USER MOD reduce.3.24.130724 H: found=0, std=0, add=817, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 817 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 52 GLN : amide:sc= -1.88 K(o=-8.8,f=-15!) USER MOD Set 1.2: A 116 MET CE :methyl -176:sc=-0.00411 (180deg=-0.0382) USER MOD Set 1.3: A 121 GLN : amide:sc= -6.89! C(o=-8.8!,f=-8.6!) USER MOD Set 2.1: A 79 LYS NZ :NH3+ 140:sc= -1.2 (180deg=0) USER MOD Set 2.2: A 86 HIS : no HD1:sc= -2.22 K(o=-3.4,f=-5!) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 33 SER OG : rot -57:sc= 0.177 USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 36 SER OG : rot 180:sc= -0.0143 USER MOD Single : A 40 MET CE :methyl 131:sc= -0.287 (180deg=-1.27) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 HIS : no HD1:sc= -0.105 K(o=-0.1,f=-1.2) USER MOD Single : A 47 LYS NZ :NH3+ -145:sc= -0.0809 (180deg=-1.35!) USER MOD Single : A 60 GLN : amide:sc= 0 K(o=0,f=-0.52) USER MOD Single : A 63 LYS NZ :NH3+ -118:sc= -0.0689 (180deg=-0.261) USER MOD Single : A 73 TYR OH : rot 180:sc=-0.00847 USER MOD Single : A 76 THR OG1 : rot 13:sc= 0.00385 USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 CYS SG : rot 180:sc= -0.0374 USER MOD Single : A 93 THR OG1 : rot 141:sc= 0.238 USER MOD Single : A 94 TYR OH : rot 6:sc= 0.533 USER MOD Single : A 95 CYS SG : rot 88:sc= -0.495 USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 GLN : amide:sc= -0.751 X(o=-0.75,f=-0.33) USER MOD Single : A 105 SER OG : rot -42:sc= 0.0345 USER MOD Single : A 108 HIS : no HD1:sc=-0.00827 K(o=-0.0083,f=-4.1!) USER MOD Single : A 110 GLN : amide:sc= -0.283 X(o=-0.28,f=-0.057) USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 THR OG1 : rot 180:sc= -0.0165 USER MOD Single : A 117 ASN : amide:sc= -0.623 K(o=-0.62,f=0.033) USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 133 SER OG : rot 180:sc= -0.0662 USER MOD Single : A 136 SER OG : rot 180:sc= -0.0456 USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 31 0.123 17.466 -27.336 1.00 0.00 N ATOM 2 CA GLY A 31 0.931 16.349 -27.792 1.00 0.00 C ATOM 3 C GLY A 31 0.163 15.410 -28.701 1.00 0.00 C ATOM 4 O GLY A 31 -0.910 15.754 -29.196 1.00 0.00 O ATOM 0 HA2 GLY A 31 1.804 16.729 -28.322 1.00 0.00 H new ATOM 0 HA3 GLY A 31 1.298 15.794 -26.929 1.00 0.00 H new ATOM 8 N SER A 32 0.714 14.221 -28.923 1.00 0.00 N ATOM 9 CA SER A 32 0.077 13.232 -29.783 1.00 0.00 C ATOM 10 C SER A 32 0.046 11.864 -29.108 1.00 0.00 C ATOM 11 O SER A 32 1.052 11.403 -28.569 1.00 0.00 O ATOM 12 CB SER A 32 0.814 13.137 -31.120 1.00 0.00 C ATOM 13 OG SER A 32 0.769 14.370 -31.817 1.00 0.00 O ATOM 0 H SER A 32 1.601 13.920 -28.519 1.00 0.00 H new ATOM 0 HA SER A 32 -0.949 13.552 -29.964 1.00 0.00 H new ATOM 0 HB2 SER A 32 1.852 12.851 -30.947 1.00 0.00 H new ATOM 0 HB3 SER A 32 0.365 12.354 -31.731 1.00 0.00 H new ATOM 0 HG SER A 32 1.249 14.283 -32.667 1.00 0.00 H new ATOM 19 N SER A 33 -1.116 11.220 -29.143 1.00 0.00 N ATOM 20 CA SER A 33 -1.281 9.907 -28.531 1.00 0.00 C ATOM 21 C SER A 33 -1.184 9.999 -27.011 1.00 0.00 C ATOM 22 O SER A 33 -0.598 9.134 -26.362 1.00 0.00 O ATOM 23 CB SER A 33 -0.224 8.937 -29.063 1.00 0.00 C ATOM 24 OG SER A 33 -0.559 7.596 -28.751 1.00 0.00 O ATOM 0 H SER A 33 -1.957 11.586 -29.589 1.00 0.00 H new ATOM 0 HA SER A 33 -2.271 9.534 -28.792 1.00 0.00 H new ATOM 0 HB2 SER A 33 -0.133 9.050 -30.143 1.00 0.00 H new ATOM 0 HB3 SER A 33 0.748 9.182 -28.634 1.00 0.00 H new ATOM 0 HG SER A 33 -0.661 7.501 -27.781 1.00 0.00 H new ATOM 30 N GLY A 34 -1.763 11.056 -26.450 1.00 0.00 N ATOM 31 CA GLY A 34 -1.731 11.244 -25.012 1.00 0.00 C ATOM 32 C GLY A 34 -0.392 11.760 -24.524 1.00 0.00 C ATOM 33 O GLY A 34 0.321 12.446 -25.258 1.00 0.00 O ATOM 0 H GLY A 34 -2.254 11.786 -26.966 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -2.514 11.945 -24.723 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -1.953 10.297 -24.520 1.00 0.00 H new ATOM 37 N SER A 35 -0.049 11.433 -23.282 1.00 0.00 N ATOM 38 CA SER A 35 1.211 11.874 -22.696 1.00 0.00 C ATOM 39 C SER A 35 2.295 10.817 -22.880 1.00 0.00 C ATOM 40 O SER A 35 2.006 9.623 -22.967 1.00 0.00 O ATOM 41 CB SER A 35 1.026 12.177 -21.207 1.00 0.00 C ATOM 42 OG SER A 35 -0.066 13.055 -20.997 1.00 0.00 O ATOM 0 H SER A 35 -0.626 10.864 -22.662 1.00 0.00 H new ATOM 0 HA SER A 35 1.524 12.783 -23.209 1.00 0.00 H new ATOM 0 HB2 SER A 35 0.860 11.248 -20.662 1.00 0.00 H new ATOM 0 HB3 SER A 35 1.937 12.623 -20.807 1.00 0.00 H new ATOM 0 HG SER A 35 -0.164 13.231 -20.038 1.00 0.00 H new ATOM 48 N SER A 36 3.545 11.265 -22.940 1.00 0.00 N ATOM 49 CA SER A 36 4.674 10.359 -23.118 1.00 0.00 C ATOM 50 C SER A 36 4.455 9.060 -22.348 1.00 0.00 C ATOM 51 O SER A 36 4.909 7.995 -22.764 1.00 0.00 O ATOM 52 CB SER A 36 5.970 11.027 -22.655 1.00 0.00 C ATOM 53 OG SER A 36 5.933 11.302 -21.265 1.00 0.00 O ATOM 0 H SER A 36 3.802 12.250 -22.868 1.00 0.00 H new ATOM 0 HA SER A 36 4.754 10.123 -24.179 1.00 0.00 H new ATOM 0 HB2 SER A 36 6.817 10.378 -22.878 1.00 0.00 H new ATOM 0 HB3 SER A 36 6.123 11.953 -23.208 1.00 0.00 H new ATOM 0 HG SER A 36 6.773 11.727 -20.993 1.00 0.00 H new ATOM 59 N GLY A 37 3.755 9.157 -21.222 1.00 0.00 N ATOM 60 CA GLY A 37 3.488 7.984 -20.411 1.00 0.00 C ATOM 61 C GLY A 37 4.411 7.885 -19.212 1.00 0.00 C ATOM 62 O GLY A 37 5.169 6.925 -19.081 1.00 0.00 O ATOM 0 H GLY A 37 3.368 10.027 -20.857 1.00 0.00 H new ATOM 0 HA2 GLY A 37 2.454 8.011 -20.068 1.00 0.00 H new ATOM 0 HA3 GLY A 37 3.597 7.090 -21.024 1.00 0.00 H new ATOM 66 N VAL A 38 4.348 8.882 -18.335 1.00 0.00 N ATOM 67 CA VAL A 38 5.184 8.904 -17.141 1.00 0.00 C ATOM 68 C VAL A 38 4.341 9.078 -15.883 1.00 0.00 C ATOM 69 O VAL A 38 3.358 9.818 -15.862 1.00 0.00 O ATOM 70 CB VAL A 38 6.227 10.036 -17.207 1.00 0.00 C ATOM 71 CG1 VAL A 38 7.163 9.831 -18.389 1.00 0.00 C ATOM 72 CG2 VAL A 38 5.539 11.390 -17.290 1.00 0.00 C ATOM 0 H VAL A 38 3.726 9.685 -18.429 1.00 0.00 H new ATOM 0 HA VAL A 38 5.701 7.945 -17.099 1.00 0.00 H new ATOM 0 HB VAL A 38 6.822 10.012 -16.294 1.00 0.00 H new ATOM 0 HG11 VAL A 38 7.893 10.640 -18.420 1.00 0.00 H new ATOM 0 HG12 VAL A 38 7.682 8.878 -18.281 1.00 0.00 H new ATOM 0 HG13 VAL A 38 6.586 9.828 -19.314 1.00 0.00 H new ATOM 0 HG21 VAL A 38 6.291 12.178 -17.336 1.00 0.00 H new ATOM 0 HG22 VAL A 38 4.918 11.428 -18.185 1.00 0.00 H new ATOM 0 HG23 VAL A 38 4.914 11.535 -16.409 1.00 0.00 H new ATOM 82 N PRO A 39 4.735 8.381 -14.807 1.00 0.00 N ATOM 83 CA PRO A 39 4.030 8.442 -13.523 1.00 0.00 C ATOM 84 C PRO A 39 4.199 9.791 -12.832 1.00 0.00 C ATOM 85 O PRO A 39 5.307 10.170 -12.454 1.00 0.00 O ATOM 86 CB PRO A 39 4.692 7.333 -12.701 1.00 0.00 C ATOM 87 CG PRO A 39 6.051 7.183 -13.294 1.00 0.00 C ATOM 88 CD PRO A 39 5.898 7.479 -14.760 1.00 0.00 C ATOM 0 HA PRO A 39 2.954 8.317 -13.643 1.00 0.00 H new ATOM 0 HB2 PRO A 39 4.748 7.601 -11.646 1.00 0.00 H new ATOM 0 HB3 PRO A 39 4.128 6.403 -12.764 1.00 0.00 H new ATOM 0 HG2 PRO A 39 6.758 7.870 -12.829 1.00 0.00 H new ATOM 0 HG3 PRO A 39 6.436 6.175 -13.137 1.00 0.00 H new ATOM 0 HD2 PRO A 39 6.790 7.952 -15.169 1.00 0.00 H new ATOM 0 HD3 PRO A 39 5.726 6.571 -15.337 1.00 0.00 H new ATOM 96 N MET A 40 3.093 10.510 -12.671 1.00 0.00 N ATOM 97 CA MET A 40 3.120 11.817 -12.024 1.00 0.00 C ATOM 98 C MET A 40 2.217 11.834 -10.795 1.00 0.00 C ATOM 99 O MET A 40 1.177 11.175 -10.767 1.00 0.00 O ATOM 100 CB MET A 40 2.685 12.906 -13.006 1.00 0.00 C ATOM 101 CG MET A 40 1.235 12.782 -13.447 1.00 0.00 C ATOM 102 SD MET A 40 0.103 13.689 -12.376 1.00 0.00 S ATOM 103 CE MET A 40 0.693 15.365 -12.602 1.00 0.00 C ATOM 0 H MET A 40 2.168 10.210 -12.979 1.00 0.00 H new ATOM 0 HA MET A 40 4.143 12.015 -11.704 1.00 0.00 H new ATOM 0 HB2 MET A 40 2.833 13.882 -12.543 1.00 0.00 H new ATOM 0 HB3 MET A 40 3.328 12.869 -13.885 1.00 0.00 H new ATOM 0 HG2 MET A 40 1.137 13.151 -14.468 1.00 0.00 H new ATOM 0 HG3 MET A 40 0.952 11.729 -13.460 1.00 0.00 H new ATOM 0 HE1 MET A 40 -0.150 16.021 -12.819 1.00 0.00 H new ATOM 0 HE2 MET A 40 1.191 15.701 -11.692 1.00 0.00 H new ATOM 0 HE3 MET A 40 1.398 15.394 -13.433 1.00 0.00 H new ATOM 113 N LYS A 41 2.620 12.590 -9.780 1.00 0.00 N ATOM 114 CA LYS A 41 1.847 12.694 -8.548 1.00 0.00 C ATOM 115 C LYS A 41 1.622 14.154 -8.168 1.00 0.00 C ATOM 116 O LYS A 41 1.993 15.063 -8.911 1.00 0.00 O ATOM 117 CB LYS A 41 2.563 11.964 -7.409 1.00 0.00 C ATOM 118 CG LYS A 41 3.783 12.703 -6.885 1.00 0.00 C ATOM 119 CD LYS A 41 5.039 12.318 -7.649 1.00 0.00 C ATOM 120 CE LYS A 41 6.228 13.170 -7.232 1.00 0.00 C ATOM 121 NZ LYS A 41 6.311 14.430 -8.021 1.00 0.00 N ATOM 0 H LYS A 41 3.479 13.141 -9.786 1.00 0.00 H new ATOM 0 HA LYS A 41 0.877 12.227 -8.717 1.00 0.00 H new ATOM 0 HB2 LYS A 41 1.861 11.811 -6.589 1.00 0.00 H new ATOM 0 HB3 LYS A 41 2.868 10.977 -7.756 1.00 0.00 H new ATOM 0 HG2 LYS A 41 3.621 13.778 -6.967 1.00 0.00 H new ATOM 0 HG3 LYS A 41 3.917 12.481 -5.826 1.00 0.00 H new ATOM 0 HD2 LYS A 41 5.265 11.266 -7.474 1.00 0.00 H new ATOM 0 HD3 LYS A 41 4.865 12.433 -8.719 1.00 0.00 H new ATOM 0 HE2 LYS A 41 6.149 13.410 -6.172 1.00 0.00 H new ATOM 0 HE3 LYS A 41 7.147 12.599 -7.362 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 7.134 14.983 -7.707 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 6.412 14.201 -9.031 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 5.445 14.987 -7.877 1.00 0.00 H new ATOM 135 N ASP A 42 1.014 14.372 -7.007 1.00 0.00 N ATOM 136 CA ASP A 42 0.743 15.722 -6.527 1.00 0.00 C ATOM 137 C ASP A 42 1.761 16.138 -5.471 1.00 0.00 C ATOM 138 O ASP A 42 2.352 15.295 -4.796 1.00 0.00 O ATOM 139 CB ASP A 42 -0.672 15.806 -5.951 1.00 0.00 C ATOM 140 CG ASP A 42 -1.736 15.822 -7.031 1.00 0.00 C ATOM 141 OD1 ASP A 42 -2.000 14.753 -7.620 1.00 0.00 O ATOM 142 OD2 ASP A 42 -2.307 16.903 -7.285 1.00 0.00 O ATOM 0 H ASP A 42 0.699 13.631 -6.381 1.00 0.00 H new ATOM 0 HA ASP A 42 0.824 16.405 -7.372 1.00 0.00 H new ATOM 0 HB2 ASP A 42 -0.843 14.957 -5.289 1.00 0.00 H new ATOM 0 HB3 ASP A 42 -0.761 16.707 -5.344 1.00 0.00 H new ATOM 147 N HIS A 43 1.963 17.445 -5.333 1.00 0.00 N ATOM 148 CA HIS A 43 2.911 17.974 -4.359 1.00 0.00 C ATOM 149 C HIS A 43 2.459 17.661 -2.936 1.00 0.00 C ATOM 150 O HIS A 43 3.278 17.558 -2.022 1.00 0.00 O ATOM 151 CB HIS A 43 3.068 19.484 -4.537 1.00 0.00 C ATOM 152 CG HIS A 43 1.846 20.262 -4.156 1.00 0.00 C ATOM 153 ND1 HIS A 43 0.723 20.337 -4.952 1.00 0.00 N ATOM 154 CD2 HIS A 43 1.575 21.002 -3.055 1.00 0.00 C ATOM 155 CE1 HIS A 43 -0.186 21.089 -4.358 1.00 0.00 C ATOM 156 NE2 HIS A 43 0.306 21.505 -3.205 1.00 0.00 N ATOM 0 H HIS A 43 1.483 18.157 -5.883 1.00 0.00 H new ATOM 0 HA HIS A 43 3.875 17.494 -4.529 1.00 0.00 H new ATOM 0 HB2 HIS A 43 3.909 19.827 -3.935 1.00 0.00 H new ATOM 0 HB3 HIS A 43 3.313 19.695 -5.578 1.00 0.00 H new ATOM 0 HD2 HIS A 43 2.234 21.166 -2.215 1.00 0.00 H new ATOM 0 HE1 HIS A 43 -1.165 21.324 -4.749 1.00 0.00 H new ATOM 0 HE2 HIS A 43 -0.178 22.103 -2.535 1.00 0.00 H new ATOM 165 N ASP A 44 1.151 17.513 -2.755 1.00 0.00 N ATOM 166 CA ASP A 44 0.590 17.212 -1.443 1.00 0.00 C ATOM 167 C ASP A 44 -0.029 15.818 -1.424 1.00 0.00 C ATOM 168 O ASP A 44 -0.960 15.551 -0.664 1.00 0.00 O ATOM 169 CB ASP A 44 -0.462 18.255 -1.063 1.00 0.00 C ATOM 170 CG ASP A 44 0.140 19.455 -0.359 1.00 0.00 C ATOM 171 OD1 ASP A 44 1.098 19.266 0.421 1.00 0.00 O ATOM 172 OD2 ASP A 44 -0.346 20.582 -0.587 1.00 0.00 O ATOM 0 H ASP A 44 0.460 17.597 -3.500 1.00 0.00 H new ATOM 0 HA ASP A 44 1.400 17.241 -0.714 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -0.981 18.588 -1.962 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -1.209 17.795 -0.416 1.00 0.00 H new ATOM 177 N ALA A 45 0.495 14.932 -2.265 1.00 0.00 N ATOM 178 CA ALA A 45 -0.005 13.565 -2.343 1.00 0.00 C ATOM 179 C ALA A 45 0.108 12.861 -0.995 1.00 0.00 C ATOM 180 O ALA A 45 0.592 13.438 -0.021 1.00 0.00 O ATOM 181 CB ALA A 45 0.750 12.787 -3.411 1.00 0.00 C ATOM 0 H ALA A 45 1.265 15.137 -2.902 1.00 0.00 H new ATOM 0 HA ALA A 45 -1.060 13.606 -2.615 1.00 0.00 H new ATOM 0 HB1 ALA A 45 0.366 11.768 -3.458 1.00 0.00 H new ATOM 0 HB2 ALA A 45 0.614 13.271 -4.378 1.00 0.00 H new ATOM 0 HB3 ALA A 45 1.811 12.764 -3.163 1.00 0.00 H new ATOM 187 N ILE A 46 -0.342 11.612 -0.946 1.00 0.00 N ATOM 188 CA ILE A 46 -0.291 10.830 0.283 1.00 0.00 C ATOM 189 C ILE A 46 0.071 9.376 -0.005 1.00 0.00 C ATOM 190 O ILE A 46 -0.336 8.813 -1.021 1.00 0.00 O ATOM 191 CB ILE A 46 -1.635 10.873 1.034 1.00 0.00 C ATOM 192 CG1 ILE A 46 -2.144 12.313 1.130 1.00 0.00 C ATOM 193 CG2 ILE A 46 -1.486 10.264 2.421 1.00 0.00 C ATOM 194 CD1 ILE A 46 -3.587 12.415 1.572 1.00 0.00 C ATOM 0 H ILE A 46 -0.746 11.120 -1.743 1.00 0.00 H new ATOM 0 HA ILE A 46 0.481 11.277 0.910 1.00 0.00 H new ATOM 0 HB ILE A 46 -2.365 10.286 0.477 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -1.518 12.865 1.831 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -2.035 12.794 0.158 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -2.444 10.302 2.940 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -1.163 9.227 2.330 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -0.744 10.827 2.988 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -3.880 13.464 1.618 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -4.224 11.891 0.859 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -3.698 11.964 2.558 1.00 0.00 H new ATOM 206 N LYS A 47 0.837 8.774 0.898 1.00 0.00 N ATOM 207 CA LYS A 47 1.253 7.384 0.745 1.00 0.00 C ATOM 208 C LYS A 47 0.483 6.478 1.700 1.00 0.00 C ATOM 209 O LYS A 47 0.614 6.589 2.919 1.00 0.00 O ATOM 210 CB LYS A 47 2.756 7.249 0.996 1.00 0.00 C ATOM 211 CG LYS A 47 3.248 5.812 0.985 1.00 0.00 C ATOM 212 CD LYS A 47 4.764 5.741 1.057 1.00 0.00 C ATOM 213 CE LYS A 47 5.256 5.765 2.496 1.00 0.00 C ATOM 214 NZ LYS A 47 5.334 7.152 3.033 1.00 0.00 N ATOM 0 H LYS A 47 1.183 9.227 1.744 1.00 0.00 H new ATOM 0 HA LYS A 47 1.033 7.075 -0.277 1.00 0.00 H new ATOM 0 HB2 LYS A 47 3.295 7.815 0.236 1.00 0.00 H new ATOM 0 HB3 LYS A 47 2.997 7.699 1.959 1.00 0.00 H new ATOM 0 HG2 LYS A 47 2.817 5.273 1.828 1.00 0.00 H new ATOM 0 HG3 LYS A 47 2.902 5.315 0.079 1.00 0.00 H new ATOM 0 HD2 LYS A 47 5.110 4.830 0.568 1.00 0.00 H new ATOM 0 HD3 LYS A 47 5.195 6.580 0.510 1.00 0.00 H new ATOM 0 HE2 LYS A 47 4.586 5.172 3.119 1.00 0.00 H new ATOM 0 HE3 LYS A 47 6.240 5.298 2.551 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 6.146 7.229 3.679 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 5.452 7.823 2.247 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 4.459 7.374 3.549 1.00 0.00 H new ATOM 228 N LEU A 48 -0.319 5.579 1.138 1.00 0.00 N ATOM 229 CA LEU A 48 -1.109 4.652 1.940 1.00 0.00 C ATOM 230 C LEU A 48 -0.293 3.415 2.304 1.00 0.00 C ATOM 231 O LEU A 48 0.505 2.927 1.503 1.00 0.00 O ATOM 232 CB LEU A 48 -2.371 4.238 1.182 1.00 0.00 C ATOM 233 CG LEU A 48 -3.463 5.303 1.065 1.00 0.00 C ATOM 234 CD1 LEU A 48 -4.587 4.817 0.164 1.00 0.00 C ATOM 235 CD2 LEU A 48 -3.999 5.669 2.441 1.00 0.00 C ATOM 0 H LEU A 48 -0.439 5.473 0.131 1.00 0.00 H new ATOM 0 HA LEU A 48 -1.396 5.160 2.861 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -2.083 3.930 0.177 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -2.796 3.363 1.674 1.00 0.00 H new ATOM 0 HG LEU A 48 -3.028 6.196 0.618 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -5.355 5.587 0.092 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -4.191 4.606 -0.829 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -5.022 3.909 0.582 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -4.775 6.428 2.339 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -4.419 4.782 2.916 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -3.188 6.060 3.055 1.00 0.00 H new ATOM 247 N PHE A 49 -0.499 2.912 3.517 1.00 0.00 N ATOM 248 CA PHE A 49 0.217 1.732 3.987 1.00 0.00 C ATOM 249 C PHE A 49 -0.758 0.635 4.403 1.00 0.00 C ATOM 250 O PHE A 49 -1.718 0.885 5.132 1.00 0.00 O ATOM 251 CB PHE A 49 1.126 2.095 5.163 1.00 0.00 C ATOM 252 CG PHE A 49 1.626 0.901 5.925 1.00 0.00 C ATOM 253 CD1 PHE A 49 2.718 0.180 5.469 1.00 0.00 C ATOM 254 CD2 PHE A 49 1.004 0.500 7.096 1.00 0.00 C ATOM 255 CE1 PHE A 49 3.180 -0.919 6.168 1.00 0.00 C ATOM 256 CE2 PHE A 49 1.462 -0.598 7.800 1.00 0.00 C ATOM 257 CZ PHE A 49 2.552 -1.308 7.335 1.00 0.00 C ATOM 0 H PHE A 49 -1.156 3.303 4.192 1.00 0.00 H new ATOM 0 HA PHE A 49 0.829 1.358 3.166 1.00 0.00 H new ATOM 0 HB2 PHE A 49 1.979 2.662 4.791 1.00 0.00 H new ATOM 0 HB3 PHE A 49 0.582 2.749 5.844 1.00 0.00 H new ATOM 0 HD1 PHE A 49 3.213 0.480 4.557 1.00 0.00 H new ATOM 0 HD2 PHE A 49 0.151 1.052 7.463 1.00 0.00 H new ATOM 0 HE1 PHE A 49 4.032 -1.473 5.802 1.00 0.00 H new ATOM 0 HE2 PHE A 49 0.969 -0.900 8.712 1.00 0.00 H new ATOM 0 HZ PHE A 49 2.913 -2.166 7.883 1.00 0.00 H new ATOM 267 N VAL A 50 -0.506 -0.583 3.933 1.00 0.00 N ATOM 268 CA VAL A 50 -1.360 -1.720 4.256 1.00 0.00 C ATOM 269 C VAL A 50 -0.680 -2.653 5.251 1.00 0.00 C ATOM 270 O VAL A 50 0.484 -3.014 5.084 1.00 0.00 O ATOM 271 CB VAL A 50 -1.733 -2.518 2.992 1.00 0.00 C ATOM 272 CG1 VAL A 50 -2.964 -3.375 3.246 1.00 0.00 C ATOM 273 CG2 VAL A 50 -1.960 -1.579 1.817 1.00 0.00 C ATOM 0 H VAL A 50 0.283 -0.807 3.327 1.00 0.00 H new ATOM 0 HA VAL A 50 -2.268 -1.317 4.704 1.00 0.00 H new ATOM 0 HB VAL A 50 -0.904 -3.180 2.743 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -3.213 -3.931 2.342 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -2.760 -4.073 4.058 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -3.803 -2.735 3.520 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -2.223 -2.160 0.933 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -2.771 -0.890 2.053 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -1.049 -1.013 1.622 1.00 0.00 H new ATOM 283 N GLY A 51 -1.416 -3.041 6.288 1.00 0.00 N ATOM 284 CA GLY A 51 -0.867 -3.930 7.296 1.00 0.00 C ATOM 285 C GLY A 51 -1.708 -5.176 7.489 1.00 0.00 C ATOM 286 O GLY A 51 -1.736 -5.750 8.577 1.00 0.00 O ATOM 0 H GLY A 51 -2.382 -2.756 6.448 1.00 0.00 H new ATOM 0 HA2 GLY A 51 0.144 -4.219 7.010 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -0.790 -3.397 8.244 1.00 0.00 H new ATOM 290 N GLN A 52 -2.396 -5.594 6.431 1.00 0.00 N ATOM 291 CA GLN A 52 -3.244 -6.779 6.491 1.00 0.00 C ATOM 292 C GLN A 52 -3.022 -7.669 5.273 1.00 0.00 C ATOM 293 O GLN A 52 -3.964 -8.260 4.744 1.00 0.00 O ATOM 294 CB GLN A 52 -4.716 -6.375 6.581 1.00 0.00 C ATOM 295 CG GLN A 52 -5.094 -5.743 7.911 1.00 0.00 C ATOM 296 CD GLN A 52 -4.603 -6.547 9.099 1.00 0.00 C ATOM 297 OE1 GLN A 52 -4.461 -7.768 9.022 1.00 0.00 O ATOM 298 NE2 GLN A 52 -4.339 -5.865 10.208 1.00 0.00 N ATOM 0 H GLN A 52 -2.383 -5.130 5.523 1.00 0.00 H new ATOM 0 HA GLN A 52 -2.975 -7.343 7.384 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -4.941 -5.673 5.778 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -5.336 -7.256 6.418 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -4.679 -4.736 7.962 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -6.178 -5.644 7.967 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -4.471 -4.854 10.228 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -4.005 -6.353 11.039 1.00 0.00 H new ATOM 307 N ILE A 53 -1.771 -7.759 4.832 1.00 0.00 N ATOM 308 CA ILE A 53 -1.427 -8.578 3.677 1.00 0.00 C ATOM 309 C ILE A 53 -0.803 -9.902 4.107 1.00 0.00 C ATOM 310 O ILE A 53 0.296 -9.948 4.661 1.00 0.00 O ATOM 311 CB ILE A 53 -0.450 -7.845 2.738 1.00 0.00 C ATOM 312 CG1 ILE A 53 -1.017 -6.479 2.343 1.00 0.00 C ATOM 313 CG2 ILE A 53 -0.171 -8.686 1.502 1.00 0.00 C ATOM 314 CD1 ILE A 53 0.009 -5.554 1.729 1.00 0.00 C ATOM 0 H ILE A 53 -0.980 -7.275 5.257 1.00 0.00 H new ATOM 0 HA ILE A 53 -2.356 -8.774 3.142 1.00 0.00 H new ATOM 0 HB ILE A 53 0.490 -7.689 3.266 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -1.833 -6.624 1.635 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -1.442 -6.002 3.226 1.00 0.00 H new ATOM 0 HG21 ILE A 53 0.521 -8.154 0.849 1.00 0.00 H new ATOM 0 HG22 ILE A 53 0.270 -9.637 1.801 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -1.104 -8.870 0.969 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -0.463 -4.605 1.474 1.00 0.00 H new ATOM 0 HD12 ILE A 53 0.814 -5.378 2.443 1.00 0.00 H new ATOM 0 HD13 ILE A 53 0.417 -6.010 0.827 1.00 0.00 H new ATOM 326 N PRO A 54 -1.518 -11.005 3.846 1.00 0.00 N ATOM 327 CA PRO A 54 -1.054 -12.351 4.195 1.00 0.00 C ATOM 328 C PRO A 54 0.128 -12.796 3.341 1.00 0.00 C ATOM 329 O PRO A 54 0.676 -12.012 2.566 1.00 0.00 O ATOM 330 CB PRO A 54 -2.275 -13.231 3.918 1.00 0.00 C ATOM 331 CG PRO A 54 -3.057 -12.483 2.894 1.00 0.00 C ATOM 332 CD PRO A 54 -2.836 -11.025 3.188 1.00 0.00 C ATOM 0 HA PRO A 54 -0.698 -12.405 5.224 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -1.979 -14.214 3.550 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -2.860 -13.392 4.823 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -2.722 -12.733 1.887 1.00 0.00 H new ATOM 0 HG3 PRO A 54 -4.116 -12.736 2.950 1.00 0.00 H new ATOM 0 HD2 PRO A 54 -2.839 -10.426 2.277 1.00 0.00 H new ATOM 0 HD3 PRO A 54 -3.615 -10.623 3.836 1.00 0.00 H new ATOM 340 N ARG A 55 0.516 -14.059 3.488 1.00 0.00 N ATOM 341 CA ARG A 55 1.634 -14.608 2.730 1.00 0.00 C ATOM 342 C ARG A 55 1.136 -15.471 1.574 1.00 0.00 C ATOM 343 O ARG A 55 0.466 -16.481 1.784 1.00 0.00 O ATOM 344 CB ARG A 55 2.541 -15.434 3.644 1.00 0.00 C ATOM 345 CG ARG A 55 1.859 -16.658 4.233 1.00 0.00 C ATOM 346 CD ARG A 55 2.693 -17.282 5.341 1.00 0.00 C ATOM 347 NE ARG A 55 2.203 -18.606 5.716 1.00 0.00 N ATOM 348 CZ ARG A 55 2.489 -19.195 6.872 1.00 0.00 C ATOM 349 NH1 ARG A 55 3.258 -18.580 7.760 1.00 0.00 N ATOM 350 NH2 ARG A 55 2.006 -20.401 7.140 1.00 0.00 N ATOM 0 H ARG A 55 0.073 -14.721 4.125 1.00 0.00 H new ATOM 0 HA ARG A 55 2.205 -13.776 2.319 1.00 0.00 H new ATOM 0 HB2 ARG A 55 3.418 -15.753 3.080 1.00 0.00 H new ATOM 0 HB3 ARG A 55 2.898 -14.801 4.456 1.00 0.00 H new ATOM 0 HG2 ARG A 55 0.882 -16.377 4.626 1.00 0.00 H new ATOM 0 HG3 ARG A 55 1.687 -17.394 3.447 1.00 0.00 H new ATOM 0 HD2 ARG A 55 3.730 -17.358 5.015 1.00 0.00 H new ATOM 0 HD3 ARG A 55 2.681 -16.630 6.215 1.00 0.00 H new ATOM 0 HE ARG A 55 1.609 -19.106 5.054 1.00 0.00 H new ATOM 0 HH11 ARG A 55 3.631 -17.653 7.556 1.00 0.00 H new ATOM 0 HH12 ARG A 55 3.476 -19.034 8.647 1.00 0.00 H new ATOM 0 HH21 ARG A 55 1.415 -20.877 6.458 1.00 0.00 H new ATOM 0 HH22 ARG A 55 2.226 -20.853 8.028 1.00 0.00 H new ATOM 364 N GLY A 56 1.468 -15.064 0.352 1.00 0.00 N ATOM 365 CA GLY A 56 1.045 -15.811 -0.818 1.00 0.00 C ATOM 366 C GLY A 56 0.733 -14.912 -1.998 1.00 0.00 C ATOM 367 O GLY A 56 0.871 -15.319 -3.152 1.00 0.00 O ATOM 0 H GLY A 56 2.022 -14.231 0.152 1.00 0.00 H new ATOM 0 HA2 GLY A 56 1.828 -16.515 -1.099 1.00 0.00 H new ATOM 0 HA3 GLY A 56 0.162 -16.399 -0.570 1.00 0.00 H new ATOM 371 N LEU A 57 0.308 -13.687 -1.709 1.00 0.00 N ATOM 372 CA LEU A 57 -0.027 -12.727 -2.755 1.00 0.00 C ATOM 373 C LEU A 57 1.116 -11.741 -2.977 1.00 0.00 C ATOM 374 O LEU A 57 2.125 -11.777 -2.272 1.00 0.00 O ATOM 375 CB LEU A 57 -1.305 -11.970 -2.390 1.00 0.00 C ATOM 376 CG LEU A 57 -2.557 -12.825 -2.188 1.00 0.00 C ATOM 377 CD1 LEU A 57 -3.724 -11.963 -1.731 1.00 0.00 C ATOM 378 CD2 LEU A 57 -2.909 -13.566 -3.469 1.00 0.00 C ATOM 0 H LEU A 57 0.187 -13.335 -0.759 1.00 0.00 H new ATOM 0 HA LEU A 57 -0.191 -13.279 -3.681 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -1.122 -11.408 -1.474 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -1.509 -11.242 -3.175 1.00 0.00 H new ATOM 0 HG LEU A 57 -2.349 -13.561 -1.411 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -4.606 -12.588 -1.592 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -3.471 -11.478 -0.788 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -3.932 -11.204 -2.485 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -3.802 -14.169 -3.307 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -3.097 -12.846 -4.266 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -2.080 -14.214 -3.754 1.00 0.00 H new ATOM 390 N ASP A 58 0.949 -10.861 -3.957 1.00 0.00 N ATOM 391 CA ASP A 58 1.965 -9.862 -4.269 1.00 0.00 C ATOM 392 C ASP A 58 1.322 -8.558 -4.729 1.00 0.00 C ATOM 393 O ASP A 58 0.099 -8.426 -4.732 1.00 0.00 O ATOM 394 CB ASP A 58 2.912 -10.387 -5.350 1.00 0.00 C ATOM 395 CG ASP A 58 3.443 -11.771 -5.032 1.00 0.00 C ATOM 396 OD1 ASP A 58 2.748 -12.760 -5.346 1.00 0.00 O ATOM 397 OD2 ASP A 58 4.554 -11.865 -4.470 1.00 0.00 O ATOM 0 H ASP A 58 0.120 -10.819 -4.550 1.00 0.00 H new ATOM 0 HA ASP A 58 2.535 -9.664 -3.361 1.00 0.00 H new ATOM 0 HB2 ASP A 58 2.389 -10.412 -6.306 1.00 0.00 H new ATOM 0 HB3 ASP A 58 3.748 -9.697 -5.463 1.00 0.00 H new ATOM 402 N GLU A 59 2.156 -7.597 -5.115 1.00 0.00 N ATOM 403 CA GLU A 59 1.667 -6.302 -5.575 1.00 0.00 C ATOM 404 C GLU A 59 0.784 -6.460 -6.809 1.00 0.00 C ATOM 405 O GLU A 59 -0.057 -5.608 -7.096 1.00 0.00 O ATOM 406 CB GLU A 59 2.841 -5.372 -5.890 1.00 0.00 C ATOM 407 CG GLU A 59 3.872 -5.294 -4.777 1.00 0.00 C ATOM 408 CD GLU A 59 5.265 -4.991 -5.292 1.00 0.00 C ATOM 409 OE1 GLU A 59 5.378 -4.405 -6.389 1.00 0.00 O ATOM 410 OE2 GLU A 59 6.243 -5.340 -4.597 1.00 0.00 O ATOM 0 H GLU A 59 3.172 -7.690 -5.118 1.00 0.00 H new ATOM 0 HA GLU A 59 1.069 -5.864 -4.776 1.00 0.00 H new ATOM 0 HB2 GLU A 59 3.329 -5.714 -6.803 1.00 0.00 H new ATOM 0 HB3 GLU A 59 2.457 -4.371 -6.089 1.00 0.00 H new ATOM 0 HG2 GLU A 59 3.576 -4.523 -4.066 1.00 0.00 H new ATOM 0 HG3 GLU A 59 3.887 -6.239 -4.234 1.00 0.00 H new ATOM 417 N GLN A 60 0.981 -7.556 -7.534 1.00 0.00 N ATOM 418 CA GLN A 60 0.204 -7.826 -8.738 1.00 0.00 C ATOM 419 C GLN A 60 -1.231 -8.204 -8.385 1.00 0.00 C ATOM 420 O GLN A 60 -2.144 -8.039 -9.195 1.00 0.00 O ATOM 421 CB GLN A 60 0.854 -8.947 -9.550 1.00 0.00 C ATOM 422 CG GLN A 60 0.737 -10.316 -8.901 1.00 0.00 C ATOM 423 CD GLN A 60 1.372 -11.413 -9.733 1.00 0.00 C ATOM 424 OE1 GLN A 60 2.376 -11.191 -10.410 1.00 0.00 O ATOM 425 NE2 GLN A 60 0.789 -12.605 -9.686 1.00 0.00 N ATOM 0 H GLN A 60 1.672 -8.272 -7.309 1.00 0.00 H new ATOM 0 HA GLN A 60 0.184 -6.917 -9.339 1.00 0.00 H new ATOM 0 HB2 GLN A 60 0.394 -8.982 -10.538 1.00 0.00 H new ATOM 0 HB3 GLN A 60 1.908 -8.713 -9.697 1.00 0.00 H new ATOM 0 HG2 GLN A 60 1.210 -10.290 -7.919 1.00 0.00 H new ATOM 0 HG3 GLN A 60 -0.316 -10.549 -8.742 1.00 0.00 H new ATOM 0 HE21 GLN A 60 -0.042 -12.744 -9.111 1.00 0.00 H new ATOM 0 HE22 GLN A 60 1.172 -13.382 -10.225 1.00 0.00 H new ATOM 434 N ASP A 61 -1.423 -8.713 -7.173 1.00 0.00 N ATOM 435 CA ASP A 61 -2.747 -9.114 -6.713 1.00 0.00 C ATOM 436 C ASP A 61 -3.446 -7.962 -5.998 1.00 0.00 C ATOM 437 O ASP A 61 -4.673 -7.940 -5.886 1.00 0.00 O ATOM 438 CB ASP A 61 -2.642 -10.322 -5.781 1.00 0.00 C ATOM 439 CG ASP A 61 -4.000 -10.852 -5.365 1.00 0.00 C ATOM 440 OD1 ASP A 61 -4.646 -10.219 -4.504 1.00 0.00 O ATOM 441 OD2 ASP A 61 -4.418 -11.900 -5.900 1.00 0.00 O ATOM 0 H ASP A 61 -0.678 -8.858 -6.491 1.00 0.00 H new ATOM 0 HA ASP A 61 -3.340 -9.389 -7.585 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -2.083 -11.114 -6.279 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -2.076 -10.043 -4.892 1.00 0.00 H new ATOM 446 N LEU A 62 -2.659 -7.008 -5.515 1.00 0.00 N ATOM 447 CA LEU A 62 -3.202 -5.853 -4.809 1.00 0.00 C ATOM 448 C LEU A 62 -3.464 -4.700 -5.772 1.00 0.00 C ATOM 449 O LEU A 62 -4.317 -3.848 -5.521 1.00 0.00 O ATOM 450 CB LEU A 62 -2.238 -5.404 -3.708 1.00 0.00 C ATOM 451 CG LEU A 62 -2.052 -6.375 -2.542 1.00 0.00 C ATOM 452 CD1 LEU A 62 -0.913 -5.918 -1.644 1.00 0.00 C ATOM 453 CD2 LEU A 62 -3.342 -6.504 -1.745 1.00 0.00 C ATOM 0 H LEU A 62 -1.642 -7.011 -5.599 1.00 0.00 H new ATOM 0 HA LEU A 62 -4.149 -6.147 -4.357 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -1.263 -5.219 -4.159 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -2.591 -4.453 -3.310 1.00 0.00 H new ATOM 0 HG LEU A 62 -1.798 -7.355 -2.947 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -0.795 -6.621 -0.819 1.00 0.00 H new ATOM 0 HD12 LEU A 62 0.011 -5.877 -2.221 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -1.137 -4.928 -1.247 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -3.191 -7.199 -0.919 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -3.625 -5.528 -1.351 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -4.135 -6.877 -2.393 1.00 0.00 H new ATOM 465 N LYS A 63 -2.727 -4.679 -6.877 1.00 0.00 N ATOM 466 CA LYS A 63 -2.881 -3.634 -7.881 1.00 0.00 C ATOM 467 C LYS A 63 -4.328 -3.546 -8.357 1.00 0.00 C ATOM 468 O LYS A 63 -4.905 -2.464 -8.468 1.00 0.00 O ATOM 469 CB LYS A 63 -1.957 -3.900 -9.072 1.00 0.00 C ATOM 470 CG LYS A 63 -1.438 -2.636 -9.734 1.00 0.00 C ATOM 471 CD LYS A 63 -0.337 -2.943 -10.736 1.00 0.00 C ATOM 472 CE LYS A 63 0.240 -1.670 -11.336 1.00 0.00 C ATOM 473 NZ LYS A 63 0.943 -0.844 -10.315 1.00 0.00 N ATOM 0 H LYS A 63 -2.016 -5.375 -7.100 1.00 0.00 H new ATOM 0 HA LYS A 63 -2.608 -2.683 -7.423 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -1.110 -4.499 -8.737 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -2.494 -4.493 -9.812 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -2.258 -2.125 -10.238 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -1.059 -1.955 -8.972 1.00 0.00 H new ATOM 0 HD2 LYS A 63 0.456 -3.507 -10.245 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -0.733 -3.575 -11.531 1.00 0.00 H new ATOM 0 HE2 LYS A 63 0.935 -1.928 -12.135 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -0.562 -1.085 -11.787 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 0.469 0.077 -10.227 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 0.921 -1.333 -9.398 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 1.931 -0.698 -10.606 1.00 0.00 H new ATOM 487 N PRO A 64 -4.929 -4.710 -8.645 1.00 0.00 N ATOM 488 CA PRO A 64 -6.316 -4.790 -9.112 1.00 0.00 C ATOM 489 C PRO A 64 -7.265 -3.957 -8.257 1.00 0.00 C ATOM 490 O PRO A 64 -7.981 -3.094 -8.767 1.00 0.00 O ATOM 491 CB PRO A 64 -6.648 -6.279 -8.982 1.00 0.00 C ATOM 492 CG PRO A 64 -5.333 -6.971 -9.089 1.00 0.00 C ATOM 493 CD PRO A 64 -4.301 -6.037 -8.536 1.00 0.00 C ATOM 0 HA PRO A 64 -6.428 -4.400 -10.124 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -7.133 -6.495 -8.030 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -7.331 -6.602 -9.768 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -5.344 -7.908 -8.532 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -5.111 -7.220 -10.127 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -4.056 -6.279 -7.502 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -3.372 -6.087 -9.104 1.00 0.00 H new ATOM 501 N LEU A 65 -7.265 -4.219 -6.954 1.00 0.00 N ATOM 502 CA LEU A 65 -8.126 -3.492 -6.028 1.00 0.00 C ATOM 503 C LEU A 65 -7.814 -1.999 -6.052 1.00 0.00 C ATOM 504 O LEU A 65 -8.694 -1.175 -6.303 1.00 0.00 O ATOM 505 CB LEU A 65 -7.956 -4.037 -4.609 1.00 0.00 C ATOM 506 CG LEU A 65 -8.522 -5.434 -4.354 1.00 0.00 C ATOM 507 CD1 LEU A 65 -8.116 -5.932 -2.975 1.00 0.00 C ATOM 508 CD2 LEU A 65 -10.037 -5.429 -4.496 1.00 0.00 C ATOM 0 H LEU A 65 -6.679 -4.929 -6.516 1.00 0.00 H new ATOM 0 HA LEU A 65 -9.160 -3.633 -6.344 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -6.892 -4.049 -4.371 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -8.430 -3.343 -3.915 1.00 0.00 H new ATOM 0 HG LEU A 65 -8.109 -6.114 -5.099 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -8.528 -6.928 -2.812 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -7.029 -5.974 -2.909 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -8.500 -5.251 -2.215 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -10.423 -6.431 -4.311 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -10.468 -4.735 -3.774 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -10.307 -5.117 -5.505 1.00 0.00 H new ATOM 520 N PHE A 66 -6.556 -1.658 -5.792 1.00 0.00 N ATOM 521 CA PHE A 66 -6.128 -0.264 -5.786 1.00 0.00 C ATOM 522 C PHE A 66 -6.422 0.402 -7.127 1.00 0.00 C ATOM 523 O PHE A 66 -6.632 1.612 -7.197 1.00 0.00 O ATOM 524 CB PHE A 66 -4.633 -0.170 -5.474 1.00 0.00 C ATOM 525 CG PHE A 66 -4.272 -0.678 -4.107 1.00 0.00 C ATOM 526 CD1 PHE A 66 -5.017 -0.311 -2.998 1.00 0.00 C ATOM 527 CD2 PHE A 66 -3.189 -1.524 -3.932 1.00 0.00 C ATOM 528 CE1 PHE A 66 -4.687 -0.777 -1.740 1.00 0.00 C ATOM 529 CE2 PHE A 66 -2.854 -1.993 -2.676 1.00 0.00 C ATOM 530 CZ PHE A 66 -3.605 -1.620 -1.578 1.00 0.00 C ATOM 0 H PHE A 66 -5.816 -2.328 -5.583 1.00 0.00 H new ATOM 0 HA PHE A 66 -6.688 0.259 -5.011 1.00 0.00 H new ATOM 0 HB2 PHE A 66 -4.078 -0.737 -6.222 1.00 0.00 H new ATOM 0 HB3 PHE A 66 -4.316 0.869 -5.562 1.00 0.00 H new ATOM 0 HD1 PHE A 66 -5.865 0.347 -3.118 1.00 0.00 H new ATOM 0 HD2 PHE A 66 -2.600 -1.820 -4.787 1.00 0.00 H new ATOM 0 HE1 PHE A 66 -5.275 -0.482 -0.883 1.00 0.00 H new ATOM 0 HE2 PHE A 66 -2.006 -2.650 -2.553 1.00 0.00 H new ATOM 0 HZ PHE A 66 -3.347 -1.987 -0.596 1.00 0.00 H new ATOM 540 N GLU A 67 -6.435 -0.399 -8.188 1.00 0.00 N ATOM 541 CA GLU A 67 -6.702 0.113 -9.527 1.00 0.00 C ATOM 542 C GLU A 67 -8.193 0.378 -9.721 1.00 0.00 C ATOM 543 O GLU A 67 -8.609 0.920 -10.744 1.00 0.00 O ATOM 544 CB GLU A 67 -6.207 -0.876 -10.584 1.00 0.00 C ATOM 545 CG GLU A 67 -4.769 -0.640 -11.013 1.00 0.00 C ATOM 546 CD GLU A 67 -4.660 0.305 -12.194 1.00 0.00 C ATOM 547 OE1 GLU A 67 -5.607 0.349 -13.007 1.00 0.00 O ATOM 548 OE2 GLU A 67 -3.629 1.000 -12.305 1.00 0.00 O ATOM 0 H GLU A 67 -6.264 -1.404 -8.146 1.00 0.00 H new ATOM 0 HA GLU A 67 -6.165 1.055 -9.642 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -6.299 -1.889 -10.193 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -6.853 -0.813 -11.459 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -4.206 -0.233 -10.173 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -4.310 -1.594 -11.272 1.00 0.00 H new ATOM 555 N GLU A 68 -8.990 -0.008 -8.730 1.00 0.00 N ATOM 556 CA GLU A 68 -10.434 0.186 -8.792 1.00 0.00 C ATOM 557 C GLU A 68 -10.812 1.599 -8.358 1.00 0.00 C ATOM 558 O GLU A 68 -11.936 2.049 -8.580 1.00 0.00 O ATOM 559 CB GLU A 68 -11.148 -0.839 -7.908 1.00 0.00 C ATOM 560 CG GLU A 68 -12.652 -0.879 -8.116 1.00 0.00 C ATOM 561 CD GLU A 68 -13.052 -1.687 -9.335 1.00 0.00 C ATOM 562 OE1 GLU A 68 -12.405 -1.526 -10.391 1.00 0.00 O ATOM 563 OE2 GLU A 68 -14.011 -2.481 -9.234 1.00 0.00 O ATOM 0 H GLU A 68 -8.661 -0.457 -7.875 1.00 0.00 H new ATOM 0 HA GLU A 68 -10.749 0.045 -9.826 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -10.736 -1.828 -8.107 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -10.940 -0.612 -6.862 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -13.126 -1.304 -7.231 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -13.028 0.139 -8.220 1.00 0.00 H new ATOM 570 N PHE A 69 -9.864 2.295 -7.738 1.00 0.00 N ATOM 571 CA PHE A 69 -10.097 3.656 -7.271 1.00 0.00 C ATOM 572 C PHE A 69 -9.301 4.660 -8.101 1.00 0.00 C ATOM 573 O PHE A 69 -9.751 5.779 -8.340 1.00 0.00 O ATOM 574 CB PHE A 69 -9.717 3.783 -5.794 1.00 0.00 C ATOM 575 CG PHE A 69 -10.329 2.723 -4.924 1.00 0.00 C ATOM 576 CD1 PHE A 69 -11.573 2.916 -4.345 1.00 0.00 C ATOM 577 CD2 PHE A 69 -9.661 1.533 -4.686 1.00 0.00 C ATOM 578 CE1 PHE A 69 -12.138 1.942 -3.544 1.00 0.00 C ATOM 579 CE2 PHE A 69 -10.222 0.555 -3.886 1.00 0.00 C ATOM 580 CZ PHE A 69 -11.462 0.760 -3.315 1.00 0.00 C ATOM 0 H PHE A 69 -8.928 1.938 -7.548 1.00 0.00 H new ATOM 0 HA PHE A 69 -11.158 3.876 -7.386 1.00 0.00 H new ATOM 0 HB2 PHE A 69 -8.632 3.736 -5.701 1.00 0.00 H new ATOM 0 HB3 PHE A 69 -10.026 4.763 -5.431 1.00 0.00 H new ATOM 0 HD1 PHE A 69 -12.107 3.838 -4.522 1.00 0.00 H new ATOM 0 HD2 PHE A 69 -8.691 1.367 -5.131 1.00 0.00 H new ATOM 0 HE1 PHE A 69 -13.108 2.105 -3.097 1.00 0.00 H new ATOM 0 HE2 PHE A 69 -9.691 -0.368 -3.708 1.00 0.00 H new ATOM 0 HZ PHE A 69 -11.903 -0.003 -2.690 1.00 0.00 H new ATOM 590 N GLY A 70 -8.114 4.248 -8.536 1.00 0.00 N ATOM 591 CA