USER MOD reduce.3.24.130724 H: found=0, std=0, add=1380, rem=0, adj=46 USER MOD reduce.3.24.130724 removed 1376 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 69 TYR OH : rot 110:sc= 0.557 USER MOD Set 1.2: A 70 GLN : amide:sc= -0.678! K(o=-0.12!,f=0.47) USER MOD Set 2.1: A 8 SER OG : rot 53:sc= 0.62 USER MOD Set 2.2: A 10 TYR OH : rot 180:sc= 0 USER MOD Single : A 1 SER N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 THR OG1 : rot 180:sc= -0.171 USER MOD Single : A 6 LYS NZ :NH3+ -146:sc= 0.897 (180deg=0.0413) USER MOD Single : A 14 ASN : amide:sc= -0.288 X(o=-0.29,f=-0.29) USER MOD Single : A 16 GLN : amide:sc= -0.256 X(o=-0.26,f=-0.16) USER MOD Single : A 20 TYR OH : rot 180:sc= 0 USER MOD Single : A 22 CYS SG : rot -97:sc= 1.03 USER MOD Single : A 24 CYS SG : rot 180:sc= 0 USER MOD Single : A 26 CYS SG : rot -159:sc= -0.743! USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 36 CYS SG : rot 5:sc= -2.78! USER MOD Single : A 37 ASN : amide:sc= -1 K(o=-1,f=-0.38!) USER MOD Single : A 38 SER OG : rot 60:sc= 0.463 USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 TYR OH : rot -111:sc= 1.01 USER MOD Single : A 53 ASN : amide:sc= -0.129 X(o=-0.13,f=-0.23) USER MOD Single : A 55 SER OG : rot 47:sc= 0.0757 USER MOD Single : A 57 HIS : no HD1:sc= -2.38 K(o=-2.4,f=-0.19) USER MOD Single : A 58 MET CE :methyl 177:sc= 0 (180deg=-0.0111) USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 GLN : amide:sc= 0 X(o=0,f=-0.0037) USER MOD Single : A 66 TYR OH : rot 180:sc= -0.174 USER MOD Single : A 73 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 76 ASN : amide:sc= -3.06! C(o=-3.1!,f=-4.1!) USER MOD Single : A 81 SER OG : rot -91:sc= -0.118 USER MOD Single : A 82 CYS SG : rot 19:sc= 0.302 USER MOD Single : A 86 HIS : no HD1:sc= -0.154 X(o=-0.15,f=-0.0021) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 89 SER OG : rot 180:sc= 0.215 USER MOD Single : A 92 GLN : amide:sc= -0.543 K(o=-0.54,f=-2.1!) USER MOD Single : A 94 LYS NZ :NH3+ 137:sc= -3.97! (180deg=-6.77!) USER MOD Single : A 96 GLN : amide:sc= -3.81 X(o=-3.8,f=-3.3) USER MOD Single : A 100 LYS NZ :NH3+ -158:sc= -0.0227 (180deg=-0.333) USER MOD Single : A 104 ASN : amide:sc= -2.11! C(o=-2.1!,f=-4.4!) USER MOD Single : A 106 GLN : amide:sc= -0.119 X(o=-0.12,f=-0.12) USER MOD Single : A 107 MET CE :methyl 148:sc= -0.304 (180deg=-1.52!) USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 110 THR OG1 : rot 180:sc= 0.227 USER MOD Single : A 111 THR OG1 : rot 180:sc= 0 USER MOD Single : A 114 CYS SG : rot -103:sc= -12.4! USER MOD Single : A 116 SER OG : rot -177:sc= 1.18 USER MOD Single : A 118 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 120 GLN : amide:sc= -2.65! C(o=-2.6!,f=-4.2!) USER MOD Single : A 122 HIS : no HD1:sc= -2.15! C(o=-2.1!,f=-3.9!) USER MOD Single : A 127 HIS : no HD1:sc= -0.103 X(o=-0.1,f=-0.016) USER MOD Single : A 128 SER OG : rot 134:sc= -0.198 USER MOD Single : A 129 CYS SG : rot 41:sc= -0.718 USER MOD Single : A 130 LYS NZ :NH3+ 148:sc= -0.328 (180deg=-1.36!) USER MOD Single : A 135 THR OG1 : rot 180:sc= -0.542 USER MOD Single : A 139 TYR OH : rot 180:sc= 0 USER MOD Single : A 143 ASN : amide:sc= -0.348 K(o=-0.35,f=-0.89) USER MOD Single : A 144 TYR OH : rot 180:sc= 0 USER MOD Single : A 148 GLN : amide:sc= -5.38! C(o=-5.4!,f=-3.4!) USER MOD Single : A 149 TYR OH : rot 165:sc=-0.000585 USER MOD Single : A 153 LYS NZ :NH3+ -166:sc= -5.6! (180deg=-6.25!) USER MOD Single : A 154 LYS NZ :NH3+ -104:sc= -1.18 (180deg=-2.05!) USER MOD Single : A 156 TYR OH : rot 180:sc= -0.547 USER MOD Single : A 158 LYS NZ :NH3+ -158:sc= -0.0424 (180deg=-0.583) USER MOD Single : A 166 SER OG : rot 180:sc= -0.576 USER MOD Single : A 170 GLN : amide:sc= -0.04 K(o=-0.04,f=-2.2!) USER MOD Single : A 171 SER OG : rot -127:sc= -0.671 USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 23.415 -19.582 5.332 1.00 4.50 N ATOM 2 CA SER A 1 22.507 -18.405 5.226 1.00 4.52 C ATOM 3 C SER A 1 21.084 -18.882 4.928 1.00 3.57 C ATOM 4 O SER A 1 20.854 -19.653 4.017 1.00 3.03 O ATOM 5 CB SER A 1 22.988 -17.492 4.097 1.00 4.81 C ATOM 6 OG SER A 1 22.183 -16.320 4.065 1.00 5.28 O ATOM 0 H1 SER A 1 24.382 -19.257 5.535 1.00 4.50 H new ATOM 0 H2 SER A 1 23.090 -20.203 6.100 1.00 4.50 H new ATOM 0 H3 SER A 1 23.407 -20.108 4.435 1.00 4.50 H new ATOM 0 HA SER A 1 22.514 -17.854 6.167 1.00 4.52 H new ATOM 0 HB2 SER A 1 24.034 -17.225 4.250 1.00 4.81 H new ATOM 0 HB3 SER A 1 22.929 -18.014 3.142 1.00 4.81 H new ATOM 0 HG SER A 1 22.490 -15.732 3.344 1.00 5.28 H new ATOM 14 N LYS A 2 20.124 -18.427 5.689 1.00 3.60 N ATOM 15 CA LYS A 2 18.717 -18.853 5.451 1.00 3.08 C ATOM 16 C LYS A 2 18.222 -18.266 4.127 1.00 2.11 C ATOM 17 O LYS A 2 18.693 -18.647 3.075 1.00 2.12 O ATOM 18 CB LYS A 2 17.833 -18.353 6.597 1.00 3.28 C ATOM 19 CG LYS A 2 18.315 -18.962 7.915 1.00 3.95 C ATOM 20 CD LYS A 2 17.441 -18.453 9.063 1.00 4.66 C ATOM 21 CE LYS A 2 17.702 -19.293 10.315 1.00 5.66 C ATOM 22 NZ LYS A 2 17.112 -18.612 11.502 1.00 5.96 N ATOM 0 H LYS A 2 20.255 -17.778 6.465 1.00 3.60 H new ATOM 0 HA LYS A 2 18.669 -19.941 5.404 1.00 3.08 H new ATOM 0 HB2 LYS A 2 17.870 -17.265 6.651 1.00 3.28 H new ATOM 0 HB3 LYS A 2 16.794 -18.628 6.416 1.00 3.28 H new ATOM 0 HG2 LYS A 2 18.269 -20.050 7.864 1.00 3.95 H new ATOM 0 HG3 LYS A 2 19.357 -18.695 8.091 1.00 3.95 H new ATOM 0 HD2 LYS A 2 17.660 -17.404 9.264 1.00 4.66 H new ATOM 0 HD3 LYS A 2 16.388 -18.511 8.786 1.00 4.66 H new ATOM 0 HE2 LYS A 2 17.266 -20.285 10.198 1.00 5.66 H new ATOM 0 HE3 LYS A 2 18.774 -19.430 10.457 1.00 5.66 H new ATOM 0 HZ1 LYS A 2 17.289 -19.183 12.353 1.00 5.96 H new ATOM 0 HZ2 LYS A 2 17.548 -17.675 11.617 1.00 5.96 H new ATOM 0 HZ3 LYS A 2 16.087 -18.503 11.366 1.00 5.96 H new ATOM 36 N THR A 3 17.284 -17.357 4.137 1.00 1.72 N ATOM 37 CA THR A 3 16.794 -16.790 2.849 1.00 1.18 C ATOM 38 C THR A 3 15.790 -15.676 3.155 1.00 1.02 C ATOM 39 O THR A 3 15.220 -15.623 4.226 1.00 1.63 O ATOM 40 CB THR A 3 16.062 -17.873 2.055 1.00 1.48 C ATOM 41 OG1 THR A 3 15.279 -17.264 1.037 1.00 2.13 O ATOM 42 CG2 THR A 3 15.153 -18.668 2.992 1.00 2.22 C ATOM 0 H THR A 3 16.839 -16.985 4.976 1.00 1.72 H new ATOM 0 HA THR A 3 17.640 -16.411 2.276 1.00 1.18 H new ATOM 0 HB THR A 3 16.790 -18.546 1.601 1.00 1.48 H new ATOM 0 HG1 THR A 3 14.811 -17.957 0.526 1.00 2.13 H new ATOM 0 HG21 THR A 3 14.632 -19.440 2.425 1.00 2.22 H new ATOM 0 HG22 THR A 3 15.754 -19.135 3.773 1.00 2.22 H new ATOM 0 HG23 THR A 3 14.424 -17.998 3.447 1.00 2.22 H new ATOM 50 N GLY A 4 15.564 -14.785 2.228 1.00 0.52 N ATOM 51 CA GLY A 4 14.589 -13.693 2.504 1.00 0.30 C ATOM 52 C GLY A 4 14.480 -12.722 1.326 1.00 0.41 C ATOM 53 O GLY A 4 15.160 -12.840 0.327 1.00 0.81 O ATOM 0 H GLY A 4 16.003 -14.765 1.308 1.00 0.52 H new ATOM 0 HA2 GLY A 4 13.610 -14.123 2.713 1.00 0.30 H new ATOM 0 HA3 GLY A 4 14.895 -13.149 3.397 1.00 0.30 H new ATOM 57 N GLY A 5 13.622 -11.748 1.470 1.00 0.01 N ATOM 58 CA GLY A 5 13.436 -10.727 0.400 1.00 0.01 C ATOM 59 C GLY A 5 14.589 -9.726 0.458 1.00 0.01 C ATOM 60 O GLY A 5 15.221 -9.555 1.482 1.00 0.01 O ATOM 0 H GLY A 5 13.035 -11.615 2.294 1.00 0.01 H new ATOM 0 HA2 GLY A 5 13.405 -11.208 -0.578 1.00 0.01 H new ATOM 0 HA3 GLY A 5 12.484 -10.212 0.533 1.00 0.01 H new ATOM 64 N LYS A 6 14.880 -9.066 -0.633 1.00 0.00 N ATOM 65 CA LYS A 6 16.007 -8.082 -0.632 1.00 0.01 C ATOM 66 C LYS A 6 15.713 -6.941 -1.607 1.00 0.01 C ATOM 67 O LYS A 6 15.278 -7.154 -2.727 1.00 0.00 O ATOM 68 CB LYS A 6 17.313 -8.784 -1.030 1.00 0.02 C ATOM 69 CG LYS A 6 18.416 -7.754 -1.303 1.00 0.02 C ATOM 70 CD LYS A 6 19.777 -8.458 -1.344 1.00 0.02 C ATOM 71 CE LYS A 6 20.799 -7.566 -2.057 1.00 0.02 C ATOM 72 NZ LYS A 6 22.177 -8.042 -1.745 1.00 0.02 N ATOM 0 H LYS A 6 14.389 -9.164 -1.522 1.00 0.00 H new ATOM 0 HA LYS A 6 16.113 -7.670 0.371 1.00 0.01 H new ATOM 0 HB2 LYS A 6 17.627 -9.459 -0.234 1.00 0.02 H new ATOM 0 HB3 LYS A 6 17.149 -9.394 -1.919 1.00 0.02 H new ATOM 0 HG2 LYS A 6 18.228 -7.247 -2.250 1.00 0.02 H new ATOM 0 HG3 LYS A 6 18.414 -6.989 -0.526 1.00 0.02 H new ATOM 0 HD2 LYS A 6 20.115 -8.676 -0.331 1.00 0.02 H new ATOM 0 HD3 LYS A 6 19.688 -9.412 -1.863 1.00 0.02 H new ATOM 0 HE2 LYS A 6 20.630 -7.589 -3.134 1.00 0.02 H new ATOM 0 HE3 LYS A 6 20.679 -6.531 -1.738 1.00 0.02 H new ATOM 0 HZ1 LYS A 6 22.823 -7.228 -1.697 1.00 0.02 H new ATOM 0 HZ2 LYS A 6 22.175 -8.537 -0.830 1.00 0.02 H new ATOM 0 HZ3 LYS A 6 22.496 -8.694 -2.490 1.00 0.02 H new ATOM 86 N ILE A 7 15.978 -5.727 -1.173 1.00 0.02 N ATOM 87 CA ILE A 7 15.755 -4.524 -2.034 1.00 0.00 C ATOM 88 C ILE A 7 17.017 -3.652 -2.019 1.00 0.02 C ATOM 89 O ILE A 7 17.652 -3.485 -0.995 1.00 0.01 O ATOM 90 CB ILE A 7 14.537 -3.748 -1.523 1.00 0.02 C ATOM 91 CG1 ILE A 7 14.440 -2.400 -2.245 1.00 0.02 C ATOM 92 CG2 ILE A 7 14.673 -3.512 -0.023 1.00 0.01 C ATOM 93 CD1 ILE A 7 13.096 -1.743 -1.919 1.00 0.02 C ATOM 0 H ILE A 7 16.345 -5.520 -0.244 1.00 0.02 H new ATOM 0 HA ILE A 7 15.557 -4.827 -3.062 1.00 0.00 H new ATOM 0 HB ILE A 7 13.635 -4.328 -1.720 1.00 0.02 H new ATOM 0 HG12 ILE A 7 15.259 -1.750 -1.937 1.00 0.02 H new ATOM 0 HG13 ILE A 7 14.535 -2.544 -3.321 1.00 0.02 H new ATOM 0 HG21 ILE A 7 13.806 -2.960 0.339 1.00 0.01 H new ATOM 0 HG22 ILE A 7 14.733 -4.471 0.492 1.00 0.01 H new ATOM 0 HG23 ILE A 7 15.577 -2.937 0.174 1.00 0.01 H new ATOM 0 HD11 ILE A 7 13.026 -0.784 -2.432 1.00 0.02 H new ATOM 0 HD12 ILE A 7 12.284 -2.391 -2.249 1.00 0.02 H new ATOM 0 HD13 ILE A 7 13.020 -1.585 -0.843 1.00 0.02 H new ATOM 105 N SER A 8 17.377 -3.089 -3.151 1.00 0.02 N ATOM 106 CA SER A 8 18.595 -2.212 -3.226 1.00 0.02 C ATOM 107 C SER A 8 18.200 -0.810 -3.702 1.00 0.01 C ATOM 108 O SER A 8 17.530 -0.651 -4.701 1.00 0.02 O ATOM 109 CB SER A 8 19.614 -2.806 -4.203 1.00 0.30 C ATOM 110 OG SER A 8 20.883 -2.206 -3.979 1.00 0.39 O ATOM 0 H SER A 8 16.876 -3.200 -4.033 1.00 0.02 H new ATOM 0 HA SER A 8 19.040 -2.150 -2.233 1.00 0.02 H new ATOM 0 HB2 SER A 8 19.680 -3.885 -4.066 1.00 0.30 H new ATOM 0 HB3 SER A 8 19.293 -2.634 -5.230 1.00 0.30 H new ATOM 0 HG SER A 8 21.121 -2.289 -3.032 1.00 0.39 H new ATOM 116 N PHE A 9 18.631 0.209 -2.992 1.00 0.02 N ATOM 117 CA PHE A 9 18.311 1.622 -3.386 1.00 0.01 C ATOM 118 C PHE A 9 19.590 2.310 -3.886 1.00 0.01 C ATOM 119 O PHE A 9 20.655 2.124 -3.326 1.00 0.02 O ATOM 120 CB PHE A 9 17.777 2.385 -2.166 1.00 0.02 C ATOM 121 CG PHE A 9 16.832 1.508 -1.379 1.00 0.01 C ATOM 122 CD1 PHE A 9 17.339 0.496 -0.559 1.00 0.01 C ATOM 123 CD2 PHE A 9 15.449 1.716 -1.462 1.00 0.01 C ATOM 124 CE1 PHE A 9 16.465 -0.312 0.177 1.00 0.02 C ATOM 125 CE2 PHE A 9 14.575 0.909 -0.724 1.00 0.02 C ATOM 126 CZ PHE A 9 15.083 -0.106 0.095 1.00 0.02 C ATOM 0 H PHE A 9 19.197 0.121 -2.148 1.00 0.02 H new ATOM 0 HA PHE A 9 17.559 1.618 -4.175 1.00 0.01 H new ATOM 0 HB2 PHE A 9 18.606 2.700 -1.533 1.00 0.02 H new ATOM 0 HB3 PHE A 9 17.262 3.289 -2.490 1.00 0.02 H new ATOM 0 HD1 PHE A 9 18.405 0.338 -0.493 1.00 0.01 H new ATOM 0 HD2 PHE A 9 15.057 2.499 -2.095 1.00 0.01 H new ATOM 0 HE1 PHE A 9 16.857 -1.095 0.809 1.00 0.02 H new ATOM 0 HE2 PHE A 9 13.509 1.070 -0.787 1.00 0.02 H new ATOM 0 HZ PHE A 9 14.409 -0.730 0.663 1.00 0.02 H new ATOM 136 N TYR A 10 19.500 3.099 -4.935 1.00 0.02 N ATOM 137 CA TYR A 10 20.712 3.798 -5.479 1.00 0.01 C ATOM 138 C TYR A 10 20.477 5.314 -5.462 1.00 0.02 C ATOM 139 O TYR A 10 19.396 5.799 -5.762 1.00 0.01 O ATOM 140 CB TYR A 10 20.955 3.353 -6.925 1.00 0.02 C ATOM 141 CG TYR A 10 20.911 1.841 -7.023 1.00 0.02 C ATOM 142 CD1 TYR A 10 19.689 1.162 -6.903 1.00 0.02 C ATOM 143 CD2 TYR A 10 22.091 1.118 -7.244 1.00 0.00 C ATOM 144 CE1 TYR A 10 19.651 -0.233 -7.004 1.00 0.02 C ATOM 145 CE2 TYR A 10 22.050 -0.277 -7.344 1.00 0.02 C ATOM 146 CZ TYR A 10 20.831 -0.953 -7.225 1.00 0.00 C ATOM 147 OH TYR A 10 20.791 -2.329 -7.324 1.00 0.02 O ATOM 0 H TYR A 10 18.634 3.289 -5.440 1.00 0.02 H new ATOM 0 HA TYR A 10 21.577 3.548 -4.864 1.00 0.01 H new ATOM 0 HB2 TYR A 10 20.200 3.789 -7.579 1.00 0.02 H new ATOM 0 HB3 TYR A 10 21.923 3.719 -7.268 1.00 0.02 H new ATOM 0 HD1 TYR A 10 18.778 1.716 -6.733 1.00 0.02 H new ATOM 0 HD2 TYR A 10 23.033 1.638 -7.337 1.00 0.00 H new ATOM 0 HE1 TYR A 10 18.710 -0.755 -6.911 1.00 0.02 H new ATOM 0 HE2 TYR A 10 22.961 -0.833 -7.513 1.00 0.02 H new ATOM 0 HH TYR A 10 21.696 -2.672 -7.478 1.00 0.02 H new ATOM 157 N GLU A 11 21.473 6.071 -5.071 1.00 0.00 N ATOM 158 CA GLU A 11 21.297 7.549 -4.986 1.00 0.02 C ATOM 159 C GLU A 11 21.171 8.185 -6.370 1.00 0.03 C ATOM 160 O GLU A 11 20.553 9.221 -6.508 1.00 0.03 O ATOM 161 CB GLU A 11 22.501 8.161 -4.268 1.00 0.00 C ATOM 162 CG GLU A 11 22.616 7.557 -2.870 1.00 0.00 C ATOM 163 CD GLU A 11 23.626 8.356 -2.045 1.00 0.02 C ATOM 164 OE1 GLU A 11 24.310 9.185 -2.624 1.00 0.01 O ATOM 165 OE2 GLU A 11 23.699 8.127 -0.850 1.00 0.02 O ATOM 0 H GLU A 11 22.397 5.728 -4.808 1.00 0.00 H new ATOM 0 HA GLU A 11 20.377 7.745 -4.435 1.00 0.02 H new ATOM 0 HB2 GLU A 11 23.412 7.971 -4.835 1.00 0.00 H new ATOM 0 HB3 GLU A 11 22.387 9.243 -4.201 1.00 0.00 H new ATOM 0 HG2 GLU A 11 21.643 7.565 -2.379 1.00 0.00 H new ATOM 0 HG3 GLU A 11 22.930 6.515 -2.938 1.00 0.00 H new ATOM 172 N ASP A 12 21.738 7.595 -7.401 1.00 0.02 N ATOM 173 CA ASP A 12 21.627 8.203 -8.769 1.00 0.01 C ATOM 174 C ASP A 12 20.813 7.285 -9.684 1.00 0.02 C ATOM 175 O ASP A 12 20.487 6.165 -9.346 1.00 0.02 O ATOM 176 CB ASP A 12 23.024 8.399 -9.367 1.00 0.01 C ATOM 177 CG ASP A 12 22.942 9.344 -10.569 1.00 0.01 C ATOM 178 OD1 ASP A 12 22.713 8.859 -11.664 1.00 0.03 O ATOM 179 OD2 ASP A 12 23.111 10.536 -10.372 1.00 0.02 O ATOM 0 H ASP A 12 22.269 6.725 -7.354 1.00 0.02 H new ATOM 0 HA ASP A 12 21.127 9.168 -8.684 1.00 0.01 H new ATOM 0 HB2 ASP A 12 23.698 8.809 -8.615 1.00 0.01 H new ATOM 0 HB3 ASP A 12 23.437 7.438 -9.675 1.00 0.01 H new ATOM 184 N ARG A 13 20.483 7.781 -10.840 1.00 0.02 N ATOM 185 CA ARG A 13 19.680 6.994 -11.818 1.00 0.02 C ATOM 186 C ARG A 13 20.552 5.922 -12.479 1.00 0.00 C ATOM 187 O ARG A 13 21.767 5.985 -12.460 1.00 0.02 O ATOM 188 CB ARG A 13 19.157 7.953 -12.889 1.00 0.00 C ATOM 189 CG ARG A 13 18.037 8.814 -12.301 1.00 0.01 C ATOM 190 CD ARG A 13 17.692 9.940 -13.276 1.00 0.02 C ATOM 191 NE ARG A 13 17.543 9.382 -14.649 1.00 0.03 N ATOM 192 CZ ARG A 13 16.961 10.087 -15.581 1.00 0.02 C ATOM 193 NH1 ARG A 13 16.514 11.283 -15.311 1.00 0.02 N ATOM 194 NH2 ARG A 13 16.826 9.594 -16.782 1.00 0.02 N ATOM 0 H ARG A 13 20.740 8.716 -11.156 1.00 0.02 H new ATOM 0 HA ARG A 13 18.853 6.503 -11.305 1.00 0.02 H new ATOM 0 HB2 ARG A 13 19.966 8.588 -13.250 1.00 0.00 H new ATOM 0 HB3 ARG A 13 18.786 7.391 -13.746 1.00 0.00 H new ATOM 0 HG2 ARG A 13 17.156 8.202 -12.110 1.00 0.01 H new ATOM 0 HG3 ARG A 13 18.349 9.231 -11.344 1.00 0.01 H new ATOM 0 HD2 ARG A 13 16.768 10.430 -12.969 1.00 0.02 H new ATOM 0 HD3 ARG A 13 18.475 10.698 -13.263 1.00 0.02 H new ATOM 0 HE ARG A 13 17.896 8.449 -14.861 1.00 0.03 H new ATOM 0 HH11 ARG A 13 16.619 11.667 -14.372 1.00 0.02 H new ATOM 0 HH12 ARG A 13 16.059 11.834 -16.039 1.00 0.02 H new ATOM 0 HH21 ARG A 13 17.175 8.659 -16.992 1.00 0.02 H new ATOM 0 HH22 ARG A 13 16.371 10.144 -17.511 1.00 0.02 H new ATOM 208 N ASN A 14 19.925 4.931 -13.059 1.00 0.02 N ATOM 209 CA ASN A 14 20.676 3.841 -13.742 1.00 0.02 C ATOM 210 C ASN A 14 21.547 3.082 -12.743 1.00 0.02 C ATOM 211 O ASN A 14 22.639 2.645 -13.045 1.00 0.02 O ATOM 212 CB ASN A 14 21.529 4.448 -14.859 1.00 0.26 C ATOM 213 CG ASN A 14 20.738 5.551 -15.564 1.00 0.12 C ATOM 214 OD1 ASN A 14 21.183 6.679 -15.641 1.00 0.74 O ATOM 215 ND2 ASN A 14 19.576 5.270 -16.085 1.00 0.46 N ATOM 0 H ASN A 14 18.910 4.832 -13.087 1.00 0.02 H new ATOM 0 HA ASN A 14 19.973 3.129 -14.174 1.00 0.02 H new ATOM 0 HB2 ASN A 14 22.452 4.855 -14.446 1.00 0.26 H new ATOM 0 HB3 ASN A 14 21.813 3.676 -15.574 1.00 0.26 H new ATOM 0 HD21 ASN A 14 19.040 5.998 -16.558 1.00 0.46 H new ATOM 0 HD22 ASN A 14 19.203 4.323 -16.020 1.00 0.46 H new ATOM 222 N PHE A 15 21.040 2.951 -11.543 1.00 0.02 N ATOM 223 CA PHE A 15 21.756 2.237 -10.442 1.00 0.02 C ATOM 224 C PHE A 15 23.192 2.735 -10.313 1.00 0.00 C ATOM 225 O PHE A 15 24.117 1.971 -10.120 1.00 0.02 O ATOM 226 CB PHE A 15 21.732 0.712 -10.659 1.00 0.02 C ATOM 227 CG PHE A 15 22.092 0.358 -12.080 1.00 0.02 C ATOM 228 CD1 PHE A 15 21.090 0.259 -13.052 1.00 0.02 C ATOM 229 CD2 PHE A 15 23.429 0.128 -12.427 1.00 0.02 C ATOM 230 CE1 PHE A 15 21.424 -0.071 -14.371 1.00 0.02 C ATOM 231 CE2 PHE A 15 23.763 -0.201 -13.745 1.00 0.02 C ATOM 232 CZ PHE A 15 22.761 -0.300 -14.718 1.00 0.02 C ATOM 0 H PHE A 15 20.129 3.322 -11.273 1.00 0.02 H new ATOM 0 HA PHE A 15 21.232 2.455 -9.512 1.00 0.02 H new ATOM 0 HB2 PHE A 15 22.432 0.233 -9.974 1.00 0.02 H new ATOM 0 HB3 PHE A 15 20.741 0.324 -10.425 1.00 0.02 H new ATOM 0 HD1 PHE A 15 20.059 0.437 -12.785 1.00 0.02 H new ATOM 0 HD2 PHE A 15 24.202 0.205 -11.677 1.00 0.02 H new ATOM 0 HE1 PHE A 15 20.650 -0.149 -15.121 1.00 0.02 H new ATOM 0 HE2 PHE A 15 24.794 -0.379 -14.012 1.00 0.02 H new ATOM 0 HZ PHE A 15 23.019 -0.553 -15.736 1.00 0.02 H new ATOM 242 N GLN A 16 23.368 4.028 -10.385 1.00 0.02 N ATOM 243 CA GLN A 16 24.727 4.629 -10.231 1.00 0.02 C ATOM 244 C GLN A 16 24.766 5.366 -8.888 1.00 0.02 C ATOM 245 O GLN A 16 23.741 5.608 -8.277 1.00 0.02 O ATOM 246 CB GLN A 16 24.974 5.626 -11.369 1.00 0.02 C ATOM 247 CG GLN A 16 25.353 4.866 -12.642 1.00 0.00 C ATOM 248 CD GLN A 16 25.484 5.849 -13.805 1.00 0.00 C ATOM 249 OE1 GLN A 16 26.114 6.881 -13.677 1.00 0.02 O ATOM 250 NE2 GLN A 16 24.910 5.572 -14.944 1.00 0.02 N ATOM 0 H GLN A 16 22.619 4.702 -10.546 1.00 0.02 H new ATOM 0 HA GLN A 16 25.494 3.855 -10.264 1.00 0.02 H new ATOM 0 HB2 GLN A 16 24.080 6.224 -11.543 1.00 0.02 H new ATOM 0 HB3 GLN A 16 25.771 6.317 -11.095 1.00 0.02 H new ATOM 0 HG2 GLN A 16 26.293 4.334 -12.494 1.00 0.00 H new ATOM 0 HG3 GLN A 16 24.595 4.116 -12.870 1.00 0.00 H new ATOM 0 HE21 GLN A 16 24.381 4.706 -15.052 1.00 0.02 H new ATOM 0 HE22 GLN A 16 24.990 6.221 -15.727 1.00 0.02 H new ATOM 259 N GLY A 17 25.930 5.724 -8.410 1.00 0.03 N ATOM 260 CA GLY A 17 26.008 6.445 -7.103 1.00 0.03 C ATOM 261 C GLY A 17 26.134 5.451 -5.941 1.00 0.02 C ATOM 262 O GLY A 17 26.370 4.275 -6.137 1.00 0.02 O ATOM 0 H GLY A 17 26.826 5.550 -8.865 1.00 0.03 H new ATOM 0 HA2 GLY A 17 26.864 7.120 -7.105 1.00 0.03 H new ATOM 0 HA3 GLY A 17 25.118 7.059 -6.967 1.00 0.03 H new ATOM 266 N ARG A 18 25.967 5.920 -4.732 1.00 0.00 N ATOM 267 CA ARG A 18 26.061 5.017 -3.546 1.00 0.02 C ATOM 268 C ARG A 18 24.860 4.069 -3.543 1.00 0.02 C ATOM 269 O ARG A 18 23.766 4.433 -3.933 1.00 0.02 O ATOM 270 CB ARG A 18 26.062 5.866 -2.266 1.00 0.79 C ATOM 271 CG ARG A 18 26.628 5.048 -1.087 1.00 1.49 C ATOM 272 CD ARG A 18 28.160 5.159 -1.048 1.00 1.42 C ATOM 273 NE ARG A 18 28.549 6.422 -0.362 1.00 2.07 N ATOM 274 CZ ARG A 18 29.777 6.590 0.047 1.00 2.35 C ATOM 275 NH1 ARG A 18 30.663 5.654 -0.151 1.00 2.53 N ATOM 276 NH2 ARG A 18 30.118 7.695 0.652 1.00 2.76 N ATOM 0 H ARG A 18 25.768 6.896 -4.514 1.00 0.00 H new ATOM 0 HA ARG A 18 26.980 4.433 -3.591 1.00 0.02 H new ATOM 0 HB2 ARG A 18 26.661 6.764 -2.417 1.00 0.79 H new ATOM 0 HB3 ARG A 18 25.048 6.194 -2.037 1.00 0.79 H new ATOM 0 HG2 ARG A 18 26.206 5.409 -0.149 1.00 1.49 H new ATOM 0 HG3 ARG A 18 26.335 4.003 -1.187 1.00 1.49 H new ATOM 0 HD2 ARG A 18 28.584 4.302 -0.524 1.00 1.42 H new ATOM 0 HD3 ARG A 18 28.562 5.144 -2.061 1.00 1.42 H new ATOM 0 HE ARG A 18 27.856 7.155 -0.212 1.00 2.07 H new ATOM 0 HH11 ARG A 18 30.396 4.791 -0.625 1.00 2.53 H new ATOM 0 HH12 ARG A 18 31.623 5.785 0.168 1.00 2.53 H new ATOM 0 HH21 ARG A 18 29.425 8.427 0.805 1.00 2.76 H new ATOM 0 HH22 ARG A 18 31.078 7.826 0.972 1.00 2.76 H new ATOM 290 N ARG A 19 25.067 2.841 -3.127 1.00 0.02 N ATOM 291 CA ARG A 19 23.961 1.832 -3.111 1.00 0.02 C ATOM 292 C ARG A 19 23.774 1.273 -1.697 1.00 0.02 C ATOM 293 O ARG A 19 24.712 1.155 -0.933 1.00 0.02 O ATOM 294 CB ARG A 19 24.346 0.679 -4.045 1.00 0.85 C ATOM 295 CG ARG A 19 23.157 -0.272 -4.231 1.00 1.31 C ATOM 296 CD ARG A 19 23.613 -1.540 -4.964 1.00 1.34 C ATOM 297 NE ARG A 19 24.200 -2.494 -3.981 1.00 1.50 N ATOM 298 CZ ARG A 19 24.377 -3.744 -4.312 1.00 1.63 C ATOM 299 NH1 ARG A 19 24.044 -4.158 -5.502 1.00 1.72 N ATOM 300 NH2 ARG A 19 24.887 -4.579 -3.449 1.00 1.89 N ATOM 0 H ARG A 19 25.966 2.492 -2.794 