USER MOD reduce.3.24.130724 H: found=0, std=0, add=1497, rem=0, adj=48 USER MOD reduce.3.24.130724 removed 1498 hydrogens (22 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 191 GLC O2 : rot 140:sc= 0.139 USER MOD Set 1.2: A 192 BGC O3 : rot -1:sc= 0.263 USER MOD Set 2.1: A 110 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 113 LYS NZ :NH3+ 138:sc= -0.43 (180deg=-1.88!) USER MOD Set 3.1: A 96 GLN : amide:sc= 0 K(o=0,f=-1.7) USER MOD Set 3.2: A 99 GLN : amide:sc= 0 K(o=0,f=-1.7!) USER MOD Set 4.1: A 20 SER OG : rot 180:sc= -0.598 USER MOD Set 4.2: A 31 LYS NZ :NH3+ 141:sc= -0.499 (180deg=-2.07!) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 ASN : amide:sc= -5.99! C(o=-6!,f=-8.1!) USER MOD Single : A 21 HIS : no HD1:sc= -0.195 X(o=-0.2,f=-0.0064) USER MOD Single : A 25 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 28 HIS : no HE2:sc= -2.22 K(o=-2.2,f=-3.8!) USER MOD Single : A 29 TYR OH : rot 120:sc=-0.000128 USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 44 TYR OH : rot 180:sc= 0 USER MOD Single : A 46 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 47 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.039) USER MOD Single : A 53 SER OG : rot 132:sc= -0.0221 USER MOD Single : A 54 ASN : amide:sc= -0.122 X(o=-0.12,f=-0.015) USER MOD Single : A 58 GLN : amide:sc= -2.17 K(o=-2.2,f=-2.8!) USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 GLN : amide:sc= -0.847 X(o=-0.85,f=-0.61) USER MOD Single : A 63 THR OG1 : rot -88:sc= 0.609 USER MOD Single : A 66 TYR OH : rot 180:sc= 0 USER MOD Single : A 67 ASN : amide:sc= -0.319 K(o=-0.32,f=-1.5) USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 73 TYR OH : rot 180:sc= -0.0236 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 TYR OH : rot 180:sc= -0.857 USER MOD Single : A 88 LYS NZ :NH3+ -171:sc= -4.04! (180deg=-4.87!) USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 SER OG : rot 180:sc= -0.0806 USER MOD Single : A 98 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 100 LYS NZ :NH3+ 169:sc= -0.0133 (180deg=-0.169) USER MOD Single : A 107 ASN : amide:sc= -2.52 K(o=-2.5,f=-1.2) USER MOD Single : A 109 HIS : no HE2:sc= 0.0216 X(o=0.022,f=-0.39) USER MOD Single : A 123 HIS : no HD1:sc= 0 X(o=0,f=-0.0022) USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 125 THR OG1 : rot 180:sc= 0 USER MOD Single : A 127 HIS : no HD1:sc= -0.102 X(o=-0.1,f=-0.42) USER MOD Single : A 134 SER OG : rot 180:sc= 0 USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD Single : A 143 GLN : amide:sc= -0.0112 K(o=-0.011,f=-2!) USER MOD Single : A 147 SER OG : rot 29:sc= 0.0235 USER MOD Single : A 148 THR OG1 : rot 180:sc= 0 USER MOD Single : A 150 THR OG1 : rot 180:sc= 0 USER MOD Single : A 152 LYS NZ :NH3+ -144:sc= 1.08 (180deg=0.665) USER MOD Single : A 154 SER OG : rot 23:sc= 0.181 USER MOD Single : A 159 LYS NZ :NH3+ -132:sc= 0.0466 (180deg=-0.0693) USER MOD Single : A 161 TYR OH : rot 180:sc= 0 USER MOD Single : A 162 TYR OH : rot 180:sc= 0 USER MOD Single : A 164 ASN : amide:sc= -7.54! C(o=-7.5!,f=-5.2!) USER MOD Single : A 166 LYS NZ :NH3+ -167:sc= -0.0399 (180deg=-0.283) USER MOD Single : A 168 CYS SG : rot 180:sc= 0 USER MOD Single : A 173 MET CE :methyl 155:sc= -0.266 (180deg=-0.958) USER MOD Single : A 174 LYS NZ :NH3+ -161:sc= -0.0839 (180deg=-0.482) USER MOD Single : A 176 THR OG1 : rot 180:sc= 0 USER MOD Single : A 182 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 184 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 186 HIS : no HE2:sc= -0.161 K(o=-0.16,f=-2.3) USER MOD Single : A 191 GLC O3 : rot 180:sc= 0 USER MOD Single : A 191 GLC O4 : rot 117:sc= 0.531 USER MOD Single : A 191 GLC O6 : rot -12:sc= 0.291 USER MOD Single : A 192 BGC O1 : rot 180:sc= 0 USER MOD Single : A 192 BGC O2 : rot -109:sc= 0.632 USER MOD Single : A 192 BGC O6 : rot -20:sc= 0.327 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 23.262 -21.406 -6.806 1.00 8.93 N ATOM 2 CA GLY A 1 23.124 -20.234 -5.900 1.00 8.42 C ATOM 3 C GLY A 1 21.678 -19.829 -5.692 1.00 7.62 C ATOM 4 O GLY A 1 21.083 -19.171 -6.550 1.00 7.93 O ATOM 0 H1 GLY A 1 24.269 -21.643 -6.916 1.00 8.93 H new ATOM 0 H2 GLY A 1 22.757 -22.220 -6.401 1.00 8.93 H new ATOM 0 H3 GLY A 1 22.857 -21.176 -7.736 1.00 8.93 H new ATOM 0 HA2 GLY A 1 23.575 -20.469 -4.936 1.00 8.42 H new ATOM 0 HA3 GLY A 1 23.678 -19.392 -6.314 1.00 8.42 H new ATOM 10 N ALA A 2 21.108 -20.231 -4.528 1.00 6.82 N ATOM 11 CA ALA A 2 19.702 -19.921 -4.164 1.00 6.18 C ATOM 12 C ALA A 2 19.619 -18.922 -2.972 1.00 5.26 C ATOM 13 O ALA A 2 20.314 -19.070 -1.949 1.00 5.28 O ATOM 14 CB ALA A 2 18.925 -21.229 -3.851 1.00 6.51 C ATOM 0 H ALA A 2 21.604 -20.774 -3.821 1.00 6.82 H new ATOM 0 HA ALA A 2 19.235 -19.435 -5.021 1.00 6.18 H new ATOM 0 HB1 ALA A 2 17.896 -20.986 -3.586 1.00 6.51 H new ATOM 0 HB2 ALA A 2 18.931 -21.875 -4.729 1.00 6.51 H new ATOM 0 HB3 ALA A 2 19.402 -21.745 -3.018 1.00 6.51 H new ATOM 20 N MET A 3 18.772 -17.881 -3.134 1.00 4.80 N ATOM 21 CA MET A 3 18.581 -16.846 -2.102 1.00 4.18 C ATOM 22 C MET A 3 17.090 -16.609 -1.807 1.00 3.48 C ATOM 23 O MET A 3 16.342 -16.116 -2.660 1.00 3.94 O ATOM 24 CB MET A 3 19.240 -15.519 -2.537 1.00 4.96 C ATOM 25 CG MET A 3 20.777 -15.536 -2.545 1.00 5.72 C ATOM 26 SD MET A 3 21.480 -13.985 -3.142 1.00 6.64 S ATOM 27 CE MET A 3 23.238 -14.316 -3.000 1.00 7.64 C ATOM 0 H MET A 3 18.210 -17.738 -3.973 1.00 4.80 H new ATOM 0 HA MET A 3 19.058 -17.205 -1.190 1.00 4.18 H new ATOM 0 HB2 MET A 3 18.888 -15.265 -3.537 1.00 4.96 H new ATOM 0 HB3 MET A 3 18.903 -14.726 -1.870 1.00 4.96 H new ATOM 0 HG2 MET A 3 21.141 -15.732 -1.536 1.00 5.72 H new ATOM 0 HG3 MET A 3 21.125 -16.355 -3.174 1.00 5.72 H new ATOM 0 HE1 MET A 3 23.801 -13.444 -3.334 1.00 7.64 H new ATOM 0 HE2 MET A 3 23.485 -14.530 -1.960 1.00 7.64 H new ATOM 0 HE3 MET A 3 23.498 -15.175 -3.619 1.00 7.64 H new ATOM 37 N SER A 4 16.677 -16.966 -0.578 1.00 2.65 N ATOM 38 CA SER A 4 15.281 -16.806 -0.131 1.00 2.27 C ATOM 39 C SER A 4 15.206 -16.242 1.296 1.00 1.31 C ATOM 40 O SER A 4 15.541 -16.928 2.270 1.00 0.88 O ATOM 41 CB SER A 4 14.532 -18.148 -0.202 1.00 2.95 C ATOM 42 OG SER A 4 14.047 -18.403 -1.511 1.00 3.86 O ATOM 0 H SER A 4 17.294 -17.369 0.127 1.00 2.65 H new ATOM 0 HA SER A 4 14.804 -16.094 -0.804 1.00 2.27 H new ATOM 0 HB2 SER A 4 15.198 -18.955 0.104 1.00 2.95 H new ATOM 0 HB3 SER A 4 13.699 -18.139 0.501 1.00 2.95 H new ATOM 0 HG SER A 4 13.578 -19.263 -1.524 1.00 3.86 H new ATOM 48 N GLY A 5 14.758 -14.982 1.399 1.00 1.11 N ATOM 49 CA GLY A 5 14.637 -14.318 2.693 1.00 0.31 C ATOM 50 C GLY A 5 13.973 -12.954 2.598 1.00 0.28 C ATOM 51 O GLY A 5 14.653 -11.942 2.421 1.00 0.31 O ATOM 0 H GLY A 5 14.476 -14.410 0.603 1.00 1.11 H new ATOM 0 HA2 GLY A 5 14.061 -14.951 3.368 1.00 0.31 H new ATOM 0 HA3 GLY A 5 15.628 -14.204 3.131 1.00 0.31 H new ATOM 55 N LEU A 6 12.626 -12.934 2.714 1.00 0.23 N ATOM 56 CA LEU A 6 11.810 -11.692 2.653 1.00 0.22 C ATOM 57 C LEU A 6 11.638 -10.995 4.043 1.00 0.17 C ATOM 58 O LEU A 6 11.781 -9.765 4.158 1.00 0.16 O ATOM 59 CB LEU A 6 10.444 -12.033 2.007 1.00 0.24 C ATOM 60 CG LEU A 6 9.530 -10.842 1.595 1.00 0.27 C ATOM 61 CD1 LEU A 6 10.230 -9.812 0.705 1.00 0.33 C ATOM 62 CD2 LEU A 6 8.242 -11.301 0.901 1.00 0.35 C ATOM 0 H LEU A 6 12.070 -13.778 2.853 1.00 0.23 H new ATOM 0 HA LEU A 6 12.340 -10.963 2.040 1.00 0.22 H new ATOM 0 HB2 LEU A 6 10.632 -12.636 1.119 1.00 0.24 H new ATOM 0 HB3 LEU A 6 9.888 -12.659 2.705 1.00 0.24 H new ATOM 0 HG LEU A 6 9.279 -10.361 2.540 1.00 0.27 H new ATOM 0 HD11 LEU A 6 9.533 -9.011 0.458 1.00 0.33 H new ATOM 0 HD12 LEU A 6 11.087 -9.396 1.235 1.00 0.33 H new ATOM 0 HD13 LEU A 6 10.569 -10.294 -0.212 1.00 0.33 H new ATOM 0 HD21 LEU A 6 7.642 -10.431 0.635 1.00 0.35 H new ATOM 0 HD22 LEU A 6 8.494 -11.858 -0.002 1.00 0.35 H new ATOM 0 HD23 LEU A 6 7.674 -11.941 1.576 1.00 0.35 H new ATOM 74 N ALA A 7 11.317 -11.814 5.088 1.00 0.17 N ATOM 75 CA ALA A 7 11.166 -11.392 6.529 1.00 0.16 C ATOM 76 C ALA A 7 12.460 -10.747 7.176 1.00 0.15 C ATOM 77 O ALA A 7 12.362 -9.970 8.136 1.00 0.15 O ATOM 78 CB ALA A 7 10.715 -12.617 7.353 1.00 0.20 C ATOM 0 H ALA A 7 11.151 -12.812 4.956 1.00 0.17 H new ATOM 0 HA ALA A 7 10.420 -10.597 6.544 1.00 0.16 H new ATOM 0 HB1 ALA A 7 10.601 -12.330 8.398 1.00 0.20 H new ATOM 0 HB2 ALA A 7 9.762 -12.982 6.970 1.00 0.20 H new ATOM 0 HB3 ALA A 7 11.464 -13.405 7.273 1.00 0.20 H new ATOM 84 N ASP A 8 13.663 -11.066 6.609 1.00 0.16 N ATOM 85 CA ASP A 8 14.968 -10.518 7.065 1.00 0.18 C ATOM 86 C ASP A 8 15.336 -9.145 6.408 1.00 0.17 C ATOM 87 O ASP A 8 16.270 -8.478 6.862 1.00 0.21 O ATOM 88 CB ASP A 8 16.091 -11.532 6.792 1.00 0.21 C ATOM 89 CG ASP A 8 16.438 -12.384 8.008 1.00 0.26 C ATOM 90 OD1 ASP A 8 15.809 -13.448 8.187 1.00 0.31 O ATOM 91 OD2 ASP A 8 17.339 -11.983 8.776 1.00 0.32 O ATOM 0 H ASP A 8 13.749 -11.711 5.823 1.00 0.16 H new ATOM 0 HA ASP A 8 14.864 -10.339 8.135 1.00 0.18 H new ATOM 0 HB2 ASP A 8 15.791 -12.185 5.972 1.00 0.21 H new ATOM 0 HB3 ASP A 8 16.983 -10.998 6.464 1.00 0.21 H new ATOM 96 N LYS A 9 14.589 -8.733 5.343 1.00 0.14 N ATOM 97 CA LYS A 9 14.834 -7.450 4.644 1.00 0.14 C ATOM 98 C LYS A 9 13.778 -6.358 4.973 1.00 0.10 C ATOM 99 O LYS A 9 14.078 -5.177 4.785 1.00 0.10 O ATOM 100 CB LYS A 9 14.927 -7.622 3.101 1.00 0.19 C ATOM 101 CG LYS A 9 15.510 -8.972 2.616 1.00 0.32 C ATOM 102 CD LYS A 9 16.999 -9.156 2.999 1.00 0.92 C ATOM 103 CE LYS A 9 17.591 -10.464 2.451 1.00 1.20 C ATOM 104 NZ LYS A 9 19.004 -10.651 2.881 1.00 1.73 N ATOM 0 H LYS A 9 13.816 -9.274 4.956 1.00 0.14 H new ATOM 0 HA LYS A 9 15.799 -7.113 5.023 1.00 0.14 H new ATOM 0 HB2 LYS A 9 13.929 -7.504 2.679 1.00 0.19 H new ATOM 0 HB3 LYS A 9 15.540 -6.816 2.699 1.00 0.19 H new ATOM 0 HG2 LYS A 9 14.927 -9.788 3.042 1.00 0.32 H new ATOM 0 HG3 LYS A 9 15.407 -9.038 1.533 1.00 0.32 H new ATOM 0 HD2 LYS A 9 17.575 -8.313 2.618 1.00 0.92 H new ATOM 0 HD3 LYS A 9 17.096 -9.144 4.085 1.00 0.92 H new ATOM 0 HE2 LYS A 9 16.991 -11.307 2.795 1.00 1.20 H new ATOM 0 HE3 LYS A 9 17.539 -10.459 1.362 1.00 1.20 H new ATOM 0 HZ1 LYS A 9 19.370 -11.544 2.492 1.00 1.73 H new ATOM 0 HZ2 LYS A 9 19.581 -9.859 2.532 1.00 1.73 H new ATOM 0 HZ3 LYS A 9 19.050 -10.681 3.920 1.00 1.73 H new ATOM 118 N VAL A 10 12.529 -6.738 5.443 1.00 0.09 N ATOM 119 CA VAL A 10 11.450 -5.754 5.850 1.00 0.07 C ATOM 120 C VAL A 10 11.888 -4.687 6.949 1.00 0.06 C ATOM 121 O VAL A 10 12.546 -5.021 7.944 1.00 0.09 O ATOM 122 CB VAL A 10 10.088 -6.543 6.233 1.00 0.08 C ATOM 123 CG1 VAL A 10 10.098 -7.324 7.594 1.00 0.11 C ATOM 124 CG2 VAL A 10 8.817 -5.645 6.163 1.00 0.10 C ATOM 0 H VAL A 10 12.249 -7.713 5.548 1.00 0.09 H new ATOM 0 HA VAL A 10 11.256 -5.134 4.975 1.00 0.07 H new ATOM 0 HB VAL A 10 10.046 -7.300 5.449 1.00 0.08 H new ATOM 0 HG11 VAL A 10 9.134 -7.811 7.741 1.00 0.11 H new ATOM 0 HG12 VAL A 10 10.886 -8.077 7.576 1.00 0.11 H new ATOM 0 HG13 VAL A 10 10.281 -6.627 8.412 1.00 0.11 H new ATOM 0 HG21 VAL A 10 7.940 -6.234 6.431 1.00 0.10 H new ATOM 0 HG22 VAL A 10 8.921 -4.812 6.859 1.00 0.10 H new ATOM 0 HG23 VAL A 10 8.699 -5.259 5.150 1.00 0.10 H new ATOM 134 N ILE A 11 11.503 -3.421 6.711 1.00 0.06 N ATOM 135 CA ILE A 11 11.806 -2.326 7.669 1.00 0.07 C ATOM 136 C ILE A 11 10.526 -1.600 8.144 1.00 0.07 C ATOM 137 O ILE A 11 10.499 -1.077 9.263 1.00 0.08 O ATOM 138 CB ILE A 11 12.833 -1.248 7.129 1.00 0.10 C ATOM 139 CG1 ILE A 11 12.531 -0.839 5.645 1.00 0.10 C ATOM 140 CG2 ILE A 11 14.309 -1.742 7.302 1.00 0.13 C ATOM 141 CD1 ILE A 11 12.582 0.670 5.368 1.00 0.16 C ATOM 0 H ILE A 11 10.990 -3.127 5.880 1.00 0.06 H new ATOM 0 HA ILE A 11 12.280 -2.837 8.507 1.00 0.07 H new ATOM 0 HB ILE A 11 12.709 -0.349 7.733 1.00 0.10 H new ATOM 0 HG12 ILE A 11 13.248 -1.338 4.993 1.00 0.10 H new ATOM 0 HG13 ILE A 11 11.542 -1.210 5.375 1.00 0.10 H new ATOM 0 HG21 ILE A 11 14.993 -0.983 6.923 1.00 0.13 H new ATOM 0 HG22 ILE A 11 14.512 -1.919 8.358 1.00 0.13 H new ATOM 0 HG23 ILE A 11 14.450 -2.668 6.745 1.00 0.13 H new ATOM 0 HD11 ILE A 11 12.360 0.855 4.317 1.00 0.16 H new ATOM 0 HD12 ILE A 11 11.845 1.179 5.989 1.00 0.16 H new ATOM 0 HD13 ILE A 11 13.577 1.049 5.601 1.00 0.16 H new ATOM 153 N TRP A 12 9.465 -1.578 7.297 1.00 0.06 N ATOM 154 CA TRP A 12 8.210 -0.891 7.632 1.00 0.07 C ATOM 155 C TRP A 12 7.048 -1.375 6.724 1.00 0.08 C ATOM 156 O TRP A 12 7.105 -1.235 5.511 1.00 0.10 O ATOM 157 CB TRP A 12 8.477 0.623 7.494 1.00 0.10 C ATOM 158 CG TRP A 12 7.400 1.530 7.994 1.00 0.09 C ATOM 159 CD1 TRP A 12 7.301 2.130 9.218 1.00 0.19 C ATOM 160 CD2 TRP A 12 6.281 1.957 7.240 1.00 0.22 C ATOM 161 NE1 TRP A 12 6.177 2.912 9.259 1.00 0.26 N ATOM 162 CE2 TRP A 12 5.529 2.810 8.049 1.00 0.30 C ATOM 163 CE3 TRP A 12 5.854 1.682 5.943 1.00 0.35 C ATOM 164 CZ2 TRP A 12 4.361 3.396 7.596 1.00 0.44 C ATOM 165 CZ3 TRP A 12 4.708 2.253 5.485 1.00 0.51 C ATOM 166 CH2 TRP A 12 3.959 3.107 6.304 1.00 0.54 C ATOM 0 H TRP A 12 9.462 -2.029 6.382 1.00 0.06 H new ATOM 0 HA TRP A 12 7.896 -1.118 8.651 1.00 0.07 H new ATOM 0 HB2 TRP A 12 9.398 0.859 8.027 1.00 0.10 H new ATOM 0 HB3 TRP A 12 8.652 0.846 6.441 1.00 0.10 H new ATOM 0 HD1 TRP A 12 8.003 2.006 10.030 1.00 0.19 H new ATOM 0 HE1 TRP A 12 5.872 3.475 10.053 1.00 0.26 H new ATOM 0 HE3 TRP A 12 6.427 1.022 5.308 1.00 0.35 H new ATOM 0 HZ2 TRP A 12 3.784 4.055 8.228 1.00 0.44 H new ATOM 0 HZ3 TRP A 12 4.372 2.046 4.480 1.00 0.51 H new ATOM 0 HH2 TRP A 12 3.051 3.548 5.920 1.00 0.54 H new ATOM 177 N ALA A 13 5.977 -1.972 7.321 1.00 0.09 N ATOM 178 CA ALA A 13 4.794 -2.462 6.543 1.00 0.12 C ATOM 179 C ALA A 13 3.466 -2.160 7.275 1.00 0.16 C ATOM 180 O ALA A 13 3.313 -2.442 8.479 1.00 0.19 O ATOM 181 CB ALA A 13 4.879 -3.982 6.212 1.00 0.14 C ATOM 0 H ALA A 13 5.906 -2.126 8.327 1.00 0.09 H new ATOM 0 HA ALA A 13 4.812 -1.915 5.601 1.00 0.12 H new ATOM 0 HB1 ALA A 13 3.996 -4.281 5.648 1.00 0.14 H new ATOM 0 HB2 ALA A 13 5.772 -4.176 5.618 1.00 0.14 H new ATOM 0 HB3 ALA A 13 4.929 -4.554 7.139 1.00 0.14 H new ATOM 187 N VAL A 14 2.500 -1.549 6.542 1.00 0.20 N ATOM 188 CA VAL A 14 1.167 -1.208 7.123 1.00 0.26 C ATOM 189 C VAL A 14 0.033 -1.646 6.151 1.00 0.27 C ATOM 190 O VAL A 14 -0.040 -1.199 5.012 1.00 0.28 O ATOM 191 CB VAL A 14 0.968 0.348 7.537 1.00 0.34 C ATOM 192 CG1 VAL A 14 -0.341 0.623 8.335 1.00 0.80 C ATOM 193 CG2 VAL A 14 2.101 0.913 8.402 1.00 1.05 C ATOM 0 H VAL A 14 2.612 -1.284 5.563 1.00 0.20 H new ATOM 0 HA VAL A 14 1.116 -1.763 8.060 1.00 0.26 H new ATOM 0 HB VAL A 14 0.943 0.839 6.564 1.00 0.34 H new ATOM 0 HG11 VAL A 14 -0.404 1.684 8.576 1.00 0.80 H new ATOM 0 HG12 VAL A 14 -1.202 0.336 7.731 1.00 0.80 H new ATOM 0 HG13 VAL A 14 -0.334 0.041 9.257 1.00 0.80 H new ATOM 0 HG21 VAL A 14 1.894 1.957 8.636 1.00 1.05 H new ATOM 0 HG22 VAL A 14 2.172 0.341 9.327 1.00 1.05 H new ATOM 0 HG23 VAL A 14 3.043 0.843 7.858 1.00 1.05 H new ATOM 203 N ASN A 15 -0.894 -2.464 6.673 1.00 0.33 N ATOM 204 CA ASN A 15 -2.055 -2.937 5.882 1.00 0.43 C ATOM 205 C ASN A 15 -3.334 -2.337 6.502 1.00 0.46 C ATOM 206 O ASN A 15 -3.984 -2.951 7.345 1.00 0.55 O ATOM 207 CB ASN A 15 -2.154 -4.512 5.737 1.00 0.56 C ATOM 208 CG ASN A 15 -0.817 -5.242 5.570 1.00 1.40 C ATOM 209 OD1 ASN A 15 -0.648 -6.366 6.044 1.00 2.05 O ATOM 210 ND2 ASN A 15 0.127 -4.609 4.883 1.00 2.11 N ATOM 0 H ASN A 15 -0.869 -2.813 7.631 1.00 0.33 H new ATOM 0 HA ASN A 15 -1.924 -2.590 4.857 1.00 0.43 H new ATOM 0 HB2 ASN A 15 -2.658 -4.910 6.618 1.00 0.56 H new ATOM 0 HB3 ASN A 15 -2.784 -4.742 4.878 1.00 0.56 H new ATOM 0 HD21 ASN A 15 1.032 -5.054 4.732 1.00 2.11 H new ATOM 0 HD22 ASN A 15 -0.053 -3.678 4.507 1.00 2.11 H new ATOM 217 N ALA A 16 -3.700 -1.112 6.016 1.00 0.47 N ATOM 218 CA ALA A 16 -4.831 -0.296 6.549 1.00 0.54 C ATOM 219 C ALA A 16 -6.269 -0.817 6.208 1.00 0.58 C ATOM 220 O ALA A 16 -6.720 -0.841 5.017 1.00 0.63 O ATOM 221 CB ALA A 16 -4.641 1.189 6.129 1.00 0.59 C ATOM 0 H ALA A 16 -3.214 -0.663 5.239 1.00 0.47 H new ATOM 0 HA ALA A 16 -4.782 -0.394 7.634 1.00 0.54 H new ATOM 0 HB1 ALA A 16 -5.466 1.786 6.518 1.00 0.59 H new ATOM 0 HB2 ALA A 16 -3.701 1.564 6.533 1.00 0.59 H new ATOM 0 HB3 ALA A 16 -4.623 1.260 5.041 1.00 0.59 H new ATOM 227 N GLY A 17 -6.946 -1.225 7.324 1.00 0.58 N ATOM 228 CA GLY A 17 -8.313 -1.765 7.312 1.00 0.61 C ATOM 229 C GLY A 17 -8.611 -2.769 8.440 1.00 0.62 C ATOM 230 O GLY A 17 -9.651 -2.676 9.096 1.00 0.71 O ATOM 0 H GLY A 17 -6.540 -1.181 8.259 1.00 0.58 H new ATOM 0 HA2 GLY A 17 -9.018 -0.937 7.384 1.00 0.61 H new ATOM 0 HA3 GLY A 17 -8.490 -2.252 6.353 1.00 0.61 H new ATOM 234 N GLY A 18 -7.680 -3.731 8.653 1.00 0.72 N ATOM 235 CA GLY A 18 -7.823 -4.804 9.671 1.00 0.73 C ATOM 236 C GLY A 18 -7.223 -4.450 11.043 1.00 0.68 C ATOM 237 O GLY A 18 -7.583 -3.435 11.648 1.00 0.80 O ATOM 0 H GLY A 18 -6.809 -3.786 8.125 1.00 0.72 H new ATOM 0 HA2 GLY A 18 -8.881 -5.032 9.797 1.00 0.73 H new ATOM 0 HA3 GLY A 18 -7.344 -5.710 9.299 1.00 0.73 H new ATOM 241 N GLU A 19 -6.303 -5.312 11.512 1.00 0.59 N ATOM 242 CA GLU A 19 -5.558 -5.145 12.778 1.00 0.60 C ATOM 243 C GLU A 19 -4.435 -6.192 12.838 1.00 0.54 C ATOM 244 O GLU A 19 -4.715 -7.388 12.985 1.00 0.65 O ATOM 245 CB GLU A 19 -6.467 -5.348 14.017 1.00 0.77 C ATOM 246 CG GLU A 19 -7.163 -4.089 14.549 1.00 1.43 C ATOM 247 CD GLU A 19 -7.965 -4.372 15.807 1.00 1.39 C ATOM 248 OE1 GLU A 19 -9.149 -4.749 15.686 1.00 1.50 O ATOM 249 OE2 GLU A 19 -7.408 -4.216 16.914 1.00 1.63 O ATOM 0 H GLU A 19 -6.049 -6.164 11.012 1.00 0.59 H new ATOM 0 HA GLU A 19 -5.163 -4.129 12.798 1.00 0.60 H new ATOM 0 HB2 GLU A 19 -7.231 -6.084 13.767 1.00 0.77 H new ATOM 0 HB3 GLU A 19 -5.865 -5.774 14.820 1.00 0.77 H new ATOM 0 HG2 GLU A 19 -6.416 -3.323 14.759 1.00 1.43 H new ATOM 0 HG3 GLU A 19 -7.823 -3.687 13.780 1.00 1.43 H new ATOM 256 N SER A 20 -3.147 -5.710 12.766 1.00 0.48 N ATOM 257 CA SER A 20 -1.867 -6.531 12.806 1.00 0.45 C ATOM 258 C SER A 20 -1.861 -7.878 12.004 1.00 0.43 C ATOM 259 O SER A 20 -2.330 -8.897 12.530 1.00 0.51 O ATOM 260 CB SER A 20 -1.488 -6.809 14.269 1.00 0.52 C ATOM 261 OG SER A 20 -0.585 -5.830 14.759 1.00 1.00 O ATOM 0 H SER A 20 -2.958 -4.712 12.676 1.00 0.48 H new ATOM 0 HA SER A 20 -1.133 -5.910 12.292 1.00 0.45 H new ATOM 0 HB2 SER A 20 -2.387 -6.819 14.885 1.00 0.52 H new ATOM 0 HB3 SER A 20 -1.036 -7.797 14.349 1.00 0.52 H new ATOM 0 HG SER A 20 -0.361 -6.029 15.692 1.00 1.00 H new ATOM 267 N HIS A 21 -1.324 -7.907 10.755 1.00 0.39 N ATOM 268 CA HIS A 21 -1.343 -9.194 9.995 1.00 0.40 C ATOM 269 C HIS A 21 0.024 -9.642 9.457 1.00 0.40 C ATOM 270 O HIS A 21 0.718 -8.906 8.768 1.00 0.41 O ATOM 271 CB HIS A 21 -2.387 -9.182 8.838 1.00 0.43 C ATOM 272 CG HIS A 21 -2.471 -10.496 8.066 1.00 0.41 C ATOM 273 ND1 HIS A 21 -3.245 -11.573 8.445 1.00 0.39 N ATOM 274 CD2 HIS A 21 -1.805 -10.913 6.964 1.00 0.45 C ATOM 275 CE1 HIS A 21 -3.024 -12.573 7.597 1.00 0.40 C ATOM 276 NE2 HIS A 21 -2.160 -12.188 6.708 1.00 0.43 N ATOM 0 H HIS A 21 -0.899 -7.114 10.275 1.00 0.39 H new ATOM 0 HA HIS A 21 -1.640 -9.931 10.741 1.00 0.40 H new ATOM 0 HB2 HIS A 21 -3.369 -8.951 9.251 1.00 0.43 H new ATOM 0 HB3 HIS A 21 -2.136 -8.380 8.144 1.00 0.43 H new ATOM 0 HD2 HIS A 21 -1.107 -10.324 6.387 1.00 0.45 H new ATOM 0 HE1 HIS A 21 -3.488 -13.547 7.641 1.00 0.40 H new ATOM 0 HE2 HIS A 21 -1.807 -12.758 5.940 1.00 0.43 H new ATOM 285 N VAL A 22 0.319 -10.934 9.708 1.00 0.41 N ATOM 286 CA VAL A 22 1.553 -11.592 9.239 1.00 0.43 C ATOM 287 C VAL A 22 1.224 -12.570 8.051 1.00 0.44 C ATOM 288 O VAL A 22 0.513 -13.569 8.207 1.00 0.48 O ATOM 289 CB VAL A 22 2.419 -12.215 10.472 1.00 0.49 C ATOM 290 CG1 VAL A 22 1.793 -13.433 11.214 1.00 1.38 C ATOM 291 CG2 VAL A 22 3.884 -12.552 10.082 1.00 1.39 C ATOM 0 H VAL A 22 -0.293 -11.550 10.242 1.00 0.41 H new ATOM 0 HA VAL A 22 2.234 -10.854 8.816 1.00 0.43 H new ATOM 0 HB VAL A 22 2.405 -11.389 11.183 1.00 0.49 H new ATOM 0 HG11 VAL A 22 2.462 -13.756 12.012 1.00 1.38 H new ATOM 0 HG12 VAL A 22 0.832 -13.145 11.641 1.00 1.38 H new ATOM 0 HG13 VAL A 22 1.646 -14.252 10.510 1.00 1.38 H new ATOM 0 HG21 VAL A 22 4.405 -12.963 10.947 1.00 1.39 H new ATOM 0 HG22 VAL A 22 3.886 -13.285 9.275 1.00 1.39 H new ATOM 0 HG23 VAL A 22 4.390 -11.645 9.750 1.00 1.39 H new ATOM 301 N ASP A 23 1.756 -12.212 6.862 1.00 0.41 N ATOM 302 CA ASP A 23 1.570 -13.011 5.619 1.00 0.44 C ATOM 303 C ASP A 23 2.563 -14.191 5.503 1.00 0.43 C ATOM 304 O ASP A 23 3.637 -14.164 6.120 1.00 0.41 O ATOM 305 CB ASP A 23 1.566 -12.161 4.289 1.00 0.49 C ATOM 306 CG ASP A 23 2.616 -11.071 4.116 1.00 1.04 C ATOM 307 OD1 ASP A 23 2.401 -9.968 4.665 1.00 1.85 O ATOM 308 OD2 ASP A 23 3.654 -11.348 3.478 1.00 1.46 O ATOM 0 H ASP A 23 2.321 -11.373 6.731 1.00 0.41 H new ATOM 0 HA ASP A 23 0.566 -13.421 5.728 1.00 0.44 H new ATOM 0 HB2 ASP A 23 1.667 -12.854 3.453 1.00 0.49 H new ATOM 0 HB3 ASP A 23 0.586 -11.693 4.198 1.00 0.49 H new ATOM 313 N VAL A 24 2.168 -15.163 4.624 1.00 0.47 N ATOM 314 CA VAL A 24 2.865 -16.498 4.310 1.00 0.50 C ATOM 315 C VAL A 24 4.428 -16.512 4.121 1.00 0.47 C ATOM 316 O VAL A 24 5.054 -17.555 4.328 1.00 0.51 O ATOM 317 CB VAL A 24 2.189 -17.297 3.083 1.00 0.57 C ATOM 318 CG1 VAL A 24 0.963 -18.119 3.530 1.00 0.72 C ATOM 319 CG2 VAL A 24 1.744 -16.413 1.878 1.00 0.58 C ATOM 0 H VAL A 24 1.314 -15.052 4.077 1.00 0.47 H new ATOM 0 HA VAL A 24 2.696 -17.008 5.259 1.00 0.50 H new ATOM 0 HB VAL A 24 2.997 -17.944 2.743 1.00 0.57 H new ATOM 0 HG11 VAL A 24 0.541 -18.640 2.670 1.00 0.72 H new ATOM 0 HG12 VAL A 24 1.268 -18.847 4.282 1.00 0.72 H new ATOM 0 HG13 VAL A 24 0.213 -17.452 3.954 1.00 0.72 H new ATOM 0 HG21 VAL A 24 