USER MOD reduce.3.24.130724 H: found=0, std=0, add=800, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 804 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 107 HIS : no HD1:sc= -1.71 K(o=-3.3,f=-2.7) USER MOD Set 1.2: A 111 ASN : amide:sc= -1.36 X(o=-3.3,f=-3.2) USER MOD Set 1.3: B 34 MET CE :methyl 154:sc= -0.18 (180deg=0) USER MOD Set 2.1: A 109 MET CE :methyl -146:sc= -0.53 (180deg=-1.45) USER MOD Set 2.2: A 124 MET CE :methyl 158:sc= -0.115 (180deg=-1.75) USER MOD Single : A 76 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 77 LYS NZ :NH3+ 156:sc= -0.0828 (180deg=-0.556) USER MOD Single : A 79 THR OG1 : rot 180:sc= -0.226 USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 94 LYS NZ :NH3+ -112:sc= 1.01 (180deg=-0.916) USER MOD Single : A 97 ASN : amide:sc= -0.109 K(o=-0.11,f=-1.5!) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 110 THR OG1 : rot -80:sc= 0.996 USER MOD Single : A 115 LYS NZ :NH3+ 165:sc= 1.29 (180deg=0.388) USER MOD Single : A 117 THR OG1 : rot -76:sc= 0.0462 USER MOD Single : A 135 GLN : amide:sc= -2.57! C(o=-2.6!,f=-12!) USER MOD Single : A 137 ASN : amide:sc= -0.825! C(o=-0.82!,f=-0.64!) USER MOD Single : A 138 TYR OH : rot 150:sc= -0.418 USER MOD Single : A 143 GLN : amide:sc= -0.234 X(o=-0.23,f=-0.24) USER MOD Single : A 144 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 145 MET CE :methyl -126:sc= -0.0684 (180deg=-4.31!) USER MOD Single : A 146 THR OG1 : rot 62:sc= 0.154 USER MOD Single : A 148 LYS NZ :NH3+ -175:sc= -1.46! (180deg=-1.59!) USER MOD Single : B 39 THR OG1 : rot 166:sc= 0.222 USER MOD Single : B 47 GLN : amide:sc= -3! C(o=-3!,f=-14!) USER MOD Single : B 48 SER OG : rot 180:sc= 0 USER MOD Single : B 49 GLN : amide:sc= -2.55! K(o=-2.6!,f=-1.6) USER MOD Single : B 52 LYS NZ :NH3+ -155:sc= -0.142 (180deg=-0.874) USER MOD Single : B 54 GLN : amide:sc= -4.9! C(o=-4.9!,f=-2.6!) USER MOD Single : B 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 56 LYS NZ :NH3+ 150:sc= -0.162 (180deg=-1.09) USER MOD Single : B 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 60 SER OG : rot 180:sc= 0 USER MOD Single : B 61 GLN : amide:sc= -0.0175 K(o=-0.017,f=-1.4!) USER MOD Single : B 62 SER OG : rot -39:sc= 0.114 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 76 4.590 -17.059 -14.711 1.00 0.00 N ATOM 2 CA MET A 76 4.965 -16.434 -13.412 1.00 0.00 C ATOM 3 C MET A 76 6.351 -15.812 -13.529 1.00 0.00 C ATOM 4 O MET A 76 7.211 -16.324 -14.246 1.00 0.00 O ATOM 5 CB MET A 76 4.970 -17.504 -12.317 1.00 0.00 C ATOM 6 CG MET A 76 3.562 -17.654 -11.735 1.00 0.00 C ATOM 7 SD MET A 76 3.146 -16.180 -10.769 1.00 0.00 S ATOM 8 CE MET A 76 1.475 -16.685 -10.296 1.00 0.00 C ATOM 0 HA MET A 76 4.243 -15.658 -13.157 1.00 0.00 H new ATOM 0 HB2 MET A 76 5.308 -18.456 -12.727 1.00 0.00 H new ATOM 0 HB3 MET A 76 5.672 -17.229 -11.530 1.00 0.00 H new ATOM 0 HG2 MET A 76 2.838 -17.791 -12.538 1.00 0.00 H new ATOM 0 HG3 MET A 76 3.511 -18.541 -11.104 1.00 0.00 H new ATOM 0 HE1 MET A 76 1.020 -15.908 -9.682 1.00 0.00 H new ATOM 0 HE2 MET A 76 0.874 -16.838 -11.192 1.00 0.00 H new ATOM 0 HE3 MET A 76 1.523 -17.614 -9.728 1.00 0.00 H new ATOM 20 N LYS A 77 6.560 -14.708 -12.818 1.00 0.00 N ATOM 21 CA LYS A 77 7.847 -14.020 -12.842 1.00 0.00 C ATOM 22 C LYS A 77 8.050 -13.315 -14.180 1.00 0.00 C ATOM 23 O LYS A 77 8.313 -12.114 -14.228 1.00 0.00 O ATOM 24 CB LYS A 77 8.980 -15.023 -12.617 1.00 0.00 C ATOM 25 CG LYS A 77 10.176 -14.312 -11.982 1.00 0.00 C ATOM 26 CD LYS A 77 11.315 -15.315 -11.780 1.00 0.00 C ATOM 27 CE LYS A 77 12.430 -14.666 -10.959 1.00 0.00 C ATOM 28 NZ LYS A 77 11.949 -14.429 -9.568 1.00 0.00 N ATOM 0 H LYS A 77 5.858 -14.272 -12.220 1.00 0.00 H new ATOM 0 HA LYS A 77 7.856 -13.277 -12.045 1.00 0.00 H new ATOM 0 HB2 LYS A 77 8.640 -15.832 -11.971 1.00 0.00 H new ATOM 0 HB3 LYS A 77 9.274 -15.474 -13.565 1.00 0.00 H new ATOM 0 HG2 LYS A 77 10.507 -13.493 -12.620 1.00 0.00 H new ATOM 0 HG3 LYS A 77 9.888 -13.875 -11.026 1.00 0.00 H new ATOM 0 HD2 LYS A 77 10.944 -16.204 -11.270 1.00 0.00 H new ATOM 0 HD3 LYS A 77 11.702 -15.640 -12.746 1.00 0.00 H new ATOM 0 HE2 LYS A 77 13.309 -15.310 -10.946 1.00 0.00 H new ATOM 0 HE3 LYS A 77 12.732 -13.724 -11.416 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 12.763 -14.382 -8.922 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 11.425 -13.532 -9.530 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 11.323 -15.208 -9.280 1.00 0.00 H new ATOM 42 N ASP A 78 7.925 -14.075 -15.264 1.00 0.00 N ATOM 43 CA ASP A 78 8.096 -13.515 -16.599 1.00 0.00 C ATOM 44 C ASP A 78 6.744 -13.154 -17.208 1.00 0.00 C ATOM 45 O ASP A 78 6.463 -13.493 -18.357 1.00 0.00 O ATOM 46 CB ASP A 78 8.808 -14.524 -17.502 1.00 0.00 C ATOM 47 CG ASP A 78 9.098 -13.893 -18.860 1.00 0.00 C ATOM 48 OD1 ASP A 78 8.603 -12.804 -19.104 1.00 0.00 O ATOM 49 OD2 ASP A 78 9.810 -14.509 -19.637 1.00 0.00 O ATOM 0 H ASP A 78 7.708 -15.071 -15.245 1.00 0.00 H new ATOM 0 HA ASP A 78 8.699 -12.610 -16.517 1.00 0.00 H new ATOM 0 HB2 ASP A 78 9.738 -14.848 -17.036 1.00 0.00 H new ATOM 0 HB3 ASP A 78 8.188 -15.412 -17.629 1.00 0.00 H new ATOM 54 N THR A 79 5.911 -12.467 -16.434 1.00 0.00 N ATOM 55 CA THR A 79 4.595 -12.069 -16.916 1.00 0.00 C ATOM 56 C THR A 79 4.253 -10.657 -16.454 1.00 0.00 C ATOM 57 O THR A 79 3.997 -9.772 -17.270 1.00 0.00 O ATOM 58 CB THR A 79 3.534 -13.045 -16.402 1.00 0.00 C ATOM 59 OG1 THR A 79 3.544 -13.045 -14.981 1.00 0.00 O ATOM 60 CG2 THR A 79 3.838 -14.453 -16.916 1.00 0.00 C ATOM 0 H THR A 79 6.121 -12.177 -15.479 1.00 0.00 H