1.00 0.02 H new ATOM 0 HA ARG A 19 23.034 2.305 -3.435 1.00 0.02 H new ATOM 0 HB2 ARG A 19 24.660 1.074 -5.011 1.00 0.85 H new ATOM 0 HB3 ARG A 19 25.195 0.135 -3.632 1.00 0.85 H new ATOM 0 HG2 ARG A 19 22.734 -0.534 -3.261 1.00 1.31 H new ATOM 0 HG3 ARG A 19 22.369 0.223 -4.799 1.00 1.31 H new ATOM 0 HD2 ARG A 19 22.768 -2.001 -5.476 1.00 1.34 H new ATOM 0 HD3 ARG A 19 24.349 -1.288 -5.727 1.00 1.34 H new ATOM 0 HE ARG A 19 24.463 -2.170 -3.050 1.00 1.50 H new ATOM 0 HH11 ARG A 19 23.645 -3.505 -6.176 1.00 1.72 H new ATOM 0 HH12 ARG A 19 24.183 -5.135 -5.759 1.00 1.72 H new ATOM 0 HH21 ARG A 19 25.147 -4.255 -2.517 1.00 1.89 H new ATOM 0 HH22 ARG A 19 25.026 -5.556 -3.706 1.00 1.89 H new ATOM 314 N TYR A 20 22.566 0.888 -1.373 1.00 0.02 N ATOM 315 CA TYR A 20 22.292 0.280 -0.030 1.00 0.02 C ATOM 316 C TYR A 20 21.389 -0.938 -0.204 1.00 0.02 C ATOM 317 O TYR A 20 20.393 -0.878 -0.890 1.00 0.02 O ATOM 318 CB TYR A 20 21.612 1.281 0.914 1.00 0.02 C ATOM 319 CG TYR A 20 21.778 0.785 2.339 1.00 0.01 C ATOM 320 CD1 TYR A 20 21.041 -0.322 2.792 1.00 0.01 C ATOM 321 CD2 TYR A 20 22.686 1.416 3.198 1.00 0.02 C ATOM 322 CE1 TYR A 20 21.214 -0.789 4.101 1.00 0.02 C ATOM 323 CE2 TYR A 20 22.859 0.943 4.504 1.00 0.02 C ATOM 324 CZ TYR A 20 22.123 -0.158 4.956 1.00 0.02 C ATOM 325 OH TYR A 20 22.295 -0.621 6.245 1.00 0.01 O ATOM 0 H TYR A 20 21.752 0.968 -1.982 1.00 0.02 H new ATOM 0 HA TYR A 20 23.245 -0.010 0.412 1.00 0.02 H new ATOM 0 HB2 TYR A 20 22.057 2.270 0.802 1.00 0.02 H new ATOM 0 HB3 TYR A 20 20.555 1.377 0.667 1.00 0.02 H new ATOM 0 HD1 TYR A 20 20.342 -0.813 2.131 1.00 0.01 H new ATOM 0 HD2 TYR A 20 23.253 2.268 2.853 1.00 0.02 H new ATOM 0 HE1 TYR A 20 20.645 -1.638 4.451 1.00 0.02 H new ATOM 0 HE2 TYR A 20 23.562 1.429 5.164 1.00 0.02 H new ATOM 0 HH TYR A 20 22.964 -0.071 6.704 1.00 0.01 H new ATOM 335 N ASP A 21 21.721 -2.033 0.428 1.00 0.01 N ATOM 336 CA ASP A 21 20.880 -3.268 0.326 1.00 0.02 C ATOM 337 C ASP A 21 20.178 -3.497 1.669 1.00 0.00 C ATOM 338 O ASP A 21 20.774 -3.372 2.721 1.00 0.01 O ATOM 339 CB ASP A 21 21.791 -4.459 0.020 1.00 0.12 C ATOM 340 CG ASP A 21 22.198 -4.427 -1.454 1.00 0.41 C ATOM 341 OD1 ASP A 21 21.852 -3.467 -2.122 1.00 1.12 O ATOM 342 OD2 ASP A 21 22.849 -5.363 -1.888 1.00 0.56 O ATOM 0 H ASP A 21 22.548 -2.128 1.018 1.00 0.01 H new ATOM 0 HA ASP A 21 20.138 -3.159 -0.465 1.00 0.02 H new ATOM 0 HB2 ASP A 21 22.677 -4.424 0.653 1.00 0.12 H new ATOM 0 HB3 ASP A 21 21.275 -5.392 0.245 1.00 0.12 H new ATOM 347 N CYS A 22 18.904 -3.820 1.632 1.00 0.01 N ATOM 348 CA CYS A 22 18.133 -4.049 2.900 1.00 0.00 C ATOM 349 C CYS A 22 17.425 -5.403 2.827 1.00 0.02 C ATOM 350 O CYS A 22 16.877 -5.779 1.805 1.00 0.01 O ATOM 351 CB CYS A 22 17.098 -2.934 3.071 1.00 0.00 C ATOM 352 SG CYS A 22 16.485 -2.937 4.773 1.00 0.02 S ATOM 0 H CYS A 22 18.363 -3.935 0.775 1.00 0.01 H new ATOM 0 HA CYS A 22 18.815 -4.044 3.751 1.00 0.00 H new ATOM 0 HB2 CYS A 22 17.546 -1.968 2.836 1.00 0.00 H new ATOM 0 HB3 CYS A 22 16.272 -3.080 2.375 1.00 0.00 H new ATOM 0 HG CYS A 22 15.366 -3.596 4.830 1.00 0.02 H new ATOM 358 N ASP A 23 17.444 -6.141 3.912 1.00 0.01 N ATOM 359 CA ASP A 23 16.790 -7.487 3.946 1.00 0.02 C ATOM 360 C ASP A 23 15.678 -7.508 5.002 1.00 0.00 C ATOM 361 O ASP A 23 15.165 -8.554 5.345 1.00 0.02 O ATOM 362 CB ASP A 23 17.842 -8.541 4.294 1.00 0.16 C ATOM 363 CG ASP A 23 18.468 -8.211 5.651 1.00 0.17 C ATOM 364 OD1 ASP A 23 18.518 -7.039 5.988 1.00 0.20 O ATOM 365 OD2 ASP A 23 18.885 -9.134 6.329 1.00 0.17 O ATOM 0 H ASP A 23 17.891 -5.863 4.786 1.00 0.01 H new ATOM 0 HA ASP A 23 16.354 -7.701 2.970 1.00 0.02 H new ATOM 0 HB2 ASP A 23 17.385 -9.530 4.324 1.00 0.16 H new ATOM 0 HB3 ASP A 23 18.613 -8.569 3.524 1.00 0.16 H new ATOM 370 N CYS A 24 15.293 -6.369 5.521 1.00 0.01 N ATOM 371 CA CYS A 24 14.207 -6.345 6.546 1.00 0.01 C ATOM 372 C CYS A 24 13.616 -4.930 6.618 1.00 0.01 C ATOM 373 O CYS A 24 14.108 -4.018 5.985 1.00 0.01 O ATOM 374 CB CYS A 24 14.780 -6.739 7.910 1.00 0.62 C ATOM 375 SG CYS A 24 16.116 -5.602 8.355 1.00 1.23 S ATOM 0 H CYS A 24 15.683 -5.458 5.280 1.00 0.01 H new ATOM 0 HA CYS A 24 13.425 -7.053 6.271 1.00 0.01 H new ATOM 0 HB2 CYS A 24 13.997 -6.711 8.667 1.00 0.62 H new ATOM 0 HB3 CYS A 24 15.155 -7.762 7.877 1.00 0.62 H new ATOM 0 HG CYS A 24 16.601 -5.935 9.514 1.00 1.23 H new ATOM 381 N ASP A 25 12.563 -4.733 7.371 1.00 0.02 N ATOM 382 CA ASP A 25 11.945 -3.374 7.465 1.00 0.01 C ATOM 383 C ASP A 25 12.929 -2.374 8.083 1.00 0.02 C ATOM 384 O ASP A 25 13.703 -2.709 8.957 1.00 0.00 O ATOM 385 CB ASP A 25 10.706 -3.454 8.355 1.00 0.01 C ATOM 386 CG ASP A 25 11.081 -4.096 9.692 1.00 0.01 C ATOM 387 OD1 ASP A 25 11.755 -3.442 10.472 1.00 0.01 O ATOM 388 OD2 ASP A 25 10.692 -5.230 9.912 1.00 0.01 O ATOM 0 H ASP A 25 12.104 -5.455 7.926 1.00 0.02 H new ATOM 0 HA ASP A 25 11.680 -3.039 6.462 1.00 0.01 H new ATOM 0 HB2 ASP A 25 10.298 -2.457 8.520 1.00 0.01 H new ATOM 0 HB3 ASP A 25 9.929 -4.039 7.863 1.00 0.01 H new ATOM 393 N CYS A 26 12.877 -1.138 7.648 1.00 0.01 N ATOM 394 CA CYS A 26 13.775 -0.078 8.217 1.00 0.01 C ATOM 395 C CYS A 26 12.936 1.175 8.511 1.00 0.01 C ATOM 396 O CYS A 26 12.329 1.744 7.626 1.00 0.01 O ATOM 397 CB CYS A 26 14.883 0.253 7.214 1.00 0.01 C ATOM 398 SG CYS A 26 15.690 1.806 7.679 1.00 0.02 S ATOM 0 H CYS A 26 12.245 -0.813 6.916 1.00 0.01 H new ATOM 0 HA CYS A 26 14.235 -0.434 9.139 1.00 0.01 H new ATOM 0 HB2 CYS A 26 15.615 -0.554 7.188 1.00 0.01 H new ATOM 0 HB3 CYS A 26 14.465 0.336 6.211 1.00 0.01 H new ATOM 0 HG CYS A 26 16.291 2.310 6.642 1.00 0.02 H new ATOM 404 N ALA A 27 12.860 1.577 9.756 1.00 0.01 N ATOM 405 CA ALA A 27 12.016 2.759 10.126 1.00 0.01 C ATOM 406 C ALA A 27 12.711 4.085 9.790 1.00 0.01 C ATOM 407 O ALA A 27 12.066 5.111 9.675 1.00 0.02 O ATOM 408 CB ALA A 27 11.719 2.712 11.625 1.00 0.24 C ATOM 0 H ALA A 27 13.348 1.136 10.536 1.00 0.01 H new ATOM 0 HA ALA A 27 11.093 2.709 9.548 1.00 0.01 H new ATOM 0 HB1 ALA A 27 11.105 3.569 11.901 1.00 0.24 H new ATOM 0 HB2 ALA A 27 11.185 1.792 11.861 1.00 0.24 H new ATOM 0 HB3 ALA A 27 12.655 2.741 12.182 1.00 0.24 H new ATOM 414 N ASP A 28 14.008 4.093 9.653 1.00 0.01 N ATOM 415 CA ASP A 28 14.717 5.377 9.341 1.00 0.02 C ATOM 416 C ASP A 28 15.988 5.078 8.550 1.00 0.01 C ATOM 417 O ASP A 28 16.960 4.576 9.078 1.00 0.02 O ATOM 418 CB ASP A 28 15.075 6.099 10.643 1.00 0.67 C ATOM 419 CG ASP A 28 15.630 7.489 10.323 1.00 0.90 C ATOM 420 OD1 ASP A 28 14.840 8.414 10.225 1.00 0.87 O ATOM 421 OD2 ASP A 28 16.836 7.606 10.184 1.00 1.14 O ATOM 0 H ASP A 28 14.609 3.274 9.742 1.00 0.01 H new ATOM 0 HA ASP A 28 14.064 6.016 8.747 1.00 0.02 H new ATOM 0 HB2 ASP A 28 14.193 6.186 11.277 1.00 0.67 H new ATOM 0 HB3 ASP A 28 15.812 5.521 11.200 1.00 0.67 H new ATOM 426 N PHE A 29 15.973 5.357 7.271 1.00 0.02 N ATOM 427 CA PHE A 29 17.151 5.071 6.397 1.00 0.02 C ATOM 428 C PHE A 29 17.949 6.360 6.136 1.00 0.00 C ATOM 429 O PHE A 29 18.858 6.393 5.330 1.00 0.02 O ATOM 430 CB PHE A 29 16.605 4.496 5.059 1.00 2.87 C ATOM 431 CG PHE A 29 17.163 3.113 4.812 1.00 3.99 C ATOM 432 CD1 PHE A 29 18.532 2.957 4.618 1.00 4.68 C ATOM 433 CD2 PHE A 29 16.317 1.996 4.793 1.00 4.52 C ATOM 434 CE1 PHE A 29 19.068 1.689 4.403 1.00 5.85 C ATOM 435 CE2 PHE A 29 16.852 0.722 4.575 1.00 5.75 C ATOM 436 CZ PHE A 29 18.229 0.567 4.380 1.00 6.37 C ATOM 0 H PHE A 29 15.180 5.778 6.788 1.00 0.02 H new ATOM 0 HA PHE A 29 17.821 4.359 6.878 1.00 0.02 H new ATOM 0 HB2 PHE A 29 15.516 4.455 5.091 1.00 2.87 H new ATOM 0 HB3 PHE A 29 16.875 5.156 4.235 1.00 2.87 H new ATOM 0 HD1 PHE A 29 19.180 3.821 4.634 1.00 4.68 H new ATOM 0 HD2 PHE A 29 15.255 2.118 4.946 1.00 4.52 H new ATOM 0 HE1 PHE A 29 20.131 1.571 4.254 1.00 5.85 H new ATOM 0 HE2 PHE A 29 16.203 -0.141 4.557 1.00 5.75 H new ATOM 0 HZ PHE A 29 18.644 -0.416 4.212 1.00 6.37 H new ATOM 446 N ARG A 30 17.568 7.431 6.770 1.00 0.01 N ATOM 447 CA ARG A 30 18.247 8.736 6.530 1.00 0.00 C ATOM 448 C ARG A 30 19.731 8.712 6.923 1.00 0.01 C ATOM 449 O ARG A 30 20.524 9.439 6.361 1.00 0.02 O ATOM 450 CB ARG A 30 17.546 9.830 7.338 1.00 0.32 C ATOM 451 CG ARG A 30 16.030 9.734 7.134 1.00 0.86 C ATOM 452 CD ARG A 30 15.694 9.856 5.644 1.00 1.62 C ATOM 453 NE ARG A 30 14.265 10.248 5.490 1.00 2.25 N ATOM 454 CZ ARG A 30 13.831 10.699 4.345 1.00 2.70 C ATOM 455 NH1 ARG A 30 14.650 10.811 3.335 1.00 3.11 N ATOM 456 NH2 ARG A 30 12.579 11.039 4.212 1.00 3.02 N ATOM 0 H ARG A 30 16.809 7.460 7.451 1.00 0.01 H new ATOM 0 HA ARG A 30 18.187 8.935 5.460 1.00 0.00 H new ATOM 0 HB2 ARG A 30 17.787 9.725 8.396 1.00 0.32 H new ATOM 0 HB3 ARG A 30 17.903 10.811 7.025 1.00 0.32 H new ATOM 0 HG2 ARG A 30 15.662 8.784 7.522 1.00 0.86 H new ATOM 0 HG3 ARG A 30 15.528 10.523 7.694 1.00 0.86 H new ATOM 0 HD2 ARG A 30 16.339 10.598 5.174 1.00 1.62 H new ATOM 0 HD3 ARG A 30 15.879 8.908 5.139 1.00 1.62 H new ATOM 0 HE ARG A 30 13.625 10.164 6.280 1.00 2.25 H new ATOM 0 HH11 ARG A 30 15.629 10.546 3.441 1.00 3.11 H new ATOM 0 HH12 ARG A 30 14.311 11.164 2.440 1.00 3.11 H new ATOM 0 HH21 ARG A 30 11.940 10.952 5.002 1.00 3.02 H new ATOM 0 HH22 ARG A 30 12.239 11.392 3.318 1.00 3.02 H new ATOM 470 N SER A 31 20.131 7.925 7.889 1.00 0.02 N ATOM 471 CA SER A 31 21.572 7.939 8.305 1.00 0.02 C ATOM 472 C SER A 31 22.456 7.171 7.319 1.00 0.01 C ATOM 473 O SER A 31 23.660 7.334 7.309 1.00 0.02 O ATOM 474 CB SER A 31 21.693 7.297 9.686 1.00 0.37 C ATOM 475 OG SER A 31 21.357 5.919 9.593 1.00 0.88 O ATOM 0 H SER A 31 19.533 7.279 8.404 1.00 0.02 H new ATOM 0 HA SER A 31 21.910 8.975 8.324 1.00 0.02 H new ATOM 0 HB2 SER A 31 22.709 7.411 10.065 1.00 0.37 H new ATOM 0 HB3 SER A 31 21.031 7.798 10.392 1.00 0.37 H new ATOM 0 HG SER A 31 21.435 5.503 10.477 1.00 0.88 H new ATOM 481 N TYR A 32 21.880 6.318 6.515 1.00 0.01 N ATOM 482 CA TYR A 32 22.699 5.510 5.552 1.00 0.01 C ATOM 483 C TYR A 32 22.498 6.027 4.126 1.00 0.02 C ATOM 484 O TYR A 32 23.286 5.748 3.244 1.00 0.02 O ATOM 485 CB TYR A 32 22.246 4.047 5.645 1.00 0.02 C ATOM 486 CG TYR A 32 22.867 3.396 6.865 1.00 0.02 C ATOM 487 CD1 TYR A 32 24.254 3.219 6.933 1.00 0.01 C ATOM 488 CD2 TYR A 32 22.056 2.970 7.927 1.00 0.01 C ATOM 489 CE1 TYR A 32 24.830 2.618 8.058 1.00 0.02 C ATOM 490 CE2 TYR A 32 22.633 2.369 9.052 1.00 0.00 C ATOM 491 CZ TYR A 32 24.021 2.193 9.117 1.00 0.02 C ATOM 492 OH TYR A 32 24.589 1.601 10.226 1.00 0.02 O ATOM 0 H TYR A 32 20.876 6.142 6.480 1.00 0.01 H new ATOM 0 HA TYR A 32 23.757 5.594 5.802 1.00 0.01 H new ATOM 0 HB2 TYR A 32 21.159 3.996 5.708 1.00 0.02 H new ATOM 0 HB3 TYR A 32 22.539 3.508 4.744 1.00 0.02 H new ATOM 0 HD1 TYR A 32 24.880 3.547 6.116 1.00 0.01 H new ATOM 0 HD2 TYR A 32 20.986 3.106 7.877 1.00 0.01 H new ATOM 0 HE1 TYR A 32 25.900 2.482 8.109 1.00 0.02 H new ATOM 0 HE2 TYR A 32 22.008 2.041 9.870 1.00 0.00 H new ATOM 0 HH TYR A 32 23.886 1.367 10.868 1.00 0.02 H new ATOM 502 N LEU A 33 21.440 6.749 3.878 1.00 0.02 N ATOM 503 CA LEU A 33 21.185 7.247 2.489 1.00 0.02 C ATOM 504 C LEU A 33 20.453 8.592 2.557 1.00 0.02 C ATOM 505 O LEU A 33 19.441 8.733 3.215 1.00 0.02 O ATOM 506 CB LEU A 33 20.284 6.225 1.771 1.00 1.66 C ATOM 507 CG LEU A 33 20.449 6.345 0.241 1.00 2.38 C ATOM 508 CD1 LEU A 33 21.671 5.545 -0.229 1.00 3.32 C ATOM 509 CD2 LEU A 33 19.200 5.798 -0.458 1.00 2.80 C ATOM 0 H LEU A 33 20.741 7.017 4.571 1.00 0.02 H new ATOM 0 HA LEU A 33 22.127 7.372 1.955 1.00 0.02 H new ATOM 0 HB2 LEU A 33 20.540 5.216 2.093 1.00 1.66 H new ATOM 0 HB3 LEU A 33 19.242 6.393 2.045 1.00 1.66 H new ATOM 0 HG LEU A 33 20.587 7.397 -0.011 1.00 2.38 H new ATOM 0 HD11 LEU A 33 21.774 5.640 -1.310 1.00 3.32 H new ATOM 0 HD12 LEU A 33 22.567 5.931 0.256 1.00 3.32 H new ATOM 0 HD13 LEU A 33 21.541 4.495 0.033 1.00 3.32 H new ATOM 0 HD21 LEU A 33 19.320 5.884 -1.538 1.00 2.80 H new ATOM 0 HD22 LEU A 33 19.063 4.750 -0.191 1.00 2.80 H new ATOM 0 HD23 LEU A 33 18.327 6.370 -0.143 1.00 2.80 H new ATOM 521 N SER A 34 20.981 9.588 1.891 1.00 0.02 N ATOM 522 CA SER A 34 20.353 10.940 1.920 1.00 0.02 C ATOM 523 C SER A 34 19.285 11.077 0.832 1.00 0.00 C ATOM 524 O SER A 34 18.510 12.014 0.834 1.00 0.01 O ATOM 525 CB SER A 34 21.432 12.001 1.700 1.00 0.02 C ATOM 526 OG SER A 34 22.510 11.769 2.597 1.00 0.02 O ATOM 0 H SER A 34 21.827 9.520 1.325 1.00 0.02 H new ATOM 0 HA SER A 34 19.876 11.077 2.891 1.00 0.02 H new ATOM 0 HB2 SER A 34 21.787 11.967 0.670 1.00 0.02 H new ATOM 0 HB3 SER A 34 21.018 12.996 1.861 1.00 0.02 H new ATOM 0 HG SER A 34 23.204 12.447 2.457 1.00 0.02 H new ATOM 532 N ARG A 35 19.228 10.162 -0.102 1.00 0.02 N ATOM 533 CA ARG A 35 18.210 10.248 -1.187 1.00 0.01 C ATOM 534 C ARG A 35 18.269 8.957 -2.010 1.00 0.02 C ATOM 535 O ARG A 35 19.241 8.228 -1.966 1.00 0.02 O ATOM 536 CB ARG A 35 18.518 11.443 -2.091 1.00 0.02 C ATOM 537 CG ARG A 35 19.996 11.417 -2.487 1.00 0.02 C ATOM 538 CD ARG A 35 20.286 12.570 -3.450 1.00 0.02 C ATOM 539 NE ARG A 35 21.754 12.661 -3.687 1.00 0.02 N ATOM 540 CZ ARG A 35 22.211 13.364 -4.687 1.00 0.02 C ATOM 541 NH1 ARG A 35 21.383 13.983 -5.482 1.00 0.00 N ATOM 542 NH2 ARG A 35 23.497 13.445 -4.893 1.00 0.02 N ATOM 0 H ARG A 35 19.848 9.354 -0.158 1.00 0.02 H new ATOM 0 HA ARG A 35 17.217 10.376 -0.757 1.00 0.01 H new ATOM 0 HB2 ARG A 35 17.891 11.409 -2.982 1.00 0.02 H new ATOM 0 HB3 ARG A 35 18.286 12.374 -1.573 1.00 0.02 H new ATOM 0 HG2 ARG A 35 20.623 11.504 -1.600 1.00 0.02 H new ATOM 0 HG3 ARG A 35 20.241 10.465 -2.958 1.00 0.02 H new ATOM 0 HD2 ARG A 35 19.764 12.410 -4.393 1.00 0.02 H new ATOM 0 HD3 ARG A 35 19.915 13.507 -3.035 1.00 0.02 H new ATOM 0 HE ARG A 35 22.402 12.174 -3.068 1.00 0.02 H new ATOM 0 HH11 ARG A 35 20.378 13.918 -5.322 1.00 0.00 H new ATOM 0 HH12 ARG A 35 21.741 14.532 -6.263 1.00 0.00 H new ATOM 0 HH21 ARG A 35 24.144 12.959 -4.273 1.00 0.02 H new ATOM 0 HH22 ARG A 35 23.855 13.994 -5.674 1.00 0.02 H new ATOM 556 N CYS A 36 17.244 8.668 -2.770 1.00 0.02 N ATOM 557 CA CYS A 36 17.240 7.428 -3.609 1.00 0.02 C ATOM 558 C CYS A 36 16.553 7.737 -4.943 1.00 0.02 C ATOM 559 O CYS A 36 15.382 8.058 -4.962 1.00 0.02 O ATOM 560 CB CYS A 36 16.459 6.334 -2.881 1.00 0.02 C ATOM 561 SG CYS A 36 14.946 7.051 -2.194 1.00 0.02 S ATOM 0 H CYS A 36 16.403 9.241 -2.847 1.00 0.02 H new ATOM 0 HA CYS A 36 18.262 7.092 -3.786 1.00 0.02 H new ATOM 0 HB2 CYS A 36 16.214 5.525 -3.569 1.00 0.02 H new ATOM 0 HB3 CYS A 36 17.067 5.903 -2.085 1.00 0.02 H new ATOM 0 HG CYS A 36 14.841 8.290 -2.574 1.00 0.02 H new ATOM 567 N ASN A 37 17.257 7.678 -6.058 1.00 0.02 N ATOM 568 CA ASN A 37 16.608 8.016 -7.370 1.00 0.01 C ATOM 569 C ASN A 37 16.385 6.763 -8.224 1.00 0.02 C ATOM 570 O ASN A 37 15.802 6.821 -9.289 1.00 0.02 O ATOM 571 CB ASN A 37 17.494 8.996 -8.144 1.00 0.02 C ATOM 572 CG ASN A 37 17.639 10.292 -7.346 1.00 0.01 C ATOM 573 OD1 ASN A 37 18.412 10.362 -6.412 1.00 0.03 O ATOM 574 ND2 ASN A 37 16.922 11.329 -7.678 1.00 0.02 N ATOM 0 H ASN A 37 18.241 7.414 -6.114 1.00 0.02 H new ATOM 0 HA ASN A 37 15.639 8.467 -7.158 1.00 0.01 H new ATOM 0 HB2 ASN A 37 18.474 8.554 -8.321 1.00 0.02 H new ATOM 0 HB3 ASN A 37 17.057 9.205 -9.120 1.00 0.02 H new ATOM 0 HD21 ASN A 37 17.010 12.199 -7.153 1.00 0.02 H new ATOM 0 HD22 ASN A 37 16.273 11.270 -8.463 1.00 0.02 H new ATOM 581 N SER A 38 16.805 5.621 -7.743 1.00 0.02 N ATOM 582 CA SER A 38 16.580 4.354 -8.502 1.00 0.02 C ATOM 583 C SER A 38 16.528 3.205 -7.495 1.00 0.01 C ATOM 584 O SER A 38 17.075 3.295 -6.415 1.00 0.02 O ATOM 585 CB SER A 38 17.705 4.122 -9.515 1.00 0.01 C ATOM 586 OG SER A 38 17.859 2.726 -9.734 1.00 0.02 O ATOM 0 H SER A 38 17.295 5.511 -6.855 1.00 0.02 H new ATOM 0 HA SER A 38 15.644 4.415 -9.058 1.00 0.02 H new ATOM 0 HB2 SER A 38 17.474 4.626 -10.454 1.00 0.01 H new ATOM 0 HB3 SER A 38 18.637 4.549 -9.145 1.00 0.01 H new ATOM 0 HG SER A 38 17.019 2.354 -10.075 1.00 0.02 H new ATOM 592 N ILE A 39 15.846 2.134 -7.820 1.00 0.02 N ATOM 593 CA ILE A 39 15.736 1.002 -6.846 1.00 0.02 C ATOM 594 C ILE A 39 15.667 -0.339 -7.582 1.00 0.02 C ATOM 595 O ILE A 39 15.103 -0.458 -8.650 1.00 0.02 O ATOM 596 CB ILE A 39 14.450 1.170 -6.029 1.00 0.00 C ATOM 597 CG1 ILE A 39 14.315 2.625 -5.567 1.00 0.01 C ATOM 598 CG2 ILE A 39 14.498 0.253 -4.805 1.00 0.01 C ATOM 599 CD1 ILE A 39 13.108 2.757 -4.637 1.00 0.00 C ATOM 0 H ILE A 39 15.365 1.994 -8.708 1.00 0.02 H new ATOM 0 HA ILE A 39 16.613 1.013 -6.199 1.00 0.02 H new ATOM 0 HB ILE A 39 13.594 0.907 -6.651 1.00 0.00 H new ATOM 0 HG12 ILE A 39 15.222 2.939 -5.050 1.00 0.01 H new ATOM 0 HG13 ILE A 39 14.196 3.282 -6.429 1.00 0.01 H new ATOM 0 HG21 ILE A 39 13.583 0.373 -4.224 1.00 0.01 H new ATOM 0 HG22 ILE A 39 14.588 -0.783 -5.130 1.00 0.01 H new ATOM 0 HG23 ILE A 39 15.357 0.515 -4.187 1.00 0.01 H new ATOM 0 HD11 ILE A 39 13.013 3.792 -4.309 1.00 0.00 H new ATOM 0 HD12 ILE A 39 12.204 2.461 -5.169 1.00 0.00 H new ATOM 0 HD13 ILE A 39 13.245 2.112 -3.769 1.00 0.00 H new ATOM 611 N ARG A 40 16.208 -1.361 -6.967 1.00 0.02 N ATOM 612 CA ARG A 40 16.156 -2.737 -7.548 1.00 0.02 C ATOM 613 C ARG A 40 15.541 -3.666 -6.500 1.00 0.01 C ATOM 614 O ARG A 40 16.037 -3.760 -5.395 1.00 0.02 O ATOM 615 CB ARG A 40 17.559 -3.239 -7.904 1.00 0.01 C ATOM 616 CG ARG A 40 17.449 -4.465 -8.815 1.00 0.02 C ATOM 617 CD ARG A 40 18.811 -5.155 -8.910 1.00 0.02 C ATOM 618 NE ARG A 40 19.182 -5.711 -7.579 1.00 0.02 N ATOM 619 CZ ARG A 40 20.141 -6.590 -7.482 1.00 0.02 C ATOM 620 NH1 ARG A 40 20.776 -6.982 -8.552 1.00 0.02 N ATOM 621 NH2 ARG A 40 20.463 -7.077 -6.315 1.00 0.02 N ATOM 0 H ARG A 40 16.692 -1.298 -6.071 1.00 0.02 H new ATOM 0 HA ARG A 40 15.561 -2.721 -8.461 1.00 0.02 H new ATOM 0 HB2 ARG A 40 18.122 -2.451 -8.404 1.00 0.01 H new ATOM 0 HB3 ARG A 40 18.106 -3.495 -6.997 1.00 0.01 H new ATOM 0 HG2 ARG A 40 16.705 -5.158 -8.422 1.00 0.02 H new ATOM 0 HG3 ARG A 40 17.112 -4.165 -9.807 1.00 0.02 H new ATOM 0 HD2 ARG A 40 18.775 -5.953 -9.652 1.00 0.02 H new ATOM 0 HD3 ARG A 40 19.568 -4.445 -9.243 1.00 0.02 H new ATOM 0 HE ARG A 40 18.686 -5.404 -6.742 1.00 0.02 H new ATOM 0 HH11 ARG A 40 20.523 -6.601 -9.464 1.00 0.02 H new ATOM 0 HH12 ARG A 40 21.526 -7.669 -8.477 1.00 0.02 H new ATOM 0 HH21 ARG A 40 19.965 -6.770 -5.479 1.00 0.02 H new ATOM 0 HH22 ARG A 40 21.213 -7.764 -6.238 1.00 0.02 H new ATOM 635 N VAL A 41 14.505 -4.388 -6.842 1.00 0.02 N ATOM 636 CA VAL A 41 13.905 -5.352 -5.871 1.00 0.01 C ATOM 637 C VAL A 41 14.323 -6.749 -6.320 1.00 0.02 C ATOM 638 O VAL A 41 13.956 -7.195 -7.388 1.00 0.02 O ATOM 639 CB VAL A 41 12.384 -5.215 -5.860 1.00 0.01 C ATOM 640 CG1 VAL A 41 11.808 -6.101 -4.751 1.00 0.02 C ATOM 641 CG2 VAL A 41 12.021 -3.758 -5.571 1.00 0.00 C ATOM 0 H VAL A 41 14.048 -4.352 -7.753 1.00 0.02 H new ATOM 0 HA VAL A 41 14.252 -5.156 -4.856 1.00 0.01 H new ATOM 0 HB VAL A 41 11.977 -5.518 -6.824 1.00 0.01 H new ATOM 0 HG11 VAL A 41 10.722 -6.008 -4.738 1.00 0.02 H new ATOM 0 HG12 VAL A 41 12.081 -7.140 -4.937 1.00 0.02 H new ATOM 0 HG13 VAL A 41 12.211 -5.787 -3.788 1.00 0.02 H new ATOM 0 HG21 VAL A 41 10.937 -3.648 -5.561 1.00 0.00 H new ATOM 0 HG22 VAL A 41 12.424 -3.468 -4.601 1.00 0.00 H new ATOM 0 HG23 VAL A 41 12.443 -3.117 -6.345 1.00 0.00 H new ATOM 651 N GLU A 42 15.117 -7.428 -5.532 1.00 0.01 N ATOM 652 CA GLU A 42 15.593 -8.780 -5.936 1.00 0.01 C ATOM 653 C GLU A 42 14.570 -9.834 -5.543 1.00 0.02 C ATOM 654 O GLU A 42 14.398 -10.818 -6.233 1.00 0.01 O ATOM 655 CB GLU A 42 16.929 -9.078 -5.253 1.00 0.99 C ATOM 656 CG GLU A 42 17.598 -10.278 -5.928 1.00 1.86 C ATOM 657 CD GLU A 42 18.159 -9.854 -7.286 1.00 3.10 C ATOM 658 OE1 GLU A 42 19.160 -9.157 -7.300 1.00 3.81 O ATOM 659 OE2 GLU A 42 17.580 -10.235 -8.290 1.00 3.67 O ATOM 0 H GLU A 42 15.455 -7.102 -4.626 1.00 0.01 H new ATOM 0 HA GLU A 42 15.725 -8.802 -7.018 1.00 0.01 H new ATOM 0 HB2 GLU A 42 17.580 -8.206 -5.311 1.00 0.99 H new ATOM 0 HB3 GLU A 42 16.769 -9.286 -4.195 1.00 0.99 H new ATOM 0 HG2 GLU A 42 18.398 -10.664 -5.297 1.00 1.86 H new ATOM 0 HG3 GLU A 42 16.877 -11.085 -6.057 1.00 1.86 H new ATOM 666 N GLY A 43 13.892 -9.669 -4.443 1.00 0.01 N ATOM 667 CA GLY A 43 12.903 -10.713 -4.058 1.00 0.02 C ATOM 668 C GLY A 43 11.928 -10.177 -3.021 1.00 0.02 C ATOM 669 O GLY A 43 12.284 -9.354 -2.199 1.00 0.02 O ATOM 0 H GLY A 43 13.975 -8.876 -3.807 1.00 0.01 H new ATOM 0 HA2 GLY A 43 12.356 -11.045 -4.940 1.00 0.02 H new ATOM 0 HA3 GLY A 43 13.423 -11.584 -3.659 1.00 0.02 