GLY A 70 -7.273 5.122 -9.334 1.00 0.00 C ATOM 592 C GLY A 70 -5.979 4.455 -9.756 1.00 0.00 C ATOM 593 O GLY A 70 -5.701 3.322 -9.363 1.00 0.00 O ATOM 0 H GLY A 70 -7.720 3.326 -8.350 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -7.821 5.438 -10.221 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -7.045 6.022 -8.763 1.00 0.00 H new ATOM 597 N ARG A 71 -5.188 5.157 -10.561 1.00 0.00 N ATOM 598 CA ARG A 71 -3.919 4.624 -11.040 1.00 0.00 C ATOM 599 C ARG A 71 -2.842 4.735 -9.964 1.00 0.00 C ATOM 600 O ARG A 71 -2.594 5.816 -9.429 1.00 0.00 O ATOM 601 CB ARG A 71 -3.472 5.367 -12.300 1.00 0.00 C ATOM 602 CG ARG A 71 -2.180 4.833 -12.897 1.00 0.00 C ATOM 603 CD ARG A 71 -1.811 5.568 -14.176 1.00 0.00 C ATOM 604 NE ARG A 71 -0.469 5.225 -14.636 1.00 0.00 N ATOM 605 CZ ARG A 71 -0.177 4.100 -15.278 1.00 0.00 C ATOM 606 NH1 ARG A 71 -1.129 3.213 -15.534 1.00 0.00 N ATOM 607 NH2 ARG A 71 1.069 3.859 -15.665 1.00 0.00 N ATOM 0 H ARG A 71 -5.404 6.096 -10.895 1.00 0.00 H new ATOM 0 HA ARG A 71 -4.064 3.570 -11.279 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -4.262 5.303 -13.049 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -3.343 6.423 -12.062 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -1.373 4.936 -12.171 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -2.287 3.769 -13.106 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -2.534 5.326 -14.955 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -1.873 6.643 -14.007 1.00 0.00 H new ATOM 0 HE ARG A 71 0.286 5.886 -14.454 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -2.088 3.394 -15.238 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -0.902 2.350 -16.027 1.00 0.00 H new ATOM 0 HH21 ARG A 71 1.804 4.538 -15.469 1.00 0.00 H new ATOM 0 HH22 ARG A 71 1.292 2.994 -16.158 1.00 0.00 H new ATOM 621 N ILE A 72 -2.208 3.610 -9.651 1.00 0.00 N ATOM 622 CA ILE A 72 -1.159 3.581 -8.640 1.00 0.00 C ATOM 623 C ILE A 72 0.095 4.298 -9.128 1.00 0.00 C ATOM 624 O ILE A 72 0.380 4.327 -10.325 1.00 0.00 O ATOM 625 CB ILE A 72 -0.792 2.137 -8.250 1.00 0.00 C ATOM 626 CG1 ILE A 72 -2.030 1.391 -7.746 1.00 0.00 C ATOM 627 CG2 ILE A 72 0.301 2.135 -7.192 1.00 0.00 C ATOM 628 CD1 ILE A 72 -1.854 -0.111 -7.702 1.00 0.00 C ATOM 0 H ILE A 72 -2.403 2.707 -10.083 1.00 0.00 H new ATOM 0 HA ILE A 72 -1.552 4.097 -7.764 1.00 0.00 H new ATOM 0 HB ILE A 72 -0.416 1.623 -9.134 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -2.278 1.749 -6.747 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -2.876 1.631 -8.390 1.00 0.00 H new ATOM 0 HG21 ILE A 72 0.549 1.107 -6.927 1.00 0.00 H new ATOM 0 HG22 ILE A 72 1.188 2.633 -7.584 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -0.050 2.664 -6.306 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -2.770 -0.574 -7.335 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -1.636 -0.481 -8.704 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -1.029 -0.361 -7.035 1.00 0.00 H new ATOM 640 N TYR A 73 0.842 4.874 -8.193 1.00 0.00 N ATOM 641 CA TYR A 73 2.066 5.592 -8.527 1.00 0.00 C ATOM 642 C TYR A 73 3.298 4.772 -8.156 1.00 0.00 C ATOM 643 O TYR A 73 4.328 4.842 -8.825 1.00 0.00 O ATOM 644 CB TYR A 73 2.103 6.942 -7.809 1.00 0.00 C ATOM 645 CG TYR A 73 3.286 7.801 -8.195 1.00 0.00 C ATOM 646 CD1 TYR A 73 4.578 7.446 -7.824 1.00 0.00 C ATOM 647 CD2 TYR A 73 3.113 8.968 -8.929 1.00 0.00 C ATOM 648 CE1 TYR A 73 5.661 8.228 -8.174 1.00 0.00 C ATOM 649 CE2 TYR A 73 4.191 9.755 -9.284 1.00 0.00 C ATOM 650 CZ TYR A 73 5.463 9.381 -8.904 1.00 0.00 C ATOM 651 OH TYR A 73 6.539 10.164 -9.255 1.00 0.00 O ATOM 0 H TYR A 73 0.621 4.858 -7.197 1.00 0.00 H new ATOM 0 HA TYR A 73 2.075 5.760 -9.604 1.00 0.00 H new ATOM 0 HB2 TYR A 73 1.184 7.485 -8.027 1.00 0.00 H new ATOM 0 HB3 TYR A 73 2.125 6.771 -6.733 1.00 0.00 H new ATOM 0 HD1 TYR A 73 4.737 6.544 -7.253 1.00 0.00 H new ATOM 0 HD2 TYR A 73 2.118 9.265 -9.227 1.00 0.00 H new ATOM 0 HE1 TYR A 73 6.658 7.938 -7.877 1.00 0.00 H new ATOM 0 HE2 TYR A 73 4.039 10.658 -9.856 1.00 0.00 H new ATOM 0 HH TYR A 73 6.227 10.938 -9.768 1.00 0.00 H new ATOM 661 N GLU A 74 3.182 3.994 -7.084 1.00 0.00 N ATOM 662 CA GLU A 74 4.285 3.160 -6.623 1.00 0.00 C ATOM 663 C GLU A 74 3.800 2.127 -5.610 1.00 0.00 C ATOM 664 O GLU A 74 3.163 2.470 -4.613 1.00 0.00 O ATOM 665 CB GLU A 74 5.382 4.026 -6.000 1.00 0.00 C ATOM 666 CG GLU A 74 6.504 3.223 -5.364 1.00 0.00 C ATOM 667 CD GLU A 74 7.245 4.001 -4.294 1.00 0.00 C ATOM 668 OE1 GLU A 74 6.575 4.607 -3.431 1.00 0.00 O ATOM 669 OE2 GLU A 74 8.493 4.003 -4.318 1.00 0.00 O ATOM 0 H GLU A 74 2.336 3.924 -6.519 1.00 0.00 H new ATOM 0 HA GLU A 74 4.694 2.633 -7.485 1.00 0.00 H new ATOM 0 HB2 GLU A 74 5.802 4.675 -6.769 1.00 0.00 H new ATOM 0 HB3 GLU A 74 4.937 4.674 -5.245 1.00 0.00 H new ATOM 0 HG2 GLU A 74 6.092 2.313 -4.927 1.00 0.00 H new ATOM 0 HG3 GLU A 74 7.208 2.915 -6.137 1.00 0.00 H new ATOM 676 N LEU A 75 4.106 0.862 -5.872 1.00 0.00 N ATOM 677 CA LEU A 75 3.701 -0.223 -4.984 1.00 0.00 C ATOM 678 C LEU A 75 4.895 -1.096 -4.612 1.00 0.00 C ATOM 679 O LEU A 75 5.546 -1.680 -5.479 1.00 0.00 O ATOM 680 CB LEU A 75 2.619 -1.076 -5.649 1.00 0.00 C ATOM 681 CG LEU A 75 1.869 -2.042 -4.732 1.00 0.00 C ATOM 682 CD1 LEU A 75 1.434 -1.339 -3.456 1.00 0.00 C ATOM 683 CD2 LEU A 75 0.666 -2.635 -5.452 1.00 0.00 C ATOM 0 H LEU A 75 4.633 0.561 -6.692 1.00 0.00 H new ATOM 0 HA LEU A 75 3.298 0.218 -4.072 1.00 0.00 H new ATOM 0 HB2 LEU A 75 1.893 -0.409 -6.113 1.00 0.00 H new ATOM 0 HB3 LEU A 75 3.080 -1.652 -6.451 1.00 0.00 H new ATOM 0 HG LEU A 75 2.544 -2.854 -4.463 1.00 0.00 H new ATOM 0 HD11 LEU A 75 0.902 -2.043 -2.816 1.00 0.00 H new ATOM 0 HD12 LEU A 75 2.312 -0.963 -2.930 1.00 0.00 H new ATOM 0 HD13 LEU A 75 0.776 -0.506 -3.705 1.00 0.00 H new ATOM 0 HD21 LEU A 75 0.144 -3.320 -4.784 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -0.010 -1.834 -5.751 1.00 0.00 H new ATOM 0 HD23 LEU A 75 1.002 -3.176 -6.337 1.00 0.00 H new ATOM 695 N THR A 76 5.177 -1.183 -3.316 1.00 0.00 N ATOM 696 CA THR A 76 6.291 -1.985 -2.828 1.00 0.00 C ATOM 697 C THR A 76 5.911 -2.742 -1.560 1.00 0.00 C ATOM 698 O THR A 76 5.400 -2.156 -0.605 1.00 0.00 O ATOM 699 CB THR A 76 7.528 -1.113 -2.540 1.00 0.00 C ATOM 700 OG1 THR A 76 8.176 -0.761 -3.767 1.00 0.00 O ATOM 701 CG2 THR A 76 8.507 -1.844 -1.634 1.00 0.00 C ATOM 0 H THR A 76 4.648 -0.707 -2.585 1.00 0.00 H new ATOM 0 HA THR A 76 6.534 -2.699 -3.615 1.00 0.00 H new ATOM 0 HB THR A 76 7.196 -0.207 -2.033 1.00 0.00 H new ATOM 0 HG1 THR A 76 7.588 -0.975 -4.521 1.00 0.00 H new ATOM 0 HG21 THR A 76 9.372 -1.208 -1.445 1.00 0.00 H new ATOM 0 HG22 THR A 76 8.019 -2.083 -0.689 1.00 0.00 H new ATOM 0 HG23 THR A 76 8.832 -2.765 -2.118 1.00 0.00 H new ATOM 709 N VAL A 77 6.163 -4.047 -1.557 1.00 0.00 N ATOM 710 CA VAL A 77 5.848 -4.884 -0.405 1.00 0.00 C ATOM 711 C VAL A 77 7.037 -4.981 0.544 1.00 0.00 C ATOM 712 O VAL A 77 8.184 -5.098 0.111 1.00 0.00 O ATOM 713 CB VAL A 77 5.434 -6.302 -0.839 1.00 0.00 C ATOM 714 CG1 VAL A 77 5.456 -7.252 0.349 1.00 0.00 C ATOM 715 CG2 VAL A 77 4.059 -6.280 -1.489 1.00 0.00 C ATOM 0 H VAL A 77 6.584 -4.548 -2.339 1.00 0.00 H new ATOM 0 HA VAL A 77 5.012 -4.412 0.111 1.00 0.00 H new ATOM 0 HB VAL A 77 6.153 -6.662 -1.575 1.00 0.00 H new ATOM 0 HG11 VAL A 77 5.161 -8.249 0.023 1.00 0.00 H new ATOM 0 HG12 VAL A 77 6.462 -7.290 0.766 1.00 0.00 H new ATOM 0 HG13 VAL A 77 4.761 -6.899 1.110 1.00 0.00 H new ATOM 0 HG21 VAL A 77 3.782 -7.291 -1.790 1.00 0.00 H new ATOM 0 HG22 VAL A 77 3.326 -5.900 -0.777 1.00 0.00 H new ATOM 0 HG23 VAL A 77 4.082 -5.634 -2.367 1.00 0.00 H new ATOM 725 N LEU A 78 6.756 -4.933 1.842 1.00 0.00 N ATOM 726 CA LEU A 78 7.802 -5.016 2.855 1.00 0.00 C ATOM 727 C LEU A 78 8.060 -6.466 3.253 1.00 0.00 C ATOM 728 O LEU A 78 7.162 -7.158 3.734 1.00 0.00 O ATOM 729 CB LEU A 78 7.413 -4.198 4.087 1.00 0.00 C ATOM 730 CG LEU A 78 7.546 -2.680 3.955 1.00 0.00 C ATOM 731 CD1 LEU A 78 6.625 -1.976 4.940 1.00 0.00 C ATOM 732 CD2 LEU A 78 8.989 -2.251 4.171 1.00 0.00 C ATOM 0 H LEU A 78 5.812 -4.837 2.217 1.00 0.00 H new ATOM 0 HA LEU A 78 8.718 -4.606 2.430 1.00 0.00 H new ATOM 0 HB2 LEU A 78 6.379 -4.431 4.341 1.00 0.00 H new ATOM 0 HB3 LEU A 78 8.029 -4.525 4.925 1.00 0.00 H new ATOM 0 HG LEU A 78 7.250 -2.395 2.945 1.00 0.00 H new ATOM 0 HD11 LEU A 78 6.733 -0.897 4.832 1.00 0.00 H new ATOM 0 HD12 LEU A 78 5.592 -2.259 4.738 1.00 0.00 H new ATOM 0 HD13 LEU A 78 6.889 -2.267 5.957 1.00 0.00 H new ATOM 0 HD21 LEU A 78 9.065 -1.168 4.073 1.00 0.00 H new ATOM 0 HD22 LEU A 78 9.312 -2.549 5.169 1.00 0.00 H new ATOM 0 HD23 LEU A 78 9.626 -2.728 3.426 1.00 0.00 H new ATOM 744 N LYS A 79 9.293 -6.919 3.053 1.00 0.00 N ATOM 745 CA LYS A 79 9.672 -8.285 3.394 1.00 0.00 C ATOM 746 C LYS A 79 10.925 -8.301 4.263 1.00 0.00 C ATOM 747 O LYS A 79 11.741 -7.381 4.210 1.00 0.00 O ATOM 748 CB LYS A 79 9.909 -9.103 2.123 1.00 0.00 C ATOM 749 CG LYS A 79 8.691 -9.189 1.219 1.00 0.00 C ATOM 750 CD LYS A 79 8.870 -10.245 0.141 1.00 0.00 C ATOM 751 CE LYS A 79 7.766 -10.170 -0.902 1.00 0.00 C ATOM 752 NZ LYS A 79 6.500 -10.784 -0.415 1.00 0.00 N ATOM 0 H LYS A 79 10.048 -6.359 2.656 1.00 0.00 H new ATOM 0 HA LYS A 79 8.854 -8.732 3.959 1.00 0.00 H new ATOM 0 HB2 LYS A 79 10.735 -8.661 1.565 1.00 0.00 H new ATOM 0 HB3 LYS A 79 10.216 -10.111 2.402 1.00 0.00 H new ATOM 0 HG2 LYS A 79 7.810 -9.423 1.816 1.00 0.00 H new ATOM 0 HG3 LYS A 79 8.513 -8.219 0.754 1.00 0.00 H new ATOM 0 HD2 LYS A 79 9.838 -10.113 -0.342 1.00 0.00 H new ATOM 0 HD3 LYS A 79 8.874 -11.235 0.597 1.00 0.00 H new ATOM 0 HE2 LYS A 79 7.586 -9.128 -1.166 1.00 0.00 H new ATOM 0 HE3 LYS A 79 8.090 -10.678 -1.811 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 5.693 -10.206 -0.723 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 6.407 -11.744 -0.805 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 6.515 -10.832 0.624 1.00 0.00 H new ATOM 766 N ASP A 80 11.073 -9.353 5.061 1.00 0.00 N ATOM 767 CA ASP A 80 12.229 -9.490 5.939 1.00 0.00 C ATOM 768 C ASP A 80 13.520 -9.562 5.131 1.00 0.00 C ATOM 769 O ASP A 80 13.494 -9.563 3.900 1.00 0.00 O ATOM 770 CB ASP A 80 12.088 -10.739 6.811 1.00 0.00 C ATOM 771 CG ASP A 80 11.336 -10.465 8.099 1.00 0.00 C ATOM 772 OD1 ASP A 80 11.407 -9.321 8.595 1.00 0.00 O ATOM 773 OD2 ASP A 80 10.677 -11.394 8.611 1.00 0.00 O ATOM 0 H ASP A 80 10.407 -10.123 5.118 1.00 0.00 H new ATOM 0 HA ASP A 80 12.273 -8.610 6.581 1.00 0.00 H new ATOM 0 HB2 ASP A 80 11.568 -11.514 6.248 1.00 0.00 H new ATOM 0 HB3 ASP A 80 13.079 -11.127 7.048 1.00 0.00 H new ATOM 778 N ARG A 81 14.648 -9.620 5.831 1.00 0.00 N ATOM 779 CA ARG A 81 15.950 -9.689 5.178 1.00 0.00 C ATOM 780 C ARG A 81 16.676 -10.979 5.548 1.00 0.00 C ATOM 781 O ARG A 81 17.262 -11.642 4.691 1.00 0.00 O ATOM 782 CB ARG A 81 16.804 -8.481 5.567 1.00 0.00 C ATOM 783 CG ARG A 81 17.852 -8.116 4.528 1.00 0.00 C ATOM 784 CD ARG A 81 18.763 -7.003 5.023 1.00 0.00 C ATOM 785 NE ARG A 81 18.110 -5.698 4.974 1.00 0.00 N ATOM 786 CZ ARG A 81 18.746 -4.550 5.181 1.00 0.00 C ATOM 787 NH1 ARG A 81 20.045 -4.547 5.448 1.00 0.00 N ATOM 788 NH2 ARG A 81 18.083 -3.403 5.119 1.00 0.00 N ATOM 0 H ARG A 81 14.687 -9.621 6.850 1.00 0.00 H new ATOM 0 HA ARG A 81 15.789 -9.679 4.100 1.00 0.00 H new ATOM 0 HB2 ARG A 81 16.152 -7.623 5.730 1.00 0.00 H new ATOM 0 HB3 ARG A 81 17.301 -8.688 6.515 1.00 0.00 H new ATOM 0 HG2 ARG A 81 18.449 -8.996 4.287 1.00 0.00 H new ATOM 0 HG3 ARG A 81 17.360 -7.802 3.607 1.00 0.00 H new ATOM 0 HD2 ARG A 81 19.072 -7.216 6.047 1.00 0.00 H new ATOM 0 HD3 ARG A 81 19.668 -6.978 4.416 1.00 0.00 H new ATOM 0 HE ARG A 81 17.111 -5.666 4.770 1.00 0.00 H new ATOM 0 HH11 ARG A 81 20.558 -5.427 5.495 1.00 0.00 H new ATOM 0 HH12 ARG A 81 20.531 -3.664 5.607 1.00 0.00 H new ATOM 0 HH21 ARG A 81 17.084 -3.402 4.912 1.00 0.00 H new ATOM 0 HH22 ARG A 81 18.572 -2.522 5.278 1.00 0.00 H new ATOM 802 N LEU A 82 16.632 -11.330 6.828 1.00 0.00 N ATOM 803 CA LEU A 82 17.286 -12.541 