1.302 -17.044 1.107 1.00 0.58 H new ATOM 0 HG22 VAL A 24 1.008 -15.683 2.215 1.00 0.58 H new ATOM 0 HG23 VAL A 24 2.610 -15.893 1.469 1.00 0.58 H new ATOM 329 N HIS A 25 5.030 -15.370 3.737 1.00 0.42 N ATOM 330 CA HIS A 25 6.507 -15.239 3.610 1.00 0.40 C ATOM 331 C HIS A 25 7.136 -14.747 4.955 1.00 0.36 C ATOM 332 O HIS A 25 8.285 -15.063 5.276 1.00 0.39 O ATOM 333 CB HIS A 25 6.865 -14.260 2.479 1.00 0.38 C ATOM 334 CG HIS A 25 6.116 -14.498 1.192 1.00 0.42 C ATOM 335 ND1 HIS A 25 6.375 -15.563 0.355 1.00 0.45 N ATOM 336 CD2 HIS A 25 5.100 -13.807 0.614 1.00 0.48 C ATOM 337 CE1 HIS A 25 5.552 -15.519 -0.679 1.00 0.49 C ATOM 338 NE2 HIS A 25 4.771 -14.464 -0.544 1.00 0.51 N ATOM 0 H HIS A 25 4.519 -14.517 3.507 1.00 0.42 H new ATOM 0 HA HIS A 25 6.914 -16.221 3.371 1.00 0.40 H new ATOM 0 HB2 HIS A 25 6.667 -13.243 2.818 1.00 0.38 H new ATOM 0 HB3 HIS A 25 7.935 -14.327 2.281 1.00 0.38 H new ATOM 0 HD2 HIS A 25 4.638 -12.908 0.995 1.00 0.48 H new ATOM 0 HE1 HIS A 25 5.524 -16.226 -1.495 1.00 0.49 H new ATOM 0 HE2 HIS A 25 4.040 -14.182 -1.197 1.00 0.51 H new ATOM 347 N GLY A 26 6.329 -13.967 5.711 1.00 0.34 N ATOM 348 CA GLY A 26 6.689 -13.444 7.026 1.00 0.32 C ATOM 349 C GLY A 26 6.692 -11.923 7.125 1.00 0.27 C ATOM 350 O GLY A 26 7.574 -11.341 7.760 1.00 0.26 O ATOM 0 H GLY A 26 5.396 -13.685 5.409 1.00 0.34 H new ATOM 0 HA2 GLY A 26 5.992 -13.842 7.764 1.00 0.32 H new ATOM 0 HA3 GLY A 26 7.679 -13.814 7.291 1.00 0.32 H new ATOM 354 N ILE A 27 5.684 -11.284 6.504 1.00 0.26 N ATOM 355 CA ILE A 27 5.553 -9.803 6.522 1.00 0.23 C ATOM 356 C ILE A 27 4.350 -9.393 7.451 1.00 0.26 C ATOM 357 O ILE A 27 3.216 -9.799 7.221 1.00 0.33 O ATOM 358 CB ILE A 27 5.463 -9.250 5.023 1.00 0.22 C ATOM 359 CG1 ILE A 27 6.752 -9.566 4.161 1.00 0.18 C ATOM 360 CG2 ILE A 27 5.098 -7.739 4.852 1.00 0.26 C ATOM 361 CD1 ILE A 27 8.137 -9.193 4.708 1.00 0.55 C ATOM 0 H ILE A 27 4.948 -11.761 5.984 1.00 0.26 H new ATOM 0 HA ILE A 27 6.436 -9.333 6.955 1.00 0.23 H new ATOM 0 HB ILE A 27 4.610 -9.813 4.645 1.00 0.22 H new ATOM 0 HG12 ILE A 27 6.757 -10.638 3.962 1.00 0.18 H new ATOM 0 HG13 ILE A 27 6.634 -9.064 3.201 1.00 0.18 H new ATOM 0 HG21 ILE A 27 5.069 -7.489 3.791 1.00 0.26 H new ATOM 0 HG22 ILE A 27 4.121 -7.548 5.296 1.00 0.26 H new ATOM 0 HG23 ILE A 27 5.849 -7.125 5.349 1.00 0.26 H new ATOM 0 HD11 ILE A 27 8.902 -9.482 3.988 1.00 0.55 H new ATOM 0 HD12 ILE A 27 8.184 -8.117 4.876 1.00 0.55 H new ATOM 0 HD13 ILE A 27 8.309 -9.715 5.649 1.00 0.55 H new ATOM 373 N HIS A 28 4.618 -8.540 8.450 1.00 0.25 N ATOM 374 CA HIS A 28 3.587 -8.124 9.418 1.00 0.30 C ATOM 375 C HIS A 28 3.195 -6.623 9.362 1.00 0.28 C ATOM 376 O HIS A 28 4.055 -5.736 9.371 1.00 0.28 O ATOM 377 CB HIS A 28 4.109 -8.467 10.824 1.00 0.40 C ATOM 378 CG HIS A 28 3.076 -8.690 11.902 1.00 0.63 C ATOM 379 ND1 HIS A 28 3.097 -9.793 12.730 1.00 0.93 N ATOM 380 CD2 HIS A 28 2.025 -7.941 12.312 1.00 0.96 C ATOM 381 CE1 HIS A 28 2.107 -9.711 13.600 1.00 1.30 C ATOM 382 NE2 HIS A 28 1.443 -8.596 13.369 1.00 1.34 N ATOM 0 H HIS A 28 5.536 -8.125 8.611 1.00 0.25 H new ATOM 0 HA HIS A 28 2.674 -8.660 9.161 1.00 0.30 H new ATOM 0 HB2 HIS A 28 4.720 -9.367 10.749 1.00 0.40 H new ATOM 0 HB3 HIS A 28 4.767 -7.661 11.147 1.00 0.40 H new ATOM 0 HD1 HIS A 28 3.773 -10.555 12.678 1.00 0.93 H new ATOM 0 HD2 HIS A 28 1.704 -7.002 11.886 1.00 0.96 H new ATOM 0 HE1 HIS A 28 1.880 -10.434 14.369 1.00 1.30 H new ATOM 391 N TYR A 29 1.848 -6.367 9.308 1.00 0.33 N ATOM 392 CA TYR A 29 1.258 -5.003 9.354 1.00 0.38 C ATOM 393 C TYR A 29 1.109 -4.518 10.817 1.00 0.45 C ATOM 394 O TYR A 29 0.599 -5.258 11.671 1.00 0.46 O ATOM 395 CB TYR A 29 -0.115 -4.963 8.583 1.00 0.45 C ATOM 396 CG TYR A 29 -1.368 -4.306 9.256 1.00 0.98 C ATOM 397 CD1 TYR A 29 -1.348 -2.974 9.692 1.00 1.31 C ATOM 398 CD2 TYR A 29 -2.576 -4.996 9.401 1.00 1.34 C ATOM 399 CE1 TYR A 29 -2.453 -2.369 10.247 1.00 1.91 C ATOM 400 CE2 TYR A 29 -3.690 -4.379 9.950 1.00 1.91 C ATOM 401 CZ TYR A 29 -3.614 -3.067 10.371 1.00 2.21 C ATOM 402 OH TYR A 29 -4.710 -2.445 10.916 1.00 2.79 O ATOM 0 H TYR A 29 1.149 -7.106 9.231 1.00 0.33 H new ATOM 0 HA TYR A 29 1.937 -4.315 8.850 1.00 0.38 H new ATOM 0 HB2 TYR A 29 0.057 -4.444 7.640 1.00 0.45 H new ATOM 0 HB3 TYR A 29 -0.380 -5.991 8.337 1.00 0.45 H new ATOM 0 HD1 TYR A 29 -0.436 -2.404 9.589 1.00 1.31 H new ATOM 0 HD2 TYR A 29 -2.642 -6.025 9.080 1.00 1.34 H new ATOM 0 HE1 TYR A 29 -2.398 -1.344 10.583 1.00 1.91 H new ATOM 0 HE2 TYR A 29 -4.617 -4.925 10.048 1.00 1.91 H new ATOM 0 HH TYR A 29 -5.441 -2.440 10.264 1.00 2.79 H new ATOM 412 N ARG A 30 1.476 -3.229 11.031 1.00 0.54 N ATOM 413 CA ARG A 30 1.437 -2.554 12.353 1.00 0.63 C ATOM 414 C ARG A 30 0.071 -1.879 12.645 1.00 0.91 C ATOM 415 O ARG A 30 -0.240 -0.815 12.106 1.00 1.87 O ATOM 416 CB ARG A 30 2.551 -1.481 12.426 1.00 0.72 C ATOM 417 CG ARG A 30 3.922 -1.944 11.887 1.00 0.68 C ATOM 418 CD ARG A 30 4.971 -0.816 11.883 1.00 0.87 C ATOM 419 NE ARG A 30 5.332 -0.390 13.235 1.00 1.70 N ATOM 420 CZ ARG A 30 6.261 0.525 13.493 1.00 2.08 C ATOM 421 NH1 ARG A 30 6.913 1.113 12.499 1.00 1.93 N ATOM 422 NH2 ARG A 30 6.539 0.855 14.747 1.00 3.00 N ATOM 0 H ARG A 30 1.811 -2.623 10.282 1.00 0.54 H new ATOM 0 HA ARG A 30 1.592 -3.327 13.105 1.00 0.63 H new ATOM 0 HB2 ARG A 30 2.231 -0.604 11.863 1.00 0.72 H new ATOM 0 HB3 ARG A 30 2.669 -1.168 13.463 1.00 0.72 H new ATOM 0 HG2 ARG A 30 4.287 -2.771 12.496 1.00 0.68 H new ATOM 0 HG3 ARG A 30 3.800 -2.324 10.873 1.00 0.68 H new ATOM 0 HD2 ARG A 30 5.865 -1.156 11.361 1.00 0.87 H new ATOM 0 HD3 ARG A 30 4.582 0.037 11.327 1.00 0.87 H new ATOM 0 HE ARG A 30 4.845 -0.818 14.022 1.00 1.70 H new ATOM 0 HH11 ARG A 30 6.702 0.864 11.533 1.00 1.93 H new ATOM 0 HH12 ARG A 30 7.625 1.815 12.701 1.00 1.93 H new ATOM 0 HH21 ARG A 30 6.040 0.406 15.515 1.00 3.00 H new ATOM 0 HH22 ARG A 30 7.252 1.557 14.943 1.00 3.00 H new ATOM 436 N LYS A 31 -0.729 -2.582 13.490 1.00 0.57 N ATOM 437 CA LYS A 31 -2.108 -2.236 14.006 1.00 0.59 C ATOM 438 C LYS A 31 -2.485 -0.725 14.201 1.00 0.64 C ATOM 439 O LYS A 31 -2.146 -0.126 15.227 1.00 0.79 O ATOM 440 CB LYS A 31 -2.239 -2.944 15.372 1.00 0.73 C ATOM 441 CG LYS A 31 -3.680 -3.277 15.809 1.00 1.15 C ATOM 442 CD LYS A 31 -3.825 -3.500 17.339 1.00 1.44 C ATOM 443 CE LYS A 31 -2.901 -4.607 17.886 1.00 1.70 C ATOM 444 NZ LYS A 31 -1.498 -4.134 18.059 1.00 2.30 N ATOM 0 H LYS A 31 -0.415 -3.477 13.865 1.00 0.57 H new ATOM 0 HA LYS A 31 -2.795 -2.559 13.224 1.00 0.59 H new ATOM 0 HB2 LYS A 31 -1.664 -3.870 15.339 1.00 0.73 H new ATOM 0 HB3 LYS A 31 -1.783 -2.313 16.135 1.00 0.73 H new ATOM 0 HG2 LYS A 31 -4.341 -2.466 15.503 1.00 1.15 H new ATOM 0 HG3 LYS A 31 -4.012 -4.173 15.286 1.00 1.15 H new ATOM 0 HD2 LYS A 31 -3.607 -2.566 17.857 1.00 1.44 H new ATOM 0 HD3 LYS A 31 -4.860 -3.756 17.565 1.00 1.44 H new ATOM 0 HE2 LYS A 31 -3.285 -4.958 18.844 1.00 1.70 H new ATOM 0 HE3 LYS A 31 -2.914 -5.458 17.206 1.00 1.70 H new ATOM 0 HZ1 LYS A 31 -1.101 -4.537 18.932 1.00 2.30 H new ATOM 0 HZ2 LYS A 31 -0.926 -4.439 17.246 1.00 2.30 H new ATOM 0 HZ3 LYS A 31 -1.487 -3.096 18.120 1.00 2.30 H new ATOM 458 N ASP A 32 -3.212 -0.144 13.184 1.00 0.61 N ATOM 459 CA ASP A 32 -3.728 1.289 13.153 1.00 0.72 C ATOM 460 C ASP A 32 -2.736 2.430 13.603 1.00 0.75 C ATOM 461 O ASP A 32 -2.888 2.974 14.700 1.00 1.00 O ATOM 462 CB ASP A 32 -5.013 1.378 14.000 1.00 0.86 C ATOM 463 CG ASP A 32 -6.286 1.297 13.173 1.00 0.95 C ATOM 464 OD1 ASP A 32 -6.571 0.212 12.626 1.00 1.01 O ATOM 465 OD2 ASP A 32 -6.991 2.324 13.070 1.00 1.17 O ATOM 0 H ASP A 32 -3.464 -0.663 12.343 1.00 0.61 H new ATOM 0 HA ASP A 32 -3.894 1.487 12.094 1.00 0.72 H new ATOM 0 HB2 ASP A 32 -5.013 0.572 14.733 1.00 0.86 H new ATOM 0 HB3 ASP A 32 -5.009 2.315 14.557 1.00 0.86 H new ATOM 470 N PRO A 33 -1.692 2.784 12.789 1.00 0.59 N ATOM 471 CA PRO A 33 -0.727 3.854 13.147 1.00 0.66 C ATOM 472 C PRO A 33 -0.926 5.243 12.457 1.00 0.83 C ATOM 473 O PRO A 33 -0.012 6.073 12.485 1.00 1.45 O ATOM 474 CB PRO A 33 0.587 3.207 12.686 1.00 0.59 C ATOM 475 CG PRO A 33 0.214 2.457 11.423 1.00 0.57 C ATOM 476 CD PRO A 33 -1.279 2.102 11.543 1.00 0.49 C ATOM 0 HA PRO A 33 -0.811 4.126 14.199 1.00 0.66 H new ATOM 0 HB2 PRO A 33 1.353 3.958 12.491 1.00 0.59 H new ATOM 0 HB3 PRO A 33 0.986 2.534 13.445 1.00 0.59 H new ATOM 0 HG2 PRO A 33 0.396 3.071 10.541 1.00 0.57 H new ATOM 0 HG3 PRO A 33 0.818 1.556 11.315 1.00 0.57 H new ATOM 0 HD2 PRO A 33 -1.847 2.457 10.683 1.00 0.49 H new ATOM 0 HD3 PRO A 33 -1.433 1.025 11.604 1.00 0.49 H new ATOM 484 N LEU A 34 -2.109 5.493 11.854 1.00 0.72 N ATOM 485 CA LEU A 34 -2.375 6.789 11.177 1.00 0.91 C ATOM 486 C LEU A 34 -3.828 7.288 11.349 1.00 1.43 C ATOM 487 O LEU A 34 -4.045 8.372 11.893 1.00 1.91 O ATOM 488 CB LEU A 34 -2.025 6.710 9.651 1.00 1.02 C ATOM 489 CG LEU A 34 -2.463 7.901 8.743 1.00 0.88 C ATOM 490 CD1 LEU A 34 -1.620 9.139 8.995 1.00 1.67 C ATOM 491 CD2 LEU A 34 -2.400 7.520 7.275 1.00 1.33 C ATOM 0 H LEU A 34 -2.884 4.831 11.820 1.00 0.72 H new ATOM 0 HA LEU A 34 -1.725 7.513 11.668 1.00 0.91 H new ATOM 0 HB2 LEU A 34 -0.944 6.599 9.560 1.00 1.02 H new ATOM 0 HB3 LEU A 34 -2.474 5.801 9.251 1.00 1.02 H new ATOM 0 HG LEU A 34 -3.496 8.135 9.001 1.00 0.88 H new ATOM 0 HD11 LEU A 34 -1.955 9.946 8.344 1.00 1.67 H new ATOM 0 HD12 LEU A 34 -1.725 9.445 10.036 1.00 1.67 H new ATOM 0 HD13 LEU A 34 -0.574 8.915 8.786 1.00 1.67 H new ATOM 0 HD21 LEU A 34 -2.710 8.368 6.665 1.00 1.33 H new ATOM 0 HD22 LEU A 34 -1.379 7.241 7.015 1.00 1.33 H new ATOM 0 HD23 LEU A 34 -3.065 6.677 7.089 1.00 1.33 H new ATOM 503 N GLU A 35 -4.815 6.498 10.872 1.00 1.77 N ATOM 504 CA GLU A 35 -6.245 6.896 10.893 1.00 2.54 C ATOM 505 C GLU A 35 -6.983 6.463 12.177 1.00 2.66 C ATOM 506 O GLU A 35 -7.625 5.408 12.235 1.00 3.33 O ATOM 507 CB GLU A 35 -6.942 6.329 9.638 1.00 3.34 C ATOM 508 CG GLU A 35 -6.145 6.546 8.339 1.00 3.49 C ATOM 509 CD GLU A 35 -6.783 5.902 7.126 1.00 4.38 C ATOM 510 OE1 GLU A 35 -7.890 6.326 6.744 1.00 4.84 O ATOM 511 OE2 GLU A 35 -6.167 4.982 6.550 1.00 4.80 O ATOM 0 H GLU A 35 -4.649 5.577 10.466 1.00 1.77 H new ATOM 0 HA GLU A 35 -6.285 7.985 10.887 1.00 2.54 H new ATOM 0 HB2 GLU A 35 -7.110 5.261 9.777 1.00 3.34 H new ATOM 0 HB3 GLU A 35 -7.922 6.795 9.535 1.00 3.34 H new ATOM 0 HG2 GLU A 35 -6.041 7.616 8.160 1.00 3.49 H new ATOM 0 HG3 GLU A 35 -5.140 6.145 8.467 1.00 3.49 H new ATOM 518 N GLY A 36 -6.850 7.321 13.206 1.00 2.22 N ATOM 519 CA GLY A 36 -7.457 7.089 14.524 1.00 2.37 C ATOM 520 C GLY A 36 -6.455 6.646 15.609 1.00 1.99 C ATOM 521 O GLY A 36 -6.626 7.000 16.779 1.00 2.30 O ATOM 0 H GLY A 36 -6.320 8.190 13.145 1.00 2.22 H new ATOM 0 HA2 GLY A 36 -7.950 8.005 14.852 1.00 2.37 H new ATOM 0 HA3 GLY A 36 -8.231 6.328 14.427 1.00 2.37 H new ATOM 525 N ARG A 37 -5.381 5.885 15.187 1.00 1.73 N ATOM 526 CA ARG A 37 -4.262 5.313 16.039 1.00 2.21 C ATOM 527 C ARG A 37 -4.700 4.610 17.371 1.00 2.05 C ATOM 528 O ARG A 37 -4.213 4.927 18.460 1.00 2.64 O ATOM 529 CB ARG A 37 -3.099 6.342 16.283 1.00 3.16 C ATOM 530 CG ARG A 37 -3.498 7.845 16.321 1.00 3.40 C ATOM 531 CD ARG A 37 -3.212 8.581 14.994 1.00 3.20 C ATOM 532 NE ARG A 37 -3.755 9.938 15.008 1.00 3.69 N ATOM 533 CZ ARG A 37 -3.417 10.884 14.134 1.00 3.94 C ATOM 534 NH1 ARG A 37 -2.546 10.623 13.167 1.00 3.94 N ATOM 535 NH2 ARG A 37 -3.955 12.092 14.225 1.00 4.50 N ATOM 0 H ARG A 37 -5.265 5.642 14.203 1.00 1.73 H new ATOM 0 HA ARG A 37 -3.877 4.501 15.422 1.00 2.21 H new ATOM 0 HB2 ARG A 37 -2.616 6.093 17.228 1.00 3.16 H new ATOM 0 HB3 ARG A 37 -2.354 6.207 15.499 1.00 3.16 H new ATOM 0 HG2 ARG A 37 -4.560 7.927 16.554 1.00 3.40 H new ATOM 0 HG3 ARG A 37 -2.956 8.339 17.128 1.00 3.40 H new ATOM 0 HD2 ARG A 37 -2.136 8.620 14.822 1.00 3.20 H new ATOM 0 HD3 ARG A 37 -3.647 8.022 14.165 1.00 3.20 H new ATOM 0 HE ARG A 37 -4.434 10.175 15.731 1.00 3.69 H new ATOM 0 HH11 ARG A 37 -2.132 9.694 13.091 1.00 3.94 H new ATOM 0 HH12 ARG A 37 -2.291 11.351 12.500 1.00 3.94 H new ATOM 0 HH21 ARG A 37 -4.627 12.296 14.964 1.00 4.50 H new ATOM 0 HH22 ARG A 37 -3.697 12.817 13.556 1.00 4.50 H new ATOM 549 N VAL A 38 -5.636 3.648 17.224 1.00 1.67 N ATOM 550 CA VAL A 38 -6.212 2.849 18.352 1.00 1.61 C ATOM 551 C VAL A 38 -6.440 1.362 17.921 1.00 1.73 C ATOM 552 O VAL A 38 -6.169 0.980 16.776 1.00 2.44 O ATOM 553 CB VAL A 38 -7.567 3.437 19.008 1.00 2.08 C ATOM 554 CG1 VAL A 38 -7.258 4.373 20.194 1.00 2.70 C ATOM 555 CG2 VAL A 38 -8.533 4.178 18.028 1.00 2.63 C ATOM 0 H VAL A 38 -6.023 3.394 16.315 1.00 1.67 H new ATOM 0 HA VAL A 38 -5.458 2.916 19.136 1.00 1.61 H new ATOM 0 HB VAL A 38 -8.093 2.541 19.338 1.00 2.08 H new ATOM 0 HG11 VAL A 38 -8.191 4.751 20.612 1.00 2.70 H new ATOM 0 HG12 VAL A 38 -6.714 3.821 20.961 1.00 2.70 H new ATOM 0 HG13 VAL A 38 -6.650 5.209 19.849 1.00 2.70 H new ATOM 0 HG21 VAL A 38 -9.407 4.530 18.576 1.00 2.63 H new ATOM 0 HG22 VAL A 38 -8.017 5.029 17.583 1.00 2.63 H new ATOM 0 HG23 VAL A 38 -8.849 3.493 17.241 1.00 2.63 H new ATOM 565 N GLY A 39 -6.945 0.522 18.854 1.00 1.64 N ATOM 566 CA GLY A 39 -7.198 -0.902 18.557 1.00 1.95 C ATOM 567 C GLY A 39 -8.643 -1.216 18.136 1.00 1.52 C ATOM 568 O GLY A 39 -9.452 -1.661 18.954 1.00 1.67 O ATOM 0 H GLY A 39 -7.182 0.803 19.806 1.00 1.64 H new ATOM 0 HA2 GLY A 39 -6.524 -1.220 17.762 1.00 1.95 H new ATOM 0 HA3 GLY A 39 -6.953 -1.494 19.439 1.00 1.95 H new ATOM 572 N ARG A 40 -8.946 -0.974 16.841 1.00 1.49 N ATOM 573 CA ARG A 40 -10.285 -1.222 16.270 1.00 1.54 C ATOM 574 C ARG A 40 -10.215 -1.482 14.747 1.00 1.40 C ATOM 575 O ARG A 40 -9.520 -0.777 14.006 1.00 1.40 O ATOM 576 CB ARG A 40 -11.221 -0.021 16.547 1.00 2.19 C ATOM 577 CG ARG A 40 -12.730 -0.361 16.540 1.00 2.54 C ATOM 578 CD ARG A 40 -13.618 0.893 16.650 1.00 3.29 C ATOM 579 NE ARG A 40 -13.522 1.739 15.461 1.00 3.83 N ATOM 580 CZ ARG A 40 -14.155 2.901 15.328 1.00 4.62 C ATOM 581 NH1 ARG A 40 -14.922 3.360 16.307 1.00 4.94 N ATOM 582 NH2 ARG A 40 -14.020 3.606 14.212 1.00 5.34 N ATOM 0 H ARG A 40 -8.274 -0.604 16.169 1.00 1.49 H new ATOM 0 HA ARG A 40 -10.684 -2.114 16.752 1.00 1.54 H new ATOM 0 HB2 ARG A 40 -10.964 0.407 17.516 1.00 2.19 H new ATOM 0 HB3 ARG A 40 -11.033 0.749 15.799 1.00 2.19 H new ATOM 0 HG2 ARG A 40 -12.974 -0.896 15.622 1.00 2.54 H new ATOM 0 HG3 ARG A 40 -12.952 -1.033 17.369 1.00 2.54 H new ATOM 0 HD2 ARG A 40 -14.655 0.591 16.797 1.00 3.29 H new ATOM 0 HD3 ARG A 40 -13.326 1.468 17.529 1.00 3.29 H new ATOM 0 HE ARG A 40 -12.936 1.420 14.690 1.00 3.83 H new ATOM 0 HH11 ARG A 40 -15.029 2.821 17.167 1.00 4.94 H new ATOM 0 HH12 ARG A 40 -15.406 4.252 16.201 1.00 4.94 H new ATOM 0 HH21 ARG A 40 -13.431 3.257 13.456 1.00 5.34 H new ATOM 0 HH22 ARG A 40 -14.505 4.497 14.110 1.00 5.34 H new ATOM 596 N ALA A 41 -10.977 -2.510 14.294 1.00 1.35 N ATOM 597 CA ALA A 41 -11.057 -2.916 12.863 1.00 1.29 C ATOM 598 C ALA A 41 -12.368 -2.410 12.194 1.00 1.31 C ATOM 599 O ALA A 41 -13.464 -2.471 12.782 1.00 1.64 O ATOM 600 CB ALA A 41 -10.946 -4.460 12.741 1.00 1.35 C ATOM 0 H ALA A 41 -11.555 -3.083 14.910 1.00 1.35 H new ATOM 0 HA ALA A 41 -10.222 -2.454 12.336 1.00 1.29 H new ATOM 0 HB1 ALA A 41 -11.006 -4.747 11.691 1.00 1.35 H new ATOM 0 HB2 ALA A 41 -9.993 -4.790 13.154 1.00 1.35 H new ATOM 0 HB3 ALA A 41 -11.762 -4.928 13.292 1.00 1.35 H new ATOM 606 N SER A 42 -12.233 -1.887 10.958 1.00 1.13 N ATOM 607 CA SER A 42 -13.373 -1.368 10.186 1.00 1.15 C ATOM 608 C SER A 42 -13.637 -2.232 8.949 1.00 1.10 C ATOM 609 O SER A 42 -12.905 -2.174 7.955 1.00 1.57 O ATOM 610 CB SER A 42 -13.140 0.094 9.765 1.00 1.23 C ATOM 611 OG SER A 42 -13.274 0.981 10.865 1.00 1.43 O ATOM 0 H SER A 42 -11.338 -1.814 10.474 1.00 1.13 H new ATOM 0 HA SER A 42 -14.249 -1.406 10.833 1.00 1.15 H new ATOM 0 HB2 SER A 42 -12.144 0.195 9.334 1.00 1.23 H new ATOM 0 HB3 SER A 42 -13.853 0.367 8.987 1.00 1.23 H new ATOM 0 HG SER A 42 -13.118 1.901 10.564 1.00 1.43 H new ATOM 617 N ASP A 43 -14.689 -3.051 9.041 1.00 0.99 N ATOM 618 CA ASP A 43 -15.085 -3.956 7.952 1.00 0.98 C ATOM 619 C ASP A 43 -16.558 -3.703 7.551 1.00 1.13 C ATOM 620 O ASP A 43 -17.480 -4.308 8.111 1.00 1.62 O ATOM 621 CB ASP A 43 -14.900 -5.425 8.382 1.00 1.01 C ATOM 622 CG ASP A 43 -13.533 -5.990 8.027 1.00 1.65 C ATOM 623 OD1 ASP A 43 -13.277 -6.199 6.824 1.00 2.33 O ATOM 624 OD2 ASP A 43 -12.725 -6.217 8.952 1.00 1.80 O ATOM 0 H ASP A 43 -15.288 -3.107 9.865 1.00 0.99 H new ATOM 0 HA ASP A 43 -14.447 -3.759 7.090 1.00 0.98 H new ATOM 0 HB2 ASP A 43 -15.048 -5.502 9.459 1.00 1.01 H new ATOM 0 HB3 ASP A 43 -15.671 -6.034 7.910 1.00 1.01 H new ATOM 629 N TYR A 44 -16.766 -2.789 6.576 1.00 1.26 N ATOM 630 CA TYR A 44 -18.125 -2.435 6.072 1.00 1.48 C ATOM 631 C TYR A 44 -18.523 -3.240 4.808 1.00 1.68 C ATOM 632 O TYR A 44 -19.688 -3.613 4.648 1.00 2.40 O ATOM 633 CB TYR A 44 -18.217 -0.927 5.780 1.00 1.58 C ATOM 634 CG TYR A 44 -18.228 -0.046 7.039 1.00 1.67 C ATOM 635 CD1 TYR A 44 -19.413 0.186 7.745 1.00 1.93 C ATOM 636 CD2 TYR A 44 -17.056 0.548 7.526 1.00 2.02 C ATOM 637 CE1 TYR A 44 -19.428 0.976 8.884 1.00 2.32 C ATOM 638 CE2 TYR A 44 -17.074 1.338 8.665 1.00 2.50 C ATOM 639 CZ TYR A 44 -18.259 1.547 9.335 1.00 2.56 C ATOM 640 OH TYR A 44 -18.275 2.330 10.467 1.00 3.16 O ATOM 0 H TYR A 44 -16.011 -2.278 6.117 1.00 1.26 H new ATOM 0 HA TYR A 44 -18.828 -2.700 6.862 1.00 1.48 H new ATOM 0 HB2 TYR A 44 -17.374 -0.637 5.153 1.00 1.58 H new ATOM 0 HB3 TYR A 44 -19.123 -0.733 5.206 1.00 1.58 H new ATOM 0 HD1 TYR A 44 -20.333 -0.259 7.396 1.00 1.93 H new ATOM 0 HD2 TYR A 44 -16.123 0.388 7.005 1.00 2.02 H new ATOM 0 HE1 TYR A 44 -20.353 1.143 9.416 1.00 2.32 H new ATOM 0 HE2 TYR A 44 -16.161 1.788 9.026 1.00 2.50 H new ATOM 0 HH TYR A 44 -17.370 2.656 10.652 1.00 3.16 H new ATOM 650 N GLY A 45 -17.536 -3.495 3.919 1.00 1.41 N ATOM 651 CA GLY A 45 -17.757 -4.296 2.714 1.00 1.52 C ATOM 652 C GLY A 45 -16.985 -5.617 2.774 1.00 1.29 C ATOM 653 O GLY A 45 -16.035 -5.831 2.017 1.00 1.22 O ATOM 0 H GLY A 45 -16.581 -3.153 4.022 1.00 1.41 H new ATOM 0 HA2 GLY A 45 -18.822 -4.500 2.600 1.00 1.52 H new ATOM 0 HA3 GLY A 45 -17.445 -3.730 1.836 1.00 1.52 H new ATOM 657 N MET A 46 -17.421 -6.501 3.703 1.00 1.26 N ATOM 658 CA MET A 46 -16.792 -7.820 3.954 1.00 1.14 C ATOM 659 C MET A 46 -17.417 -9.014 3.163 1.00 1.13 C ATOM 660 O MET A 46 -16.968 -10.154 3.320 1.00 1.13 O ATOM 661 CB MET A 46 -16.850 -8.108 5.468 1.00 1.28 C ATOM 662 CG MET A 46 -15.601 -8.785 6.052 1.00 1.04 C ATOM 663 SD MET A 46 -15.822 -9.272 7.777 1.00 1.58 S ATOM 664 CE MET A 46 -14.251 -10.064 8.125 1.00 1.67 C ATOM 0 H MET A 46 -18.225 -6.317 4.304 1.00 1.26 H new ATOM 0 HA MET A 46 -15.767 -7.747 3.590 1.00 1.14 H new ATOM 0 HB2 MET A 46 -17.014 -7.168 5.995 1.00 1.28 H new ATOM 0 HB3 MET A 46 -17.714 -8.741 5.669 1.00 1.28 H new ATOM 0 HG2 MET A 46 -15.357 -9.665 5.458 1.00 1.04 H new ATOM 0 HG3 MET A 46 -14.753 -8.104 5.976 1.00 1.04 H new ATOM 0 HE1 MET A 46 -14.242 -10.416 9.157 1.00 1.67 H new ATOM 0 HE2 MET A 46 -14.113 -10.910 7.452 1.00 1.67 H new ATOM 0 HE3 MET A 46 -13.442 -9.348 7.979 1.00 1.67 H new ATOM 674 N LYS A 47 -18.442 -8.750 2.315 1.00 1.20 N ATOM 675 CA LYS A 47 -19.103 -9.803 1.509 1.00 1.24 C ATOM 676 C LYS A 47 -18.753 -9.713 -0.015 1.00 1.33 C ATOM 677 O LYS A 47 -19.589 -9.990 -0.882 1.00 1.68 O ATOM 678 CB LYS A 47 -20.643 -9.773 1.742 1.00 1.34 C ATOM 679 CG LYS A 47 -21.357 -8.440 1.368 1.00 2.03 C ATOM 680 CD LYS A 47 -21.369 -7.408 2.522 1.00 2.90 C ATOM 681 CE LYS A 47 -21.980 -6.062 2.093 1.00 3.65 C ATOM 682 NZ LYS A 47 -23.401 -6.209 1.668 1.00 4.18 N ATOM 0 H LYS A 47 -18.828 -7.816 2.173 1.00 1.20 H new ATOM 0 HA LYS A 47 -18.714 -10.763 1.850 1.00 1.24 H new ATOM 0 HB2 LYS A 47 -21.095 -10.580 1.165 1.00 1.34 H new ATOM 0 HB3 LYS A 47 -20.837 -9.985 2.793 1.00 1.34 H new ATOM 0 HG2 LYS A 47 -20.862 -8.001 0.502 1.00 2.03 H new ATOM 0 HG3 LYS A 47 -22.384 -8.656 1.072 1.00 2.03 H new ATOM 0 HD2 LYS A 47 -21.936 -7.811 3.361 1.00 2.90 H new ATOM 0 HD3 LYS A 47 -20.350 -7.247 2.873 1.00 2.90 H new ATOM 0 HE2 LYS A 47 -21.920 -5.355 2.921 1.00 3.65 H new ATOM 0 HE3 LYS A 47 -21.397 -5.643 1.273 1.00 3.65 H new ATOM 0 HZ1 LYS A 47 -23.807 -5.269 1.484 1.00 4.18 H new ATOM 0 HZ2 LYS A 47 -23.447 -6.782 0.801 1.00 4.18 H new ATOM 0 HZ3 LYS A 47 -23.942 -6.678 2.422 1.00 4.18 H new ATOM 696 N LEU A 48 -17.490 -9.330 -0.300 1.00 1.18 N ATOM 697 CA LEU A 48 -16.943 -9.203 -1.655 1.00 1.29 C ATOM 698 C LEU A 48 -15.420 -9.447 -1.589 1.00 1.00 C ATOM 699 O LEU A 48 -14.633 -8.498 -1.694 1.00 1.21 O ATOM 700 CB LEU A 48 -17.244 -7.800 -2.245 1.00 1.76 C ATOM 701 CG LEU A 48 -18.606 -7.636 -2.981 1.00 1.96 C ATOM 702 CD1 LEU A 48 -19.109 -6.195 -2.906 1.00 2.24 C ATOM 703 CD2 LEU A 48 -18.509 -8.062 -4.450 1.00 2.63 C ATOM 0 H LEU A 48 -16.813 -9.097 0.426 1.00 1.18 H new ATOM 0 HA LEU A 48 -17.411 -9.939 -2.309 1.00 1.29 H new ATOM 0 HB2 LEU A 48 -17.204 -7.073 -1.434 1.00 1.76 H new ATOM 0 HB3 LEU A 48 -16.446 -7.544 -2.942 1.00 1.76 H new ATOM 0 HG LEU A 48 -19.316 -8.288 -2.472 1.00 1.96 H new ATOM 0 HD11 LEU A 48 -20.062 -6.114 -3.429 1.00 2.24 H new ATOM 0 HD12 LEU A 48 -19.243 -5.910 -1.862 1.00 2.24 H new ATOM 0 HD13 LEU A 48 -18.381 -5.531 -3.373 1.00 2.24 H new ATOM 0 HD21 LEU A 48 -19.479 -7.934 -4.931 1.00 2.63 H new ATOM 0 HD22 LEU A 48 -17.767 -7.447 -4.959 1.00 2.63 H new ATOM 0 HD23 LEU A 48 -18.212 -9.109 -4.506 1.00 2.63 H new ATOM 715 N PRO A 49 -14.969 -10.745 -1.384 1.00 0.82 N ATOM 716 CA PRO A 49 -13.511 -11.136 -1.267 1.00 0.89 C ATOM 717 C PRO A 49 -12.632 -10.938 -2.525 1.00 0.75 C ATOM 718 O PRO A 49 -13.140 -10.812 -3.643 1.00 