H new ATOM 673 N GLY A 44 10.715 -10.662 -3.030 1.00 0.00 N ATOM 674 CA GLY A 44 9.718 -10.198 -2.027 1.00 0.01 C ATOM 675 C GLY A 44 9.025 -8.926 -2.522 1.00 0.01 C ATOM 676 O GLY A 44 9.413 -8.333 -3.509 1.00 0.01 O ATOM 0 H GLY A 44 10.373 -11.360 -3.690 1.00 0.00 H new ATOM 0 HA2 GLY A 44 8.978 -10.979 -1.850 1.00 0.01 H new ATOM 0 HA3 GLY A 44 10.212 -10.005 -1.075 1.00 0.01 H new ATOM 680 N THR A 45 8.017 -8.493 -1.811 1.00 0.01 N ATOM 681 CA THR A 45 7.288 -7.238 -2.180 1.00 0.00 C ATOM 682 C THR A 45 7.450 -6.254 -1.024 1.00 0.01 C ATOM 683 O THR A 45 7.360 -6.637 0.124 1.00 0.01 O ATOM 684 CB THR A 45 5.802 -7.559 -2.384 1.00 0.73 C ATOM 685 OG1 THR A 45 5.646 -8.344 -3.558 1.00 0.88 O ATOM 686 CG2 THR A 45 4.998 -6.263 -2.528 1.00 1.48 C ATOM 0 H THR A 45 7.661 -8.961 -0.978 1.00 0.01 H new ATOM 0 HA THR A 45 7.686 -6.812 -3.101 1.00 0.00 H new ATOM 0 HB THR A 45 5.435 -8.111 -1.519 1.00 0.73 H new ATOM 0 HG1 THR A 45 4.697 -8.552 -3.689 1.00 0.88 H new ATOM 0 HG21 THR A 45 3.944 -6.503 -2.672 1.00 1.48 H new ATOM 0 HG22 THR A 45 5.113 -5.661 -1.626 1.00 1.48 H new ATOM 0 HG23 THR A 45 5.364 -5.702 -3.388 1.00 1.48 H new ATOM 694 N TRP A 46 7.762 -5.006 -1.296 1.00 0.02 N ATOM 695 CA TRP A 46 8.002 -4.034 -0.175 1.00 0.01 C ATOM 696 C TRP A 46 7.150 -2.771 -0.307 1.00 0.01 C ATOM 697 O TRP A 46 6.793 -2.333 -1.380 1.00 0.01 O ATOM 698 CB TRP A 46 9.476 -3.623 -0.191 1.00 0.00 C ATOM 699 CG TRP A 46 10.332 -4.825 0.045 1.00 0.01 C ATOM 700 CD1 TRP A 46 10.526 -5.824 -0.844 1.00 0.01 C ATOM 701 CD2 TRP A 46 11.110 -5.170 1.228 1.00 0.01 C ATOM 702 NE1 TRP A 46 11.375 -6.762 -0.284 1.00 0.00 N ATOM 703 CE2 TRP A 46 11.761 -6.402 0.992 1.00 0.01 C ATOM 704 CE3 TRP A 46 11.312 -4.539 2.468 1.00 0.01 C ATOM 705 CZ2 TRP A 46 12.583 -6.991 1.954 1.00 0.01 C ATOM 706 CZ3 TRP A 46 12.138 -5.127 3.439 1.00 0.02 C ATOM 707 CH2 TRP A 46 12.773 -6.350 3.181 1.00 0.01 C ATOM 0 H TRP A 46 7.860 -4.621 -2.235 1.00 0.02 H new ATOM 0 HA TRP A 46 7.730 -4.529 0.757 1.00 0.01 H new ATOM 0 HB2 TRP A 46 9.727 -3.167 -1.149 1.00 0.00 H new ATOM 0 HB3 TRP A 46 9.664 -2.873 0.578 1.00 0.00 H new ATOM 0 HD1 TRP A 46 10.090 -5.881 -1.830 1.00 0.01 H new ATOM 0 HE1 TRP A 46 11.678 -7.614 -0.755 1.00 0.00 H new ATOM 0 HE3 TRP A 46 10.829 -3.596 2.675 1.00 0.01 H new ATOM 0 HZ2 TRP A 46 13.068 -7.934 1.752 1.00 0.01 H new ATOM 0 HZ3 TRP A 46 12.285 -4.635 4.389 1.00 0.02 H new ATOM 0 HH2 TRP A 46 13.409 -6.797 3.931 1.00 0.01 H new ATOM 718 N ALA A 47 6.895 -2.159 0.820 1.00 0.01 N ATOM 719 CA ALA A 47 6.143 -0.872 0.864 1.00 0.01 C ATOM 720 C ALA A 47 7.182 0.183 1.235 1.00 0.01 C ATOM 721 O ALA A 47 7.952 0.003 2.158 1.00 0.01 O ATOM 722 CB ALA A 47 5.037 -0.940 1.922 1.00 0.24 C ATOM 0 H ALA A 47 7.185 -2.508 1.734 1.00 0.01 H new ATOM 0 HA ALA A 47 5.657 -0.645 -0.085 1.00 0.01 H new ATOM 0 HB1 ALA A 47 4.496 0.006 1.944 1.00 0.24 H new ATOM 0 HB2 ALA A 47 4.347 -1.747 1.676 1.00 0.24 H new ATOM 0 HB3 ALA A 47 5.480 -1.127 2.900 1.00 0.24 H new ATOM 728 N VAL A 48 7.195 1.292 0.538 1.00 0.01 N ATOM 729 CA VAL A 48 8.170 2.385 0.855 1.00 0.02 C ATOM 730 C VAL A 48 7.405 3.638 1.268 1.00 0.01 C ATOM 731 O VAL A 48 6.352 3.927 0.733 1.00 0.01 O ATOM 732 CB VAL A 48 9.033 2.684 -0.372 1.00 0.09 C ATOM 733 CG1 VAL A 48 9.813 1.428 -0.761 1.00 0.48 C ATOM 734 CG2 VAL A 48 8.137 3.110 -1.538 1.00 0.65 C ATOM 0 H VAL A 48 6.569 1.490 -0.242 1.00 0.01 H new ATOM 0 HA VAL A 48 8.817 2.068 1.673 1.00 0.02 H new ATOM 0 HB VAL A 48 9.730 3.489 -0.139 1.00 0.09 H new ATOM 0 HG11 VAL A 48 10.429 1.638 -1.635 1.00 0.48 H new ATOM 0 HG12 VAL A 48 10.452 1.125 0.069 1.00 0.48 H new ATOM 0 HG13 VAL A 48 9.115 0.624 -0.994 1.00 0.48 H new ATOM 0 HG21 VAL A 48 8.753 3.323 -2.412 1.00 0.65 H new ATOM 0 HG22 VAL A 48 7.439 2.306 -1.773 1.00 0.65 H new ATOM 0 HG23 VAL A 48 7.580 4.005 -1.261 1.00 0.65 H new ATOM 744 N TYR A 49 7.925 4.380 2.216 1.00 0.01 N ATOM 745 CA TYR A 49 7.229 5.623 2.682 1.00 0.01 C ATOM 746 C TYR A 49 8.136 6.836 2.476 1.00 0.01 C ATOM 747 O TYR A 49 9.347 6.762 2.563 1.00 0.02 O ATOM 748 CB TYR A 49 6.881 5.480 4.162 1.00 0.01 C ATOM 749 CG TYR A 49 5.978 4.281 4.346 1.00 0.00 C ATOM 750 CD1 TYR A 49 6.508 2.988 4.259 1.00 0.01 C ATOM 751 CD2 TYR A 49 4.615 4.461 4.611 1.00 0.01 C ATOM 752 CE1 TYR A 49 5.676 1.876 4.434 1.00 0.01 C ATOM 753 CE2 TYR A 49 3.783 3.348 4.788 1.00 0.01 C ATOM 754 CZ TYR A 49 4.314 2.056 4.699 1.00 0.02 C ATOM 755 OH TYR A 49 3.495 0.959 4.873 1.00 0.01 O ATOM 0 H TYR A 49 8.805 4.178 2.690 1.00 0.01 H new ATOM 0 HA TYR A 49 6.315 5.765 2.105 1.00 0.01 H new ATOM 0 HB2 TYR A 49 7.790 5.360 4.752 1.00 0.01 H new ATOM 0 HB3 TYR A 49 6.385 6.382 4.520 1.00 0.01 H new ATOM 0 HD1 TYR A 49 7.560 2.848 4.057 1.00 0.01 H new ATOM 0 HD2 TYR A 49 4.205 5.458 4.679 1.00 0.01 H new ATOM 0 HE1 TYR A 49 6.085 0.879 4.364 1.00 0.01 H new ATOM 0 HE2 TYR A 49 2.732 3.487 4.993 1.00 0.01 H new ATOM 0 HH TYR A 49 2.872 0.893 4.120 1.00 0.01 H new ATOM 765 N GLU A 50 7.533 7.946 2.150 1.00 0.01 N ATOM 766 CA GLU A 50 8.302 9.190 1.865 1.00 0.01 C ATOM 767 C GLU A 50 9.017 9.705 3.117 1.00 0.01 C ATOM 768 O GLU A 50 10.082 10.282 3.017 1.00 0.02 O ATOM 769 CB GLU A 50 7.325 10.258 1.370 1.00 0.02 C ATOM 770 CG GLU A 50 8.106 11.431 0.775 1.00 0.01 C ATOM 771 CD GLU A 50 7.141 12.567 0.434 1.00 0.02 C ATOM 772 OE1 GLU A 50 6.232 12.333 -0.344 1.00 0.02 O ATOM 773 OE2 GLU A 50 7.328 13.653 0.959 1.00 0.01 O ATOM 0 H GLU A 50 6.521 8.045 2.068 1.00 0.01 H new ATOM 0 HA GLU A 50 9.058 8.970 1.111 1.00 0.01 H new ATOM 0 HB2 GLU A 50 6.657 9.835 0.620 1.00 0.02 H new ATOM 0 HB3 GLU A 50 6.701 10.604 2.194 1.00 0.02 H new ATOM 0 HG2 GLU A 50 8.857 11.779 1.484 1.00 0.01 H new ATOM 0 HG3 GLU A 50 8.638 11.110 -0.121 1.00 0.01 H new ATOM 780 N ARG A 51 8.444 9.535 4.287 1.00 0.02 N ATOM 781 CA ARG A 51 9.106 10.058 5.533 1.00 0.02 C ATOM 782 C ARG A 51 9.280 8.906 6.546 1.00 0.01 C ATOM 783 O ARG A 51 8.581 7.910 6.476 1.00 0.02 O ATOM 784 CB ARG A 51 8.193 11.155 6.131 1.00 0.02 C ATOM 785 CG ARG A 51 8.640 12.541 5.646 1.00 0.01 C ATOM 786 CD ARG A 51 7.637 13.596 6.113 1.00 0.02 C ATOM 787 NE ARG A 51 7.655 13.676 7.601 1.00 0.02 N ATOM 788 CZ ARG A 51 7.111 14.696 8.206 1.00 0.02 C ATOM 789 NH1 ARG A 51 6.556 15.650 7.509 1.00 0.02 N ATOM 790 NH2 ARG A 51 7.125 14.764 9.509 1.00 0.01 N ATOM 0 H ARG A 51 7.553 9.061 4.435 1.00 0.02 H new ATOM 0 HA ARG A 51 10.089 10.470 5.303 1.00 0.02 H new ATOM 0 HB2 ARG A 51 7.158 10.976 5.839 1.00 0.02 H new ATOM 0 HB3 ARG A 51 8.228 11.114 7.220 1.00 0.02 H new ATOM 0 HG2 ARG A 51 9.632 12.771 6.035 1.00 0.01 H new ATOM 0 HG3 ARG A 51 8.713 12.551 4.559 1.00 0.01 H new ATOM 0 HD2 ARG A 51 7.887 14.566 5.683 1.00 0.02 H new ATOM 0 HD3 ARG A 51 6.636 13.341 5.764 1.00 0.02 H new ATOM 0 HE ARG A 51 8.093 12.933 8.146 1.00 0.02 H new ATOM 0 HH11 ARG A 51 6.547 15.599 6.490 1.00 0.02 H new ATOM 0 HH12 ARG A 51 6.131 16.447 7.983 1.00 0.02 H new ATOM 0 HH21 ARG A 51 7.561 14.020 10.054 1.00 0.01 H new ATOM 0 HH22 ARG A 51 6.700 15.561 9.983 1.00 0.01 H new ATOM 804 N PRO A 52 10.209 9.044 7.483 1.00 0.02 N ATOM 805 CA PRO A 52 10.461 7.982 8.502 1.00 0.02 C ATOM 806 C PRO A 52 9.191 7.571 9.255 1.00 0.01 C ATOM 807 O PRO A 52 8.174 8.235 9.222 1.00 0.02 O ATOM 808 CB PRO A 52 11.491 8.646 9.444 1.00 0.02 C ATOM 809 CG PRO A 52 11.704 10.100 8.982 1.00 0.01 C ATOM 810 CD PRO A 52 11.074 10.259 7.591 1.00 0.01 C ATOM 0 HA PRO A 52 10.814 7.052 8.056 1.00 0.02 H new ATOM 0 HB2 PRO A 52 11.133 8.623 10.473 1.00 0.02 H new ATOM 0 HB3 PRO A 52 12.433 8.099 9.422 1.00 0.02 H new ATOM 0 HG2 PRO A 52 11.247 10.794 9.688 1.00 0.01 H new ATOM 0 HG3 PRO A 52 12.768 10.336 8.947 1.00 0.01 H new ATOM 0 HD2 PRO A 52 10.493 11.178 7.512 1.00 0.01 H new ATOM 0 HD3 PRO A 52 11.829 10.290 6.805 1.00 0.01 H new ATOM 818 N ASN A 53 9.291 6.478 9.964 1.00 0.02 N ATOM 819 CA ASN A 53 8.150 5.976 10.779 1.00 0.02 C ATOM 820 C ASN A 53 6.964 5.605 9.891 1.00 0.01 C ATOM 821 O ASN A 53 5.817 5.779 10.251 1.00 0.01 O ATOM 822 CB ASN A 53 7.735 7.055 11.785 1.00 0.01 C ATOM 823 CG ASN A 53 6.905 6.425 12.907 1.00 0.02 C ATOM 824 OD1 ASN A 53 7.348 5.503 13.564 1.00 0.02 O ATOM 825 ND2 ASN A 53 5.710 6.886 13.157 1.00 0.01 N ATOM 0 H ASN A 53 10.132 5.903 10.012 1.00 0.02 H new ATOM 0 HA ASN A 53 8.466 5.078 11.310 1.00 0.02 H new ATOM 0 HB2 ASN A 53 8.620 7.537 12.201 1.00 0.01 H new ATOM 0 HB3 ASN A 53 7.156 7.830 11.283 1.00 0.01 H new ATOM 0 HD21 ASN A 53 5.150 6.473 13.902 1.00 0.01 H new ATOM 0 HD22 ASN A 53 5.336 7.660 12.607 1.00 0.01 H new ATOM 832 N PHE A 54 7.247 5.066 8.736 1.00 0.02 N ATOM 833 CA PHE A 54 6.166 4.641 7.808 1.00 0.01 C ATOM 834 C PHE A 54 5.088 5.720 7.694 1.00 0.01 C ATOM 835 O PHE A 54 3.911 5.464 7.854 1.00 0.02 O ATOM 836 CB PHE A 54 5.553 3.336 8.324 1.00 1.78 C ATOM 837 CG PHE A 54 6.651 2.444 8.861 1.00 2.32 C ATOM 838 CD1 PHE A 54 7.723 2.084 8.036 1.00 2.53 C ATOM 839 CD2 PHE A 54 6.599 1.978 10.183 1.00 2.77 C ATOM 840 CE1 PHE A 54 8.741 1.259 8.529 1.00 3.03 C ATOM 841 CE2 PHE A 54 7.617 1.153 10.675 1.00 3.32 C ATOM 842 CZ PHE A 54 8.689 0.793 9.848 1.00 3.39 C ATOM 0 H PHE A 54 8.194 4.901 8.394 1.00 0.02 H new ATOM 0 HA PHE A 54 6.589 4.485 6.816 1.00 0.01 H new ATOM 0 HB2 PHE A 54 4.825 3.548 9.107 1.00 1.78 H new ATOM 0 HB3 PHE A 54 5.018 2.830 7.520 1.00 1.78 H new ATOM 0 HD1 PHE A 54 7.765 2.443 7.018 1.00 2.53 H new ATOM 0 HD2 PHE A 54 5.773 2.256 10.821 1.00 2.77 H new ATOM 0 HE1 PHE A 54 9.567 0.982 7.891 1.00 3.03 H new ATOM 0 HE2 PHE A 54 7.576 0.794 11.693 1.00 3.32 H new ATOM 0 HZ PHE A 54 9.475 0.157 10.228 1.00 3.39 H new ATOM 852 N SER A 55 5.503 6.934 7.415 1.00 0.02 N ATOM 853 CA SER A 55 4.532 8.071 7.278 1.00 0.02 C ATOM 854 C SER A 55 4.732 8.772 5.930 1.00 0.01 C ATOM 855 O SER A 55 5.738 8.593 5.269 1.00 0.01 O ATOM 856 CB SER A 55 4.774 9.072 8.409 1.00 1.90 C ATOM 857 OG SER A 55 4.778 8.382 9.653 1.00 2.33 O ATOM 0 H SER A 55 6.481 7.189 7.275 1.00 0.02 H new ATOM 0 HA SER A 55 3.514 7.685 7.331 1.00 0.02 H new ATOM 0 HB2 SER A 55 5.725 9.583 8.260 1.00 1.90 H new ATOM 0 HB3 SER A 55 3.997 9.836 8.406 1.00 1.90 H new ATOM 0 HG SER A 55 5.340 7.582 9.582 1.00 2.33 H new ATOM 863 N GLY A 56 3.774 9.560 5.507 1.00 0.02 N ATOM 864 CA GLY A 56 3.890 10.266 4.193 1.00 0.02 C ATOM 865 C GLY A 56 3.326 9.381 3.073 1.00 0.02 C ATOM 866 O GLY A 56 2.573 8.461 3.321 1.00 0.00 O ATOM 0 H GLY A 56 2.911 9.745 6.019 1.00 0.02 H new ATOM 0 HA2 GLY A 56 3.348 11.211 4.229 1.00 0.02 H new ATOM 0 HA3 GLY A 56 4.934 10.504 3.989 1.00 0.02 H new ATOM 870 N HIS A 57 3.662 9.662 1.841 1.00 0.02 N ATOM 871 CA HIS A 57 3.117 8.845 0.713 1.00 0.02 C ATOM 872 C HIS A 57 3.637 7.411 0.803 1.00 0.01 C ATOM 873 O HIS A 57 4.790 7.189 1.110 1.00 0.01 O ATOM 874 CB HIS A 57 3.551 9.463 -0.616 1.00 0.00 C ATOM 875 CG HIS A 57 3.102 10.897 -0.676 1.00 0.01 C ATOM 876 ND1 HIS A 57 2.143 11.333 -1.576 1.00 0.01 N ATOM 877 CD2 HIS A 57 3.474 12.007 0.042 1.00 0.01 C ATOM 878 CE1 HIS A 57 1.972 12.652 -1.379 1.00 0.02 C ATOM 879 NE2 HIS A 57 2.759 13.114 -0.403 1.00 0.01 N ATOM 0 H HIS A 57 4.288 10.419 1.566 1.00 0.02 H new ATOM 0 HA HIS A 57 2.029 8.832 0.775 1.00 0.02 H new ATOM 0 HB2 HIS A 57 4.635 9.406 -0.718 1.00 0.00 H new ATOM 0 HB3 HIS A 57 3.122 8.902 -1.447 1.00 0.00 H new ATOM 0 HD2 HIS A 57 4.210 12.019 0.832 1.00 0.01 H new ATOM 0 HE1 HIS A 57 1.282 13.264 -1.941 1.00 0.02 H new ATOM 0 HE2 HIS A 57 2.822 14.072 -0.059 1.00 0.01 H new ATOM 887 N MET A 58 2.788 6.440 0.532 1.00 0.02 N ATOM 888 CA MET A 58 3.212 5.000 0.591 1.00 0.02 C ATOM 889 C MET A 58 3.062 4.356 -0.794 1.00 0.01 C ATOM 890 O MET A 58 2.085 4.567 -1.486 1.00 0.01 O ATOM 891 CB MET A 58 2.319 4.256 1.589 1.00 2.61 C ATOM 892 CG MET A 58 2.655 2.763 1.568 1.00 3.46 C ATOM 893 SD MET A 58 1.854 1.943 2.969 1.00 4.50 S ATOM 894 CE MET A 58 0.220 1.753 2.216 1.00 5.01 C ATOM 0 H MET A 58 1.813 6.586 0.271 1.00 0.02 H new ATOM 0 HA MET A 58 4.254 4.942 0.905 1.00 0.02 H new ATOM 0 HB2 MET A 58 2.465 4.657 2.592 1.00 2.61 H new ATOM 0 HB3 MET A 58 1.270 4.406 1.335 1.00 2.61 H new ATOM 0 HG2 MET A 58 2.319 2.317 0.632 1.00 3.46 H new ATOM 0 HG3 MET A 58 3.735 2.622 1.619 1.00 3.46 H new ATOM 0 HE1 MET A 58 -0.435 1.212 2.899 1.00 5.01 H new ATOM 0 HE2 MET A 58 -0.203 2.737 2.011 1.00 5.01 H new ATOM 0 HE3 MET A 58 0.312 1.196 1.284 1.00 5.01 H new ATOM 904 N TYR A 59 4.031 3.571 -1.199 1.00 0.02 N ATOM 905 CA TYR A 59 3.975 2.895 -2.540 1.00 0.01 C ATOM 906 C TYR A 59 4.383 1.420 -2.400 1.00 0.01 C ATOM 907 O TYR A 59 5.313 1.079 -1.697 1.00 0.02 O ATOM 908 CB TYR A 59 4.944 3.581 -3.501 1.00 0.01 C ATOM 909 CG TYR A 59 4.460 4.981 -3.797 1.00 0.01 C ATOM 910 CD1 TYR A 59 3.524 5.195 -4.816 1.00 0.01 C ATOM 911 CD2 TYR A 59 4.950 6.064 -3.058 1.00 0.01 C ATOM 912 CE1 TYR A 59 3.080 6.493 -5.097 1.00 0.02 C ATOM 913 CE2 TYR A 59 4.504 7.361 -3.337 1.00 0.01 C ATOM 914 CZ TYR A 59 3.570 7.576 -4.357 1.00 0.01 C ATOM 915 OH TYR A 59 3.132 8.855 -4.633 1.00 0.01 O ATOM 0 H TYR A 59 4.868 3.366 -0.654 1.00 0.02 H new ATOM 0 HA TYR A 59 2.957 2.961 -2.925 1.00 0.01 H new ATOM 0 HB2 TYR A 59 5.942 3.615 -3.064 1.00 0.01 H new ATOM 0 HB3 TYR A 59 5.021 3.009 -4.426 1.00 0.01 H new ATOM 0 HD1 TYR A 59 3.145 4.359 -5.385 1.00 0.01 H new ATOM 0 HD2 TYR A 59 5.672 5.899 -2.272 1.00 0.01 H new ATOM 0 HE1 TYR A 59 2.360 6.659 -5.884 1.00 0.02 H new ATOM 0 HE2 TYR A 59 4.881 8.196 -2.765 1.00 0.01 H new ATOM 0 HH TYR A 59 3.570 9.489 -4.027 1.00 0.01 H new ATOM 925 N ILE A 60 3.682 0.546 -3.086 1.00 0.02 N ATOM 926 CA ILE A 60 3.999 -0.917 -3.037 1.00 0.01 C ATOM 927 C ILE A 60 4.919 -1.269 -4.215 1.00 0.01 C ATOM 928 O ILE A 60 4.660 -0.889 -5.340 1.00 0.01 O ATOM 929 CB ILE A 60 2.698 -1.727 -3.156 1.00 0.45 C ATOM 930 CG1 ILE A 60 1.600 -1.129 -2.253 1.00 1.35 C ATOM 931 CG2 ILE A 60 2.959 -3.182 -2.763 1.00 1.21 C ATOM 932 CD1 ILE A 60 1.990 -1.220 -0.770 1.00 1.72 C ATOM 0 H ILE A 60 2.893 0.789 -3.685 1.00 0.02 H new ATOM 0 HA ILE A 60 4.492 -1.154 -2.094 1.00 0.01 H new ATOM 0 HB ILE A 60 2.355 -1.686 -4.190 1.00 0.45 H new ATOM 0 HG12 ILE A 60 1.430 -0.087 -2.524 1.00 1.35 H new ATOM 0 HG13 ILE A 60 0.661 -1.658 -2.418 1.00 1.35 H new ATOM 0 HG21 ILE A 60 2.035 -3.753 -2.848 1.00 1.21 H new ATOM 0 HG22 ILE A 60 3.712 -3.608 -3.426 1.00 1.21 H new ATOM 0 HG23 ILE A 60 3.317 -3.222 -1.734 1.00 1.21 H new ATOM 0 HD11 ILE A 60 1.197 -0.791 -0.158 1.00 1.72 H new ATOM 0 HD12 ILE A 60 2.135 -2.265 -0.495 1.00 1.72 H new ATOM 0 HD13 ILE A 60 2.916 -0.669 -0.603 1.00 1.72 H new ATOM 944 N LEU A 61 6.006 -1.968 -3.960 1.00 0.01 N ATOM 945 CA LEU A 61 6.970 -2.320 -5.061 1.00 0.01 C ATOM 946 C LEU A 61 7.114 -3.865 -5.191 1.00 0.01 C ATOM 947 O LEU A 61 7.703 -4.492 -4.330 1.00 0.00 O ATOM 948 CB LEU A 61 8.353 -1.702 -4.705 1.00 0.01 C ATOM 949 CG LEU A 61 8.717 -0.564 -5.677 1.00 0.02 C ATOM 950 CD1 LEU A 61 9.847 0.279 -5.084 1.00 0.01 C ATOM 951 CD2 LEU A 61 9.188 -1.151 -7.011 1.00 0.01 C ATOM 0 H LEU A 61 6.268 -2.310 -3.036 1.00 0.01 H new ATOM 0 HA LEU A 61 6.601 -1.929 -6.009 1.00 0.01 H new ATOM 0 HB2 LEU A 61 8.333 -1.320 -3.684 1.00 0.01 H new ATOM 0 HB3 LEU A 61 9.121 -2.475 -4.741 1.00 0.01 H new ATOM 0 HG LEU A 61 7.836 0.057 -5.838 1.00 0.02 H new ATOM 0 HD11 LEU A 61 10.102 1.083 -5.774 1.00 0.01 H new ATOM 0 HD12 LEU A 61 9.523 0.705 -4.134 1.00 0.01 H new ATOM 0 HD13 LEU A 61 10.722 -0.350 -4.920 1.00 0.01 H new ATOM 0 HD21 LEU A 61 9.444 -0.341 -7.695 1.00 0.01 H new ATOM 0 HD22 LEU A 61 10.065 -1.776 -6.844 1.00 0.01 H new ATOM 0 HD23 LEU A 61 8.390 -1.754 -7.445 1.00 0.01 H new ATOM 963 N PRO A 62 6.627 -4.488 -6.260 1.00 0.02 N ATOM 964 CA PRO A 62 6.806 -5.960 -6.426 1.00 0.01 C ATOM 965 C PRO A 62 8.231 -6.272 -6.915 1.00 0.00 C ATOM 966 O PRO A 62 8.971 -5.382 -7.289 1.00 0.02 O ATOM 967 CB PRO A 62 5.754 -6.297 -7.493 1.00 1.47 C ATOM 968 CG PRO A 62 5.382 -4.990 -8.217 1.00 1.29 C ATOM 969 CD PRO A 62 5.866 -3.808 -7.354 1.00 0.82 C ATOM 0 HA PRO A 62 6.682 -6.535 -5.508 1.00 0.01 H new ATOM 0 HB2 PRO A 62 6.148 -7.027 -8.200 1.00 1.47 H new ATOM 0 HB3 PRO A 62 4.872 -6.743 -7.033 1.00 1.47 H new ATOM 0 HG2 PRO A 62 5.846 -4.956 -9.203 1.00 1.29 H new ATOM 0 HG3 PRO A 62 4.304 -4.933 -8.370 1.00 1.29 H new ATOM 0 HD2 PRO A 62 6.497 -3.124 -7.922 1.00 0.82 H new ATOM 0 HD3 PRO A 62 5.033 -3.223 -6.964 1.00 0.82 H new ATOM 977 N GLN A 63 8.630 -7.517 -6.909 1.00 0.02 N ATOM 978 CA GLN A 63 10.008 -7.862 -7.369 1.00 0.00 C ATOM 979 C GLN A 63 10.264 -7.299 -8.770 1.00 0.00 C ATOM 980 O GLN A 63 9.397 -7.323 -9.622 1.00 0.02 O ATOM 981 CB GLN A 63 10.156 -9.384 -7.405 1.00 1.27 C ATOM 982 CG GLN A 63 9.109 -9.977 -8.348 1.00 1.67 C ATOM 983 CD GLN A 63 9.099 -11.500 -8.207 1.00 2.43 C ATOM 984 OE1 GLN A 63 8.794 -12.022 -7.153 1.00 4.25 O ATOM 985 NE2 GLN A 63 9.422 -12.240 -9.232 1.00 3.04 N ATOM 0 H GLN A 63 8.063 -8.309 -6.606 1.00 0.02 H new ATOM 0 HA GLN A 63 10.730 -7.427 -6.678 1.00 0.00 H new ATOM 0 HB2 GLN A 63 11.157 -9.655 -7.740 1.00 1.27 H new ATOM 0 HB3 GLN A 63 10.033 -9.796 -6.403 1.00 1.27 H new ATOM 0 HG2 GLN A 63 8.124 -9.573 -8.115 1.00 1.67 H new ATOM 0 HG3 GLN A 63 9.332 -9.698 -9.378 1.00 1.67 H new ATOM 0 HE21 GLN A 63 9.678 -11.802 -10.117 1.00 3.04 H new ATOM 0 HE22 GLN A 63 9.418 -13.257 -9.148 1.00 3.04 H new ATOM 994 N GLY A 64 11.448 -6.794 -9.028 1.00 0.02 N ATOM 995 CA GLY A 64 11.736 -6.242 -10.387 1.00 0.01 C ATOM 996 C GLY A 64 12.856 -5.198 -10.319 1.00 0.02 C ATOM 997 O GLY A 64 13.426 -4.942 -9.277 1.00 0.02 O ATOM 0 H GLY A 64 12.219 -6.741 -8.362 1.00 0.02 H new ATOM 0 HA2 GLY A 64 12.025 -7.050 -11.060 1.00 0.01 H new ATOM 0 HA3 GLY A 64 10.834 -5.790 -10.800 1.00 0.01 H new ATOM 1001 N GLU A 65 13.175 -4.597 -11.438 1.00 0.02 N ATOM 1002 CA GLU A 65 14.260 -3.565 -11.479 1.00 0.02 C ATOM 1003 C GLU A 65 13.679 -2.222 -11.926 1.00 0.02 C ATOM 1004 O GLU A 65 12.990 -2.127 -12.922 1.00 0.02 O ATOM 1005 CB GLU A 65 15.326 -4.004 -12.485 1.00 0.77 C ATOM 1006 CG GLU A 65 16.416 -2.933 -12.575 1.00 0.49 C ATOM 1007 CD GLU A 65 17.603 -3.480 -13.369 1.00 0.67 C ATOM 1008 OE1 GLU A 65 17.404 -3.852 -14.514 1.00 0.96 O ATOM 1009 OE2 GLU A 65 18.691 -3.518 -12.819 1.00 0.71 O ATOM 0 H GLU A 65 12.726 -4.779 -12.335 1.00 0.02 H new ATOM 0 HA GLU A 65 14.698 -3.459 -10.487 1.00 0.02 H new ATOM 0 HB2 GLU A 65 15.761 -4.955 -12.178 1.00 0.77 H new ATOM 0 HB3 GLU A 65 14.874 -4.161 -13.464 1.00 0.77 H new ATOM 0 HG2 GLU A 65 16.023 -2.038 -13.058 1.00 0.49 H new ATOM 0 HG3 GLU A 65 16.737 -2.641 -11.575 1.00 0.49 H new ATOM 1016 N TYR A 66 13.977 -1.179 -11.188 1.00 0.02 N ATOM 1017 CA TYR A 66 13.484 0.188 -11.536 1.00 0.02 C ATOM 1018 C TYR A 66 14.712 1.099 -11.744 1.00 0.02 C ATOM 1019 O TYR A 66 15.280 1.590 -10.783 1.00 0.02 O ATOM 1020 CB TYR A 66 12.648 0.707 -10.365 1.00 0.01 C ATOM 1021 CG TYR A 66 11.467 -0.216 -10.168 1.00 0.02 C ATOM 1022 CD1 TYR A 66 11.647 -1.454 -9.538 1.00 0.02 C ATOM 1023 CD2 TYR A 66 10.199 0.158 -10.627 1.00 0.01 C ATOM 1024 CE1 TYR A 66 10.557 -2.315 -9.365 1.00 0.02 C ATOM 1025 CE2 TYR A 66 9.110 -0.704 -10.456 1.00 0.02 C ATOM 1026 CZ TYR A 66 9.289 -1.941 -9.826 1.00 0.02 C ATOM 1027 OH TYR A 66 8.215 -2.791 -9.658 1.00 0.01 O ATOM 0 H TYR A 66 14.551 -1.220 -10.346 1.00 0.02 H new ATOM 0 HA TYR A 66 12.877 0.172 -12.441 1.00 0.02 H new ATOM 0 HB2 TYR A 66 13.252 0.748 -9.458 1.00 0.01 H new ATOM 0 HB3 TYR A 66 12.305 1.722 -10.566 1.00 0.01 H new ATOM 0 HD1 TYR A 66 12.626 -1.744 -9.186 1.00 0.02 H new ATOM 0 HD2 TYR A 66 10.061 1.112 -11.113 1.00 0.01 H new ATOM 0 HE1 TYR A 66 10.694 -3.268 -8.876 1.00 0.02 H new ATOM 0 HE2 TYR A 66 8.132 -0.415 -10.810 1.00 0.02 H new ATOM 0 HH TYR A 66 7.409 -2.378 -10.033 1.00 0.01 H new ATOM 1037 N PRO A 67 15.153 1.314 -12.975 1.00 0.01 N ATOM 1038 CA PRO A 67 16.356 2.160 -13.215 1.00 0.02 C ATOM 1039 C PRO A 67 16.129 3.652 -12.923 1.00 0.02 C ATOM 1040 O PRO A 67 17.050 4.439 -12.995 1.00 0.02 O ATOM 1041 CB PRO A 67 16.656 1.916 -14.711 1.00 0.02 C ATOM 1042 CG PRO A 67 15.491 1.106 -15.318 1.00 0.02 C ATOM 1043 CD PRO A 67 14.507 0.738 -14.192 1.00 0.01 C ATOM 0 HA PRO A 67 17.177 1.896 -12.549 1.00 0.02 H new ATOM 0 HB2 PRO A 67 16.770 2.865 -15.234 1.00 0.02 H new ATOM 0 HB3 PRO A 67 17.595 1.374 -14.826 1.00 0.02 H new ATOM 0 HG2 PRO A 67 