new ATOM 0 HA THR A 79 4.611 -12.086 -18.006 1.00 0.00 H new ATOM 0 HB THR A 79 2.552 -12.736 -16.760 1.00 0.00 H new ATOM 0 HG1 THR A 79 2.864 -13.668 -14.649 1.00 0.00 H new ATOM 0 HG21 THR A 79 3.081 -15.146 -16.548 1.00 0.00 H new ATOM 0 HG22 THR A 79 3.830 -14.452 -18.006 1.00 0.00 H new ATOM 0 HG23 THR A 79 4.820 -14.766 -16.560 1.00 0.00 H new ATOM 68 N ASP A 80 4.261 -10.451 -15.139 1.00 0.00 N ATOM 69 CA ASP A 80 3.958 -9.138 -14.579 1.00 0.00 C ATOM 70 C ASP A 80 4.198 -9.120 -13.072 1.00 0.00 C ATOM 71 O ASP A 80 3.789 -10.035 -12.361 1.00 0.00 O ATOM 72 CB ASP A 80 2.499 -8.774 -14.866 1.00 0.00 C ATOM 73 CG ASP A 80 2.293 -7.273 -14.701 1.00 0.00 C ATOM 74 OD1 ASP A 80 3.251 -6.595 -14.367 1.00 0.00 O ATOM 75 OD2 ASP A 80 1.178 -6.823 -14.909 1.00 0.00 O ATOM 0 H ASP A 80 4.472 -11.170 -14.447 1.00 0.00 H new ATOM 0 HA ASP A 80 4.619 -8.408 -15.046 1.00 0.00 H new ATOM 0 HB2 ASP A 80 2.233 -9.077 -15.879 1.00 0.00 H new ATOM 0 HB3 ASP A 80 1.840 -9.316 -14.188 1.00 0.00 H new ATOM 80 N SER A 81 4.852 -8.066 -12.594 1.00 0.00 N ATOM 81 CA SER A 81 5.129 -7.923 -11.165 1.00 0.00 C ATOM 82 C SER A 81 3.916 -7.354 -10.442 1.00 0.00 C ATOM 83 O SER A 81 3.898 -7.262 -9.217 1.00 0.00 O ATOM 84 CB SER A 81 6.337 -7.015 -10.943 1.00 0.00 C ATOM 85 OG SER A 81 7.488 -7.615 -11.522 1.00 0.00 O ATOM 0 H SER A 81 5.200 -7.300 -13.171 1.00 0.00 H new ATOM 0 HA SER A 81 5.351 -8.911 -10.760 1.00 0.00 H new ATOM 0 HB2 SER A 81 6.159 -6.037 -11.390 1.00 0.00 H new ATOM 0 HB3 SER A 81 6.494 -6.854 -9.877 1.00 0.00 H new ATOM 0 HG SER A 81 8.265 -7.034 -11.383 1.00 0.00 H new ATOM 91 N GLU A 82 2.911 -6.955 -11.204 1.00 0.00 N ATOM 92 CA GLU A 82 1.715 -6.377 -10.608 1.00 0.00 C ATOM 93 C GLU A 82 1.126 -7.350 -9.598 1.00 0.00 C ATOM 94 O GLU A 82 0.615 -6.946 -8.553 1.00 0.00 O ATOM 95 CB GLU A 82 0.676 -6.072 -11.691 1.00 0.00 C ATOM 96 CG GLU A 82 1.142 -4.896 -12.542 1.00 0.00 C ATOM 97 CD GLU A 82 0.195 -4.703 -13.723 1.00 0.00 C ATOM 98 OE1 GLU A 82 -0.610 -5.588 -13.962 1.00 0.00 O ATOM 99 OE2 GLU A 82 0.289 -3.674 -14.372 1.00 0.00 O ATOM 0 H GLU A 82 2.897 -7.018 -12.222 1.00 0.00 H new ATOM 0 HA GLU A 82 1.986 -5.448 -10.106 1.00 0.00 H new ATOM 0 HB2 GLU A 82 0.525 -6.950 -12.320 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -0.285 -5.841 -11.231 1.00 0.00 H new ATOM 0 HG2 GLU A 82 1.174 -3.989 -11.938 1.00 0.00 H new ATOM 0 HG3 GLU A 82 2.155 -5.075 -12.902 1.00 0.00 H new ATOM 106 N GLU A 83 1.217 -8.631 -9.912 1.00 0.00 N ATOM 107 CA GLU A 83 0.707 -9.671 -9.026 1.00 0.00 C ATOM 108 C GLU A 83 1.518 -9.732 -7.729 1.00 0.00 C ATOM 109 O GLU A 83 1.006 -10.137 -6.686 1.00 0.00 O ATOM 110 CB GLU A 83 0.800 -11.022 -9.739 1.00 0.00 C ATOM 111 CG GLU A 83 2.274 -11.408 -9.913 1.00 0.00 C ATOM 112 