0.78 O ATOM 719 CB PRO A 49 -13.576 -12.648 -0.953 1.00 1.31 C ATOM 720 CG PRO A 49 -14.946 -12.863 -0.390 1.00 1.37 C ATOM 721 CD PRO A 49 -15.836 -11.939 -1.186 1.00 1.05 C ATOM 0 HA PRO A 49 -13.038 -10.495 -0.523 1.00 0.89 H new ATOM 0 HB2 PRO A 49 -13.419 -13.246 -1.851 1.00 1.31 H new ATOM 0 HB3 PRO A 49 -12.805 -12.937 -0.239 1.00 1.31 H new ATOM 0 HG2 PRO A 49 -15.259 -13.902 -0.495 1.00 1.37 H new ATOM 0 HG3 PRO A 49 -14.979 -12.626 0.673 1.00 1.37 H new ATOM 0 HD2 PRO A 49 -16.137 -12.383 -2.135 1.00 1.05 H new ATOM 0 HD3 PRO A 49 -16.750 -11.691 -0.646 1.00 1.05 H new ATOM 729 N ILE A 50 -11.289 -10.928 -2.305 1.00 0.67 N ATOM 730 CA ILE A 50 -10.288 -10.768 -3.377 1.00 0.60 C ATOM 731 C ILE A 50 -9.902 -12.179 -3.977 1.00 0.64 C ATOM 732 O ILE A 50 -9.586 -13.130 -3.253 1.00 0.69 O ATOM 733 CB ILE A 50 -9.064 -9.808 -2.842 1.00 0.57 C ATOM 734 CG1 ILE A 50 -9.320 -8.319 -3.239 1.00 0.54 C ATOM 735 CG2 ILE A 50 -7.628 -10.145 -3.351 1.00 0.59 C ATOM 736 CD1 ILE A 50 -10.353 -7.564 -2.436 1.00 0.59 C ATOM 0 H ILE A 50 -10.878 -11.031 -1.377 1.00 0.67 H new ATOM 0 HA ILE A 50 -10.685 -10.233 -4.239 1.00 0.60 H new ATOM 0 HB ILE A 50 -9.079 -9.990 -1.767 1.00 0.57 H new ATOM 0 HG12 ILE A 50 -8.375 -7.781 -3.166 1.00 0.54 H new ATOM 0 HG13 ILE A 50 -9.621 -8.294 -4.286 1.00 0.54 H new ATOM 0 HG21 ILE A 50 -6.916 -9.438 -2.925 1.00 0.59 H new ATOM 0 HG22 ILE A 50 -7.362 -11.157 -3.046 1.00 0.59 H new ATOM 0 HG23 ILE A 50 -7.602 -10.075 -4.438 1.00 0.59 H new ATOM 0 HD11 ILE A 50 -10.433 -6.545 -2.813 1.00 0.59 H new ATOM 0 HD12 ILE A 50 -11.319 -8.061 -2.526 1.00 0.59 H new ATOM 0 HD13 ILE A 50 -10.053 -7.540 -1.388 1.00 0.59 H new ATOM 748 N LEU A 51 -9.933 -12.241 -5.324 1.00 0.65 N ATOM 749 CA LEU A 51 -9.672 -13.475 -6.111 1.00 0.71 C ATOM 750 C LEU A 51 -8.200 -13.722 -6.539 1.00 0.78 C ATOM 751 O LEU A 51 -7.883 -14.823 -7.000 1.00 1.26 O ATOM 752 CB LEU A 51 -10.530 -13.416 -7.383 1.00 0.74 C ATOM 753 CG LEU A 51 -11.985 -13.951 -7.284 1.00 0.86 C ATOM 754 CD1 LEU A 51 -12.903 -13.214 -8.260 1.00 1.22 C ATOM 755 CD2 LEU A 51 -12.051 -15.457 -7.555 1.00 1.28 C ATOM 0 H LEU A 51 -10.142 -11.430 -5.907 1.00 0.65 H new ATOM 0 HA LEU A 51 -9.920 -14.300 -5.443 1.00 0.71 H new ATOM 0 HB2 LEU A 51 -10.574 -12.378 -7.713 1.00 0.74 H new ATOM 0 HB3 LEU A 51 -10.016 -13.977 -8.163 1.00 0.74 H new ATOM 0 HG LEU A 51 -12.325 -13.769 -6.265 1.00 0.86 H new ATOM 0 HD11 LEU A 51 -13.916 -13.606 -8.173 1.00 1.22 H new ATOM 0 HD12 LEU A 51 -12.904 -12.150 -8.025 1.00 1.22 H new ATOM 0 HD13 LEU A 51 -12.544 -13.361 -9.279 1.00 1.22 H new ATOM 0 HD21 LEU A 51 -13.084 -15.796 -7.477 1.00 1.28 H new ATOM 0 HD22 LEU A 51 -11.676 -15.663 -8.558 1.00 1.28 H new ATOM 0 HD23 LEU A 51 -11.440 -15.985 -6.823 1.00 1.28 H new ATOM 767 N ARG A 52 -7.303 -12.721 -6.393 1.00 0.58 N ATOM 768 CA ARG A 52 -5.883 -12.888 -6.785 1.00 0.58 C ATOM 769 C ARG A 52 -4.909 -13.161 -5.589 1.00 0.57 C ATOM 770 O ARG A 52 -3.687 -13.163 -5.775 1.00 0.65 O ATOM 771 CB ARG A 52 -5.403 -11.647 -7.565 1.00 0.57 C ATOM 772 CG ARG A 52 -4.860 -11.914 -8.997 1.00 0.70 C ATOM 773 CD ARG A 52 -5.960 -12.280 -10.013 1.00 0.64 C ATOM 774 NE ARG A 52 -5.408 -12.496 -11.348 1.00 0.87 N ATOM 775 CZ ARG A 52 -6.145 -12.803 -12.411 1.00 1.19 C ATOM 776 NH1 ARG A 52 -7.461 -12.924 -12.299 1.00 1.34 N ATOM 777 NH2 ARG A 52 -5.566 -12.988 -13.589 1.00 1.51 N ATOM 0 H ARG A 52 -7.531 -11.802 -6.013 1.00 0.58 H new ATOM 0 HA ARG A 52 -5.853 -13.779 -7.412 1.00 0.58 H new ATOM 0 HB2 ARG A 52 -6.233 -10.944 -7.637 1.00 0.57 H new ATOM 0 HB3 ARG A 52 -4.620 -11.158 -6.986 1.00 0.57 H new ATOM 0 HG2 ARG A 52 -4.332 -11.027 -9.348 1.00 0.70 H new ATOM 0 HG3 ARG A 52 -4.131 -12.723 -8.956 1.00 0.70 H new ATOM 0 HD2 ARG A 52 -6.477 -13.181 -9.682 1.00 0.64 H new ATOM 0 HD3 ARG A 52 -6.702 -11.482 -10.050 1.00 0.64 H new ATOM 0 HE ARG A 52 -4.400 -12.406 -11.472 1.00 0.87 H new ATOM 0 HH11 ARG A 52 -7.911 -12.781 -11.395 1.00 1.34 H new ATOM 0 HH12 ARG A 52 -8.023 -13.160 -13.117 1.00 1.34 H new ATOM 0 HH21 ARG A 52 -4.554 -12.895 -13.680 1.00 1.51 H new ATOM 0 HH22 ARG A 52 -6.132 -13.224 -14.404 1.00 1.51 H new ATOM 791 N SER A 53 -5.461 -13.402 -4.379 1.00 0.53 N ATOM 792 CA SER A 53 -4.658 -13.685 -3.169 1.00 0.54 C ATOM 793 C SER A 53 -5.160 -14.951 -2.396 1.00 0.57 C ATOM 794 O SER A 53 -5.996 -15.720 -2.890 1.00 0.67 O ATOM 795 CB SER A 53 -4.682 -12.431 -2.262 1.00 0.53 C ATOM 796 OG SER A 53 -3.466 -12.277 -1.541 1.00 1.09 O ATOM 0 H SER A 53 -6.468 -13.406 -4.214 1.00 0.53 H new ATOM 0 HA SER A 53 -3.636 -13.910 -3.474 1.00 0.54 H new ATOM 0 HB2 SER A 53 -4.858 -11.545 -2.872 1.00 0.53 H new ATOM 0 HB3 SER A 53 -5.513 -12.505 -1.561 1.00 0.53 H new ATOM 0 HG SER A 53 -3.152 -11.352 -1.623 1.00 1.09 H new ATOM 802 N ASN A 54 -4.616 -15.153 -1.165 1.00 0.59 N ATOM 803 CA ASN A 54 -4.981 -16.300 -0.244 1.00 0.64 C ATOM 804 C ASN A 54 -6.103 -15.830 0.755 1.00 0.63 C ATOM 805 O ASN A 54 -6.542 -14.691 0.642 1.00 0.66 O ATOM 806 CB ASN A 54 -3.748 -16.805 0.607 1.00 0.80 C ATOM 807 CG ASN A 54 -2.350 -16.671 -0.019 1.00 0.85 C ATOM 808 OD1 ASN A 54 -2.145 -16.946 -1.203 1.00 1.27 O ATOM 809 ND2 ASN A 54 -1.391 -16.243 0.796 1.00 1.12 N ATOM 0 H ASN A 54 -3.910 -14.532 -0.770 1.00 0.59 H new ATOM 0 HA ASN A 54 -5.324 -17.120 -0.874 1.00 0.64 H new ATOM 0 HB2 ASN A 54 -3.747 -16.262 1.552 1.00 0.80 H new ATOM 0 HB3 ASN A 54 -3.911 -17.856 0.844 1.00 0.80 H new ATOM 0 HD21 ASN A 54 -0.439 -16.130 0.448 1.00 1.12 H new ATOM 0 HD22 ASN A 54 -1.607 -16.027 1.769 1.00 1.12 H new ATOM 816 N PRO A 55 -6.643 -16.673 1.731 1.00 0.71 N ATOM 817 CA PRO A 55 -7.663 -16.196 2.754 1.00 0.75 C ATOM 818 C PRO A 55 -7.054 -15.215 3.801 1.00 0.74 C ATOM 819 O PRO A 55 -7.640 -14.165 4.135 1.00 0.80 O ATOM 820 CB PRO A 55 -8.118 -17.498 3.450 1.00 0.89 C ATOM 821 CG PRO A 55 -7.730 -18.589 2.491 1.00 0.95 C ATOM 822 CD PRO A 55 -6.422 -18.130 1.880 1.00 0.83 C ATOM 0 HA PRO A 55 -8.472 -15.640 2.280 1.00 0.75 H new ATOM 0 HB2 PRO A 55 -7.628 -17.625 4.415 1.00 0.89 H new ATOM 0 HB3 PRO A 55 -9.192 -17.495 3.635 1.00 0.89 H new ATOM 0 HG2 PRO A 55 -7.612 -19.543 3.006 1.00 0.95 H new ATOM 0 HG3 PRO A 55 -8.494 -18.732 1.726 1.00 0.95 H new ATOM 0 HD2 PRO A 55 -5.572 -18.349 2.526 1.00 0.83 H new ATOM 0 HD3 PRO A 55 -6.228 -18.613 0.922 1.00 0.83 H new ATOM 830 N GLU A 56 -5.800 -15.555 4.210 1.00 0.71 N ATOM 831 CA GLU A 56 -4.942 -14.776 5.162 1.00 0.73 C ATOM 832 C GLU A 56 -4.512 -13.405 4.561 1.00 0.65 C ATOM 833 O GLU A 56 -4.782 -12.299 5.101 1.00 0.67 O ATOM 834 CB GLU A 56 -3.660 -15.613 5.430 1.00 0.80 C ATOM 835 CG GLU A 56 -3.852 -16.874 6.297 1.00 0.97 C ATOM 836 CD GLU A 56 -4.378 -16.578 7.696 1.00 1.48 C ATOM 837 OE1 GLU A 56 -3.563 -16.234 8.578 1.00 1.63 O ATOM 838 OE2 GLU A 56 -5.604 -16.692 7.906 1.00 2.04 O ATOM 0 H GLU A 56 -5.340 -16.403 3.879 1.00 0.71 H new ATOM 0 HA GLU A 56 -5.510 -14.585 6.073 1.00 0.73 H new ATOM 0 HB2 GLU A 56 -3.239 -15.915 4.471 1.00 0.80 H new ATOM 0 HB3 GLU A 56 -2.924 -14.971 5.914 1.00 0.80 H new ATOM 0 HG2 GLU A 56 -4.544 -17.549 5.793 1.00 0.97 H new ATOM 0 HG3 GLU A 56 -2.899 -17.397 6.379 1.00 0.97 H new ATOM 845 N ASP A 57 -3.938 -13.515 3.349 1.00 0.62 N ATOM 846 CA ASP A 57 -3.470 -12.372 2.552 1.00 0.58 C ATOM 847 C ASP A 57 -4.624 -11.650 1.770 1.00 0.52 C ATOM 848 O ASP A 57 -4.374 -10.726 1.008 1.00 0.53 O ATOM 849 CB ASP A 57 -2.400 -12.872 1.600 1.00 0.60 C ATOM 850 CG ASP A 57 -0.986 -12.787 2.133 1.00 1.08 C ATOM 851 OD1 ASP A 57 -0.632 -13.629 2.986 1.00 1.62 O ATOM 852 OD2 ASP A 57 -0.232 -11.896 1.689 1.00 1.62 O ATOM 0 H ASP A 57 -3.785 -14.414 2.892 1.00 0.62 H new ATOM 0 HA ASP A 57 -3.066 -11.620 3.230 1.00 0.58 H new ATOM 0 HB2 ASP A 57 -2.616 -13.910 1.346 1.00 0.60 H new ATOM 0 HB3 ASP A 57 -2.460 -12.298 0.675 1.00 0.60 H new ATOM 857 N GLN A 58 -5.891 -12.120 2.000 1.00 0.52 N ATOM 858 CA GLN A 58 -7.143 -11.527 1.481 1.00 0.51 C ATOM 859 C GLN A 58 -7.583 -10.422 2.463 1.00 0.50 C ATOM 860 O GLN A 58 -7.985 -9.363 2.048 1.00 0.49 O ATOM 861 CB GLN A 58 -8.242 -12.600 1.376 1.00 0.60 C ATOM 862 CG GLN A 58 -9.461 -12.227 0.528 1.00 0.84 C ATOM 863 CD GLN A 58 -10.507 -13.322 0.542 1.00 0.91 C ATOM 864 OE1 GLN A 58 -11.398 -13.334 1.391 1.00 1.16 O ATOM 865 NE2 GLN A 58 -10.401 -14.254 -0.400 1.00 1.77 N ATOM 0 H GLN A 58 -6.061 -12.948 2.571 1.00 0.52 H new ATOM 0 HA GLN A 58 -6.978 -11.114 0.486 1.00 0.51 H new ATOM 0 HB2 GLN A 58 -7.800 -13.506 0.963 1.00 0.60 H new ATOM 0 HB3 GLN A 58 -8.584 -12.842 2.382 1.00 0.60 H new ATOM 0 HG2 GLN A 58 -9.897 -11.302 0.904 1.00 0.84 H new ATOM 0 HG3 GLN A 58 -9.146 -12.037 -0.498 1.00 0.84 H new ATOM 0 HE21 GLN A 58 -9.646 -14.204 -1.084 1.00 1.77 H new ATOM 0 HE22 GLN A 58 -11.075 -15.019 -0.439 1.00 1.77 H new ATOM 874 N VAL A 59 -7.437 -10.710 3.797 1.00 0.52 N ATOM 875 CA VAL A 59 -7.699 -9.729 4.941 1.00 0.54 C ATOM 876 C VAL A 59 -6.702 -8.515 4.852 1.00 0.52 C ATOM 877 O VAL A 59 -7.125 -7.374 5.039 1.00 0.55 O ATOM 878 CB VAL A 59 -7.568 -10.373 6.409 1.00 0.55 C ATOM 879 CG1 VAL A 59 -8.180 -9.525 7.555 1.00 0.80 C ATOM 880 CG2 VAL A 59 -8.191 -11.758 6.531 1.00 0.81 C ATOM 0 H VAL A 59 -7.134 -11.627 4.125 1.00 0.52 H new ATOM 0 HA VAL A 59 -8.735 -9.413 4.815 1.00 0.54 H new ATOM 0 HB VAL A 59 -6.485 -10.419 6.524 1.00 0.55 H new ATOM 0 HG11 VAL A 59 -8.042 -10.043 8.504 1.00 0.80 H new ATOM 0 HG12 VAL A 59 -7.684 -8.555 7.595 1.00 0.80 H new ATOM 0 HG13 VAL A 59 -9.245 -9.381 7.372 1.00 0.80 H new ATOM 0 HG21 VAL A 59 -8.063 -12.126 7.549 1.00 0.81 H new ATOM 0 HG22 VAL A 59 -9.254 -11.701 6.297 1.00 0.81 H new ATOM 0 HG23 VAL A 59 -7.702 -12.439 5.835 1.00 0.81 H new ATOM 890 N LEU A 60 -5.379 -8.772 4.565 1.00 0.49 N ATOM 891 CA LEU A 60 -4.402 -7.641 4.399 1.00 0.48 C ATOM 892 C LEU A 60 -4.584 -6.914 3.028 1.00 0.49 C ATOM 893 O LEU A 60 -4.593 -5.687 2.982 1.00 0.65 O ATOM 894 CB LEU A 60 -2.918 -8.102 4.669 1.00 0.52 C ATOM 895 CG LEU A 60 -1.987 -8.507 3.464 1.00 0.71 C ATOM 896 CD1 LEU A 60 -1.214 -7.335 2.872 1.00 1.15 C ATOM 897 CD2 LEU A 60 -0.921 -9.471 3.879 1.00 0.90 C ATOM 0 H LEU A 60 -4.982 -9.705 4.449 1.00 0.49 H new ATOM 0 HA LEU A 60 -4.626 -6.898 5.164 1.00 0.48 H new ATOM 0 HB2 LEU A 60 -2.420 -7.294 5.206 1.00 0.52 H new ATOM 0 HB3 LEU A 60 -2.962 -8.955 5.346 1.00 0.52 H new ATOM 0 HG LEU A 60 -2.684 -8.930 2.740 1.00 0.71 H new ATOM 0 HD11 LEU A 60 -0.594 -7.687 2.047 1.00 1.15 H new ATOM 0 HD12 LEU A 60 -1.915 -6.585 2.505 1.00 1.15 H new ATOM 0 HD13 LEU A 60 -0.579 -6.893 3.640 1.00 1.15 H new ATOM 0 HD21 LEU A 60 -0.303 -9.723 3.017 1.00 0.90 H new ATOM 0 HD22 LEU A 60 -0.300 -9.017 4.651 1.00 0.90 H new ATOM 0 HD23 LEU A 60 -1.383 -10.377 4.272 1.00 0.90 H new ATOM 909 N TYR A 61 -4.778 -7.711 1.935 1.00 0.44 N ATOM 910 CA TYR A 61 -5.067 -7.199 0.546 1.00 0.45 C ATOM 911 C TYR A 61 -6.541 -6.664 0.386 1.00 0.47 C ATOM 912 O TYR A 61 -6.946 -6.238 -0.690 1.00 0.52 O ATOM 913 CB TYR A 61 -4.882 -8.321 -0.503 1.00 0.44 C ATOM 914 CG TYR A 61 -3.492 -8.500 -1.153 1.00 0.46 C ATOM 915 CD1 TYR A 61 -2.322 -8.189 -0.442 1.00 0.70 C ATOM 916 CD2 TYR A 61 -3.338 -8.948 -2.460 1.00 0.76 C ATOM 917 CE1 TYR A 61 -1.070 -8.329 -1.017 1.00 0.72 C ATOM 918 CE2 TYR A 61 -2.084 -9.085 -3.038 1.00 0.92 C ATOM 919 CZ TYR A 61 -0.988 -8.872 -2.347 1.00 0.72 C ATOM 920 OH TYR A 61 0.285 -8.910 -2.886 1.00 0.88 O ATOM 0 H TYR A 61 -4.740 -8.729 1.986 1.00 0.44 H new ATOM 0 HA TYR A 61 -4.364 -6.382 0.387 1.00 0.45 H new ATOM 0 HB2 TYR A 61 -5.151 -9.265 -0.029 1.00 0.44 H new ATOM 0 HB3 TYR A 61 -5.602 -8.149 -1.303 1.00 0.44 H new ATOM 0 HD1 TYR A 61 -2.400 -7.833 0.575 1.00 0.70 H new ATOM 0 HD2 TYR A 61 -4.215 -9.195 -3.039 1.00 0.76 H new ATOM 0 HE1 TYR A 61 -0.178 -8.038 -0.481 1.00 0.72 H new ATOM 0 HE2 TYR A 61 -2.008 -9.372 -4.076 1.00 0.92 H new ATOM 0 HH TYR A 61 0.247 -9.293 -3.787 1.00 0.88 H new ATOM 930 N GLN A 62 -7.319 -6.711 1.483 1.00 0.50 N ATOM 931 CA GLN A 62 -8.712 -6.244 1.511 1.00 0.57 C ATOM 932 C GLN A 62 -8.954 -5.330 2.740 1.00 0.70 C ATOM 933 O GLN A 62 -8.163 -4.421 2.993 1.00 1.33 O ATOM 934 CB GLN A 62 -9.722 -7.435 1.464 1.00 0.57 C ATOM 935 CG GLN A 62 -11.208 -7.060 1.226 1.00 0.75 C ATOM 936 CD GLN A 62 -12.156 -7.920 2.042 1.00 0.77 C ATOM 937 OE1 GLN A 62 -12.601 -7.524 3.120 1.00 1.26 O ATOM 938 NE2 GLN A 62 -12.450 -9.111 1.547 1.00 1.02 N ATOM 0 H GLN A 62 -6.994 -7.076 2.378 1.00 0.50 H new ATOM 0 HA GLN A 62 -8.888 -5.651 0.613 1.00 0.57 H new ATOM 0 HB2 GLN A 62 -9.410 -8.119 0.674 1.00 0.57 H new ATOM 0 HB3 GLN A 62 -9.652 -7.981 2.405 1.00 0.57 H new ATOM 0 HG2 GLN A 62 -11.361 -6.011 1.481 1.00 0.75 H new ATOM 0 HG3 GLN A 62 -11.443 -7.168 0.167 1.00 0.75 H new ATOM 0 HE21 GLN A 62 -12.060 -9.401 0.650 1.00 1.02 H new ATOM 0 HE22 GLN A 62 -13.066 -9.739 2.062 1.00 1.02 H new ATOM 947 N THR A 63 -10.001 -5.649 3.560 1.00 0.58 N ATOM 948 CA THR A 63 -10.519 -4.807 4.732 1.00 0.62 C ATOM 949 C THR A 63 -10.826 -3.295 4.325 1.00 0.76 C ATOM 950 O THR A 63 -11.306 -3.078 3.206 1.00 1.28 O ATOM 951 CB THR A 63 -9.643 -4.921 6.039 1.00 0.59 C ATOM 952 OG1 THR A 63 -8.240 -4.742 5.784 1.00 0.63 O ATOM 953 CG2 THR A 63 -9.853 -6.266 6.754 1.00 0.60 C ATOM 0 H THR A 63 -10.532 -6.511 3.439 1.00 0.58 H new ATOM 0 HA THR A 63 -11.478 -5.254 4.993 1.00 0.62 H new ATOM 0 HB THR A 63 -9.983 -4.111 6.685 1.00 0.59 H new ATOM 0 HG1 THR A 63 -7.837 -5.604 5.550 1.00 0.63 H new ATOM 0 HG21 THR A 63 -9.231 -6.303 7.649 1.00 0.60 H new ATOM 0 HG22 THR A 63 -10.901 -6.369 7.036 1.00 0.60 H new ATOM 0 HG23 THR A 63 -9.576 -7.081 6.085 1.00 0.60 H new ATOM 961 N GLU A 64 -10.612 -2.274 5.216 1.00 0.57 N ATOM 962 CA GLU A 64 -10.822 -0.821 4.851 1.00 0.60 C ATOM 963 C GLU A 64 -10.636 0.157 6.031 1.00 0.64 C ATOM 964 O GLU A 64 -11.293 0.054 7.070 1.00 0.69 O ATOM 965 CB GLU A 64 -12.213 -0.550 4.189 1.00 0.67 C ATOM 966 CG GLU A 64 -13.434 -0.963 5.024 1.00 0.84 C ATOM 967 CD GLU A 64 -14.736 -0.600 4.340 1.00 1.07 C ATOM 968 OE1 GLU A 64 -15.183 0.557 4.486 1.00 1.50 O ATOM 969 OE2 GLU A 64 -15.315 -1.478 3.664 1.00 1.53 O ATOM 0 H GLU A 64 -10.300 -2.420 6.176 1.00 0.57 H new ATOM 0 HA GLU A 64 -10.034 -0.629 4.123 1.00 0.60 H new ATOM 0 HB2 GLU A 64 -12.289 0.515 3.968 1.00 0.67 H new ATOM 0 HB3 GLU A 64 -12.251 -1.077 3.236 1.00 0.67 H new ATOM 0 HG2 GLU A 64 -13.405 -2.038 5.202 1.00 0.84 H new ATOM 0 HG3 GLU A 64 -13.388 -0.477 5.999 1.00 0.84 H new ATOM 976 N ARG A 65 -9.712 1.112 5.827 1.00 0.74 N ATOM 977 CA ARG A 65 -9.396 2.182 6.801 1.00 0.91 C ATOM 978 C ARG A 65 -9.723 3.577 6.197 1.00 1.19 C ATOM 979 O ARG A 65 -9.222 3.926 5.120 1.00 2.12 O ATOM 980 CB ARG A 65 -7.894 2.115 7.151 1.00 0.98 C ATOM 981 CG ARG A 65 -7.485 2.609 8.571 1.00 0.90 C ATOM 982 CD ARG A 65 -7.221 1.466 9.586 1.00 0.96 C ATOM 983 NE ARG A 65 -8.429 0.704 9.905 1.00 1.63 N ATOM 984 CZ ARG A 65 -9.298 1.048 10.856 1.00 2.39 C ATOM 985 NH1 ARG A 65 -9.162 2.193 11.512 1.00 2.86 N ATOM 986 NH2 ARG A 65 -10.309 0.251 11.142 1.00 3.22 N ATOM 0 H ARG A 65 -9.156 1.167 4.974 1.00 0.74 H new ATOM 0 HA ARG A 65 -9.998 2.038 7.698 1.00 0.91 H new ATOM 0 HB2 ARG A 65 -7.565 1.082 7.042 1.00 0.98 H new ATOM 0 HB3 ARG A 65 -7.346 2.703 6.415 1.00 0.98 H new ATOM 0 HG2 ARG A 65 -6.587 3.221 8.487 1.00 0.90 H new ATOM 0 HG3 ARG A 65 -8.273 3.253 8.961 1.00 0.90 H new ATOM 0 HD2 ARG A 65 -6.468 0.791 9.179 1.00 0.96 H new ATOM 0 HD3 ARG A 65 -6.810 1.888 10.503 1.00 0.96 H new ATOM 0 HE ARG A 65 -8.618 -0.142 9.367 1.00 1.63 H new ATOM 0 HH11 ARG A 65 -8.388 2.819 11.290 1.00 2.86 H new ATOM 0 HH12 ARG A 65 -9.832 2.448 12.238 1.00 2.86 H new ATOM 0 HH21 ARG A 65 -10.425 -0.627 10.636 1.00 3.22 H new ATOM 0 HH22 ARG A 65 -10.975 0.513 11.869 1.00 3.22 H new ATOM 1000 N TYR A 66 -10.552 4.377 6.902 1.00 0.77 N ATOM 1001 CA TYR A 66 -10.953 5.723 6.414 1.00 0.92 C ATOM 1002 C TYR A 66 -10.853 6.817 7.508 1.00 1.10 C ATOM 1003 O TYR A 66 -11.108 6.565 8.694 1.00 1.80 O ATOM 1004 CB TYR A 66 -12.395 5.658 5.859 1.00 1.58 C ATOM 1005 CG TYR A 66 -12.793 6.837 4.951 1.00 1.83 C ATOM 1006 CD1 TYR A 66 -12.321 6.944 3.635 1.00 2.21 C ATOM 1007 CD2 TYR A 66 -13.647 7.840 5.415 1.00 2.35 C ATOM 1008 CE1 TYR A 66 -12.690 8.009 2.826 1.00 2.72 C ATOM 1009 CE2 TYR A 66 -14.015 8.903 4.605 1.00 2.90 C ATOM 1010 CZ TYR A 66 -13.496 8.971 3.289 1.00 2.96 C ATOM 1011 OH TYR A 66 -13.900 10.036 2.514 1.00 3.66 O ATOM 0 H TYR A 66 -10.956 4.121 7.803 1.00 0.77 H new ATOM 0 HA TYR A 66 -10.255 6.005 5.626 1.00 0.92 H new ATOM 0 HB2 TYR A 66 -12.512 4.731 5.298 1.00 1.58 H new ATOM 0 HB3 TYR A 66 -13.090 5.613 6.697 1.00 1.58 H new ATOM 0 HD1 TYR A 66 -11.659 6.185 3.245 1.00 2.21 H new ATOM 0 HD2 TYR A 66 -14.028 7.786 6.424 1.00 2.35 H new ATOM 0 HE1 TYR A 66 -12.323 8.062 1.812 1.00 2.72 H new ATOM 0 HE2 TYR A 66 -14.686 9.666 4.971 1.00 2.90 H new ATOM 0 HH TYR A 66 -14.484 10.621 3.040 1.00 3.66 H new ATOM 1021 N ASN A 67 -10.493 8.050 7.075 1.00 1.30 N ATOM 1022 CA ASN A 67 -10.354 9.202 7.988 1.00 1.97 C ATOM 1023 C ASN A 67 -11.122 10.455 7.482 1.00 1.59 C ATOM 1024 O ASN A 67 -12.281 10.650 7.862 1.00 1.69 O ATOM 1025 CB ASN A 67 -8.864 9.528 8.234 1.00 3.06 C ATOM 1026 CG ASN A 67 -8.478 9.517 9.714 1.00 3.99 C ATOM 1027 OD1 ASN A 67 -9.054 8.783 10.519 1.00 4.39 O ATOM 1028 ND2 ASN A 67 -7.495 10.336 10.073 1.00 4.70 N ATOM 0 H ASN A 67 -10.295 8.268 6.099 1.00 1.30 H new ATOM 0 HA ASN A 67 -10.809 8.916 8.936 1.00 1.97 H new ATOM 0 HB2 ASN A 67 -8.248 8.805 7.700 1.00 3.06 H new ATOM 0 HB3 ASN A 67 -8.640 10.509 7.815 1.00 3.06 H new ATOM 0 HD21 ASN A 67 -7.192 10.373 11.046 1.00 4.70 H new ATOM 0 HD22 ASN A 67 -7.044 10.928 9.375 1.00 4.70 H new ATOM 1035 N GLU A 68 -10.483 11.300 6.630 1.00 1.31 N ATOM 1036 CA GLU A 68 -11.130 12.530 6.135 1.00 1.11 C ATOM 1037 C GLU A 68 -10.638 12.956 4.723 1.00 0.91 C ATOM 1038 O GLU A 68 -11.235 12.548 3.724 1.00 1.18 O ATOM 1039 CB GLU A 68 -10.941 13.677 7.169 1.00 1.42 C ATOM 1040 CG GLU A 68 -11.873 14.887 6.987 1.00 1.26 C ATOM 1041 CD GLU A 68 -11.588 15.991 7.987 1.00 1.99 C ATOM 1042 OE1 GLU A 68 -10.694 16.822 7.719 1.00 2.55 O ATOM 1043 OE2 GLU A 68 -12.262 16.028 9.038 1.00 2.25 O ATOM 0 H GLU A 68 -9.537 11.150 6.280 1.00 1.31 H new ATOM 0 HA GLU A 68 -12.193 12.315 6.024 1.00 1.11 H new ATOM 0 HB2 GLU A 68 -11.092 13.271 8.169 1.00 1.42 H new ATOM 0 HB3 GLU A 68 -9.909 14.023 7.118 1.00 1.42 H new ATOM 0 HG2 GLU A 68 -11.762 15.279 5.976 1.00 1.26 H new ATOM 0 HG3 GLU A 68 -12.909 14.564 7.092 1.00 1.26 H new ATOM 1050 N ASP A 69 -9.536 13.754 4.649 1.00 0.76 N ATOM 1051 CA ASP A 69 -8.994 14.291 3.366 1.00 0.75 C ATOM 1052 C ASP A 69 -7.531 14.749 3.535 1.00 0.69 C ATOM 1053 O ASP A 69 -7.231 15.565 4.417 1.00 1.33 O ATOM 1054 CB ASP A 69 -9.817 15.507 2.885 1.00 1.17 C ATOM 1055 CG ASP A 69 -10.871 15.211 1.813 1.00 1.63 C ATOM 1056 OD1 ASP A 69 -10.944 14.046 1.369 1.00 2.06 O ATOM 1057 OD2 ASP A 69 -11.612 16.135 1.418 1.00 2.15 O ATOM 0 H ASP A 69 -9.002 14.042 5.469 1.00 0.76 H new ATOM 0 HA ASP A 69 -9.053 13.485 2.634 1.00 0.75 H new ATOM 0 HB2 ASP A 69 -10.316 15.949 3.747 1.00 1.17 H new ATOM 0 HB3 ASP A 69 -9.129 16.257 2.495 1.00 1.17 H new ATOM 1062 N SER A 70 -6.614 14.220 2.663 1.00 0.72 N ATOM 1063 CA SER A 70 -5.135 14.530 2.662 1.00 0.57 C ATOM 1064 C SER A 70 -4.408 13.939 3.893 1.00 0.53 C ATOM 1065 O SER A 70 -4.195 14.632 4.897 1.00 0.57 O ATOM 1066 CB SER A 70 -4.872 16.050 2.546 1.00 0.70 C ATOM 1067 OG SER A 70 -3.797 16.328 1.661 1.00 0.77 O ATOM 0 H SER A 70 -6.879 13.560 1.932 1.00 0.72 H new ATOM 0 HA SER A 70 -4.720 14.046 1.778 1.00 0.57 H new ATOM 0 HB2 SER A 70 -5.774 16.550 2.193 1.00 0.70 H new ATOM 0 HB3 SER A 70 -4.647 16.457 3.532 1.00 0.70 H new ATOM 0 HG SER A 70 -3.658 17.297 1.609 1.00 0.77 H new ATOM 1073 N PHE A 71 -4.042 12.653 3.799 1.00 0.49 N ATOM 1074 CA PHE A 71 -3.380 11.963 4.926 1.00 0.47 C ATOM 1075 C PHE A 71 -2.374 10.890 4.464 1.00 0.33 C ATOM 1076 O PHE A 71 -2.483 10.336 3.357 1.00 0.39 O ATOM 1077 CB PHE A 71 -4.430 11.378 5.935 1.00 0.66 C ATOM 1078 CG PHE A 71 -5.652 10.656 5.336 1.00 0.54 C ATOM 1079 CD1 PHE A 71 -6.778 11.378 4.933 1.00 0.75 C ATOM 1080 CD2 PHE A 71 -5.694 9.260 5.216 1.00 0.73 C ATOM 1081 CE1 PHE A 71 -7.896 10.735 4.423 1.00 0.81 C ATOM 1082 CE2 PHE A 71 -6.821 8.620 4.710 1.00 0.78 C ATOM 1083 CZ PHE A 71 -7.919 9.361 4.314 1.00 0.67 C ATOM 0 H PHE A 71 -4.188 12.074 2.972 1.00 0.49 H new ATOM 0 HA PHE A 71 -2.797 12.719 5.452 1.00 0.47 H new ATOM 0 HB2 PHE A 71 -3.914 10.680 6.594 1.00 0.66 H new ATOM 0 HB3 PHE A 71 -4.792 12.196 6.558 1.00 0.66 H new ATOM 0 HD1 PHE A 71 -6.778 12.454 5.020 1.00 0.75 H new ATOM 0 HD2 PHE A 71 -4.840 8.673 5.520 1.00 0.73 H new ATOM 0 HE1 PHE A 71 -8.753 11.313 4.110 1.00 0.81 H new ATOM 0 HE2 PHE A 71 -6.838 7.543 4.626 1.00 0.78 H new ATOM 0 HZ PHE A 71 -8.793 8.864 3.920 1.00 0.67 H new ATOM 1093 N GLY A 72 -1.369 10.628 5.325 1.00 0.31 N ATOM 1094 CA GLY A 72 -0.343 9.639 5.001 1.00 0.41 C ATOM 1095 C GLY A 72 0.697 9.368 6.081 1.00 0.33 C ATOM 1096 O GLY A 72 0.747 10.033 7.119 1.00 0.47 O ATOM 0 H GLY A 72 -1.254 11.082 6.231 1.00 0.31 H new ATOM 0 HA2 GLY A 72 -0.838 8.699 4.759 1.00 0.41 H new ATOM 0 HA3 GLY A 72 0.176 9.967 4.100 1.00 0.41 H new ATOM 1100 N TYR A 73 1.614 8.447 5.754 1.00 0.28 N ATOM 1101 CA TYR A 73 2.624 7.956 6.716 1.00 0.24 C ATOM 1102 C TYR A 73 4.048 8.551 6.617 1.00 0.21 C ATOM 1103 O TYR A 73 4.401 9.289 5.686 1.00 0.27 O ATOM 1104 CB TYR A 73 2.761 6.440 6.572 1.00 0.36 C ATOM 1105 CG TYR A 73 1.445 5.660 6.520 1.00 