ATOM 0 HA3 GLY A 114 0.901 13.588 6.781 1.00 0.00 H new ATOM 1639 N ARG A 115 0.133 10.904 5.125 1.00 0.00 N ATOM 1640 CA ARG A 115 -0.758 10.231 4.187 1.00 0.00 C ATOM 1641 C ARG A 115 -1.414 9.040 4.896 1.00 0.00 C ATOM 1642 O ARG A 115 -1.052 8.733 6.031 1.00 0.00 O ATOM 1643 CB ARG A 115 0.045 9.819 2.948 1.00 0.00 C ATOM 1644 CG ARG A 115 0.528 11.063 2.193 1.00 0.00 C ATOM 1645 CD ARG A 115 1.442 10.728 1.007 1.00 0.00 C ATOM 1646 NE ARG A 115 2.303 11.885 0.708 1.00 0.00 N ATOM 1647 CZ ARG A 115 3.180 11.986 -0.300 1.00 0.00 C ATOM 1648 NH1 ARG A 115 3.439 10.916 -1.059 1.00 0.00 N ATOM 1649 NH2 ARG A 115 3.783 13.154 -0.540 1.00 0.00 N ATOM 0 H ARG A 115 1.011 10.409 5.284 1.00 0.00 H new ATOM 0 HA ARG A 115 -1.557 10.891 3.851 1.00 0.00 H new ATOM 0 HB2 ARG A 115 0.899 9.210 3.245 1.00 0.00 H new ATOM 0 HB3 ARG A 115 -0.572 9.204 2.293 1.00 0.00 H new ATOM 0 HG2 ARG A 115 -0.336 11.620 1.832 1.00 0.00 H new ATOM 0 HG3 ARG A 115 1.063 11.715 2.883 1.00 0.00 H new ATOM 0 HD2 ARG A 115 2.054 9.857 1.241 1.00 0.00 H new ATOM 0 HD3 ARG A 115 0.843 10.472 0.133 1.00 0.00 H new ATOM 0 HE ARG A 115 2.224 12.689 1.330 1.00 0.00 H new ATOM 0 HH11 ARG A 115 2.970 10.030 -0.869 1.00 0.00 H new ATOM 0 HH12 ARG A 115 4.105 10.985 -1.828 1.00 0.00 H new ATOM 0 HH21 ARG A 115 3.575 13.965 0.043 1.00 0.00 H new ATOM 0 HH22 ARG A 115 4.451 13.235 -1.306 1.00 0.00 H new ATOM 1663 N THR A 116 -2.371 8.360 4.246 1.00 0.00 N ATOM 1664 CA THR A 116 -3.036 7.182 4.776 1.00 0.00 C ATOM 1665 C THR A 116 -2.933 6.017 3.799 1.00 0.00 C ATOM 1666 O THR A 116 -3.417 6.112 2.669 1.00 0.00 O ATOM 1667 CB THR A 116 -4.471 7.518 5.196 1.00 0.00 C ATOM 1668 OG1 THR A 116 -4.389 8.157 6.448 1.00 0.00 O ATOM 1669 CG2 THR A 116 -5.383 6.306 5.381 1.00 0.00 C ATOM 0 H THR A 116 -2.704 8.627 3.319 1.00 0.00 H new ATOM 0 HA THR A 116 -2.527 6.853 5.682 1.00 0.00 H new ATOM 0 HB THR A 116 -4.902 8.123 4.398 1.00 0.00 H new ATOM 0 HG1 THR A 116 -5.288 8.249 6.828 1.00 0.00 H new ATOM 0 HG21 THR A 116 -6.377 6.641 5.678 1.00 0.00 H new ATOM 0 HG22 THR A 116 -5.451 5.755 4.443 1.00 0.00 H new ATOM 0 HG23 THR A 116 -4.973 5.657 6.154 1.00 0.00 H new ATOM 1677 N LEU A 117 -2.300 4.924 4.238 1.00 0.00 N ATOM 1678 CA LEU A 117 -2.193 3.699 3.467 1.00 0.00 C ATOM 1679 C LEU A 117 -3.388 2.826 3.846 1.00 0.00 C ATOM 1680 O LEU A 117 -3.718 2.698 5.028 1.00 0.00 O ATOM 1681 CB LEU A 117 -0.823 3.038 3.701 1.00 0.00 C ATOM 1682 CG LEU A 117 -0.298 2.264 2.476 1.00 0.00 C ATOM 1683 CD1 LEU A 117 1.180 1.916 2.680 1.00 0.00 C ATOM 1684 CD2 LEU A 117 -1.070 0.970 2.210 1.00 0.00 C ATOM 0 H LEU A 117 -1.845 4.873 5.150 1.00 0.00 H new ATOM 0 HA LEU A 117 -2.232 3.880 2.393 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -0.099 3.806 3.973 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -0.897 2.356 4.548 1.00 0.00 H new ATOM 0 HG LEU A 117 -0.435 2.917 1.614 1.00 0.00 H new ATOM 0 HD11 LEU A 117 1.548 1.369 1.812 1.00 0.00 H new ATOM 0 HD12 LEU A 117 1.756 2.833 2.802 1.00 0.00 H new ATOM 0 HD13 LEU A 117 1.289 1.298 3.571 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -0.653 0.471 1.335 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -0.988 0.313 3.076 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -2.119 1.203 2.029 1.00 0.00 H new ATOM 1696 N VAL A 118 -4.084 2.297 2.839 1.00 0.00 N ATOM 1697 CA VAL A 118 -5.296 1.514 3.007 1.00 0.00 C ATOM 1698 C VAL A 118 -5.130 0.199 2.246 1.00 0.00 C ATOM 1699 O VAL A 118 -4.539 0.186 1.162 1.00 0.00 O ATOM 1700 CB VAL A 118 -6.490 2.331 2.493 1.00 0.00 C ATOM 1701 CG1 VAL A 118 -7.830 1.681 2.831 1.00 0.00 C ATOM 1702 CG2 VAL A 118 -6.495 3.750 3.076 1.00 0.00 C ATOM 0 H VAL A 118 -3.809 2.407 1.863 1.00 0.00 H new ATOM 0 HA VAL A 118 -5.479 1.281 4.056 1.00 0.00 H new ATOM 0 HB VAL A 118 -6.371 2.369 1.410 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -8.641 2.298 2.445 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -7.879 0.692 2.376 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -7.927 1.589 3.913 