14.985 1.690 -16.087 1.00 0.02 H new ATOM 0 HG3 PRO A 67 15.868 0.204 -15.800 1.00 0.02 H new ATOM 0 HD2 PRO A 67 13.519 1.165 -14.364 1.00 0.01 H new ATOM 0 HD3 PRO A 67 14.377 -0.341 -14.107 1.00 0.01 H new ATOM 1051 N GLU A 68 14.934 4.056 -12.577 1.00 0.01 N ATOM 1052 CA GLU A 68 14.706 5.499 -12.274 1.00 0.01 C ATOM 1053 C GLU A 68 13.465 5.609 -11.390 1.00 0.03 C ATOM 1054 O GLU A 68 12.607 4.750 -11.379 1.00 0.02 O ATOM 1055 CB GLU A 68 14.464 6.282 -13.570 1.00 0.69 C ATOM 1056 CG GLU A 68 15.751 6.348 -14.392 1.00 1.09 C ATOM 1057 CD GLU A 68 15.603 7.406 -15.488 1.00 1.35 C ATOM 1058 OE1 GLU A 68 14.961 8.410 -15.232 1.00 1.55 O ATOM 1059 OE2 GLU A 68 16.135 7.192 -16.565 1.00 2.02 O ATOM 0 H GLU A 68 14.114 3.455 -12.492 1.00 0.01 H new ATOM 0 HA GLU A 68 15.581 5.911 -11.771 1.00 0.01 H new ATOM 0 HB2 GLU A 68 13.676 5.803 -14.151 1.00 0.69 H new ATOM 0 HB3 GLU A 68 14.120 7.290 -13.336 1.00 0.69 H new ATOM 0 HG2 GLU A 68 16.595 6.593 -13.747 1.00 1.09 H new ATOM 0 HG3 GLU A 68 15.961 5.375 -14.837 1.00 1.09 H new ATOM 1066 N TYR A 69 13.393 6.652 -10.614 1.00 0.02 N ATOM 1067 CA TYR A 69 12.247 6.811 -9.678 1.00 0.02 C ATOM 1068 C TYR A 69 10.910 6.852 -10.420 1.00 0.01 C ATOM 1069 O TYR A 69 9.923 6.307 -9.969 1.00 0.01 O ATOM 1070 CB TYR A 69 12.442 8.077 -8.838 1.00 0.02 C ATOM 1071 CG TYR A 69 12.458 9.291 -9.737 1.00 0.02 C ATOM 1072 CD1 TYR A 69 13.628 9.640 -10.420 1.00 0.02 C ATOM 1073 CD2 TYR A 69 11.303 10.071 -9.882 1.00 0.02 C ATOM 1074 CE1 TYR A 69 13.645 10.768 -11.250 1.00 0.02 C ATOM 1075 CE2 TYR A 69 11.321 11.200 -10.710 1.00 0.02 C ATOM 1076 CZ TYR A 69 12.491 11.547 -11.394 1.00 0.02 C ATOM 1077 OH TYR A 69 12.508 12.659 -12.211 1.00 0.01 O ATOM 0 H TYR A 69 14.081 7.404 -10.587 1.00 0.02 H new ATOM 0 HA TYR A 69 12.220 5.943 -9.020 1.00 0.02 H new ATOM 0 HB2 TYR A 69 11.639 8.166 -8.106 1.00 0.02 H new ATOM 0 HB3 TYR A 69 13.376 8.014 -8.280 1.00 0.02 H new ATOM 0 HD1 TYR A 69 14.518 9.039 -10.307 1.00 0.02 H new ATOM 0 HD2 TYR A 69 10.399 9.802 -9.355 1.00 0.02 H new ATOM 0 HE1 TYR A 69 14.548 11.037 -11.778 1.00 0.02 H new ATOM 0 HE2 TYR A 69 10.432 11.803 -10.821 1.00 0.02 H new ATOM 0 HH TYR A 69 11.967 12.486 -13.010 1.00 0.01 H new ATOM 1087 N GLN A 70 10.866 7.495 -11.556 1.00 0.01 N ATOM 1088 CA GLN A 70 9.595 7.572 -12.331 1.00 0.02 C ATOM 1089 C GLN A 70 9.118 6.165 -12.711 1.00 0.01 C ATOM 1090 O GLN A 70 7.948 5.935 -12.947 1.00 0.02 O ATOM 1091 CB GLN A 70 9.834 8.377 -13.609 1.00 0.01 C ATOM 1092 CG GLN A 70 10.411 9.748 -13.253 1.00 0.01 C ATOM 1093 CD GLN A 70 10.563 10.585 -14.524 1.00 0.02 C ATOM 1094 OE1 GLN A 70 10.805 11.774 -14.458 1.00 0.01 O ATOM 1095 NE2 GLN A 70 10.429 10.011 -15.689 1.00 0.02 N ATOM 0 H GLN A 70 11.660 7.972 -11.982 1.00 0.01 H new ATOM 0 HA GLN A 70 8.835 8.054 -11.717 1.00 0.02 H new ATOM 0 HB2 GLN A 70 10.521 7.842 -14.265 1.00 0.01 H new ATOM 0 HB3 GLN A 70 8.899 8.496 -14.156 1.00 0.01 H new ATOM 0 HG2 GLN A 70 9.756 10.257 -12.546 1.00 0.01 H new ATOM 0 HG3 GLN A 70 11.378 9.631 -12.764 1.00 0.01 H new ATOM 0 HE21 GLN A 70 10.226 9.013 -15.745 1.00 0.02 H new ATOM 0 HE22 GLN A 70 10.527 10.561 -16.543 1.00 0.02 H new ATOM 1104 N ARG A 71 10.025 5.223 -12.768 1.00 0.01 N ATOM 1105 CA ARG A 71 9.631 3.830 -13.129 1.00 0.02 C ATOM 1106 C ARG A 71 8.823 3.231 -11.977 1.00 0.01 C ATOM 1107 O ARG A 71 8.110 2.259 -12.132 1.00 0.02 O ATOM 1108 CB ARG A 71 10.883 2.983 -13.384 1.00 0.34 C ATOM 1109 CG ARG A 71 10.506 1.689 -14.134 1.00 0.72 C ATOM 1110 CD ARG A 71 10.484 1.936 -15.649 1.00 1.04 C ATOM 1111 NE ARG A 71 11.818 2.432 -16.090 1.00 1.67 N ATOM 1112 CZ ARG A 71 12.131 2.428 -17.357 1.00 2.47 C ATOM 1113 NH1 ARG A 71 11.277 1.986 -18.240 1.00 2.54 N ATOM 1114 NH2 ARG A 71 13.300 2.865 -17.741 1.00 3.42 N ATOM 0 H ARG A 71 11.018 5.359 -12.581 1.00 0.01 H new ATOM 0 HA ARG A 71 9.027 3.842 -14.036 1.00 0.02 H new ATOM 0 HB2 ARG A 71 11.604 3.554 -13.969 1.00 0.34 H new ATOM 0 HB3 ARG A 71 11.363 2.737 -12.437 1.00 0.34 H new ATOM 0 HG2 ARG A 71 11.222 0.902 -13.898 1.00 0.72 H new ATOM 0 HG3 ARG A 71 9.528 1.340 -13.802 1.00 0.72 H new ATOM 0 HD2 ARG A 71 10.234 1.015 -16.175 1.00 1.04 H new ATOM 0 HD3 ARG A 71 9.712 2.664 -15.898 1.00 1.04 H new ATOM 0 HE ARG A 71 12.487 2.775 -15.401 1.00 1.67 H new ATOM 0 HH11 ARG A 71 10.364 1.643 -17.940 1.00 2.54 H new ATOM 0 HH12 ARG A 71 11.522 1.983 -19.230 1.00 2.54 H new ATOM 0 HH21 ARG A 71 13.968 3.209 -17.051 1.00 3.42 H new ATOM 0 HH22 ARG A 71 13.545 2.862 -18.731 1.00 3.42 H new ATOM 1128 N TRP A 72 8.942 3.823 -10.818 1.00 0.02 N ATOM 1129 CA TRP A 72 8.207 3.338 -9.612 1.00 0.01 C ATOM 1130 C TRP A 72 7.100 4.356 -9.310 1.00 0.01 C ATOM 1131 O TRP A 72 6.466 4.332 -8.276 1.00 0.02 O ATOM 1132 CB TRP A 72 9.241 3.215 -8.464 1.00 0.02 C ATOM 1133 CG TRP A 72 8.664 3.558 -7.123 1.00 0.01 C ATOM 1134 CD1 TRP A 72 7.667 2.888 -6.500 1.00 0.01 C ATOM 1135 CD2 TRP A 72 9.065 4.630 -6.221 1.00 0.02 C ATOM 1136 NE1 TRP A 72 7.421 3.492 -5.280 1.00 0.02 N ATOM 1137 CE2 TRP A 72 8.258 4.568 -5.063 1.00 0.02 C ATOM 1138 CE3 TRP A 72 10.038 5.644 -6.299 1.00 0.01 C ATOM 1139 CZ2 TRP A 72 8.410 5.479 -4.017 1.00 0.02 C ATOM 1140 CZ3 TRP A 72 10.195 6.562 -5.247 1.00 0.02 C ATOM 1141 CH2 TRP A 72 9.382 6.479 -4.109 1.00 0.02 C ATOM 0 H TRP A 72 9.530 4.640 -10.653 1.00 0.02 H new ATOM 0 HA TRP A 72 7.738 2.364 -9.751 1.00 0.01 H new ATOM 0 HB2 TRP A 72 9.629 2.197 -8.438 1.00 0.02 H new ATOM 0 HB3 TRP A 72 10.086 3.872 -8.670 1.00 0.02 H new ATOM 0 HD1 TRP A 72 7.149 2.025 -6.891 1.00 0.01 H new ATOM 0 HE1 TRP A 72 6.708 3.180 -4.621 1.00 0.02 H new ATOM 0 HE3 TRP A 72 10.668 5.717 -7.173 1.00 0.01 H new ATOM 0 HZ2 TRP A 72 7.781 5.412 -3.142 1.00 0.02 H new ATOM 0 HZ3 TRP A 72 10.946 7.335 -5.316 1.00 0.02 H new ATOM 0 HH2 TRP A 72 9.506 7.187 -3.303 1.00 0.02 H new ATOM 1152 N MET A 73 6.875 5.254 -10.232 1.00 0.02 N ATOM 1153 CA MET A 73 5.824 6.298 -10.055 1.00 0.02 C ATOM 1154 C MET A 73 6.109 7.138 -8.804 1.00 0.01 C ATOM 1155 O MET A 73 5.229 7.752 -8.234 1.00 0.02 O ATOM 1156 CB MET A 73 4.441 5.639 -9.936 1.00 0.02 C ATOM 1157 CG MET A 73 4.159 4.794 -11.184 1.00 0.01 C ATOM 1158 SD MET A 73 5.015 3.206 -11.049 1.00 0.01 S ATOM 1159 CE MET A 73 4.949 2.764 -12.802 1.00 0.01 C ATOM 0 H MET A 73 7.384 5.309 -11.114 1.00 0.02 H new ATOM 0 HA MET A 73 5.835 6.952 -10.927 1.00 0.02 H new ATOM 0 HB2 MET A 73 4.402 5.012 -9.045 1.00 0.02 H new ATOM 0 HB3 MET A 73 3.672 6.403 -9.822 1.00 0.02 H new ATOM 0 HG2 MET A 73 3.086 4.632 -11.291 1.00 0.01 H new ATOM 0 HG3 MET A 73 4.492 5.323 -12.077 1.00 0.01 H new ATOM 0 HE1 MET A 73 5.430 1.798 -12.952 1.00 0.01 H new ATOM 0 HE2 MET A 73 3.909 2.705 -13.123 1.00 0.01 H new ATOM 0 HE3 MET A 73 5.468 3.523 -13.388 1.00 0.01 H new ATOM 1169 N GLY A 74 7.345 7.162 -8.379 1.00 0.02 N ATOM 1170 CA GLY A 74 7.706 7.955 -7.170 1.00 0.02 C ATOM 1171 C GLY A 74 7.359 9.423 -7.404 1.00 0.01 C ATOM 1172 O GLY A 74 7.505 9.938 -8.494 1.00 0.01 O ATOM 0 H GLY A 74 8.120 6.666 -8.818 1.00 0.02 H new ATOM 0 HA2 GLY A 74 7.169 7.577 -6.300 1.00 0.02 H new ATOM 0 HA3 GLY A 74 8.770 7.851 -6.958 1.00 0.02 H new ATOM 1176 N LEU A 75 6.937 10.117 -6.380 1.00 0.02 N ATOM 1177 CA LEU A 75 6.631 11.564 -6.549 1.00 0.02 C ATOM 1178 C LEU A 75 7.960 12.329 -6.524 1.00 0.01 C ATOM 1179 O LEU A 75 8.125 13.335 -7.184 1.00 0.02 O ATOM 1180 CB LEU A 75 5.715 12.031 -5.411 1.00 0.55 C ATOM 1181 CG LEU A 75 5.544 13.556 -5.452 1.00 0.58 C ATOM 1182 CD1 LEU A 75 5.063 13.996 -6.841 1.00 0.98 C ATOM 1183 CD2 LEU A 75 4.512 13.970 -4.398 1.00 0.42 C ATOM 0 H LEU A 75 6.792 9.746 -5.441 1.00 0.02 H new ATOM 0 HA LEU A 75 6.117 11.747 -7.493 1.00 0.02 H new ATOM 0 HB2 LEU A 75 4.742 11.547 -5.497 1.00 0.55 H new ATOM 0 HB3 LEU A 75 6.136 11.732 -4.451 1.00 0.55 H new ATOM 0 HG LEU A 75 6.502 14.033 -5.244 1.00 0.58 H new ATOM 0 HD11 LEU A 75 4.945 15.079 -6.859 1.00 0.98 H new ATOM 0 HD12 LEU A 75 5.796 13.698 -7.591 1.00 0.98 H new ATOM 0 HD13 LEU A 75 4.106 13.523 -7.061 1.00 0.98 H new ATOM 0 HD21 LEU A 75 4.384 15.052 -4.420 1.00 0.42 H new ATOM 0 HD22 LEU A 75 3.559 13.487 -4.613 1.00 0.42 H new ATOM 0 HD23 LEU A 75 4.858 13.665 -3.410 1.00 0.42 H new ATOM 1195 N ASN A 76 8.920 11.833 -5.785 1.00 0.01 N ATOM 1196 CA ASN A 76 10.261 12.468 -5.711 1.00 0.02 C ATOM 1197 C ASN A 76 11.237 11.373 -5.274 1.00 0.02 C ATOM 1198 O ASN A 76 10.873 10.215 -5.219 1.00 0.02 O ATOM 1199 CB ASN A 76 10.247 13.608 -4.690 1.00 0.02 C ATOM 1200 CG ASN A 76 11.519 14.446 -4.845 1.00 0.02 C ATOM 1201 OD1 ASN A 76 12.123 14.839 -3.867 1.00 0.01 O ATOM 1202 ND2 ASN A 76 11.952 14.739 -6.040 1.00 0.02 N ATOM 0 H ASN A 76 8.822 10.992 -5.217 1.00 0.01 H new ATOM 0 HA ASN A 76 10.553 12.892 -6.672 1.00 0.02 H new ATOM 0 HB2 ASN A 76 9.366 14.233 -4.838 1.00 0.02 H new ATOM 0 HB3 ASN A 76 10.185 13.205 -3.679 1.00 0.02 H new ATOM 0 HD21 ASN A 76 12.798 15.298 -6.153 1.00 0.02 H new ATOM 0 HD22 ASN A 76 11.445 14.409 -6.861 1.00 0.02 H new ATOM 1209 N ASP A 77 12.467 11.702 -4.975 1.00 0.01 N ATOM 1210 CA ASP A 77 13.443 10.643 -4.562 1.00 0.01 C ATOM 1211 C ASP A 77 13.559 10.582 -3.034 1.00 0.01 C ATOM 1212 O ASP A 77 14.597 10.225 -2.508 1.00 0.01 O ATOM 1213 CB ASP A 77 14.818 10.978 -5.148 1.00 0.01 C ATOM 1214 CG ASP A 77 15.114 12.463 -4.930 1.00 0.01 C ATOM 1215 OD1 ASP A 77 14.500 13.045 -4.050 1.00 0.02 O ATOM 1216 OD2 ASP A 77 15.947 12.991 -5.646 1.00 0.01 O ATOM 0 H ASP A 77 12.839 12.652 -4.998 1.00 0.01 H new ATOM 0 HA ASP A 77 13.093 9.679 -4.930 1.00 0.01 H new ATOM 0 HB2 ASP A 77 15.587 10.369 -4.672 1.00 0.01 H new ATOM 0 HB3 ASP A 77 14.839 10.744 -6.212 1.00 0.01 H new ATOM 1221 N ARG A 78 12.525 10.942 -2.310 1.00 0.01 N ATOM 1222 CA ARG A 78 12.609 10.920 -0.813 1.00 0.01 C ATOM 1223 C ARG A 78 11.997 9.634 -0.241 1.00 0.02 C ATOM 1224 O ARG A 78 10.834 9.347 -0.440 1.00 0.02 O ATOM 1225 CB ARG A 78 11.870 12.134 -0.247 1.00 0.43 C ATOM 1226 CG ARG A 78 12.545 13.417 -0.734 1.00 0.80 C ATOM 1227 CD ARG A 78 12.017 14.608 0.069 1.00 1.00 C ATOM 1228 NE ARG A 78 12.512 14.520 1.472 1.00 1.30 N ATOM 1229 CZ ARG A 78 12.437 15.561 2.258 1.00 2.30 C ATOM 1230 NH1 ARG A 78 11.927 16.678 1.814 1.00 2.72 N ATOM 1231 NH2 ARG A 78 12.872 15.484 3.486 1.00 3.20 N ATOM 0 H ARG A 78 11.629 11.249 -2.689 1.00 0.01 H new ATOM 0 HA ARG A 78 13.660 10.953 -0.526 1.00 0.01 H new ATOM 0 HB2 ARG A 78 10.827 12.117 -0.563 1.00 0.43 H new ATOM 0 HB3 ARG A 78 11.874 12.100 0.842 1.00 0.43 H new ATOM 0 HG2 ARG A 78 13.626 13.338 -0.619 1.00 0.80 H new ATOM 0 HG3 ARG A 78 12.347 13.564 -1.796 1.00 0.80 H new ATOM 0 HD2 ARG A 78 12.347 15.542 -0.386 1.00 1.00 H new ATOM 0 HD3 ARG A 78 10.927 14.614 0.056 1.00 1.00 H new ATOM 0 HE ARG A 78 12.909 13.647 1.819 1.00 1.30 H new ATOM 0 HH11 ARG A 78 11.587 16.738 0.854 1.00 2.72 H new ATOM 0 HH12 ARG A 78 11.868 17.491 2.427 1.00 2.72 H new ATOM 0 HH21 ARG A 78 13.271 14.611 3.832 1.00 3.20 H new ATOM 0 HH22 ARG A 78 12.814 16.297 4.100 1.00 3.20 H new ATOM 1245 N LEU A 79 12.765 8.887 0.509 1.00 0.01 N ATOM 1246 CA LEU A 79 12.243 7.640 1.156 1.00 0.01 C ATOM 1247 C LEU A 79 12.879 7.545 2.544 1.00 0.01 C ATOM 1248 O LEU A 79 14.087 7.512 2.671 1.00 0.02 O ATOM 1249 CB LEU A 79 12.633 6.399 0.339 1.00 1.04 C ATOM 1250 CG LEU A 79 11.816 6.324 -0.964 1.00 1.85 C ATOM 1251 CD1 LEU A 79 12.258 5.091 -1.770 1.00 2.40 C ATOM 1252 CD2 LEU A 79 10.303 6.221 -0.651 1.00 2.61 C ATOM 0 H LEU A 79 13.745 9.089 0.705 1.00 0.01 H new ATOM 0 HA LEU A 79 11.155 7.681 1.216 1.00 0.01 H new ATOM 0 HB2 LEU A 79 13.697 6.432 0.105 1.00 1.04 H new ATOM 0 HB3 LEU A 79 12.464 5.500 0.932 1.00 1.04 H new ATOM 0 HG LEU A 79 11.992 7.230 -1.544 1.00 1.85 H new ATOM 0 HD11 LEU A 79 11.682 5.034 -2.693 1.00 2.40 H new ATOM 0 HD12 LEU A 79 13.318 5.173 -2.008 1.00 2.40 H new ATOM 0 HD13 LEU A 79 12.087 4.190 -1.180 1.00 2.40 H new ATOM 0 HD21 LEU A 79 9.741 6.169 -1.584 1.00 2.61 H new ATOM 0 HD22 LEU A 79 10.113 5.323 -0.063 1.00 2.61 H new ATOM 0 HD23 LEU A 79 9.988 7.098 -0.086 1.00 2.61 H new ATOM 1264 N GLY A 80 12.085 7.549 3.587 1.00 0.02 N ATOM 1265 CA GLY A 80 12.650 7.511 4.976 1.00 0.02 C ATOM 1266 C GLY A 80 12.452 6.146 5.644 1.00 0.02 C ATOM 1267 O GLY A 80 13.118 5.832 6.609 1.00 0.01 O ATOM 0 H GLY A 80 11.067 7.577 3.538 1.00 0.02 H new ATOM 0 HA2 GLY A 80 13.714 7.745 4.940 1.00 0.02 H new ATOM 0 HA3 GLY A 80 12.174 8.282 5.581 1.00 0.02 H new ATOM 1271 N SER A 81 11.558 5.322 5.162 1.00 0.01 N ATOM 1272 CA SER A 81 11.362 3.993 5.817 1.00 0.01 C ATOM 1273 C SER A 81 10.775 2.998 4.822 1.00 0.02 C ATOM 1274 O SER A 81 10.129 3.362 3.858 1.00 0.01 O ATOM 1275 CB SER A 81 10.408 4.147 6.999 1.00 0.01 C ATOM 1276 OG SER A 81 9.170 4.672 6.537 1.00 0.01 O ATOM 0 H SER A 81 10.963 5.507 4.355 1.00 0.01 H new ATOM 0 HA SER A 81 12.326 3.623 6.165 1.00 0.01 H new ATOM 0 HB2 SER A 81 10.250 3.183 7.482 1.00 0.01 H new ATOM 0 HB3 SER A 81 10.841 4.811 7.747 1.00 0.01 H new ATOM 0 HG SER A 81 9.192 5.651 6.582 1.00 0.01 H new ATOM 1282 N CYS A 82 10.998 1.731 5.062 1.00 0.02 N ATOM 1283 CA CYS A 82 10.459 0.680 4.146 1.00 0.01 C ATOM 1284 C CYS A 82 10.070 -0.561 4.957 1.00 0.01 C ATOM 1285 O CYS A 82 10.682 -0.874 5.957 1.00 0.01 O ATOM 1286 CB CYS A 82 11.523 0.302 3.113 1.00 0.01 C ATOM 1287 SG CYS A 82 12.865 -0.594 3.933 1.00 0.02 S ATOM 0 H CYS A 82 11.532 1.378 5.856 1.00 0.02 H new ATOM 0 HA CYS A 82 9.579 1.068 3.633 1.00 0.01 H new ATOM 0 HB2 CYS A 82 11.083 -0.316 2.331 1.00 0.01 H new ATOM 0 HB3 CYS A 82 11.911 1.199 2.630 1.00 0.01 H new ATOM 0 HG CYS A 82 12.444 -1.058 5.072 1.00 0.02 H new ATOM 1293 N ARG A 83 9.062 -1.273 4.522 1.00 0.01 N ATOM 1294 CA ARG A 83 8.625 -2.507 5.254 1.00 0.01 C ATOM 1295 C ARG A 83 8.323 -3.611 4.241 1.00 0.01 C ATOM 1296 O ARG A 83 7.793 -3.366 3.175 1.00 0.01 O ATOM 1297 CB ARG A 83 7.341 -2.216 6.033 1.00 0.01 C ATOM 1298 CG ARG A 83 7.594 -1.097 7.045 1.00 0.01 C ATOM 1299 CD ARG A 83 6.408 -1.004 8.008 1.00 0.01 C ATOM 1300 NE ARG A 83 5.155 -0.791 7.230 1.00 0.01 N ATOM 1301 CZ ARG A 83 3.993 -0.976 7.799 1.00 0.01 C ATOM 1302 NH1 ARG A 83 3.929 -1.345 9.048 1.00 0.01 N ATOM 1303 NH2 ARG A 83 2.895 -0.792 7.117 1.00 0.01 N ATOM 0 H ARG A 83 8.518 -1.054 3.687 1.00 0.01 H new ATOM 0 HA ARG A 83 9.417 -2.816 5.936 1.00 0.01 H new ATOM 0 HB2 ARG A 83 6.546 -1.926 5.347 1.00 0.01 H new ATOM 0 HB3 ARG A 83 7.005 -3.116 6.548 1.00 0.01 H new ATOM 0 HG2 ARG A 83 8.512 -1.294 7.599 1.00 0.01 H new ATOM 0 HG3 ARG A 83 7.731 -0.148 6.527 1.00 0.01 H new ATOM 0 HD2 ARG A 83 6.332 -1.917 8.598 1.00 0.01 H new ATOM 0 HD3 ARG A 83 6.558 -0.183 8.709 1.00 0.01 H new ATOM 0 HE ARG A 83 5.204 -0.501 6.253 1.00 0.01 H new ATOM 0 HH11 ARG A 83 4.786 -1.489 9.582 1.00 0.01 H new ATOM 0 HH12 ARG A 83 3.022 -1.489 9.491 1.00 0.01 H new ATOM 0 HH21 ARG A 83 2.944 -0.504 6.140 1.00 0.01 H new ATOM 0 HH22 ARG A 83 1.988 -0.936 7.561 1.00 0.01 H new ATOM 1317 N ALA A 84 8.661 -4.831 4.565 1.00 0.01 N ATOM 1318 CA ALA A 84 8.399 -5.955 3.626 1.00 0.01 C ATOM 1319 C ALA A 84 6.927 -6.358 3.714 1.00 0.01 C ATOM 1320 O ALA A 84 6.379 -6.541 4.784 1.00 0.00 O ATOM 1321 CB ALA A 84 9.268 -7.155 4.009 1.00 0.43 C ATOM 0 H ALA A 84 9.108 -5.096 5.443 1.00 0.01 H new ATOM 0 HA ALA A 84 8.636 -5.639 2.610 1.00 0.01 H new ATOM 0 HB1 ALA A 84 9.076 -7.978 3.321 1.00 0.43 H new ATOM 0 HB2 ALA A 84 10.320 -6.875 3.954 1.00 0.43 H new ATOM 0 HB3 ALA A 84 9.028 -7.468 5.025 1.00 0.43 H new ATOM 1327 N VAL A 85 6.295 -6.520 2.587 1.00 0.01 N ATOM 1328 CA VAL A 85 4.868 -6.938 2.569 1.00 0.01 C ATOM 1329 C VAL A 85 4.808 -8.462 2.526 1.00 0.01 C ATOM 1330 O VAL A 85 5.359 -9.083 1.640 1.00 0.01 O ATOM 1331 CB VAL A 85 4.175 -6.366 1.329 1.00 0.98 C ATOM 1332 CG1 VAL A 85 2.664 -6.597 1.433 1.00 1.25 C ATOM 1333 CG2 VAL A 85 4.455 -4.864 1.232 1.00 1.12 C ATOM 0 H VAL A 85 6.712 -6.379 1.667 1.00 0.01 H new ATOM 0 HA VAL A 85 4.363 -6.566 3.461 1.00 0.01 H new ATOM 0 HB VAL A 85 4.558 -6.865 0.439 1.00 0.98 H new ATOM 0 HG11 VAL A 85 2.172 -6.189 0.550 1.00 1.25 H new ATOM 0 HG12 VAL A 85 2.463 -7.666 1.499 1.00 1.25 H new ATOM 0 HG13 VAL A 85 2.280 -6.100 2.324 1.00 1.25 H new ATOM 0 HG21 VAL A 85 3.961 -4.458 0.349 1.00 1.12 H new ATOM 0 HG22 VAL A 85 4.074 -4.365 2.123 1.00 1.12 H new ATOM 0 HG23 VAL A 85 5.530 -4.698 1.155 1.00 1.12 H new ATOM 1343 N HIS A 86 4.140 -9.082 3.458 1.00 0.01 N ATOM 1344 CA HIS A 86 4.049 -10.569 3.439 1.00 0.01 C ATOM 1345 C HIS A 86 2.795 -10.958 2.665 1.00 0.01 C ATOM 1346 O HIS A 86 1.723 -10.434 2.893 1.00 0.00 O ATOM 1347 CB HIS A 86 3.942 -11.094 4.872 1.00 0.21 C ATOM 1348 CG HIS A 86 5.033 -10.488 5.710 1.00 0.71 C ATOM 1349 ND1 HIS A 86 4.882 -10.260 7.069 1.00 1.26 N ATOM 1350 CD2 HIS A 86 6.299 -10.058 5.397 1.00 1.20 C ATOM 1351 CE1 HIS A 86 6.028 -9.717 7.519 1.00 1.77 C ATOM 1352 NE2 HIS A 86 6.925 -9.571 6.541 1.00 1.71 N ATOM 0 H HIS A 86 3.654 -8.625 4.230 1.00 0.01 H new ATOM 0 HA HIS A 86 4.935 -10.995 2.968 1.00 0.01 H new ATOM 0 HB2 HIS A 86 2.967 -10.845 5.290 1.00 0.21 H new ATOM 0 HB3 HIS A 86 4.024 -12.181 4.880 1.00 0.21 H new ATOM 0 HD2 HIS A 86 6.742 -10.092 4.413 1.00 1.20 H new ATOM 0 HE1 HIS A 86 6.201 -9.434 8.547 1.00 1.77 H new ATOM 0 HE2 HIS A 86 7.866 -9.186 6.616 1.00 1.71 H new ATOM 1360 N LEU A 87 2.922 -11.876 1.744 1.00 0.01 N ATOM 1361 CA LEU A 87 1.744 -12.309 0.939 1.00 0.01 C ATOM 1362 C LEU A 87 1.179 -13.583 1.567 1.00 0.01 C ATOM 1363 O LEU A 87 1.915 -14.470 1.950 1.00 0.01 O ATOM 1364 CB LEU A 87 2.196 -12.598 -0.509 1.00 0.67 C ATOM 1365 CG LEU A 87 3.380 -11.698 -0.889 1.00 1.25 C ATOM 1366 CD1 LEU A 87 3.759 -11.961 -2.349 1.00 1.63 C ATOM 1367 CD2 LEU A 87 2.996 -10.221 -0.717 1.00 1.34 C ATOM 0 H LEU A 87 3.797 -12.347 1.514 1.00 0.01 H new ATOM 0 HA LEU A 87 0.982 -11.529 0.925 1.00 0.01 H new ATOM 0 HB2 LEU A 87 2.481 -13.646 -0.606 1.00 0.67 H new ATOM 0 HB3 LEU A 87 1.367 -12.429 -1.196 1.00 0.67 H new ATOM 0 HG LEU A 87 4.226 -11.921 -0.239 1.00 1.25 H new ATOM 0 HD11 LEU A 87 4.600 -11.325 -2.627 1.00 1.63 H new ATOM 0 HD12 LEU A 87 4.040 -13.007 -2.469 1.00 1.63 H new ATOM 0 HD13 LEU A 87 2.907 -11.738 -2.992 1.00 1.63 H new ATOM 0 HD21 LEU A 87 3.843 -9.591 -0.989 1.00 1.34 H new ATOM 0 HD22 LEU A 87 2.148 -9.988 -1.361 1.00 1.34 H new ATOM 0 HD23 LEU A 87 2.724 -10.034 0.322 1.00 1.34 H new ATOM 1379 N SER A 88 -0.122 -13.693 1.650 1.00 0.01 N ATOM 1380 CA SER A 88 -0.757 -14.916 2.222 1.00 0.01 C ATOM 1381 C SER A 88 -1.453 -15.677 1.096 1.00 0.01 C ATOM 1382 O SER A 88 -2.295 -15.121 0.420 1.00 0.01 O ATOM 1383 CB SER A 88 -1.793 -14.517 3.273 1.00 0.81 C ATOM 1384 OG SER A 88 -1.128 -13.970 4.405 1.00 1.08 O ATOM 0 H SER A 88 -0.779 -12.977 1.341 1.00 0.01 H new ATOM 0 HA SER A 88 0.004 -15.542 2.688 1.00 0.01 H new ATOM 0 HB2 SER A 88 -2.487 -13.787 2.857 1.00 0.81 H new ATOM 0 HB3 SER A 88 -2.382 -15.385 3.568 1.00 0.81 H new ATOM 0 HG SER A 88 -1.790 -13.712 5.080 1.00 1.08 H new ATOM 1390 N SER A 89 -1.175 -16.942 0.906 1.00 0.01 N ATOM 1391 CA SER A 89 -1.901 -17.709 -0.153 1.00 0.01 C ATOM 1392 C SER A 89 -2.936 -18.557 0.577 1.00 0.01 C ATOM 1393 O SER A 89 -3.319 -18.222 1.680 1.00 0.01 O ATOM 1394 CB SER A 89 -0.926 -18.616 -0.906 1.00 0.43 C ATOM 1395 OG SER A 89 -1.569 -19.146 -2.058 1.00 1.26 O ATOM 0 H SER A 89 -0.483 -17.474 1.433 1.00 0.01 H new ATOM 0 HA SER A 89 -2.365 -17.043 -0.880 1.00 0.01 H new ATOM 0 HB2 SER A 89 -0.039 -18.053 -1.197 1.00 0.43 H new ATOM 0 HB3 SER A 89 -0.591 -19.426 -0.258 1.00 0.43 H new ATOM 0 HG SER A 89 -0.945 -19.726 -2.543 1.00 1.26 H new ATOM 1401 N GLY A 90 -3.375 -19.662 0.029 1.00 0.01 N ATOM 1402 CA GLY A 90 -4.357 -20.520 0.763 1.00 0.00 C ATOM 1403 C GLY A 90 -5.489 -20.993 -0.146 1.00 0.00 C ATOM 1404 O GLY A 90 -5.802 -22.167 -0.185 1.00 0.01 O ATOM 0 H GLY A 90 -3.098 -20.007 -0.890 1.00 0.01 H new ATOM 0 HA2 GLY A 90 -3.842 -21.385 1.182 1.00 0.00 H new ATOM 0 HA3 GLY A 90 -4.773 -19.960 1.601 1.00 0.00 H new ATOM 1408 N GLY A 91 -6.111 -20.114 -0.887 1.00 0.00 N ATOM 1409 CA GLY A 91 -7.208 -20.577 -1.778 1.00 0.00 C ATOM 1410 C GLY A 91 -7.841 -19.417 -2.556 1.00 0.00 C ATOM 1411 O GLY A 91 -7.316 -18.990 -3.565 1.00 0.01 O ATOM 0 H GLY A 91 -5.910 -19.114 -0.913 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -6.819 -21.315 -2.479 