0.33 C ATOM 1106 CD1 TYR A 73 0.847 5.175 7.681 1.00 0.48 C ATOM 1107 CD2 TYR A 73 0.812 5.396 5.301 1.00 0.47 C ATOM 1108 CE1 TYR A 73 -0.331 4.457 7.625 1.00 0.62 C ATOM 1109 CE2 TYR A 73 -0.367 4.681 5.249 1.00 0.63 C ATOM 1110 CZ TYR A 73 -0.931 4.214 6.411 1.00 0.68 C ATOM 1111 OH TYR A 73 -2.102 3.502 6.361 1.00 0.89 O ATOM 0 H TYR A 73 1.681 8.023 4.829 1.00 0.28 H new ATOM 0 HA TYR A 73 2.234 8.283 7.680 1.00 0.24 H new ATOM 0 HB2 TYR A 73 3.324 6.229 5.663 1.00 0.36 H new ATOM 0 HB3 TYR A 73 3.352 6.065 7.408 1.00 0.36 H new ATOM 0 HD1 TYR A 73 1.311 5.363 8.638 1.00 0.48 H new ATOM 0 HD2 TYR A 73 1.254 5.758 4.384 1.00 0.47 H new ATOM 0 HE1 TYR A 73 -0.781 4.086 8.534 1.00 0.62 H new ATOM 0 HE2 TYR A 73 -0.844 4.490 4.299 1.00 0.63 H new ATOM 0 HH TYR A 73 -2.395 3.419 5.430 1.00 0.89 H new ATOM 1121 N ASP A 74 4.855 8.140 7.623 1.00 0.17 N ATOM 1122 CA ASP A 74 6.261 8.539 7.792 1.00 0.16 C ATOM 1123 C ASP A 74 7.161 7.304 8.064 1.00 0.15 C ATOM 1124 O ASP A 74 6.959 6.578 9.046 1.00 0.24 O ATOM 1125 CB ASP A 74 6.378 9.524 8.975 1.00 0.21 C ATOM 1126 CG ASP A 74 6.327 10.992 8.562 1.00 0.26 C ATOM 1127 OD1 ASP A 74 5.533 11.328 7.657 1.00 0.51 O ATOM 1128 OD2 ASP A 74 7.073 11.800 9.151 1.00 0.40 O ATOM 0 H ASP A 74 4.533 7.506 8.354 1.00 0.17 H new ATOM 0 HA ASP A 74 6.595 9.017 6.871 1.00 0.16 H new ATOM 0 HB2 ASP A 74 5.571 9.327 9.681 1.00 0.21 H new ATOM 0 HB3 ASP A 74 7.314 9.336 9.500 1.00 0.21 H new ATOM 1133 N ILE A 75 8.160 7.086 7.185 1.00 0.10 N ATOM 1134 CA ILE A 75 9.121 5.959 7.303 1.00 0.09 C ATOM 1135 C ILE A 75 10.554 6.519 7.608 1.00 0.08 C ATOM 1136 O ILE A 75 11.155 7.128 6.734 1.00 0.12 O ATOM 1137 CB ILE A 75 9.172 5.058 5.979 1.00 0.11 C ATOM 1138 CG1 ILE A 75 7.771 4.649 5.480 1.00 0.13 C ATOM 1139 CG2 ILE A 75 9.982 3.742 6.158 1.00 0.14 C ATOM 1140 CD1 ILE A 75 7.220 5.453 4.326 1.00 0.15 C ATOM 0 H ILE A 75 8.327 7.682 6.374 1.00 0.10 H new ATOM 0 HA ILE A 75 8.778 5.324 8.120 1.00 0.09 H new ATOM 0 HB ILE A 75 9.665 5.703 5.252 1.00 0.11 H new ATOM 0 HG12 ILE A 75 7.804 3.601 5.184 1.00 0.13 H new ATOM 0 HG13 ILE A 75 7.074 4.723 6.314 1.00 0.13 H new ATOM 0 HG21 ILE A 75 9.976 3.181 5.224 1.00 0.14 H new ATOM 0 HG22 ILE A 75 11.010 3.982 6.430 1.00 0.14 H new ATOM 0 HG23 ILE A 75 9.529 3.140 6.946 1.00 0.14 H new ATOM 0 HD11 ILE A 75 6.232 5.078 4.060 1.00 0.15 H new ATOM 0 HD12 ILE A 75 7.144 6.501 4.616 1.00 0.15 H new ATOM 0 HD13 ILE A 75 7.886 5.361 3.468 1.00 0.15 H new ATOM 1152 N PRO A 76 11.118 6.336 8.842 1.00 0.09 N ATOM 1153 CA PRO A 76 12.490 6.801 9.153 1.00 0.10 C ATOM 1154 C PRO A 76 13.622 5.798 8.745 1.00 0.09 C ATOM 1155 O PRO A 76 13.672 4.670 9.243 1.00 0.11 O ATOM 1156 CB PRO A 76 12.423 7.006 10.666 1.00 0.14 C ATOM 1157 CG PRO A 76 11.502 5.908 11.147 1.00 0.15 C ATOM 1158 CD PRO A 76 10.476 5.719 10.037 1.00 0.12 C ATOM 0 HA PRO A 76 12.759 7.693 8.588 1.00 0.10 H new ATOM 0 HB2 PRO A 76 13.409 6.927 11.123 1.00 0.14 H new ATOM 0 HB3 PRO A 76 12.033 7.992 10.918 1.00 0.14 H new ATOM 0 HG2 PRO A 76 12.054 4.986 11.332 1.00 0.15 H new ATOM 0 HG3 PRO A 76 11.019 6.184 12.084 1.00 0.15 H new ATOM 0 HD2 PRO A 76 10.257 4.664 9.872 1.00 0.12 H new ATOM 0 HD3 PRO A 76 9.532 6.207 10.279 1.00 0.12 H new ATOM 1166 N ILE A 77 14.511 6.236 7.829 1.00 0.09 N ATOM 1167 CA ILE A 77 15.632 5.393 7.323 1.00 0.10 C ATOM 1168 C ILE A 77 17.015 6.111 7.488 1.00 0.13 C ATOM 1169 O ILE A 77 17.107 7.339 7.610 1.00 0.19 O ATOM 1170 CB ILE A 77 15.417 4.965 5.797 1.00 0.12 C ATOM 1171 CG1 ILE A 77 13.920 4.813 5.447 1.00 0.11 C ATOM 1172 CG2 ILE A 77 16.114 3.606 5.434 1.00 0.18 C ATOM 1173 CD1 ILE A 77 13.306 5.892 4.589 1.00 0.19 C ATOM 0 H ILE A 77 14.480 7.170 7.420 1.00 0.09 H new ATOM 0 HA ILE A 77 15.636 4.489 7.932 1.00 0.10 H new ATOM 0 HB ILE A 77 15.870 5.772 5.222 1.00 0.12 H new ATOM 0 HG12 ILE A 77 13.786 3.858 4.939 1.00 0.11 H new ATOM 0 HG13 ILE A 77 13.357 4.760 6.379 1.00 0.11 H new ATOM 0 HG21 ILE A 77 15.931 3.372 4.385 1.00 0.18 H new ATOM 0 HG22 ILE A 77 17.187 3.691 5.605 1.00 0.18 H new ATOM 0 HG23 ILE A 77 15.709 2.811 6.060 1.00 0.18 H new ATOM 0 HD11 ILE A 77 12.254 5.666 4.418 1.00 0.19 H new ATOM 0 HD12 ILE A 77 13.393 6.853 5.096 1.00 0.19 H new ATOM 0 HD13 ILE A 77 13.828 5.938 3.633 1.00 0.19 H new ATOM 1185 N LYS A 78 18.077 5.286 7.475 1.00 0.15 N ATOM 1186 CA LYS A 78 19.478 5.734 7.588 1.00 0.20 C ATOM 1187 C LYS A 78 20.456 4.777 6.839 1.00 0.21 C ATOM 1188 O LYS A 78 21.651 4.741 7.156 1.00 0.25 O ATOM 1189 CB LYS A 78 19.902 5.838 9.074 1.00 0.27 C ATOM 1190 CG LYS A 78 19.497 7.157 9.774 1.00 0.87 C ATOM 1191 CD LYS A 78 19.803 7.172 11.297 1.00 1.32 C ATOM 1192 CE LYS A 78 21.309 7.188 11.622 1.00 1.91 C ATOM 1193 NZ LYS A 78 21.553 7.447 13.069 1.00 2.53 N ATOM 0 H LYS A 78 17.986 4.274 7.384 1.00 0.15 H new ATOM 0 HA LYS A 78 19.535 6.718 7.122 1.00 0.20 H new ATOM 0 HB2 LYS A 78 19.464 5.003 9.621 1.00 0.27 H new ATOM 0 HB3 LYS A 78 20.985 5.727 9.137 1.00 0.27 H new ATOM 0 HG2 LYS A 78 20.020 7.986 9.299 1.00 0.87 H new ATOM 0 HG3 LYS A 78 18.431 7.325 9.624 1.00 0.87 H new ATOM 0 HD2 LYS A 78 19.334 8.048 11.745 1.00 1.32 H new ATOM 0 HD3 LYS A 78 19.349 6.295 11.759 1.00 1.32 H new ATOM 0 HE2 LYS A 78 21.753 6.232 11.343 1.00 1.91 H new ATOM 0 HE3 LYS A 78 21.803 7.955 11.026 1.00 1.91 H new ATOM 0 HZ1 LYS A 78 22.577 7.451 13.253 1.00 2.53 H new ATOM 0 HZ2 LYS A 78 21.151 8.370 13.329 1.00 2.53 H new ATOM 0 HZ3 LYS A 78 21.102 6.701 13.636 1.00 2.53 H new ATOM 1207 N GLU A 79 19.949 4.010 5.834 1.00 0.19 N ATOM 1208 CA GLU A 79 20.772 3.071 5.059 1.00 0.22 C ATOM 1209 C GLU A 79 20.588 3.283 3.542 1.00 0.20 C ATOM 1210 O GLU A 79 19.573 3.836 3.089 1.00 0.18 O ATOM 1211 CB GLU A 79 20.403 1.623 5.434 1.00 0.24 C ATOM 1212 CG GLU A 79 20.907 1.167 6.812 1.00 0.55 C ATOM 1213 CD GLU A 79 20.452 -0.239 7.158 1.00 1.17 C ATOM 1214 OE1 GLU A 79 19.342 -0.386 7.713 1.00 2.12 O ATOM 1215 OE2 GLU A 79 21.206 -1.194 6.876 1.00 1.03 O ATOM 0 H GLU A 79 18.970 4.033 5.550 1.00 0.19 H new ATOM 0 HA GLU A 79 21.818 3.257 5.301 1.00 0.22 H new ATOM 0 HB2 GLU A 79 19.318 1.521 5.407 1.00 0.24 H new ATOM 0 HB3 GLU A 79 20.805 0.952 4.675 1.00 0.24 H new ATOM 0 HG2 GLU A 79 21.996 1.208 6.829 1.00 0.55 H new ATOM 0 HG3 GLU A 79 20.550 1.860 7.574 1.00 0.55 H new ATOM 1222 N GLU A 80 21.571 2.823 2.755 1.00 0.26 N ATOM 1223 CA GLU A 80 21.531 2.984 1.295 1.00 0.25 C ATOM 1224 C GLU A 80 21.560 1.653 0.524 1.00 0.27 C ATOM 1225 O GLU A 80 22.233 0.686 0.904 1.00 0.32 O ATOM 1226 CB GLU A 80 22.703 3.862 0.832 1.00 0.27 C ATOM 1227 CG GLU A 80 22.630 5.344 1.252 1.00 0.28 C ATOM 1228 CD GLU A 80 23.702 5.706 2.265 1.00 0.36 C ATOM 1229 OE1 GLU A 80 24.857 5.940 1.850 1.00 0.40 O ATOM 1230 OE2 GLU A 80 23.387 5.755 3.472 1.00 0.42 O ATOM 0 H GLU A 80 22.399 2.339 3.103 1.00 0.26 H new ATOM 0 HA GLU A 80 20.576 3.459 1.070 1.00 0.25 H new ATOM 0 HB2 GLU A 80 23.628 3.437 1.222 1.00 0.27 H new ATOM 0 HB3 GLU A 80 22.763 3.813 -0.255 1.00 0.27 H new ATOM 0 HG2 GLU A 80 22.738 5.976 0.370 1.00 0.28 H new ATOM 0 HG3 GLU A 80 21.647 5.552 1.675 1.00 0.28 H new ATOM 1237 N GLY A 81 20.820 1.659 -0.587 1.00 0.22 N ATOM 1238 CA GLY A 81 20.715 0.502 -1.474 1.00 0.23 C ATOM 1239 C GLY A 81 19.504 0.598 -2.395 1.00 0.19 C ATOM 1240 O GLY A 81 19.262 1.663 -2.983 1.00 0.18 O ATOM 0 H GLY A 81 20.278 2.466 -0.895 1.00 0.22 H new ATOM 0 HA2 GLY A 81 21.621 0.421 -2.074 1.00 0.23 H new ATOM 0 HA3 GLY A 81 20.646 -0.408 -0.877 1.00 0.23 H new ATOM 1244 N GLU A 82 18.737 -0.507 -2.563 1.00 0.20 N ATOM 1245 CA GLU A 82 17.533 -0.446 -3.406 1.00 0.17 C ATOM 1246 C GLU A 82 16.269 -0.765 -2.590 1.00 0.18 C ATOM 1247 O GLU A 82 16.006 -1.911 -2.244 1.00 0.30 O ATOM 1248 CB GLU A 82 17.655 -1.398 -4.610 1.00 0.19 C ATOM 1249 CG GLU A 82 18.688 -0.996 -5.676 1.00 0.26 C ATOM 1250 CD GLU A 82 18.403 -1.633 -7.025 1.00 0.86 C ATOM 1251 OE1 GLU A 82 17.437 -1.204 -7.691 1.00 0.78 O ATOM 1252 OE2 GLU A 82 19.144 -2.559 -7.414 1.00 1.75 O ATOM 0 H GLU A 82 18.926 -1.416 -2.141 1.00 0.20 H new ATOM 0 HA GLU A 82 17.444 0.573 -3.784 1.00 0.17 H new ATOM 0 HB2 GLU A 82 17.910 -2.391 -4.240 1.00 0.19 H new ATOM 0 HB3 GLU A 82 16.679 -1.477 -5.088 1.00 0.19 H new ATOM 0 HG2 GLU A 82 18.693 0.089 -5.783 1.00 0.26 H new ATOM 0 HG3 GLU A 82 19.684 -1.288 -5.342 1.00 0.26 H new ATOM 1259 N TYR A 83 15.460 0.274 -2.317 1.00 0.08 N ATOM 1260 CA TYR A 83 14.221 0.121 -1.527 1.00 0.08 C ATOM 1261 C TYR A 83 12.997 0.039 -2.437 1.00 0.08 C ATOM 1262 O TYR A 83 12.789 0.882 -3.298 1.00 0.12 O ATOM 1263 CB TYR A 83 14.055 1.268 -0.515 1.00 0.10 C ATOM 1264 CG TYR A 83 15.081 1.243 0.621 1.00 0.11 C ATOM 1265 CD1 TYR A 83 16.408 1.627 0.419 1.00 0.16 C ATOM 1266 CD2 TYR A 83 14.716 0.842 1.906 1.00 0.17 C ATOM 1267 CE1 TYR A 83 17.318 1.609 1.453 1.00 0.18 C ATOM 1268 CE2 TYR A 83 15.622 0.826 2.938 1.00 0.19 C ATOM 1269 CZ TYR A 83 16.969 1.185 2.664 1.00 0.16 C ATOM 1270 OH TYR A 83 17.828 1.207 3.736 1.00 0.21 O ATOM 0 H TYR A 83 15.640 1.228 -2.630 1.00 0.08 H new ATOM 0 HA TYR A 83 14.304 -0.813 -0.972 1.00 0.08 H new ATOM 0 HB2 TYR A 83 14.133 2.219 -1.042 1.00 0.10 H new ATOM 0 HB3 TYR A 83 13.053 1.221 -0.088 1.00 0.10 H new ATOM 0 HD1 TYR A 83 16.726 1.943 -0.563 1.00 0.16 H new ATOM 0 HD2 TYR A 83 13.697 0.537 2.094 1.00 0.17 H new ATOM 0 HE1 TYR A 83 18.330 1.944 1.278 1.00 0.18 H new ATOM 0 HE2 TYR A 83 15.317 0.547 3.936 1.00 0.19 H new ATOM 0 HH TYR A 83 17.372 0.853 4.528 1.00 0.21 H new ATOM 1280 N VAL A 84 12.185 -0.996 -2.221 1.00 0.08 N ATOM 1281 CA VAL A 84 10.992 -1.248 -3.073 1.00 0.10 C ATOM 1282 C VAL A 84 9.689 -1.022 -2.265 1.00 0.10 C ATOM 1283 O VAL A 84 9.465 -1.638 -1.213 1.00 0.10 O ATOM 1284 CB VAL A 84 10.983 -2.710 -3.773 1.00 0.11 C ATOM 1285 CG1 VAL A 84 10.140 -2.747 -5.078 1.00 0.13 C ATOM 1286 CG2 VAL A 84 12.386 -3.250 -4.136 1.00 0.20 C ATOM 0 H VAL A 84 12.318 -1.676 -1.473 1.00 0.08 H new ATOM 0 HA VAL A 84 11.047 -0.526 -3.888 1.00 0.10 H new ATOM 0 HB VAL A 84 10.540 -3.343 -3.004 1.00 0.11 H new ATOM 0 HG11 VAL A 84 10.170 -3.750 -5.503 1.00 0.13 H new ATOM 0 HG12 VAL A 84 9.108 -2.480 -4.852 1.00 0.13 H new ATOM 0 HG13 VAL A 84 10.550 -2.037 -5.796 1.00 0.13 H new ATOM 0 HG21 VAL A 84 12.289 -4.232 -4.599 1.00 0.20 H new ATOM 0 HG22 VAL A 84 12.870 -2.566 -4.833 1.00 0.20 H new ATOM 0 HG23 VAL A 84 12.989 -3.333 -3.232 1.00 0.20 H new ATOM 1296 N LEU A 85 8.838 -0.124 -2.807 1.00 0.12 N ATOM 1297 CA LEU A 85 7.544 0.197 -2.202 1.00 0.15 C ATOM 1298 C LEU A 85 6.405 -0.406 -3.050 1.00 0.16 C ATOM 1299 O LEU A 85 6.109 0.048 -4.165 1.00 0.21 O ATOM 1300 CB LEU A 85 7.412 1.732 -2.038 1.00 0.25 C ATOM 1301 CG LEU A 85 6.299 2.267 -1.073 1.00 0.43 C ATOM 1302 CD1 LEU A 85 6.852 3.274 -0.072 1.00 0.78 C ATOM 1303 CD2 LEU A 85 5.154 2.926 -1.833 1.00 0.61 C ATOM 0 H LEU A 85 9.033 0.389 -3.667 1.00 0.12 H new ATOM 0 HA LEU A 85 7.474 -0.244 -1.208 1.00 0.15 H new ATOM 0 HB2 LEU A 85 8.371 2.116 -1.690 1.00 0.25 H new ATOM 0 HB3 LEU A 85 7.236 2.161 -3.024 1.00 0.25 H new ATOM 0 HG LEU A 85 5.925 1.392 -0.541 1.00 0.43 H new ATOM 0 HD11 LEU A 85 6.048 3.620 0.578 1.00 0.78 H new ATOM 0 HD12 LEU A 85 7.627 2.800 0.530 1.00 0.78 H new ATOM 0 HD13 LEU A 85 7.277 4.123 -0.607 1.00 0.78 H new ATOM 0 HD21 LEU A 85 4.405 3.282 -1.126 1.00 0.61 H new ATOM 0 HD22 LEU A 85 5.537 3.767 -2.410 1.00 0.61 H new ATOM 0 HD23 LEU A 85 4.700 2.200 -2.507 1.00 0.61 H new ATOM 1315 N VAL A 86 5.820 -1.479 -2.493 1.00 0.17 N ATOM 1316 CA VAL A 86 4.704 -2.231 -3.123 1.00 0.21 C ATOM 1317 C VAL A 86 3.426 -2.022 -2.269 1.00 0.21 C ATOM 1318 O VAL A 86 3.428 -2.229 -1.047 1.00 0.27 O ATOM 1319 CB VAL A 86 4.955 -3.820 -3.307 1.00 0.25 C ATOM 1320 CG1 VAL A 86 4.181 -4.404 -4.523 1.00 0.44 C ATOM 1321 CG2 VAL A 86 6.443 -4.240 -3.459 1.00 0.32 C ATOM 0 H VAL A 86 6.104 -1.857 -1.589 1.00 0.17 H new ATOM 0 HA VAL A 86 4.608 -1.832 -4.133 1.00 0.21 H new ATOM 0 HB VAL A 86 4.581 -4.231 -2.369 1.00 0.25 H new ATOM 0 HG11 VAL A 86 4.382 -5.472 -4.603 1.00 0.44 H new ATOM 0 HG12 VAL A 86 3.112 -4.246 -4.384 1.00 0.44 H new ATOM 0 HG13 VAL A 86 4.506 -3.904 -5.435 1.00 0.44 H new ATOM 0 HG21 VAL A 86 6.506 -5.322 -3.576 1.00 0.32 H new ATOM 0 HG22 VAL A 86 6.870 -3.755 -4.336 1.00 0.32 H new ATOM 0 HG23 VAL A 86 6.999 -3.939 -2.571 1.00 0.32 H new ATOM 1331 N LEU A 87 2.350 -1.612 -2.940 1.00 0.20 N ATOM 1332 CA LEU A 87 1.062 -1.380 -2.262 1.00 0.22 C ATOM 1333 C LEU A 87 -0.116 -2.003 -3.010 1.00 0.22 C ATOM 1334 O LEU A 87 -0.172 -1.981 -4.250 1.00 0.26 O ATOM 1335 CB LEU A 87 0.752 0.144 -2.050 1.00 0.31 C ATOM 1336 CG LEU A 87 1.500 1.199 -2.934 1.00 0.50 C ATOM 1337 CD1 LEU A 87 1.041 1.205 -4.399 1.00 1.25 C ATOM 1338 CD2 LEU A 87 1.327 2.602 -2.353 1.00 0.88 C ATOM 0 H LEU A 87 2.337 -1.433 -3.944 1.00 0.20 H new ATOM 0 HA LEU A 87 1.175 -1.864 -1.292 1.00 0.22 H new ATOM 0 HB2 LEU A 87 -0.318 0.287 -2.201 1.00 0.31 H new ATOM 0 HB3 LEU A 87 0.961 0.381 -1.007 1.00 0.31 H new ATOM 0 HG LEU A 87 2.550 0.906 -2.922 1.00 0.50 H new ATOM 0 HD11 LEU A 87 1.601 1.959 -4.952 1.00 1.25 H new ATOM 0 HD12 LEU A 87 1.219 0.224 -4.840 1.00 1.25 H new ATOM 0 HD13 LEU A 87 -0.023 1.436 -4.446 1.00 1.25 H new ATOM 0 HD21 LEU A 87 1.853 3.323 -2.979 1.00 0.88 H new ATOM 0 HD22 LEU A 87 0.267 2.854 -2.321 1.00 0.88 H new ATOM 0 HD23 LEU A 87 1.737 2.631 -1.344 1.00 0.88 H new ATOM 1350 N LYS A 88 -1.072 -2.563 -2.245 1.00 0.23 N ATOM 1351 CA LYS A 88 -2.291 -3.115 -2.860 1.00 0.26 C ATOM 1352 C LYS A 88 -3.497 -2.199 -2.574 1.00 0.27 C ATOM 1353 O LYS A 88 -3.842 -1.912 -1.426 1.00 0.29 O ATOM 1354 CB LYS A 88 -2.570 -4.599 -2.443 1.00 0.31 C ATOM 1355 CG LYS A 88 -3.775 -5.289 -3.147 1.00 0.46 C ATOM 1356 CD LYS A 88 -5.140 -4.803 -2.623 1.00 1.53 C ATOM 1357 CE LYS A 88 -6.292 -5.376 -3.439 1.00 2.13 C ATOM 1358 NZ LYS A 88 -6.237 -6.855 -3.473 1.00 2.52 N ATOM 0 H LYS A 88 -1.027 -2.644 -1.229 1.00 0.23 H new ATOM 0 HA LYS A 88 -2.126 -3.142 -3.937 1.00 0.26 H new ATOM 0 HB2 LYS A 88 -1.673 -5.186 -2.641 1.00 0.31 H new ATOM 0 HB3 LYS A 88 -2.738 -4.628 -1.366 1.00 0.31 H new ATOM 0 HG2 LYS A 88 -3.717 -5.103 -4.219 1.00 0.46 H new ATOM 0 HG3 LYS A 88 -3.701 -6.367 -3.006 1.00 0.46 H new ATOM 0 HD2 LYS A 88 -5.254 -5.094 -1.579 1.00 1.53 H new ATOM 0 HD3 LYS A 88 -5.176 -3.714 -2.657 1.00 1.53 H new ATOM 0 HE2 LYS A 88 -7.241 -5.054 -3.010 1.00 2.13 H new ATOM 0 HE3 LYS A 88 -6.252 -4.984 -4.455 1.00 2.13 H new ATOM 0 HZ1 LYS A 88 -6.936 -7.213 -4.155 1.00 2.52 H new ATOM 0 HZ2 LYS A 88 -5.285 -7.160 -3.760 1.00 2.52 H new ATOM 0 HZ3 LYS A 88 -6.451 -7.232 -2.528 1.00 2.52 H new ATOM 1372 N PHE A 89 -4.130 -1.771 -3.669 1.00 0.27 N ATOM 1373 CA PHE A 89 -5.322 -0.921 -3.628 1.00 0.29 C ATOM 1374 C PHE A 89 -6.577 -1.738 -4.027 1.00 0.31 C ATOM 1375 O PHE A 89 -6.550 -2.558 -4.979 1.00 0.32 O ATOM 1376 CB PHE A 89 -5.168 0.264 -4.600 1.00 0.30 C ATOM 1377 CG PHE A 89 -4.446 1.484 -4.030 1.00 0.28 C ATOM 1378 CD1 PHE A 89 -5.028 2.306 -3.052 1.00 0.36 C ATOM 1379 CD2 PHE A 89 -3.158 1.796 -4.467 1.00 0.25 C ATOM 1380 CE1 PHE A 89 -4.333 3.391 -2.537 1.00 0.40 C ATOM 1381 CE2 PHE A 89 -2.472 2.882 -3.954 1.00 0.26 C ATOM 1382 CZ PHE A 89 -3.190 3.756 -2.989 1.00 0.31 C ATOM 0 H PHE A 89 -3.828 -2.006 -4.614 1.00 0.27 H new ATOM 0 HA PHE A 89 -5.437 -0.546 -2.611 1.00 0.29 H new ATOM 0 HB2 PHE A 89 -4.627 -0.079 -5.482 1.00 0.30 H new ATOM 0 HB3 PHE A 89 -6.159 0.571 -4.933 1.00 0.30 H new ATOM 0 HD1 PHE A 89 -6.025 2.092 -2.697 1.00 0.36 H new ATOM 0 HD2 PHE A 89 -2.689 1.179 -5.219 1.00 0.25 H new ATOM 0 HE1 PHE A 89 -4.772 3.950 -1.724 1.00 0.40 H new ATOM 0 HE2 PHE A 89 -1.452 3.088 -4.244 1.00 0.26 H new ATOM 0 HZ PHE A 89 -2.752 4.691 -2.671 1.00 0.31 H new ATOM 1392 N ALA A 90 -7.670 -1.516 -3.262 1.00 0.33 N ATOM 1393 CA ALA A 90 -8.977 -2.202 -3.481 1.00 0.36 C ATOM 1394 C ALA A 90 -10.155 -1.169 -3.498 1.00 0.39 C ATOM 1395 O ALA A 90 -10.080 -0.081 -2.856 1.00 0.37 O ATOM 1396 CB ALA A 90 -9.251 -3.290 -2.393 1.00 0.41 C ATOM 0 H ALA A 90 -7.678 -0.862 -2.479 1.00 0.33 H new ATOM 0 HA ALA A 90 -8.917 -2.695 -4.451 1.00 0.36 H new ATOM 0 HB1 ALA A 90 -10.212 -3.766 -2.588 1.00 0.41 H new ATOM 0 HB2 ALA A 90 -8.462 -4.041 -2.423 1.00 0.41 H new ATOM 0 HB3 ALA A 90 -9.271 -2.823 -1.408 1.00 0.41 H new ATOM 1402 N GLU A 91 -11.236 -1.527 -4.243 1.00 0.46 N ATOM 1403 CA GLU A 91 -12.459 -0.708 -4.362 1.00 0.53 C ATOM 1404 C GLU A 91 -13.706 -1.524 -3.948 1.00 0.63 C ATOM 1405 O GLU A 91 -13.973 -2.598 -4.504 1.00 1.23 O ATOM 1406 CB GLU A 91 -12.628 -0.173 -5.811 1.00 0.78 C ATOM 1407 CG GLU A 91 -12.583 -1.250 -6.911 1.00 1.80 C ATOM 1408 CD GLU A 91 -12.767 -0.672 -8.301 1.00 2.04 C ATOM 1409 OE1 GLU A 91 -13.692 0.145 -8.488 1.00 1.94 O ATOM 1410 OE2 GLU A 91 -11.989 -1.043 -9.204 1.00 2.61 O ATOM 0 H GLU A 91 -11.277 -2.395 -4.777 1.00 0.46 H new ATOM 0 HA GLU A 91 -12.359 0.143 -3.688 1.00 0.53 H new ATOM 0 HB2 GLU A 91 -13.579 0.355 -5.879 1.00 0.78 H new ATOM 0 HB3 GLU A 91 -11.843 0.558 -6.006 1.00 0.78 H new ATOM 0 HG2 GLU A 91 -11.628 -1.774 -6.863 1.00 1.80 H new ATOM 0 HG3 GLU A 91 -13.362 -1.989 -6.723 1.00 1.80 H new ATOM 1417 N VAL A 92 -14.468 -1.006 -2.970 1.00 0.60 N ATOM 1418 CA VAL A 92 -15.679 -1.707 -2.475 1.00 0.76 C ATOM 1419 C VAL A 92 -16.906 -0.714 -2.233 1.00 0.66 C ATOM 1420 O VAL A 92 -17.653 -0.849 -1.257 1.00 1.19 O ATOM 1421 CB VAL A 92 -15.269 -2.687 -1.236 1.00 1.42 C ATOM 1422 CG1 VAL A 92 -14.990 -1.999 0.141 1.00 2.13 C ATOM 1423 CG2 VAL A 92 -16.253 -3.870 -1.050 1.00 2.00 C ATOM 0 H VAL A 92 -14.276 -0.117 -2.508 1.00 0.60 H new ATOM 0 HA VAL A 92 -16.078 -2.366 -3.246 1.00 0.76 H new ATOM 0 HB VAL A 92 -14.301 -3.066 -1.566 1.00 1.42 H new ATOM 0 HG11 VAL A 92 -14.728 -2.756 0.880 1.00 2.13 H new ATOM 0 HG12 VAL A 92 -14.165 -1.295 0.035 1.00 2.13 H new ATOM 0 HG13 VAL A 92 -15.882 -1.466 0.469 1.00 2.13 H new ATOM 0 HG21 VAL A 92 -15.927 -4.486 -0.211 1.00 2.00 H new ATOM 0 HG22 VAL A 92 -17.253 -3.484 -0.850 1.00 2.00 H new ATOM 0 HG23 VAL A 92 -16.272 -4.474 -1.957 1.00 2.00 H new ATOM 1433 N TYR A 93 -17.107 0.253 -3.158 1.00 0.76 N ATOM 1434 CA TYR A 93 -18.218 1.230 -3.056 1.00 0.80 C ATOM 1435 C TYR A 93 -18.525 1.930 -4.402 1.00 0.86 C ATOM 1436 O TYR A 93 -19.698 2.091 -4.751 1.00 1.46 O ATOM 1437 CB TYR A 93 -17.924 2.297 -1.977 1.00 1.23 C ATOM 1438 CG TYR A 93 -19.132 2.652 -1.092 1.00 0.97 C ATOM 1439 CD1 TYR A 93 -20.036 3.653 -1.464 1.00 1.01 C ATOM 1440 CD2 TYR A 93 -19.375 1.975 0.111 1.00 1.14 C ATOM 1441 CE1 TYR A 93 -21.128 3.967 -0.670 1.00 1.43 C ATOM 1442 CE2 TYR A 93 -20.469 2.289 0.901 1.00 1.47 C ATOM 1443 CZ TYR A 93 -21.337 3.281 0.507 1.00 1.67 C ATOM 1444 OH TYR A 93 -22.424 3.590 1.293 1.00 2.27 O ATOM 0 H TYR A 93 -16.517 0.378 -3.981 1.00 0.76 H new ATOM 0 HA TYR A 93 -19.099 0.655 -2.770 1.00 0.80 H new ATOM 0 HB2 TYR A 93 -17.115 1.940 -1.340 1.00 1.23 H new ATOM 0 HB3 TYR A 93 -17.568 3.204 -2.467 1.00 1.23 H new ATOM 0 HD1 TYR A 93 -19.880 4.191 -2.387 1.00 1.01 H new ATOM 0 HD2 TYR A 93 -18.698 1.195 0.427 1.00 1.14 H new ATOM 0 HE1 TYR A 93 -21.812 4.746 -0.972 1.00 1.43 H new ATOM 0 HE2 TYR A 93 -20.640 1.756 1.825 1.00 1.47 H new ATOM 0 HH TYR A 93 -22.428 3.015 2.087 1.00 2.27 H new ATOM 1454 N PHE A 94 -17.476 2.344 -5.156 1.00 0.78 N ATOM 1455 CA PHE A 94 -17.653 3.043 -6.448 1.00 0.82 C ATOM 1456 C PHE A 94 -17.110 2.222 -7.634 1.00 0.76 C ATOM 1457 O PHE A 94 -15.915 1.908 -7.695 1.00 0.79 O ATOM 1458 CB PHE A 94 -16.942 4.413 -6.434 1.00 1.01 C ATOM 1459 CG PHE A 94 -17.252 5.285 -5.218 1.00 1.11 C ATOM 1460 CD1 PHE A 94 -18.511 5.871 -5.046 1.00 1.31 C ATOM 1461 CD2 PHE A 94 -16.280 5.515 -4.246 1.00 1.13 C ATOM 1462 CE1 PHE A 94 -18.784 6.656 -3.939 1.00 1.46 C ATOM 1463 CE2 PHE A 94 -16.554 6.302 -3.139 1.00 1.23 C ATOM 1464 CZ PHE A 94 -17.836 6.889 -3.006 1.00 1.37 C ATOM 0 H PHE A 94 -16.501 2.205 -4.890 1.00 0.78 H new ATOM 0 HA PHE A 94 -18.727 3.178 -6.578 1.00 0.82 H new ATOM 0 HB2 PHE A 94 -15.866 4.248 -6.480 1.00 1.01 H new ATOM 0 HB3 PHE A 94 -17.220 4.960 -7.335 1.00 1.01 H new ATOM 0 HD1 PHE A 94 -19.280 5.709 -5.787 1.00 1.31 H new ATOM 0 HD2 PHE A 94 -15.300 5.074 -4.357 1.00 1.13 H new ATOM 0 HE1 PHE A 94 -19.767 7.087 -3.820 1.00 1.46 H new ATOM 0 HE2 PHE A 94 -15.798 6.466 -2.385 1.00 1.23 H new ATOM 0 HZ PHE A 94 -18.055 7.522 -2.159 1.00 1.37 H new ATOM 1474 N ALA A 95 -18.016 1.884 -8.587 1.00 0.73 N ATOM 1475 CA ALA A 95 -17.656 1.109 -9.800 1.00 0.73 C ATOM 1476 C ALA A 95 -17.820 1.976 -11.093 1.00 0.72 C ATOM 1477 O ALA A 95 -18.879 2.011 -11.752 1.00 0.84 O ATOM 1478 CB ALA A 95 -18.467 -0.220 -9.859 1.00 0.82 C ATOM 0 H ALA A 95 -19.003 2.137 -8.537 1.00 0.73 H new ATOM 0 HA ALA A 95 -16.602 0.838 -9.744 1.00 0.73 H new ATOM 0 HB1 ALA A 95 -18.190 -0.776 -10.755 1.00 0.82 H new ATOM 0 HB2 ALA A 95 -18.246 -0.821 -8.977 1.00 0.82 H new ATOM 0 HB3 ALA A 95 -19.533 0.005 -9.887 1.00 0.82 H new ATOM 1484 N GLN A 96 -16.747 2.728 -11.412 1.00 0.65 N ATOM 1485 CA GLN A 96 -16.700 3.611 -12.603 1.00 0.66 C ATOM 1486 C GLN A 96 -15.249 3.931 -13.031 1.00 0.58 C ATOM 1487 O GLN A 96 -14.300 3.813 -12.243 1.00 0.53 O ATOM 1488 CB GLN A 96 -17.460 4.936 -12.347 1.00 0.72 C ATOM 1489 CG GLN A 96 -18.921 4.948 -12.825 1.00 1.40 C ATOM 1490 CD GLN A 96 -19.625 6.255 -12.521 1.00 1.85 C ATOM 1491 OE1 GLN A 96 -19.621 7.178 -13.335 1.00 2.38 O ATOM 1492 NE2 GLN A 96 -20.235 6.341 -11.344 1.00 2.45 N ATOM 0 H GLN A 96 -15.891 2.743 -10.857 1.00 0.65 H new ATOM 0 HA GLN A 96 -17.186 3.065 -13.411 1.00 0.66 H new ATOM 0 HB2 GLN A 96 -17.441 