1.00 0.00 H new ATOM 0 HG21 VAL A 118 -7.354 4.299 2.690 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -6.557 3.697 4.163 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -5.578 4.264 2.790 1.00 0.00 H new ATOM 1712 N VAL A 119 -5.639 -0.895 2.825 1.00 0.00 N ATOM 1713 CA VAL A 119 -5.606 -2.222 2.232 1.00 0.00 C ATOM 1714 C VAL A 119 -7.011 -2.606 1.765 1.00 0.00 C ATOM 1715 O VAL A 119 -8.008 -2.243 2.392 1.00 0.00 O ATOM 1716 CB VAL A 119 -5.015 -3.239 3.219 1.00 0.00 C ATOM 1717 CG1 VAL A 119 -5.916 -3.441 4.432 1.00 0.00 C ATOM 1718 CG2 VAL A 119 -4.826 -4.605 2.556 1.00 0.00 C ATOM 0 H VAL A 119 -6.093 -0.874 3.738 1.00 0.00 H new ATOM 0 HA VAL A 119 -4.954 -2.221 1.359 1.00 0.00 H new ATOM 0 HB VAL A 119 -4.055 -2.830 3.535 1.00 0.00 H new ATOM 0 HG11 VAL A 119 -5.462 -4.168 5.106 1.00 0.00 H new ATOM 0 HG12 VAL A 119 -6.042 -2.492 4.954 1.00 0.00 H new ATOM 0 HG13 VAL A 119 -6.889 -3.808 4.105 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -4.406 -5.305 3.278 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -5.790 -4.977 2.208 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -4.147 -4.507 1.709 1.00 0.00 H new ATOM 1728 N HIS A 120 -7.076 -3.355 0.666 1.00 0.00 N ATOM 1729 CA HIS A 120 -8.303 -3.686 -0.044 1.00 0.00 C ATOM 1730 C HIS A 120 -8.625 -5.164 0.056 1.00 0.00 C ATOM 1731 O HIS A 120 -7.741 -5.978 0.313 1.00 0.00 O ATOM 1732 CB HIS A 120 -8.184 -3.288 -1.513 1.00 0.00 C ATOM 1733 CG HIS A 120 -8.224 -1.808 -1.671 1.00 0.00 C ATOM 1734 ND1 HIS A 120 -9.333 -1.032 -1.862 1.00 0.00 N ATOM 1735 CD2 HIS A 120 -7.105 -1.049 -1.612 1.00 0.00 C ATOM 1736 CE1 HIS A 120 -8.908 0.232 -1.965 1.00 0.00 C ATOM 1737 NE2 HIS A 120 -7.561 0.241 -1.832 1.00 0.00 N ATOM 0 H HIS A 120 -6.246 -3.760 0.233 1.00 0.00 H new ATOM 0 HA HIS A 120 -9.114 -3.128 0.424 1.00 0.00 H new ATOM 0 HB2 HIS A 120 -7.252 -3.676 -1.924 1.00 0.00 H new ATOM 0 HB3 HIS A 120 -8.996 -3.740 -2.083 1.00 0.00 H new ATOM 0 HD1 HIS A 120 -10.299 -1.355 -1.916 1.00 0.00 H new ATOM 0 HD2 HIS A 120 -6.090 -1.374 -1.434 1.00 0.00 H new ATOM 0 HE1 HIS A 120 -9.533 1.098 -2.127 1.00 0.00 H new ATOM 1745 N GLU A 121 -9.894 -5.509 -0.159 1.00 0.00 N ATOM 1746 CA GLU A 121 -10.367 -6.876 -0.072 1.00 0.00 C ATOM 1747 C GLU A 121 -9.640 -7.781 -1.061 1.00 0.00 C ATOM 1748 O GLU A 121 -9.071 -8.795 -0.670 1.00 0.00 O ATOM 1749 CB GLU A 121 -11.876 -6.910 -0.343 1.00 0.00 C ATOM 1750 CG GLU A 121 -12.477 -8.307 -0.130 1.00 0.00 C ATOM 1751 CD GLU A 121 -13.764 -8.438 -0.927 1.00 0.00 C ATOM 1752 OE1 GLU A 121 -14.681 -7.639 -0.643 1.00 0.00 O ATOM 1753 OE2 GLU A 121 -13.771 -9.284 -1.846 1.00 0.00 O ATOM 0 H GLU A 121 -10.623 -4.837 -0.400 1.00 0.00 H new ATOM 0 HA GLU A 121 -10.162 -7.248 0.932 1.00 0.00 H new ATOM 0 HB2 GLU A 121 -12.377 -6.198 0.313 1.00 0.00 H new ATOM 0 HB3 GLU A 121 -12.066 -6.588 -1.367 1.00 0.00 H new ATOM 0 HG2 GLU A 121 -11.765 -9.071 -0.442 1.00 0.00 H new ATOM 0 HG3 GLU A 121 -12.676 -8.470 0.929 1.00 0.00 H new ATOM 1760 N LYS A 122 -9.674 -7.433 -2.339 1.00 0.00 N ATOM 1761 CA LYS A 122 -9.040 -8.204 -3.393 1.00 0.00 C ATOM 1762 C LYS A 122 -7.691 -7.566 -3.715 1.00 0.00 C ATOM 1763 O LYS A 122 -7.373 -6.477 -3.226 1.00 0.00 O ATOM 1764 CB LYS A 122 -9.956 -8.233 -4.627 1.00 0.00 C ATOM 1765 CG LYS A 122 -11.361 -8.795 -4.339 1.00 0.00 C ATOM 1766 CD LYS A 122 -11.448 -10.319 -4.138 1.00 0.00 C ATOM 1767 CE LYS A 122 -11.592 -11.119 -5.444 1.00 0.00 C ATOM 1768 NZ LYS A 122 -10.326 -11.259 -6.190 1.00 0.00 N ATOM 0 H LYS A 122 -10.150 -6.596 -2.675 1.00 0.00 H new ATOM 0 HA LYS A 122 -8.875 -9.233 -3.075 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -10.052 -7.221 -5.021 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -9.485 -8.835 -5.404 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -11.750 -8.307 -3.445 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -12.018 -8.519 -5.164 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -10.554 -10.657 -3.615 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -12.298 -10.541 -3.493 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -11.980 -12.111 -5.212 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -12.328 -10.630 -6.082 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -10.386 -12.080 -6.825 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -10.156 -10.400 -6.750 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -9.542 -11.396 -5.521 1.00 0.00 H new ATOM 1782 N ALA A 123 -6.903 -8.228 -4.565 1.00 0.00 N ATOM 1783 CA ALA A 123 -5.795 -7.558 -5.221 1.00 0.00 C ATOM 1784 C ALA A 123 -6.344 -6.421 -6.065 1.00 0.00 C ATOM 1785 O ALA A 123 -7.490 -6.453 -6.512 1.00 0.00 O ATOM 1786 CB ALA A 123 -4.979 -8.500 -6.111 1.00 0.00 C ATOM 0 H ALA A 123 -7.014 -9.212 -4.808 1.00 0.00 H new ATOM 0 HA ALA A 123 -5.125 -7.187 -4.446 1.00 0.00 H new ATOM 0 HB1 ALA A 123 -4.164 -7.946 -6.576 1.00 0.00 H new ATOM 0 HB2 ALA A 123 -4.569 -9.308 -5.506 1.00 0.00 H new ATOM 0 HB3 ALA A 123 -5.623 -8.917 -6.886 1.00 0.00 H new ATOM 1792 N ASP A 124 -5.485 -5.442 -6.297 1.00 0.00 N ATOM 1793 CA ASP A 124 -5.707 -4.432 -7.299 1.00 0.00 C ATOM 1794 C ASP A 124 -5.565 -5.086 -8.688 1.00 0.00 C ATOM 1795 O ASP A 124 -4.767 -6.004 -8.872 1.00 0.00 O ATOM 1796 CB ASP A 124 -4.708 -3.298 -7.032 1.00 0.00 C ATOM 1797 CG ASP A 124 -3.495 -3.471 -7.915 1.00 0.00 C ATOM 1798 OD1 ASP A 124 -2.577 -4.210 -7.504 1.00 0.00 O ATOM 1799 OD2 ASP A 124 -3.573 -2.890 -9.016 1.00 0.00 O ATOM 0 H ASP A 124 -4.609 -5.332 -5.787 1.00 0.00 H new ATOM 0 HA ASP A 124 -6.707 -4.001 -7.264 1.00 0.00 H new ATOM 0 HB2 ASP A 124 -5.177 -2.334 -7.227 1.00 0.00 H new ATOM 0 HB3 ASP A 124 -4.410 -3.302 -5.983 1.00 0.00 H new ATOM 1804 N ASP A 125 -6.356 -4.622 -9.653 1.00 0.00 N ATOM 1805 CA ASP A 125 -6.430 -5.131 -11.016 1.00 0.00 C ATOM 1806 C ASP A 125 -5.403 -4.444 -11.926 1.00 0.00 C ATOM 1807 O ASP A 125 -5.610 -4.338 -13.132 1.00 0.00 O ATOM 1808 CB ASP A 125 -7.878 -4.928 -11.496 1.00 0.00 C ATOM 1809 CG ASP A 125 -8.170 -5.330 -12.940 1.00 0.00 C ATOM 1810 OD1 ASP A 125 -7.633 -6.364 -13.404 1.00 0.00 O ATOM 1811 OD2 ASP A 125 -8.959 -4.569 -13.547 1.00 0.00 O ATOM 0 H ASP A 125 -6.994 -3.842 -9.495 1.00 0.00 H new ATOM 0 HA ASP A 125 -6.178 -6.191 -11.051 1.00 0.00 H new ATOM 0 HB2 ASP A 125 -8.539 -5.496 -10.841 1.00 0.00 H new ATOM 0 HB3 ASP A 125 -8.136 -3.876 -11.374 1.00 0.00 H new ATOM 1816 N LEU A 126 -4.279 -3.945 -11.394 1.00 0.00 N ATOM 1817 CA LEU A 126 -3.180 -3.447 -12.218 1.00 0.00 C ATOM 1818 C LEU A 126 -3.678 -2.406 -13.237 1.00 0.00 C ATOM 1819 O LEU A 126 -3.131 -2.264 -14.327 1.00 0.00 O ATOM 1820 CB LEU A 126 -2.460 -4.661 -12.849 1.00 0.00 C ATOM 1821 CG LEU A 126 -1.293 -5.224 -12.014 1.00 0.00 C ATOM 1822 CD1 LEU A 126 -0.053 -4.389 -12.289 1.00 0.00 C ATOM 1823 CD2 LEU A 126 -1.528 -5.327 -10.495 1.00 0.00 C ATOM 0 H LEU A 126 -4.111 -3.877 -10.390 1.00 0.00 H new ATOM 0 HA LEU A 126 -2.450 -2.909 -11.613 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -3.189 -5.455 -13.010 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -2.081 -4.372 -13.829 1.00 0.00 H new ATOM 0 HG LEU A 126 -1.178 -6.259 -12.336 1.00 0.00 H new ATOM 0 HD11 LEU A 126 0.782 -4.775 -11.705 1.00 0.00 H new ATOM 0 HD12 LEU A 126 0.192 -4.440 -13.350 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -0.243 -3.353 -12.010 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -0.638 -5.736 -10.016 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -1.735 -4.336 -10.091 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -2.378 -5.982 -10.302 1.00 0.00 H new ATOM 1835 N GLY A 127 -4.743 -1.683 -12.872 1.00 0.00 N ATOM 1836 CA GLY A 127 -5.412 -0.659 -13.665 1.00 0.00 C ATOM 1837 C GLY A 127 -5.996 -1.126 -14.997 1.00 0.00 C ATOM 1838 O GLY A 127 -6.597 -0.313 -15.705 1.00 0.00 O ATOM 0 H GLY A 127 -5.183 -1.809 -11.960 1.00 0.00 H new ATOM 0 HA2 GLY A 127 -6.217 -0.231 -13.067 1.00 0.00 H new ATOM 0 HA3 GLY A 127 -4.701 0.143 -13.863 1.00 0.00 H new ATOM 1842 N LYS A 128 -5.862 -2.407 -15.345 1.00 0.00 N ATOM 1843 CA LYS A 128 -6.091 -2.862 -16.709 1.00 0.00 C ATOM 1844 C LYS A 128 -7.538 -3.307 -16.937 1.00 0.00 C ATOM 1845 O LYS A 128 -7.843 -3.888 -17.976 1.00 0.00 O ATOM 1846 CB LYS A 128 -5.049 -3.924 -17.086 1.00 0.00 C ATOM 1847 CG LYS A 128 -5.291 -5.257 -16.371 1.00 0.00 C ATOM 1848 CD LYS A 128 -4.082 -6.186 -16.524 1.00 0.00 C ATOM 1849 CE LYS A 128 -4.264 -7.456 -15.683 1.00 0.00 C ATOM 1850 NZ LYS A 128 -5.532 -8.152 -15.988 1.00 0.00 N ATOM 0 H LYS A 128 -5.595 -3.147 -14.695 1.00 0.00 H new ATOM 0 HA LYS A 128 -5.954 -2.021 -17.389 1.00 0.00 H new ATOM 0 HB2 LYS A 128 -5.070 -4.084 -18.164 1.00 0.00 H new ATOM 0 HB3 LYS A 128 -4.053 -3.557 -16.838 1.00 0.00 H new ATOM 0 HG2 LYS A 128 -5.485 -5.077 -15.314 1.00 0.00 H new ATOM 0 HG3 LYS A 128 -6.179 -5.738 -16.781 1.00 0.00 H new ATOM 0 HD2 LYS A 128 -3.953 -6.454 -17.573 1.00 0.00 H new ATOM 0 HD3 LYS A 128 -3.176 -5.666 -16.214 1.00 0.00 H new ATOM 0 HE2 LYS A 128 -3.428 -8.132 -15.864 1.00 0.00 H new ATOM 0 HE3 LYS A 128 -4.240 -7.195 -14.625 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 -5.522 -9.097 -15.555 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 -6.329 -7.604 -15.606 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 -5.638 -8.244 -17.018 1.00 0.00 H new ATOM 1864 N GLY A 129 -8.442 -3.010 -15.998 1.00 0.00 N ATOM 1865 CA GLY A 129 -9.859 -3.301 -16.146 1.00 0.00 C ATOM 1866 C GLY A 129 -10.516 -2.455 -17.238 1.00 0.00 C ATOM 1867 O GLY A 129 -11.643 -2.738 -17.635 1.00 0.00 O ATOM 0 H GLY A 129 -8.204 -2.560 -15.114 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -9.988 -4.357 -16.382 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -10.365 -3.122 -15.197 1.00 0.00 H new ATOM 1871 N GLY A 130 -9.838 -1.400 -17.710 1.00 0.00 N ATOM 1872 CA GLY A 130 -10.341 -0.550 -18.779 1.00 0.00 C ATOM 1873 C GLY A 130 -11.632 0.147 -18.359 1.00 0.00 C ATOM 1874 O GLY A 130 -12.576 0.250 -19.138 1.00 0.00 O ATOM 0 H GLY A 130 -8.924 -1.118 -17.355 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -9.590 0.195 -19.041 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -10.520 -1.149 -19.672 1.00 0.00 H new ATOM 1878 N ASN A 131 -11.676 0.619 -17.113 1.00 0.00 N ATOM 1879 CA ASN A 131 -12.863 1.179 -16.499 1.00 0.00 C ATOM 1880 C ASN A 131 -12.352 2.087 -15.402 1.00 0.00 C ATOM 1881 O ASN A 131 -11.559 1.598 -14.605 1.00 0.00 O ATOM 1882 CB ASN A 131 -13.757 0.025 -16.000 1.00 0.00 C ATOM 1883 CG ASN A 131 -14.584 0.395 -14.777 1.00 0.00 C ATOM 1884 OD1 ASN A 131 -15.798 0.539 -14.823 1.00 0.00 O ATOM 1885 ND2 ASN A 131 -13.884 0.573 -13.665 1.00 0.00 N ATOM 0 H ASN A 131 -10.865 0.619 -16.495 1.00 0.00 H new ATOM 0 HA ASN A 131 -13.489 1.759 -17.177 1.00 0.00 H new ATOM 0 HB2 ASN A 131 -14.426 -0.282 -16.804 1.00 0.00 H new ATOM 0 HB3 ASN A 131 -13.131 -0.834 -15.761 1.00 0.00 H new ATOM 0 HD21 ASN A 131 -14.357 0.841 -12.802 1.00 0.00 H new ATOM 0 HD22 ASN A 131 -12.872 0.442 -13.673 1.00 0.00 H new ATOM 1892 N GLU A 132 -12.825 3.335 -15.318 1.00 0.00 N ATOM 1893 CA GLU A 132 -12.402 4.296 -14.310 1.00 0.00 C ATOM 1894 C GLU A 132 -12.171 3.662 -12.942 1.00 0.00 C ATOM 1895 O GLU A 132 -11.055 3.706 -12.450 1.00 0.00 O ATOM 1896 CB GLU A 132 -13.400 5.457 -14.227 1.00 0.00 C ATOM 1897 CG GLU A 132 -13.074 6.522 -15.282 1.00 0.00 C ATOM 1898 CD GLU A 132 -11.735 7.201 -14.993 1.00 0.00 C ATOM 1899 OE1 GLU A 132 -11.592 7.682 -13.847 1.00 0.00 O ATOM 1900 OE2 GLU A 132 -10.869 7.178 -15.897 1.00 0.00 O ATOM 0 H GLU A 132 -13.524 3.706 -15.962 1.00 0.00 H new ATOM 0 HA GLU A 132 -11.435 4.686 -14.626 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -14.413 5.085 -14.378 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -13.369 5.901 -13.232 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -13.045 6.061 -16.269 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -13.866 7.270 -15.303 1.00 0.00 H new ATOM 1907 N GLN A 133 -13.187 3.049 -12.326 1.00 0.00 N ATOM 1908 CA GLN A 133 -13.053 2.430 -11.009 1.00 0.00 C ATOM 1909 C GLN A 133 -11.761 1.588 -10.891 1.00 0.00 C ATOM 