7.312 1.00 0.00 C ATOM 804 C LEU A 82 16.579 -13.788 6.788 1.00 0.00 C ATOM 805 O LEU A 82 17.223 -14.750 6.367 1.00 0.00 O ATOM 806 CB LEU A 82 17.305 -12.558 8.842 1.00 0.00 C ATOM 807 CG LEU A 82 18.465 -11.815 9.506 1.00 0.00 C ATOM 808 CD1 LEU A 82 18.257 -11.736 11.010 1.00 0.00 C ATOM 809 CD2 LEU A 82 19.788 -12.494 9.183 1.00 0.00 C ATOM 0 H LEU A 82 16.150 -10.794 7.550 1.00 0.00 H new ATOM 0 HA LEU A 82 18.311 -12.543 6.942 1.00 0.00 H new ATOM 0 HB2 LEU A 82 16.370 -12.128 9.202 1.00 0.00 H new ATOM 0 HB3 LEU A 82 17.327 -13.596 9.174 1.00 0.00 H new ATOM 0 HG LEU A 82 18.495 -10.800 9.111 1.00 0.00 H new ATOM 0 HD11 LEU A 82 19.092 -11.204 11.465 1.00 0.00 H new ATOM 0 HD12 LEU A 82 17.329 -11.204 11.222 1.00 0.00 H new ATOM 0 HD13 LEU A 82 18.200 -12.743 11.423 1.00 0.00 H new ATOM 0 HD21 LEU A 82 20.602 -11.952 9.664 1.00 0.00 H new ATOM 0 HD22 LEU A 82 19.769 -13.520 9.550 1.00 0.00 H new ATOM 0 HD23 LEU A 82 19.941 -12.497 8.104 1.00 0.00 H new ATOM 821 N THR A 83 15.250 -13.764 6.815 1.00 0.00 N ATOM 822 CA THR A 83 14.456 -14.891 6.342 1.00 0.00 C ATOM 823 C THR A 83 13.928 -14.639 4.934 1.00 0.00 C ATOM 824 O THR A 83 13.786 -15.567 4.139 1.00 0.00 O ATOM 825 CB THR A 83 13.268 -15.174 7.280 1.00 0.00 C ATOM 826 OG1 THR A 83 12.404 -14.034 7.334 1.00 0.00 O ATOM 827 CG2 THR A 83 13.754 -15.515 8.681 1.00 0.00 C ATOM 0 H THR A 83 14.701 -12.976 7.159 1.00 0.00 H new ATOM 0 HA THR A 83 15.115 -15.759 6.330 1.00 0.00 H new ATOM 0 HB THR A 83 12.718 -16.028 6.885 1.00 0.00 H new ATOM 0 HG1 THR A 83 11.650 -14.223 7.931 1.00 0.00 H new ATOM 0 HG21 THR A 83 12.897 -15.711 9.326 1.00 0.00 H new ATOM 0 HG22 THR A 83 14.388 -16.401 8.641 1.00 0.00 H new ATOM 0 HG23 THR A 83 14.326 -14.678 9.082 1.00 0.00 H new ATOM 835 N GLY A 84 13.640 -13.377 4.632 1.00 0.00 N ATOM 836 CA GLY A 84 13.131 -13.026 3.319 1.00 0.00 C ATOM 837 C GLY A 84 11.674 -13.404 3.141 1.00 0.00 C ATOM 838 O GLY A 84 11.195 -13.548 2.016 1.00 0.00 O ATOM 0 H GLY A 84 13.750 -12.591 5.273 1.00 0.00 H new ATOM 0 HA2 GLY A 84 13.246 -11.953 3.163 1.00 0.00 H new ATOM 0 HA3 GLY A 84 13.728 -13.525 2.556 1.00 0.00 H new ATOM 842 N LEU A 85 10.968 -13.568 4.254 1.00 0.00 N ATOM 843 CA LEU A 85 9.556 -13.934 4.217 1.00 0.00 C ATOM 844 C LEU A 85 8.670 -12.694 4.276 1.00 0.00 C ATOM 845 O LEU A 85 9.030 -11.689 4.890 1.00 0.00 O ATOM 846 CB LEU A 85 9.221 -14.870 5.379 1.00 0.00 C ATOM 847 CG LEU A 85 10.073 -16.135 5.490 1.00 0.00 C ATOM 848 CD1 LEU A 85 9.769 -16.872 6.785 1.00 0.00 C ATOM 849 CD2 LEU A 85 9.841 -17.042 4.291 1.00 0.00 C ATOM 0 H LEU A 85 11.350 -13.453 5.193 1.00 0.00 H new ATOM 0 HA LEU A 85 9.364 -14.450 3.276 1.00 0.00 H new ATOM 0 HB2 LEU A 85 9.316 -14.310 6.309 1.00 0.00 H new ATOM 0 HB3 LEU A 85 8.176 -15.167 5.290 1.00 0.00 H new ATOM 0 HG LEU A 85 11.123 -15.842 5.501 1.00 0.00 H new ATOM 0 HD11 LEU A 85 10.385 -17.769 6.846 1.00 0.00 H new ATOM 0 HD12 LEU A 85 9.988 -16.223 7.633 1.00 0.00 H new ATOM 0 HD13 LEU A 85 8.716 -17.153 6.805 1.00 0.00 H new ATOM 0 HD21 LEU A 85 10.456 -17.937 4.387 1.00 0.00 H new ATOM 0 HD22 LEU A 85 8.790 -17.327 4.248 1.00 0.00 H new ATOM 0 HD23 LEU A 85 10.111 -16.513 3.377 1.00 0.00 H new ATOM 861 N HIS A 86 7.508 -12.772 3.635 1.00 0.00 N ATOM 862 CA HIS A 86 6.568 -11.656 3.617 1.00 0.00 C ATOM 863 C HIS A 86 6.199 -11.234 5.036 1.00 0.00 C ATOM 864 O HIS A 86 5.407 -11.897 5.707 1.00 0.00 O ATOM 865 CB HIS A 86 5.307 -12.037 2.842 1.00 0.00 C ATOM 866 CG HIS A 86 4.502 -10.857 2.392 1.00 0.00 C ATOM 867 ND1 HIS A 86 4.100 -9.851 3.245 1.00 0.00 N ATOM 868 CD2 HIS A 86 4.025 -10.524 1.169 1.00 0.00 C ATOM 869 CE1 HIS A 86 3.409 -8.952 2.567 1.00 0.00 C ATOM 870 NE2 HIS A 86 3.349 -9.337 1.305 1.00 0.00 N ATOM 0 H HIS A 86 7.195 -13.596 3.121 1.00 0.00 H new ATOM 0 HA HIS A 86 7.050 -10.814 3.120 1.00 0.00 H new ATOM 0 HB2 HIS A 86 5.590 -12.627 1.970 1.00 0.00 H new ATOM 0 HB3 HIS A 86 4.683 -12.674 3.469 1.00 0.00 H new ATOM 0 HD2 HIS A 86 4.153 -11.087 0.257 1.00 0.00 H new ATOM 0 HE1 HIS A 86 2.968 -8.055 2.975 1.00 0.00 H new ATOM 0 HE2 HIS A 86 2.877 -8.834 0.554 1.00 0.00 H new ATOM 879 N LYS A 87 6.779 -10.127 5.489 1.00 0.00 N ATOM 880 CA LYS A 87 6.512 -9.615 6.827 1.00 0.00 C ATOM 881 C LYS A 87 5.011 -9.518 7.083 1.00 0.00 C ATOM 882 O LYS A 87 4.510 -10.018 8.089 1.00 0.00 O ATOM 883 CB LYS A 87 7.161 -8.242 7.009 1.00 0.00 C ATOM 884 CG LYS A 87 8.667 -8.301 7.200 1.00 0.00 C ATOM 885 CD LYS A 87 9.347 -7.053 6.663 1.00 0.00 C ATOM 886 CE LYS A 87 9.133 -5.861 7.585 1.00 0.00 C ATOM 887 NZ LYS A 87 9.982 -4.701 7.196 1.00 0.00 N ATOM 0 H LYS A 87 7.438 -9.567 4.948 1.00 0.00 H new ATOM 0 HA LYS A 87 6.941 -10.311 7.548 1.00 0.00 H new ATOM 0 HB2 LYS A 87 6.938 -7.626 6.138 1.00 0.00 H new ATOM 0 HB3 LYS A 87 6.713 -7.749 7.872 1.00 0.00 H new ATOM 0 HG2 LYS A 87 8.896 -8.414 8.260 1.00 0.00 H new ATOM 0 HG3 LYS A 87 9.065 -9.180 6.693 1.00 0.00 H new ATOM 0 HD2 LYS A 87 10.415 -7.239 6.549 1.00 0.00 H new ATOM 0 HD3 LYS A 87 8.957 -6.822 5.672 1.00 0.00 H new ATOM 0 HE2 LYS A 87 8.084 -5.567 7.562 1.00 0.00 H new ATOM 0 HE3 LYS A 87 9.360 -6.150 8.611 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 9.808 -3.909 7.847 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 10.985 -4.973 7.243 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 9.747 -4.409 6.226 1.00 0.00 H new ATOM 901 N GLY A 88 4.300 -8.872 6.164 1.00 0.00 N ATOM 902 CA GLY A 88 2.863 -8.722 6.309 1.00 0.00 C ATOM 903 C GLY A 88 2.412 -7.284 6.153 1.00 0.00 C ATOM 904 O GLY A 88 1.566 -6.806 6.911 1.00 0.00 O ATOM 0 H GLY A 88 4.693 -8.450 5.322 1.00 0.00 H new ATOM 0 HA2 GLY A 88 2.359 -9.340 5.566 1.00 0.00 H new ATOM 0 HA3 GLY A 88 2.559 -9.091 7.289 1.00 0.00 H new ATOM 908 N CYS A 89 2.976 -6.592 5.169 1.00 0.00 N ATOM 909 CA CYS A 89 2.628 -5.198 4.918 1.00 0.00 C ATOM 910 C CYS A 89 3.258 -4.706 3.619 1.00 0.00 C ATOM 911 O CYS A 89 4.194 -5.315 3.102 1.00 0.00 O ATOM 912 CB CYS A 89 3.081 -4.319 6.084 1.00 0.00 C ATOM 913 SG CYS A 89 4.723 -4.727 6.721 1.00 0.00 S ATOM 0 H CYS A 89 3.676 -6.973 4.532 1.00 0.00 H new ATOM 0 HA CYS A 89 1.544 -5.131 4.823 1.00 0.00 H new ATOM 0 HB2 CYS A 89 3.076 -3.277 5.763 1.00 0.00 H new ATOM 0 HB3 CYS A 89 2.357 -4.407 6.894 1.00 0.00 H new ATOM 0 HG CYS A 89 5.018 -3.928 7.703 1.00 0.00 H new ATOM 919 N ALA A 90 2.738 -3.600 3.097 1.00 0.00 N ATOM 920 CA ALA A 90 3.250 -3.026 1.858 1.00 0.00 C ATOM 921 C ALA A 90 2.953 -1.532 1.782 1.00 0.00 C ATOM 922 O ALA A 90 1.943 -1.062 2.307 1.00 0.00 O ATOM 923 CB ALA A 90 2.655 -3.747 0.657 1.00 0.00 C ATOM 0 H ALA A 90 1.963 -3.084 3.512 1.00 0.00 H new ATOM 0 HA ALA A 90 4.332 -3.156 1.846 1.00 0.00 H new ATOM 0 HB1 ALA A 90 3.046 -3.308 -0.261 1.00 0.00 H new ATOM 0 HB2 ALA A 90 2.923 -4.803 0.697 1.00 0.00 H new ATOM 0 HB3 ALA A 90 1.570 -3.647 0.674 1.00 0.00 H new ATOM 929 N PHE A 91 3.839 -0.791 1.126 1.00 0.00 N ATOM 930 CA PHE A 91 3.672 0.651 0.982 1.00 0.00 C ATOM 931 C PHE A 91 3.079 0.997 -0.380 1.00 0.00 C ATOM 932 O PHE A 91 3.682 0.728 -1.420 1.00 0.00 O ATOM 933 CB PHE A 91 5.016 1.361 1.161 1.00 0.00 C ATOM 934 CG PHE A 91 5.359 1.641 2.596 1.00 0.00 C ATOM 935 CD1 PHE A 91 4.428 2.217 3.446 1.00 0.00 C ATOM 936 CD2 PHE A 91 6.613 1.328 3.096 1.00 0.00 C ATOM 937 CE1 PHE A 91 4.742 2.476 4.766 1.00 0.00 C ATOM 938 CE2 PHE A 91 6.933 1.585 4.416 1.00 0.00 C ATOM 939 CZ PHE A 91 5.996 2.159 5.252 1.00 0.00 C ATOM 0 H PHE A 91 4.680 -1.164 0.686 1.00 0.00 H new ATOM 0 HA PHE A 91 2.983 0.991 1.755 1.00 0.00 H new ATOM 0 HB2 PHE A 91 5.803 0.749 0.720 1.00 0.00 H new ATOM 0 HB3 PHE A 91 4.997 2.301 0.610 1.00 0.00 H new ATOM 0 HD1 PHE A 91 3.446 2.466 3.072 1.00 0.00 H new ATOM 0 HD2 PHE A 91 7.349 0.878 2.447 1.00 0.00 H new ATOM 0 HE1 PHE A 91 4.008 2.926 5.418 1.00 0.00 H new ATOM 0 HE2 PHE A 91 7.914 1.337 4.793 1.00 0.00 H new ATOM 0 HZ PHE A 91 6.243 2.360 6.284 1.00 0.00 H new ATOM 949 N LEU A 92 1.892 1.594 -0.367 1.00 0.00 N ATOM 950 CA LEU A 92 1.215 1.978 -1.601 1.00 0.00 C ATOM 951 C LEU A 92 1.195 3.494 -1.763 1.00 0.00 C ATOM 952 O LEU A 92 0.971 4.230 -0.801 1.00 0.00 O ATOM 953 CB LEU A 92 -0.214 1.433 -1.612 1.00 0.00 C ATOM 954 CG LEU A 92 -1.144 2.010 -2.680 1.00 0.00 C ATOM 955 CD1 LEU A 92 -0.785 1.463 -4.052 1.00 0.00 C ATOM 956 CD2 LEU A 92 -2.597 1.703 -2.344 1.00 0.00 C ATOM 0 H LEU A 92 1.379 1.823 0.484 1.00 0.00 H new ATOM 0 HA LEU A 92 1.767 1.550 -2.438 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -0.168 0.352 -1.744 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -0.659 1.616 -0.634 1.00 0.00 H new ATOM 0 HG LEU A 92 -1.017 3.092 -2.699 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -1.457 1.885 -4.799 1.00 0.00 H new ATOM 0 HD12 LEU A 92 0.243 1.734 -4.294 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -0.882 0.377 -4.048 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -3.245 2.121 -3.115 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -2.739 0.623 -2.297 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -2.849 2.145 -1.380 1.00 0.00 H new ATOM 968 N THR A 93 1.428 3.957 -2.987 1.00 0.00 N ATOM 969 CA THR A 93 1.435 5.386 -3.276 1.00 0.00 C ATOM 970 C THR A 93 0.486 5.720 -4.420 1.00 0.00 C ATOM 971 O THR A 93 0.524 5.088 -5.477 1.00 0.00 O ATOM 972 CB THR A 93 2.850 5.878 -3.636 1.00 0.00 C ATOM 973 OG1 THR A 93 3.757 5.589 -2.567 1.00 0.00 O ATOM 974 CG2 THR A 93 2.847 7.374 -3.915 1.00 0.00 C ATOM 0 H THR A 93 1.615 3.363 -3.795 1.00 0.00 H new ATOM 0 HA THR A 93 1.101 5.894 -2.371 1.00 0.00 H new ATOM 0 HB THR A 93 3.174 5.356 -4.537 1.00 0.00 H new ATOM 0 HG1 THR A 93 4.618 5.302 -2.937 1.00 0.00 H new ATOM 0 HG21 THR A 93 3.856 7.699 -4.167 1.00 0.00 H new ATOM 0 HG22 THR A 93 2.178 7.587 -4.749 1.00 0.00 H new ATOM 0 HG23 THR A 93 2.504 7.909 -3.029 1.00 0.00 H new ATOM 982 N TYR A 94 -0.365 6.717 -4.205 1.00 0.00 N ATOM 983 CA TYR A 94 -1.326 7.135 -5.219 1.00 0.00 C ATOM 984 C TYR A 94 -0.857 8.404 -5.924 1.00 0.00 C ATOM 985 O TYR A 94 -0.176 9.241 -5.331 1.00 0.00 O ATOM 986 CB TYR A 94 -2.698 7.367 -4.585 1.00 0.00 C ATOM 987 CG TYR A 94 -3.575 6.135 -4.570 1.00 0.00 C ATOM 988 CD1 TYR A 94 -4.046 5.580 -5.754 1.00 0.00 C ATOM 989 CD2 TYR A 94 -3.934 5.528 -3.374 1.00 0.00 C ATOM 990 CE1 TYR A 94 -4.848 4.455 -5.746 1.00 0.00 C ATOM 991 CE2 TYR A 94 -4.734 4.402 -3.356 1.00 0.00 C ATOM 992 CZ TYR A 94 -5.188 3.869 -4.544 1.00 0.00 C ATOM 993 OH TYR A 94 -5.987 2.749 -4.531 1.00 0.00 O ATOM 0 H TYR A 94 -0.409 7.251 -3.337 1.00 0.00 H new ATOM 0 HA TYR A 94 -1.405 6.339 -5.959 1.00 0.00 H new ATOM 0 HB2 TYR A 94 -2.561 7.718 -3.562 1.00 0.00 H new ATOM 0 HB3 TYR A 94 -3.210 8.161 -5.129 1.00 0.00 H new ATOM 0 HD1 TYR A 94 -3.781 6.036 -6.696 1.00 0.00 H new ATOM 0 HD2 TYR A 94 -3.582 5.943 -2.441 1.00 0.00 H new ATOM 0 HE1 TYR A 94 -5.207 4.037 -6.675 1.00 0.00 H new ATOM 0 HE2 TYR A 94 -5.002 3.942 -2.417 1.00 0.00 H new ATOM 0 HH TYR A 94 -6.145 2.449 -5.451 1.00 0.00 H new ATOM 1003 N CYS A 95 -1.228 8.539 -7.192 1.00 0.00 N ATOM 1004 CA CYS A 95 -0.846 9.706 -7.980 1.00 0.00 C ATOM 1005 C CYS A 95 -1.596 10.948 -7.510 1.00 0.00 C ATOM 1006 O CYS A 95 -1.033 12.041 -7.454 1.00 0.00 O ATOM 1007 CB CYS A 95 -1.124 9.458 -9.463 1.00 0.00 C ATOM 1008 SG CYS A 95 -0.309 7.989 -10.132 1.00 0.00 S ATOM 0 H CYS A 95 -1.793 7.856 -7.697 1.00 0.00 H new ATOM 0 HA CYS A 95 0.222 9.875 -7.841 1.00 0.00 H new ATOM 0 HB2 CYS A 95 -2.200 9.361 -9.609 1.00 0.00 H new ATOM 0 HB3 CYS A 95 -0.802 10.330 -10.033 1.00 0.00 H new ATOM 0 HG CYS A 95 -1.071 6.951 -9.954 1.00 0.00 H new ATOM 1014 N ALA A 96 -2.870 10.773 -7.175 1.00 0.00 N ATOM 1015 CA ALA A 96 -3.697 11.879 -6.709 1.00 0.00 C ATOM 1016 C ALA A 96 -3.936 11.792 -5.206 1.00 0.00 C ATOM 1017 O ALA A 96 -3.775 10.730 -4.603 1.00 0.00 O ATOM 1018 CB ALA A 96 -5.022 11.898 -7.456 1.00 0.00 C ATOM 0 H ALA A 96 -3.352 9.875 -7.218 1.00 0.00 H new ATOM 0 HA ALA A 96 -3.164 12.808 -6.912 