5.148 -11.278 1.00 0.72 H new ATOM 0 HB3 GLN A 96 -16.925 5.746 -12.842 1.00 0.72 H new ATOM 0 HG2 GLN A 96 -18.949 4.766 -13.899 1.00 1.40 H new ATOM 0 HG3 GLN A 96 -19.461 4.130 -12.349 1.00 1.40 H new ATOM 0 HE21 GLN A 96 -20.213 5.551 -10.699 1.00 2.45 H new ATOM 0 HE22 GLN A 96 -20.725 7.197 -11.085 1.00 2.45 H new ATOM 1501 N SER A 97 -15.098 4.367 -14.298 1.00 0.64 N ATOM 1502 CA SER A 97 -13.780 4.704 -14.872 1.00 0.62 C ATOM 1503 C SER A 97 -13.707 6.160 -15.376 1.00 0.81 C ATOM 1504 O SER A 97 -14.532 6.595 -16.189 1.00 1.66 O ATOM 1505 CB SER A 97 -13.453 3.748 -16.026 1.00 0.68 C ATOM 1506 OG SER A 97 -13.108 2.456 -15.554 1.00 0.73 O ATOM 0 H SER A 97 -15.876 4.494 -14.945 1.00 0.64 H new ATOM 0 HA SER A 97 -13.047 4.597 -14.072 1.00 0.62 H new ATOM 0 HB2 SER A 97 -14.312 3.675 -16.693 1.00 0.68 H new ATOM 0 HB3 SER A 97 -12.628 4.154 -16.612 1.00 0.68 H new ATOM 0 HG SER A 97 -12.907 1.872 -16.315 1.00 0.73 H new ATOM 1512 N GLN A 98 -12.682 6.904 -14.866 1.00 0.55 N ATOM 1513 CA GLN A 98 -12.393 8.352 -15.188 1.00 0.54 C ATOM 1514 C GLN A 98 -13.387 9.340 -14.505 1.00 0.56 C ATOM 1515 O GLN A 98 -14.057 10.147 -15.161 1.00 0.67 O ATOM 1516 CB GLN A 98 -12.323 8.621 -16.718 1.00 0.62 C ATOM 1517 CG GLN A 98 -11.243 7.821 -17.463 1.00 1.06 C ATOM 1518 CD GLN A 98 -10.922 8.411 -18.820 1.00 1.14 C ATOM 1519 OE1 GLN A 98 -11.535 8.054 -19.827 1.00 1.89 O ATOM 1520 NE2 GLN A 98 -9.955 9.322 -18.853 1.00 1.60 N ATOM 0 H GLN A 98 -12.013 6.513 -14.203 1.00 0.55 H new ATOM 0 HA GLN A 98 -11.405 8.543 -14.769 1.00 0.54 H new ATOM 0 HB2 GLN A 98 -13.294 8.392 -17.158 1.00 0.62 H new ATOM 0 HB3 GLN A 98 -12.143 9.684 -16.878 1.00 0.62 H new ATOM 0 HG2 GLN A 98 -10.336 7.790 -16.859 1.00 1.06 H new ATOM 0 HG3 GLN A 98 -11.578 6.791 -17.587 1.00 1.06 H new ATOM 0 HE21 GLN A 98 -9.474 9.587 -17.993 1.00 1.60 H new ATOM 0 HE22 GLN A 98 -9.694 9.756 -19.738 1.00 1.60 H new ATOM 1529 N GLN A 99 -13.451 9.237 -13.172 1.00 0.53 N ATOM 1530 CA GLN A 99 -14.322 10.062 -12.310 1.00 0.58 C ATOM 1531 C GLN A 99 -13.755 10.080 -10.876 1.00 0.57 C ATOM 1532 O GLN A 99 -13.740 11.126 -10.224 1.00 0.62 O ATOM 1533 CB GLN A 99 -15.776 9.528 -12.308 1.00 0.61 C ATOM 1534 CG GLN A 99 -16.831 10.536 -11.816 1.00 1.18 C ATOM 1535 CD GLN A 99 -18.228 9.947 -11.782 1.00 1.71 C ATOM 1536 OE1 GLN A 99 -18.654 9.389 -10.771 1.00 2.56 O ATOM 1537 NE2 GLN A 99 -18.949 10.067 -12.892 1.00 2.02 N ATOM 0 H GLN A 99 -12.890 8.566 -12.647 1.00 0.53 H new ATOM 0 HA GLN A 99 -14.343 11.077 -12.706 1.00 0.58 H new ATOM 0 HB2 GLN A 99 -16.035 9.216 -13.320 1.00 0.61 H new ATOM 0 HB3 GLN A 99 -15.821 8.639 -11.679 1.00 0.61 H new ATOM 0 HG2 GLN A 99 -16.561 10.880 -10.818 1.00 1.18 H new ATOM 0 HG3 GLN A 99 -16.825 11.410 -12.467 1.00 1.18 H new ATOM 0 HE21 GLN A 99 -18.556 10.538 -13.707 1.00 2.02 H new ATOM 0 HE22 GLN A 99 -19.896 9.689 -12.929 1.00 2.02 H new ATOM 1546 N LYS A 100 -13.288 8.894 -10.398 1.00 0.53 N ATOM 1547 CA LYS A 100 -12.661 8.749 -9.073 1.00 0.55 C ATOM 1548 C LYS A 100 -11.138 8.578 -9.258 1.00 0.48 C ATOM 1549 O LYS A 100 -10.604 7.462 -9.269 1.00 0.49 O ATOM 1550 CB LYS A 100 -13.267 7.552 -8.307 1.00 0.64 C ATOM 1551 CG LYS A 100 -14.575 7.857 -7.526 1.00 1.11 C ATOM 1552 CD LYS A 100 -15.746 8.269 -8.448 1.00 1.52 C ATOM 1553 CE LYS A 100 -17.029 8.576 -7.656 1.00 2.14 C ATOM 1554 NZ LYS A 100 -16.823 9.677 -6.674 1.00 2.76 N ATOM 0 H LYS A 100 -13.339 8.022 -10.924 1.00 0.53 H new ATOM 0 HA LYS A 100 -12.852 9.642 -8.479 1.00 0.55 H new ATOM 0 HB2 LYS A 100 -13.466 6.750 -9.018 1.00 0.64 H new ATOM 0 HB3 LYS A 100 -12.523 7.177 -7.604 1.00 0.64 H new ATOM 0 HG2 LYS A 100 -14.864 6.976 -6.953 1.00 1.11 H new ATOM 0 HG3 LYS A 100 -14.386 8.656 -6.809 1.00 1.11 H new ATOM 0 HD2 LYS A 100 -15.459 9.147 -9.026 1.00 1.52 H new ATOM 0 HD3 LYS A 100 -15.944 7.469 -9.161 1.00 1.52 H new ATOM 0 HE2 LYS A 100 -17.826 8.850 -8.347 1.00 2.14 H new ATOM 0 HE3 LYS A 100 -17.356 7.678 -7.132 1.00 2.14 H new ATOM 0 HZ1 LYS A 100 -17.743 9.981 -6.295 1.00 2.76 H new ATOM 0 HZ2 LYS A 100 -16.222 9.340 -5.895 1.00 2.76 H new ATOM 0 HZ3 LYS A 100 -16.360 10.480 -7.145 1.00 2.76 H new ATOM 1568 N VAL A 101 -10.464 9.732 -9.413 1.00 0.45 N ATOM 1569 CA VAL A 101 -8.997 9.807 -9.667 1.00 0.40 C ATOM 1570 C VAL A 101 -8.227 10.373 -8.437 1.00 0.41 C ATOM 1571 O VAL A 101 -8.488 11.486 -7.969 1.00 0.47 O ATOM 1572 CB VAL A 101 -8.603 10.593 -11.015 1.00 0.38 C ATOM 1573 CG1 VAL A 101 -8.524 9.632 -12.220 1.00 0.69 C ATOM 1574 CG2 VAL A 101 -9.537 11.775 -11.410 1.00 0.68 C ATOM 0 H VAL A 101 -10.914 10.646 -9.367 1.00 0.45 H new ATOM 0 HA VAL A 101 -8.682 8.776 -9.825 1.00 0.40 H new ATOM 0 HB VAL A 101 -7.631 11.024 -10.774 1.00 0.38 H new ATOM 0 HG11 VAL A 101 -8.256 10.193 -13.116 1.00 0.69 H new ATOM 0 HG12 VAL A 101 -7.768 8.870 -12.029 1.00 0.69 H new ATOM 0 HG13 VAL A 101 -9.492 9.153 -12.368 1.00 0.69 H new ATOM 0 HG21 VAL A 101 -9.177 12.231 -12.332 1.00 0.68 H new ATOM 0 HG22 VAL A 101 -10.551 11.403 -11.561 1.00 0.68 H new ATOM 0 HG23 VAL A 101 -9.538 12.519 -10.614 1.00 0.68 H new ATOM 1584 N PHE A 102 -7.269 9.563 -7.949 1.00 0.39 N ATOM 1585 CA PHE A 102 -6.459 9.867 -6.734 1.00 0.40 C ATOM 1586 C PHE A 102 -4.991 10.256 -7.012 1.00 0.38 C ATOM 1587 O PHE A 102 -4.470 10.004 -8.081 1.00 0.41 O ATOM 1588 CB PHE A 102 -6.396 8.594 -5.887 1.00 0.42 C ATOM 1589 CG PHE A 102 -7.720 7.961 -5.416 1.00 0.49 C ATOM 1590 CD1 PHE A 102 -8.950 8.639 -5.445 1.00 0.60 C ATOM 1591 CD2 PHE A 102 -7.717 6.647 -4.937 1.00 0.60 C ATOM 1592 CE1 PHE A 102 -10.115 8.020 -5.017 1.00 0.67 C ATOM 1593 CE2 PHE A 102 -8.882 6.037 -4.507 1.00 0.70 C ATOM 1594 CZ PHE A 102 -10.081 6.723 -4.548 1.00 0.69 C ATOM 0 H PHE A 102 -7.027 8.672 -8.382 1.00 0.39 H new ATOM 0 HA PHE A 102 -6.946 10.717 -6.256 1.00 0.40 H new ATOM 0 HB2 PHE A 102 -5.853 7.841 -6.459 1.00 0.42 H new ATOM 0 HB3 PHE A 102 -5.799 8.813 -5.002 1.00 0.42 H new ATOM 0 HD1 PHE A 102 -8.989 9.656 -5.806 1.00 0.60 H new ATOM 0 HD2 PHE A 102 -6.788 6.098 -4.902 1.00 0.60 H new ATOM 0 HE1 PHE A 102 -11.052 8.555 -5.051 1.00 0.67 H new ATOM 0 HE2 PHE A 102 -8.854 5.022 -4.138 1.00 0.70 H new ATOM 0 HZ PHE A 102 -10.990 6.245 -4.214 1.00 0.69 H new ATOM 1604 N ASP A 103 -4.309 10.854 -6.007 1.00 0.36 N ATOM 1605 CA ASP A 103 -2.869 11.208 -6.153 1.00 0.34 C ATOM 1606 C ASP A 103 -2.009 10.493 -5.086 1.00 0.32 C ATOM 1607 O ASP A 103 -2.361 10.445 -3.902 1.00 0.34 O ATOM 1608 CB ASP A 103 -2.605 12.725 -6.101 1.00 0.37 C ATOM 1609 CG ASP A 103 -3.076 13.502 -7.331 1.00 0.85 C ATOM 1610 OD1 ASP A 103 -3.687 12.890 -8.232 1.00 1.30 O ATOM 1611 OD2 ASP A 103 -2.830 14.726 -7.386 1.00 1.33 O ATOM 0 H ASP A 103 -4.717 11.099 -5.105 1.00 0.36 H new ATOM 0 HA ASP A 103 -2.581 10.864 -7.146 1.00 0.34 H new ATOM 0 HB2 ASP A 103 -3.098 13.135 -5.219 1.00 0.37 H new ATOM 0 HB3 ASP A 103 -1.535 12.889 -5.973 1.00 0.37 H new ATOM 1616 N VAL A 104 -0.853 9.959 -5.536 1.00 0.29 N ATOM 1617 CA VAL A 104 0.081 9.160 -4.679 1.00 0.28 C ATOM 1618 C VAL A 104 1.537 9.775 -4.754 1.00 0.26 C ATOM 1619 O VAL A 104 2.109 9.894 -5.854 1.00 0.25 O ATOM 1620 CB VAL A 104 0.053 7.600 -5.123 1.00 0.33 C ATOM 1621 CG1 VAL A 104 0.962 6.669 -4.266 1.00 0.31 C ATOM 1622 CG2 VAL A 104 -1.352 6.958 -5.074 1.00 0.48 C ATOM 0 H VAL A 104 -0.532 10.063 -6.499 1.00 0.29 H new ATOM 0 HA VAL A 104 -0.244 9.206 -3.640 1.00 0.28 H new ATOM 0 HB VAL A 104 0.422 7.661 -6.147 1.00 0.33 H new ATOM 0 HG11 VAL A 104 0.882 5.645 -4.632 1.00 0.31 H new ATOM 0 HG12 VAL A 104 1.997 7.002 -4.341 1.00 0.31 H new ATOM 0 HG13 VAL A 104 0.643 6.708 -3.224 1.00 0.31 H new ATOM 0 HG21 VAL A 104 -1.287 5.915 -5.385 1.00 0.48 H new ATOM 0 HG22 VAL A 104 -1.740 7.010 -4.057 1.00 0.48 H new ATOM 0 HG23 VAL A 104 -2.021 7.496 -5.746 1.00 0.48 H new ATOM 1632 N ARG A 105 2.132 10.064 -3.554 1.00 0.26 N ATOM 1633 CA ARG A 105 3.488 10.690 -3.442 1.00 0.26 C ATOM 1634 C ARG A 105 4.500 9.938 -2.530 1.00 0.23 C ATOM 1635 O ARG A 105 4.111 9.328 -1.527 1.00 0.26 O ATOM 1636 CB ARG A 105 3.366 12.113 -2.851 1.00 0.33 C ATOM 1637 CG ARG A 105 2.324 13.027 -3.517 1.00 0.53 C ATOM 1638 CD ARG A 105 2.468 14.491 -3.072 1.00 0.51 C ATOM 1639 NE ARG A 105 1.323 15.290 -3.489 1.00 0.92 N ATOM 1640 CZ ARG A 105 1.365 16.607 -3.701 1.00 1.25 C ATOM 1641 NH1 ARG A 105 2.482 17.290 -3.488 1.00 1.15 N ATOM 1642 NH2 ARG A 105 0.280 17.245 -4.120 1.00 1.69 N ATOM 0 H ARG A 105 1.693 9.873 -2.653 1.00 0.26 H new ATOM 0 HA ARG A 105 3.869 10.668 -4.463 1.00 0.26 H new ATOM 0 HB2 ARG A 105 3.122 12.027 -1.792 1.00 0.33 H new ATOM 0 HB3 ARG A 105 4.340 12.597 -2.915 1.00 0.33 H new ATOM 0 HG2 ARG A 105 2.429 12.966 -4.600 1.00 0.53 H new ATOM 0 HG3 ARG A 105 1.323 12.672 -3.273 1.00 0.53 H new ATOM 0 HD2 ARG A 105 2.568 14.535 -1.987 1.00 0.51 H new ATOM 0 HD3 ARG A 105 3.380 14.913 -3.494 1.00 0.51 H new ATOM 0 HE ARG A 105 0.433 14.812 -3.628 1.00 0.92 H new ATOM 0 HH11 ARG A 105 3.319 16.809 -3.159 1.00 1.15 H new ATOM 0 HH12 ARG A 105 2.504 18.296 -3.653 1.00 1.15 H new ATOM 0 HH21 ARG A 105 -0.585 16.729 -4.280 1.00 1.69 H new ATOM 0 HH22 ARG A 105 0.311 18.252 -4.282 1.00 1.69 H new ATOM 1656 N VAL A 106 5.825 10.037 -2.883 1.00 0.23 N ATOM 1657 CA VAL A 106 6.943 9.433 -2.063 1.00 0.23 C ATOM 1658 C VAL A 106 8.091 10.455 -1.756 1.00 0.22 C ATOM 1659 O VAL A 106 8.804 10.895 -2.662 1.00 0.23 O ATOM 1660 CB VAL A 106 7.582 8.056 -2.594 1.00 0.29 C ATOM 1661 CG1 VAL A 106 6.700 6.839 -2.258 1.00 0.57 C ATOM 1662 CG2 VAL A 106 7.932 8.020 -4.103 1.00 0.60 C ATOM 0 H VAL A 106 6.146 10.523 -3.720 1.00 0.23 H new ATOM 0 HA VAL A 106 6.414 9.169 -1.147 1.00 0.23 H new ATOM 0 HB VAL A 106 8.527 8.002 -2.054 1.00 0.29 H new ATOM 0 HG11 VAL A 106 7.172 5.932 -2.636 1.00 0.57 H new ATOM 0 HG12 VAL A 106 6.582 6.763 -1.177 1.00 0.57 H new ATOM 0 HG13 VAL A 106 5.721 6.960 -2.723 1.00 0.57 H new ATOM 0 HG21 VAL A 106 8.356 7.048 -4.355 1.00 0.60 H new ATOM 0 HG22 VAL A 106 7.029 8.185 -4.690 1.00 0.60 H new ATOM 0 HG23 VAL A 106 8.658 8.801 -4.327 1.00 0.60 H new ATOM 1672 N ASN A 107 8.251 10.815 -0.435 1.00 0.23 N ATOM 1673 CA ASN A 107 9.273 11.807 0.114 1.00 0.23 C ATOM 1674 C ASN A 107 9.088 13.267 -0.404 1.00 0.24 C ATOM 1675 O ASN A 107 10.037 14.062 -0.424 1.00 0.25 O ATOM 1676 CB ASN A 107 10.709 11.360 -0.210 1.00 0.23 C ATOM 1677 CG ASN A 107 11.610 11.233 1.003 1.00 0.27 C ATOM 1678 OD1 ASN A 107 11.699 12.143 1.824 1.00 1.05 O ATOM 1679 ND2 ASN A 107 12.286 10.107 1.098 1.00 1.12 N ATOM 0 H ASN A 107 7.665 10.420 0.300 1.00 0.23 H new ATOM 0 HA ASN A 107 9.100 11.813 1.190 1.00 0.23 H new ATOM 0 HB2 ASN A 107 10.671 10.399 -0.723 1.00 0.23 H new ATOM 0 HB3 ASN A 107 11.152 12.074 -0.904 1.00 0.23 H new ATOM 0 HD21 ASN A 107 12.921 9.958 1.882 1.00 1.12 H new ATOM 0 HD22 ASN A 107 12.174 9.384 0.388 1.00 1.12 H new ATOM 1686 N GLY A 108 7.853 13.595 -0.797 1.00 0.25 N ATOM 1687 CA GLY A 108 7.549 14.900 -1.372 1.00 0.29 C ATOM 1688 C GLY A 108 7.347 14.870 -2.909 1.00 0.29 C ATOM 1689 O GLY A 108 6.785 15.805 -3.483 1.00 0.32 O ATOM 0 H GLY A 108 7.050 12.971 -0.725 1.00 0.25 H new ATOM 0 HA2 GLY A 108 6.647 15.293 -0.903 1.00 0.29 H new ATOM 0 HA3 GLY A 108 8.358 15.590 -1.134 1.00 0.29 H new ATOM 1693 N HIS A 109 7.823 13.768 -3.560 1.00 0.27 N ATOM 1694 CA HIS A 109 7.749 13.533 -5.011 1.00 0.28 C ATOM 1695 C HIS A 109 6.417 12.884 -5.479 1.00 0.30 C ATOM 1696 O HIS A 109 5.565 12.550 -4.663 1.00 0.57 O ATOM 1697 CB HIS A 109 8.884 12.564 -5.329 1.00 0.29 C ATOM 1698 CG HIS A 109 10.266 13.133 -5.170 1.00 0.31 C ATOM 1699 ND1 HIS A 109 10.886 13.901 -6.130 1.00 0.43 N ATOM 1700 CD2 HIS A 109 11.151 13.023 -4.147 1.00 0.27 C ATOM 1701 CE1 HIS A 109 12.092 14.238 -5.709 1.00 0.46 C ATOM 1702 NE2 HIS A 109 12.276 13.719 -4.510 1.00 0.36 N ATOM 0 H HIS A 109 8.280 13.004 -3.063 1.00 0.27 H new ATOM 0 HA HIS A 109 7.817 14.493 -5.523 1.00 0.28 H new ATOM 0 HB2 HIS A 109 8.789 11.692 -4.682 1.00 0.29 H new ATOM 0 HB3 HIS A 109 8.767 12.214 -6.355 1.00 0.29 H new ATOM 0 HD1 HIS A 109 10.478 14.168 -7.026 1.00 0.43 H new ATOM 0 HD2 HIS A 109 10.998 12.488 -3.221 1.00 0.27 H new ATOM 0 HE1 HIS A 109 12.806 14.837 -6.254 1.00 0.46 H new ATOM 1711 N THR A 110 6.243 12.715 -6.806 1.00 0.31 N ATOM 1712 CA THR A 110 5.026 12.050 -7.343 1.00 0.32 C ATOM 1713 C THR A 110 5.361 10.787 -8.135 1.00 0.35 C ATOM 1714 O THR A 110 6.320 10.739 -8.917 1.00 0.47 O ATOM 1715 CB THR A 110 4.068 12.933 -8.209 1.00 0.43 C ATOM 1716 OG1 THR A 110 4.779 13.926 -8.974 1.00 0.55 O ATOM 1717 CG2 THR A 110 2.993 13.608 -7.349 1.00 0.47 C ATOM 0 H THR A 110 6.910 13.020 -7.515 1.00 0.31 H new ATOM 0 HA THR A 110 4.480 11.812 -6.430 1.00 0.32 H new ATOM 0 HB THR A 110 3.582 12.254 -8.910 1.00 0.43 H new ATOM 0 HG1 THR A 110 4.141 14.452 -9.500 1.00 0.55 H new ATOM 0 HG21 THR A 110 2.346 14.213 -7.984 1.00 0.47 H new ATOM 0 HG22 THR A 110 2.398 12.846 -6.846 1.00 0.47 H new ATOM 0 HG23 THR A 110 3.470 14.246 -6.605 1.00 0.47 H new ATOM 1725 N VAL A 111 4.520 9.778 -7.926 1.00 0.29 N ATOM 1726 CA VAL A 111 4.685 8.458 -8.567 1.00 0.35 C ATOM 1727 C VAL A 111 3.421 8.001 -9.331 1.00 0.35 C ATOM 1728 O VAL A 111 3.500 7.730 -10.533 1.00 0.39 O ATOM 1729 CB VAL A 111 5.183 7.297 -7.585 1.00 0.38 C ATOM 1730 CG1 VAL A 111 6.720 7.236 -7.561 1.00 1.06 C ATOM 1731 CG2 VAL A 111 4.654 7.369 -6.114 1.00 1.00 C ATOM 0 H VAL A 111 3.707 9.842 -7.313 1.00 0.29 H new ATOM 0 HA VAL A 111 5.488 8.623 -9.286 1.00 0.35 H new ATOM 0 HB VAL A 111 4.750 6.391 -8.008 1.00 0.38 H new ATOM 0 HG11 VAL A 111 7.042 6.441 -6.888 1.00 1.06 H new ATOM 0 HG12 VAL A 111 7.092 7.034 -8.566 1.00 1.06 H new ATOM 0 HG13 VAL A 111 7.117 8.189 -7.212 1.00 1.06 H new ATOM 0 HG21 VAL A 111 5.056 6.533 -5.541 1.00 1.00 H new ATOM 0 HG22 VAL A 111 4.972 8.307 -5.659 1.00 1.00 H new ATOM 0 HG23 VAL A 111 3.565 7.317 -6.116 1.00 1.00 H new ATOM 1741 N VAL A 112 2.263 7.917 -8.635 1.00 0.33 N ATOM 1742 CA VAL A 112 1.009 7.483 -9.302 1.00 0.35 C ATOM 1743 C VAL A 112 -0.068 8.579 -9.131 1.00 0.34 C ATOM 1744 O VAL A 112 -0.856 8.566 -8.186 1.00 0.32 O ATOM 1745 CB VAL A 112 0.406 6.042 -8.857 1.00 0.37 C ATOM 1746 CG1 VAL A 112 -0.064 5.227 -10.087 1.00 0.44 C ATOM 1747 CG2 VAL A 112 1.363 5.130 -8.042 1.00 0.40 C ATOM 0 H VAL A 112 2.168 8.136 -7.643 1.00 0.33 H new ATOM 0 HA VAL A 112 1.289 7.340 -10.346 1.00 0.35 H new ATOM 0 HB VAL A 112 -0.420 6.315 -8.201 1.00 0.37 H new ATOM 0 HG11 VAL A 112 -0.463 4.268 -9.757 1.00 0.44 H new ATOM 0 HG12 VAL A 112 -0.841 5.780 -10.615 1.00 0.44 H new ATOM 0 HG13 VAL A 112 0.780 5.059 -10.756 1.00 0.44 H new ATOM 0 HG21 VAL A 112 0.857 4.196 -7.799 1.00 0.40 H new ATOM 0 HG22 VAL A 112 2.254 4.917 -8.633 1.00 0.40 H new ATOM 0 HG23 VAL A 112 1.651 5.636 -7.121 1.00 0.40 H new ATOM 1757 N LYS A 113 -0.079 9.514 -10.104 1.00 0.36 N ATOM 1758 CA LYS A 113 -1.033 10.619 -10.157 1.00 0.38 C ATOM 1759 C LYS A 113 -2.159 10.312 -11.159 1.00 0.43 C ATOM 1760 O LYS A 113 -1.937 10.113 -12.359 1.00 0.70 O ATOM 1761 CB LYS A 113 -0.310 11.918 -10.529 1.00 0.42 C ATOM 1762 CG LYS A 113 -1.177 13.185 -10.379 1.00 1.12 C ATOM 1763 CD LYS A 113 -0.644 14.389 -11.183 1.00 1.27 C ATOM 1764 CE LYS A 113 0.799 14.777 -10.819 1.00 1.50 C ATOM 1765 NZ LYS A 113 1.805 13.890 -11.473 1.00 2.30 N ATOM 0 H LYS A 113 0.585 9.515 -10.878 1.00 0.36 H new ATOM 0 HA LYS A 113 -1.484 10.743 -9.172 1.00 0.38 H new ATOM 0 HB2 LYS A 113 0.576 12.021 -9.903 1.00 0.42 H new ATOM 0 HB3 LYS A 113 0.035 11.847 -11.560 1.00 0.42 H new ATOM 0 HG2 LYS A 113 -2.193 12.962 -10.704 1.00 1.12 H new ATOM 0 HG3 LYS A 113 -1.232 13.457 -9.325 1.00 1.12 H new ATOM 0 HD2 LYS A 113 -0.692 14.156 -12.247 1.00 1.27 H new ATOM 0 HD3 LYS A 113 -1.296 15.246 -11.015 1.00 1.27 H new ATOM 0 HE2 LYS A 113 0.981 15.810 -11.116 1.00 1.50 H new ATOM 0 HE3 LYS A 113 0.924 14.729 -9.737 1.00 1.50 H new ATOM 0 HZ1 LYS A 113 2.598 14.464 -11.824 1.00 2.30 H new ATOM 0 HZ2 LYS A 113 2.158 13.197 -10.782 1.00 2.30 H new ATOM 0 HZ3 LYS A 113 1.361 13.389 -12.269 1.00 2.30 H new ATOM 1779 N ASP A 114 -3.370 10.286 -10.588 1.00 0.37 N ATOM 1780 CA ASP A 114 -4.672 9.964 -11.240 1.00 0.42 C ATOM 1781 C ASP A 114 -4.948 8.442 -11.193 1.00 0.38 C ATOM 1782 O ASP A 114 -5.035 7.779 -12.235 1.00 0.40 O ATOM 1783 CB ASP A 114 -4.836 10.512 -12.690 1.00 0.50 C ATOM 1784 CG ASP A 114 -5.204 11.994 -12.740 1.00 1.70 C ATOM 1785 OD1 ASP A 114 -4.292 12.836 -12.606 1.00 2.09 O ATOM 1786 OD2 ASP A 114 -6.401 12.305 -12.913 1.00 2.48 O ATOM 0 H ASP A 114 -3.488 10.501 -9.598 1.00 0.37 H new ATOM 0 HA ASP A 114 -5.422 10.493 -10.652 1.00 0.42 H new ATOM 0 HB2 ASP A 114 -3.906 10.358 -13.236 1.00 0.50 H new ATOM 0 HB3 ASP A 114 -5.606 9.936 -13.203 1.00 0.50 H new ATOM 1791 N LEU A 115 -5.074 7.893 -9.949 1.00 0.36 N ATOM 1792 CA LEU A 115 -5.339 6.461 -9.736 1.00 0.36 C ATOM 1793 C LEU A 115 -6.834 6.100 -9.795 1.00 0.38 C ATOM 1794 O LEU A 115 -7.615 6.408 -8.884 1.00 0.42 O ATOM 1795 CB LEU A 115 -4.777 5.955 -8.388 1.00 0.38 C ATOM 1796 CG LEU A 115 -3.854 4.677 -8.382 1.00 0.35 C ATOM 1797 CD1 LEU A 115 -3.651 4.186 -6.968 1.00 1.13 C ATOM 1798 CD2 LEU A 115 -4.368 3.492 -9.214 1.00 1.06 C ATOM 0 H LEU A 115 -4.994 8.432 -9.087 1.00 0.36 H new ATOM 0 HA LEU A 115 -4.826 5.968 -10.562 1.00 0.36 H new ATOM 0 HB2 LEU A 115 -4.213 6.772 -7.938 1.00 0.38 H new ATOM 0 HB3 LEU A 115 -5.624 5.754 -7.732 1.00 0.38 H new ATOM 0 HG LEU A 115 -2.926 5.014 -8.844 1.00 0.35 H new ATOM 0 HD11 LEU A 115 -3.012 3.303 -6.978 1.00 1.13 H new ATOM 0 HD12 LEU A 115 -3.179 4.969 -6.375 1.00 1.13 H new ATOM 0 HD13 LEU A 115 -4.616 3.931 -6.529 1.00 1.13 H new ATOM 0 HD21 LEU A 115 -3.662 2.665 -9.144 1.00 1.06 H new ATOM 0 HD22 LEU A 115 -5.339 3.174 -8.833 1.00 1.06 H new ATOM 0 HD23 LEU A 115 -4.469 3.796 -10.256 1.00 1.06 H new ATOM 1810 N ASP A 116 -7.194 5.480 -10.921 1.00 0.39 N ATOM 1811 CA ASP A 116 -8.541 4.942 -11.167 1.00 0.43 C ATOM 1812 C ASP A 116 -8.426 3.395 -11.192 1.00 0.42 C ATOM 1813 O ASP A 116 -8.034 2.797 -12.205 1.00 0.43 O ATOM 1814 CB ASP A 116 -9.239 5.524 -12.465 1.00 0.46 C ATOM 1815 CG ASP A 116 -8.343 5.767 -13.704 1.00 1.55 C ATOM 1816 OD1 ASP A 116 -7.407 4.970 -13.927 1.00 2.35 O ATOM 1817 OD2 ASP A 116 -8.590 6.751 -14.433 1.00 1.83 O ATOM 0 H ASP A 116 -6.552 5.334 -11.700 1.00 0.39 H new ATOM 0 HA ASP A 116 -9.203 5.260 -10.362 1.00 0.43 H new ATOM 0 HB2 ASP A 116 -10.037 4.840 -12.754 1.00 0.46 H new ATOM 0 HB3 ASP A 116 -9.711 6.470 -12.199 1.00 0.46 H new ATOM 1822 N ILE A 117 -8.783 2.765 -10.039 1.00 0.42 N ATOM 1823 CA ILE A 117 -8.675 1.281 -9.799 1.00 0.42 C ATOM 1824 C ILE A 117 -9.555 0.388 -10.769 1.00 0.44 C ATOM 1825 O ILE A 117 -9.129 -0.709 -11.146 1.00 0.44 O ATOM 1826 CB ILE A 117 -8.971 0.917 -8.268 1.00 0.43 C ATOM 1827 CG1 ILE A 117 -8.610 2.098 -7.305 1.00 0.55 C ATOM 1828 CG2 ILE A 117 -8.193 -0.355 -7.798 1.00 0.49 C ATOM 1829 CD1 ILE A 117 -9.787 2.760 -6.583 1.00 0.68 C ATOM 0 H ILE A 117 -9.159 3.270 -9.236 1.00 0.42 H new ATOM 0 HA ILE A 117 -7.640 1.034 -10.035 1.00 0.42 H new ATOM 0 HB ILE A 117 -10.042 0.720 -8.220 1.00 0.43 H new ATOM 0 HG12 ILE A 117 -7.911 1.728 -6.555 1.00 0.55 H new ATOM 0 HG13 ILE A 117 -8.086 2.862 -7.880 1.00 0.55 H new ATOM 0 HG21 ILE A 117 -8.428 -0.560 -6.753 1.00 0.49 H new ATOM 0 HG22 ILE A 117 -8.487 -1.208 -8.410 1.00 0.49 H new ATOM 0 HG23 ILE A 117 -7.121 -0.185 -7.903 1.00 0.49 H new ATOM 0 HD11 ILE A 117 -9.417 3.563 -5.945 1.00 0.68 H new ATOM 0 HD12 ILE A 117 -10.480 3.170 -7.317 1.00 0.68 H new ATOM 0 HD13 ILE A 117 -10.302 2.019 -5.972 1.00 0.68 H new ATOM 1841 N PHE A 118 -10.739 0.906 -11.209 1.00 0.48 N ATOM 1842 CA PHE A 118 -11.655 0.189 -12.148 1.00 0.51 C ATOM 1843 C PHE A 118 -11.135 0.189 -13.625 1.00 0.53 C ATOM 1844 O PHE A 118 -11.282 -0.810 -14.330 1.00 0.56 O ATOM 1845 CB PHE A 118 -13.059 0.821 -12.077 1.00 0.56 C ATOM 1846 CG PHE A 118 -14.194 -0.081 -12.567 1.00 0.62 C ATOM 1847 CD1 PHE A 118 -14.703 -1.088 -11.746 1.00 0.65 C ATOM 1848 CD2 PHE A 118 -14.751 0.078 -13.839 1.00 0.68 C ATOM 1849 CE1 PHE A 118 -15.734 -1.906 -12.178 1.00 0.72 C ATOM 1850 CE2 PHE A 118 -15.781 -0.741 -14.272 1.00 0.75 C ATOM 1851 CZ PHE A 118 -16.274 -1.732 -13.441 1.00 0.77 C ATOM 0 H PHE A 118 -11.083 1.824 -10.926 1.00 0.48 H new ATOM 0 HA PHE A 118 -11.695 -0.854 -11.833 1.00 0.51 H new ATOM 0 HB2 PHE A 118 -13.261 1.108 -11.045 1.00 0.56 H new ATOM 0 HB3 PHE A 118 -13.060 1.737 -12.668 1.00 0.56 H new ATOM 0 HD1 PHE A 118 -14.287 -1.232 -10.760 1.00 0.65 H new ATOM 0 HD2 PHE A 118 -14.373 0.850 -14.493 1.00 0.68 H new ATOM 0 HE1 PHE A 118 -16.117 -2.680 -11.529 1.00 0.72 H new ATOM 0 HE2 PHE A 118 -16.199 -0.606 -15.258 1.00 0.75 H new ATOM 0 HZ PHE A 118 -17.079 -2.369 -13.777 1.00 0.77 H new ATOM 1861 N ASP A 119 -10.515 1.327 -14.061 1.00 0.52 N ATOM 1862 CA ASP A 119 -9.901 1.488 -15.416 1.00 0.54 C ATOM 1863 C ASP A 119 -8.540 0.714 -15.584 1.00 0.53 C ATOM 1864 O ASP A 119 -8.179 0.348 -16.706 1.00 0.57 O ATOM 1865 CB ASP A 119 -9.689 2.990 -15.712 1.00 0.55 C ATOM 1866 CG ASP A 119 -10.016 3.404 -17.154 1.00 0.57 C ATOM 1867 OD1 ASP A 119 -10.053 2.515 -18.029 1.00 0.72 O ATOM 1868 OD2 ASP A 119 -10.248 4.607 -17.394 1.00 0.91 O ATOM 0 H ASP A 119 -10.427 2.161 -13.480 1.00 0.52 H new ATOM 0 HA ASP A 119 -10.597 1.049 -16.131 1.00 0.54 H new ATOM 0 HB2 ASP A 119 -10.308 3.573 -15.030 1.00 0.55 H new ATOM 0 HB3 ASP A 119 -8.651 3.247 -15.499 1.00 0.55 H new ATOM 1873 N ARG A 120 -7.799 0.483 -14.457 1.00 0.49 N ATOM 1874 CA ARG A 120 -6.502 -0.249 -14.470 