1910 O GLN A 133 -10.901 1.955 -10.106 1.00 0.00 O ATOM 1911 CB GLN A 133 -14.349 1.702 -10.610 1.00 0.00 C ATOM 1912 CG GLN A 133 -14.753 1.979 -9.155 1.00 0.00 C ATOM 1913 CD GLN A 133 -13.689 1.624 -8.140 1.00 0.00 C ATOM 1914 OE1 GLN A 133 -13.394 2.397 -7.233 1.00 0.00 O ATOM 1915 NE2 GLN A 133 -13.068 0.473 -8.325 1.00 0.00 N ATOM 0 H GLN A 133 -14.121 2.970 -12.727 1.00 0.00 H new ATOM 0 HA GLN A 133 -12.923 3.214 -10.263 1.00 0.00 H new ATOM 0 HB2 GLN A 133 -15.156 2.013 -11.274 1.00 0.00 H new ATOM 0 HB3 GLN A 133 -14.217 0.629 -10.749 1.00 0.00 H new ATOM 0 HG2 GLN A 133 -14.999 3.036 -9.053 1.00 0.00 H new ATOM 0 HG3 GLN A 133 -15.659 1.417 -8.927 1.00 0.00 H new ATOM 0 HE21 GLN A 133 -13.346 -0.139 -9.092 1.00 0.00 H new ATOM 0 HE22 GLN A 133 -12.310 0.196 -7.701 1.00 0.00 H new ATOM 1924 N SER A 134 -11.575 0.501 -11.647 1.00 0.00 N ATOM 1925 CA SER A 134 -10.309 -0.213 -11.824 1.00 0.00 C ATOM 1926 C SER A 134 -9.140 0.732 -12.105 1.00 0.00 C ATOM 1927 O SER A 134 -8.179 0.782 -11.348 1.00 0.00 O ATOM 1928 CB SER A 134 -10.402 -1.283 -12.928 1.00 0.00 C ATOM 1929 OG SER A 134 -9.172 -1.988 -12.985 1.00 0.00 O ATOM 0 H SER A 134 -12.338 0.077 -12.175 1.00 0.00 H new ATOM 0 HA SER A 134 -10.114 -0.713 -10.875 1.00 0.00 H new ATOM 0 HB2 SER A 134 -11.222 -1.970 -12.720 1.00 0.00 H new ATOM 0 HB3 SER A 134 -10.614 -0.816 -13.890 1.00 0.00 H new ATOM 0 HG SER A 134 -9.348 -2.951 -13.017 1.00 0.00 H new ATOM 1935 N THR A 135 -9.213 1.507 -13.175 1.00 0.00 N ATOM 1936 CA THR A 135 -8.110 2.314 -13.667 1.00 0.00 C ATOM 1937 C THR A 135 -7.799 3.506 -12.733 1.00 0.00 C ATOM 1938 O THR A 135 -6.836 4.241 -12.953 1.00 0.00 O ATOM 1939 CB THR A 135 -8.408 2.652 -15.135 1.00 0.00 C ATOM 1940 OG1 THR A 135 -8.776 1.456 -15.809 1.00 0.00 O ATOM 1941 CG2 THR A 135 -7.194 3.234 -15.853 1.00 0.00 C ATOM 0 H THR A 135 -10.060 1.594 -13.737 1.00 0.00 H new ATOM 0 HA THR A 135 -7.167 1.768 -13.651 1.00 0.00 H new ATOM 0 HB THR A 135 -9.206 3.395 -15.147 1.00 0.00 H new ATOM 0 HG1 THR A 135 -8.022 0.830 -15.800 1.00 0.00 H new ATOM 0 HG21 THR A 135 -7.455 3.456 -16.888 1.00 0.00 H new ATOM 0 HG22 THR A 135 -6.880 4.150 -15.353 1.00 0.00 H new ATOM 0 HG23 THR A 135 -6.378 2.512 -15.832 1.00 0.00 H new ATOM 1949 N LYS A 136 -8.563 3.638 -11.643 1.00 0.00 N ATOM 1950 CA LYS A 136 -8.408 4.554 -10.533 1.00 0.00 C ATOM 1951 C LYS A 136 -8.062 3.803 -9.241 1.00 0.00 C ATOM 1952 O LYS A 136 -7.352 4.371 -8.411 1.00 0.00 O ATOM 1953 CB LYS A 136 -9.736 5.299 -10.372 1.00 0.00 C ATOM 1954 CG LYS A 136 -9.720 6.381 -9.290 1.00 0.00 C ATOM 1955 CD LYS A 136 -11.103 7.039 -9.192 1.00 0.00 C ATOM 1956 CE LYS A 136 -12.148 6.141 -8.502 1.00 0.00 C ATOM 1957 NZ LYS A 136 -13.476 6.792 -8.489 1.00 0.00 N ATOM 0 H LYS A 136 -9.382 3.043 -11.514 1.00 0.00 H new ATOM 0 HA LYS A 136 -7.591 5.248 -10.730 1.00 0.00 H new ATOM 0 HB2 LYS A 136 -10.001 5.757 -11.325 1.00 0.00 H new ATOM 0 HB3 LYS A 136 -10.519 4.577 -10.137 1.00 0.00 H new ATOM 0 HG2 LYS A 136 -9.446 5.944 -8.330 1.00 0.00 H new ATOM 0 HG3 LYS A 136 -8.966 7.132 -9.525 1.00 0.00 H new ATOM 0 HD2 LYS A 136 -11.016 7.975 -8.641 1.00 0.00 H new ATOM 0 HD3 LYS A 136 -11.452 7.290 -10.194 1.00 0.00 H new ATOM 0 HE2 LYS A 136 -12.212 5.185 -9.022 1.00 0.00 H new ATOM 0 HE3 LYS A 136 -11.833 5.928 -7.481 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 -14.164 6.169 -8.019 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 -13.416 7.693 -7.973 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 -13.784 6.973 -9.466 1.00 0.00 H new ATOM 1971 N THR A 137 -8.585 2.585 -9.019 1.00 0.00 N ATOM 1972 CA THR A 137 -8.416 1.921 -7.705 1.00 0.00 C ATOM 1973 C THR A 137 -7.859 0.500 -7.771 1.00 0.00 C ATOM 1974 O THR A 137 -7.307 -0.006 -6.793 1.00 0.00 O ATOM 1975 CB THR A 137 -9.717 1.879 -6.905 1.00 0.00 C ATOM 1976 OG1 THR A 137 -10.608 1.027 -7.576 1.00 0.00 O ATOM 1977 CG2 THR A 137 -10.328 3.271 -6.715 1.00 0.00 C ATOM 0 H THR A 137 -9.114 2.049 -9.707 1.00 0.00 H new ATOM 0 HA THR A 137 -7.677 2.548 -7.205 