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -7.973 -21.075 -1.183 1.00 0.00 H new ATOM 1415 N GLN A 92 -8.966 -18.912 -2.106 1.00 1.80 N ATOM 1416 CA GLN A 92 -9.643 -17.780 -2.831 1.00 2.31 C ATOM 1417 C GLN A 92 -9.782 -16.560 -1.915 1.00 1.91 C ATOM 1418 O GLN A 92 -10.381 -16.618 -0.858 1.00 2.31 O ATOM 1419 CB GLN A 92 -11.016 -18.255 -3.310 1.00 2.11 C ATOM 1420 CG GLN A 92 -11.579 -17.257 -4.325 1.00 2.86 C ATOM 1421 CD GLN A 92 -10.826 -17.399 -5.650 1.00 3.70 C ATOM 1422 OE1 GLN A 92 -10.325 -16.429 -6.183 1.00 3.99 O ATOM 1423 NE2 GLN A 92 -10.724 -18.574 -6.207 1.00 4.43 N ATOM 0 H GLN A 92 -9.448 -19.233 -1.267 1.00 1.80 H new ATOM 0 HA GLN A 92 -9.040 -17.482 -3.689 1.00 2.31 H new ATOM 0 HB2 GLN A 92 -10.932 -19.243 -3.764 1.00 2.11 H new ATOM 0 HB3 GLN A 92 -11.695 -18.350 -2.463 1.00 2.11 H new ATOM 0 HG2 GLN A 92 -12.643 -17.438 -4.478 1.00 2.86 H new ATOM 0 HG3 GLN A 92 -11.480 -16.240 -3.945 1.00 2.86 H new ATOM 0 HE21 GLN A 92 -11.144 -19.389 -5.760 1.00 4.43 H new ATOM 0 HE22 GLN A 92 -10.224 -18.678 -7.090 1.00 4.43 H new ATOM 1432 N ALA A 93 -9.196 -15.458 -2.318 1.00 0.01 N ATOM 1433 CA ALA A 93 -9.248 -14.224 -1.477 1.00 0.01 C ATOM 1434 C ALA A 93 -10.696 -13.719 -1.403 1.00 0.01 C ATOM 1435 O ALA A 93 -11.405 -13.722 -2.390 1.00 0.01 O ATOM 1436 CB ALA A 93 -8.364 -13.146 -2.112 1.00 2.99 C ATOM 0 H ALA A 93 -8.684 -15.361 -3.195 1.00 0.01 H new ATOM 0 HA ALA A 93 -8.890 -14.448 -0.472 1.00 0.01 H new ATOM 0 HB1 ALA A 93 -8.398 -12.243 -1.503 1.00 2.99 H new ATOM 0 HB2 ALA A 93 -7.337 -13.506 -2.171 1.00 2.99 H new ATOM 0 HB3 ALA A 93 -8.728 -12.921 -3.115 1.00 2.99 H new ATOM 1442 N LYS A 94 -11.162 -13.334 -0.225 1.00 0.00 N ATOM 1443 CA LYS A 94 -12.605 -12.880 -0.093 1.00 0.01 C ATOM 1444 C LYS A 94 -12.758 -11.588 0.729 1.00 0.01 C ATOM 1445 O LYS A 94 -12.244 -11.452 1.857 1.00 0.01 O ATOM 1446 CB LYS A 94 -13.424 -13.989 0.575 1.00 2.49 C ATOM 1447 CG LYS A 94 -14.919 -13.726 0.363 1.00 3.43 C ATOM 1448 CD LYS A 94 -15.738 -14.578 1.337 1.00 4.11 C ATOM 1449 CE LYS A 94 -15.330 -16.049 1.212 1.00 5.23 C ATOM 1450 NZ LYS A 94 -14.050 -16.269 1.942 1.00 6.36 N ATOM 0 H LYS A 94 -10.619 -13.313 0.638 1.00 0.00 H new ATOM 0 HA LYS A 94 -12.966 -12.671 -1.100 1.00 0.01 H new ATOM 0 HB2 LYS A 94 -13.152 -14.958 0.156 1.00 2.49 H new ATOM 0 HB3 LYS A 94 -13.199 -14.029 1.641 1.00 2.49 H new ATOM 0 HG2 LYS A 94 -15.137 -12.669 0.517 1.00 3.43 H new ATOM 0 HG3 LYS A 94 -15.197 -13.962 -0.664 1.00 3.43 H new ATOM 0 HD2 LYS A 94 -15.579 -14.233 2.359 1.00 4.11 H new ATOM 0 HD3 LYS A 94 -16.801 -14.467 1.125 1.00 4.11 H new ATOM 0 HE2 LYS A 94 -16.110 -16.691 1.621 1.00 5.23 H new ATOM 0 HE3 LYS A 94 -15.214 -16.318 0.162 1.00 5.23 H new ATOM 0 HZ1 LYS A 94 -14.107 -17.155 2.484 1.00 6.36 H new ATOM 0 HZ2 LYS A 94 -13.267 -16.330 1.260 1.00 6.36 H new ATOM 0 HZ3 LYS A 94 -13.881 -15.476 2.593 1.00 6.36 H new ATOM 1464 N ILE A 95 -13.505 -10.638 0.170 1.00 0.00 N ATOM 1465 CA ILE A 95 -13.761 -9.333 0.859 1.00 0.01 C ATOM 1466 C ILE A 95 -15.270 -8.999 0.823 1.00 0.01 C ATOM 1467 O ILE A 95 -15.944 -9.198 -0.172 1.00 0.01 O ATOM 1468 CB ILE A 95 -12.957 -8.234 0.137 1.00 0.34 C ATOM 1469 CG1 ILE A 95 -13.517 -6.837 0.467 1.00 0.30 C ATOM 1470 CG2 ILE A 95 -13.037 -8.458 -1.373 1.00 0.36 C ATOM 1471 CD1 ILE A 95 -12.534 -5.759 0.001 1.00 1.09 C ATOM 0 H ILE A 95 -13.947 -10.726 -0.745 1.00 0.00 H new ATOM 0 HA ILE A 95 -13.450 -9.396 1.902 1.00 0.01 H new ATOM 0 HB ILE A 95 -11.922 -8.286 0.474 1.00 0.34 H new ATOM 0 HG12 ILE A 95 -14.482 -6.698 -0.021 1.00 0.30 H new ATOM 0 HG13 ILE A 95 -13.687 -6.748 1.540 1.00 0.30 H new ATOM 0 HG21 ILE A 95 -12.469 -7.682 -1.887 1.00 0.36 H new ATOM 0 HG22 ILE A 95 -12.621 -9.435 -1.618 1.00 0.36 H new ATOM 0 HG23 ILE A 95 -14.078 -8.417 -1.692 1.00 0.36 H new ATOM 0 HD11 ILE A 95 -12.936 -4.774 0.237 1.00 1.09 H new ATOM 0 HD12 ILE A 95 -11.579 -5.893 0.509 1.00 1.09 H new ATOM 0 HD13 ILE A 95 -12.386 -5.842 -1.076 1.00 1.09 H new ATOM 1483 N GLN A 96 -15.775 -8.430 1.898 1.00 0.01 N ATOM 1484 CA GLN A 96 -17.218 -7.996 1.957 1.00 0.01 C ATOM 1485 C GLN A 96 -17.240 -6.505 2.321 1.00 0.01 C ATOM 1486 O GLN A 96 -16.462 -6.073 3.145 1.00 0.00 O ATOM 1487 CB GLN A 96 -17.996 -8.821 2.992 1.00 0.53 C ATOM 1488 CG GLN A 96 -17.118 -9.106 4.206 1.00 0.82 C ATOM 1489 CD GLN A 96 -17.989 -9.600 5.363 1.00 1.25 C ATOM 1490 OE1 GLN A 96 -19.024 -9.031 5.647 1.00 1.75 O ATOM 1491 NE2 GLN A 96 -17.612 -10.644 6.049 1.00 2.05 N ATOM 0 H GLN A 96 -15.243 -8.245 2.749 1.00 0.01 H new ATOM 0 HA GLN A 96 -17.700 -8.158 0.993 1.00 0.01 H new ATOM 0 HB2 GLN A 96 -18.891 -8.281 3.300 1.00 0.53 H new ATOM 0 HB3 GLN A 96 -18.328 -9.759 2.546 1.00 0.53 H new ATOM 0 HG2 GLN A 96 -16.367 -9.856 3.957 1.00 0.82 H new ATOM 0 HG3 GLN A 96 -16.582 -8.204 4.500 1.00 0.82 H new ATOM 0 HE21 GLN A 96 -16.743 -11.123 5.812 1.00 2.05 H new ATOM 0 HE22 GLN A 96 -18.186 -10.981 6.822 1.00 2.05 H new ATOM 1500 N VAL A 97 -18.102 -5.704 1.724 1.00 0.01 N ATOM 1501 CA VAL A 97 -18.126 -4.233 2.052 1.00 0.01 C ATOM 1502 C VAL A 97 -19.526 -3.788 2.512 1.00 0.01 C ATOM 1503 O VAL A 97 -20.534 -4.299 2.063 1.00 0.01 O ATOM 1504 CB VAL A 97 -17.727 -3.450 0.800 1.00 0.77 C ATOM 1505 CG1 VAL A 97 -16.370 -3.949 0.297 1.00 1.10 C ATOM 1506 CG2 VAL A 97 -18.779 -3.661 -0.292 1.00 1.03 C ATOM 0 H VAL A 97 -18.786 -6.003 1.028 1.00 0.01 H new ATOM 0 HA VAL A 97 -17.427 -4.040 2.866 1.00 0.01 H new ATOM 0 HB VAL A 97 -17.660 -2.389 1.043 1.00 0.77 H new ATOM 0 HG11 VAL A 97 -16.085 -3.391 -0.595 1.00 1.10 H new ATOM 0 HG12 VAL A 97 -15.618 -3.802 1.072 1.00 1.10 H new ATOM 0 HG13 VAL A 97 -16.439 -5.010 0.055 1.00 1.10 H new ATOM 0 HG21 VAL A 97 -18.494 -3.103 -1.184 1.00 1.03 H new ATOM 0 HG22 VAL A 97 -18.845 -4.722 -0.533 1.00 1.03 H new ATOM 0 HG23 VAL A 97 -19.748 -3.309 0.063 1.00 1.03 H new ATOM 1516 N PHE A 98 -19.580 -2.840 3.433 1.00 0.01 N ATOM 1517 CA PHE A 98 -20.894 -2.346 3.971 1.00 0.01 C ATOM 1518 C PHE A 98 -21.060 -0.841 3.706 1.00 0.01 C ATOM 1519 O PHE A 98 -20.126 -0.052 3.822 1.00 0.01 O ATOM 1520 CB PHE A 98 -20.948 -2.577 5.483 1.00 0.25 C ATOM 1521 CG PHE A 98 -20.970 -4.056 5.791 1.00 0.36 C ATOM 1522 CD1 PHE A 98 -19.778 -4.786 5.779 1.00 0.42 C ATOM 1523 CD2 PHE A 98 -22.177 -4.692 6.106 1.00 0.58 C ATOM 1524 CE1 PHE A 98 -19.790 -6.152 6.079 1.00 0.56 C ATOM 1525 CE2 PHE A 98 -22.189 -6.059 6.409 1.00 0.73 C ATOM 1526 CZ PHE A 98 -20.995 -6.790 6.394 1.00 0.69 C ATOM 0 H PHE A 98 -18.760 -2.386 3.835 1.00 0.01 H new ATOM 0 HA PHE A 98 -21.693 -2.892 3.470 1.00 0.01 H new ATOM 0 HB2 PHE A 98 -20.084 -2.113 5.959 1.00 0.25 H new ATOM 0 HB3 PHE A 98 -21.835 -2.100 5.898 1.00 0.25 H new ATOM 0 HD1 PHE A 98 -18.847 -4.295 5.538 1.00 0.42 H new ATOM 0 HD2 PHE A 98 -23.098 -4.128 6.115 1.00 0.58 H new ATOM 0 HE1 PHE A 98 -18.868 -6.715 6.068 1.00 0.56 H new ATOM 0 HE2 PHE A 98 -23.119 -6.550 6.654 1.00 0.73 H new ATOM 0 HZ PHE A 98 -21.004 -7.845 6.625 1.00 0.69 H new ATOM 1536 N GLU A 99 -22.257 -0.454 3.346 1.00 0.01 N ATOM 1537 CA GLU A 99 -22.538 0.980 3.042 1.00 0.01 C ATOM 1538 C GLU A 99 -22.458 1.856 4.301 1.00 0.01 C ATOM 1539 O GLU A 99 -22.093 3.012 4.220 1.00 0.01 O ATOM 1540 CB GLU A 99 -23.938 1.103 2.439 1.00 0.01 C ATOM 1541 CG GLU A 99 -24.192 2.554 2.026 1.00 0.01 C ATOM 1542 CD GLU A 99 -25.467 2.629 1.181 1.00 0.01 C ATOM 1543 OE1 GLU A 99 -26.490 2.151 1.643 1.00 0.02 O ATOM 1544 OE2 GLU A 99 -25.396 3.162 0.086 1.00 0.01 O ATOM 0 H GLU A 99 -23.059 -1.077 3.249 1.00 0.01 H new ATOM 0 HA GLU A 99 -21.782 1.327 2.338 1.00 0.01 H new ATOM 0 HB2 GLU A 99 -24.032 0.446 1.574 1.00 0.01 H new ATOM 0 HB3 GLU A 99 -24.687 0.784 3.164 1.00 0.01 H new ATOM 0 HG2 GLU A 99 -24.292 3.183 2.911 1.00 0.01 H new ATOM 0 HG3 GLU A 99 -23.344 2.935 1.458 1.00 0.01 H new ATOM 1551 N LYS A 100 -22.804 1.332 5.459 1.00 0.01 N ATOM 1552 CA LYS A 100 -22.755 2.161 6.713 1.00 0.01 C ATOM 1553 C LYS A 100 -21.697 1.612 7.673 1.00 0.01 C ATOM 1554 O LYS A 100 -21.173 0.531 7.490 1.00 0.01 O ATOM 1555 CB LYS A 100 -24.121 2.137 7.402 1.00 0.94 C ATOM 1556 CG LYS A 100 -25.179 2.697 6.451 1.00 1.63 C ATOM 1557 CD LYS A 100 -26.561 2.590 7.101 1.00 2.19 C ATOM 1558 CE LYS A 100 -27.552 3.472 6.341 1.00 2.84 C ATOM 1559 NZ LYS A 100 -27.284 4.905 6.652 1.00 3.18 N ATOM 0 H LYS A 100 -23.117 0.370 5.589 1.00 0.01 H new ATOM 0 HA LYS A 100 -22.496 3.185 6.443 1.00 0.01 H new ATOM 0 HB2 LYS A 100 -24.378 1.117 7.690 1.00 0.94 H new ATOM 0 HB3 LYS A 100 -24.089 2.728 8.317 1.00 0.94 H new ATOM 0 HG2 LYS A 100 -24.956 3.738 6.215 1.00 1.63 H new ATOM 0 HG3 LYS A 100 -25.165 2.147 5.510 1.00 1.63 H new ATOM 0 HD2 LYS A 100 -26.899 1.554 7.092 1.00 2.19 H new ATOM 0 HD3 LYS A 100 -26.509 2.900 8.145 1.00 2.19 H new ATOM 0 HE2 LYS A 100 -27.461 3.299 5.269 1.00 2.84 H new ATOM 0 HE3 LYS A 100 -28.573 3.213 6.620 1.00 2.84 H new ATOM 0 HZ1 LYS A 100 -28.138 5.467 6.461 1.00 3.18 H new ATOM 0 HZ2 LYS A 100 -27.024 5.000 7.654 1.00 3.18 H new ATOM 0 HZ3 LYS A 100 -26.503 5.249 6.058 1.00 3.18 H new ATOM 1573 N GLY A 101 -21.373 2.367 8.684 1.00 0.01 N ATOM 1574 CA GLY A 101 -20.336 1.928 9.660 1.00 0.01 C ATOM 1575 C GLY A 101 -20.847 0.770 10.523 1.00 0.00 C ATOM 1576 O GLY A 101 -22.031 0.505 10.609 1.00 0.01 O ATOM 0 H GLY A 101 -21.786 3.279 8.879 1.00 0.01 H new ATOM 0 HA2 GLY A 101 -19.437 1.619 9.126 1.00 0.01 H new ATOM 0 HA3 GLY A 101 -20.055 2.766 10.299 1.00 0.01 H new ATOM 1580 N ASP A 102 -19.938 0.102 11.182 1.00 0.01 N ATOM 1581 CA ASP A 102 -20.301 -1.031 12.082 1.00 0.00 C ATOM 1582 C ASP A 102 -21.066 -2.123 11.332 1.00 0.00 C ATOM 1583 O ASP A 102 -21.970 -2.740 11.858 1.00 0.01 O ATOM 1584 CB ASP A 102 -21.157 -0.505 13.236 1.00 0.01 C ATOM 1585 CG ASP A 102 -20.538 0.779 13.790 1.00 0.01 C ATOM 1586 OD1 ASP A 102 -19.322 0.847 13.854 1.00 0.01 O ATOM 1587 OD2 ASP A 102 -21.291 1.673 14.141 1.00 0.01 O ATOM 0 H ASP A 102 -18.938 0.299 11.133 1.00 0.01 H new ATOM 0 HA ASP A 102 -19.380 -1.470 12.465 1.00 0.00 H new ATOM 0 HB2 ASP A 102 -22.172 -0.311 12.890 1.00 0.01 H new ATOM 0 HB3 ASP A 102 -21.226 -1.256 14.023 1.00 0.01 H new ATOM 1592 N PHE A 103 -20.675 -2.390 10.117 1.00 0.01 N ATOM 1593 CA PHE A 103 -21.333 -3.470 9.326 1.00 0.01 C ATOM 1594 C PHE A 103 -22.851 -3.290 9.300 1.00 0.00 C ATOM 1595 O PHE A 103 -23.595 -4.191 9.633 1.00 0.01 O ATOM 1596 CB PHE A 103 -20.993 -4.824 9.954 1.00 0.01 C ATOM 1597 CG PHE A 103 -19.525 -4.857 10.311 1.00 0.00 C ATOM 1598 CD1 PHE A 103 -18.564 -4.981 9.301 1.00 0.01 C ATOM 1599 CD2 PHE A 103 -19.124 -4.763 11.650 1.00 0.01 C ATOM 1600 CE1 PHE A 103 -17.203 -5.011 9.628 1.00 0.01 C ATOM 1601 CE2 PHE A 103 -17.763 -4.792 11.977 1.00 0.01 C ATOM 1602 CZ PHE A 103 -16.803 -4.916 10.966 1.00 0.01 C ATOM 0 H PHE A 103 -19.921 -1.902 9.633 1.00 0.01 H new ATOM 0 HA PHE A 103 -20.967 -3.423 8.300 1.00 0.01 H new ATOM 0 HB2 PHE A 103 -21.599 -4.986 10.845 1.00 0.01 H new ATOM 0 HB3 PHE A 103 -21.228 -5.629 9.258 1.00 0.01 H new ATOM 0 HD1 PHE A 103 -18.873 -5.054 8.269 1.00 0.01 H new ATOM 0 HD2 PHE A 103 -19.865 -4.668 12.430 1.00 0.01 H new ATOM 0 HE1 PHE A 103 -16.462 -5.107 8.848 1.00 0.01 H new ATOM 0 HE2 PHE A 103 -17.454 -4.719 13.009 1.00 0.01 H new ATOM 0 HZ PHE A 103 -15.753 -4.938 11.218 1.00 0.01 H new ATOM 1612 N ASN A 104 -23.315 -2.142 8.879 1.00 0.00 N ATOM 1613 CA ASN A 104 -24.786 -1.889 8.788 1.00 0.01 C ATOM 1614 C ASN A 104 -25.089 -1.354 7.387 1.00 0.01 C ATOM 1615 O ASN A 104 -24.196 -0.970 6.656 1.00 0.01 O ATOM 1616 CB ASN A 104 -25.200 -0.851 9.832 1.00 1.68 C ATOM 1617 CG ASN A 104 -26.667 -0.473 9.624 1.00 2.31 C ATOM 1618 OD1 ASN A 104 -26.972 0.643 9.252 1.00 3.15 O ATOM 1619 ND2 ASN A 104 -27.596 -1.361 9.853 1.00 2.38 N ATOM 0 H ASN A 104 -22.730 -1.358 8.590 1.00 0.00 H new ATOM 0 HA ASN A 104 -25.338 -2.810 8.973 1.00 0.01 H new ATOM 0 HB2 ASN A 104 -25.056 -1.252 10.835 1.00 1.68 H new ATOM 0 HB3 ASN A 104 -24.570 0.035 9.749 1.00 1.68 H new ATOM 0 HD21 ASN A 104 -28.578 -1.118 9.720 1.00 2.38 H new ATOM 0 HD22 ASN A 104 -27.340 -2.298 10.165 1.00 2.38 H new ATOM 1626 N GLY A 105 -26.333 -1.338 6.991 1.00 0.01 N ATOM 1627 CA GLY A 105 -26.674 -0.833 5.627 1.00 0.01 C ATOM 1628 C GLY A 105 -26.637 -1.999 4.641 1.00 0.01 C ATOM 1629 O GLY A 105 -26.659 -3.149 5.034 1.00 0.01 O ATOM 0 H GLY A 105 -27.127 -1.651 7.550 1.00 0.01 H new ATOM 0 HA2 GLY A 105 -27.663 -0.375 5.632 1.00 0.01 H new ATOM 0 HA3 GLY A 105 -25.967 -0.061 5.324 1.00 0.01 H new ATOM 1633 N GLN A 106 -26.571 -1.728 3.366 1.00 0.01 N ATOM 1634 CA GLN A 106 -26.521 -2.840 2.378 1.00 0.01 C ATOM 1635 C GLN A 106 -25.119 -3.454 2.382 1.00 0.01 C ATOM 1636 O GLN A 106 -24.118 -2.769 2.502 1.00 0.01 O ATOM 1637 CB GLN A 106 -26.835 -2.292 0.984 1.00 0.01 C ATOM 1638 CG GLN A 106 -27.058 -3.454 0.013 1.00 0.01 C ATOM 1639 CD GLN A 106 -28.409 -4.110 0.303 1.00 0.01 C ATOM 1640 OE1 GLN A 106 -28.466 -5.203 0.831 1.00 0.01 O ATOM 1641 NE2 GLN A 106 -29.508 -3.486 -0.022 1.00 0.01 N ATOM 0 H GLN A 106 -26.550 -0.789 2.968 1.00 0.01 H new ATOM 0 HA GLN A 106 -27.254 -3.602 2.643 1.00 0.01 H new ATOM 0 HB2 GLN A 106 -27.723 -1.661 1.022 1.00 0.01 H new ATOM 0 HB3 GLN A 106 -26.014 -1.666 0.635 1.00 0.01 H new ATOM 0 HG2 GLN A 106 -27.030 -3.093 -1.015 1.00 0.01 H new ATOM 0 HG3 GLN A 106 -26.257 -4.186 0.115 1.00 0.01 H new ATOM 0 HE21 GLN A 106 -29.462 -2.569 -0.465 1.00 0.01 H new ATOM 0 HE22 GLN A 106 -30.413 -3.916 0.167 1.00 0.01 H new ATOM 1650 N MET A 107 -25.055 -4.757 2.254 1.00 0.01 N ATOM 1651 CA MET A 107 -23.740 -5.474 2.251 1.00 0.01 C ATOM 1652 C MET A 107 -23.529 -6.150 0.896 1.00 0.01 C ATOM 1653 O MET A 107 -24.446 -6.673 0.295 1.00 0.01 O ATOM 1654 CB MET A 107 -23.754 -6.549 3.344 1.00 0.00 C ATOM 1655 CG MET A 107 -22.369 -7.197 3.464 1.00 0.01 C ATOM 1656 SD MET A 107 -22.474 -8.652 4.540 1.00 0.01 S ATOM 1657 CE MET A 107 -23.502 -9.686 3.466 1.00 0.01 C ATOM 0 H MET A 107 -25.869 -5.363 2.150 1.00 0.01 H new ATOM 0 HA MET A 107 -22.936 -4.761 2.435 1.00 0.01 H new ATOM 0 HB2 MET A 107 -24.040 -6.105 4.298 1.00 0.00 H new ATOM 0 HB3 MET A 107 -24.500 -7.308 3.109 1.00 0.00 H new ATOM 0 HG2 MET A 107 -22.004 -7.486 2.478 1.00 0.01 H new ATOM 0 HG3 MET A 107 -21.655 -6.481 3.871 1.00 0.01 H new ATOM 0 HE1 MET A 107 -23.242 -10.734 3.613 1.00 0.01 H new ATOM 0 HE2 MET A 107 -24.553 -9.535 3.713 1.00 0.01 H new ATOM 0 HE3 MET A 107 -23.331 -9.412 2.425 1.00 0.01 H new ATOM 1667 N TYR A 108 -22.307 -6.158 0.428 1.00 0.01 N ATOM 1668 CA TYR A 108 -21.978 -6.815 -0.876 1.00 0.00 C ATOM 1669 C TYR A 108 -20.747 -7.705 -0.667 1.00 0.01 C ATOM 1670 O TYR A 108 -19.797 -7.329 -0.007 1.00 0.01 O ATOM 1671 CB TYR A 108 -21.669 -5.746 -1.928 1.00 0.54 C ATOM 1672 CG TYR A 108 -22.959 -5.117 -2.401 1.00 0.60 C ATOM 1673 CD1 TYR A 108 -23.774 -5.797 -3.313 1.00 1.24 C ATOM 1674 CD2 TYR A 108 -23.342 -3.855 -1.926 1.00 0.93 C ATOM 1675 CE1 TYR A 108 -24.972 -5.218 -3.750 1.00 1.76 C ATOM 1676 CE2 TYR A 108 -24.538 -3.277 -2.363 1.00 1.51 C ATOM 1677 CZ TYR A 108 -25.354 -3.958 -3.276 1.00 1.82 C ATOM 1678 OH TYR A 108 -26.534 -3.388 -3.706 1.00 2.48 O ATOM 0 H TYR A 108 -21.510 -5.731 0.901 1.00 0.01 H new ATOM 0 HA TYR A 108 -22.822 -7.413 -1.221 1.00 0.00 H new ATOM 0 HB2 TYR A 108 -21.014 -4.984 -1.506 1.00 0.54 H new ATOM 0 HB3 TYR A 108 -21.139 -6.191 -2.770 1.00 0.54 H new ATOM 0 HD1 TYR A 108 -23.479 -6.769 -3.680 1.00 1.24 H new ATOM 0 HD2 TYR A 108 -22.713 -3.329 -1.223 1.00 0.93 H new ATOM 0 HE1 TYR A 108 -25.601 -5.744 -4.453 1.00 1.76 H new ATOM 0 HE2 TYR A 108 -24.833 -2.305 -1.996 1.00 1.51 H new ATOM 0 HH TYR A 108 -26.649 -2.513 -3.279 1.00 2.48 H new ATOM 1688 N GLU A 109 -20.781 -8.899 -1.205 1.00 0.01 N ATOM 1689 CA GLU A 109 -19.648 -9.867 -1.033 1.00 0.01 C ATOM 1690 C GLU A 109 -19.021 -10.172 -2.392 1.00 0.01 C ATOM 1691 O GLU A 109 -19.712 -10.426 -3.359 1.00 0.01 O ATOM 1692 CB GLU A 109 -20.213 -11.151 -0.414 1.00 0.01 C ATOM 1693 CG GLU A 109 -19.075 -11.997 0.171 1.00 0.01 C ATOM 1694 CD GLU A 109 -18.184 -12.514 -0.959 1.00 0.00 C ATOM 1695 OE1 GLU A 109 -18.666 -13.308 -1.751 1.00 0.00 O ATOM 1696 OE2 GLU A 109 -17.034 -12.109 -1.015 1.00 0.00 O ATOM 0 H GLU A 109 -21.557 -9.251 -1.765 1.00 0.01 H new ATOM 0 HA GLU A 109 -18.879 -9.445 -0.386 1.00 0.01 H new ATOM 0 HB2 GLU A 109 -20.931 -10.902 0.368 1.00 0.01 H new ATOM 0 HB3 GLU A 109 -20.751 -11.723 -1.170 1.00 0.01 H new ATOM 0 HG2 GLU A 109 -18.486 -11.400 0.867 1.00 0.01 H new ATOM 0 HG3 GLU A 109 -19.485 -12.834 0.736 1.00 0.01 H new ATOM 1703 N THR A 110 -17.710 -10.147 -2.483 1.00 0.01 N ATOM 1704 CA THR A 110 -17.060 -10.435 -3.798 1.00 0.00 C ATOM 1705 C THR A 110 -15.688 -11.097 -3.603 1.00 0.01 C ATOM 1706 O THR A 110 -14.972 -10.854 -2.638 1.00 0.01 O ATOM 1707 CB THR A 110 -16.889 -9.130 -4.593 1.00 1.21 C ATOM 1708 OG1 THR A 110 -15.736 -9.224 -5.418 1.00 1.65 O ATOM 1709 CG2 THR A 110 -16.731 -7.952 -3.628 1.00 1.69 C ATOM 0 H THR A 110 -17.072 -9.942 -1.714 1.00 0.01 H new ATOM 0 HA THR A 110 -17.702 -11.122 -4.349 1.00 0.00 H new ATOM 0 HB THR A 110 -17.770 -8.971 -5.215 1.00 1.21 H new ATOM 0 HG1 THR A 110 -15.628 -8.393 -5.925 1.00 1.65 H new ATOM 0 HG21 THR A 110 -16.610 -7.030 -4.196 1.00 1.69 H new ATOM 0 HG22 THR A 110 -17.617 -7.876 -2.998 1.00 1.69 H new ATOM 0 HG23 THR A 110 -15.853 -8.110 -3.002 1.00 1.69 H new ATOM 1717 N THR A 111 -15.341 -11.939 -4.546 1.00 0.00 N ATOM 1718 CA THR A 111 -14.038 -12.672 -4.515 1.00 0.01 C ATOM 1719 C THR A 111 -13.158 -12.236 -5.694 1.00 0.01 C ATOM 1720 O THR A 111 -12.133 -12.830 -5.961 1.00 0.01 O ATOM 1721 CB THR A 111 -14.305 -14.178 -4.616 1.00 0.01 C ATOM 1722 OG1 THR A 111 -14.408 -14.547 -5.983 1.00 0.01 O ATOM 1723 CG2 THR A 111 -15.611 -14.519 -3.896 1.00 0.01 C ATOM 0 H THR A 111 -15.922 -12.153 -5.356 1.00 0.00 H new ATOM 0 HA THR A 111 -13.523 -12.445 -3.582 1.00 0.01 H new ATOM 0 HB THR A 111 -13.484 -14.723 -4.151 1.00 0.01 H new ATOM 0 HG1 THR A 111 -14.577 -15.510 -6.050 1.00 0.01 H new ATOM 0 HG21 THR A 111 -15.798 -15.590 -3.970 1.00 0.01 H new ATOM 0 HG22 THR A 111 -15.533 -14.236 -2.846 1.00 0.01 H new ATOM 0 HG23 THR A 111 -16.434 -13.974 -4.358 1.00 0.01 H new ATOM 1731 N GLU A 112 -13.576 -11.226 -6.428 1.00 0.01 N ATOM 1732 CA GLU A 112 -12.791 -10.772 -7.630 1.00 0.01 C ATOM 1733 C GLU A 112 -12.392 -9.300 -7.507 1.00 0.01 C ATOM 1734 O GLU A 112 -12.947 -8.558 -6.720 1.00 0.01 O ATOM 1735 CB GLU A 112 -13.652 -10.951 -8.881 1.00 0.85 C ATOM 1736 CG GLU A 112 -13.867 -12.444 -9.141 1.00 1.61 C ATOM 1737 CD GLU A 112 -14.587 -12.630 -10.477 1.00 2.51 C ATOM 1738 OE1 GLU A 112 -15.201 -11.680 -10.936 1.00 3.07 O ATOM 1739 OE2 GLU A 112 -14.516 -13.721 -11.019 1.00 3.21 O ATOM 0 H GLU A 112 -14.428 -10.695 -6.247 1.00 0.01 H new ATOM 0 HA GLU A 112 -11.883 -11.371 -7.697 1.00 0.01 H new ATOM 0 HB2 GLU A 112 -14.612 -10.452 -8.750 1.00 0.85 H new ATOM 0 HB3 GLU A 112 -13.166 -10.487 -9.740 1.00 0.85 H new ATOM 0 HG2 GLU A 112 -12.909 -12.963 -9.157 1.00 1.61 H new ATOM 0 HG3 GLU A 112 -14.454 -12.884 -8.335 1.00 1.61 H new ATOM 1746 N ASP A 113 -11.445 -8.866 -8.300 1.00 0.01 N ATOM 1747 CA ASP A 113 -11.012 -7.439 -8.264 1.00 0.01 C ATOM 1748 C ASP A 113 -12.131 -6.555 -8.829 1.00 0.00 C ATOM 1749 O ASP A 113 -12.929 -6.993 -9.634 1.00 0.01 O ATOM 1750 CB ASP A 113 -9.758 -7.280 -9.132 1.00 0.01 C ATOM 1751 CG ASP A 113 -9.896 -8.144 -10.387 1.00 0.01 C ATOM 1752 OD1 ASP A 113 -10.858 -7.952 -11.111 1.00 0.00 O ATOM 1753 OD2 ASP A 113 -9.038 -8.984 -10.602 1.00 0.00 O ATOM 0 H ASP A 113 -10.950 -9.446 -8.977 1.00 0.01 H new ATOM 0 HA ASP A 113 -10.796 -7.143 -7.238 1.00 0.01 H new ATOM 0 HB2 ASP A 113 -9.625 -6.234 -9.410 1.00 0.01 H new ATOM 0 HB3 ASP A 113 -8.873 -7.576 -8.569 1.00 0.01 H new ATOM 1758 N CYS A 114 -12.168 -5.304 -8.433 1.00 0.01 N ATOM 1759 CA CYS A 114 -13.207 -4.359 -8.962 1.00 0.01 C ATOM 1760 C CYS A 114 -12.509 -3.089 -9.514 1.00 0.01 C ATOM 1761 O CYS A 114 -11.845 -2.397 -8.765 1.00 0.01 O ATOM 1762 CB CYS A 114 -14.158 -3.960 -7.826 1.00 0.01 C ATOM 1763 SG CYS A 114 -13.297 -2.904 -6.638 1.00 0.01 S ATOM 0 H CYS A 114 -11.519 -4.894 -7.762 1.00 0.01 H new ATOM 0 HA CYS A 114 -13.772 -4.844 -9.758 1.00 0.01 H new ATOM 0 HB2 CYS A 114 -15.022 -3.434 -8.232 1.00 0.01 H new ATOM 0 HB3 CYS A 114 -14.534 -4.852 -7.326 