1.00 0.48 C ATOM 1875 C ARG A 120 -6.670 -1.796 -14.496 1.00 0.50 C ATOM 1876 O ARG A 120 -6.164 -2.437 -15.421 1.00 0.54 O ATOM 1877 CB ARG A 120 -5.635 0.154 -13.261 1.00 0.46 C ATOM 1878 CG ARG A 120 -5.262 1.657 -13.179 1.00 0.45 C ATOM 1879 CD ARG A 120 -4.197 2.088 -14.207 1.00 0.52 C ATOM 1880 NE ARG A 120 -3.758 3.463 -13.979 1.00 1.23 N ATOM 1881 CZ ARG A 120 -2.873 4.095 -14.747 1.00 1.49 C ATOM 1882 NH1 ARG A 120 -2.336 3.481 -15.793 1.00 1.03 N ATOM 1883 NH2 ARG A 120 -2.525 5.344 -14.469 1.00 2.43 N ATOM 0 H ARG A 120 -8.083 0.796 -13.529 1.00 0.49 H new ATOM 0 HA ARG A 120 -6.005 0.039 -15.397 1.00 0.48 H new ATOM 0 HB2 ARG A 120 -6.164 -0.122 -12.349 1.00 0.46 H new ATOM 0 HB3 ARG A 120 -4.715 -0.430 -13.285 1.00 0.46 H new ATOM 0 HG2 ARG A 120 -6.161 2.254 -13.329 1.00 0.45 H new ATOM 0 HG3 ARG A 120 -4.896 1.877 -12.176 1.00 0.45 H new ATOM 0 HD2 ARG A 120 -3.340 1.417 -14.148 1.00 0.52 H new ATOM 0 HD3 ARG A 120 -4.604 1.997 -15.214 1.00 0.52 H new ATOM 0 HE ARG A 120 -4.153 3.968 -13.185 1.00 1.23 H new ATOM 0 HH11 ARG A 120 -2.601 2.521 -16.012 1.00 1.03 H new ATOM 0 HH12 ARG A 120 -1.658 3.969 -16.378 1.00 1.03 H new ATOM 0 HH21 ARG A 120 -2.935 5.821 -13.666 1.00 2.43 H new ATOM 0 HH22 ARG A 120 -1.847 5.828 -15.058 1.00 2.43 H new ATOM 1897 N VAL A 121 -7.373 -2.401 -13.491 1.00 0.48 N ATOM 1898 CA VAL A 121 -7.609 -3.894 -13.497 1.00 0.51 C ATOM 1899 C VAL A 121 -8.908 -4.336 -14.268 1.00 0.56 C ATOM 1900 O VAL A 121 -8.883 -5.362 -14.954 1.00 0.62 O ATOM 1901 CB VAL A 121 -7.553 -4.632 -12.072 1.00 0.53 C ATOM 1902 CG1 VAL A 121 -6.109 -5.037 -11.715 1.00 0.92 C ATOM 1903 CG2 VAL A 121 -8.159 -3.845 -10.873 1.00 0.93 C ATOM 0 H VAL A 121 -7.775 -1.908 -12.693 1.00 0.48 H new ATOM 0 HA VAL A 121 -6.734 -4.235 -14.051 1.00 0.51 H new ATOM 0 HB VAL A 121 -8.190 -5.505 -12.214 1.00 0.53 H new ATOM 0 HG11 VAL A 121 -6.100 -5.535 -10.745 1.00 0.92 H new ATOM 0 HG12 VAL A 121 -5.723 -5.716 -12.475 1.00 0.92 H new ATOM 0 HG13 VAL A 121 -5.482 -4.147 -11.672 1.00 0.92 H new ATOM 0 HG21 VAL A 121 -8.066 -4.439 -9.964 1.00 0.93 H new ATOM 0 HG22 VAL A 121 -7.624 -2.904 -10.748 1.00 0.93 H new ATOM 0 HG23 VAL A 121 -9.212 -3.641 -11.067 1.00 0.93 H new ATOM 1913 N GLY A 122 -10.022 -3.568 -14.149 1.00 0.57 N ATOM 1914 CA GLY A 122 -11.276 -3.918 -14.845 1.00 0.63 C ATOM 1915 C GLY A 122 -12.385 -4.436 -13.921 1.00 0.66 C ATOM 1916 O GLY A 122 -13.420 -3.787 -13.752 1.00 0.85 O ATOM 0 H GLY A 122 -10.073 -2.718 -13.587 1.00 0.57 H new ATOM 0 HA2 GLY A 122 -11.642 -3.039 -15.375 1.00 0.63 H new ATOM 0 HA3 GLY A 122 -11.061 -4.677 -15.597 1.00 0.63 H new ATOM 1920 N HIS A 123 -12.139 -5.621 -13.330 1.00 0.72 N ATOM 1921 CA HIS A 123 -13.075 -6.293 -12.400 1.00 0.87 C ATOM 1922 C HIS A 123 -12.584 -6.212 -10.931 1.00 0.73 C ATOM 1923 O HIS A 123 -11.471 -5.739 -10.655 1.00 1.34 O ATOM 1924 CB HIS A 123 -13.256 -7.767 -12.815 1.00 1.38 C ATOM 1925 CG HIS A 123 -13.985 -7.954 -14.115 1.00 1.76 C ATOM 1926 ND1 HIS A 123 -13.350 -8.298 -15.290 1.00 2.62 N ATOM 1927 CD2 HIS A 123 -15.302 -7.843 -14.423 1.00 2.27 C ATOM 1928 CE1 HIS A 123 -14.240 -8.387 -16.263 1.00 3.18 C ATOM 1929 NE2 HIS A 123 -15.431 -8.117 -15.761 1.00 3.01 N ATOM 0 H HIS A 123 -11.278 -6.146 -13.484 1.00 0.72 H new ATOM 0 HA HIS A 123 -14.032 -5.775 -12.457 1.00 0.87 H new ATOM 0 HB2 HIS A 123 -12.274 -8.235 -12.891 1.00 1.38 H new ATOM 0 HB3 HIS A 123 -13.799 -8.291 -12.028 1.00 1.38 H new ATOM 0 HD2 HIS A 123 -16.100 -7.587 -13.742 1.00 2.27 H new ATOM 0 HE1 HIS A 123 -14.029 -8.638 -17.292 1.00 3.18 H new ATOM 0 HE2 HIS A 123 -16.307 -8.113 -16.284 1.00 3.01 H new ATOM 1938 N SER A 124 -13.435 -6.673 -9.977 1.00 0.86 N ATOM 1939 CA SER A 124 -13.112 -6.644 -8.520 1.00 0.70 C ATOM 1940 C SER A 124 -12.203 -7.822 -8.058 1.00 0.99 C ATOM 1941 O SER A 124 -12.672 -8.857 -7.574 1.00 2.08 O ATOM 1942 CB SER A 124 -14.407 -6.623 -7.693 1.00 0.73 C ATOM 1943 OG SER A 124 -14.989 -5.328 -7.675 1.00 1.20 O ATOM 0 H SER A 124 -14.351 -7.070 -10.188 1.00 0.86 H new ATOM 0 HA SER A 124 -12.542 -5.731 -8.350 1.00 0.70 H new ATOM 0 HB2 SER A 124 -15.118 -7.337 -8.109 1.00 0.73 H new ATOM 0 HB3 SER A 124 -14.194 -6.942 -6.673 1.00 0.73 H new ATOM 0 HG SER A 124 -15.812 -5.346 -7.143 1.00 1.20 H new ATOM 1949 N THR A 125 -10.885 -7.610 -8.243 1.00 0.56 N ATOM 1950 CA THR A 125 -9.812 -8.575 -7.884 1.00 0.51 C ATOM 1951 C THR A 125 -8.709 -7.808 -7.083 1.00 0.48 C ATOM 1952 O THR A 125 -9.036 -7.086 -6.130 1.00 0.51 O ATOM 1953 CB THR A 125 -9.195 -9.313 -9.159 1.00 0.55 C ATOM 1954 OG1 THR A 125 -8.842 -8.370 -10.195 1.00 0.62 O ATOM 1955 CG2 THR A 125 -10.124 -10.391 -9.789 1.00 0.62 C ATOM 0 H THR A 125 -10.524 -6.749 -8.653 1.00 0.56 H new ATOM 0 HA THR A 125 -10.243 -9.365 -7.269 1.00 0.51 H new ATOM 0 HB THR A 125 -8.310 -9.818 -8.772 1.00 0.55 H new ATOM 0 HG1 THR A 125 -8.466 -8.851 -10.961 1.00 0.62 H new ATOM 0 HG21 THR A 125 -9.628 -10.842 -10.648 1.00 0.62 H new ATOM 0 HG22 THR A 125 -10.341 -11.162 -9.049 1.00 0.62 H new ATOM 0 HG23 THR A 125 -11.055 -9.925 -10.111 1.00 0.62 H new ATOM 1963 N ALA A 126 -7.403 -7.963 -7.443 1.00 0.46 N ATOM 1964 CA ALA A 126 -6.310 -7.243 -6.747 1.00 0.43 C ATOM 1965 C ALA A 126 -5.552 -6.209 -7.634 1.00 0.38 C ATOM 1966 O ALA A 126 -5.145 -6.517 -8.769 1.00 0.41 O ATOM 1967 CB ALA A 126 -5.290 -8.255 -6.155 1.00 0.46 C ATOM 0 H ALA A 126 -7.090 -8.571 -8.200 1.00 0.46 H new ATOM 0 HA ALA A 126 -6.798 -6.673 -5.956 1.00 0.43 H new ATOM 0 HB1 ALA A 126 -4.493 -7.713 -5.647 1.00 0.46 H new ATOM 0 HB2 ALA A 126 -5.796 -8.907 -5.443 1.00 0.46 H new ATOM 0 HB3 ALA A 126 -4.865 -8.856 -6.959 1.00 0.46 H new ATOM 1973 N HIS A 127 -5.386 -4.950 -7.117 1.00 0.34 N ATOM 1974 CA HIS A 127 -4.579 -3.925 -7.816 1.00 0.32 C ATOM 1975 C HIS A 127 -3.254 -3.725 -7.043 1.00 0.31 C ATOM 1976 O HIS A 127 -3.262 -3.516 -5.829 1.00 0.35 O ATOM 1977 CB HIS A 127 -5.309 -2.572 -7.965 1.00 0.32 C ATOM 1978 CG HIS A 127 -4.642 -1.645 -8.960 1.00 0.33 C ATOM 1979 ND1 HIS A 127 -4.064 -2.096 -10.133 1.00 0.35 N ATOM 1980 CD2 HIS A 127 -4.402 -0.312 -8.921 1.00 0.36 C ATOM 1981 CE1 HIS A 127 -3.493 -1.086 -10.758 1.00 0.38 C ATOM 1982 NE2 HIS A 127 -3.686 0.006 -10.047 1.00 0.38 N ATOM 0 H HIS A 127 -5.795 -4.637 -6.237 1.00 0.34 H new ATOM 0 HA HIS A 127 -4.393 -4.286 -8.827 1.00 0.32 H new ATOM 0 HB2 HIS A 127 -6.337 -2.753 -8.278 1.00 0.32 H new ATOM 0 HB3 HIS A 127 -5.354 -2.081 -6.993 1.00 0.32 H new ATOM 0 HD2 HIS A 127 -4.716 0.373 -8.147 1.00 0.36 H new ATOM 0 HE1 HIS A 127 -2.958 -1.144 -11.694 1.00 0.38 H new ATOM 0 HE2 HIS A 127 -3.356 0.939 -10.294 1.00 0.38 H new ATOM 1991 N ASP A 128 -2.124 -3.784 -7.755 1.00 0.32 N ATOM 1992 CA ASP A 128 -0.801 -3.662 -7.114 1.00 0.33 C ATOM 1993 C ASP A 128 0.216 -2.910 -7.978 1.00 0.30 C ATOM 1994 O ASP A 128 0.423 -3.233 -9.154 1.00 0.42 O ATOM 1995 CB ASP A 128 -0.228 -5.055 -6.778 1.00 0.45 C ATOM 1996 CG ASP A 128 -0.392 -5.447 -5.312 1.00 1.70 C ATOM 1997 OD1 ASP A 128 0.396 -4.958 -4.475 1.00 2.50 O ATOM 1998 OD2 ASP A 128 -1.310 -6.238 -5.008 1.00 2.10 O ATOM 0 H ASP A 128 -2.093 -3.914 -8.766 1.00 0.32 H new ATOM 0 HA ASP A 128 -0.962 -3.085 -6.203 1.00 0.33 H new ATOM 0 HB2 ASP A 128 -0.720 -5.801 -7.402 1.00 0.45 H new ATOM 0 HB3 ASP A 128 0.831 -5.074 -7.034 1.00 0.45 H new ATOM 2003 N GLU A 129 0.858 -1.906 -7.358 1.00 0.25 N ATOM 2004 CA GLU A 129 1.904 -1.115 -8.019 1.00 0.30 C ATOM 2005 C GLU A 129 3.289 -1.361 -7.374 1.00 0.27 C ATOM 2006 O GLU A 129 3.456 -1.280 -6.140 1.00 0.25 O ATOM 2007 CB GLU A 129 1.555 0.389 -7.985 1.00 0.43 C ATOM 2008 CG GLU A 129 1.749 1.141 -9.320 1.00 0.91 C ATOM 2009 CD GLU A 129 0.706 0.773 -10.365 1.00 0.76 C ATOM 2010 OE1 GLU A 129 -0.395 1.364 -10.340 1.00 1.56 O ATOM 2011 OE2 GLU A 129 0.989 -0.107 -11.206 1.00 1.12 O ATOM 0 H GLU A 129 0.668 -1.624 -6.396 1.00 0.25 H new ATOM 0 HA GLU A 129 1.955 -1.438 -9.059 1.00 0.30 H new ATOM 0 HB2 GLU A 129 0.516 0.497 -7.673 1.00 0.43 H new ATOM 0 HB3 GLU A 129 2.168 0.870 -7.223 1.00 0.43 H new ATOM 0 HG2 GLU A 129 1.708 2.214 -9.136 1.00 0.91 H new ATOM 0 HG3 GLU A 129 2.742 0.923 -9.713 1.00 0.91 H new ATOM 2018 N ILE A 130 4.265 -1.666 -8.255 1.00 0.28 N ATOM 2019 CA ILE A 130 5.674 -1.952 -7.884 1.00 0.28 C ATOM 2020 C ILE A 130 6.577 -0.775 -8.340 1.00 0.29 C ATOM 2021 O ILE A 130 6.795 -0.575 -9.542 1.00 0.39 O ATOM 2022 CB ILE A 130 6.209 -3.313 -8.521 1.00 0.31 C ATOM 2023 CG1 ILE A 130 5.053 -4.247 -9.007 1.00 0.37 C ATOM 2024 CG2 ILE A 130 7.122 -4.105 -7.533 1.00 0.37 C ATOM 2025 CD1 ILE A 130 4.753 -4.188 -10.506 1.00 0.45 C ATOM 0 H ILE A 130 4.098 -1.722 -9.260 1.00 0.28 H new ATOM 0 HA ILE A 130 5.710 -2.064 -6.800 1.00 0.28 H new ATOM 0 HB ILE A 130 6.797 -3.011 -9.387 1.00 0.31 H new ATOM 0 HG12 ILE A 130 5.303 -5.275 -8.743 1.00 0.37 H new ATOM 0 HG13 ILE A 130 4.146 -3.989 -8.461 1.00 0.37 H new ATOM 0 HG21 ILE A 130 7.463 -5.024 -8.010 1.00 0.37 H new ATOM 0 HG22 ILE A 130 7.984 -3.494 -7.265 1.00 0.37 H new ATOM 0 HG23 ILE A 130 6.558 -4.351 -6.633 1.00 0.37 H new ATOM 0 HD11 ILE A 130 3.937 -4.871 -10.741 1.00 0.45 H new ATOM 0 HD12 ILE A 130 4.467 -3.173 -10.780 1.00 0.45 H new ATOM 0 HD13 ILE A 130 5.642 -4.478 -11.067 1.00 0.45 H new ATOM 2037 N ILE A 131 7.098 -0.015 -7.360 1.00 0.21 N ATOM 2038 CA ILE A 131 7.942 1.157 -7.655 1.00 0.26 C ATOM 2039 C ILE A 131 9.332 1.095 -6.926 1.00 0.18 C ATOM 2040 O ILE A 131 9.389 1.357 -5.717 1.00 0.18 O ATOM 2041 CB ILE A 131 7.219 2.511 -7.279 1.00 0.34 C ATOM 2042 CG1 ILE A 131 5.684 2.315 -7.012 1.00 0.30 C ATOM 2043 CG2 ILE A 131 7.423 3.559 -8.423 1.00 0.62 C ATOM 2044 CD1 ILE A 131 5.139 2.995 -5.758 1.00 0.84 C ATOM 0 H ILE A 131 6.951 -0.189 -6.366 1.00 0.21 H new ATOM 0 HA ILE A 131 8.115 1.130 -8.731 1.00 0.26 H new ATOM 0 HB ILE A 131 7.670 2.872 -6.355 1.00 0.34 H new ATOM 0 HG12 ILE A 131 5.133 2.689 -7.875 1.00 0.30 H new ATOM 0 HG13 ILE A 131 5.479 1.247 -6.942 1.00 0.30 H new ATOM 0 HG21 ILE A 131 6.922 4.490 -8.157 1.00 0.62 H new ATOM 0 HG22 ILE A 131 8.488 3.746 -8.559 1.00 0.62 H new ATOM 0 HG23 ILE A 131 7.001 3.172 -9.351 1.00 0.62 H new ATOM 0 HD11 ILE A 131 4.071 2.795 -5.671 1.00 0.84 H new ATOM 0 HD12 ILE A 131 5.654 2.606 -4.880 1.00 0.84 H new ATOM 0 HD13 ILE A 131 5.302 4.070 -5.827 1.00 0.84 H new ATOM 2056 N PRO A 132 10.479 0.724 -7.634 1.00 0.13 N ATOM 2057 CA PRO A 132 11.857 0.711 -7.021 1.00 0.09 C ATOM 2058 C PRO A 132 12.493 2.110 -6.816 1.00 0.08 C ATOM 2059 O PRO A 132 12.305 3.022 -7.625 1.00 0.16 O ATOM 2060 CB PRO A 132 12.713 -0.078 -8.039 1.00 0.13 C ATOM 2061 CG PRO A 132 11.716 -0.790 -8.904 1.00 0.16 C ATOM 2062 CD PRO A 132 10.542 0.164 -9.010 1.00 0.16 C ATOM 0 HA PRO A 132 11.803 0.281 -6.021 1.00 0.09 H new ATOM 0 HB2 PRO A 132 13.343 0.589 -8.628 1.00 0.13 H new ATOM 0 HB3 PRO A 132 13.376 -0.782 -7.537 1.00 0.13 H new ATOM 0 HG2 PRO A 132 12.133 -1.014 -9.886 1.00 0.16 H new ATOM 0 HG3 PRO A 132 11.415 -1.739 -8.461 1.00 0.16 H new ATOM 0 HD2 PRO A 132 10.711 0.938 -9.759 1.00 0.16 H new ATOM 0 HD3 PRO A 132 9.621 -0.350 -9.285 1.00 0.16 H new ATOM 2070 N ILE A 133 13.244 2.231 -5.710 1.00 0.07 N ATOM 2071 CA ILE A 133 13.941 3.470 -5.300 1.00 0.08 C ATOM 2072 C ILE A 133 15.460 3.151 -5.071 1.00 0.08 C ATOM 2073 O ILE A 133 15.821 2.045 -4.657 1.00 0.10 O ATOM 2074 CB ILE A 133 13.286 4.088 -3.974 1.00 0.15 C ATOM 2075 CG1 ILE A 133 11.723 3.903 -3.962 1.00 0.23 C ATOM 2076 CG2 ILE A 133 13.635 5.604 -3.794 1.00 0.30 C ATOM 2077 CD1 ILE A 133 11.086 3.597 -2.593 1.00 0.38 C ATOM 0 H ILE A 133 13.389 1.458 -5.060 1.00 0.07 H new ATOM 0 HA ILE A 133 13.841 4.214 -6.090 1.00 0.08 H new ATOM 0 HB ILE A 133 13.715 3.536 -3.138 1.00 0.15 H new ATOM 0 HG12 ILE A 133 11.267 4.811 -4.357 1.00 0.23 H new ATOM 0 HG13 ILE A 133 11.468 3.094 -4.647 1.00 0.23 H new ATOM 0 HG21 ILE A 133 13.169 5.979 -2.882 1.00 0.30 H new ATOM 0 HG22 ILE A 133 14.716 5.723 -3.724 1.00 0.30 H new ATOM 0 HG23 ILE A 133 13.263 6.167 -4.650 1.00 0.30 H new ATOM 0 HD11 ILE A 133 10.007 3.490 -2.709 1.00 0.38 H new ATOM 0 HD12 ILE A 133 11.502 2.670 -2.197 1.00 0.38 H new ATOM 0 HD13 ILE A 133 11.298 4.413 -1.903 1.00 0.38 H new ATOM 2089 N SER A 134 16.336 4.137 -5.346 1.00 0.10 N ATOM 2090 CA SER A 134 17.782 3.951 -5.152 1.00 0.12 C ATOM 2091 C SER A 134 18.430 5.157 -4.432 1.00 0.13 C ATOM 2092 O SER A 134 18.444 6.280 -4.943 1.00 0.15 O ATOM 2093 CB SER A 134 18.467 3.669 -6.507 1.00 0.15 C ATOM 2094 OG SER A 134 19.722 3.013 -6.347 1.00 1.31 O ATOM 0 H SER A 134 16.070 5.057 -5.698 1.00 0.10 H new ATOM 0 HA SER A 134 17.926 3.087 -4.503 1.00 0.12 H new ATOM 0 HB2 SER A 134 17.812 3.052 -7.122 1.00 0.15 H new ATOM 0 HB3 SER A 134 18.615 4.608 -7.040 1.00 0.15 H new ATOM 0 HG SER A 134 20.121 2.851 -7.227 1.00 1.31 H new ATOM 2100 N ILE A 135 18.971 4.875 -3.231 1.00 0.13 N ATOM 2101 CA ILE A 135 19.665 5.874 -2.385 1.00 0.15 C ATOM 2102 C ILE A 135 21.178 5.477 -2.271 1.00 0.18 C ATOM 2103 O ILE A 135 21.512 4.342 -1.907 1.00 0.18 O ATOM 2104 CB ILE A 135 18.957 6.011 -0.949 1.00 0.16 C ATOM 2105 CG1 ILE A 135 17.426 6.232 -1.095 1.00 0.13 C ATOM 2106 CG2 ILE A 135 19.552 7.153 -0.047 1.00 0.25 C ATOM 2107 CD1 ILE A 135 16.553 5.318 -0.225 1.00 0.15 C ATOM 0 H ILE A 135 18.940 3.944 -2.815 1.00 0.13 H new ATOM 0 HA ILE A 135 19.600 6.859 -2.847 1.00 0.15 H new ATOM 0 HB ILE A 135 19.158 5.064 -0.449 1.00 0.16 H new ATOM 0 HG12 ILE A 135 17.199 7.269 -0.848 1.00 0.13 H new ATOM 0 HG13 ILE A 135 17.151 6.085 -2.139 1.00 0.13 H new ATOM 0 HG21 ILE A 135 19.020 7.180 0.904 1.00 0.25 H new ATOM 0 HG22 ILE A 135 20.609 6.960 0.134 1.00 0.25 H new ATOM 0 HG23 ILE A 135 19.440 8.112 -0.553 1.00 0.25 H new ATOM 0 HD11 ILE A 135 15.501 5.548 -0.397 1.00 0.15 H new ATOM 0 HD12 ILE A 135 16.744 4.277 -0.485 1.00 0.15 H new ATOM 0 HD13 ILE A 135 16.792 5.479 0.826 1.00 0.15 H new ATOM 2119 N LYS A 136 22.060 6.450 -2.592 1.00 0.20 N ATOM 2120 CA LYS A 136 23.526 6.263 -2.547 1.00 0.23 C ATOM 2121 C LYS A 136 24.214 7.501 -1.959 1.00 0.28 C ATOM 2122 O LYS A 136 24.009 8.628 -2.437 1.00 0.29 O ATOM 2123 CB LYS A 136 24.077 5.990 -3.963 1.00 0.22 C ATOM 2124 CG LYS A 136 23.628 4.639 -4.569 1.00 0.25 C ATOM 2125 CD LYS A 136 24.559 3.462 -4.184 1.00 0.94 C ATOM 2126 CE LYS A 136 24.061 2.117 -4.736 1.00 1.23 C ATOM 2127 NZ LYS A 136 24.989 1.004 -4.394 1.00 2.05 N ATOM 0 H LYS A 136 21.776 7.384 -2.888 1.00 0.20 H new ATOM 0 HA LYS A 136 23.737 5.406 -1.908 1.00 0.23 H new ATOM 0 HB2 LYS A 136 23.760 6.796 -4.625 1.00 0.22 H new ATOM 0 HB3 LYS A 136 25.166 6.016 -3.928 1.00 0.22 H new ATOM 0 HG2 LYS A 136 22.614 4.417 -4.236 1.00 0.25 H new ATOM 0 HG3 LYS A 136 23.594 4.728 -5.655 1.00 0.25 H new ATOM 0 HD2 LYS A 136 25.563 3.658 -4.562 1.00 0.94 H new ATOM 0 HD3 LYS A 136 24.633 3.401 -3.098 1.00 0.94 H new ATOM 0 HE2 LYS A 136 23.071 1.902 -4.333 1.00 1.23 H new ATOM 0 HE3 LYS A 136 23.957 2.184 -5.819 1.00 1.23 H new ATOM 0 HZ1 LYS A 136 24.620 0.113 -4.783 1.00 2.05 H new ATOM 0 HZ2 LYS A 136 25.927 1.197 -4.800 1.00 2.05 H new ATOM 0 HZ3 LYS A 136 25.069 0.924 -3.360 1.00 2.05 H new ATOM 2141 N LYS A 137 25.006 7.285 -0.860 1.00 0.33 N ATOM 2142 CA LYS A 137 25.775 8.363 -0.112 1.00 0.40 C ATOM 2143 C LYS A 137 24.891 9.398 0.662 1.00 0.39 C ATOM 2144 O LYS A 137 25.379 10.443 1.106 1.00 0.42 O ATOM 2145 CB LYS A 137 26.705 9.128 -1.069 1.00 0.44 C ATOM 2146 CG LYS A 137 27.954 8.343 -1.531 1.00 0.99 C ATOM 2147 CD LYS A 137 28.594 8.932 -2.815 1.00 1.59 C ATOM 2148 CE LYS A 137 28.882 10.438 -2.709 1.00 2.70 C ATOM 2149 NZ LYS A 137 29.648 10.932 -3.887 1.00 3.55 N ATOM 0 H LYS A 137 25.136 6.357 -0.458 1.00 0.33 H new ATOM 0 HA LYS A 137 26.341 7.816 0.642 1.00 0.40 H new ATOM 0 HB2 LYS A 137 26.133 9.423 -1.949 1.00 0.44 H new ATOM 0 HB3 LYS A 137 27.031 10.045 -0.579 1.00 0.44 H new ATOM 0 HG2 LYS A 137 28.693 8.342 -0.730 1.00 0.99 H new ATOM 0 HG3 LYS A 137 27.678 7.304 -1.712 1.00 0.99 H new ATOM 0 HD2 LYS A 137 29.524 8.404 -3.025 1.00 1.59 H new ATOM 0 HD3 LYS A 137 27.929 8.754 -3.660 1.00 1.59 H new ATOM 0 HE2 LYS A 137 27.942 10.984 -2.630 1.00 2.70 H new ATOM 0 HE3 LYS A 137 29.445 10.638 -1.798 1.00 2.70 H new ATOM 0 HZ1 LYS A 137 29.825 11.952 -3.783 1.00 3.55 H new ATOM 0 HZ2 LYS A 137 30.555 10.427 -3.948 1.00 3.55 H new ATOM 0 HZ3 LYS A 137 29.099 10.763 -4.754 1.00 3.55 H new ATOM 2163 N GLY A 138 23.597 9.065 0.819 1.00 0.35 N ATOM 2164 CA GLY A 138 22.611 9.926 1.484 1.00 0.36 C ATOM 2165 C GLY A 138 21.704 10.733 0.524 1.00 0.33 C ATOM 2166 O GLY A 138 21.048 11.682 0.963 1.00 0.37 O ATOM 0 H GLY A 138 23.207 8.184 0.484 1.00 0.35 H new ATOM 0 HA2 GLY A 138 21.981 9.307 2.123 1.00 0.36 H new ATOM 0 HA3 GLY A 138 23.138 10.623 2.135 1.00 0.36 H new ATOM 2170 N LYS A 139 21.669 10.358 -0.784 1.00 0.29 N ATOM 2171 CA LYS A 139 20.818 11.040 -1.776 1.00 0.29 C ATOM 2172 C LYS A 139 19.832 10.076 -2.456 1.00 0.26 C ATOM 2173 O LYS A 139 20.169 8.929 -2.763 1.00 0.25 O ATOM 2174 CB LYS A 139 21.665 11.726 -2.846 1.00 0.33 C ATOM 2175 CG LYS A 139 22.581 12.848 -2.325 1.00 0.65 C ATOM 2176 CD LYS A 139 23.360 13.546 -3.461 1.00 0.67 C ATOM 2177 CE LYS A 139 24.195 14.726 -2.950 1.00 1.00 C ATOM 2178 NZ LYS A 139 24.895 15.428 -4.061 1.00 1.56 N ATOM 0 H LYS A 139 22.221 9.590 -1.166 1.00 0.29 H new ATOM 0 HA LYS A 139 20.245 11.788 -1.227 1.00 0.29 H new ATOM 0 HB2 LYS A 139 22.280 10.974 -3.339 1.00 0.33 H new ATOM 0 HB3 LYS A 139 21.001 12.141 -3.604 1.00 0.33 H new ATOM 0 HG2 LYS A 139 21.981 13.586 -1.793 1.00 0.65 H new ATOM 0 HG3 LYS A 139 23.287 12.433 -1.606 1.00 0.65 H new ATOM 0 HD2 LYS A 139 24.015 12.823 -3.948 1.00 0.67 H new ATOM 0 HD3 LYS A 139 22.658 13.900 -4.217 1.00 0.67 H new ATOM 0 HE2 LYS A 139 23.548 15.429 -2.426 1.00 1.00 H new ATOM 0 HE3 LYS A 139 24.928 14.367 -2.227 1.00 1.00 H new ATOM 0 HZ1 LYS A 139 25.449 16.220 -3.677 1.00 1.56 H new ATOM 0 HZ2 LYS A 139 25.531 14.763 -4.546 1.00 1.56 H new ATOM 0 HZ3 LYS A 139 24.194 15.792 -4.738 1.00 1.56 H new ATOM 2192 N LEU A 140 18.631 10.590 -2.768 1.00 0.25 N ATOM 2193 CA LEU A 140 17.543 9.784 -3.352 1.00 0.24 C ATOM 2194 C LEU A 140 17.374 9.949 -4.879 1.00 0.26 C ATOM 2195 O LEU A 140 17.585 11.024 -5.446 1.00 0.34 O ATOM 2196 CB LEU A 140 16.230 10.173 -2.639 1.00 0.24 C ATOM 2197 CG LEU A 140 15.114 9.094 -2.517 1.00 0.22 C ATOM 2198 CD1 LEU A 140 14.522 9.062 -1.115 1.00 0.22 C ATOM 2199 CD2 LEU A 140 13.993 9.334 -3.515 1.00 0.25 C ATOM 0 H LEU A 140 18.386 11.570 -2.624 1.00 0.25 H new ATOM 0 HA LEU A 140 17.800 8.736 -3.201 1.00 0.24 H new ATOM 0 HB2 LEU A 140 16.483 10.506 -1.632 1.00 0.24 H new ATOM 0 HB3 LEU A 140 15.808 11.031 -3.162 1.00 0.24 H new ATOM 0 HG LEU A 140 15.587 8.136 -2.732 1.00 0.22 H new ATOM 0 HD11 LEU A 140 13.746 8.298 -1.065 1.00 0.22 H new ATOM 0 HD12 LEU A 140 15.306 8.831 -0.394 1.00 0.22 H new ATOM 0 HD13 LEU A 140 14.089 10.034 -0.881 1.00 0.22 H new ATOM 0 HD21 LEU A 140 13.232 8.562 -3.401 1.00 0.25 H new ATOM 0 HD22 LEU A 140 13.547 10.312 -3.333 1.00 0.25 H new ATOM 0 HD23 LEU A 140 14.394 9.301 -4.528 1.00 0.25 H new ATOM 2211 N SER A 141 16.967 8.840 -5.514 1.00 0.21 N ATOM 2212 CA SER A 141 16.709 8.785 -6.954 1.00 0.22 C ATOM 2213 C SER A 141 15.376 8.056 -7.226 1.00 0.19 C ATOM 2214 O SER A 141 15.261 6.838 -7.009 1.00 0.16 O ATOM 2215 CB SER A 141 17.863 8.077 -7.680 1.00 0.25 C ATOM 2216 OG SER A 141 18.190 8.731 -8.898 1.00 0.64 O ATOM 0 H SER A 141 16.808 7.953 -5.037 1.00 0.21 H new ATOM 0 HA SER A 141 16.636 9.804 -7.335 1.00 0.22 H new ATOM 0 HB2 SER A 141 18.740 8.051 -7.033 1.00 0.25 H new ATOM 0 HB3 SER A 141 17.586 7.043 -7.884 1.00 0.25 H new ATOM 0 HG SER A 141 18.928 8.258 -9.335 1.00 0.64 H new ATOM 2222 N VAL A 142 14.375 8.828 -7.696 1.00 0.21 N ATOM 2223 CA VAL A 142 13.030 8.297 -8.012 1.00 0.22 C ATOM 2224 C VAL A 142 12.781 8.337 -9.585 1.00 0.25 C ATOM 2225 O VAL A 142 12.353 9.353 -10.138 1.00 0.26 O ATOM 2226 CB VAL A 142 11.883 9.021 -7.083 1.00 0.27 C ATOM 2227 CG1 VAL A 142 11.556 10.503 -7.413 1.00 0.46 C ATOM 2228 CG2 VAL A 142 10.570 8.211 -7.034 1.00 0.41 C ATOM 0 H VAL A 142 14.473 9.829 -7.867 1.00 0.21 H new ATOM 0 HA VAL A 142 12.960 7.243 -7.745 1.00 0.22 H new ATOM 0 HB VAL A 142 12.361 9.035 -6.103 1.00 0.27 H new ATOM 0 HG11 VAL A 142 10.786 10.866 -6.732 1.00 0.46 H new ATOM 0 HG12 VAL A 142 12.456 11.108 -7.299 1.00 0.46 H new ATOM 0 HG13 VAL A 142 11.197 10.576 -8.439 1.00 0.46 H new ATOM 0 HG21 VAL A 142 9.845 8.731 -6.408 1.00 0.41 H new ATOM 0 HG22 VAL A 142 10.170 8.106 -8.042 1.00 0.41 H new ATOM 0 HG23 VAL A 142 10.767 7.223 -6.617 1.00 0.41 H new ATOM 2238 N GLN A 143 13.092 7.195 -10.280 1.00 0.31 N ATOM 2239 CA GLN A 143 12.934 7.010 -11.777 1.00 0.39 C ATOM 2240 C GLN A 143 13.886 7.913 -12.625 1.00 0.41 C ATOM 2241 O GLN A 143 14.955 7.470 -13.052 1.00 0.46 O ATOM 2242 CB GLN A 143 11.453 7.207 -12.234 1.00 0.44 C ATOM 2243 CG GLN A 143 10.495 6.018 -11.981 1.00 0.65 C ATOM 2244 CD GLN A 143 9.891 6.022 -10.587 1.00 0.87 C ATOM 2245 OE1 GLN A 143 8.822 6.589 -10.365 1.00 1.56 O ATOM 2246 NE2 GLN A 143 10.575 5.389 -9.641 1.00 1.12 N ATOM 0 H GLN A 143 13.464 6.365 -9.818 1.00 0.31 H new ATOM 0 HA GLN A 143 13.227 5.977 -11.967 1.00 0.39 H new ATOM 0 HB2 GLN A 143 11.052 8.084 -11.726 1.00 0.44 H new ATOM 0 HB3 GLN A 143 11.450 7.428 -13.301 1.00 0.44 H new ATOM 0 HG2 GLN A 143 9.692 6.044 -12.718 1.00 0.65 H new ATOM 0 HG3 GLN A 143 11.037 5.085 -12.132 1.00 0.65 H new ATOM 0 HE21 GLN A 143 11.458 4.932 -9.869 1.00 1.12 H new ATOM 0 HE22 GLN A 143 10.218 5.360 -8.686 1.00 1.12 H