1.00 0.00 H new ATOM 0 HB THR A 137 -9.509 1.503 -5.903 1.00 0.00 H new ATOM 0 HG1 THR A 137 -10.794 1.386 -8.469 1.00 0.00 H new ATOM 0 HG21 THR A 137 -11.251 3.188 -6.141 1.00 0.00 H new ATOM 0 HG22 THR A 137 -9.623 3.908 -6.180 1.00 0.00 H new ATOM 0 HG23 THR A 137 -10.545 3.709 -7.689 1.00 0.00 H new ATOM 1985 N GLY A 138 -8.088 -0.168 -8.892 1.00 0.00 N ATOM 1986 CA GLY A 138 -7.749 -1.547 -9.129 1.00 0.00 C ATOM 1987 C GLY A 138 -8.961 -2.427 -8.903 1.00 0.00 C ATOM 1988 O GLY A 138 -8.797 -3.639 -8.863 1.00 0.00 O ATOM 0 H GLY A 138 -8.539 0.268 -9.697 1.00 0.00 H new ATOM 0 HA2 GLY A 138 -7.386 -1.670 -10.149 1.00 0.00 H new ATOM 0 HA3 GLY A 138 -6.940 -1.850 -8.464 1.00 0.00 H new ATOM 1992 N ASN A 139 -10.167 -1.858 -8.729 1.00 0.00 N ATOM 1993 CA ASN A 139 -11.353 -2.670 -8.515 1.00 0.00 C ATOM 1994 C ASN A 139 -11.117 -3.649 -7.362 1.00 0.00 C ATOM 1995 O ASN A 139 -11.647 -4.758 -7.332 1.00 0.00 O ATOM 1996 CB ASN A 139 -11.751 -3.384 -9.815 1.00 0.00 C ATOM 1997 CG ASN A 139 -13.241 -3.706 -9.857 1.00 0.00 C ATOM 1998 OD1 ASN A 139 -13.994 -3.038 -10.557 1.00 0.00 O ATOM 1999 ND2 ASN A 139 -13.682 -4.706 -9.104 1.00 0.00 N ATOM 0 H ASN A 139 -10.334 -0.852 -8.734 1.00 0.00 H new ATOM 0 HA ASN A 139 -12.188 -2.029 -8.232 1.00 0.00 H new ATOM 0 HB2 ASN A 139 -11.492 -2.756 -10.667 1.00 0.00 H new ATOM 0 HB3 ASN A 139 -11.178 -4.306 -9.912 1.00 0.00 H new ATOM 0 HD21 ASN A 139 -14.675 -4.939 -9.096 1.00 0.00 H new ATOM 0 HD22 ASN A 139 -13.028 -5.242 -8.533 1.00 0.00 H new ATOM 2006 N ALA A 140 -10.292 -3.219 -6.403 1.00 0.00 N ATOM 2007 CA ALA A 140 -9.782 -4.076 -5.353 1.00 0.00 C ATOM 2008 C ALA A 140 -10.858 -4.323 -4.297 1.00 0.00 C ATOM 2009 O ALA A 140 -10.619 -5.012 -3.310 1.00 0.00 O ATOM 2010 CB ALA A 140 -8.534 -3.417 -4.768 1.00 0.00 C ATOM 0 H ALA A 140 -9.962 -2.256 -6.342 1.00 0.00 H new ATOM 0 HA ALA A 140 -9.510 -5.054 -5.749 1.00 0.00 H new ATOM 0 HB1 ALA A 140 -8.130 -4.044 -3.973 1.00 0.00 H new ATOM 0 HB2 ALA A 140 -7.785 -3.296 -5.551 1.00 0.00 H new ATOM 0 HB3 ALA A 140 -8.795 -2.440 -4.362 1.00 0.00 H new ATOM 2016 N GLY A 141 -12.046 -3.748 -4.482 1.00 0.00 N ATOM 2017 CA GLY A 141 -13.134 -3.905 -3.552 1.00 0.00 C ATOM 2018 C GLY A 141 -12.881 -3.051 -2.319 1.00 0.00 C ATOM 2019 O GLY A 141 -12.011 -2.167 -2.302 1.00 0.00 O ATOM 0 H GLY A 141 -12.269 -3.162 -5.286 1.00 0.00 H new ATOM 0 HA2 GLY A 141 -14.073 -3.612 -4.023 1.00 0.00 H new ATOM 0 HA3 GLY A 141 -13.233 -4.952 -3.267 1.00 0.00 H new ATOM 2023 N SER A 142 -13.697 -3.297 -1.296 1.00 0.00 N ATOM 2024 CA SER A 142 -13.737 -2.430 -0.143 1.00 0.00 C ATOM 2025 C SER A 142 -12.416 -2.445 0.617 1.00 0.00 C ATOM 2026 O SER A 142 -11.557 -3.306 0.421 1.00 0.00 O ATOM 2027 CB SER A 142 -14.917 -2.775 0.765 1.00 0.00 C ATOM 2028 OG SER A 142 -15.151 -1.670 1.622 1.00 0.00 O ATOM 0 H SER A 142 -14.335 -4.092 -1.251 1.00 0.00 H new ATOM 0 HA SER A 142 -13.886 -1.411 -0.501 1.00 0.00 H new ATOM 0 HB2 SER A 142 -15.805 -2.990 0.170 1.00 0.00 H new ATOM 0 HB3 SER A 142 -14.700 -3.670 1.348 1.00 0.00 H new ATOM 0 HG SER A 142 -15.907 -1.869 2.213 1.00 0.00 H new ATOM 2034 N ARG A 143 -12.283 -1.441 1.474 1.00 0.00 N ATOM 2035 CA ARG A 143 -11.147 -1.229 2.339 1.00 0.00 C ATOM 2036 C ARG A 143 -11.291 -2.168 3.537 1.00 0.00 C ATOM 2037 O ARG A 143 -12.222 -2.006 4.322 1.00 0.00 O ATOM 2038 CB ARG A 143 -11.124 0.234 2.808 1.00 0.00 C ATOM 2039 CG ARG A 143 -11.010 1.300 1.703 1.00 0.00 C ATOM 2040 CD ARG A 143 -12.288 1.554 0.891 1.00 0.00 C ATOM 2041 NE ARG A 143 -12.268 2.902 0.292 1.00 0.00 N ATOM 2042 CZ ARG A 143 -13.233 3.415 -0.489 1.00 0.00 C ATOM 2043 NH1 ARG A 143 -14.299 2.671 -0.803 1.00 0.00 N ATOM 2044 NH2 ARG A 143 -13.133 4.667 -0.947 1.00 0.00 N ATOM 0 H ARG A 143 -13.000 -0.724 1.584 1.00 0.00 H new ATOM 0 HA ARG A 143 -10.215 -1.435 1.812 1.00 0.00 H new ATOM 0 HB2 ARG A 143 -12.034 0.426 3.377 1.00 0.00 H new ATOM 0 HB3 ARG A 143 -10.287 0.361 3.494 1.00 0.00 H new ATOM 0 HG2 ARG A 143 -10.699 2.239 2.160 1.00 0.00 H new ATOM 0 HG3 ARG A 143 -10.218 1.002 1.016 1.00 0.00 H new ATOM 0 HD2 ARG A 143 -12.381 0.804 0.106 1.00 0.00 H new ATOM 0 HD3 ARG A 143 -13.161 1.450 1.536 1.00 0.00 H new ATOM 0 HE ARG A 143 -11.458 3.491 0.486 1.00 0.00 H new ATOM 0 HH11 ARG A 143 -14.377 1.717 -0.450 1.00 0.00 H new ATOM 0 HH12 ARG A 143 -15.034 3.057 -1.396 1.00 0.00 H new ATOM 0 HH21 ARG A 143 -12.322 5.236 -0.704 1.00 0.00 H new ATOM 0 HH22 ARG A 143 -13.868 5.053 -1.540 1.00 0.00 H new ATOM 2058 N LEU A 144 -10.391 -3.142 3.690 1.00 0.00 N ATOM 2059 CA LEU A 144 -10.406 -4.007 4.870 1.00 0.00 C ATOM 2060 C LEU A 144 -9.846 -3.249 6.077 1.00 0.00 C ATOM 2061 O LEU A 144 -10.309 -3.463 7.195 1.00 0.00 O ATOM 2062 CB LEU A 144 -9.638 -5.323 4.640 1.00 0.00 C ATOM 2063 CG LEU A 144 -10.411 -6.482 3.971 1.00 0.00 C ATOM 2064 CD1 LEU A 144 -11.118 -7.329 5.038 1.00 0.00 C ATOM 2065 CD2 LEU A 144 -11.469 -5.995 2.977 1.00 0.00 C ATOM 0 H LEU A 144 -9.651 -3.350 3.020 1.00 0.00 H new ATOM 0 HA LEU A 144 -11.442 -4.282 5.068 1.00 0.00 H new ATOM 0 HB2 LEU A 144 -8.764 -5.102 4.028 1.00 0.00 H new ATOM 0 HB3 LEU A 144 -9.271 -5.674 5.605 1.00 0.00 H new ATOM 0 HG LEU A 144 -9.671 -7.069 3.427 1.00 0.00 H new ATOM 0 HD11 LEU A 144 -11.660 -8.143 4.556 1.00 0.00 H new ATOM 0 HD12 LEU A 144 -10.378 -7.742 5.724 1.00 0.00 H new ATOM 0 HD13 LEU A 144 -11.819 -6.705 5.592 1.00 0.00 H new ATOM 0 HD21 LEU A 144 -11.979 -6.853 2.539 1.00 0.00 H new ATOM 0 HD22 LEU A 144 -12.194 -5.368 3.496 1.00 0.00 H new ATOM 0 HD23 LEU A 144 -10.988 -5.417 2.188 1.00 0.00 H new ATOM 2077 N ALA A 145 -8.850 -2.376 5.871 1.00 0.00 N ATOM 2078 CA ALA A 145 -8.267 -1.570 6.936 1.00 0.00 C ATOM 2079 C ALA A 145 -7.580 -0.336 6.356 1.00 0.00 C ATOM 2080 O ALA A 145 -7.219 -0.324 5.178 1.00 0.00 O ATOM 2081 CB ALA A 145 -7.296 -2.409 7.774 1.00 0.00 C ATOM 0 H ALA A 145 -8.430 -2.214 4.956 1.00 0.00 H new ATOM 0 HA ALA A 145 -9.065 -1.229 7.595 1.00 0.00 H new ATOM 0 HB1 ALA A 145 -6.870 -1.791 8.565 1.00 0.00 H new ATOM 0 HB2 ALA A 145 -7.831 -3.249 8.218 1.00 0.00 H new ATOM 0 HB3 ALA A 145 -6.496 -2.785 7.136 1.00 0.00 H new ATOM 2087 N CYS A 146 -7.422 0.691 7.194 1.00 0.00 N ATOM 2088 CA CYS A 146 -6.955 2.030 6.869 1.00 0.00 C ATOM 2089 C CYS A 146 -5.983 2.438 7.978 1.00 0.00 C ATOM 2090 O CYS A 146 -6.165 2.031 9.125 1.00 0.00 O ATOM 2091 CB CYS A 146 -8.148 3.013 6.740 1.00 0.00 C ATOM 2092 SG CYS A 146 -9.780 2.489 7.364 1.00 0.00 S ATOM 0 H CYS A 146 -7.634 0.596 8.187 1.00 0.00 H new ATOM 0 HA CYS A 146 -6.448 2.052 5.904 1.00 0.00 H new ATOM 0 HB2 CYS A 146 -7.876 3.934 7.256 1.00 0.00 H new ATOM 0 HB3 CYS A 146 -8.261 3.261 5.684 1.00 0.00 H new ATOM 2097 N GLY A 147 -4.916 3.177 7.655 1.00 0.00 N ATOM 2098 CA GLY A 147 -3.976 3.648 8.667 1.00 0.00 C ATOM 2099 C GLY A 147 -3.151 4.849 8.205 1.00 0.00 C ATOM 2100 O GLY A 147 -2.580 4.835 7.111 1.00 0.00 O ATOM 0 H GLY A 147 -4.686 3.459 6.702 1.00 0.00 H new ATOM 0 HA2 GLY A 147 -4.526 3.918 9.568 1.00 0.00 H new ATOM 0 HA3 GLY A 147 -3.303 2.834 8.936 1.00 0.00 H new ATOM 2104 N VAL A 148 -3.079 5.873 9.062 1.00 0.00 N ATOM 2105 CA VAL A 148 -2.287 7.076 8.847 1.00 0.00 C ATOM 2106 C VAL A 148 -0.798 6.792 9.061 1.00 0.00 C ATOM 2107 O VAL A 148 -0.428 5.987 9.916 1.00 0.00 O ATOM 2108 CB VAL A 148 -2.823 8.239 9.707 1.00 0.00 C ATOM 2109 CG1 VAL A 148 -2.797 7.953 11.215 1.00 0.00 C ATOM 2110 CG2 VAL A 148 -2.048 9.534 9.435 1.00 0.00 C ATOM 0 H VAL A 148 -3.586 5.882 9.947 1.00 0.00 H new ATOM 0 HA VAL A 148 -2.387 7.393 7.809 1.00 0.00 H new ATOM 0 HB VAL A 148 -3.866 8.354 9.410 1.00 0.00 H new ATOM 0 HG11 VAL A 148 -3.188 8.815 11.756 1.00 0.00 H new ATOM 0 HG12 VAL A 148 -3.413 7.080 11.430 1.00 0.00 H new ATOM 0 HG13 VAL A 148 -1.772 7.761 11.531 1.00 0.00 H new ATOM 0 HG21 VAL A 148 -2.449 10.335 10.056 1.00 0.00 H new ATOM 0 HG22 VAL A 148 -0.995 9.384 9.672 1.00 0.00 H new ATOM 0 HG23 VAL A 148 -2.149 9.804 8.384 1.00 0.00 H new ATOM 2120 N ILE A 149 0.050 7.445 8.263 1.00 0.00 N ATOM 2121 CA ILE A 149 1.498 7.309 8.271 1.00 0.00 C ATOM 2122 C ILE A 149 2.095 