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -5.630 12.729 -7.098 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -4.836 12.018 -8.523 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -5.551 10.961 -7.283 1.00 0.00 H new ATOM 1024 N ARG A 97 -4.319 12.914 -4.606 1.00 0.00 N ATOM 1025 CA ARG A 97 -4.578 12.964 -3.172 1.00 0.00 C ATOM 1026 C ARG A 97 -5.925 12.327 -2.840 1.00 0.00 C ATOM 1027 O ARG A 97 -6.092 11.720 -1.782 1.00 0.00 O ATOM 1028 CB ARG A 97 -4.551 14.411 -2.677 1.00 0.00 C ATOM 1029 CG ARG A 97 -5.778 15.214 -3.077 1.00 0.00 C ATOM 1030 CD ARG A 97 -5.704 15.661 -4.528 1.00 0.00 C ATOM 1031 NE ARG A 97 -6.515 16.849 -4.778 1.00 0.00 N ATOM 1032 CZ ARG A 97 -6.258 18.040 -4.247 1.00 0.00 C ATOM 1033 NH1 ARG A 97 -5.216 18.199 -3.443 1.00 0.00 N ATOM 1034 NH2 ARG A 97 -7.043 19.074 -4.522 1.00 0.00 N ATOM 0 H ARG A 97 -4.457 13.801 -5.091 1.00 0.00 H new ATOM 0 HA ARG A 97 -3.794 12.400 -2.667 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -4.464 14.413 -1.590 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -3.661 14.904 -3.069 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -6.673 14.611 -2.926 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -5.869 16.087 -2.431 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -4.667 15.869 -4.791 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -6.040 14.850 -5.174 1.00 0.00 H new ATOM 0 HE ARG A 97 -7.323 16.760 -5.394 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -4.610 17.407 -3.231 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -5.020 19.114 -3.036 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -7.845 18.955 -5.141 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -6.845 19.988 -4.114 1.00 0.00 H new ATOM 1048 N ASP A 98 -6.881 12.469 -3.751 1.00 0.00 N ATOM 1049 CA ASP A 98 -8.213 11.908 -3.556 1.00 0.00 C ATOM 1050 C ASP A 98 -8.191 10.391 -3.714 1.00 0.00 C ATOM 1051 O ASP A 98 -8.666 9.659 -2.846 1.00 0.00 O ATOM 1052 CB ASP A 98 -9.199 12.523 -4.550 1.00 0.00 C ATOM 1053 CG ASP A 98 -10.485 11.726 -4.658 1.00 0.00 C ATOM 1054 OD1 ASP A 98 -11.389 11.941 -3.823 1.00 0.00 O ATOM 1055 OD2 ASP A 98 -10.586 10.887 -5.577 1.00 0.00 O ATOM 0 H ASP A 98 -6.759 12.968 -4.632 1.00 0.00 H new ATOM 0 HA ASP A 98 -8.536 12.145 -2.542 1.00 0.00 H new ATOM 0 HB2 ASP A 98 -9.432 13.543 -4.243 1.00 0.00 H new ATOM 0 HB3 ASP A 98 -8.730 12.585 -5.532 1.00 0.00 H new ATOM 1060 N SER A 99 -7.638 9.925 -4.830 1.00 0.00 N ATOM 1061 CA SER A 99 -7.559 8.495 -5.105 1.00 0.00 C ATOM 1062 C SER A 99 -7.210 7.717 -3.839 1.00 0.00 C ATOM 1063 O SER A 99 -7.803 6.677 -3.554 1.00 0.00 O ATOM 1064 CB SER A 99 -6.516 8.220 -6.190 1.00 0.00 C ATOM 1065 OG SER A 99 -7.045 8.471 -7.480 1.00 0.00 O ATOM 0 H SER A 99 -7.238 10.517 -5.558 1.00 0.00 H new ATOM 0 HA SER A 99 -8.536 8.163 -5.457 1.00 0.00 H new ATOM 0 HB2 SER A 99 -5.640 8.847 -6.024 1.00 0.00 H new ATOM 0 HB3 SER A 99 -6.183 7.184 -6.125 1.00 0.00 H new ATOM 0 HG SER A 99 -6.359 8.290 -8.156 1.00 0.00 H new ATOM 1071 N ALA A 100 -6.244 8.230 -3.085 1.00 0.00 N ATOM 1072 CA ALA A 100 -5.817 7.585 -1.849 1.00 0.00 C ATOM 1073 C ALA A 100 -6.914 7.644 -0.792 1.00 0.00 C ATOM 1074 O ALA A 100 -7.300 6.620 -0.225 1.00 0.00 O ATOM 1075 CB ALA A 100 -4.544 8.235 -1.327 1.00 0.00 C ATOM 0 H ALA A 100 -5.742 9.090 -3.308 1.00 0.00 H new ATOM 0 HA ALA A 100 -5.614 6.536 -2.067 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -4.237 7.744 -0.404 1.00 0.00 H new ATOM 0 HB2 ALA A 100 -3.754 8.136 -2.071 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -4.729 9.291 -1.132 1.00 0.00 H new ATOM 1081 N LEU A 101 -7.413 8.846 -0.529 1.00 0.00 N ATOM 1082 CA LEU A 101 -8.467 9.039 0.461 1.00 0.00 C ATOM 1083 C LEU A 101 -9.590 8.026 0.264 1.00 0.00 C ATOM 1084 O LEU A 101 -9.974 7.318 1.196 1.00 0.00 O ATOM 1085 CB LEU A 101 -9.024 10.460 0.373 1.00 0.00 C ATOM 1086 CG LEU A 101 -8.034 11.589 0.664 1.00 0.00 C ATOM 1087 CD1 LEU A 101 -8.551 12.908 0.111 1.00 0.00 C ATOM 1088 CD2 LEU A 101 -7.776 11.699 2.159 1.00 0.00 C ATOM 0 H LEU A 101 -7.105 9.703 -0.988 1.00 0.00 H new ATOM 0 HA LEU A 101 -8.035 8.887 1.450 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -9.429 10.608 -0.628 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -9.857 10.546 1.070 1.00 0.00 H new ATOM 0 HG LEU A 101 -7.091 11.357 0.169 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -7.834 13.700 0.328 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -8.683 12.823 -0.968 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -9.507 13.148 0.576 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -7.069 12.507 2.348 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -8.713 11.908 2.675 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -7.361 10.761 2.527 1.00 0.00 H new ATOM 1100 N LYS A 102 -10.114 7.961 -0.955 1.00 0.00 N ATOM 1101 CA LYS A 102 -11.192 7.033 -1.277 1.00 0.00 C ATOM 1102 C LYS A 102 -10.790 5.598 -0.950 1.00 0.00 C ATOM 1103 O LYS A 102 -11.348 4.979 -0.045 1.00 0.00 O ATOM 1104 CB LYS A 102 -11.563 7.145 -2.758 1.00 0.00 C ATOM 1105 CG LYS A 102 -12.058 8.524 -3.158 1.00 0.00 C ATOM 1106 CD LYS A 102 -12.464 8.567 -4.622 1.00 0.00 C ATOM 1107 CE LYS A 102 -13.769 7.822 -4.861 1.00 0.00 C ATOM 1108 NZ LYS A 102 -14.351 8.138 -6.195 1.00 0.00 N ATOM 0 H LYS A 102 -9.809 8.540 -1.737 1.00 0.00 H new ATOM 0 HA LYS A 102 -12.058 7.296 -0.670 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -10.692 6.891 -3.362 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -12.335 6.410 -2.987 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -12.908 8.801 -2.535 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -11.275 9.260 -2.975 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -12.572 9.604 -4.940 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -11.675 8.127 -5.232 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -13.594 6.749 -4.786 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -14.485 8.083 -4.081 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -15.239 7.611 -6.320 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -14.542 9.158 -6.258 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -13.679 7.865 -6.940 1.00 0.00 H new ATOM 1122 N ALA A 103 -9.818 5.077 -1.691 1.00 0.00 N ATOM 1123 CA ALA A 103 -9.340 3.717 -1.477 1.00 0.00 C ATOM 1124 C ALA A 103 -9.094 3.448 0.004 1.00 0.00 C ATOM 1125 O ALA A 103 -9.233 2.318 0.470 1.00 0.00 O ATOM 1126 CB ALA A 103 -8.069 3.472 -2.277 1.00 0.00 C ATOM 0 H ALA A 103 -9.346 5.576 -2.445 1.00 0.00 H new ATOM 0 HA ALA A 103 -10.112 3.029 -1.822 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -7.723 2.452 -2.108 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -8.274 3.614 -3.338 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -7.298 4.174 -1.959 1.00 0.00 H new ATOM 1132 N GLN A 104 -8.729 4.494 0.738 1.00 0.00 N ATOM 1133 CA GLN A 104 -8.463 4.370 2.166 1.00 0.00 C ATOM 1134 C GLN A 104 -9.751 4.107 2.939 1.00 0.00 C ATOM 1135 O GLN A 104 -9.840 3.151 3.710 1.00 0.00 O ATOM 1136 CB GLN A 104 -7.788 5.637 2.693 1.00 0.00 C ATOM 1137 CG GLN A 104 -7.358 5.537 4.148 1.00 0.00 C ATOM 1138 CD GLN A 104 -7.336 6.884 4.844 1.00 0.00 C ATOM 1139 OE1 GLN A 104 -8.029 7.092 5.841 1.00 0.00 O ATOM 1140 NE2 GLN A 104 -6.539 7.808 4.321 1.00 0.00 N ATOM 0 H GLN A 104 -8.611 5.437 0.367 1.00 0.00 H new ATOM 0 HA GLN A 104 -7.793 3.523 2.312 1.00 0.00 H new ATOM 0 HB2 GLN A 104 -6.914 5.856 2.079 1.00 0.00 H new ATOM 0 HB3 GLN A 104 -8.474 6.477 2.582 1.00 0.00 H new ATOM 0 HG2 GLN A 104 -8.037 4.869 4.678 1.00 0.00 H new ATOM 0 HG3 GLN A 104 -6.366 5.089 4.200 1.00 0.00 H new ATOM 0 HE21 GLN A 104 -5.982 7.592 3.494 1.00 0.00 H new ATOM 0 HE22 GLN A 104 -6.483 8.733 4.746 1.00 0.00 H new ATOM 1149 N SER A 105 -10.747 4.961 2.728 1.00 0.00 N ATOM 1150 CA SER A 105 -12.030 4.823 3.408 1.00 0.00 C ATOM 1151 C SER A 105 -12.894 3.766 2.728 1.00 0.00 C ATOM 1152 O SER A 105 -13.967 3.416 3.219 1.00 0.00 O ATOM 1153 CB SER A 105 -12.766 6.164 3.429 1.00 0.00 C ATOM 1154 OG SER A 105 -13.751 6.189 4.448 1.00 0.00 O ATOM 0 H SER A 105 -10.691 5.756 2.092 1.00 0.00 H new ATOM 0 HA SER A 105 -11.838 4.506 4.433 1.00 0.00 H new ATOM 0 HB2 SER A 105 -12.052 6.972 3.589 1.00 0.00 H new ATOM 0 HB3 SER A 105 -13.235 6.340 2.461 1.00 0.00 H new ATOM 0 HG SER A 105 -14.229 5.334 4.462 1.00 0.00 H new ATOM 1160 N ALA A 106 -12.419 3.261 1.594 1.00 0.00 N ATOM 1161 CA ALA A 106 -13.146 2.242 0.847 1.00 0.00 C ATOM 1162 C ALA A 106 -12.589 0.851 1.131 1.00 0.00 C ATOM 1163 O ALA A 106 -13.268 -0.155 0.922 1.00 0.00 O ATOM 1164 CB ALA A 106 -13.091 2.541 -0.644 1.00 0.00 C ATOM 0 H ALA A 106 -11.533 3.541 1.172 1.00 0.00 H new ATOM 0 HA ALA A 106 -14.186 2.261 1.172 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -13.638 1.772 -1.190 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -13.543 3.514 -0.837 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -12.052 2.552 -0.975 1.00 0.00 H new ATOM 1170 N LEU A 107 -11.350 0.801 1.606 1.00 0.00 N ATOM 1171 CA LEU A 107 -10.701 -0.468 1.917 1.00 0.00 C ATOM 1172 C LEU A 107 -10.528 -0.636 3.423 1.00 0.00 C ATOM 1173 O LEU A 107 -10.815 -1.697 3.977 1.00 0.00 O ATOM 1174 CB LEU A 107 -9.340 -0.551 1.224 1.00 0.00 C ATOM 1175 CG LEU A 107 -9.362 -0.520 -0.305 1.00 0.00 C ATOM 1176 CD1 LEU A 107 -7.952 -0.375 -0.856 1.00 0.00 C ATOM 1177 CD2 LEU A 107 -10.025 -1.776 -0.853 1.00 0.00 C ATOM 0 H LEU A 107 -10.774 1.624 1.784 1.00 0.00 H new ATOM 0 HA LEU A 107 -11.338 -1.273 1.551 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -8.725 0.277 1.575 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -8.848 -1.470 1.542 1.00 0.00 H new ATOM 0 HG LEU A 107 -9.945 0.344 -0.625 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -7.987 -0.355 -1.945 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -7.512 0.553 -0.490 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -7.345 -1.219 -0.528 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -10.032 -1.738 -1.942 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -9.469 -2.654 -0.524 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -11.049 -1.837 -0.485 1.00 0.00 H new ATOM 1189 N HIS A 108 -10.059 0.420 4.082 1.00 0.00 N ATOM 1190 CA HIS A 108 -9.851 0.391 5.525 1.00 0.00 C ATOM 1191 C HIS A 108 -11.066 -0.197 6.237 1.00 0.00 C ATOM 1192 O HIS A 108 -12.135 0.413 6.265 1.00 0.00 O ATOM 1193 CB HIS A 108 -9.569 1.799 6.050 1.00 0.00 C ATOM 1194 CG HIS A 108 -9.097 1.825 7.471 1.00 0.00 C ATOM 1195 ND1 HIS A 108 -7.834 1.424 7.852 1.00 0.00 N ATOM 1196 CD2 HIS A 108 -9.726 2.209 8.606 1.00 0.00 C ATOM 1197 CE1 HIS A 108 -7.707 1.559 9.160 1.00 0.00 C ATOM 1198 NE2 HIS A 108 -8.842 2.034 9.641 1.00 0.00 N ATOM 0 H HIS A 108 -9.816 1.306 3.639 1.00 0.00 H new ATOM 0 HA HIS A 108 -8.989 -0.244 5.730 1.00 0.00 H new ATOM 0 HB2 HIS A 108 -8.817 2.270 5.417 1.00 0.00 H new ATOM 0 HB3 HIS A 108 -10.476 2.398 5.966 1.00 0.00 H new ATOM 0 HD2 HIS A 108 -10.736 2.584 8.683 1.00 0.00 H new ATOM 0 HE1 HIS A 108 -6.826 1.322 9.737 1.00 0.00 H new ATOM 0 HE2 HIS A 108 -9.031 2.238 10.622 1.00 0.00 H new ATOM 1206 N GLU A 109 -10.893 -1.383 6.811 1.00 0.00 N ATOM 1207 CA GLU A 109 -11.977 -2.053 7.521 1.00 0.00 C ATOM 1208 C GLU A 109 -13.215 -2.172 6.637 1.00 0.00 C ATOM 1209 O GLU A 109 -14.340 -1.989 7.100 1.00 0.00 O ATOM 1210 CB GLU A 109 -12.323 -1.291 8.802 1.00 0.00 C ATOM 1211 CG GLU A 109 -11.138 -1.093 9.732 1.00 0.00 C ATOM 1212 CD GLU A 109 -11.548 -1.008 11.190 1.00 0.00 C ATOM 1213 OE1 GLU A 109 -12.668 -0.531 11.465 1.00 0.00 O ATOM 1214 OE2 GLU A 109 -10.747 -1.419 12.055 1.00 0.00 O ATOM 0 H GLU A 109 -10.014 -1.900 6.799 1.00 0.00 H new ATOM 0 HA GLU A 109 -11.641 -3.056 7.782 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -12.732 -0.316 8.536 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -13.106 -1.830 9.335 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -10.438 -1.918 9.603 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -10.610 -0.181 9.453 1.00 0.00 H new ATOM 1221 N GLN A 110 -12.997 -2.480 5.363 1.00 0.00 N ATOM 1222 CA GLN A 110 -14.094 -2.623 4.413 1.00 0.00 C ATOM 1223 C GLN A 110 -13.980 -3.934 3.642 1.00 0.00 C ATOM 1224 O GLN A 110 -14.965 -4.650 3.464 1.00 0.00 O ATOM 1225 CB GLN A 110 -14.111 -1.444 3.439 1.00 0.00 C ATOM 1226 CG GLN A 110 -15.500 -1.096 2.929 1.00 0.00 C ATOM 1227 CD GLN A 110 -16.205 -0.079 3.806 1.00 0.00 C ATOM 1228 OE1 GLN A 110 -17.333 -0.299 4.247 1.00 0.00 O ATOM 1229 NE2 GLN A 110 -15.542 1.043 4.062 1.00 0.00 N ATOM 0 H GLN A 110 -12.071 -2.635 4.965 1.00 0.00 H new ATOM 0 HA GLN A 110 -15.028 -2.634 4.975 1.00 0.00 H new ATOM 0 HB2 GLN A 110 -13.685 -0.570 3.932 1.00 0.00 H new ATOM 0 HB3 GLN A 110 -13.469 -1.676 2.589 1.00 0.00 H new ATOM 0 HG2 GLN A 110 -15.423 -0.704 1.915 1.00 0.00 H new ATOM 0 HG3 GLN A 110 -16.101 -2.003 2.876 1.00 0.00 H new ATOM 0 HE21 GLN A 110 -14.609 1.183 3.675 1.00 0.00 H new ATOM 0 HE22 GLN A 110 -15.966 1.764 4.645 1.00 0.00 H new ATOM 1238 N LYS A 111 -12.771 -4.242 3.185 1.00 0.00 N ATOM 1239 CA LYS A 111 -12.526 -5.467 2.433 1.00 0.00 C ATOM 1240 C LYS A 111 -11.940 -6.550 3.334 1.00 0.00 C ATOM 1241 O LYS A 111 -11.582 -6.291 4.483 1.00 0.00 O ATOM 1242 CB LYS A 111 -11.576 -5.192 1.265 1.00 0.00 C ATOM 1243 CG LYS A 111 -12.288 -4.791 -0.015 1.00 0.00 C ATOM 1244 CD LYS A 111 -12.626 -6.003 -0.867 1.00 0.00 C ATOM 1245 CE LYS A 111 -12.643 -5.656 -2.348 1.00 0.00 C ATOM 1246 NZ LYS A 111 -13.992 -5.216 -2.800 1.00 0.00 N ATOM 0 H LYS A 111 -11.945 -3.660 3.322 1.00 0.00 H new ATOM 0 HA LYS A 111 -13.480 -5.820 2.042 1.00 0.00 H new ATOM 0 HB2 LYS A 111 -10.883 -4.400 1.549 1.00 0.00 H new ATOM 0 HB3 LYS A 111 -10.979 -6.084 1.075 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -13.202 -4.251 0.230 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -11.657 -4.109 -0.585 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -11.896 -6.792 -0.685 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -13.599 -6.396 -0.573 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -11.919 -4.865 -2.544 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -12.331 -6.525 -2.928 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 -13.961 -4.989 -3.814 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 -14.679 -5.980 -2.637 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 -14.279 -4.372 -2.265 1.00 0.00 H new ATOM 1260 N THR A 112 -11.843 -7.766 2.804 1.00 0.00 N ATOM 1261 CA THR A 112 -11.301 -8.888 3.559 1.00 0.00 C ATOM 1262 C THR A 112 -10.560 -9.858 2.646 1.00 0.00 C ATOM 1263 O THR A 112 -11.177 -10.595 1.875 1.00 0.00 O ATOM 1264 CB THR A 112 -12.410 -9.650 4.307 1.00 0.00 C ATOM 1265 OG1 THR A 112 -13.211 -8.734 5.063 1.00 0.00 O ATOM 1266 CG2 THR A 112 -11.815 -10.697 5.237 1.00 0.00 C ATOM 0 H THR A 112 -12.133 -7.998 1.854 1.00 0.00 H new ATOM 0 HA THR A 112 -10.603 -8.472 4.286 1.00 0.00 H new ATOM 0 HB THR A 112 -13.034 -10.154 3.569 1.00 0.00 H new ATOM 0 HG1 THR A 112 -13.915 -9.227 5.534 1.00 0.00 H new ATOM 0 HG21 THR A 112 -12.618 -11.222 5.754 1.00 0.00 H new ATOM 0 HG22 THR A 112 -11.230 -11.410 4.656 1.00 0.00 H new ATOM 0 HG23 THR A 112 -11.170 -10.210 5.968 1.00 0.00 H new ATOM 1274 N LEU A 113 -9.235 -9.855 2.738 1.00 0.00 N ATOM 1275 CA LEU A 113 -8.409 -10.737 1.920 1.00 0.00 C ATOM 1276 C LEU A 113 -8.698 -12.201 2.236 1.00 0.00 C ATOM 1277 O LEU A 113 -9.139 -12.551 3.331 1.00 0.00 O ATOM 1278 CB LEU A 113 -6.927 -10.437 2.149 1.00 0.00 C ATOM 1279 CG LEU A 113 -6.400 -9.144 1.527 1.00 0.00 C ATOM 1280 CD1 LEU A 113 -5.031 -8.798 2.093 1.00 0.00 C ATOM 1281 CD2 LEU A 113 -6.336 -9.268 0.012 1.00 0.00 C ATOM 0 H LEU A 113 -8.709 -9.252 3.371 1.00 0.00 H new ATOM 0 HA LEU A 113 -8.653 -10.555 0.873 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -6.746 -10.400 3.223 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -6.343 -11.270 1.756 1.00 0.00 H new ATOM 0 HG LEU A 113 -7.089 -8.337 1.777 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -4.672 -7.875 1.638 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -5.106 -8.666 3.172 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -4.332 -9.605 1.874 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -5.959 -8.338 -0.414 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -5.670 -10.087 -0.258 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -7.334 -9.467 -0.379 1.00 0.00 H new ATOM 1293 N PRO A 114 -8.442 -13.080 1.255 1.00 0.00 N ATOM 1294 CA PRO A 114 -8.665 -14.521 1.405 1.00 0.00 C ATOM 1295 C PRO A 114 -7.676 -15.163 2.371 1.00 0.00 C ATOM 1296 O PRO A 114 -6.495 -15.312 2.058 1.00 0.00 O ATOM 1297 CB PRO A 114 -8.456 -15.061 -0.012 1.00 0.00 C ATOM 1298 CG PRO A 114 -7.559 -14.069 -0.668 1.00 0.00 C ATOM 1299 CD PRO A 114 -7.916 -12.733 -0.076 1.00 0.00 C ATOM 0 HA PRO A 114 -9.649 -14.741 1.819 1.00 0.00 H new ATOM 0 HB2 PRO A 114 -8.004 -16.053 0.005 1.00 0.00 H new ATOM 0 HB3 PRO A 114 -9.403 -15.151 -0.545 1.00 0.00 H new ATOM 0 HG2 PRO A 114 -6.512 -14.309 -0.486 1.00 0.00 H new ATOM 0 HG3 PRO A 114 -7.702 -14.068 -1.749 1.00 0.00 H new ATOM 0 HD2 PRO A 114 -7.047 -12.079 -0.007 1.00 0.00 H new ATOM 0 HD3 PRO A 114 -8.660 -12.212 -0.679 1.00 0.00 H new ATOM 1307 N GLY A 115 -8.165 -15.541 3.548 1.00 0.00 N ATOM 1308 CA GLY A 115 -7.310 -16.164 4.541 1.00 0.00 C ATOM 1309 C GLY A 115 -7.094 -15.281 5.755 1.00 0.00 C ATOM 1310 O GLY A 115 -6.294 -15.605 6.632 1.00 0.00 O ATOM 0 H GLY A 115 -9.138 -15.427 3.831 1.00 0.00 H new ATOM 0 HA2 GLY A 115 -7.753 -17.109 4.857 1.00 0.00 H new ATOM 0 HA3 GLY A 115 -6.346 -16.399 4.090 1.00 0.00 H new ATOM 1314 N MET A 116 -7.809 -14.161 5.805 1.00 0.00 N ATOM 1315 CA MET A 116 -7.691 -13.229 6.920 1.00 0.00 C ATOM 1316 C MET A 116 -9.028 -13.064 7.634 1.00 0.00 C ATOM 1317 O MET A 116 -9.985 -12.541 7.066 1.00 0.00 O ATOM 1318 CB MET A 116 -7.192 -11.870 6.426 1.00 0.00 C ATOM 1319 CG MET A 116 -5.728 -11.873 6.015 1.00 0.00 C ATOM 1320 SD MET A 116 -4.623 -12.266 7.384 1.00 0.00 S ATOM 1321 CE MET A 116 -3.571 -10.817 7.397 1.00 0.00 C ATOM 0 H MET A 116 -8.475 -13.878 5.087 1.00 0.00 H new ATOM 0 HA MET A 116 -6.969 -13.637 7.628 1.00 0.00 H new ATOM 0 HB2 MET A 116 -7.799 -11.556 5.577 1.00 0.00 H new ATOM 0 HB3 MET A 116 -7.338 -11.130 7.213 1.00 0.00 H new ATOM 0 HG2 MET A 116 -5.581 -12.598 5.215 1.00 0.00 H new ATOM 0 HG3 MET A 116 -5.466 -10.895 5.611 1.00 0.00 H new ATOM 0 HE1 MET A 116 -2.788 -10.942 8.145 1.00 0.00 H new ATOM 0 HE2 MET A 116 -3.117 -10.688 6.415 1.00 0.00 H new ATOM 0 HE3 MET A 116 -4.167 -9.937 7.639 1.00 0.00 H new ATOM 1331 N ASN A 117 -9.086 -13.514 8.884 1.00 0.00 N ATOM 1332 CA ASN A 117 -10.308 -13.417 9.675 1.00 0.00 C ATOM 1333 C ASN A 117 -10.789 -11.971 9.756 1.00 0.00 C ATOM 1334 O ASN A 117 -11.991 -11.704 9.719 1.00 0.00 O ATOM 1335 CB ASN A 117 -10.073 -13.967 11.083 1.00 0.00 C ATOM 1336 CG ASN A 117 -9.649 -15.424 11.071 1.00 0.00 C ATOM 1337 OD1 ASN A 117 -10.478 -16.324 11.209 1.00 0.00 O ATOM 1338 ND2 ASN A 117 -8.353 -15.661 10.906 1.00 0.00 N ATOM 0 H ASN A 117 -8.302 -13.949 9.370 1.00 0.00 H new ATOM 0 HA ASN A 117 -11.078 -14.011 9.184 1.00 0.00 H new ATOM 0 HB2 ASN A 117 -9.306 -13.372 11.579 1.00 0.00 H new ATOM 0 HB3 ASN A 117 -10.986 -13.862 11.668 1.00 0.00 H new ATOM 0 HD21 ASN A 117 -8.008 -16.621 10.890 1.00 0.00 H new ATOM 0 HD22 ASN A 117 -7.702 -14.883 10.795 1.00 0.00 H new ATOM 1345 N ARG A 118 -9.844 -11.044 9.865 1.00 0.00 N ATOM 1346 CA ARG A 118 -10.172 -9.626 9.952 1.00 0.00 C ATOM 1347 C ARG A 118 -9.986 -8.941 8.601 1.00 0.00 C ATOM 1348 O ARG A 118 -9.314 -9.453 7.705 1.00 0.00 O ATOM 1349 CB ARG A 118 -9.299 -8.942 11.006 1.00 0.00 C ATOM 1350 CG ARG A 118 -7.947 -9.608 11.203 1.00 0.00 C ATOM 1351 CD ARG A 118 -7.102 -9.537 9.940 1.00 0.00 C ATOM 1352 NE ARG A 118 -5.678 -9.686 10.226 1.00 0.00 N ATOM 1353 CZ ARG A 118 -5.086 -10.858 10.424 1.00 0.00 C ATOM 1354 NH1 ARG A 118 -5.793 -11.979 10.368 1.00 0.00 N ATOM 1355 NH2 ARG A 118 -3.785 -10.912 10.679 1.00 0.00 N ATOM 0 H ARG A 118 -8.845 -11.249 9.895 1.00 0.00 H new ATOM 0 HA ARG A 118 -11.218 -9.539 10.244 1.00 0.00 H new ATOM 0 HB2 ARG A 118 -9.144 -7.902 10.718 1.00 0.00 H new ATOM 0 HB3 ARG A 118 -9.832 -8.933 11.957 1.00 0.00 H new ATOM 0 HG2 ARG A 118 -7.418 -9.124 12.024 1.00 0.00 H new ATOM 0 HG3 ARG A 118 -8.091 -10.650 11.487 1.00 0.00 H new ATOM 0 HD2 ARG A 118 -7.417 -10.319 9.249 1.00 0.00 H new ATOM 0 HD3 ARG A 118 -7.274 -8.583 9.442 1.00 0.00 H new ATOM 0 HE ARG A 118 -5.106 -8.843 10.277 1.00 0.00 H new ATOM 0 HH11 ARG A 118 -6.793 -11.942 10.173 1.00 0.00 H new ATOM 0 HH12 ARG A 118 -5.336 -12.878 10.520 1.00 0.00 H new ATOM 0 HH21 ARG A 118 -3.238 -10.052 10.723 1.00 0.00 H new ATOM 0 HH22 ARG A 118 -3.332 -11.813 10.831 1.00 0.00 H new ATOM 1369 N PRO A 119 -10.595 -7.756 8.449 1.00 0.00 N ATOM 1370 CA PRO A 119 -10.512 -6.976 7.211 1.00 0.00 C ATOM 1371 C PRO A 119 -9.118 -6.400 6.982 1.00 0.00 C ATOM 1372 O PRO A 119 -8.182 -6.702 7.722 1.00 0.00 O ATOM 1373 CB PRO A 119 -11.526 -5.851 7.431 1.00 0.00 C ATOM 1374 CG PRO A 119 -11.616 -5.707 8.911 1.00 0.00 C ATOM 1375 CD PRO A 119 -11.412 -7.086 9.475 1.00 0.00 C ATOM 0 HA PRO A 119 -10.716 -7.585 6.331 1.00 0.00 H new ATOM 0 HB2 PRO A 119 -11.197 -4.924 6.962 1.00 0.00 H new ATOM 0 HB3 PRO A 119 -12.495 -6.101 6.998 1.00 0.00 H new ATOM 0 HG2 PRO A 119 -10.858 -5.017 9.283 1.00 0.00 H new ATOM 0 HG3 PRO A 119 -12.585 -5.304 9.206 1.00 0.00 H new ATOM 0 HD2 PRO A 119 -10.902 -7.055 10.438 1.00 0.00 H new ATOM 0 HD3 PRO A 119 -12.360 -7.600 9.633 1.00 0.00 H new ATOM 1383 N ILE A 120 -8.989 -5.569 5.953 1.00 0.00 N ATOM 1384 CA ILE A 120 -7.710 -4.950 5.628 1.00 0.00 C ATOM 1385 C ILE A 120 -7.599 -3.561 6.248 1.00 0.00 C ATOM 1386 O ILE A 120 -8.584 -2.828 6.332 1.00 0.00 O ATOM 1387 CB ILE A 120 -7.509 -4.837 4.105 1.00 0.00 C ATOM 1388 CG1 ILE A 120 -6.344 -3.897 3.790 1.00 0.00 C ATOM 1389 CG2 ILE A 120 -8.786 -4.350 3.437 1.00 0.00 C ATOM 1390 CD1 ILE A 120 -6.141 -3.662 2.310 1.00 0.00 C ATOM 0 H ILE A 120 -9.754 -5.309 5.331 1.00 0.00 H new ATOM 0 HA ILE A 120 -6.934 -5.594 6.042 1.00 0.00 H new ATOM 0 HB ILE A 120 -7.270 -5.825 3.711 1.00 0.00 H new ATOM 0 HG12 ILE A 120 -6.517 -2.940 4.281 1.00 0.00 H new ATOM 0 HG13 ILE A 120 -5.429 -4.311 4.213 1.00 0.00 H new ATOM 0 HG21 ILE A 120 -8.628 -4.275 2.361 1.00 0.00 H new ATOM 0 HG22 ILE A 120 -9.593 -5.055 3.637 1.00 0.00 H new ATOM 0 HG23 ILE A 120 -9.053 -3.370 3.833 1.00 0.00 H new ATOM 0 HD11 ILE A 120 -5.299 -2.986 2.161 1.00 0.00 H new ATOM 0 HD12 ILE A 120 -5.936 -4.612 1.816 1.00 0.00 H new ATOM 0 HD13 ILE A 120 -7.041 -3.218 1.885 1.00 0.00 H new ATOM 1402 N GLN A 121 -6.392 -3.206 6.679 1.00 0.00 N ATOM 1403 CA GLN A 121 -6.152 -1.904 7.290 1.00 0.00 C ATOM 1404 C GLN A 121 -5.245 -1.049 6.411 1.00 0.00 C ATOM 1405 O GLN A 121 -4.107 -1.424 6.126 1.00 0.00 O ATOM 1406 CB GLN A 121 -5.527 -2.074 8.675 1.00 0.00 C ATOM 1407 CG GLN A 121 -6.540 -2.386 9.765 1.00 0.00 C ATOM 1408 CD GLN A 121 -7.478 -3.515 9.385 1.00 0.00 C ATOM 1409 OE1 GLN A 121 -8.481 -3.301 8.704 1.00 0.00 O ATOM 1410 NE2 GLN A 121 -7.156 -4.726 9.823 1.00 0.00 N ATOM 0 H GLN A 121 -5.566 -3.801 6.616 1.00 0.00 H new ATOM 0 HA GLN A 121 -7.111 -1.397 7.392 1.00 0.00 H new ATOM 0 HB2 GLN A 121 -4.789 -2.876 8.636 1.00 0.00 H new ATOM 0 HB3 GLN A 121 -4.992 -1.161 8.938 1.00 0.00 H new ATOM 0 HG2 GLN A 121 -6.012 -2.650 10.681 1.00 0.00 H new ATOM 0 HG3 GLN A 121 -7.124 -1.491 9.980 1.00 0.00 H new ATOM 0 HE21 GLN A 121 -6.315 -4.858 10.385 1.00 0.00 H new ATOM 0 HE22 GLN A 121 -7.750 -5.524 9.598 1.00 0.00 H new ATOM 1419 N VAL A 122 -5.756 0.101 5.984 1.00 0.00 N ATOM 1420 CA VAL A 122 -4.991 1.010 5.138 1.00 0.00 C ATOM 1421 C VAL A 122 -5.032 2.433 5.682 1.00 0.00 C ATOM 1422 O VAL A 122 -6.092 3.057 5.742 1.00 0.00 O ATOM 1423 CB