new ATOM 2255 N GLY A 144 13.461 9.174 -12.849 1.00 0.40 N ATOM 2256 CA GLY A 144 14.255 10.155 -13.592 1.00 0.45 C ATOM 2257 C GLY A 144 14.368 11.525 -12.888 1.00 0.42 C ATOM 2258 O GLY A 144 14.565 12.543 -13.554 1.00 0.49 O ATOM 0 H GLY A 144 12.564 9.531 -12.520 1.00 0.40 H new ATOM 0 HA2 GLY A 144 15.256 9.754 -13.750 1.00 0.45 H new ATOM 0 HA3 GLY A 144 13.810 10.298 -14.577 1.00 0.45 H new ATOM 2262 N GLU A 145 14.241 11.540 -11.536 1.00 0.33 N ATOM 2263 CA GLU A 145 14.341 12.770 -10.730 1.00 0.32 C ATOM 2264 C GLU A 145 15.260 12.536 -9.519 1.00 0.27 C ATOM 2265 O GLU A 145 14.968 11.705 -8.651 1.00 0.36 O ATOM 2266 CB GLU A 145 12.936 13.233 -10.265 1.00 0.37 C ATOM 2267 CG GLU A 145 12.791 14.752 -10.072 1.00 0.80 C ATOM 2268 CD GLU A 145 11.403 15.149 -9.605 1.00 1.16 C ATOM 2269 OE1 GLU A 145 10.435 14.916 -10.359 1.00 1.53 O ATOM 2270 OE2 GLU A 145 11.283 15.694 -8.487 1.00 1.82 O ATOM 0 H GLU A 145 14.067 10.701 -10.983 1.00 0.33 H new ATOM 0 HA GLU A 145 14.772 13.557 -11.348 1.00 0.32 H new ATOM 0 HB2 GLU A 145 12.199 12.901 -10.996 1.00 0.37 H new ATOM 0 HB3 GLU A 145 12.698 12.737 -9.324 1.00 0.37 H new ATOM 0 HG2 GLU A 145 13.527 15.094 -9.345 1.00 0.80 H new ATOM 0 HG3 GLU A 145 13.013 15.257 -11.012 1.00 0.80 H new ATOM 2277 N VAL A 146 16.365 13.301 -9.459 1.00 0.30 N ATOM 2278 CA VAL A 146 17.365 13.172 -8.375 1.00 0.27 C ATOM 2279 C VAL A 146 17.282 14.372 -7.342 1.00 0.28 C ATOM 2280 O VAL A 146 17.214 15.548 -7.720 1.00 0.32 O ATOM 2281 CB VAL A 146 18.835 12.868 -9.006 1.00 0.31 C ATOM 2282 CG1 VAL A 146 19.590 14.083 -9.640 1.00 1.02 C ATOM 2283 CG2 VAL A 146 19.773 12.134 -8.013 1.00 0.72 C ATOM 0 H VAL A 146 16.591 14.018 -10.149 1.00 0.30 H new ATOM 0 HA VAL A 146 17.134 12.304 -7.757 1.00 0.27 H new ATOM 0 HB VAL A 146 18.588 12.212 -9.840 1.00 0.31 H new ATOM 0 HG11 VAL A 146 20.555 13.752 -10.024 1.00 1.02 H new ATOM 0 HG12 VAL A 146 18.996 14.495 -10.456 1.00 1.02 H new ATOM 0 HG13 VAL A 146 19.746 14.850 -8.882 1.00 1.02 H new ATOM 0 HG21 VAL A 146 20.738 11.957 -8.487 1.00 0.72 H new ATOM 0 HG22 VAL A 146 19.913 12.748 -7.123 1.00 0.72 H new ATOM 0 HG23 VAL A 146 19.328 11.180 -7.730 1.00 0.72 H new ATOM 2293 N SER A 147 17.283 14.009 -6.048 1.00 0.27 N ATOM 2294 CA SER A 147 17.220 14.966 -4.932 1.00 0.29 C ATOM 2295 C SER A 147 17.994 14.414 -3.715 1.00 0.29 C ATOM 2296 O SER A 147 18.657 13.373 -3.800 1.00 0.30 O ATOM 2297 CB SER A 147 15.753 15.245 -4.547 1.00 0.31 C ATOM 2298 OG SER A 147 15.205 16.300 -5.322 1.00 0.56 O ATOM 0 H SER A 147 17.328 13.036 -5.746 1.00 0.27 H new ATOM 0 HA SER A 147 17.681 15.902 -5.248 1.00 0.29 H new ATOM 0 HB2 SER A 147 15.160 14.341 -4.689 1.00 0.31 H new ATOM 0 HB3 SER A 147 15.695 15.501 -3.489 1.00 0.31 H new ATOM 0 HG SER A 147 15.643 16.324 -6.198 1.00 0.56 H new ATOM 2304 N THR A 148 17.949 15.134 -2.581 1.00 0.30 N ATOM 2305 CA THR A 148 18.641 14.682 -1.347 1.00 0.31 C ATOM 2306 C THR A 148 17.674 14.042 -0.304 1.00 0.27 C ATOM 2307 O THR A 148 16.573 14.553 -0.061 1.00 0.32 O ATOM 2308 CB THR A 148 19.477 15.818 -0.633 1.00 0.44 C ATOM 2309 OG1 THR A 148 18.678 16.998 -0.395 1.00 1.25 O ATOM 2310 CG2 THR A 148 20.756 16.243 -1.404 1.00 0.99 C ATOM 0 H THR A 148 17.451 16.019 -2.486 1.00 0.30 H new ATOM 0 HA THR A 148 19.333 13.921 -1.707 1.00 0.31 H new ATOM 0 HB THR A 148 19.788 15.370 0.311 1.00 0.44 H new ATOM 0 HG1 THR A 148 19.225 17.679 0.049 1.00 1.25 H new ATOM 0 HG21 THR A 148 21.273 17.026 -0.848 1.00 0.99 H new ATOM 0 HG22 THR A 148 21.415 15.383 -1.517 1.00 0.99 H new ATOM 0 HG23 THR A 148 20.479 16.620 -2.389 1.00 0.99 H new ATOM 2318 N PHE A 149 18.122 12.921 0.319 1.00 0.26 N ATOM 2319 CA PHE A 149 17.356 12.210 1.390 1.00 0.24 C ATOM 2320 C PHE A 149 17.673 12.821 2.779 1.00 0.24 C ATOM 2321 O PHE A 149 18.839 12.857 3.196 1.00 0.29 O ATOM 2322 CB PHE A 149 17.692 10.680 1.401 1.00 0.23 C ATOM 2323 CG PHE A 149 17.096 9.901 2.593 1.00 0.22 C ATOM 2324 CD1 PHE A 149 15.740 9.555 2.631 1.00 0.22 C ATOM 2325 CD2 PHE A 149 17.909 9.464 3.646 1.00 0.24 C ATOM 2326 CE1 PHE A 149 15.226 8.801 3.668 1.00 0.24 C ATOM 2327 CE2 PHE A 149 17.389 8.722 4.686 1.00 0.26 C ATOM 2328 CZ PHE A 149 15.991 8.598 4.805 1.00 0.25 C ATOM 0 H PHE A 149 19.017 12.483 0.099 1.00 0.26 H new ATOM 0 HA PHE A 149 16.294 12.333 1.176 1.00 0.24 H new ATOM 0 HB2 PHE A 149 17.329 10.235 0.475 1.00 0.23 H new ATOM 0 HB3 PHE A 149 18.775 10.559 1.410 1.00 0.23 H new ATOM 0 HD1 PHE A 149 15.085 9.883 1.837 1.00 0.22 H new ATOM 0 HD2 PHE A 149 18.960 9.712 3.644 1.00 0.24 H new ATOM 0 HE1 PHE A 149 14.237 8.374 3.593 1.00 0.24 H new ATOM 0 HE2 PHE A 149 18.044 8.243 5.399 1.00 0.26 H new ATOM 0 HZ PHE A 149 15.531 8.353 5.751 1.00 0.25 H new ATOM 2338 N THR A 150 16.631 13.285 3.485 1.00 0.25 N ATOM 2339 CA THR A 150 16.840 13.888 4.817 1.00 0.30 C ATOM 2340 C THR A 150 15.904 13.282 5.917 1.00 0.40 C ATOM 2341 O THR A 150 14.778 13.741 6.135 1.00 1.15 O ATOM 2342 CB THR A 150 16.845 15.507 4.765 1.00 0.66 C ATOM 2343 OG1 THR A 150 17.105 16.069 6.065 1.00 1.42 O ATOM 2344 CG2 THR A 150 15.562 16.192 4.180 1.00 1.18 C ATOM 0 H THR A 150 15.661 13.258 3.171 1.00 0.25 H new ATOM 0 HA THR A 150 17.845 13.609 5.133 1.00 0.30 H new ATOM 0 HB THR A 150 17.648 15.723 4.061 1.00 0.66 H new ATOM 0 HG1 THR A 150 17.104 17.047 6.005 1.00 1.42 H new ATOM 0 HG21 THR A 150 15.687 17.275 4.199 1.00 1.18 H new ATOM 0 HG22 THR A 150 15.410 15.862 3.152 1.00 1.18 H new ATOM 0 HG23 THR A 150 14.696 15.916 4.782 1.00 1.18 H new ATOM 2352 N GLY A 151 16.424 12.229 6.597 1.00 0.32 N ATOM 2353 CA GLY A 151 15.736 11.562 7.724 1.00 0.18 C ATOM 2354 C GLY A 151 14.614 10.550 7.421 1.00 0.20 C ATOM 2355 O GLY A 151 14.758 9.368 7.740 1.00 0.42 O ATOM 0 H GLY A 151 17.332 11.821 6.377 1.00 0.32 H new ATOM 0 HA2 GLY A 151 16.494 11.046 8.313 1.00 0.18 H new ATOM 0 HA3 GLY A 151 15.314 12.341 8.359 1.00 0.18 H new ATOM 2359 N LYS A 152 13.503 11.012 6.815 1.00 0.16 N ATOM 2360 CA LYS A 152 12.337 10.146 6.566 1.00 0.13 C ATOM 2361 C LYS A 152 11.761 10.250 5.134 1.00 0.13 C ATOM 2362 O LYS A 152 11.934 11.244 4.429 1.00 0.16 O ATOM 2363 CB LYS A 152 11.277 10.473 7.696 1.00 0.22 C ATOM 2364 CG LYS A 152 9.747 10.364 7.379 1.00 0.41 C ATOM 2365 CD LYS A 152 9.168 11.468 6.441 1.00 0.56 C ATOM 2366 CE LYS A 152 9.531 12.899 6.870 1.00 0.69 C ATOM 2367 NZ LYS A 152 9.363 13.109 8.336 1.00 1.10 N ATOM 0 H LYS A 152 13.390 11.973 6.491 1.00 0.16 H new ATOM 0 HA LYS A 152 12.641 9.101 6.618 1.00 0.13 H new ATOM 0 HB2 LYS A 152 11.483 9.811 8.537 1.00 0.22 H new ATOM 0 HB3 LYS A 152 11.467 11.491 8.037 1.00 0.22 H new ATOM 0 HG2 LYS A 152 9.558 9.392 6.924 1.00 0.41 H new ATOM 0 HG3 LYS A 152 9.198 10.388 8.320 1.00 0.41 H new ATOM 0 HD2 LYS A 152 9.533 11.299 5.428 1.00 0.56 H new ATOM 0 HD3 LYS A 152 8.083 11.372 6.409 1.00 0.56 H new ATOM 0 HE2 LYS A 152 10.564 13.109 6.591 1.00 0.69 H new ATOM 0 HE3 LYS A 152 8.904 13.608 6.329 1.00 0.69 H new ATOM 0 HZ1 LYS A 152 9.017 14.074 8.511 1.00 1.10 H new ATOM 0 HZ2 LYS A 152 8.677 12.422 8.709 1.00 1.10 H new ATOM 0 HZ3 LYS A 152 10.278 12.977 8.813 1.00 1.10 H new ATOM 2381 N LEU A 153 11.040 9.170 4.769 1.00 0.12 N ATOM 2382 CA LEU A 153 10.313 9.027 3.475 1.00 0.13 C ATOM 2383 C LEU A 153 8.803 9.187 3.719 1.00 0.13 C ATOM 2384 O LEU A 153 8.285 8.694 4.727 1.00 0.18 O ATOM 2385 CB LEU A 153 10.592 7.640 2.860 1.00 0.15 C ATOM 2386 CG LEU A 153 10.428 7.459 1.318 1.00 0.34 C ATOM 2387 CD1 LEU A 153 11.676 6.833 0.699 1.00 0.43 C ATOM 2388 CD2 LEU A 153 9.218 6.582 0.983 1.00 0.67 C ATOM 0 H LEU A 153 10.940 8.353 5.372 1.00 0.12 H new ATOM 0 HA LEU A 153 10.658 9.796 2.784 1.00 0.13 H new ATOM 0 HB2 LEU A 153 11.614 7.363 3.119 1.00 0.15 H new ATOM 0 HB3 LEU A 153 9.933 6.922 3.349 1.00 0.15 H new ATOM 0 HG LEU A 153 10.276 8.454 0.900 1.00 0.34 H new ATOM 0 HD11 LEU A 153 11.531 6.720 -0.375 1.00 0.43 H new ATOM 0 HD12 LEU A 153 12.536 7.477 0.884 1.00 0.43 H new ATOM 0 HD13 LEU A 153 11.853 5.855 1.147 1.00 0.43 H new ATOM 0 HD21 LEU A 153 9.133 6.477 -0.099 1.00 0.67 H new ATOM 0 HD22 LEU A 153 9.346 5.598 1.435 1.00 0.67 H new ATOM 0 HD23 LEU A 153 8.313 7.046 1.374 1.00 0.67 H new ATOM 2400 N SER A 154 8.078 9.858 2.812 1.00 0.14 N ATOM 2401 CA SER A 154 6.644 10.061 3.061 1.00 0.16 C ATOM 2402 C SER A 154 5.709 9.542 1.947 1.00 0.19 C ATOM 2403 O SER A 154 5.982 9.666 0.763 1.00 0.36 O ATOM 2404 CB SER A 154 6.401 11.569 3.291 1.00 0.21 C ATOM 2405 OG SER A 154 5.195 11.830 4.004 1.00 0.24 O ATOM 0 H SER A 154 8.437 10.252 1.942 1.00 0.14 H new ATOM 0 HA SER A 154 6.392 9.467 3.939 1.00 0.16 H new ATOM 0 HB2 SER A 154 7.242 11.988 3.843 1.00 0.21 H new ATOM 0 HB3 SER A 154 6.366 12.078 2.328 1.00 0.21 H new ATOM 0 HG SER A 154 4.938 11.034 4.514 1.00 0.24 H new ATOM 2411 N VAL A 155 4.571 8.973 2.376 1.00 0.16 N ATOM 2412 CA VAL A 155 3.520 8.483 1.439 1.00 0.19 C ATOM 2413 C VAL A 155 2.248 9.323 1.694 1.00 0.25 C ATOM 2414 O VAL A 155 1.507 9.070 2.650 1.00 0.30 O ATOM 2415 CB VAL A 155 3.120 6.926 1.495 1.00 0.28 C ATOM 2416 CG1 VAL A 155 3.200 6.276 0.096 1.00 0.39 C ATOM 2417 CG2 VAL A 155 3.943 6.052 2.473 1.00 0.74 C ATOM 0 H VAL A 155 4.346 8.836 3.361 1.00 0.16 H new ATOM 0 HA VAL A 155 3.959 8.598 0.448 1.00 0.19 H new ATOM 0 HB VAL A 155 2.098 6.947 1.874 1.00 0.28 H new ATOM 0 HG11 VAL A 155 2.924 5.224 0.167 1.00 0.39 H new ATOM 0 HG12 VAL A 155 2.515 6.786 -0.582 1.00 0.39 H new ATOM 0 HG13 VAL A 155 4.217 6.359 -0.286 1.00 0.39 H new ATOM 0 HG21 VAL A 155 3.588 5.023 2.428 1.00 0.74 H new ATOM 0 HG22 VAL A 155 4.996 6.085 2.193 1.00 0.74 H new ATOM 0 HG23 VAL A 155 3.826 6.432 3.488 1.00 0.74 H new ATOM 2427 N GLU A 156 2.020 10.316 0.821 1.00 0.28 N ATOM 2428 CA GLU A 156 0.881 11.231 0.957 1.00 0.36 C ATOM 2429 C GLU A 156 -0.136 11.067 -0.174 1.00 0.34 C ATOM 2430 O GLU A 156 0.209 11.140 -1.361 1.00 0.38 O ATOM 2431 CB GLU A 156 1.388 12.688 0.986 1.00 0.53 C ATOM 2432 CG GLU A 156 0.863 13.541 2.150 1.00 0.73 C ATOM 2433 CD GLU A 156 1.329 14.982 2.061 1.00 1.26 C ATOM 2434 OE1 GLU A 156 2.418 15.287 2.591 1.00 1.66 O ATOM 2435 OE2 GLU A 156 0.606 15.804 1.459 1.00 1.67 O ATOM 0 H GLU A 156 2.612 10.504 0.012 1.00 0.28 H new ATOM 0 HA GLU A 156 0.376 10.986 1.891 1.00 0.36 H new ATOM 0 HB2 GLU A 156 2.477 12.676 1.028 1.00 0.53 H new ATOM 0 HB3 GLU A 156 1.111 13.171 0.049 1.00 0.53 H new ATOM 0 HG2 GLU A 156 -0.227 13.513 2.156 1.00 0.73 H new ATOM 0 HG3 GLU A 156 1.198 13.110 3.094 1.00 0.73 H new ATOM 2442 N PHE A 157 -1.404 10.849 0.215 1.00 0.35 N ATOM 2443 CA PHE A 157 -2.495 10.692 -0.761 1.00 0.40 C ATOM 2444 C PHE A 157 -3.485 11.868 -0.654 1.00 0.41 C ATOM 2445 O PHE A 157 -4.032 12.167 0.431 1.00 0.43 O ATOM 2446 CB PHE A 157 -3.235 9.332 -0.622 1.00 0.51 C ATOM 2447 CG PHE A 157 -2.441 8.229 0.079 1.00 0.60 C ATOM 2448 CD1 PHE A 157 -1.458 7.518 -0.607 1.00 0.99 C ATOM 2449 CD2 PHE A 157 -2.670 7.909 1.421 1.00 1.03 C ATOM 2450 CE1 PHE A 157 -0.731 6.520 0.021 1.00 1.55 C ATOM 2451 CE2 PHE A 157 -1.942 6.912 2.049 1.00 1.60 C ATOM 2452 CZ PHE A 157 -0.973 6.218 1.348 1.00 1.80 C ATOM 0 H PHE A 157 -1.697 10.778 1.190 1.00 0.35 H new ATOM 0 HA PHE A 157 -2.040 10.698 -1.752 1.00 0.40 H new ATOM 0 HB2 PHE A 157 -4.162 9.495 -0.073 1.00 0.51 H new ATOM 0 HB3 PHE A 157 -3.511 8.983 -1.617 1.00 0.51 H new ATOM 0 HD1 PHE A 157 -1.260 7.748 -1.643 1.00 0.99 H new ATOM 0 HD2 PHE A 157 -3.425 8.447 1.975 1.00 1.03 H new ATOM 0 HE1 PHE A 157 0.025 5.977 -0.527 1.00 1.55 H new ATOM 0 HE2 PHE A 157 -2.131 6.677 3.086 1.00 1.60 H new ATOM 0 HZ PHE A 157 -0.405 5.440 1.837 1.00 1.80 H new ATOM 2462 N VAL A 158 -3.684 12.525 -1.816 1.00 0.43 N ATOM 2463 CA VAL A 158 -4.563 13.729 -1.955 1.00 0.46 C ATOM 2464 C VAL A 158 -5.878 13.378 -2.727 1.00 0.48 C ATOM 2465 O VAL A 158 -5.889 12.564 -3.664 1.00 0.47 O ATOM 2466 CB VAL A 158 -3.865 15.012 -2.653 1.00 0.50 C ATOM 2467 CG1 VAL A 158 -4.301 16.343 -1.986 1.00 0.58 C ATOM 2468 CG2 VAL A 158 -2.311 15.004 -2.668 1.00 0.58 C ATOM 0 H VAL A 158 -3.244 12.243 -2.692 1.00 0.43 H new ATOM 0 HA VAL A 158 -4.783 14.020 -0.928 1.00 0.46 H new ATOM 0 HB VAL A 158 -4.213 14.939 -3.683 1.00 0.50 H new ATOM 0 HG11 VAL A 158 -3.809 17.178 -2.485 1.00 0.58 H new ATOM 0 HG12 VAL A 158 -5.382 16.455 -2.070 1.00 0.58 H new ATOM 0 HG13 VAL A 158 -4.018 16.332 -0.933 1.00 0.58 H new ATOM 0 HG21 VAL A 158 -1.947 15.907 -3.158 1.00 0.58 H new ATOM 0 HG22 VAL A 158 -1.937 14.971 -1.645 1.00 0.58 H new ATOM 0 HG23 VAL A 158 -1.957 14.128 -3.212 1.00 0.58 H new ATOM 2478 N LYS A 159 -6.978 14.048 -2.298 1.00 0.52 N ATOM 2479 CA LYS A 159 -8.359 13.881 -2.848 1.00 0.56 C ATOM 2480 C LYS A 159 -8.613 14.611 -4.198 1.00 0.66 C ATOM 2481 O LYS A 159 -8.036 15.668 -4.478 1.00 0.81 O ATOM 2482 CB LYS A 159 -9.396 14.369 -1.792 1.00 0.72 C ATOM 2483 CG LYS A 159 -9.161 15.806 -1.226 1.00 1.06 C ATOM 2484 CD LYS A 159 -9.845 16.913 -2.062 1.00 1.48 C ATOM 2485 CE LYS A 159 -9.519 18.323 -1.535 1.00 1.63 C ATOM 2486 NZ LYS A 159 -9.956 18.501 -0.122 1.00 2.18 N ATOM 0 H LYS A 159 -6.935 14.735 -1.545 1.00 0.52 H new ATOM 0 HA LYS A 159 -8.471 12.818 -3.059 1.00 0.56 H new ATOM 0 HB2 LYS A 159 -10.389 14.333 -2.241 1.00 0.72 H new ATOM 0 HB3 LYS A 159 -9.397 13.666 -0.959 1.00 0.72 H new ATOM 0 HG2 LYS A 159 -9.533 15.851 -0.203 1.00 1.06 H new ATOM 0 HG3 LYS A 159 -8.090 16.002 -1.184 1.00 1.06 H new ATOM 0 HD2 LYS A 159 -9.525 16.832 -3.101 1.00 1.48 H new ATOM 0 HD3 LYS A 159 -10.924 16.762 -2.048 1.00 1.48 H new ATOM 0 HE2 LYS A 159 -8.446 18.499 -1.608 1.00 1.63 H new ATOM 0 HE3 LYS A 159 -10.008 19.068 -2.163 1.00 1.63 H new ATOM 0 HZ1 LYS A 159 -10.481 19.394 -0.031 1.00 2.18 H new ATOM 0 HZ2 LYS A 159 -10.571 17.709 0.154 1.00 2.18 H new ATOM 0 HZ3 LYS A 159 -9.122 18.524 0.499 1.00 2.18 H new ATOM 2500 N GLY A 160 -9.505 14.016 -5.009 1.00 0.74 N ATOM 2501 CA GLY A 160 -9.881 14.581 -6.315 1.00 0.93 C ATOM 2502 C GLY A 160 -11.321 15.118 -6.356 1.00 0.96 C ATOM 2503 O GLY A 160 -11.541 16.271 -6.735 1.00 1.02 O ATOM 0 H GLY A 160 -9.979 13.142 -4.782 1.00 0.74 H new ATOM 0 HA2 GLY A 160 -9.193 15.388 -6.565 1.00 0.93 H new ATOM 0 HA3 GLY A 160 -9.765 13.814 -7.081 1.00 0.93 H new ATOM 2507 N TYR A 161 -12.292 14.268 -5.964 1.00 0.96 N ATOM 2508 CA TYR A 161 -13.720 14.642 -5.928 1.00 1.02 C ATOM 2509 C TYR A 161 -14.369 14.327 -4.558 1.00 1.05 C ATOM 2510 O TYR A 161 -15.052 15.184 -3.989 1.00 1.11 O ATOM 2511 CB TYR A 161 -14.496 13.930 -7.052 1.00 1.14 C ATOM 2512 CG TYR A 161 -14.333 14.583 -8.432 1.00 1.34 C ATOM 2513 CD1 TYR A 161 -15.179 15.614 -8.854 1.00 1.81 C ATOM 2514 CD2 TYR A 161 -13.337 14.158 -9.318 1.00 1.63 C ATOM 2515 CE1 TYR A 161 -15.032 16.195 -10.104 1.00 2.26 C ATOM 2516 CE2 TYR A 161 -13.192 14.739 -10.567 1.00 2.07 C ATOM 2517 CZ TYR A 161 -14.035 15.786 -10.935 1.00 2.29 C ATOM 2518 OH TYR A 161 -13.897 16.330 -12.193 1.00 2.86 O ATOM 0 H TYR A 161 -12.110 13.310 -5.666 1.00 0.96 H new ATOM 0 HA TYR A 161 -13.772 15.720 -6.081 1.00 1.02 H new ATOM 0 HB2 TYR A 161 -14.163 12.894 -7.110 1.00 1.14 H new ATOM 0 HB3 TYR A 161 -15.555 13.911 -6.793 1.00 1.14 H new ATOM 0 HD1 TYR A 161 -15.960 15.963 -8.195 1.00 1.81 H new ATOM 0 HD2 TYR A 161 -12.669 13.362 -9.023 1.00 1.63 H new ATOM 0 HE1 TYR A 161 -15.710 16.974 -10.419 1.00 2.26 H new ATOM 0 HE2 TYR A 161 -12.433 14.384 -11.249 1.00 2.07 H new ATOM 0 HH TYR A 161 -13.131 15.919 -12.645 1.00 2.86 H new ATOM 2528 N TYR A 162 -14.156 13.096 -4.039 1.00 1.09 N ATOM 2529 CA TYR A 162 -14.717 12.675 -2.738 1.00 1.17 C ATOM 2530 C TYR A 162 -13.705 11.878 -1.877 1.00 1.10 C ATOM 2531 O TYR A 162 -13.565 12.152 -0.682 1.00 1.71 O ATOM 2532 CB TYR A 162 -15.990 11.832 -2.955 1.00 1.54 C ATOM 2533 CG TYR A 162 -17.187 12.261 -2.092 1.00 1.88 C ATOM 2534 CD1 TYR A 162 -17.196 12.017 -0.716 1.00 2.00 C ATOM 2535 CD2 TYR A 162 -18.298 12.915 -2.643 1.00 2.57 C ATOM 2536 CE1 TYR A 162 -18.266 12.405 0.075 1.00 2.64 C ATOM 2537 CE2 TYR A 162 -19.366 13.303 -1.849 1.00 3.18 C ATOM 2538 CZ TYR A 162 -19.343 13.045 -0.496 1.00 3.16 C ATOM 2539 OH TYR A 162 -20.405 13.429 0.290 1.00 3.91 O ATOM 0 H TYR A 162 -13.599 12.378 -4.503 1.00 1.09 H new ATOM 0 HA TYR A 162 -14.960 13.586 -2.192 1.00 1.17 H new ATOM 0 HB2 TYR A 162 -16.275 11.890 -4.005 1.00 1.54 H new ATOM 0 HB3 TYR A 162 -15.760 10.788 -2.744 1.00 1.54 H new ATOM 0 HD1 TYR A 162 -16.354 11.517 -0.261 1.00 2.00 H new ATOM 0 HD2 TYR A 162 -18.322 13.120 -3.703 1.00 2.57 H new ATOM 0 HE1 TYR A 162 -18.255 12.206 1.136 1.00 2.64 H new ATOM 0 HE2 TYR A 162 -20.214 13.806 -2.290 1.00 3.18 H new ATOM 0 HH TYR A 162 -21.082 13.868 -0.266 1.00 3.91 H new ATOM 2549 N ASP A 163 -13.006 10.893 -2.490 1.00 1.04 N ATOM 2550 CA ASP A 163 -12.013 10.040 -1.778 1.00 0.99 C ATOM 2551 C ASP A 163 -10.558 10.293 -2.257 1.00 1.06 C ATOM 2552 O ASP A 163 -10.321 10.826 -3.350 1.00 1.74 O ATOM 2553 CB ASP A 163 -12.371 8.548 -1.954 1.00 1.11 C ATOM 2554 CG ASP A 163 -13.416 8.052 -0.953 1.00 1.19 C ATOM 2555 OD1 ASP A 163 -14.422 8.760 -0.736 1.00 1.34 O ATOM 2556 OD2 ASP A 163 -13.222 6.954 -0.392 1.00 1.27 O ATOM 0 H ASP A 163 -13.109 10.666 -3.479 1.00 1.04 H new ATOM 0 HA ASP A 163 -12.059 10.310 -0.723 1.00 0.99 H new ATOM 0 HB2 ASP A 163 -12.743 8.388 -2.966 1.00 1.11 H new ATOM 0 HB3 ASP A 163 -11.466 7.950 -1.849 1.00 1.11 H new ATOM 2561 N ASN A 164 -9.585 9.888 -1.415 1.00 0.83 N ATOM 2562 CA ASN A 164 -8.132 10.073 -1.709 1.00 0.83 C ATOM 2563 C ASN A 164 -7.392 8.718 -1.755 1.00 1.01 C ATOM 2564 O ASN A 164 -6.649 8.476 -2.701 1.00 1.68 O ATOM 2565 CB ASN A 164 -7.353 11.058 -0.726 1.00 1.02 C ATOM 2566 CG ASN A 164 -8.135 11.665 0.466 1.00 0.88 C ATOM 2567 OD1 ASN A 164 -9.281 12.092 0.336 1.00 1.57 O ATOM 2568 ND2 ASN A 164 -7.500 11.716 1.627 1.00 0.82 N ATOM 0 H ASN A 164 -9.770 9.429 -0.523 1.00 0.83 H new ATOM 0 HA ASN A 164 -8.126 10.552 -2.688 1.00 0.83 H new ATOM 0 HB2 ASN A 164 -6.496 10.518 -0.323 1.00 1.02 H new ATOM 0 HB3 ASN A 164 -6.960 11.882 -1.322 1.00 1.02 H new ATOM 0 HD21 ASN A 164 -7.961 12.117 2.443 1.00 0.82 H new ATOM 0 HD22 ASN A 164 -6.550 11.354 1.705 1.00 0.82 H new ATOM 2575 N PRO A 165 -7.518 7.835 -0.713 1.00 0.87 N ATOM 2576 CA PRO A 165 -6.879 6.497 -0.716 1.00 1.06 C ATOM 2577 C PRO A 165 -7.839 5.306 -1.007 1.00 0.93 C ATOM 2578 O PRO A 165 -7.624 4.552 -1.958 1.00 1.76 O ATOM 2579 CB PRO A 165 -6.345 6.393 0.724 1.00 1.45 C ATOM 2580 CG PRO A 165 -7.207 7.342 1.554 1.00 2.06 C ATOM 2581 CD PRO A 165 -8.148 8.082 0.595 1.00 1.41 C ATOM 0 HA PRO A 165 -6.137 6.423 -1.511 1.00 1.06 H new ATOM 0 HB2 PRO A 165 -6.418 5.371 1.096 1.00 1.45 H new ATOM 0 HB3 PRO A 165 -5.293 6.675 0.773 1.00 1.45 H new ATOM 0 HG2 PRO A 165 -7.779 6.787 2.297 1.00 2.06 H new ATOM 0 HG3 PRO A 165 -6.581 8.050 2.097 1.00 2.06 H new ATOM 0 HD2 PRO A 165 -9.164 7.689 0.638 1.00 1.41 H new ATOM 0 HD3 PRO A 165 -8.208 9.146 0.824 1.00 1.41 H new ATOM 2589 N LYS A 166 -8.880 5.156 -0.132 1.00 0.54 N ATOM 2590 CA LYS A 166 -9.933 4.092 -0.164 1.00 0.47 C ATOM 2591 C LYS A 166 -9.466 2.838 0.635 1.00 0.42 C ATOM 2592 O LYS A 166 -9.459 2.889 1.870 1.00 0.47 O ATOM 2593 CB LYS A 166 -10.412 3.764 -1.615 1.00 0.82 C ATOM 2594 CG LYS A 166 -11.741 2.970 -1.719 1.00 1.30 C ATOM 2595 CD LYS A 166 -12.996 3.858 -1.544 1.00 1.83 C ATOM 2596 CE LYS A 166 -14.296 3.059 -1.725 1.00 2.33 C ATOM 2597 NZ LYS A 166 -14.401 2.471 -3.090 1.00 3.00 N ATOM 0 H LYS A 166 -9.013 5.800 0.647 1.00 0.54 H new ATOM 0 HA LYS A 166 -10.820 4.479 0.338 1.00 0.47 H new ATOM 0 HB2 LYS A 166 -10.525 4.700 -2.161 1.00 0.82 H new ATOM 0 HB3 LYS A 166 -9.629 3.195 -2.117 1.00 0.82 H new ATOM 0 HG2 LYS A 166 -11.786 2.475 -2.689 1.00 1.30 H new ATOM 0 HG3 LYS A 166 -11.749 2.187 -0.961 1.00 1.30 H new ATOM 0 HD2 LYS A 166 -12.984 4.311 -0.553 1.00 1.83 H new ATOM 0 HD3 LYS A 166 -12.967 4.673 -2.268 1.00 1.83 H new ATOM 0 HE2 LYS A 166 -14.339 2.262 -0.982 1.00 2.33 H new ATOM 0 HE3 LYS A 166 -15.151 3.710 -1.544 1.00 2.33 H new ATOM 0 HZ1 LYS A 166 -15.372 2.132 -3.248 1.00 3.00 H new ATOM 0 HZ2 LYS A 166 -14.167 3.195 -3.799 1.00 3.00 H new ATOM 0 HZ3 LYS A 166 -13.738 1.674 -3.177 1.00 3.00 H new ATOM 2611 N VAL A 167 -9.086 1.713 -0.038 1.00 0.39 N ATOM 2612 CA VAL A 167 -8.562 0.520 0.701 1.00 0.38 C ATOM 2613 C VAL A 167 -7.016 0.450 0.472 1.00 0.34 C ATOM 2614 O VAL A 167 -6.558 0.487 -0.689 1.00 0.33 O ATOM 2615 CB VAL A 167 -9.284 -0.844 0.281 1.00 0.45 C ATOM 2616 CG1 VAL A 167 -8.899 -2.036 1.171 1.00 0.80 C ATOM 2617 CG2 VAL A 167 -10.833 -0.763 0.309 1.00 0.58 C ATOM 0 H VAL A 167 -9.129 1.605 -1.051 1.00 0.39 H new ATOM 0 HA VAL A 167 -8.782 0.639 1.762 1.00 0.38 H new ATOM 0 HB VAL A 167 -8.932 -0.997 -0.739 1.00 0.45 H new ATOM 0 HG11 VAL A 167 -9.424 -2.929 0.831 1.00 0.80 H new ATOM 0 HG12 VAL A 167 -7.824 -2.203 1.111 1.00 0.80 H new ATOM 0 HG13 VAL A 167 -9.176 -1.823 2.204 1.00 0.80 H new ATOM 0 HG21 VAL A 167 -11.253 -1.724 0.013 1.00 0.58 H new ATOM 0 HG22 VAL A 167 -11.166 -0.516 1.317 1.00 0.58 H new ATOM 0 HG23 VAL A 167 -11.170 0.009 -0.383 1.00 0.58 H new ATOM 2627 N CYS A 168 -6.244 0.220 1.575 1.00 0.35 N ATOM 2628 CA CYS A 168 -4.779 0.254 1.466 1.00 0.35 C ATOM 2629 C CYS A 168 -4.045 -0.931 2.125 1.00 0.36 C ATOM 2630 O CYS A 168 -4.367 -1.367 3.230 1.00 0.48 O ATOM 2631 CB CYS A 168 -4.317 1.554 2.089 1.00 0.37 C ATOM 2632 SG CYS A 168 -2.723 2.162 1.490 1.00 0.87 S ATOM 0 H CYS A 168 -6.606 0.018 2.507 1.00 0.35 H new ATOM 0 HA CYS A 168 -4.529 0.176 0.408 1.00 0.35 H new ATOM 0 HB2 CYS A 168 -5.073 2.317 1.904 1.00 0.37 H new ATOM 