8.432 9.127 1.00 0.00 C ATOM 2123 O ILE A 149 1.838 9.608 8.856 1.00 0.00 O ATOM 2124 CB ILE A 149 2.008 7.370 6.817 1.00 0.00 C ATOM 2125 CG1 ILE A 149 1.446 6.228 5.945 1.00 0.00 C ATOM 2126 CG2 ILE A 149 3.541 7.309 6.799 1.00 0.00 C ATOM 2127 CD1 ILE A 149 1.403 6.593 4.461 1.00 0.00 C ATOM 0 H ILE A 149 -0.275 8.112 7.563 1.00 0.00 H new ATOM 0 HA ILE A 149 1.802 6.355 8.701 1.00 0.00 H new ATOM 0 HB ILE A 149 1.658 8.313 6.396 1.00 0.00 H new ATOM 0 HG12 ILE A 149 2.059 5.337 6.079 1.00 0.00 H new ATOM 0 HG13 ILE A 149 0.441 5.977 6.284 1.00 0.00 H new ATOM 0 HG21 ILE A 149 3.895 7.352 5.769 1.00 0.00 H new ATOM 0 HG22 ILE A 149 3.945 8.153 7.358 1.00 0.00 H new ATOM 0 HG23 ILE A 149 3.873 6.378 7.258 1.00 0.00 H new ATOM 0 HD11 ILE A 149 1.000 5.755 3.892 1.00 0.00 H new ATOM 0 HD12 ILE A 149 0.768 7.467 4.320 1.00 0.00 H new ATOM 0 HD13 ILE A 149 2.411 6.817 4.112 1.00 0.00 H new ATOM 2139 N GLY A 150 2.905 8.086 10.135 1.00 0.00 N ATOM 2140 CA GLY A 150 3.509 9.014 11.077 1.00 0.00 C ATOM 2141 C GLY A 150 4.951 8.593 11.351 1.00 0.00 C ATOM 2142 O GLY A 150 5.381 7.521 10.933 1.00 0.00 O ATOM 0 H GLY A 150 3.162 7.116 10.317 1.00 0.00 H new ATOM 0 HA2 GLY A 150 3.485 10.026 10.673 1.00 0.00 H new ATOM 0 HA3 GLY A 150 2.940 9.028 12.006 1.00 0.00 H new ATOM 2146 N ILE A 151 5.715 9.451 12.022 1.00 0.00 N ATOM 2147 CA ILE A 151 7.102 9.209 12.372 1.00 0.00 C ATOM 2148 C ILE A 151 7.168 8.039 13.356 1.00 0.00 C ATOM 2149 O ILE A 151 6.333 7.926 14.252 1.00 0.00 O ATOM 2150 CB ILE A 151 7.710 10.492 12.961 1.00 0.00 C ATOM 2151 CG1 ILE A 151 7.496 11.684 12.007 1.00 0.00 C ATOM 2152 CG2 ILE A 151 9.210 10.312 13.235 1.00 0.00 C ATOM 2153 CD1 ILE A 151 6.602 12.757 12.635 1.00 0.00 C ATOM 0 H ILE A 151 5.372 10.356 12.343 1.00 0.00 H new ATOM 0 HA ILE A 151 7.684 8.943 11.489 1.00 0.00 H new ATOM 0 HB ILE A 151 7.203 10.697 13.904 1.00 0.00 H new ATOM 0 HG12 ILE A 151 8.461 12.120 11.747 1.00 0.00 H new ATOM 0 HG13 ILE A 151 7.045 11.332 11.079 1.00 0.00 H new ATOM 0 HG21 ILE A 151 9.617 11.233 13.651 1.00 0.00 H new ATOM 0 HG22 ILE A 151 9.355 9.498 13.945 1.00 0.00 H new ATOM 0 HG23 ILE A 151 9.724 10.077 12.303 1.00 0.00 H new ATOM 0 HD11 ILE A 151 6.474 13.581 11.933 1.00 0.00 H new ATOM 0 HD12 ILE A 151 5.629 12.327 12.871 1.00 0.00 H new ATOM 0 HD13 ILE A 151 7.066 13.128 13.549 1.00 0.00 H new ATOM 2165 N ALA A 152 8.154 7.161 13.172 1.00 0.00 N ATOM 2166 CA ALA A 152 8.356 6.000 14.029 1.00 0.00 C ATOM 2167 C ALA A 152 9.232 6.343 15.217 1.00 0.00 C ATOM 2168 O ALA A 152 10.121 7.186 15.110 1.00 0.00 O ATOM 2169 CB ALA A 152 8.962 4.854 13.219 1.00 0.00 C ATOM 0 H ALA A 152 8.837 7.239 12.419 1.00 0.00 H new ATOM 0 HA ALA A 152 7.388 5.683 14.416 1.00 0.00 H new ATOM 0 HB1 ALA A 152 9.110 3.990 13.866 1.00 0.00 H new ATOM 0 HB2 ALA A 152 8.287 4.587 12.406 1.00 0.00 H new ATOM 0 HB3 ALA A 152 9.921 5.167 12.807 1.00 0.00 H new ATOM 2175 N GLN A 153 8.983 5.653 16.331 1.00 0.00 N ATOM 2176 CA GLN A 153 9.891 5.674 17.456 1.00 0.00 C ATOM 2177 C GLN A 153 11.155 4.903 17.055 1.00 0.00 C ATOM 2178 O GLN A 153 12.284 5.312 17.406 1.00 0.00 O ATOM 2179 CB GLN A 153 9.230 5.128 18.732 1.00 0.00 C ATOM 2180 CG GLN A 153 8.856 3.641 18.656 1.00 0.00 C ATOM 2181 CD GLN A 153 8.307 3.134 19.987 1.00 0.00 C ATOM 2182 OE1 GLN A 153 8.940 3.283 21.028 1.00 0.00 O ATOM 2183 NE2 GLN A 153 7.126 2.520 19.984 1.00 0.00 N ATOM 2184 OXT GLN A 153 11.050 3.918 16.289 1.00 0.00 O ATOM 0 H GLN A 153 8.155 5.074 16.469 1.00 0.00 H new ATOM 0 HA GLN A 153 10.166 6.700 17.702 1.00 0.00 H new ATOM 0 HB2 GLN A 153 9.907 5.279 19.573 1.00 0.00 H new ATOM 0 HB3 GLN A 153 8.331 5.708 18.939 1.00 0.00 H new ATOM 0 HG2 GLN A 153 8.112 3.491 17.874 1.00 0.00 H new ATOM 0 HG3 GLN A 153 9.734 3.058 18.377 1.00 0.00 H new ATOM 0 HE21 GLN A 153 6.613 2.405 19.110 1.00 0.00 H new ATOM 0 HE22 GLN A 153 6.734 2.165 20.856 1.00 0.00 H new TER 2193 GLN A 153 HETATM 2194 ZN ZN A 154 -3.190 3.198 -8.268 1.00 0.00 ZN HETATM 2195 CU CU1 A 155 -6.102 1.611 -1.793 1.00 0.00 CU