VAL A 122 -5.520 1.009 3.691 1.00 0.00 C ATOM 1424 CG1 VAL A 122 -4.627 1.853 2.795 1.00 0.00 C ATOM 1425 CG2 VAL A 122 -5.627 -0.413 3.164 1.00 0.00 C ATOM 0 H VAL A 122 -6.696 0.426 6.210 1.00 0.00 H new ATOM 0 HA VAL A 122 -3.961 0.653 5.141 1.00 0.00 H new ATOM 0 HB VAL A 122 -6.517 1.449 3.687 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -5.017 1.840 1.777 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -4.607 2.879 3.163 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -3.616 1.446 2.802 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -6.002 -0.395 2.141 1.00 0.00 H new ATOM 0 HG22 VAL A 122 -4.643 -0.882 3.181 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -6.312 -0.983 3.791 1.00 0.00 H new ATOM 1435 N LYS A 123 -3.871 2.943 6.078 1.00 0.00 N ATOM 1436 CA LYS A 123 -3.772 4.295 6.617 1.00 0.00 C ATOM 1437 C LYS A 123 -2.739 5.112 5.849 1.00 0.00 C ATOM 1438 O LYS A 123 -1.812 4.574 5.242 1.00 0.00 O ATOM 1439 CB LYS A 123 -3.402 4.249 8.101 1.00 0.00 C ATOM 1440 CG LYS A 123 -2.234 3.327 8.408 1.00 0.00 C ATOM 1441 CD LYS A 123 -2.284 2.821 9.839 1.00 0.00 C ATOM 1442 CE LYS A 123 -1.357 1.633 10.043 1.00 0.00 C ATOM 1443 NZ LYS A 123 0.044 2.061 10.309 1.00 0.00 N ATOM 0 H LYS A 123 -2.984 2.440 6.036 1.00 0.00 H new ATOM 0 HA LYS A 123 -4.744 4.776 6.507 1.00 0.00 H new ATOM 0 HB2 LYS A 123 -3.157 5.256 8.437 1.00 0.00 H new ATOM 0 HB3 LYS A 123 -4.271 3.924 8.674 1.00 0.00 H new ATOM 0 HG2 LYS A 123 -2.247 2.481 7.721 1.00 0.00 H new ATOM 0 HG3 LYS A 123 -1.297 3.858 8.241 1.00 0.00 H new ATOM 0 HD2 LYS A 123 -2.003 3.624 10.520 1.00 0.00 H new ATOM 0 HD3 LYS A 123 -3.305 2.534 10.089 1.00 0.00 H new ATOM 0 HE2 LYS A 123 -1.717 1.031 10.877 1.00 0.00 H new ATOM 0 HE3 LYS A 123 -1.381 0.998 9.157 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 0.644 1.222 10.442 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 0.397 2.614 9.502 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 0.071 2.646 11.168 1.00 0.00 H new ATOM 1457 N PRO A 124 -2.898 6.444 5.875 1.00 0.00 N ATOM 1458 CA PRO A 124 -1.987 7.364 5.187 1.00 0.00 C ATOM 1459 C PRO A 124 -0.612 7.417 5.845 1.00 0.00 C ATOM 1460 O PRO A 124 -0.327 8.313 6.639 1.00 0.00 O ATOM 1461 CB PRO A 124 -2.690 8.717 5.309 1.00 0.00 C ATOM 1462 CG PRO A 124 -3.544 8.592 6.524 1.00 0.00 C ATOM 1463 CD PRO A 124 -3.980 7.154 6.577 1.00 0.00 C ATOM 0 HA PRO A 124 -1.799 7.058 4.158 1.00 0.00 H new ATOM 0 HB2 PRO A 124 -1.970 9.529 5.413 1.00 0.00 H new ATOM 0 HB3 PRO A 124 -3.289 8.933 4.424 1.00 0.00 H new ATOM 0 HG2 PRO A 124 -2.988 8.865 7.421 1.00 0.00 H new ATOM 0 HG3 PRO A 124 -4.404 9.259 6.467 1.00 0.00 H new ATOM 0 HD2 PRO A 124 -4.090 6.805 7.604 1.00 0.00 H new ATOM 0 HD3 PRO A 124 -4.942 7.007 6.086 1.00 0.00 H new ATOM 1471 N ALA A 125 0.237 6.451 5.509 1.00 0.00 N ATOM 1472 CA ALA A 125 1.583 6.390 6.065 1.00 0.00 C ATOM 1473 C ALA A 125 2.226 7.773 6.101 1.00 0.00 C ATOM 1474 O ALA A 125 1.734 8.712 5.476 1.00 0.00 O ATOM 1475 CB ALA A 125 2.444 5.427 5.261 1.00 0.00 C ATOM 0 H ALA A 125 0.016 5.700 4.855 1.00 0.00 H new ATOM 0 HA ALA A 125 1.509 6.025 7.090 1.00 0.00 H new ATOM 0 HB1 ALA A 125 3.446 5.392 5.688 1.00 0.00 H new ATOM 0 HB2 ALA A 125 2.002 4.431 5.291 1.00 0.00 H new ATOM 0 HB3 ALA A 125 2.502 5.767 4.227 1.00 0.00 H new ATOM 1481 N ALA A 126 3.327 7.890 6.836 1.00 0.00 N ATOM 1482 CA ALA A 126 4.037 9.157 6.951 1.00 0.00 C ATOM 1483 C ALA A 126 3.114 10.259 7.459 1.00 0.00 C ATOM 1484 O ALA A 126 3.043 11.340 6.875 1.00 0.00 O ATOM 1485 CB ALA A 126 4.641 9.548 5.610 1.00 0.00 C ATOM 0 H ALA A 126 3.746 7.122 7.361 1.00 0.00 H new ATOM 0 HA ALA A 126 4.841 9.030 7.676 1.00 0.00 H new ATOM 0 HB1 ALA A 126 5.168 10.497 5.711 1.00 0.00 H new ATOM 0 HB2 ALA A 126 5.340 8.777 5.287 1.00 0.00 H new ATOM 0 HB3 ALA A 126 3.848 9.651 4.870 1.00 0.00 H new ATOM 1491 N SER A 127 2.409 9.978 8.550 1.00 0.00 N ATOM 1492 CA SER A 127 1.486 10.945 9.134 1.00 0.00 C ATOM 1493 C SER A 127 1.102 10.540 10.554 1.00 0.00 C ATOM 1494 O SER A 127 0.527 9.474 10.772 1.00 0.00 O ATOM 1495 CB SER A 127 0.231 11.070 8.269 1.00 0.00 C ATOM 1496 OG SER A 127 -0.662 12.033 8.802 1.00 0.00 O ATOM 0 H SER A 127 2.459 9.089 9.048 1.00 0.00 H new ATOM 0 HA SER A 127 1.988 11.912 9.174 1.00 0.00 H new ATOM 0 HB2 SER A 127 0.512 11.352 7.254 1.00 0.00 H new ATOM 0 HB3 SER A 127 -0.268 10.103 8.205 1.00 0.00 H new ATOM 0 HG SER A 127 -1.455 12.095 8.230 1.00 0.00 H new ATOM 1502 N GLU A 128 1.424 11.399 11.516 1.00 0.00 N ATOM 1503 CA GLU A 128 1.113 11.130 12.915 1.00 0.00 C ATOM 1504 C GLU A 128 -0.169 11.844 13.334 1.00 0.00 C ATOM 1505 O GLU A 128 -1.105 11.221 13.832 1.00 0.00 O ATOM 1506 CB GLU A 128 2.272 11.571 13.811 1.00 0.00 C ATOM 1507 CG GLU A 128 2.277 10.899 15.174 1.00 0.00 C ATOM 1508 CD GLU A 128 2.353 9.387 15.079 1.00 0.00 C ATOM 1509 OE1 GLU A 128 2.950 8.884 14.104 1.00 0.00 O ATOM 1510 OE2 GLU A 128 1.817 8.708 15.978 1.00 0.00 O ATOM 0 H GLU A 128 1.900 12.286 11.352 1.00 0.00 H new ATOM 0 HA GLU A 128 0.964 10.056 13.028 1.00 0.00 H new ATOM 0 HB2 GLU A 128 3.213 11.356 13.306 1.00 0.00 H new ATOM 0 HB3 GLU A 128 2.224 12.651 13.948 1.00 0.00 H new ATOM 0 HG2 GLU A 128 3.125 11.266 15.753 1.00 0.00 H new ATOM 0 HG3 GLU A 128 1.375 11.180 15.717 1.00 0.00 H new ATOM 1517 N GLY A 129 -0.202 13.158 13.129 1.00 0.00 N ATOM 1518 CA GLY A 129 -1.372 13.936 13.491 1.00 0.00 C ATOM 1519 C GLY A 129 -1.056 15.406 13.678 1.00 0.00 C ATOM 1520 O GLY A 129 0.029 15.865 13.318 1.00 0.00 O ATOM 0 H GLY A 129 0.561 13.697 12.719 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -2.131 13.827 12.716 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -1.797 13.539 14.413 1.00 0.00 H new ATOM 1524 N ARG A 130 -2.005 16.148 14.240 1.00 0.00 N ATOM 1525 CA ARG A 130 -1.823 17.576 14.470 1.00 0.00 C ATOM 1526 C ARG A 130 -2.955 18.137 15.325 1.00 0.00 C ATOM 1527 O ARG A 130 -4.007 17.515 15.467 1.00 0.00 O ATOM 1528 CB ARG A 130 -1.755 18.324 13.138 1.00 0.00 C ATOM 1529 CG ARG A 130 -3.096 18.427 12.429 1.00 0.00 C ATOM 1530 CD ARG A 130 -3.329 17.241 11.505 1.00 0.00 C ATOM 1531 NE ARG A 130 -3.974 16.128 12.196 1.00 0.00 N ATOM 1532 CZ ARG A 130 -5.220 16.171 12.655 1.00 0.00 C ATOM 1533 NH1 ARG A 130 -5.951 17.266 12.498 1.00 0.00 N ATOM 1534 NH2 ARG A 130 -5.738 15.117 13.273 1.00 0.00 N ATOM 0 H ARG A 130 -2.908 15.784 14.544 1.00 0.00 H new ATOM 0 HA ARG A 130 -0.884 17.716 15.005 1.00 0.00 H new ATOM 0 HB2 ARG A 130 -1.368 19.328 13.314 1.00 0.00 H new ATOM 0 HB3 ARG A 130 -1.045 17.819 12.483 1.00 0.00 H new ATOM 0 HG2 ARG A 130 -3.896 18.478 13.167 1.00 0.00 H new ATOM 0 HG3 ARG A 130 -3.135 19.352 11.853 1.00 0.00 H new ATOM 0 HD2 ARG A 130 -3.948 17.553 10.664 1.00 0.00 H new ATOM 0 HD3 ARG A 130 -2.376 16.909 11.094 1.00 0.00 H new ATOM 0 HE ARG A 130 -3.439 15.271 12.334 1.00 0.00 H new ATOM 0 HH11 ARG A 130 -5.557 18.079 12.024 1.00 0.00 H new ATOM 0 HH12 ARG A 130 -6.907 17.296 12.852 1.00 0.00 H new ATOM 0 HH21 ARG A 130 -5.179 14.273 13.396 1.00 0.00 H new ATOM 0 HH22 ARG A 130 -6.695 15.151 13.625 1.00 0.00 H new ATOM 1548 N GLY A 131 -2.731 19.318 15.894 1.00 0.00 N ATOM 1549 CA GLY A 131 -3.740 19.943 16.728 1.00 0.00 C ATOM 1550 C GLY A 131 -3.531 21.438 16.870 1.00 0.00 C ATOM 1551 O GLY A 131 -2.828 21.889 17.773 1.00 0.00 O ATOM 0 H GLY A 131 -1.868 19.853 15.792 1.00 0.00 H new ATOM 0 HA2 GLY A 131 -4.726 19.756 16.302 1.00 0.00 H new ATOM 0 HA3 GLY A 131 -3.727 19.482 17.716 1.00 0.00 H new ATOM 1555 N GLU A 132 -4.142 22.207 15.974 1.00 0.00 N ATOM 1556 CA GLU A 132 -4.016 23.659 16.003 1.00 0.00 C ATOM 1557 C GLU A 132 -4.373 24.209 17.381 1.00 0.00 C ATOM 1558 O GLU A 132 -5.014 23.532 18.185 1.00 0.00 O ATOM 1559 CB GLU A 132 -4.917 24.293 14.941 1.00 0.00 C ATOM 1560 CG GLU A 132 -4.304 24.304 13.551 1.00 0.00 C ATOM 1561 CD GLU A 132 -4.939 25.338 12.642 1.00 0.00 C ATOM 1562 OE1 GLU A 132 -6.068 25.097 12.165 1.00 0.00 O ATOM 1563 OE2 GLU A 132 -4.307 26.389 12.407 1.00 0.00 O ATOM 0 H GLU A 132 -4.728 21.849 15.220 1.00 0.00 H new ATOM 0 HA GLU A 132 -2.978 23.912 15.787 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -5.862 23.751 14.908 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -5.147 25.317 15.236 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -3.235 24.503 13.631 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -4.412 23.316 13.103 1.00 0.00 H new ATOM 1570 N SER A 133 -3.951 25.441 17.647 1.00 0.00 N ATOM 1571 CA SER A 133 -4.221 26.081 18.929 1.00 0.00 C ATOM 1572 C SER A 133 -4.974 27.394 18.734 1.00 0.00 C ATOM 1573 O SER A 133 -4.953 27.979 17.652 1.00 0.00 O ATOM 1574 CB SER A 133 -2.914 26.338 19.681 1.00 0.00 C ATOM 1575 OG SER A 133 -3.150 27.033 20.893 1.00 0.00 O ATOM 0 H SER A 133 -3.421 26.016 16.992 1.00 0.00 H new ATOM 0 HA SER A 133 -4.845 25.408 19.517 1.00 0.00 H new ATOM 0 HB2 SER A 133 -2.420 25.390 19.892 1.00 0.00 H new ATOM 0 HB3 SER A 133 -2.237 26.917 19.052 1.00 0.00 H new ATOM 0 HG SER A 133 -2.299 27.183 21.355 1.00 0.00 H new ATOM 1581 N GLY A 134 -5.641 27.850 19.790 1.00 0.00 N ATOM 1582 CA GLY A 134 -6.392 29.089 19.715 1.00 0.00 C ATOM 1583 C GLY A 134 -7.354 29.255 20.874 1.00 0.00 C ATOM 1584 O GLY A 134 -7.918 28.287 21.384 1.00 0.00 O ATOM 0 H GLY A 134 -5.674 27.383 20.696 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -5.699 29.930 19.699 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -6.948 29.117 18.778 1.00 0.00 H new ATOM 1588 N PRO A 135 -7.552 30.509 21.309 1.00 0.00 N ATOM 1589 CA PRO A 135 -8.452 30.828 22.421 1.00 0.00 C ATOM 1590 C PRO A 135 -9.918 30.617 22.060 1.00 0.00 C ATOM 1591 O PRO A 135 -10.563 31.504 21.500 1.00 0.00 O ATOM 1592 CB PRO A 135 -8.174 32.309 22.688 1.00 0.00 C ATOM 1593 CG PRO A 135 -7.670 32.840 21.391 1.00 0.00 C ATOM 1594 CD PRO A 135 -6.913 31.711 20.748 1.00 0.00 C ATOM 0 HA PRO A 135 -8.278 30.185 23.284 1.00 0.00 H new ATOM 0 HB2 PRO A 135 -9.077 32.830 23.005 1.00 0.00 H new ATOM 0 HB3 PRO A 135 -7.437 32.437 23.481 1.00 0.00 H new ATOM 0 HG2 PRO A 135 -8.494 33.169 20.757 1.00 0.00 H new ATOM 0 HG3 PRO A 135 -7.024 33.704 21.547 1.00 0.00 H new ATOM 0 HD2 PRO A 135 -6.995 31.740 19.661 1.00 0.00 H new ATOM 0 HD3 PRO A 135 -5.851 31.751 20.989 1.00 0.00 H new ATOM 1602 N SER A 136 -10.439 29.438 22.383 1.00 0.00 N ATOM 1603 CA SER A 136 -11.829 29.111 22.089 1.00 0.00 C ATOM 1604 C SER A 136 -12.718 29.375 23.301 1.00 0.00 C ATOM 1605 O SER A 136 -13.846 29.848 23.165 1.00 0.00 O ATOM 1606 CB SER A 136 -11.951 27.646 21.663 1.00 0.00 C ATOM 1607 OG SER A 136 -11.965 26.787 22.790 1.00 0.00 O ATOM 0 H SER A 136 -9.920 28.693 22.848 1.00 0.00 H new ATOM 0 HA SER A 136 -12.161 29.750 21.271 1.00 0.00 H new ATOM 0 HB2 SER A 136 -12.864 27.507 21.084 1.00 0.00 H new ATOM 0 HB3 SER A 136 -11.118 27.383 21.011 1.00 0.00 H new ATOM 0 HG SER A 136 -12.045 25.857 22.492 1.00 0.00 H new ATOM 1613 N SER A 137 -12.200 29.067 24.485 1.00 0.00 N ATOM 1614 CA SER A 137 -12.947 29.267 25.722 1.00 0.00 C ATOM 1615 C SER A 137 -12.016 29.236 26.930 1.00 0.00 C ATOM 1616 O SER A 137 -11.443 28.199 27.260 1.00 0.00 O ATOM 1617 CB SER A 137 -14.028 28.194 25.869 1.00 0.00 C ATOM 1618 OG SER A 137 -14.863 28.461 26.982 1.00 0.00 O ATOM 0 H SER A 137 -11.266 28.678 24.615 1.00 0.00 H new ATOM 0 HA SER A 137 -13.422 30.247 25.676 1.00 0.00 H new ATOM 0 HB2 SER A 137 -14.629 28.152 24.961 1.00 0.00 H new ATOM 0 HB3 SER A 137 -13.561 27.216 25.987 1.00 0.00 H new ATOM 0 HG SER A 137 -15.546 27.762 27.053 1.00 0.00 H new ATOM 1624 N GLY A 138 -11.869 30.384 27.585 1.00 0.00 N ATOM 1625 CA GLY A 138 -11.007 30.468 28.750 1.00 0.00 C ATOM 1626 C GLY A 138 -10.019 31.614 28.657 1.00 0.00 C ATOM 1627 O GLY A 138 -10.339 32.677 28.127 1.00 0.00 O ATOM 0 H GLY A 138 -12.331 31.257 27.330 1.00 0.00 H new ATOM 0 HA2 GLY A 138 -11.619 30.591 29.643 1.00 0.00 H new ATOM 0 HA3 GLY A 138 -10.462 29.531 28.864 1.00 0.00 H new TER 1631 GLY A 138