1.00 0.01 H new ATOM 0 HG CYS A 114 -12.981 -3.601 -5.587 1.00 0.01 H new ATOM 1769 N PRO A 115 -12.648 -2.752 -10.791 1.00 0.01 N ATOM 1770 CA PRO A 115 -12.000 -1.516 -11.315 1.00 0.01 C ATOM 1771 C PRO A 115 -12.781 -0.263 -10.891 1.00 0.01 C ATOM 1772 O PRO A 115 -12.208 0.789 -10.675 1.00 0.01 O ATOM 1773 CB PRO A 115 -12.072 -1.732 -12.834 1.00 0.01 C ATOM 1774 CG PRO A 115 -13.174 -2.768 -13.102 1.00 0.01 C ATOM 1775 CD PRO A 115 -13.418 -3.549 -11.796 1.00 0.01 C ATOM 0 HA PRO A 115 -10.987 -1.358 -10.945 1.00 0.01 H new ATOM 0 HB2 PRO A 115 -12.295 -0.795 -13.344 1.00 0.01 H new ATOM 0 HB3 PRO A 115 -11.114 -2.084 -13.217 1.00 0.01 H new ATOM 0 HG2 PRO A 115 -14.090 -2.275 -13.428 1.00 0.01 H new ATOM 0 HG3 PRO A 115 -12.874 -3.446 -13.901 1.00 0.01 H new ATOM 0 HD2 PRO A 115 -14.478 -3.601 -11.547 1.00 0.01 H new ATOM 0 HD3 PRO A 115 -13.056 -4.575 -11.863 1.00 0.01 H new ATOM 1783 N SER A 116 -14.083 -0.366 -10.787 1.00 0.01 N ATOM 1784 CA SER A 116 -14.910 0.814 -10.391 1.00 0.02 C ATOM 1785 C SER A 116 -16.068 0.346 -9.503 1.00 0.01 C ATOM 1786 O SER A 116 -16.988 -0.317 -9.949 1.00 0.00 O ATOM 1787 CB SER A 116 -15.460 1.489 -11.648 1.00 0.01 C ATOM 1788 OG SER A 116 -14.396 2.124 -12.346 1.00 0.01 O ATOM 0 H SER A 116 -14.610 -1.222 -10.960 1.00 0.01 H new ATOM 0 HA SER A 116 -14.298 1.526 -9.838 1.00 0.02 H new ATOM 0 HB2 SER A 116 -15.941 0.751 -12.290 1.00 0.01 H new ATOM 0 HB3 SER A 116 -16.221 2.221 -11.378 1.00 0.01 H new ATOM 0 HG SER A 116 -14.752 2.590 -13.131 1.00 0.01 H new ATOM 1794 N ILE A 117 -16.001 0.669 -8.239 1.00 0.01 N ATOM 1795 CA ILE A 117 -17.060 0.236 -7.282 1.00 0.01 C ATOM 1796 C ILE A 117 -18.403 0.866 -7.639 1.00 0.01 C ATOM 1797 O ILE A 117 -19.433 0.234 -7.520 1.00 0.00 O ATOM 1798 CB ILE A 117 -16.657 0.666 -5.871 1.00 0.57 C ATOM 1799 CG1 ILE A 117 -15.333 -0.004 -5.503 1.00 1.44 C ATOM 1800 CG2 ILE A 117 -17.735 0.245 -4.866 1.00 0.93 C ATOM 1801 CD1 ILE A 117 -14.753 0.667 -4.261 1.00 1.83 C ATOM 0 H ILE A 117 -15.249 1.220 -7.825 1.00 0.01 H new ATOM 0 HA ILE A 117 -17.163 -0.848 -7.334 1.00 0.01 H new ATOM 0 HB ILE A 117 -16.547 1.750 -5.842 1.00 0.57 H new ATOM 0 HG12 ILE A 117 -15.490 -1.066 -5.316 1.00 1.44 H new ATOM 0 HG13 ILE A 117 -14.631 0.073 -6.333 1.00 1.44 H new ATOM 0 HG21 ILE A 117 -17.439 0.555 -3.864 1.00 0.93 H new ATOM 0 HG22 ILE A 117 -18.681 0.718 -5.128 1.00 0.93 H new ATOM 0 HG23 ILE A 117 -17.852 -0.838 -4.890 1.00 0.93 H new ATOM 0 HD11 ILE A 117 -13.809 0.190 -3.997 1.00 1.83 H new ATOM 0 HD12 ILE A 117 -14.581 1.724 -4.465 1.00 1.83 H new ATOM 0 HD13 ILE A 117 -15.454 0.567 -3.432 1.00 1.83 H new ATOM 1813 N MET A 118 -18.413 2.107 -8.042 1.00 0.02 N ATOM 1814 CA MET A 118 -19.714 2.753 -8.363 1.00 0.01 C ATOM 1815 C MET A 118 -20.331 2.090 -9.592 1.00 0.01 C ATOM 1816 O MET A 118 -21.527 1.914 -9.670 1.00 0.02 O ATOM 1817 CB MET A 118 -19.517 4.250 -8.618 1.00 0.24 C ATOM 1818 CG MET A 118 -20.881 4.929 -8.754 1.00 0.63 C ATOM 1819 SD MET A 118 -20.647 6.704 -9.018 1.00 1.20 S ATOM 1820 CE MET A 118 -22.319 7.221 -8.559 1.00 1.34 C ATOM 0 H MET A 118 -17.588 2.694 -8.161 1.00 0.02 H new ATOM 0 HA MET A 118 -20.387 2.631 -7.514 1.00 0.01 H new ATOM 0 HB2 MET A 118 -18.956 4.698 -7.798 1.00 0.24 H new ATOM 0 HB3 MET A 118 -18.932 4.401 -9.525 1.00 0.24 H new ATOM 0 HG2 MET A 118 -21.433 4.496 -9.588 1.00 0.63 H new ATOM 0 HG3 MET A 118 -21.475 4.759 -7.856 1.00 0.63 H new ATOM 0 HE1 MET A 118 -22.403 8.304 -8.650 1.00 1.34 H new ATOM 0 HE2 MET A 118 -23.042 6.744 -9.221 1.00 1.34 H new ATOM 0 HE3 MET A 118 -22.521 6.927 -7.529 1.00 1.34 H new ATOM 1830 N GLU A 119 -19.545 1.713 -10.553 1.00 0.01 N ATOM 1831 CA GLU A 119 -20.132 1.067 -11.756 1.00 0.02 C ATOM 1832 C GLU A 119 -20.652 -0.326 -11.392 1.00 0.02 C ATOM 1833 O GLU A 119 -21.657 -0.777 -11.904 1.00 0.01 O ATOM 1834 CB GLU A 119 -19.059 0.939 -12.840 1.00 0.30 C ATOM 1835 CG GLU A 119 -18.547 2.331 -13.218 1.00 0.99 C ATOM 1836 CD GLU A 119 -17.274 2.197 -14.055 1.00 1.69 C ATOM 1837 OE1 GLU A 119 -17.241 1.333 -14.914 1.00 2.07 O ATOM 1838 OE2 GLU A 119 -16.353 2.963 -13.822 1.00 2.11 O ATOM 0 H GLU A 119 -18.531 1.821 -10.561 1.00 0.01 H new ATOM 0 HA GLU A 119 -20.957 1.676 -12.126 1.00 0.02 H new ATOM 0 HB2 GLU A 119 -18.235 0.322 -12.480 1.00 0.30 H new ATOM 0 HB3 GLU A 119 -19.471 0.441 -13.718 1.00 0.30 H new ATOM 0 HG2 GLU A 119 -19.309 2.870 -13.780 1.00 0.99 H new ATOM 0 HG3 GLU A 119 -18.344 2.912 -12.318 1.00 0.99 H new ATOM 1845 N GLN A 120 -19.940 -1.032 -10.556 1.00 0.00 N ATOM 1846 CA GLN A 120 -20.355 -2.424 -10.209 1.00 0.01 C ATOM 1847 C GLN A 120 -21.469 -2.456 -9.155 1.00 0.01 C ATOM 1848 O GLN A 120 -22.415 -3.209 -9.274 1.00 0.01 O ATOM 1849 CB GLN A 120 -19.142 -3.187 -9.677 1.00 0.52 C ATOM 1850 CG GLN A 120 -19.555 -4.614 -9.309 1.00 1.07 C ATOM 1851 CD GLN A 120 -18.304 -5.460 -9.068 1.00 1.08 C ATOM 1852 OE1 GLN A 120 -17.199 -4.959 -9.122 1.00 0.98 O ATOM 1853 NE2 GLN A 120 -18.432 -6.732 -8.806 1.00 2.08 N ATOM 0 H GLN A 120 -19.089 -0.706 -10.098 1.00 0.00 H new ATOM 0 HA GLN A 120 -20.744 -2.889 -11.115 1.00 0.01 H new ATOM 0 HB2 GLN A 120 -18.354 -3.208 -10.430 1.00 0.52 H new ATOM 0 HB3 GLN A 120 -18.734 -2.679 -8.803 1.00 0.52 H new ATOM 0 HG2 GLN A 120 -20.179 -4.605 -8.415 1.00 1.07 H new ATOM 0 HG3 GLN A 120 -20.153 -5.049 -10.110 1.00 1.07 H new ATOM 0 HE21 GLN A 120 -19.360 -7.152 -8.761 1.00 2.08 H new ATOM 0 HE22 GLN A 120 -17.604 -7.306 -8.646 1.00 2.08 H new ATOM 1862 N PHE A 121 -21.328 -1.699 -8.093 1.00 0.02 N ATOM 1863 CA PHE A 121 -22.342 -1.748 -6.984 1.00 0.01 C ATOM 1864 C PHE A 121 -23.173 -0.466 -6.887 1.00 0.01 C ATOM 1865 O PHE A 121 -24.037 -0.352 -6.041 1.00 0.01 O ATOM 1866 CB PHE A 121 -21.609 -1.964 -5.661 1.00 0.01 C ATOM 1867 CG PHE A 121 -20.732 -3.189 -5.764 1.00 0.01 C ATOM 1868 CD1 PHE A 121 -19.425 -3.075 -6.251 1.00 0.01 C ATOM 1869 CD2 PHE A 121 -21.226 -4.438 -5.370 1.00 0.01 C ATOM 1870 CE1 PHE A 121 -18.610 -4.209 -6.343 1.00 0.01 C ATOM 1871 CE2 PHE A 121 -20.412 -5.574 -5.463 1.00 0.01 C ATOM 1872 CZ PHE A 121 -19.104 -5.459 -5.949 1.00 0.01 C ATOM 0 H PHE A 121 -20.556 -1.049 -7.943 1.00 0.02 H new ATOM 0 HA PHE A 121 -23.029 -2.567 -7.199 1.00 0.01 H new ATOM 0 HB2 PHE A 121 -21.004 -1.090 -5.422 1.00 0.01 H new ATOM 0 HB3 PHE A 121 -22.328 -2.086 -4.851 1.00 0.01 H new ATOM 0 HD1 PHE A 121 -19.045 -2.111 -6.556 1.00 0.01 H new ATOM 0 HD2 PHE A 121 -22.235 -4.526 -4.994 1.00 0.01 H new ATOM 0 HE1 PHE A 121 -17.601 -4.120 -6.718 1.00 0.01 H new ATOM 0 HE2 PHE A 121 -20.793 -6.538 -5.160 1.00 0.01 H new ATOM 0 HZ PHE A 121 -18.476 -6.335 -6.020 1.00 0.01 H new ATOM 1882 N HIS A 122 -22.928 0.501 -7.722 1.00 0.01 N ATOM 1883 CA HIS A 122 -23.718 1.762 -7.641 1.00 0.01 C ATOM 1884 C HIS A 122 -23.525 2.398 -6.261 1.00 0.01 C ATOM 1885 O HIS A 122 -24.420 3.021 -5.724 1.00 0.02 O ATOM 1886 CB HIS A 122 -25.199 1.446 -7.883 1.00 0.01 C ATOM 1887 CG HIS A 122 -25.315 0.404 -8.960 1.00 0.01 C ATOM 1888 ND1 HIS A 122 -24.254 0.073 -9.786 1.00 0.01 N ATOM 1889 CD2 HIS A 122 -26.363 -0.390 -9.360 1.00 0.01 C ATOM 1890 CE1 HIS A 122 -24.680 -0.881 -10.633 1.00 0.00 C ATOM 1891 NE2 HIS A 122 -25.958 -1.200 -10.416 1.00 0.01 N ATOM 0 H HIS A 122 -22.219 0.476 -8.455 1.00 0.01 H new ATOM 0 HA HIS A 122 -23.376 2.465 -8.401 1.00 0.01 H new ATOM 0 HB2 HIS A 122 -25.661 1.088 -6.963 1.00 0.01 H new ATOM 0 HB3 HIS A 122 -25.732 2.350 -8.177 1.00 0.01 H new ATOM 0 HD2 HIS A 122 -27.350 -0.386 -8.922 1.00 0.01 H new ATOM 0 HE1 HIS A 122 -24.063 -1.334 -11.396 1.00 0.00 H new ATOM 0 HE2 HIS A 122 -26.518 -1.890 -10.917 1.00 0.01 H new ATOM 1899 N LEU A 123 -22.352 2.244 -5.686 1.00 0.01 N ATOM 1900 CA LEU A 123 -22.070 2.837 -4.331 1.00 0.01 C ATOM 1901 C LEU A 123 -21.027 3.949 -4.487 1.00 0.02 C ATOM 1902 O LEU A 123 -20.046 3.800 -5.188 1.00 0.01 O ATOM 1903 CB LEU A 123 -21.520 1.738 -3.392 1.00 0.01 C ATOM 1904 CG LEU A 123 -22.666 1.065 -2.606 1.00 0.01 C ATOM 1905 CD1 LEU A 123 -22.214 -0.314 -2.114 1.00 0.01 C ATOM 1906 CD2 LEU A 123 -23.041 1.918 -1.386 1.00 0.01 C ATOM 0 H LEU A 123 -21.573 1.731 -6.098 1.00 0.01 H new ATOM 0 HA LEU A 123 -22.986 3.246 -3.905 1.00 0.01 H new ATOM 0 HB2 LEU A 123 -20.984 0.989 -3.976 1.00 0.01 H new ATOM 0 HB3 LEU A 123 -20.802 2.173 -2.696 1.00 0.01 H new ATOM 0 HG LEU A 123 -23.528 0.965 -3.266 1.00 0.01 H new ATOM 0 HD11 LEU A 123 -23.025 -0.786 -1.560 1.00 0.01 H new ATOM 0 HD12 LEU A 123 -21.948 -0.936 -2.969 1.00 0.01 H new ATOM 0 HD13 LEU A 123 -21.347 -0.202 -1.463 1.00 0.01 H new ATOM 0 HD21 LEU A 123 -23.850 1.434 -0.839 1.00 0.01 H new ATOM 0 HD22 LEU A 123 -22.174 2.022 -0.734 1.00 0.01 H new ATOM 0 HD23 LEU A 123 -23.366 2.904 -1.718 1.00 0.01 H new ATOM 1918 N ARG A 124 -21.238 5.068 -3.840 1.00 0.01 N ATOM 1919 CA ARG A 124 -20.269 6.198 -3.952 1.00 0.00 C ATOM 1920 C ARG A 124 -19.230 6.131 -2.827 1.00 0.01 C ATOM 1921 O ARG A 124 -18.151 6.680 -2.935 1.00 0.01 O ATOM 1922 CB ARG A 124 -21.024 7.525 -3.858 1.00 1.67 C ATOM 1923 CG ARG A 124 -20.099 8.668 -4.279 1.00 1.98 C ATOM 1924 CD ARG A 124 -20.834 10.000 -4.132 1.00 2.92 C ATOM 1925 NE ARG A 124 -22.089 9.963 -4.937 1.00 3.54 N ATOM 1926 CZ ARG A 124 -23.015 10.863 -4.742 1.00 4.57 C ATOM 1927 NH1 ARG A 124 -22.842 11.796 -3.847 1.00 5.25 N ATOM 1928 NH2 ARG A 124 -24.115 10.829 -5.444 1.00 5.32 N ATOM 0 H ARG A 124 -22.042 5.247 -3.238 1.00 0.01 H new ATOM 0 HA ARG A 124 -19.757 6.124 -4.911 1.00 0.00 H new ATOM 0 HB2 ARG A 124 -21.905 7.501 -4.499 1.00 1.67 H new ATOM 0 HB3 ARG A 124 -21.376 7.684 -2.839 1.00 1.67 H new ATOM 0 HG2 ARG A 124 -19.199 8.667 -3.664 1.00 1.98 H new ATOM 0 HG3 ARG A 124 -19.779 8.529 -5.312 1.00 1.98 H new ATOM 0 HD2 ARG A 124 -21.066 10.186 -3.083 1.00 2.92 H new ATOM 0 HD3 ARG A 124 -20.197 10.819 -4.468 1.00 2.92 H new ATOM 0 HE ARG A 124 -22.224 9.236 -5.639 1.00 3.54 H new ATOM 0 HH11 ARG A 124 -21.983 11.823 -3.298 1.00 5.25 H new ATOM 0 HH12 ARG A 124 -23.566 12.498 -3.696 1.00 5.25 H new ATOM 0 HH21 ARG A 124 -24.251 10.100 -6.144 1.00 5.32 H new ATOM 0 HH22 ARG A 124 -24.839 11.532 -5.292 1.00 5.32 H new ATOM 1942 N GLU A 125 -19.552 5.481 -1.734 1.00 0.01 N ATOM 1943 CA GLU A 125 -18.593 5.402 -0.587 1.00 0.01 C ATOM 1944 C GLU A 125 -18.782 4.081 0.167 1.00 0.01 C ATOM 1945 O GLU A 125 -19.799 3.426 0.043 1.00 0.01 O ATOM 1946 CB GLU A 125 -18.868 6.555 0.380 1.00 0.01 C ATOM 1947 CG GLU A 125 -18.759 7.886 -0.367 1.00 0.01 C ATOM 1948 CD GLU A 125 -18.746 9.036 0.642 1.00 0.02 C ATOM 1949 OE1 GLU A 125 -19.775 9.275 1.252 1.00 0.02 O ATOM 1950 OE2 GLU A 125 -17.707 9.658 0.787 1.00 0.01 O ATOM 0 H GLU A 125 -20.440 5.001 -1.587 1.00 0.01 H new ATOM 0 HA GLU A 125 -17.575 5.462 -0.973 1.00 0.01 H new ATOM 0 HB2 GLU A 125 -19.862 6.450 0.814 1.00 0.01 H new ATOM 0 HB3 GLU A 125 -18.156 6.529 1.205 1.00 0.01 H new ATOM 0 HG2 GLU A 125 -17.850 7.905 -0.968 1.00 0.01 H new ATOM 0 HG3 GLU A 125 -19.598 8.000 -1.054 1.00 0.01 H new ATOM 1957 N ILE A 126 -17.819 3.705 0.974 1.00 0.01 N ATOM 1958 CA ILE A 126 -17.935 2.444 1.783 1.00 0.01 C ATOM 1959 C ILE A 126 -17.549 2.789 3.224 1.00 0.01 C ATOM 1960 O ILE A 126 -16.545 3.436 3.451 1.00 0.01 O ATOM 1961 CB ILE A 126 -16.981 1.384 1.220 1.00 1.33 C ATOM 1962 CG1 ILE A 126 -17.564 0.854 -0.095 1.00 1.49 C ATOM 1963 CG2 ILE A 126 -16.835 0.226 2.219 1.00 2.17 C ATOM 1964 CD1 ILE A 126 -16.558 -0.074 -0.772 1.00 1.70 C ATOM 0 H ILE A 126 -16.949 4.220 1.110 1.00 0.01 H new ATOM 0 HA ILE A 126 -18.949 2.046 1.745 1.00 0.01 H new ATOM 0 HB ILE A 126 -15.999 1.825 1.047 1.00 1.33 H new ATOM 0 HG12 ILE A 126 -18.493 0.318 0.099 1.00 1.49 H new ATOM 0 HG13 ILE A 126 -17.807 1.685 -0.756 1.00 1.49 H new ATOM 0 HG21 ILE A 126 -16.156 -0.523 1.811 1.00 2.17 H new ATOM 0 HG22 ILE A 126 -16.435 0.605 3.160 1.00 2.17 H new ATOM 0 HG23 ILE A 126 -17.810 -0.227 2.396 1.00 2.17 H new ATOM 0 HD11 ILE A 126 -16.978 -0.447 -1.706 1.00 1.70 H new ATOM 0 HD12 ILE A 126 -15.640 0.475 -0.981 1.00 1.70 H new ATOM 0 HD13 ILE A 126 -16.336 -0.913 -0.113 1.00 1.70 H new ATOM 1976 N HIS A 127 -18.362 2.426 4.197 1.00 0.01 N ATOM 1977 CA HIS A 127 -18.045 2.822 5.616 1.00 0.01 C ATOM 1978 C HIS A 127 -17.560 1.648 6.473 1.00 0.01 C ATOM 1979 O HIS A 127 -17.014 1.852 7.539 1.00 0.01 O ATOM 1980 CB HIS A 127 -19.286 3.454 6.260 1.00 0.02 C ATOM 1981 CG HIS A 127 -19.486 4.850 5.727 1.00 0.01 C ATOM 1982 ND1 HIS A 127 -19.661 5.942 6.563 1.00 0.01 N ATOM 1983 CD2 HIS A 127 -19.539 5.344 4.448 1.00 0.01 C ATOM 1984 CE1 HIS A 127 -19.807 7.029 5.783 1.00 0.01 C ATOM 1985 NE2 HIS A 127 -19.741 6.721 4.486 1.00 0.02 N ATOM 0 H HIS A 127 -19.216 1.882 4.074 1.00 0.01 H new ATOM 0 HA HIS A 127 -17.227 3.541 5.572 1.00 0.01 H new ATOM 0 HB2 HIS A 127 -20.165 2.846 6.049 1.00 0.02 H new ATOM 0 HB3 HIS A 127 -19.170 3.482 7.343 1.00 0.02 H new ATOM 0 HD2 HIS A 127 -19.439 4.754 3.549 1.00 0.01 H new ATOM 0 HE1 HIS A 127 -19.959 8.029 6.161 1.00 0.01 H new ATOM 0 HE2 HIS A 127 -19.821 7.358 3.693 1.00 0.02 H new ATOM 1993 N SER A 128 -17.706 0.429 6.029 1.00 0.01 N ATOM 1994 CA SER A 128 -17.190 -0.712 6.851 1.00 0.01 C ATOM 1995 C SER A 128 -16.910 -1.884 5.916 1.00 0.01 C ATOM 1996 O SER A 128 -17.489 -1.992 4.856 1.00 0.01 O ATOM 1997 CB SER A 128 -18.236 -1.109 7.904 1.00 0.01 C ATOM 1998 OG SER A 128 -18.259 -2.525 8.042 1.00 0.01 O ATOM 0 H SER A 128 -18.152 0.172 5.148 1.00 0.01 H new ATOM 0 HA SER A 128 -16.275 -0.424 7.369 1.00 0.01 H new ATOM 0 HB2 SER A 128 -17.999 -0.644 8.861 1.00 0.01 H new ATOM 0 HB3 SER A 128 -19.220 -0.746 7.609 1.00 0.01 H new ATOM 0 HG SER A 128 -18.256 -2.761 8.993 1.00 0.01 H new ATOM 2004 N CYS A 129 -16.009 -2.762 6.265 1.00 0.01 N ATOM 2005 CA CYS A 129 -15.703 -3.888 5.347 1.00 0.01 C ATOM 2006 C CYS A 129 -15.015 -5.010 6.112 1.00 0.00 C ATOM 2007 O CYS A 129 -14.260 -4.780 7.037 1.00 0.01 O ATOM 2008 CB CYS A 129 -14.782 -3.388 4.237 1.00 0.69 C ATOM 2009 SG CYS A 129 -14.102 -4.793 3.320 1.00 1.22 S ATOM 0 H CYS A 129 -15.479 -2.747 7.136 1.00 0.01 H new ATOM 0 HA CYS A 129 -16.630 -4.269 4.917 1.00 0.01 H new ATOM 0 HB2 CYS A 129 -15.334 -2.735 3.561 1.00 0.69 H new ATOM 0 HB3 CYS A 129 -13.973 -2.795 4.663 1.00 0.69 H new ATOM 0 HG CYS A 129 -15.031 -5.685 3.141 1.00 1.22 H new ATOM 2015 N LYS A 130 -15.274 -6.233 5.726 1.00 0.01 N ATOM 2016 CA LYS A 130 -14.647 -7.398 6.416 1.00 0.01 C ATOM 2017 C LYS A 130 -13.857 -8.214 5.389 1.00 0.01 C ATOM 2018 O LYS A 130 -14.403 -8.892 4.547 1.00 0.01 O ATOM 2019 CB LYS A 130 -15.765 -8.265 7.057 1.00 0.55 C ATOM 2020 CG LYS A 130 -15.612 -8.302 8.589 1.00 0.80 C ATOM 2021 CD LYS A 130 -16.793 -9.057 9.225 1.00 0.29 C ATOM 2022 CE LYS A 130 -16.539 -10.568 9.187 1.00 0.33 C ATOM 2023 NZ LYS A 130 -15.263 -10.878 9.893 1.00 1.41 N ATOM 0 H LYS A 130 -15.898 -6.475 4.956 1.00 0.01 H new ATOM 0 HA LYS A 130 -13.968 -7.061 7.199 1.00 0.01 H new ATOM 0 HB2 LYS A 130 -16.742 -7.860 6.794 1.00 0.55 H new ATOM 0 HB3 LYS A 130 -15.721 -9.278 6.657 1.00 0.55 H new ATOM 0 HG2 LYS A 130 -14.674 -8.789 8.856 1.00 0.80 H new ATOM 0 HG3 LYS A 130 -15.567 -7.286 8.982 1.00 0.80 H new ATOM 0 HD2 LYS A 130 -16.930 -8.730 10.256 1.00 0.29 H new ATOM 0 HD3 LYS A 130 -17.714 -8.822 8.691 1.00 0.29 H new ATOM 0 HE2 LYS A 130 -17.366 -11.098 9.660 1.00 0.33 H new ATOM 0 HE3 LYS A 130 -16.488 -10.913 8.154 1.00 0.33 H new ATOM 0 HZ1 LYS A 130 -15.333 -11.814 10.342 1.00 1.41 H new ATOM 0 HZ2 LYS A 130 -14.479 -10.880 9.209 1.00 1.41 H new ATOM 0 HZ3 LYS A 130 -15.085 -10.157 10.621 1.00 1.41 H new ATOM 2037 N VAL A 131 -12.564 -8.158 5.487 1.00 0.01 N ATOM 2038 CA VAL A 131 -11.679 -8.933 4.573 1.00 0.01 C ATOM 2039 C VAL A 131 -11.094 -10.047 5.406 1.00 0.01 C ATOM 2040 O VAL A 131 -10.363 -9.784 6.351 1.00 0.01 O ATOM 2041 CB VAL A 131 -10.550 -8.035 4.060 1.00 0.01 C ATOM 2042 CG1 VAL A 131 -9.695 -8.809 3.055 1.00 0.01 C ATOM 2043 CG2 VAL A 131 -11.142 -6.801 3.378 1.00 0.01 C ATOM 0 H VAL A 131 -12.068 -7.595 6.178 1.00 0.01 H new ATOM 0 HA VAL A 131 -12.229 -9.315 3.713 1.00 0.01 H new ATOM 0 HB VAL A 131 -9.931 -7.722 4.901 1.00 0.01 H new ATOM 0 HG11 VAL A 131 -8.892 -8.168 2.691 1.00 0.01 H new ATOM 0 HG12 VAL A 131 -9.267 -9.686 3.541 1.00 0.01 H new ATOM 0 HG13 VAL A 131 -10.316 -9.125 2.216 1.00 0.01 H new ATOM 0 HG21 VAL A 131 -10.336 -6.164 3.014 1.00 0.01 H new ATOM 0 HG22 VAL A 131 -11.765 -7.112 2.539 1.00 0.01 H new ATOM 0 HG23 VAL A 131 -11.748 -6.245 4.094 1.00 0.01 H new ATOM 2053 N VAL A 132 -11.314 -11.298 5.040 1.00 0.01 N ATOM 2054 CA VAL A 132 -10.656 -12.392 5.820 1.00 0.01 C ATOM 2055 C VAL A 132 -10.330 -13.531 4.869 1.00 0.00 C ATOM 2056 O VAL A 132 -10.913 -14.593 4.941 1.00 0.01 O ATOM 2057 CB VAL A 132 -11.611 -12.893 6.906 1.00 1.22 C ATOM 2058 CG1 VAL A 132 -10.862 -13.836 7.850 1.00 1.00 C ATOM 2059 CG2 VAL A 132 -12.153 -11.704 7.703 1.00 1.98 C ATOM 0 H VAL A 132 -11.901 -11.595 4.261 1.00 0.01 H new ATOM 0 HA VAL A 132 -9.745 -12.021 6.290 1.00 0.01 H new ATOM 0 HB VAL A 132 -12.440 -13.425 6.439 1.00 1.22 H new ATOM 0 HG11 VAL A 132 -11.542 -14.193 8.623 1.00 1.00 H new ATOM 0 HG12 VAL A 132 -10.477 -14.685 7.286 1.00 1.00 H new ATOM 0 HG13 VAL A 132 -10.032 -13.303 8.314 1.00 1.00 H new ATOM 0 HG21 VAL A 132 -12.833 -12.063 8.476 1.00 1.98 H new ATOM 0 HG22 VAL A 132 -11.325 -11.170 8.168 1.00 1.98 H new ATOM 0 HG23 VAL A 132 -12.688 -11.031 7.033 1.00 1.98 H new ATOM 2069 N GLU A 133 -9.400 -13.332 3.997 1.00 0.01 N ATOM 2070 CA GLU A 133 -9.010 -14.406 3.047 1.00 0.01 C ATOM 2071 C GLU A 133 -8.034 -13.774 2.055 1.00 0.01 C ATOM 2072 O GLU A 133 -8.441 -12.977 1.228 1.00 0.01 O ATOM 2073 CB GLU A 133 -10.269 -14.982 2.336 1.00 0.00 C ATOM 2074 CG GLU A 133 -10.509 -16.446 2.750 1.00 0.00 C ATOM 2075 CD GLU A 133 -9.516 -17.356 2.024 1.00 0.00 C ATOM 2076 OE1 GLU A 133 -8.370 -17.402 2.443 1.00 0.00 O ATOM 2077 OE2 GLU A 133 -9.917 -17.991 1.063 1.00 0.00 O ATOM 0 H GLU A 133 -8.881 -12.460 3.895 1.00 0.01 H new ATOM 0 HA GLU A 133 -8.536 -15.244 3.558 1.00 0.01 H new ATOM 0 HB2 GLU A 133 -11.142 -14.380 2.588 1.00 0.00 H new ATOM 0 HB3 GLU A 133 -10.142 -14.921 1.255 1.00 0.00 H new ATOM 0 HG2 GLU A 133 -10.394 -16.553 3.829 1.00 0.00 H new ATOM 0 HG3 GLU A 133 -11.530 -16.740 2.508 1.00 0.00 H new ATOM 2084 N GLY A 134 -6.771 -14.100 2.132 1.00 0.01 N ATOM 2085 CA GLY A 134 -5.784 -13.495 1.188 1.00 0.01 C ATOM 2086 C GLY A 134 -5.576 -12.015 1.537 1.00 0.01 C ATOM 2087 O GLY A 134 -6.069 -11.529 2.535 1.00 0.01 O ATOM 0 H GLY A 134 -6.380 -14.758 2.806 1.00 0.01 H new ATOM 0 HA2 GLY A 134 -4.836 -14.029 1.246 1.00 0.01 H new ATOM 0 HA3 GLY A 134 -6.141 -13.590 0.163 1.00 0.01 H new ATOM 2091 N THR A 135 -4.846 -11.297 0.713 1.00 0.01 N ATOM 2092 CA THR A 135 -4.591 -9.840 0.973 1.00 0.01 C ATOM 2093 C THR A 135 -5.330 -9.008 -0.086 1.00 0.01 C ATOM 2094 O THR A 135 -5.473 -9.421 -1.220 1.00 0.01 O ATOM 2095 CB THR A 135 -3.076 -9.568 0.885 1.00 1.43 C ATOM 2096 OG1 THR A 135 -2.498 -10.458 -0.058 1.00 1.92 O ATOM 2097 CG2 THR A 135 -2.414 -9.787 2.250 1.00 2.30 C ATOM 0 H THR A 135 -4.412 -11.661 -0.136 1.00 0.01 H new ATOM 0 HA THR A 135 -4.949 -9.568 1.966 1.00 0.01 H new ATOM 0 HB THR A 135 -2.919 -8.535 0.576 1.00 1.43 H new ATOM 0 HG1 THR A 135 -1.535 -10.289 -0.120 1.00 1.92 H new ATOM 0 HG21 THR A 135 -1.345 -9.591 2.171 1.00 2.30 H new ATOM 0 HG22 THR A 135 -2.854 -9.109 2.981 1.00 2.30 H new ATOM 0 HG23 THR A 135 -2.572 -10.817 2.570 1.00 2.30 H new ATOM 2105 N TRP A 136 -5.814 -7.843 0.286 1.00 0.01 N ATOM 2106 CA TRP A 136 -6.564 -6.973 -0.681 1.00 0.01 C ATOM 2107 C TRP A 136 -6.029 -5.536 -0.633 1.00 0.01 C ATOM 2108 O TRP A 136 -5.668 -5.030 0.408 1.00 0.00 O ATOM 2109 CB TRP A 136 -8.051 -6.973 -0.308 1.00 0.01 C ATOM 2110 CG TRP A 136 -8.681 -8.261 -0.733 1.00 0.01 C ATOM 2111 CD1 TRP A 136 -8.664 -9.408 -0.018 1.00 0.01 C ATOM 2112 CD2 TRP A 136 -9.417 -8.550 -1.955 1.00 0.01 C ATOM 2113 NE1 TRP A 136 -9.348 -10.382 -0.721 1.00 0.00 N ATOM 2114 CE2 TRP A 136 -9.830 -9.902 -1.923 1.00 0.01 C ATOM 2115 CE3 TRP A 136 -9.763 -7.777 -3.078 1.00 0.01 C ATOM 2116 CZ2 TRP A 136 -10.561 -10.469 -2.968 1.00 0.01 C ATOM 2117 CZ3 TRP A 136 -10.500 -8.344 -4.131 1.00 0.01 C ATOM 2118 CH2 TRP A 136 -10.898 -9.686 -4.076 1.00 0.01 C ATOM 0 H TRP A 136 -5.721 -7.455 1.225 1.00 0.01 H new ATOM 0 HA TRP A 136 -6.430 -7.365 -1.689 1.00 0.01 H new ATOM 0 HB2 TRP A 136 -8.165 -6.839 0.768 1.00 0.01 H new ATOM 0 HB3 TRP A 136 -8.556 -6.135 -0.789 1.00 0.01 H new ATOM 0 HD1 TRP A 136 -8.193 -9.542 0.945 1.00 0.01 H new ATOM 0 HE1 TRP A 136 -9.481 -11.338 -0.392 1.00 0.00 H new ATOM 0 HE3 TRP A 136 -9.460 -6.742 -3.131 1.00 0.01 H new ATOM 0 HZ2 TRP A 136 -10.864 -11.505 -2.921 1.00 0.01 H new ATOM 0 HZ3 TRP A 136 -10.761 -7.741 -4.988 1.00 0.01 H new ATOM 0 HH2 TRP A 136 -11.465 -10.115 -4.889 1.00 0.01 H new ATOM 2129 N ILE A 137 -6.011 -4.859 -1.755 1.00 0.01 N ATOM 2130 CA ILE A 137 -5.544 -3.434 -1.788 1.00 0.00 C ATOM 2131 C ILE A 137 -6.718 -2.568 -2.242 1.00 0.01 C ATOM 2132 O ILE A 137 -7.446 -2.934 -3.139 1.00 0.01 O ATOM 2133 CB ILE A 137 -4.406 -3.277 -2.806 1.00 0.60 C ATOM 2134 CG1 ILE A 137 -3.286 -4.270 -2.494 1.00 1.32 C ATOM 2135 CG2 ILE A 137 -3.846 -1.850 -2.736 1.00 1.37 C ATOM 2136 CD1 ILE A 137 -2.162 -4.097 -3.519 1.00 1.69 C ATOM 0 H ILE A 137 -6.302 -5.234 -2.658 1.00 0.01 H new ATOM 0 HA ILE A 137 -5.188 -3.138 -0.801 1.00 0.00 H new ATOM 0 HB ILE A 137 -4.796 -3.472 -3.805 1.00 0.60 H new ATOM 0 HG12 ILE A 137 -2.905 -4.102 -1.487 1.00 1.32 H new ATOM 0 HG13 ILE A 137 -3.669 -5.290 -2.525 1.00 1.32 H new ATOM 0 HG21 ILE A 137 -3.038 -1.740 -3.459 1.00 1.37 H new ATOM 0 HG22 ILE A 137 -4.638 -1.137 -2.965 1.00 1.37 H new ATOM 0 HG23 ILE A 137 -3.464 -1.658 -1.733 1.00 1.37 H new ATOM 0 HD11 ILE A 137 -1.360 -4.802 -3.302 1.00 1.69 H new ATOM 0 HD12 ILE A 137 -2.550 -4.286 -4.520 1.00 1.69 H new ATOM 0 HD13 ILE A 137 -1.775 -3.080 -3.466 1.00 1.69 H new ATOM 2148 N PHE A 138 -6.874 -1.399 -1.657 1.00 0.01 N ATOM 2149 CA PHE A 138 -7.978 -0.464 -2.083 1.00 0.01 C ATOM 2150 C PHE A 138 -7.323 0.776 -2.695 1.00 0.01 C ATOM 2151 O PHE A 138 -6.291 1.223 -2.238 1.00 0.00 O ATOM 2152 CB PHE A 138 -8.898 -0.119 -0.872 1.00 1.11 C ATOM 2153 CG PHE A 138 -8.599 1.229 -0.213 1.00 1.11 C ATOM 2154 CD1 PHE A 138 -8.764 2.438 -0.917 1.00 1.54 C ATOM 2155 CD2 PHE A 138 -8.196 1.267 1.130 1.00 1.46 C ATOM 2156 CE1 PHE A 138 -8.515 3.662 -0.283 1.00 2.35 C ATOM 2157 CE2 PHE A 138 -7.953 2.494 1.761 1.00 2.01 C ATOM 2158 CZ PHE A 138 -8.109 3.690 1.054 1.00 2.49 C ATOM 0 H PHE A 138 -6.285 -1.050 -0.901 1.00 0.01 H new ATOM 0 HA PHE A 138 -8.623 -0.930 -2.828 1.00 0.01 H new ATOM 0 HB2 PHE A 138 -9.935 -0.123 -1.207 1.00 1.11 H new ATOM 0 HB3 PHE A 138 -8.802 -0.905 -0.123 1.00 1.11 H new ATOM 0 HD1 PHE A 138 -9.083 2.421 -1.949 1.00 1.54 H new ATOM 0 HD2 PHE A 138 -8.072 0.346 1.680 1.00 1.46 H new ATOM 0 HE1 PHE A 138 -8.637 4.586 -0.829 1.00 2.35 H new ATOM 0 HE2 PHE A 138 -7.645 2.516 2.796 1.00 2.01 H new ATOM 0 HZ PHE A 138 -7.916 4.635 1.541 1.00 2.49 H new ATOM 2168 N TYR A 139 -7.925 1.339 -3.721 1.00 0.01 N ATOM 2169 CA TYR A 139 -7.358 2.563 -4.374 1.00 0.01 C ATOM 2170 C TYR A 139 -8.403 3.682 -4.338 1.00 0.01 C ATOM 2171 O TYR A 139 -9.598 3.437 -4.422 1.00 0.01 O ATOM 2172 CB TYR A 139 -6.996 2.254 -5.828 1.00 0.01 C ATOM 2173 CG TYR A 139 -6.138 1.010 -5.885 1.00 0.01 C ATOM 2174 CD1 TYR A 139 -6.712 -0.245 -5.658 1.00 0.01 C ATOM 2175 CD2 TYR A 139 -4.770 1.111 -6.168 1.00 0.01 C ATOM 2176 CE1 TYR A 139 -5.922 -1.399 -5.713 1.00 0.01 C ATOM 2177 CE2 TYR A 139 -3.980 -0.042 -6.223 1.00 0.02 C ATOM 2178 CZ TYR A 139 -4.554 -1.297 -5.996 1.00 0.02 C ATOM 2179 OH TYR A 139 -3.775 -2.434 -6.049 1.00 0.00 O ATOM 0 H TYR A 139 -8.792 0.998 -4.136 1.00 0.01 H new ATOM 0 HA TYR A 139 -6.461 2.876 -3.840 1.00 0.01 H new ATOM 0 HB2 TYR A 139 -7.902 2.110 -6.416 1.00 0.01 H new ATOM 0 HB3 TYR A 139 -6.462 3.097 -6.267 1.00 0.01 H new ATOM 0 HD1 TYR A 139 -7.767 -0.324 -5.440 1.00 0.01 H new ATOM 0 HD2 TYR A 139 -4.325 2.079 -6.344 1.00 0.01 H new ATOM 0 HE1 TYR A 139 -6.367 -2.367 -5.537 1.00 0.01 H new ATOM 0 HE2 TYR A 139 -2.925 0.037 -6.441 1.00 0.02 H new ATOM 0 HH TYR A 139 -2.850 -2.187 -6.258 1.00 0.00 H new ATOM 2189 N GLU A 140 -7.963 4.901 -4.163 1.00 0.01 N ATOM 2190 CA GLU A 140 -8.911 6.048 -4.045 1.00 0.02 C ATOM 2191 C GLU A 140 -9.542 6.416 -5.394 1.00 0.01 C ATOM 2192 O GLU A 140 -10.653 6.908 -5.425 1.00 0.01 O ATOM 2193 CB GLU A 140 -8.121 7.248 -3.521 1.00 0.01 C ATOM 2194 CG GLU A 140 -9.084 8.376 -3.146 1.00 0.02 C ATOM 2195 CD GLU A 140 -8.303 9.515 -2.489 1.00 0.02 C ATOM 2196 OE1 GLU A 140 -7.276 9.236 -1.893 1.00 0.01 O ATOM 2197 OE2 GLU A 140 -8.747 10.648 -2.589 1.00 0.02 O ATOM 0 H GLU A 140 -6.977 5.153 -4.096 1.00 0.01 H new ATOM 0 HA GLU A 140 -9.721 5.768 -3.371 1.00 0.02 H new ATOM 0 HB2 GLU A 140 -7.532 6.956 -2.652 1.00 0.01 H new ATOM 0 HB3 GLU A 140 -7.419 7.593 -4.280 1.00 0.01 H new ATOM 0 HG2 GLU A 140 -9.599 8.739 -4.035 1.00 0.02 H new ATOM 0 HG3 GLU A 140 -9.849 8.004 -2.464 1.00 0.02 H new ATOM 2204 N LEU A 141 -8.870 6.207 -6.508 1.00 0.01 N ATOM 2205 CA LEU A 141 -9.478 6.578 -7.835 1.00 0.02 C ATOM 2206 C LEU A 141 -9.687 5.299 -8.673 1.00 0.01 C ATOM 2207 O LEU A 141 -8.981 4.319 -8.493 1.00 0.01 O ATOM 2208 CB LEU A 141 -8.507 7.526 -8.566 1.00 0.57 C ATOM 2209 CG LEU A 141 -8.709 8.979 -8.085 1.00 0.81 C ATOM 2210 CD1 LEU A 141 -7.439 9.793 -8.354 1.00 1.48 C ATOM 2211 CD2 LEU A 141 -9.884 9.633 -8.829 1.00 1.24 C ATOM 0 H LEU A 141 -7.936 5.800 -6.557 1.00 0.01 H new ATOM 0 HA LEU A 141 -10.439 7.070 -7.689 1.00 0.02 H new ATOM 0 HB2 LEU A 141 -7.478 7.215 -8.383 1.00 0.57 H new ATOM 0 HB3 LEU A 141 -8.671 7.466 -9.642 1.00 0.57 H new ATOM 0 HG LEU A 141 -8.924 8.962 -7.016 1.00 0.81 H new ATOM 0 HD11 LEU A 141 -7.585 10.818 -8.013 1.00 1.48 H new ATOM 0 HD12 LEU A 141 -6.601 9.348 -7.817 1.00 1.48 H new ATOM 0 HD13 LEU A 141 -7.226 9.793 -9.423 1.00 1.48 H new ATOM 0 HD21 LEU A 141 -10.012 10.657 -8.478 1.00 1.24 H new ATOM 0 HD22 LEU A 141 -9.678 9.640 -9.899 1.00 1.24 H new ATOM 0 HD23 LEU A 141 -10.796 9.067 -8.638 1.00 1.24 H new ATOM 2223 N PRO A 142 -10.643 5.301 -9.592 1.00 0.01 N ATOM 2224 CA PRO A 142 -10.910 4.099 -10.433 1.00 0.01 C ATOM 2225 C PRO A 142 -9.660 3.600 -11.164 1.00 0.01 C ATOM 2226 O PRO A 142 -8.652 4.271 -11.264 1.00 0.01 O ATOM 2227 CB PRO A 142 -11.980 4.607 -11.429 1.00 0.01 C ATOM 2228 CG PRO A 142 -12.202 6.110 -11.180 1.00 0.02 C ATOM 2229 CD PRO A 142 -11.520 6.483 -9.855 1.00 0.01 C ATOM 0 HA PRO A 142 -11.232 3.241 -9.842 1.00 0.01 H new ATOM 0 HB2 PRO A 142 -11.654 4.437 -12.455 1.00 0.01 H new ATOM 0 HB3 PRO A 142 -12.913 4.059 -11.296 1.00 0.01 H new ATOM 0 HG2 PRO A 142 -11.787 6.696 -12.000 1.00 0.02 H new ATOM 0 HG3 PRO A 142 -13.268 6.335 -11.135 1.00 0.02 H new ATOM 0 HD2 PRO A 142 -10.943 7.404 -9.942 1.00 0.01 H new ATOM 0 HD3 PRO A 142 -12.245 6.635 -9.055 1.00 0.01 H new ATOM 2237 N ASN A 143 -9.764 2.412 -11.691 1.00 0.01 N ATOM 2238 CA ASN A 143 -8.644 1.800 -12.456 1.00 0.01 C ATOM 2239 C ASN A 143 -7.393 1.670 -11.589 1.00 0.01 C ATOM 2240 O ASN A 143 -6.278 1.714 -12.070 1.00 0.01 O ATOM 2241 CB ASN A 143 -8.326 2.673 -13.672 1.00 0.23 C ATOM 2242 CG ASN A 143 -7.439 1.893 -14.643 1.00 0.11 C ATOM 2243 OD1 ASN A 143 -7.685 0.734 -14.911 1.00 0.75 O ATOM 2244 ND2 ASN A 143 -6.410 2.483 -15.189 1.00 0.56 N ATOM 0 H ASN A 143 -10.597 1.828 -11.621 1.00 0.01 H new ATOM 0 HA ASN A 143 -8.949 0.803 -12.775 1.00 0.01 H new ATOM 0 HB2 ASN A 143 -9.249 2.974 -14.168 1.00 0.23 H new ATOM 0 HB3 ASN A 143 -7.822 3.586 -13.355 1.00 0.23 H new ATOM 0 HD21 ASN A 143 -5.814 1.971 -15.839 1.00 0.56 H new ATOM 0 HD22 ASN A 143 -6.202 3.456 -14.965 1.00 0.56 H new ATOM 2251 N TYR A 144 -7.578 1.471 -10.312 1.00 0.01 N ATOM 2252 CA TYR A 144 -6.420 1.290 -9.392 1.00 0.02 C ATOM 2253 C TYR A 144 -5.475 2.494 -9.457 1.00 0.01 C ATOM 2254 O TYR A 144 -4.283 2.345 -9.639 1.00 0.01 O ATOM 2255 CB TYR A 144 -5.665 0.008 -9.787 1.00 0.01 C ATOM 2256 CG TYR A 144 -6.651 -0.997 -10.342 1.00 0.01 C ATOM 2257 CD1 TYR A 144 -7.765 -1.372 -9.582 1.00 0.01 C ATOM 2258 CD2 TYR A 144 -6.460 -1.544 -11.619 1.00 0.01 C ATOM 2259 CE1 TYR A 144 -8.686 -2.294 -10.094 1.00 0.01 C ATOM 2260 CE2 TYR A 144 -7.383 -2.464 -12.131 1.00 0.01 C ATOM 2261 CZ TYR A 144 -8.494 -2.838 -11.369 1.00 0.01 C ATOM 2262 OH TYR A 144 -9.404 -3.744 -11.877 1.00 0.01 O ATOM 0 H TYR A 144 -8.493 1.426 -9.863 1.00 0.01 H new ATOM 0 HA TYR A 144 -6.788 1.207 -8.370 1.00 0.02 H new ATOM 0 HB2 TYR A 144 -4.901 0.236 -10.531 1.00 0.01 H new ATOM 0 HB3 TYR A 144 -5.152 -0.408 -8.920 1.00 0.01 H new ATOM 0 HD1 TYR A 144 -7.914 -0.950 -8.599 1.00 0.01 H new ATOM 0 HD2 TYR A 144 -5.601 -1.256 -12.207 1.00 0.01 H new ATOM 0 HE1 TYR A 144 -9.544 -2.585 -9.506 1.00 0.01 H new ATOM 0 HE2 TYR A 144 -7.237 -2.885 -13.115 1.00 0.01 H new ATOM 0 HH TYR A 144 -9.123 -4.023 -12.773 1.00 0.01 H new ATOM 2272 N ARG A 145 -6.002 3.687 -9.307 1.00 0.02 N ATOM 2273 CA ARG A 145 -5.137 4.915 -9.355 1.00 0.01 C ATOM 2274 C ARG A 145 -5.326 5.731 -8.076 1.00 0.01 C ATOM 2275 O ARG A 145 -6.265 5.524 -7.334 1.00 0.01 O ATOM 2276 CB ARG A 145 -5.543 5.776 -10.552 1.00 0.01 C ATOM 2277 CG ARG A 145 -5.294 5.004 -11.849 1.00 0.02 C ATOM 2278 CD ARG A 145 -5.884 5.784 -13.025 1.00 0.01 C ATOM 2279 NE ARG A 145 -7.336 6.017 -12.785 1.00 0.01 N ATOM 2280 CZ ARG A 145 -7.977 6.909 -13.488 1.00 0.01 C ATOM 2281 NH1 ARG A 145 -7.347 7.599 -14.399 1.00 0.02 N ATOM 2282 NH2 ARG A 145 -9.249 7.109 -13.279 1.00 0.01 N ATOM 0 H ARG A 145 -6.994 3.866 -9.153 1.00 0.02 H new ATOM 0 HA ARG A 145 -4.094 4.613 -9.448 1.00 0.01 H new ATOM 0 HB2 ARG A 145 -6.596 6.049 -10.476 1.00 0.01 H new ATOM 0 HB3 ARG A 145 -4.972 6.705 -10.555 1.00 0.01 H new ATOM 0 HG2 ARG A 145 -4.224 4.855 -11.997 1.00 0.02 H new ATOM 0 HG3 ARG A 145 -5.748 4.015 -11.790 1.00 0.02 H new ATOM 0 HD2 ARG A 145 -5.366 6.736 -13.141 1.00 0.01 H new ATOM 0 HD3 ARG A 145 -5.742 5.229 -13.952 1.00 0.01 H new ATOM 0 HE ARG A 145 -7.828 5.479 -12.072 1.00 0.01 H new ATOM 0 HH11 ARG A 145 -6.353 7.441 -14.562 1.00 0.02 H new ATOM 0 HH12 ARG A 145 -7.849 8.296 -14.948 1.00 0.02 H new ATOM 0 HH21 ARG A 145 -9.740 6.568 -12.567 1.00 0.01 H new ATOM 0 HH22 ARG A 145 -9.753 7.806 -13.828 1.00 0.01 H new ATOM 2296 N GLY A 146 -4.427 6.644 -7.791 1.00 0.01 N ATOM 2297 CA GLY A 146 -4.543 7.463 -6.549 1.00 0.02 C ATOM 2298 C GLY A 146 -3.823 6.760 -5.397 1.00 0.01 C ATOM 2299 O GLY A 146 -3.051 5.843 -5.596 1.00 0.02 O ATOM 0 H GLY A 146 -3.615 6.856 -8.371 1.00 0.01 H new ATOM 0 HA2 GLY A 146 -4.111 8.450 -6.712 1.00 0.02 H new ATOM 0 HA3 GLY A 146 -5.593 7.612 -6.297 1.00 0.02 H new ATOM 2303 N ARG A 147 -4.073 7.188 -4.191 1.00 0.01 N ATOM 2304 CA ARG A 147 -3.407 6.554 -3.016 1.00 0.01 C ATOM 2305 C ARG A 147 -3.934 5.130 -2.856 1.00 0.01 C ATOM 2306 O ARG A 147 -5.097 4.844 -3.083 1.00 0.01 O ATOM 2307 CB ARG A 147 -3.729 7.368 -1.760 1.00 0.01 C ATOM 2308 CG ARG A 147 -3.142 6.665 -0.533 1.00 0.01 C ATOM 2309 CD ARG A 147 -3.201 7.606 0.671 1.00 0.01 C ATOM 2310 NE ARG A 147 -2.233 8.721 0.478 1.00 0.02 N ATOM 2311 CZ ARG A 147 -2.311 9.790 1.223 1.00 0.02 C ATOM 2312 NH1 ARG A 147 -3.241 9.882 2.133 1.00 0.01 N ATOM 2313 NH2 ARG A 147 -1.460 10.765 1.057 1.00 0.02 N ATOM 0 H ARG A 147 -4.711 7.951 -3.967 1.00 0.01 H new ATOM 0 HA ARG A 147 -2.327 6.528 -3.164 1.00 0.01 H new ATOM 0 HB2 ARG A 147 -3.316 8.373 -1.849 1.00 0.01 H new ATOM 0 HB3 ARG A 147 -4.808 7.475 -1.650 1.00 0.01 H new ATOM 0 HG2 ARG A 147 -3.699 5.752 -0.322 1.00 0.01 H new ATOM 0 HG3 ARG A 147 -2.111 6.371 -0.728 1.00 0.01 H new ATOM 0 HD2 ARG A 147 -4.210 8.002 0.787 1.00 0.01 H new ATOM 0 HD3 ARG A 147 -2.966 7.060 1.585 1.00 0.01 H new ATOM 0 HE ARG A 147 -1.509 8.649 -0.237 1.00 0.02 H new ATOM 0 HH11 ARG A 147 -3.906 9.119 2.262 1.00 0.01 H new ATOM 0 HH12 ARG A 147 -3.303 10.717 2.716 1.00 0.01 H new ATOM 0 HH21 ARG A 147 -0.733 10.692 0.345 1.00 0.02 H new ATOM 0 HH22 ARG A 147 -1.521 11.600 1.639 1.00 0.02 H new ATOM 2327 N GLN A 148 -3.054 4.226 -2.492 1.00 0.01 N ATOM 2328 CA GLN A 148 -3.427 2.789 -2.333 1.00 0.01 C ATOM 2329 C GLN A 148 -3.191 2.367 -0.877 1.00 0.01 C ATOM 2330 O GLN A 148 -2.305 2.869 -0.214 1.00 0.01 O ATOM 2331 CB GLN A 148 -2.509 1.962 -3.258 1.00 0.00 C ATOM 2332 CG GLN A 148 -2.174 2.769 -4.521 1.00 0.02 C ATOM 2333 CD GLN A 148 -1.043 3.757 -4.218 1.00 0.02 C ATOM 2334 OE1 GLN A 148 -1.133 4.923 -4.549 1.00 0.02 O ATOM 2335 NE2 GLN A 148 0.024 3.336 -3.597 1.00 0.01 N ATOM 0 H GLN A 148 -2.074 4.431 -2.295 1.00 0.01 H new ATOM 0 HA GLN A 148 -4.475 2.630 -2.588 1.00 0.01 H new ATOM 0 HB2 GLN A 148 -1.592 1.697 -2.732 1.00 0.00 H new ATOM 0 HB3 GLN A 148 -3.001 1.029 -3.532 1.00 0.00 H new ATOM 0 HG2 GLN A 148 -1.877 2.097 -5.326 1.00 0.02 H new ATOM 0 HG3 GLN A 148 -3.057 3.307 -4.865 1.00 0.02 H new ATOM 0 HE21 GLN A 148 0.100 2.357 -3.319 1.00 0.01 H new ATOM 0 HE22 GLN A 148 0.783 3.985 -3.389 1.00 0.01 H new ATOM 2344 N TYR A 149 -3.973 1.443 -0.386 1.00 0.01 N ATOM 2345 CA TYR A 149 -3.813 0.958 1.025 1.00 0.01 C ATOM 2346 C TYR A 149 -3.725 -0.575 1.023 1.00 0.01 C ATOM 2347 O TYR A 149 -4.406 -1.233 0.258 1.00 0.01 O ATOM 2348 CB TYR A 149 -5.023 1.418 1.856 1.00 0.01 C ATOM 2349 CG TYR A 149 -4.609 1.690 3.291 1.00 0.01 C ATOM 2350 CD1 TYR A 149 -4.212 0.632 4.119 1.00 0.01 C ATOM 2351 CD2 TYR A 149 -4.622 3.000 3.790 1.00 0.01 C ATOM 2352 CE1 TYR A 149 -3.830 0.883 5.443 1.00 0.01 C ATOM 2353 CE2 TYR A 149 -4.240 3.249 5.115 1.00 0.01 C ATOM 2354 CZ TYR A 149 -3.845 2.191 5.941 1.00 0.01 C ATOM 2355 OH TYR A 149 -3.470 2.438 7.246 1.00 0.01 O ATOM 0 H TYR A 149 -4.727 0.995 -0.906 1.00 0.01 H new ATOM 0 HA TYR A 149 -2.902 1.368 1.462 1.00 0.01 H new ATOM 0 HB2 TYR A 149 -5.451 2.319 1.418 1.00 0.01 H new ATOM 0 HB3 TYR A 149 -5.799 0.653 1.834 1.00 0.01 H new ATOM 0 HD1 TYR A 149 -4.200 -0.378 3.736 1.00 0.01 H new ATOM 0 HD2 TYR A 149 -4.926 3.817 3.153 1.00 0.01 H new ATOM 0 HE1 TYR A 149 -3.524 0.067 6.080 1.00 0.01 H new ATOM 0 HE2 TYR A 149 -4.250 4.258 5.499 1.00 0.01 H new ATOM 0 HH TYR A 149 -3.305 3.397 7.363 1.00 0.01 H new ATOM 2365 N LEU A 150 -2.901 -1.144 1.869 1.00 0.01 N ATOM 2366 CA LEU A 150 -2.764 -2.636 1.916 1.00 0.01 C ATOM 2367 C LEU A 150 -3.685 -3.195 3.009 1.00 0.01 C ATOM 2368 O LEU A 150 -3.571 -2.846 4.168 1.00 0.01 O ATOM 2369 CB LEU A 150 -1.301 -2.973 2.238 1.00 0.01 C ATOM 2370 CG LEU A 150 -1.005 -4.470 1.929 1.00 0.01 C ATOM 2371 CD1 LEU A 150 -0.177 -4.595 0.643 1.00 0.01 C ATOM 2372 CD2 LEU A 150 -0.216 -5.102 3.086 1.00 0.01 C ATOM 0 H LEU A 150 -2.314 -0.638 2.532 1.00 0.01 H new ATOM 0 HA LEU A 150 -3.045 -3.078 0.960 1.00 0.01 H new ATOM 0 HB2 LEU A 150 -0.638 -2.337 1.652 1.00 0.01 H new ATOM 0 HB3 LEU A 150 -1.097 -2.765 3.288 1.00 0.01 H new ATOM 0 HG LEU A 150 -1.957 -4.987 1.804 1.00 0.01 H new ATOM 0 HD11 LEU A 150 0.022 -5.647 0.439 1.00 0.01 H new ATOM 0 HD12 LEU A 150 -0.731 -4.163 -0.190 1.00 0.01 H new ATOM 0 HD13 LEU A 150 0.767 -4.064 0.765 1.00 0.01 H new ATOM 0 HD21 LEU A 150 -0.014 -6.149 2.860 1.00 0.01 H new ATOM 0 HD22 LEU A 150 0.727 -4.571 3.216 1.00 0.01 H new ATOM 0 HD23 LEU A 150 -0.800 -5.035 4.004 1.00 0.01 H new ATOM 2384 N LEU A 151 -4.606 -4.056 2.640 1.00 0.01 N ATOM 2385 CA LEU A 151 -5.556 -4.646 3.635 1.00 0.01 C ATOM 2386 C LEU A 151 -5.188 -6.100 3.939 1.00 0.01 C ATOM 2387 O LEU A 151 -4.963 -6.892 3.046 1.00 0.01 O ATOM 2388 CB LEU A 151 -6.972 -4.609 3.058 1.00 0.01 C ATOM 2389 CG LEU A 151 -7.255 -3.221 2.478 1.00 0.01 C ATOM 2390 CD1 LEU A 151 -8.722 -3.141 2.046 1.00 0.01 C ATOM 2391 CD2 LEU A 151 -6.968 -2.151 3.540 1.00 0.01 C ATOM 0 H LEU A 151 -4.740 -4.377 1.681 1.00 0.01 H new ATOM 0 HA LEU A 151 -5.501 -4.065 4.556 1.00 0.01 H new ATOM 0 HB2 LEU A 151 -7.079 -5.367 2.282 1.00 0.01 H new ATOM 0 HB3 LEU A 151 -7.699 -4.844 3.836 1.00 0.01 H new ATOM 0 HG LEU A 151 -6.613 -3.049 1.614 1.00 0.01 H new ATOM 0 HD11 LEU A 151 -8.926 -2.153 1.633 1.00 0.01 H new ATOM 0 HD12 LEU A 151 -8.920 -3.899 1.289 1.00 0.01 H new ATOM 0 HD13 LEU A 151 -9.365 -3.313 2.909 1.00 0.01 H new ATOM 0 HD21 LEU A 151 -7.170 -1.163 3.125 1.00 0.01 H new ATOM 0 HD22 LEU A 151 -7.607 -2.318 4.407 1.00 0.01 H new ATOM 0 HD23 LEU A 151 -5.923 -2.210 3.843 1.00 0.01 H new ATOM 2403 N ASP A 152 -5.169 -6.463 5.197 1.00 0.01 N ATOM 2404 CA ASP A 152 -4.860 -7.875 5.588 1.00 0.01 C ATOM 2405 C ASP A 152 -6.142 -8.512 6.130 1.00 0.00 C ATOM 2406 O ASP A 152 -7.158 -7.858 6.248 1.00 0.01 O ATOM 2407 CB ASP A 152 -3.788 -7.879 6.681 1.00 1.04 C ATOM 2408 CG ASP A 152 -2.425 -7.564 6.062 1.00 1.54 C ATOM 2409 OD1 ASP A 152 -2.360 -6.653 5.254 1.00 2.27 O ATOM 2410 OD2 ASP A 152 -1.469 -8.238 6.408 1.00 1.57 O ATOM 0 H ASP A 152 -5.356 -5.835 5.979 1.00 0.01 H new ATOM 0 HA ASP A 152 -4.493 -8.434 4.727 1.00 0.01 H new ATOM 0 HB2 ASP A 152 -4.031 -7.141 7.446 1.00 1.04 H new ATOM 0 HB3 ASP A 152 -3.760 -8.851 7.173 1.00 1.04 H new ATOM 2415 N LYS A 153 -6.112 -9.774 6.465 1.00 0.01 N ATOM 2416 CA LYS A 153 -7.343 -10.425 7.004 1.00 0.01 C ATOM 2417 C LYS A 153 -7.810 -9.642 8.234 1.00 0.01 C ATOM 2418 O LYS A 153 -7.455 -9.963 9.351 1.00 0.01 O ATOM 2419 CB LYS A 153 -7.021 -11.867 7.405 1.00 0.38 C ATOM 2420 CG LYS A 153 -6.370 -12.594 6.225 1.00 0.71 C ATOM 2421 CD LYS A 153 -5.946 -14.002 6.659 1.00 0.72 C ATOM 2422 CE LYS A 153 -4.958 -14.578 5.640 1.00 1.09 C ATOM 2423 NZ LYS A 153 -5.406 -14.231 4.263 1.00 1.84 N ATOM 0 H LYS A 153 -5.295 -10.380 6.390 1.00 0.01 H new ATOM 0 HA LYS A 153 -8.127 -10.431 6.247 1.00 0.01 H new ATOM 0 HB2 LYS A 153 -6.351 -11.875 8.265 1.00 0.38 H new ATOM 0 HB3 LYS A 153 -7.932 -12.384 7.706 1.00 0.38 H new ATOM 0 HG2 LYS A 153 -7.070 -12.655 5.391 1.00 0.71 H new ATOM 0 HG3 LYS A 153 -5.503 -12.034 5.873 1.00 0.71 H new ATOM 0 HD2 LYS A 153 -5.486 -13.966 7.646 1.00 0.72 H new ATOM 0 HD3 LYS A 153 -6.820 -14.648 6.738 1.00 0.72 H new ATOM 0 HE2 LYS A 153 -3.960 -14.180 5.820 1.00 1.09 H new ATOM 0 HE3 LYS A 153 -4.894 -15.660 5.751 1.00 1.09 H new ATOM 0 HZ1 LYS A 153 -4.885 -14.808 3.573 1.00 1.84 H new ATOM 0 HZ2 LYS A 153 -6.425 -14.418 4.172 1.00 1.84 H new ATOM 0 HZ3 LYS A 153 -5.221 -13.224 4.081 1.00 1.84 H new ATOM 2437 N LYS A 154 -8.580 -8.594 8.038 1.00 0.00 N ATOM 2438 CA LYS A 154 -9.042 -7.764 9.202 1.00 0.01 C ATOM 2439 C LYS A 154 -10.525 -7.398 9.086 1.00 0.01 C ATOM 2440 O LYS A 154 -11.129 -7.485 8.031 1.00 0.00 O ATOM 2441 CB LYS A 154 -8.211 -6.478 9.253 1.00 0.39 C ATOM 2442 CG LYS A 154 -6.795 -6.804 9.732 1.00 0.48 C ATOM 2443 CD LYS A 154 -5.940 -5.535 9.707 1.00 0.97 C ATOM 2444 CE LYS A 154 -4.670 -5.758 10.529 1.00 1.44 C ATOM 2445 NZ LYS A 154 -4.053 -7.060 10.146 1.00 2.28 N ATOM 0 H LYS A 154 -8.908 -8.278 7.125 1.00 0.00 H new ATOM 0 HA LYS A 154 -8.910 -8.350 10.112 1.00 0.01 H new ATOM 0 HB2 LYS A 154 -8.175 -6.016 8.266 1.00 0.39 H new ATOM 0 HB3 LYS A 154 -8.677 -5.758 9.925 1.00 0.39 H new ATOM 0 HG2 LYS A 154 -6.827 -7.213 10.742 1.00 0.48 H new ATOM 0 HG3 LYS A 154 -6.351 -7.567 9.093 1.00 0.48 H new ATOM 0 HD2 LYS A 154 -5.681 -5.279 8.680 1.00 0.97 H new ATOM 0 HD3 LYS A 154 -6.505 -4.695 10.112 1.00 0.97 H new ATOM 0 HE2 LYS A 154 -3.965 -4.945 10.357 1.00 1.44 H new ATOM 0 HE3 LYS A 154 -4.907 -5.755 11.593 1.00 1.44 H new ATOM 0 HZ1 LYS A 154 -4.247 -7.766 10.884 1.00 2.28 H new ATOM 0 HZ2 LYS A 154 -4.456 -7.383 9.243 1.00 2.28 H new ATOM 0 HZ3 LYS A 154 -3.025 -6.940 10.043 1.00 2.28 H new ATOM 2459 N GLU A 155 -11.095 -6.943 10.177 1.00 0.01 N ATOM 2460 CA GLU A 155 -12.524 -6.505 10.191 1.00 0.01 C ATOM 2461 C GLU A 155 -12.552 -4.988 10.434 1.00 0.01 C ATOM 2462 O GLU A 155 -12.242 -4.525 11.514 1.00 0.01 O ATOM 2463 CB GLU A 155 -13.269 -7.233 11.317 1.00 0.01 C ATOM 2464 CG GLU A 155 -12.333 -7.424 12.512 1.00 0.01 C ATOM 2465 CD GLU A 155 -13.127 -7.972 13.700 1.00 0.01 C ATOM 2466 OE1 GLU A 155 -13.712 -7.175 14.414 1.00 0.01 O ATOM 2467 OE2 GLU A 155 -13.139 -9.179 13.872 1.00 0.01 O ATOM 0 H GLU A 155 -10.619 -6.856 11.075 1.00 0.01 H new ATOM 0 HA GLU A 155 -13.009 -6.741 9.244 1.00 0.01 H new ATOM 0 HB2 GLU A 155 -14.146 -6.659 11.617 1.00 0.01 H new ATOM 0 HB3 GLU A 155 -13.627 -8.200 10.964 1.00 0.01 H new ATOM 0 HG2 GLU A 155 -11.528 -8.111 12.251 1.00 0.01 H new ATOM 0 HG3 GLU A 155 -11.868 -6.475 12.779 1.00 0.01 H new ATOM 2474 N TYR A 156 -12.899 -4.210 9.437 1.00 0.00 N ATOM 2475 CA TYR A 156 -12.919 -2.722 9.609 1.00 0.01 C ATOM 2476 C TYR A 156 -14.348 -2.238 9.859 1.00 0.01 C ATOM 2477 O TYR A 156 -15.209 -2.370 9.013 1.00 0.01 O ATOM 