0 HB3 CYS A 168 -4.256 1.421 3.169 1.00 0.37 H new ATOM 0 HG CYS A 168 -2.431 3.278 2.089 1.00 0.87 H new ATOM 2638 N ALA A 169 -3.023 -1.428 1.388 1.00 0.29 N ATOM 2639 CA ALA A 169 -2.160 -2.582 1.784 1.00 0.29 C ATOM 2640 C ALA A 169 -0.594 -2.335 1.675 1.00 0.25 C ATOM 2641 O ALA A 169 0.129 -3.082 0.978 1.00 0.26 O ATOM 2642 CB ALA A 169 -2.623 -3.912 1.153 1.00 0.34 C ATOM 0 H ALA A 169 -2.765 -1.035 0.483 1.00 0.29 H new ATOM 0 HA ALA A 169 -2.316 -2.677 2.859 1.00 0.29 H new ATOM 0 HB1 ALA A 169 -1.961 -4.717 1.474 1.00 0.34 H new ATOM 0 HB2 ALA A 169 -3.642 -4.131 1.472 1.00 0.34 H new ATOM 0 HB3 ALA A 169 -2.593 -3.829 0.067 1.00 0.34 H new ATOM 2648 N LEU A 170 -0.103 -1.162 2.210 1.00 0.22 N ATOM 2649 CA LEU A 170 1.358 -0.715 2.228 1.00 0.21 C ATOM 2650 C LEU A 170 2.412 -1.789 2.660 1.00 0.19 C ATOM 2651 O LEU A 170 2.210 -2.534 3.625 1.00 0.34 O ATOM 2652 CB LEU A 170 1.502 0.469 3.217 1.00 0.31 C ATOM 2653 CG LEU A 170 1.994 1.866 2.698 1.00 0.38 C ATOM 2654 CD1 LEU A 170 3.289 1.801 1.869 1.00 0.50 C ATOM 2655 CD2 LEU A 170 0.906 2.592 1.903 1.00 0.70 C ATOM 0 H LEU A 170 -0.719 -0.480 2.653 1.00 0.22 H new ATOM 0 HA LEU A 170 1.577 -0.468 1.189 1.00 0.21 H new ATOM 0 HB2 LEU A 170 0.530 0.621 3.686 1.00 0.31 H new ATOM 0 HB3 LEU A 170 2.189 0.154 4.003 1.00 0.31 H new ATOM 0 HG LEU A 170 2.221 2.434 3.600 1.00 0.38 H new ATOM 0 HD11 LEU A 170 3.565 2.805 1.546 1.00 0.50 H new ATOM 0 HD12 LEU A 170 4.090 1.382 2.478 1.00 0.50 H new ATOM 0 HD13 LEU A 170 3.130 1.170 0.995 1.00 0.50 H new ATOM 0 HD21 LEU A 170 1.286 3.555 1.561 1.00 0.70 H new ATOM 0 HD22 LEU A 170 0.621 1.988 1.042 1.00 0.70 H new ATOM 0 HD23 LEU A 170 0.035 2.751 2.539 1.00 0.70 H new ATOM 2667 N PHE A 171 3.537 -1.831 1.923 1.00 0.16 N ATOM 2668 CA PHE A 171 4.627 -2.790 2.175 1.00 0.14 C ATOM 2669 C PHE A 171 5.992 -2.240 1.669 1.00 0.14 C ATOM 2670 O PHE A 171 6.227 -2.210 0.457 1.00 0.19 O ATOM 2671 CB PHE A 171 4.254 -4.125 1.449 1.00 0.17 C ATOM 2672 CG PHE A 171 5.318 -5.229 1.381 1.00 0.16 C ATOM 2673 CD1 PHE A 171 6.280 -5.338 2.390 1.00 0.15 C ATOM 2674 CD2 PHE A 171 5.367 -6.148 0.330 1.00 0.20 C ATOM 2675 CE1 PHE A 171 7.245 -6.326 2.348 1.00 0.15 C ATOM 2676 CE2 PHE A 171 6.328 -7.129 0.293 1.00 0.21 C ATOM 2677 CZ PHE A 171 7.234 -7.246 1.219 1.00 0.17 C ATOM 0 H PHE A 171 3.715 -1.203 1.139 1.00 0.16 H new ATOM 0 HA PHE A 171 4.740 -2.959 3.246 1.00 0.14 H new ATOM 0 HB2 PHE A 171 3.374 -4.539 1.942 1.00 0.17 H new ATOM 0 HB3 PHE A 171 3.961 -3.880 0.428 1.00 0.17 H new ATOM 0 HD1 PHE A 171 6.269 -4.640 3.214 1.00 0.15 H new ATOM 0 HD2 PHE A 171 4.639 -6.086 -0.465 1.00 0.20 H new ATOM 0 HE1 PHE A 171 7.986 -6.413 3.129 1.00 0.15 H new ATOM 0 HE2 PHE A 171 6.331 -7.826 -0.532 1.00 0.21 H new ATOM 0 HZ PHE A 171 7.978 -8.026 1.151 1.00 0.17 H new ATOM 2687 N ILE A 172 6.897 -1.805 2.592 1.00 0.10 N ATOM 2688 CA ILE A 172 8.250 -1.368 2.167 1.00 0.10 C ATOM 2689 C ILE A 172 9.372 -2.327 2.733 1.00 0.08 C ATOM 2690 O ILE A 172 9.536 -2.524 3.977 1.00 0.08 O ATOM 2691 CB ILE A 172 8.605 0.207 2.332 1.00 0.13 C ATOM 2692 CG1 ILE A 172 9.784 0.566 1.293 1.00 0.14 C ATOM 2693 CG2 ILE A 172 8.903 0.648 3.813 1.00 0.22 C ATOM 2694 CD1 ILE A 172 10.317 2.023 1.217 1.00 0.31 C ATOM 0 H ILE A 172 6.721 -1.750 3.595 1.00 0.10 H new ATOM 0 HA ILE A 172 8.226 -1.469 1.082 1.00 0.10 H new ATOM 0 HB ILE A 172 7.721 0.796 2.087 1.00 0.13 H new ATOM 0 HG12 ILE A 172 10.631 -0.080 1.523 1.00 0.14 H new ATOM 0 HG13 ILE A 172 9.436 0.293 0.297 1.00 0.14 H new ATOM 0 HG21 ILE A 172 9.131 1.714 3.836 1.00 0.22 H new ATOM 0 HG22 ILE A 172 8.030 0.450 4.434 1.00 0.22 H new ATOM 0 HG23 ILE A 172 9.755 0.086 4.195 1.00 0.22 H new ATOM 0 HD11 ILE A 172 11.106 2.083 0.467 1.00 0.31 H new ATOM 0 HD12 ILE A 172 9.503 2.694 0.942 1.00 0.31 H new ATOM 0 HD13 ILE A 172 10.716 2.315 2.188 1.00 0.31 H new ATOM 2706 N MET A 173 10.138 -2.881 1.789 1.00 0.09 N ATOM 2707 CA MET A 173 11.245 -3.797 2.097 1.00 0.11 C ATOM 2708 C MET A 173 12.577 -3.292 1.482 1.00 0.13 C ATOM 2709 O MET A 173 12.572 -2.417 0.603 1.00 0.21 O ATOM 2710 CB MET A 173 10.895 -5.238 1.642 1.00 0.15 C ATOM 2711 CG MET A 173 10.320 -5.348 0.209 1.00 0.17 C ATOM 2712 SD MET A 173 11.580 -5.270 -1.086 1.00 0.44 S ATOM 2713 CE MET A 173 12.602 -6.688 -0.693 1.00 0.26 C ATOM 0 H MET A 173 10.011 -2.709 0.792 1.00 0.09 H new ATOM 0 HA MET A 173 11.390 -3.821 3.177 1.00 0.11 H new ATOM 0 HB2 MET A 173 11.794 -5.852 1.705 1.00 0.15 H new ATOM 0 HB3 MET A 173 10.172 -5.659 2.341 1.00 0.15 H new ATOM 0 HG2 MET A 173 9.774 -6.287 0.117 1.00 0.17 H new ATOM 0 HG3 MET A 173 9.600 -4.544 0.053 1.00 0.17 H new ATOM 0 HE1 MET A 173 13.113 -7.029 -1.593 1.00 0.26 H new ATOM 0 HE2 MET A 173 13.339 -6.408 0.059 1.00 0.26 H new ATOM 0 HE3 MET A 173 11.976 -7.492 -0.305 1.00 0.26 H new ATOM 2723 N LYS A 174 13.723 -3.848 1.923 1.00 0.12 N ATOM 2724 CA LYS A 174 15.018 -3.338 1.442 1.00 0.19 C ATOM 2725 C LYS A 174 15.978 -4.328 0.730 1.00 0.16 C ATOM 2726 O LYS A 174 15.943 -5.553 0.882 1.00 0.17 O ATOM 2727 CB LYS A 174 15.769 -2.637 2.616 1.00 0.38 C ATOM 2728 CG LYS A 174 16.519 -3.592 3.580 1.00 0.54 C ATOM 2729 CD LYS A 174 17.271 -2.862 4.726 1.00 0.57 C ATOM 2730 CE LYS A 174 18.622 -2.262 4.277 1.00 0.49 C ATOM 2731 NZ LYS A 174 19.540 -3.301 3.731 1.00 1.26 N ATOM 0 H LYS A 174 13.779 -4.621 2.586 1.00 0.12 H new ATOM 0 HA LYS A 174 14.735 -2.651 0.645 1.00 0.19 H new ATOM 0 HB2 LYS A 174 16.486 -1.931 2.198 1.00 0.38 H new ATOM 0 HB3 LYS A 174 15.049 -2.056 3.192 1.00 0.38 H new ATOM 0 HG2 LYS A 174 15.804 -4.290 4.014 1.00 0.54 H new ATOM 0 HG3 LYS A 174 17.234 -4.183 3.008 1.00 0.54 H new ATOM 0 HD2 LYS A 174 16.639 -2.065 5.118 1.00 0.57 H new ATOM 0 HD3 LYS A 174 17.445 -3.562 5.543 1.00 0.57 H new ATOM 0 HE2 LYS A 174 18.446 -1.499 3.519 1.00 0.49 H new ATOM 0 HE3 LYS A 174 19.098 -1.766 5.123 1.00 0.49 H new ATOM 0 HZ1 LYS A 174 20.516 -2.943 3.743 1.00 1.26 H new ATOM 0 HZ2 LYS A 174 19.479 -4.159 4.315 1.00 1.26 H new ATOM 0 HZ3 LYS A 174 19.266 -3.527 2.754 1.00 1.26 H new ATOM 2745 N GLY A 175 16.834 -3.665 -0.048 1.00 0.14 N ATOM 2746 CA GLY A 175 17.973 -4.221 -0.785 1.00 0.15 C ATOM 2747 C GLY A 175 17.851 -4.420 -2.306 1.00 0.13 C ATOM 2748 O GLY A 175 18.766 -3.950 -2.992 1.00 0.17 O ATOM 0 H GLY A 175 16.746 -2.659 -0.191 1.00 0.14 H new ATOM 0 HA2 GLY A 175 18.830 -3.572 -0.606 1.00 0.15 H new ATOM 0 HA3 GLY A 175 18.209 -5.189 -0.344 1.00 0.15 H new ATOM 2752 N THR A 176 16.685 -4.904 -2.854 1.00 0.11 N ATOM 2753 CA THR A 176 16.515 -5.135 -4.341 1.00 0.10 C ATOM 2754 C THR A 176 15.095 -5.613 -4.721 1.00 0.10 C ATOM 2755 O THR A 176 14.344 -6.155 -3.900 1.00 0.13 O ATOM 2756 CB THR A 176 17.506 -6.193 -4.990 1.00 0.12 C ATOM 2757 OG1 THR A 176 18.060 -7.109 -4.025 1.00 0.15 O ATOM 2758 CG2 THR A 176 18.653 -5.543 -5.800 1.00 0.15 C ATOM 0 H THR A 176 15.860 -5.139 -2.302 1.00 0.11 H new ATOM 0 HA THR A 176 16.735 -4.143 -4.736 1.00 0.10 H new ATOM 0 HB THR A 176 16.880 -6.756 -5.682 1.00 0.12 H new ATOM 0 HG1 THR A 176 18.660 -7.738 -4.478 1.00 0.15 H new ATOM 0 HG21 THR A 176 19.292 -6.322 -6.215 1.00 0.15 H new ATOM 0 HG22 THR A 176 18.234 -4.947 -6.611 1.00 0.15 H new ATOM 0 HG23 THR A 176 19.242 -4.901 -5.145 1.00 0.15 H new ATOM 2766 N ALA A 177 14.759 -5.413 -6.034 1.00 0.10 N ATOM 2767 CA ALA A 177 13.468 -5.837 -6.669 1.00 0.11 C ATOM 2768 C ALA A 177 13.404 -7.373 -7.034 1.00 0.15 C ATOM 2769 O ALA A 177 12.322 -7.914 -7.308 1.00 0.17 O ATOM 2770 CB ALA A 177 13.215 -4.963 -7.921 1.00 0.15 C ATOM 0 H ALA A 177 15.386 -4.946 -6.689 1.00 0.10 H new ATOM 0 HA ALA A 177 12.681 -5.688 -5.930 1.00 0.11 H new ATOM 0 HB1 ALA A 177 12.278 -5.263 -8.391 1.00 0.15 H new ATOM 0 HB2 ALA A 177 13.154 -3.915 -7.627 1.00 0.15 H new ATOM 0 HB3 ALA A 177 14.034 -5.095 -8.628 1.00 0.15 H new ATOM 2776 N ASP A 178 14.578 -8.071 -7.012 1.00 0.19 N ATOM 2777 CA ASP A 178 14.676 -9.539 -7.280 1.00 0.24 C ATOM 2778 C ASP A 178 14.482 -10.429 -5.998 1.00 0.26 C ATOM 2779 O ASP A 178 14.592 -11.656 -6.072 1.00 0.31 O ATOM 2780 CB ASP A 178 16.033 -9.865 -7.926 1.00 0.31 C ATOM 2781 CG ASP A 178 15.978 -9.902 -9.451 1.00 0.42 C ATOM 2782 OD1 ASP A 178 15.574 -10.946 -10.005 1.00 0.55 O ATOM 2783 OD2 ASP A 178 16.340 -8.887 -10.083 1.00 0.51 O ATOM 0 H ASP A 178 15.478 -7.635 -6.809 1.00 0.19 H new ATOM 0 HA ASP A 178 13.857 -9.780 -7.958 1.00 0.24 H new ATOM 0 HB2 ASP A 178 16.766 -9.121 -7.613 1.00 0.31 H new ATOM 0 HB3 ASP A 178 16.381 -10.830 -7.558 1.00 0.31 H new ATOM 2788 N ASP A 179 14.186 -9.786 -4.839 1.00 0.24 N ATOM 2789 CA ASP A 179 13.965 -10.475 -3.540 1.00 0.31 C ATOM 2790 C ASP A 179 12.460 -10.568 -3.130 1.00 0.32 C ATOM 2791 O ASP A 179 12.137 -11.236 -2.146 1.00 0.44 O ATOM 2792 CB ASP A 179 14.746 -9.754 -2.430 1.00 0.37 C ATOM 2793 CG ASP A 179 16.113 -10.375 -2.155 1.00 0.48 C ATOM 2794 OD1 ASP A 179 17.082 -10.006 -2.851 1.00 0.52 O ATOM 2795 OD2 ASP A 179 16.207 -11.226 -1.246 1.00 0.60 O ATOM 0 H ASP A 179 14.094 -8.772 -4.779 1.00 0.24 H new ATOM 0 HA ASP A 179 14.323 -11.496 -3.670 1.00 0.31 H new ATOM 0 HB2 ASP A 179 14.879 -8.709 -2.708 1.00 0.37 H new ATOM 0 HB3 ASP A 179 14.157 -9.767 -1.513 1.00 0.37 H new ATOM 2800 N VAL A 180 11.561 -9.869 -3.876 1.00 0.24 N ATOM 2801 CA VAL A 180 10.071 -9.883 -3.633 1.00 0.29 C ATOM 2802 C VAL A 180 9.330 -10.983 -4.491 1.00 0.50 C ATOM 2803 O VAL A 180 8.930 -10.700 -5.627 1.00 0.95 O ATOM 2804 CB VAL A 180 9.319 -8.475 -3.868 1.00 0.27 C ATOM 2805 CG1 VAL A 180 9.117 -7.722 -2.547 1.00 0.48 C ATOM 2806 CG2 VAL A 180 9.984 -7.500 -4.886 1.00 0.50 C ATOM 0 H VAL A 180 11.836 -9.279 -4.662 1.00 0.24 H new ATOM 0 HA VAL A 180 10.006 -10.115 -2.570 1.00 0.29 H new ATOM 0 HB VAL A 180 8.370 -8.779 -4.309 1.00 0.27 H new ATOM 0 HG11 VAL A 180 8.608 -6.778 -2.741 1.00 0.48 H new ATOM 0 HG12 VAL A 180 8.513 -8.328 -1.871 1.00 0.48 H new ATOM 0 HG13 VAL A 180 10.086 -7.524 -2.089 1.00 0.48 H new ATOM 0 HG21 VAL A 180 9.389 -6.590 -4.960 1.00 0.50 H new ATOM 0 HG22 VAL A 180 10.989 -7.250 -4.547 1.00 0.50 H new ATOM 0 HG23 VAL A 180 10.039 -7.977 -5.864 1.00 0.50 H new ATOM 2816 N PRO A 181 9.147 -12.256 -3.977 1.00 0.59 N ATOM 2817 CA PRO A 181 8.443 -13.332 -4.724 1.00 0.75 C ATOM 2818 C PRO A 181 6.933 -13.473 -4.399 1.00 1.31 C ATOM 2819 O PRO A 181 6.499 -13.192 -3.278 1.00 1.80 O ATOM 2820 CB PRO A 181 9.213 -14.579 -4.264 1.00 1.20 C ATOM 2821 CG PRO A 181 9.552 -14.300 -2.816 1.00 1.57 C ATOM 2822 CD PRO A 181 9.669 -12.778 -2.685 1.00 1.05 C ATOM 0 HA PRO A 181 8.442 -13.142 -5.797 1.00 0.75 H new ATOM 0 HB2 PRO A 181 8.607 -15.479 -4.364 1.00 1.20 H new ATOM 0 HB3 PRO A 181 10.113 -14.733 -4.860 1.00 1.20 H new ATOM 0 HG2 PRO A 181 8.778 -14.688 -2.154 1.00 1.57 H new ATOM 0 HG3 PRO A 181 10.486 -14.787 -2.535 1.00 1.57 H new ATOM 0 HD2 PRO A 181 9.088 -12.406 -1.842 1.00 1.05 H new ATOM 0 HD3 PRO A 181 10.702 -12.471 -2.520 1.00 1.05 H new ATOM 2830 N MET A 182 6.157 -13.910 -5.407 1.00 1.54 N ATOM 2831 CA MET A 182 4.702 -14.110 -5.267 1.00 2.26 C ATOM 2832 C MET A 182 4.277 -15.466 -5.859 1.00 2.40 C ATOM 2833 O MET A 182 4.151 -15.614 -7.082 1.00 2.49 O ATOM 2834 CB MET A 182 3.923 -12.966 -5.955 1.00 2.82 C ATOM 2835 CG MET A 182 4.000 -11.610 -5.237 1.00 3.46 C ATOM 2836 SD MET A 182 3.153 -10.299 -6.143 1.00 4.01 S ATOM 2837 CE MET A 182 3.418 -8.895 -5.061 1.00 4.96 C ATOM 0 H MET A 182 6.517 -14.133 -6.335 1.00 1.54 H new ATOM 0 HA MET A 182 4.465 -14.104 -4.203 1.00 2.26 H new ATOM 0 HB2 MET A 182 4.303 -12.846 -6.970 1.00 2.82 H new ATOM 0 HB3 MET A 182 2.876 -13.258 -6.039 1.00 2.82 H new ATOM 0 HG2 MET A 182 3.561 -11.703 -4.244 1.00 3.46 H new ATOM 0 HG3 MET A 182 5.046 -11.335 -5.099 1.00 3.46 H new ATOM 0 HE1 MET A 182 2.950 -8.010 -5.492 1.00 4.96 H new ATOM 0 HE2 MET A 182 2.978 -9.100 -4.085 1.00 4.96 H new ATOM 0 HE3 MET A 182 4.488 -8.720 -4.947 1.00 4.96 H new ATOM 2847 N LEU A 183 4.067 -16.454 -4.972 1.00 2.65 N ATOM 2848 CA LEU A 183 3.665 -17.816 -5.380 1.00 2.86 C ATOM 2849 C LEU A 183 2.554 -18.409 -4.483 1.00 3.61 C ATOM 2850 O LEU A 183 2.174 -17.848 -3.445 1.00 4.00 O ATOM 2851 CB LEU A 183 4.894 -18.765 -5.356 1.00 2.51 C ATOM 2852 CG LEU A 183 5.936 -18.585 -6.497 1.00 2.24 C ATOM 2853 CD1 LEU A 183 7.345 -18.946 -6.022 1.00 2.43 C ATOM 2854 CD2 LEU A 183 5.582 -19.430 -7.725 1.00 2.58 C ATOM 0 H LEU A 183 4.169 -16.336 -3.964 1.00 2.65 H new ATOM 0 HA LEU A 183 3.265 -17.732 -6.391 1.00 2.86 H new ATOM 0 HB2 LEU A 183 5.407 -18.634 -4.403 1.00 2.51 H new ATOM 0 HB3 LEU A 183 4.531 -19.793 -5.385 1.00 2.51 H new ATOM 0 HG LEU A 183 5.913 -17.532 -6.779 1.00 2.24 H new ATOM 0 HD11 LEU A 183 8.051 -18.810 -6.841 1.00 2.43 H new ATOM 0 HD12 LEU A 183 7.625 -18.300 -5.190 1.00 2.43 H new ATOM 0 HD13 LEU A 183 7.364 -19.986 -5.696 1.00 2.43 H new ATOM 0 HD21 LEU A 183 6.333 -19.278 -8.500 1.00 2.58 H new ATOM 0 HD22 LEU A 183 5.557 -20.484 -7.447 1.00 2.58 H new ATOM 0 HD23 LEU A 183 4.604 -19.131 -8.103 1.00 2.58 H new ATOM 2866 N GLN A 184 2.047 -19.574 -4.920 1.00 3.87 N ATOM 2867 CA GLN A 184 0.995 -20.334 -4.212 1.00 4.58 C ATOM 2868 C GLN A 184 1.560 -21.675 -3.659 1.00 4.68 C ATOM 2869 O GLN A 184 2.600 -22.147 -4.146 1.00 4.25 O ATOM 2870 CB GLN A 184 -0.160 -20.612 -5.199 1.00 4.95 C ATOM 2871 CG GLN A 184 -1.235 -19.518 -5.257 1.00 5.32 C ATOM 2872 CD GLN A 184 -2.295 -19.804 -6.305 1.00 5.82 C ATOM 2873 OE1 GLN A 184 -2.165 -19.402 -7.460 1.00 6.06 O ATOM 2874 NE2 GLN A 184 -3.351 -20.503 -5.905 1.00 6.27 N ATOM 0 H GLN A 184 2.357 -20.022 -5.783 1.00 3.87 H new ATOM 0 HA GLN A 184 0.633 -19.749 -3.366 1.00 4.58 H new ATOM 0 HB2 GLN A 184 0.258 -20.744 -6.197 1.00 4.95 H new ATOM 0 HB3 GLN A 184 -0.635 -21.554 -4.925 1.00 4.95 H new ATOM 0 HG2 GLN A 184 -1.709 -19.426 -4.280 1.00 5.32 H new ATOM 0 HG3 GLN A 184 -0.763 -18.560 -5.473 1.00 5.32 H new ATOM 0 HE21 GLN A 184 -3.418 -20.817 -4.937 1.00 6.27 H new ATOM 0 HE22 GLN A 184 -4.095 -20.726 -6.566 1.00 6.27 H new ATOM 2883 N PRO A 185 0.901 -22.342 -2.632 1.00 5.36 N ATOM 2884 CA PRO A 185 1.408 -23.638 -2.058 1.00 5.62 C ATOM 2885 C PRO A 185 1.273 -24.860 -3.003 1.00 5.52 C ATOM 2886 O PRO A 185 0.174 -25.222 -3.435 1.00 5.77 O ATOM 2887 CB PRO A 185 0.536 -23.830 -0.799 1.00 6.42 C ATOM 2888 CG PRO A 185 -0.741 -23.101 -1.118 1.00 6.59 C ATOM 2889 CD PRO A 185 -0.315 -21.875 -1.906 1.00 5.99 C ATOM 0 HA PRO A 185 2.480 -23.582 -1.868 1.00 5.62 H new ATOM 0 HB2 PRO A 185 0.352 -24.886 -0.599 1.00 6.42 H new ATOM 0 HB3 PRO A 185 1.019 -23.417 0.087 1.00 6.42 H new ATOM 0 HG2 PRO A 185 -1.417 -23.728 -1.700 1.00 6.59 H new ATOM 0 HG3 PRO A 185 -1.271 -22.819 -0.208 1.00 6.59 H new ATOM 0 HD2 PRO A 185 -1.094 -21.548 -2.594 1.00 5.99 H new ATOM 0 HD3 PRO A 185 -0.094 -21.032 -1.251 1.00 5.99 H new ATOM 2897 N HIS A 186 2.431 -25.463 -3.300 1.00 5.25 N ATOM 2898 CA HIS A 186 2.530 -26.618 -4.202 1.00 5.19 C ATOM 2899 C HIS A 186 3.493 -27.707 -3.624 1.00 5.51 C ATOM 2900 O HIS A 186 4.511 -27.362 -3.009 1.00 5.51 O ATOM 2901 CB HIS A 186 3.037 -26.114 -5.585 1.00 4.55 C ATOM 2902 CG HIS A 186 2.864 -27.089 -6.725 1.00 4.63 C ATOM 2903 ND1 HIS A 186 3.665 -28.198 -6.888 1.00 4.77 N ATOM 2904 CD2 HIS A 186 1.944 -27.148 -7.721 1.00 4.82 C ATOM 2905 CE1 HIS A 186 3.246 -28.902 -7.919 1.00 4.89 C ATOM 2906 NE2 HIS A 186 2.204 -28.286 -8.446 1.00 4.96 N ATOM 0 H HIS A 186 3.329 -25.163 -2.920 1.00 5.25 H new ATOM 0 HA HIS A 186 1.550 -27.082 -4.309 1.00 5.19 H new ATOM 0 HB2 HIS A 186 2.511 -25.192 -5.833 1.00 4.55 H new ATOM 0 HB3 HIS A 186 4.095 -25.865 -5.498 1.00 4.55 H new ATOM 0 HD1 HIS A 186 4.462 -28.438 -6.299 1.00 4.77 H new ATOM 0 HD2 HIS A 186 1.155 -26.434 -7.909 1.00 4.82 H new ATOM 0 HE1 HIS A 186 3.680 -29.825 -8.273 1.00 4.89 H new ATOM 2915 N PRO A 187 3.210 -29.054 -3.823 1.00 5.90 N ATOM 2916 CA PRO A 187 4.105 -30.155 -3.333 1.00 6.31 C ATOM 2917 C PRO A 187 5.232 -30.544 -4.342 1.00 6.06 C ATOM 2918 O PRO A 187 5.663 -29.712 -5.145 1.00 5.96 O ATOM 2919 CB PRO A 187 3.090 -31.306 -3.193 1.00 6.77 C ATOM 2920 CG PRO A 187 2.222 -31.125 -4.398 1.00 6.43 C ATOM 2921 CD PRO A 187 1.974 -29.634 -4.449 1.00 6.09 C ATOM 0 HA PRO A 187 4.652 -29.886 -2.429 1.00 6.31 H new ATOM 0 HB2 PRO A 187 3.580 -32.280 -3.189 1.00 6.77 H new ATOM 0 HB3 PRO A 187 2.519 -31.232 -2.267 1.00 6.77 H new ATOM 0 HG2 PRO A 187 2.716 -31.479 -5.303 1.00 6.43 H new ATOM 0 HG3 PRO A 187 1.290 -31.682 -4.306 1.00 6.43 H new ATOM 0 HD2 PRO A 187 1.840 -29.284 -5.472 1.00 6.09 H new ATOM 0 HD3 PRO A 187 1.076 -29.357 -3.897 1.00 6.09 H new ATOM 2929 N GLY A 188 5.700 -31.798 -4.271 1.00 6.19 N ATOM 2930 CA GLY A 188 6.711 -32.268 -5.199 1.00 6.09 C ATOM 2931 C GLY A 188 7.263 -33.643 -4.845 1.00 6.57 C ATOM 2932 O GLY A 188 8.282 -33.748 -4.157 1.00 7.02 O ATOM 0 H GLY A 188 5.393 -32.489 -3.587 1.00 6.19 H new ATOM 0 HA2 GLY A 188 6.285 -32.302 -6.202 1.00 6.09 H new ATOM 0 HA3 GLY A 188 7.531 -31.551 -5.225 1.00 6.09 H new ATOM 2936 N LEU A 189 6.578 -34.698 -5.326 1.00 6.77 N ATOM 2937 CA LEU A 189 6.982 -36.093 -5.075 1.00 7.51 C ATOM 2938 C LEU A 189 7.290 -36.849 -6.382 1.00 7.90 C ATOM 2939 O LEU A 189 6.406 -37.045 -7.226 1.00 7.97 O ATOM 2940 CB LEU A 189 5.879 -36.832 -4.288 1.00 7.96 C ATOM 2941 CG LEU A 189 5.740 -36.463 -2.782 1.00 8.35 C ATOM 2942 CD1 LEU A 189 4.285 -36.536 -2.324 1.00 8.85 C ATOM 2943 CD2 LEU A 189 6.601 -37.371 -1.898 1.00 8.99 C ATOM 0 H LEU A 189 5.736 -34.608 -5.895 1.00 6.77 H new ATOM 0 HA LEU A 189 7.898 -36.066 -4.485 1.00 7.51 H new ATOM 0 HB2 LEU A 189 4.924 -36.641 -4.777 1.00 7.96 H new ATOM 0 HB3 LEU A 189 6.066 -37.903 -4.362 1.00 7.96 H new ATOM 0 HG LEU A 189 6.093 -35.437 -2.676 1.00 8.35 H new ATOM 0 HD11 LEU A 189 4.222 -36.273 -1.268 1.00 8.85 H new ATOM 0 HD12 LEU A 189 3.684 -35.839 -2.908 1.00 8.85 H new ATOM 0 HD13 LEU A 189 3.908 -37.549 -2.468 1.00 8.85 H new ATOM 0 HD21 LEU A 189 6.479 -37.084 -0.854 1.00 8.99 H new ATOM 0 HD22 LEU A 189 6.290 -38.407 -2.029 1.00 8.99 H new ATOM 0 HD23 LEU A 189 7.648 -37.268 -2.182 1.00 8.99 H new ATOM 2955 N GLU A 190 8.558 -37.274 -6.528 1.00 8.45 N ATOM 2956 CA GLU A 190 9.016 -38.013 -7.717 1.00 9.15 C ATOM 2957 C GLU A 190 9.787 -39.278 -7.317 1.00 10.12 C ATOM 2958 O GLU A 190 9.154 -40.351 -7.226 1.00 10.56 O ATOM 2959 CB GLU A 190 9.915 -37.121 -8.600 1.00 9.15 C ATOM 2960 CG GLU A 190 9.177 -35.992 -9.335 1.00 8.88 C ATOM 2961 CD GLU A 190 10.118 -35.122 -10.148 1.00 9.20 C ATOM 2962 OE1 GLU A 190 10.405 -35.481 -11.309 1.00 9.58 O ATOM 2963 OE2 GLU A 190 10.568 -34.081 -9.622 1.00 9.27 O ATOM 2964 OXT GLU A 190 11.012 -39.181 -7.097 1.00 10.60 O ATOM 0 H GLU A 190 9.287 -37.117 -5.832 1.00 8.45 H new ATOM 0 HA GLU A 190 8.132 -38.305 -8.284 1.00 9.15 H new ATOM 0 HB2 GLU A 190 10.693 -36.682 -7.975 1.00 9.15 H new ATOM 0 HB3 GLU A 190 10.415 -37.749 -9.337 1.00 9.15 H new ATOM 0 HG2 GLU A 190 8.423 -36.423 -9.994 1.00 8.88 H new ATOM 0 HG3 GLU A 190 8.650 -35.373 -8.609 1.00 8.88 H new TER 2971 GLU A 190 HETATM 2972 C1 GLC A 191 -17.582 6.408 2.602 1.00 1.34 C HETATM 2973 C2 GLC A 191 -16.303 5.781 1.907 1.00 1.55 C HETATM 2974 C3 GLC A 191 -16.468 4.199 1.779 1.00 1.62 C HETATM 2975 C4 GLC A 191 -16.916 3.504 3.143 1.00 1.59 C HETATM 2976 C5 GLC A 191 -18.217 4.220 3.714 1.00 1.39 C HETATM 2977 C6 GLC A 191 -18.659 3.758 5.136 1.00 1.49 C HETATM 2978 O2 GLC A 191 -16.164 6.301 0.581 1.00 1.64 O HETATM 2979 O3 GLC A 191 -15.215 3.647 1.378 1.00 1.88 O HETATM 2980 O4 GLC A 191 -17.169 2.115 2.907 1.00 1.73 O HETATM 2981 O5 GLC A 191 -17.837 5.656 3.858 1.00 1.36 O HETATM 2982 O6 GLC A 191 -19.117 4.785 6.005 1.00 1.50 O HETATM 0 HO6 GLC A 191 -18.894 5.660 5.624 1.00 1.50 H new HETATM 0 HO4 GLC A 191 -16.538 1.575 3.427 1.00 1.73 H new HETATM 0 HO3 GLC A 191 -15.298 2.674 1.296 1.00 1.88 H new HETATM 0 HO2 GLC A 191 -15.218 6.480 0.397 1.00 1.64 H new HETATM 0 H62 GLC A 191 -19.453 3.019 5.027 1.00 1.49 H new HETATM 0 H61 GLC A 191 -17.818 3.254 5.612 1.00 1.49 H new HETATM 0 H5 GLC A 191 -19.040 3.995 3.036 1.00 1.39 H new HETATM 0 H4 GLC A 191 -16.119 3.598 3.881 1.00 1.59 H new HETATM 0 H3 GLC A 191 -17.253 4.010 1.046 1.00 1.62 H new HETATM 0 H2 GLC A 191 -15.433 6.030 2.515 1.00 1.55 H new HETATM 2994 C2 BGC A 192 -20.687 9.544 0.392 1.00 1.56 C HETATM 2995 C3 BGC A 192 -19.625 8.366 0.445 1.00 1.44 C HETATM 2996 C4 BGC A 192 -19.681 7.531 1.814 1.00 1.26 C HETATM 2997 C5 BGC A 192 -21.187 7.040 2.056 1.00 1.30 C HETATM 2998 C6 BGC A 192 -21.439 6.349 3.431 1.00 1.26 C HETATM 2999 C1 BGC A 192 -22.089 8.996 0.803 1.00 1.63 C HETATM 3000 O1 BGC A 192 -23.008 10.026 0.973 1.00 1.86 O HETATM 3001 O2 BGC A 192 -20.752 10.086 -0.928 1.00 1.78 O HETATM 3002 O3 BGC A 192 -18.321 8.922 0.297 1.00 1.54 O HETATM 3003 O4 BGC A 192 -18.745 6.377 1.743 1.00 1.27 O HETATM 3004 O5 BGC A 192 -22.008 8.282 2.093 1.00 1.47 O HETATM 3005 O6 BGC A 192 -22.645 6.709 4.094 1.00 1.46 O HETATM 0 H6C2 BGC A 192 -21.439 5.270 3.279 1.00 1.26 H new HETATM 0 H6C1 BGC A 192 -20.602 6.579 4.090 1.00 1.26 H new HETATM 0 HC BGC A 192 -18.391 9.892 0.177 1.00 1.54 H new HETATM 0 HB BGC A 192 -20.358 10.983 -0.933 1.00 1.78 H new HETATM 0 HA BGC A 192 -23.876 9.651 1.229 1.00 1.86 H new HETATM 0 H6 BGC A 192 -22.968 7.565 3.743 1.00 1.46 H new HETATM 0 H5 BGC A 192 -21.422 6.318 1.274 1.00 1.30 H new HETATM 0 H4 BGC A 192 -19.373 8.158 2.651 1.00 1.26 H new HETATM 0 H3 BGC A 192 -19.863 7.675 -0.364 1.00 1.44 H new HETATM 0 H2 BGC A 192 -20.384 10.331 1.083 1.00 1.56 H new HETATM 0 H1 BGC A 192 -22.409 8.330 0.001 1.00 1.63 H new