2478 CB TYR A 156 -12.365 -2.069 8.341 1.00 0.01 C ATOM 2479 CG TYR A 156 -10.966 -2.575 8.083 1.00 0.00 C ATOM 2480 CD1 TYR A 156 -9.870 -1.938 8.676 1.00 0.01 C ATOM 2481 CD2 TYR A 156 -10.766 -3.682 7.249 1.00 0.01 C ATOM 2482 CE1 TYR A 156 -8.573 -2.406 8.434 1.00 0.01 C ATOM 2483 CE2 TYR A 156 -9.469 -4.149 7.006 1.00 0.01 C ATOM 2484 CZ TYR A 156 -8.373 -3.512 7.599 1.00 0.01 C ATOM 2485 OH TYR A 156 -7.094 -3.973 7.357 1.00 0.01 O ATOM 0 H TYR A 156 -13.169 -4.541 8.511 1.00 0.00 H new ATOM 0 HA TYR A 156 -12.305 -2.447 10.466 1.00 0.01 H new ATOM 0 HB2 TYR A 156 -13.008 -2.297 7.491 1.00 0.01 H new ATOM 0 HB3 TYR A 156 -12.356 -0.985 8.452 1.00 0.01 H new ATOM 0 HD1 TYR A 156 -10.025 -1.085 9.320 1.00 0.01 H new ATOM 0 HD2 TYR A 156 -11.612 -4.175 6.794 1.00 0.01 H new ATOM 0 HE1 TYR A 156 -7.727 -1.914 8.891 1.00 0.01 H new ATOM 0 HE2 TYR A 156 -9.314 -5.001 6.361 1.00 0.01 H new ATOM 0 HH TYR A 156 -7.133 -4.747 6.758 1.00 0.01 H new ATOM 2495 N ARG A 157 -14.619 -1.708 11.024 1.00 0.01 N ATOM 2496 CA ARG A 157 -16.010 -1.257 11.335 1.00 0.01 C ATOM 2497 C ARG A 157 -16.204 0.219 10.981 1.00 0.00 C ATOM 2498 O ARG A 157 -17.308 0.643 10.707 1.00 0.01 O ATOM 2499 CB ARG A 157 -16.272 -1.451 12.830 1.00 0.01 C ATOM 2500 CG ARG A 157 -15.106 -0.870 13.633 1.00 0.01 C ATOM 2501 CD ARG A 157 -15.481 -0.826 15.115 1.00 0.00 C ATOM 2502 NE ARG A 157 -15.986 -2.163 15.537 1.00 0.01 N ATOM 2503 CZ ARG A 157 -16.092 -2.449 16.806 1.00 0.01 C ATOM 2504 NH1 ARG A 157 -15.761 -1.564 17.704 1.00 0.01 N ATOM 2505 NH2 ARG A 157 -16.529 -3.620 17.174 1.00 0.01 N ATOM 0 H ARG A 157 -13.940 -1.568 11.772 1.00 0.01 H new ATOM 0 HA ARG A 157 -16.708 -1.848 10.742 1.00 0.01 H new ATOM 0 HB2 ARG A 157 -17.203 -0.960 13.113 1.00 0.01 H new ATOM 0 HB3 ARG A 157 -16.390 -2.511 13.055 1.00 0.01 H new ATOM 0 HG2 ARG A 157 -14.213 -1.479 13.491 1.00 0.01 H new ATOM 0 HG3 ARG A 157 -14.869 0.132 13.277 1.00 0.01 H new ATOM 0 HD2 ARG A 157 -14.613 -0.547 15.713 1.00 0.00 H new ATOM 0 HD3 ARG A 157 -16.244 -0.066 15.286 1.00 0.00 H new ATOM 0 HE ARG A 157 -16.249 -2.854 14.834 1.00 0.01 H new ATOM 0 HH11 ARG A 157 -15.419 -0.648 17.415 1.00 0.01 H new ATOM 0 HH12 ARG A 157 -15.844 -1.788 18.696 1.00 0.01 H new ATOM 0 HH21 ARG A 157 -16.788 -4.312 16.471 1.00 0.01 H new ATOM 0 HH22 ARG A 157 -16.612 -3.845 18.165 1.00 0.01 H new ATOM 2519 N LYS A 158 -15.153 1.006 10.975 1.00 0.01 N ATOM 2520 CA LYS A 158 -15.287 2.460 10.622 1.00 0.01 C ATOM 2521 C LYS A 158 -14.310 2.777 9.477 1.00 0.01 C ATOM 2522 O LYS A 158 -13.290 2.133 9.352 1.00 0.01 O ATOM 2523 CB LYS A 158 -14.922 3.300 11.856 1.00 0.58 C ATOM 2524 CG LYS A 158 -16.118 3.365 12.809 1.00 0.97 C ATOM 2525 CD LYS A 158 -15.724 4.135 14.072 1.00 1.44 C ATOM 2526 CE LYS A 158 -16.798 3.940 15.144 1.00 2.13 C ATOM 2527 NZ LYS A 158 -18.140 4.228 14.562 1.00 2.54 N ATOM 0 H LYS A 158 -14.205 0.705 11.200 1.00 0.01 H new ATOM 0 HA LYS A 158 -16.306 2.688 10.311 1.00 0.01 H new ATOM 0 HB2 LYS A 158 -14.063 2.862 12.365 1.00 0.58 H new ATOM 0 HB3 LYS A 158 -14.633 4.306 11.551 1.00 0.58 H new ATOM 0 HG2 LYS A 158 -16.960 3.855 12.320 1.00 0.97 H new ATOM 0 HG3 LYS A 158 -16.443 2.358 13.071 1.00 0.97 H new ATOM 0 HD2 LYS A 158 -14.760 3.783 14.440 1.00 1.44 H new ATOM 0 HD3 LYS A 158 -15.611 5.195 13.844 1.00 1.44 H new ATOM 0 HE2 LYS A 158 -16.766 2.919 15.524 1.00 2.13 H new ATOM 0 HE3 LYS A 158 -16.607 4.601 15.990 1.00 2.13 H new ATOM 0 HZ1 LYS A 158 -18.806 4.463 15.325 1.00 2.54 H new ATOM 0 HZ2 LYS A 158 -18.069 5.032 13.906 1.00 2.54 H new ATOM 0 HZ3 LYS A 158 -18.483 3.391 14.048 1.00 2.54 H new ATOM 2541 N PRO A 159 -14.579 3.773 8.660 1.00 0.01 N ATOM 2542 CA PRO A 159 -13.633 4.122 7.560 1.00 0.02 C ATOM 2543 C PRO A 159 -12.265 4.517 8.129 1.00 0.01 C ATOM 2544 O PRO A 159 -11.235 4.134 7.606 1.00 0.01 O ATOM 2545 CB PRO A 159 -14.344 5.303 6.872 1.00 0.41 C ATOM 2546 CG PRO A 159 -15.513 5.746 7.773 1.00 0.70 C ATOM 2547 CD PRO A 159 -15.808 4.608 8.763 1.00 0.28 C ATOM 0 HA PRO A 159 -13.422 3.302 6.873 1.00 0.02 H new ATOM 0 HB2 PRO A 159 -13.649 6.128 6.717 1.00 0.41 H new ATOM 0 HB3 PRO A 159 -14.711 5.007 5.890 1.00 0.41 H new ATOM 0 HG2 PRO A 159 -15.256 6.660 8.309 1.00 0.70 H new ATOM 0 HG3 PRO A 159 -16.395 5.966 7.172 1.00 0.70 H new ATOM 0 HD2 PRO A 159 -15.964 4.980 9.776 1.00 0.28 H new ATOM 0 HD3 PRO A 159 -16.703 4.050 8.487 1.00 0.28 H new ATOM 2555 N VAL A 160 -12.232 5.279 9.184 1.00 0.01 N ATOM 2556 CA VAL A 160 -10.917 5.674 9.754 1.00 0.02 C ATOM 2557 C VAL A 160 -10.168 4.408 10.171 1.00 0.02 C ATOM 2558 O VAL A 160 -8.962 4.407 10.308 1.00 0.02 O ATOM 2559 CB VAL A 160 -11.138 6.570 10.974 1.00 0.14 C ATOM 2560 CG1 VAL A 160 -9.784 6.989 11.549 1.00 0.86 C ATOM 2561 CG2 VAL A 160 -11.921 7.816 10.554 1.00 0.74 C ATOM 0 H VAL A 160 -13.050 5.642 9.672 1.00 0.01 H new ATOM 0 HA VAL A 160 -10.335 6.222 9.013 1.00 0.02 H new ATOM 0 HB VAL A 160 -11.701 6.024 11.731 1.00 0.14 H new ATOM 0 HG11 VAL A 160 -9.940 7.628 12.418 1.00 0.86 H new ATOM 0 HG12 VAL A 160 -9.225 6.102 11.846 1.00 0.86 H new ATOM 0 HG13 VAL A 160 -9.221 7.537 10.793 1.00 0.86 H new ATOM 0 HG21 VAL A 160 -12.080 8.456 11.422 1.00 0.74 H new ATOM 0 HG22 VAL A 160 -11.357 8.363 9.798 1.00 0.74 H new ATOM 0 HG23 VAL A 160 -12.885 7.518 10.142 1.00 0.74 H new ATOM 2571 N ASP A 161 -10.867 3.323 10.364 1.00 0.00 N ATOM 2572 CA ASP A 161 -10.172 2.069 10.757 1.00 0.01 C ATOM 2573 C ASP A 161 -9.268 1.603 9.610 1.00 0.01 C ATOM 2574 O ASP A 161 -8.381 0.794 9.795 1.00 0.01 O ATOM 2575 CB ASP A 161 -11.204 0.981 11.063 1.00 0.00 C ATOM 2576 CG ASP A 161 -10.528 -0.174 11.802 1.00 0.02 C ATOM 2577 OD1 ASP A 161 -9.325 -0.318 11.662 1.00 0.00 O ATOM 2578 OD2 ASP A 161 -11.225 -0.896 12.496 1.00 0.00 O ATOM 0 H ASP A 161 -11.880 3.252 10.267 1.00 0.00 H new ATOM 0 HA ASP A 161 -9.569 2.256 11.645 1.00 0.01 H new ATOM 0 HB2 ASP A 161 -12.011 1.392 11.670 1.00 0.00 H new ATOM 0 HB3 ASP A 161 -11.653 0.621 10.137 1.00 0.00 H new ATOM 2583 N TRP A 162 -9.479 2.125 8.425 1.00 0.01 N ATOM 2584 CA TRP A 162 -8.623 1.733 7.261 1.00 0.01 C ATOM 2585 C TRP A 162 -7.497 2.769 7.135 1.00 0.01 C ATOM 2586 O TRP A 162 -6.760 2.769 6.169 1.00 0.01 O ATOM 2587 CB TRP A 162 -9.466 1.779 5.953 1.00 0.01 C ATOM 2588 CG TRP A 162 -9.736 0.424 5.349 1.00 0.02 C ATOM 2589 CD1 TRP A 162 -8.933 -0.675 5.390 1.00 0.01 C ATOM 2590 CD2 TRP A 162 -10.893 0.044 4.551 1.00 0.01 C ATOM 2591 NE1 TRP A 162 -9.546 -1.699 4.688 1.00 0.01 N ATOM 2592 CE2 TRP A 162 -10.754 -1.303 4.152 1.00 0.01 C ATOM 2593 CE3 TRP A 162 -12.049 0.738 4.149 1.00 0.01 C ATOM 2594 CZ2 TRP A 162 -11.724 -1.939 3.376 1.00 0.01 C ATOM 2595 CZ3 TRP A 162 -13.026 0.103 3.367 1.00 0.01 C ATOM 2596 CH2 TRP A 162 -12.863 -1.233 2.981 1.00 0.01 C ATOM 0 H TRP A 162 -10.208 2.806 8.214 1.00 0.01 H new ATOM 0 HA TRP A 162 -8.228 0.728 7.412 1.00 0.01 H new ATOM 0 HB2 TRP A 162 -10.417 2.268 6.163 1.00 0.01 H new ATOM 0 HB3 TRP A 162 -8.946 2.395 5.219 1.00 0.01 H new ATOM 0 HD1 TRP A 162 -7.977 -0.738 5.888 1.00 0.01 H new ATOM 0 HE1 TRP A 162 -9.152 -2.634 4.580 1.00 0.01 H new ATOM 0 HE3 TRP A 162 -12.186 1.768 4.445 1.00 0.01 H new ATOM 0 HZ2 TRP A 162 -11.595 -2.970 3.083 1.00 0.01 H new ATOM 0 HZ3 TRP A 162 -13.907 0.647 3.062 1.00 0.01 H new ATOM 0 HH2 TRP A 162 -13.617 -1.717 2.378 1.00 0.01 H new ATOM 2607 N GLY A 163 -7.341 3.640 8.090 1.00 0.02 N ATOM 2608 CA GLY A 163 -6.246 4.642 7.990 1.00 0.01 C ATOM 2609 C GLY A 163 -6.644 5.745 7.008 1.00 0.01 C ATOM 2610 O GLY A 163 -5.834 6.551 6.598 1.00 0.01 O ATOM 0 H GLY A 163 -7.918 3.702 8.929 1.00 0.02 H new ATOM 0 HA2 GLY A 163 -6.042 5.071 8.971 1.00 0.01 H new ATOM 0 HA3 GLY A 163 -5.328 4.159 7.657 1.00 0.01 H new ATOM 2614 N ALA A 164 -7.891 5.762 6.605 1.00 0.01 N ATOM 2615 CA ALA A 164 -8.359 6.782 5.616 1.00 0.02 C ATOM 2616 C ALA A 164 -9.081 7.920 6.335 1.00 0.01 C ATOM 2617 O ALA A 164 -9.808 7.716 7.287 1.00 0.02 O ATOM 2618 CB ALA A 164 -9.354 6.116 4.663 1.00 0.01 C ATOM 0 H ALA A 164 -8.609 5.109 6.921 1.00 0.01 H new ATOM 0 HA ALA A 164 -7.499 7.177 5.075 1.00 0.02 H new ATOM 0 HB1 ALA A 164 -9.705 6.847 3.935 1.00 0.01 H new ATOM 0 HB2 ALA A 164 -8.865 5.292 4.143 1.00 0.01 H new ATOM 0 HB3 ALA A 164 -10.202 5.734 5.231 1.00 0.01 H new ATOM 2624 N ALA A 165 -8.882 9.123 5.869 1.00 0.02 N ATOM 2625 CA ALA A 165 -9.547 10.300 6.492 1.00 0.01 C ATOM 2626 C ALA A 165 -10.949 10.477 5.903 1.00 0.02 C ATOM 2627 O ALA A 165 -11.727 11.280 6.378 1.00 0.01 O ATOM 2628 CB ALA A 165 -8.728 11.563 6.216 1.00 0.59 C ATOM 0 H ALA A 165 -8.280 9.341 5.075 1.00 0.02 H new ATOM 0 HA ALA A 165 -9.619 10.136 7.567 1.00 0.01 H new ATOM 0 HB1 ALA A 165 -9.219 12.422 6.674 1.00 0.59 H new ATOM 0 HB2 ALA A 165 -7.729 11.448 6.637 1.00 0.59 H new ATOM 0 HB3 ALA A 165 -8.652 11.720 5.140 1.00 0.59 H new ATOM 2634 N SER A 166 -11.293 9.731 4.878 1.00 0.01 N ATOM 2635 CA SER A 166 -12.654 9.850 4.269 1.00 0.01 C ATOM 2636 C SER A 166 -13.118 8.443 3.823 1.00 0.02 C ATOM 2637 O SER A 166 -12.298 7.630 3.445 1.00 0.01 O ATOM 2638 CB SER A 166 -12.571 10.781 3.052 1.00 0.72 C ATOM 2639 OG SER A 166 -13.856 11.321 2.778 1.00 0.87 O ATOM 0 H SER A 166 -10.684 9.042 4.436 1.00 0.01 H new ATOM 0 HA SER A 166 -13.363 10.258 4.989 1.00 0.01 H new ATOM 0 HB2 SER A 166 -11.861 11.585 3.244 1.00 0.72 H new ATOM 0 HB3 SER A 166 -12.204 10.232 2.185 1.00 0.72 H new ATOM 0 HG SER A 166 -13.802 11.917 2.002 1.00 0.87 H new ATOM 2645 N PRO A 167 -14.404 8.137 3.844 1.00 0.02 N ATOM 2646 CA PRO A 167 -14.873 6.785 3.401 1.00 0.01 C ATOM 2647 C PRO A 167 -14.834 6.628 1.873 1.00 0.01 C ATOM 2648 O PRO A 167 -15.542 5.813 1.306 1.00 0.01 O ATOM 2649 CB PRO A 167 -16.322 6.773 3.910 1.00 0.38 C ATOM 2650 CG PRO A 167 -16.752 8.234 4.108 1.00 0.35 C ATOM 2651 CD PRO A 167 -15.477 9.071 4.307 1.00 0.22 C ATOM 0 HA PRO A 167 -14.252 5.972 3.778 1.00 0.01 H new ATOM 0 HB2 PRO A 167 -16.976 6.274 3.195 1.00 0.38 H new ATOM 0 HB3 PRO A 167 -16.395 6.221 4.847 1.00 0.38 H new ATOM 0 HG2 PRO A 167 -17.312 8.589 3.243 1.00 0.35 H new ATOM 0 HG3 PRO A 167 -17.409 8.326 4.973 1.00 0.35 H new ATOM 0 HD2 PRO A 167 -15.498 9.989 3.720 1.00 0.22 H new ATOM 0 HD3 PRO A 167 -15.341 9.362 5.349 1.00 0.22 H new ATOM 2659 N ALA A 168 -14.046 7.422 1.198 1.00 0.01 N ATOM 2660 CA ALA A 168 -14.013 7.334 -0.291 1.00 0.01 C ATOM 2661 C ALA A 168 -13.082 6.213 -0.775 1.00 0.01 C ATOM 2662 O ALA A 168 -11.908 6.160 -0.467 1.00 0.02 O ATOM 2663 CB ALA A 168 -13.522 8.666 -0.861 1.00 0.18 C ATOM 0 H ALA A 168 -13.429 8.122 1.609 1.00 0.01 H new ATOM 0 HA ALA A 168 -15.022 7.111 -0.637 1.00 0.01 H new ATOM 0 HB1 ALA A 168 -13.495 8.608 -1.949 1.00 0.18 H new ATOM 0 HB2 ALA A 168 -14.199 9.464 -0.556 1.00 0.18 H new ATOM 0 HB3 ALA A 168 -12.521 8.876 -0.484 1.00 0.18 H new ATOM 2669 N ILE A 169 -13.647 5.330 -1.551 1.00 0.01 N ATOM 2670 CA ILE A 169 -12.894 4.178 -2.128 1.00 0.01 C ATOM 2671 C ILE A 169 -13.498 3.901 -3.503 1.00 0.01 C ATOM 2672 O ILE A 169 -14.699 3.767 -3.631 1.00 0.01 O ATOM 2673 CB ILE A 169 -13.079 2.954 -1.219 1.00 1.81 C ATOM 2674 CG1 ILE A 169 -12.674 3.328 0.214 1.00 2.75 C ATOM 2675 CG2 ILE A 169 -12.223 1.774 -1.720 1.00 2.24 C ATOM 2676 CD1 ILE A 169 -12.662 2.075 1.092 1.00 3.99 C ATOM 0 H ILE A 169 -14.631 5.360 -1.818 1.00 0.01 H new ATOM 0 HA ILE A 169 -11.829 4.393 -2.210 1.00 0.01 H new ATOM 0 HB ILE A 169 -14.125 2.648 -1.237 1.00 1.81 H new ATOM 0 HG12 ILE A 169 -11.688 3.793 0.214 1.00 2.75 H new ATOM 0 HG13 ILE A 169 -13.372 4.061 0.619 1.00 2.75 H new ATOM 0 HG21 ILE A 169 -12.367 0.916 -1.064 1.00 2.24 H new ATOM 0 HG22 ILE A 169 -12.525 1.510 -2.734 1.00 2.24 H new ATOM 0 HG23 ILE A 169 -11.171 2.060 -1.717 1.00 2.24 H new ATOM 0 HD11 ILE A 169 -12.374 2.345 2.108 1.00 3.99 H new ATOM 0 HD12 ILE A 169 -13.657 1.629 1.103 1.00 3.99 H new ATOM 0 HD13 ILE A 169 -11.947 1.357 0.691 1.00 3.99 H new ATOM 2688 N GLN A 170 -12.693 3.857 -4.547 1.00 0.01 N ATOM 2689 CA GLN A 170 -13.243 3.638 -5.926 1.00 0.01 C ATOM 2690 C GLN A 170 -12.836 2.286 -6.523 1.00 0.02 C ATOM 2691 O GLN A 170 -13.482 1.823 -7.444 1.00 0.01 O ATOM 2692 CB GLN A 170 -12.749 4.758 -6.844 1.00 2.62 C ATOM 2693 CG GLN A 170 -13.211 6.110 -6.295 1.00 3.39 C ATOM 2694 CD GLN A 170 -14.707 6.288 -6.566 1.00 4.36 C ATOM 2695 OE1 GLN A 170 -15.274 5.601 -7.392 1.00 4.83 O ATOM 2696 NE2 GLN A 170 -15.376 7.190 -5.900 1.00 5.17 N ATOM 0 H GLN A 170 -11.680 3.964 -4.500 1.00 0.01 H new ATOM 0 HA GLN A 170 -14.330 3.643 -5.846 1.00 0.01 H new ATOM 0 HB2 GLN A 170 -11.661 4.734 -6.912 1.00 2.62 H new ATOM 0 HB3 GLN A 170 -13.135 4.612 -7.853 1.00 2.62 H new ATOM 0 HG2 GLN A 170 -13.016 6.165 -5.224 1.00 3.39 H new ATOM 0 HG3 GLN A 170 -12.647 6.917 -6.764 1.00 3.39 H new ATOM 0 HE21 GLN A 170 -14.902 7.768 -5.206 1.00 5.17 H new ATOM 0 HE22 GLN A 170 -16.373 7.317 -6.074 1.00 5.17 H new ATOM 2705 N SER A 171 -11.809 1.614 -6.059 1.00 0.01 N ATOM 2706 CA SER A 171 -11.478 0.297 -6.698 1.00 0.01 C ATOM 2707 C SER A 171 -10.660 -0.569 -5.731 1.00 0.01 C ATOM 2708 O SER A 171 -10.030 -0.074 -4.818 1.00 0.01 O ATOM 2709 CB SER A 171 -10.671 0.540 -7.973 1.00 0.01 C ATOM 2710 OG SER A 171 -9.299 0.691 -7.639 1.00 0.02 O ATOM 0 H SER A 171 -11.203 1.906 -5.292 1.00 0.01 H new ATOM 0 HA SER A 171 -12.404 -0.223 -6.942 1.00 0.01 H new ATOM 0 HB2 SER A 171 -10.799 -0.294 -8.663 1.00 0.01 H new ATOM 0 HB3 SER A 171 -11.034 1.433 -8.482 1.00 0.01 H new ATOM 0 HG SER A 171 -8.958 1.525 -8.024 1.00 0.02 H new ATOM 2716 N PHE A 172 -10.632 -1.865 -5.951 1.00 0.01 N ATOM 2717 CA PHE A 172 -9.813 -2.753 -5.061 1.00 0.01 C ATOM 2718 C PHE A 172 -9.358 -4.001 -5.822 1.00 0.01 C ATOM 2719 O PHE A 172 -9.973 -4.413 -6.785 1.00 0.01 O ATOM 2720 CB PHE A 172 -10.589 -3.149 -3.790 1.00 1.06 C ATOM 2721 CG PHE A 172 -11.987 -3.654 -4.097 1.00 0.75 C ATOM 2722 CD1 PHE A 172 -12.169 -4.884 -4.744 1.00 0.75 C ATOM 2723 CD2 PHE A 172 -13.105 -2.904 -3.699 1.00 1.29 C ATOM 2724 CE1 PHE A 172 -13.462 -5.358 -4.998 1.00 1.16 C ATOM 2725 CE2 PHE A 172 -14.398 -3.382 -3.950 1.00 2.02 C ATOM 2726 CZ PHE A 172 -14.576 -4.608 -4.602 1.00 1.92 C ATOM 0 H PHE A 172 -11.135 -2.342 -6.700 1.00 0.01 H new ATOM 0 HA PHE A 172 -8.932 -2.191 -4.750 1.00 0.01 H new ATOM 0 HB2 PHE A 172 -10.036 -3.922 -3.256 1.00 1.06 H new ATOM 0 HB3 PHE A 172 -10.655 -2.288 -3.125 1.00 1.06 H new ATOM 0 HD1 PHE A 172 -11.311 -5.467 -5.047 1.00 0.75 H new ATOM 0 HD2 PHE A 172 -12.968 -1.957 -3.198 1.00 1.29 H new ATOM 0 HE1 PHE A 172 -13.600 -6.304 -5.500 1.00 1.16 H new ATOM 0 HE2 PHE A 172 -15.257 -2.805 -3.641 1.00 2.02 H new ATOM 0 HZ PHE A 172 -15.572 -4.975 -4.799 1.00 1.92 H new ATOM 2736 N ARG A 173 -8.268 -4.601 -5.404 1.00 0.01 N ATOM 2737 CA ARG A 173 -7.754 -5.817 -6.114 1.00 0.01 C ATOM 2738 C ARG A 173 -7.135 -6.799 -5.119 1.00 0.01 C ATOM 2739 O ARG A 173 -6.625 -6.419 -4.084 1.00 0.01 O ATOM 2740 CB ARG A 173 -6.657 -5.416 -7.106 1.00 0.01 C ATOM 2741 CG ARG A 173 -7.200 -4.435 -8.155 1.00 0.01 C ATOM 2742 CD ARG A 173 -6.326 -4.492 -9.419 1.00 0.01 C ATOM 2743 NE ARG A 173 -6.769 -5.628 -10.275 1.00 0.01 N ATOM 2744 CZ ARG A 173 -6.378 -5.703 -11.520 1.00 0.01 C ATOM 2745 NH1 ARG A 173 -5.597 -4.783 -12.016 1.00 0.01 N ATOM 2746 NH2 ARG A 173 -6.769 -6.698 -12.268 1.00 0.01 N ATOM 0 H ARG A 173 -7.712 -4.302 -4.603 1.00 0.01 H new ATOM 0 HA ARG A 173 -8.594 -6.282 -6.629 1.00 0.01 H new ATOM 0 HB2 ARG A 173 -5.826 -4.958 -6.570 1.00 0.01 H new ATOM 0 HB3 ARG A 173 -6.266 -6.305 -7.601 1.00 0.01 H new ATOM 0 HG2 ARG A 173 -8.231 -4.686 -8.403 1.00 0.01 H new ATOM 0 HG3 ARG A 173 -7.207 -3.423 -7.751 1.00 0.01 H new ATOM 0 HD2 ARG A 173 -6.403 -3.555 -9.970 1.00 0.01 H new ATOM 0 HD3 ARG A 173 -5.278 -4.615 -9.145 1.00 0.01 H new ATOM 0 HE ARG A 173 -7.379 -6.349 -9.889 1.00 0.01 H new ATOM 0 HH11 ARG A 173 -5.291 -4.005 -11.432 1.00 0.01 H new ATOM 0 HH12 ARG A 173 -5.292 -4.842 -12.988 1.00 0.01 H new ATOM 0 HH21 ARG A 173 -7.380 -7.417 -11.881 1.00 0.01 H new ATOM 0 HH22 ARG A 173 -6.464 -6.756 -13.240 1.00 0.01 H new ATOM 2760 N ARG A 174 -7.167 -8.064 -5.444 1.00 0.01 N ATOM 2761 CA ARG A 174 -6.568 -9.093 -4.547 1.00 0.01 C ATOM 2762 C ARG A 174 -5.083 -9.254 -4.893 1.00 0.01 C ATOM 2763 O ARG A 174 -4.699 -9.215 -6.044 1.00 0.01 O ATOM 2764 CB ARG A 174 -7.272 -10.436 -4.757 1.00 0.01 C ATOM 2765 CG ARG A 174 -7.135 -10.860 -6.221 1.00 0.01 C ATOM 2766 CD ARG A 174 -7.998 -12.098 -6.477 1.00 0.01 C ATOM 2767 NE ARG A 174 -8.045 -12.375 -7.940 1.00 0.01 N ATOM 2768 CZ ARG A 174 -8.463 -13.534 -8.371 1.00 0.01 C ATOM 2769 NH1 ARG A 174 -8.839 -14.451 -7.522 1.00 0.01 N ATOM 2770 NH2 ARG A 174 -8.502 -13.777 -9.654 1.00 0.01 N ATOM 0 H ARG A 174 -7.586 -8.430 -6.299 1.00 0.01 H new ATOM 0 HA ARG A 174 -6.683 -8.779 -3.510 1.00 0.01 H new ATOM 0 HB2 ARG A 174 -6.836 -11.193 -4.106 1.00 0.01 H new ATOM 0 HB3 ARG A 174 -8.325 -10.353 -4.488 1.00 0.01 H new ATOM 0 HG2 ARG A 174 -7.444 -10.046 -6.877 1.00 0.01 H new ATOM 0 HG3 ARG A 174 -6.092 -11.077 -6.452 1.00 0.01 H new ATOM 0 HD2 ARG A 174 -7.588 -12.957 -5.946 1.00 0.01 H new ATOM 0 HD3 ARG A 174 -9.006 -11.938 -6.093 1.00 0.01 H new ATOM 0 HE ARG A 174 -7.751 -11.659 -8.605 1.00 0.01 H new ATOM 0 HH11 ARG A 174 -8.806 -14.263 -6.520 1.00 0.01 H new ATOM 0 HH12 ARG A 174 -9.165 -15.356 -7.860 1.00 0.01 H new ATOM 0 HH21 ARG A 174 -8.206 -13.061 -10.318 1.00 0.01 H new ATOM 0 HH22 ARG A 174 -8.828 -14.682 -9.992 1.00 0.01 H new ATOM 2784 N ILE A 175 -4.245 -9.455 -3.907 1.00 0.01 N ATOM 2785 CA ILE A 175 -2.787 -9.641 -4.198 1.00 0.01 C ATOM 2786 C ILE A 175 -2.487 -11.136 -4.322 1.00 0.00 C ATOM 2787 O ILE A 175 -2.839 -11.919 -3.463 1.00 0.01 O ATOM 2788 CB ILE A 175 -1.925 -9.061 -3.071 1.00 1.52 C ATOM 2789 CG1 ILE A 175 -2.411 -7.657 -2.703 1.00 2.51 C ATOM 2790 CG2 ILE A 175 -0.472 -8.983 -3.544 1.00 1.75 C ATOM 2791 CD1 ILE A 175 -1.459 -7.046 -1.667 1.00 3.04 C ATOM 0 H ILE A 175 -4.502 -9.498 -2.921 1.00 0.01 H new ATOM 0 HA ILE A 175 -2.552 -9.121 -5.127 1.00 0.01 H new ATOM 0 HB ILE A 175 -2.001 -9.704 -2.194 1.00 1.52 H new ATOM 0 HG12 ILE A 175 -2.450 -7.029 -3.593 1.00 2.51 H new ATOM 0 HG13 ILE A 175 -3.423 -7.704 -2.301 1.00 2.51 H new ATOM 0 HG21 ILE A 175 0.148 -8.571 -2.748 1.00 1.75 H new ATOM 0 HG22 ILE A 175 -0.118 -9.982 -3.800 1.00 1.75 H new ATOM 0 HG23 ILE A 175 -0.409 -8.340 -4.422 1.00 1.75 H new ATOM 0 HD11 ILE A 175 -1.802 -6.046 -1.403 1.00 3.04 H new ATOM 0 HD12 ILE A 175 -1.442 -7.672 -0.775 1.00 3.04 H new ATOM 0 HD13 ILE A 175 -0.455 -6.986 -2.087 1.00 3.04 H new ATOM 2803 N VAL A 176 -1.839 -11.542 -5.386 1.00 0.01 N ATOM 2804 CA VAL A 176 -1.513 -12.992 -5.573 1.00 0.00 C ATOM 2805 C VAL A 176 -0.071 -13.133 -6.067 1.00 0.01 C ATOM 2806 O VAL A 176 0.432 -12.297 -6.791 1.00 0.00 O ATOM 2807 CB VAL A 176 -2.453 -13.600 -6.616 1.00 1.38 C ATOM 2808 CG1 VAL A 176 -3.857 -13.728 -6.024 1.00 1.88 C ATOM 2809 CG2 VAL A 176 -2.499 -12.694 -7.848 1.00 1.89 C ATOM 0 H VAL A 176 -1.520 -10.930 -6.137 1.00 0.01 H new ATOM 0 HA VAL A 176 -1.632 -13.510 -4.621 1.00 0.00 H new ATOM 0 HB VAL A 176 -2.089 -14.587 -6.903 1.00 1.38 H new ATOM 0 HG11 VAL A 176 -4.527 -14.161 -6.767 1.00 1.88 H new ATOM 0 HG12 VAL A 176 -3.824 -14.372 -5.145 1.00 1.88 H new ATOM 0 HG13 VAL A 176 -4.222 -12.742 -5.737 1.00 1.88 H new ATOM 0 HG21 VAL A 176 -3.168 -13.126 -8.592 1.00 1.89 H new ATOM 0 HG22 VAL A 176 -2.863 -11.708 -7.561 1.00 1.89 H new ATOM 0 HG23 VAL A 176 -1.498 -12.602 -8.270 1.00 1.89 H new ATOM 2819 N GLU A 177 0.596 -14.185 -5.679 1.00 0.01 N ATOM 2820 CA GLU A 177 2.005 -14.389 -6.121 1.00 0.01 C ATOM 2821 C GLU A 177 2.374 -15.868 -5.980 1.00 0.01 C ATOM 2822 CB GLU A 177 2.939 -13.547 -5.250 1.00 2.15 C ATOM 2823 CG GLU A 177 4.380 -13.705 -5.741 1.00 3.19 C ATOM 2824 CD GLU A 177 5.263 -12.646 -5.080 1.00 4.20 C ATOM 2825 OE1 GLU A 177 4.940 -11.475 -5.197 1.00 4.77 O ATOM 2826 OE2 GLU A 177 6.249 -13.023 -4.466 1.00 4.89 O ATOM 0 H GLU A 177 0.224 -14.916 -5.072 1.00 0.01 H new ATOM 0 HA GLU A 177 2.107 -14.086 -7.163 1.00 0.01 H new ATOM 0 HB2 GLU A 177 2.643 -12.499 -5.290 1.00 2.15 H new ATOM 0 HB3 GLU A 177 2.862 -13.860 -4.209 1.00 2.15 H new ATOM 0 HG2 GLU A 177 4.749 -14.702 -5.502 1.00 3.19 H new ATOM 0 HG3 GLU A 177 4.419 -13.601 -6.825 1.00 3.19 H new TER 2833 GLU A 177