CD GLU A 83 2.390 -12.593 -10.867 1.00 0.00 C ATOM 113 OE1 GLU A 83 1.364 -13.044 -11.348 1.00 0.00 O ATOM 114 OE2 GLU A 83 3.504 -13.032 -11.101 1.00 0.00 O ATOM 0 H GLU A 83 1.639 -8.979 -10.773 1.00 0.00 H new ATOM 0 HA GLU A 83 -0.329 -9.440 -8.777 1.00 0.00 H new ATOM 0 HB2 GLU A 83 0.279 -11.786 -9.163 1.00 0.00 H new ATOM 0 HB3 GLU A 83 0.310 -10.967 -10.711 1.00 0.00 H new ATOM 0 HG2 GLU A 83 2.838 -10.560 -10.302 1.00 0.00 H new ATOM 0 HG3 GLU A 83 2.709 -11.664 -8.947 1.00 0.00 H new ATOM 121 N GLU A 84 2.791 -9.348 -7.804 1.00 0.00 N ATOM 122 CA GLU A 84 3.660 -9.386 -6.629 1.00 0.00 C ATOM 123 C GLU A 84 3.140 -8.448 -5.540 1.00 0.00 C ATOM 124 O GLU A 84 3.054 -8.823 -4.369 1.00 0.00 O ATOM 125 CB GLU A 84 5.088 -8.986 -7.020 1.00 0.00 C ATOM 126 CG GLU A 84 6.012 -9.115 -5.805 1.00 0.00 C ATOM 127 CD GLU A 84 7.446 -8.784 -6.202 1.00 0.00 C ATOM 128 OE1 GLU A 84 7.662 -8.468 -7.361 1.00 0.00 O ATOM 129 OE2 GLU A 84 8.308 -8.849 -5.342 1.00 0.00 O ATOM 0 H GLU A 84 3.240 -9.011 -8.656 1.00 0.00 H new ATOM 0 HA GLU A 84 3.664 -10.403 -6.238 1.00 0.00 H new ATOM 0 HB2 GLU A 84 5.445 -9.622 -7.830 1.00 0.00 H new ATOM 0 HB3 GLU A 84 5.100 -7.961 -7.391 1.00 0.00 H new ATOM 0 HG2 GLU A 84 5.681 -8.443 -5.013 1.00 0.00 H new ATOM 0 HG3 GLU A 84 5.961 -10.128 -5.405 1.00 0.00 H new ATOM 136 N ILE A 85 2.785 -7.230 -5.936 1.00 0.00 N ATOM 137 CA ILE A 85 2.266 -6.253 -4.991 1.00 0.00 C ATOM 138 C ILE A 85 0.850 -6.626 -4.575 1.00 0.00 C ATOM 139 O ILE A 85 0.414 -6.328 -3.464 1.00 0.00 O ATOM 140 CB ILE A 85 2.285 -4.857 -5.601 1.00 0.00 C ATOM 141 CG1 ILE A 85 3.677 -4.608 -6.190 1.00 0.00 C ATOM 142 CG2 ILE A 85 1.983 -3.823 -4.507 1.00 0.00 C ATOM 143 CD1 ILE A 85 3.995 -3.118 -6.159 1.00 0.00 C ATOM 0 H ILE A 85 2.847 -6.899 -6.899 1.00 0.00 H new ATOM 0 HA ILE A 85 2.904 -6.253 -4.107 1.00 0.00 H new ATOM 0 HB ILE A 85 1.532 -4.771 -6.385 1.00 0.00 H new ATOM 0 HG12 ILE A 85 4.426 -5.160 -5.622 1.00 0.00 H new ATOM 0 HG13 ILE A 85 3.719 -4.976 -7.215 1.00 0.00 H new ATOM 0 HG21 ILE A 85 1.996 -2.822 -4.939 1.00 0.00 H new ATOM 0 HG22 ILE A 85 1.000 -4.022 -4.080 1.00 0.00 H new ATOM 0 HG23 ILE A 85 2.739 -3.890 -3.724 1.00 0.00 H new ATOM 0 HD11 ILE A 85 4.986 -2.949 -6.579 1.00 0.00 H new ATOM 0 HD12 ILE A 85 3.254 -2.576 -6.746 1.00 0.00 H new ATOM 0 HD13 ILE A 85 3.972 -2.762 -5.129 1.00 0.00 H new ATOM 155 N ARG A 86 0.143 -7.300 -5.469 1.00 0.00 N ATOM 156 CA ARG A 86 -1.216 -7.731 -5.186 1.00 0.00 C ATOM 157 C ARG A 86 -1.224 -8.660 -3.980 1.00 0.00 C ATOM 158 O ARG A 86 -2.114 -8.590 -3.136 1.00 0.00 O ATOM 159 CB ARG A 86 -1.788 -8.446 -6.408 1.00 0.00 C ATOM 160 CG ARG A 86 -3.213 -8.913 -6.125 1.00 0.00 C ATOM 161 CD ARG A 86 -3.844 -9.397 -7.429 1.00 0.00 C ATOM 162 NE ARG A 86 -4.129 -8.263 -8.300 1.00 0.00 N ATOM 163 CZ ARG A 86 -4.668 -8.438 -9.501 1.00 0.00 C ATOM 164 NH1 ARG A 86 -4.946 -9.641 -9.921 1.00 0.00 N ATOM 165 NH2 ARG A 86 -4.922 -7.406 -10.259 1.00 0.00 N ATOM 0 H ARG A 86 0.487 -7.559 -6.394 1.00 0.00 H new ATOM 0 HA ARG A 86 -1.833 -6.861 -4.961 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -1.781 -7.775 -7.267 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -1.162 -9.300 -6.665 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -3.207 -9.716 -5.388 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -3.800 -8.097 -5.702 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -3.171 -10.091 -7.932 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -4.764 -9.942 -7.216 1.00 0.00 H new ATOM 0 HE ARG A 86 -3.911 -7.319 -7.981 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -4.749 -10.447 -9.327 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -5.360 -9.776 -10.843 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -4.706 -6.465 -9.929 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -5.336 -7.540 -11.181 1.00 0.00 H new ATOM 179 N GLU A 87 -0.218 -9.526 -3.902 1.00 0.00 N ATOM 180 CA GLU A 87 -0.118 -10.459 -2.788 1.00 0.00 C ATOM 181 C GLU A 87 -0.047 -9.679 -1.479 1.00 0.00 C ATOM 182 O GLU A 87 -0.703 -10.027 -0.497 1.00 0.00 O ATOM 183 CB GLU A 87 1.135 -11.326 -2.947 1.00 0.00 C ATOM 184 CG GLU A 87 1.223 -12.333 -1.797 1.00 0.00 C ATOM 185 CD GLU A 87 2.443 -13.228 -1.982 1.00 0.00 C ATOM 186 OE1 GLU A 87 3.536 -12.695 -2.070 1.00 0.00 O ATOM 187 OE2 GLU A 87 2.267 -14.434 -2.031 1.00 0.00 O ATOM 0 H GLU A 87 0.532 -9.600 -4.590 1.00 0.00 H new ATOM 0 HA GLU A 87 -0.996 -11.105 -2.776 1.00 0.00 H new ATOM 0 HB2 GLU A 87 1.105 -11.852 -3.901 1.00 0.00 H new ATOM 0 HB3 GLU A 87 2.024 -10.696 -2.959 1.00 0.00 H new ATOM 0 HG2 GLU A 87 1.289 -11.806 -0.845 1.00 0.00 H new ATOM 0 HG3 GLU A 87 0.318 -12.940 -1.763 1.00 0.00 H new ATOM 194 N ALA A 88 0.755 -8.621 -1.479 1.00 0.00 N ATOM 195 CA ALA A 88 0.911 -7.785 -0.293 1.00 0.00 C ATOM 196 C ALA A 88 -0.423 -7.169 0.120 1.00 0.00 C ATOM 197 O ALA A 88 -0.726 -7.073 1.309 1.00 0.00 O ATOM 198 CB ALA A 88 1.925 -6.675 -0.569 1.00 0.00 C ATOM 0 H ALA A 88 1.306 -8.322 -2.283 1.00 0.00 H new ATOM 0 HA ALA A 88 1.269 -8.413 0.522 1.00 0.00 H new ATOM 0 HB1 ALA A 88 2.037 -6.055 0.320 1.00 0.00 H new ATOM 0 HB2 ALA A 88 2.888 -7.117 -0.826 1.00 0.00 H new ATOM 0 HB3 ALA A 88 1.575 -6.060 -1.398 1.00 0.00 H new ATOM 204 N PHE A 89 -1.234 -6.779 -0.862 1.00 0.00 N ATOM 205 CA PHE A 89 -2.545 -6.212 -0.563 1.00 0.00 C ATOM 206 C PHE A 89 -3.524 -7.316 -0.170 1.00 0.00 C ATOM 207 O PHE A 89 -4.304 -7.164 0.770 1.00 0.00 O ATOM 208 CB PHE A 89 -3.073 -5.436 -1.770 1.00 0.00 C ATOM 209 CG PHE A 89 -2.425 -4.071 -1.802 1.00 0.00 C ATOM 210 CD1 PHE A 89 -2.828 -3.091 -0.886 1.00 0.00 C ATOM 211 CD2 PHE A 89 -1.427 -3.782 -2.743 1.00 0.00 C ATOM 212 CE1 PHE A 89 -2.235 -1.824 -0.909 1.00 0.00 C ATOM 213 CE2 PHE A 89 -0.833 -2.510 -2.764 1.00 0.00 C ATOM 214 CZ PHE A 89 -1.239 -1.533 -1.847 1.00 0.00 C ATOM 0 H PHE A 89 -1.011 -6.844 -1.855 1.00 0.00 H new ATOM 0 HA PHE A 89 -2.445 -5.524 0.276 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -2.854 -5.978 -2.690 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -4.157 -5.337 -1.708 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -3.597 -3.314 -0.161 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -1.116 -4.536 -3.450 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -2.547 -1.070 -0.202 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -0.063 -2.285 -3.487 1.00 0.00 H new ATOM 0 HZ PHE A 89 -0.783 -0.554 -1.864 1.00 0.00 H new ATOM 224 N ARG A 90 -3.487 -8.420 -0.914 1.00 0.00 N ATOM 225 CA ARG A 90 -4.392 -9.534 -0.649 1.00 0.00 C ATOM 226 C ARG A 90 -4.380 -9.888 0.830 1.00 0.00 C ATOM 227 O ARG A 90 -5.352 -10.431 1.354 1.00 0.00 O ATOM 228 CB ARG A 90 -4.011 -10.758 -1.486 1.00 0.00 C ATOM 229 CG ARG A 90 -4.536 -10.579 -2.914 1.00 0.00 C ATOM 230 CD ARG A 90 -4.004 -11.701 -3.808 1.00 0.00 C ATOM 231 NE ARG A 90 -4.639 -11.644 -5.121 1.00 0.00 N ATOM 232 CZ ARG A 90 -4.231 -12.426 -6.115 1.00 0.00 C ATOM 233 NH1 ARG A 90 -3.246 -13.261 -5.926 1.00 0.00 N ATOM 234 NH2 ARG A 90 -4.813 -12.356 -7.281 1.00 0.00 N ATOM 0 H ARG A 90 -2.848 -8.566 -1.696 1.00 0.00 H new ATOM 0 HA ARG A 90 -5.399 -9.225 -0.929 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -2.928 -10.882 -1.497 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -4.431 -11.661 -1.043 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -5.626 -10.588 -2.914 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -4.225 -9.611 -3.307 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -2.923 -11.609 -3.915 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -4.198 -12.668 -3.344 1.00 0.00 H new ATOM 0 HE ARG A 90 -5.409 -10.993 -5.278 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -2.789 -13.313 -5.015 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -2.933 -13.861 -6.689 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -5.581 -11.701 -7.429 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -4.500 -12.956 -8.044 1.00 0.00 H new ATOM 248 N VAL A 91 -3.290 -9.555 1.507 1.00 0.00 N ATOM 249 CA VAL A 91 -3.183 -9.819 2.934 1.00 0.00 C ATOM 250 C VAL A 91 -4.265 -9.053 3.687 1.00 0.00 C ATOM 251 O VAL A 91 -4.865 -9.570 4.629 1.00 0.00 O ATOM 252 CB VAL A 91 -1.802 -9.401 3.440 1.00 0.00 C ATOM 253 CG1 VAL A 91 -1.779 -9.456 4.968 1.00 0.00 C ATOM 254 CG2 VAL A 91 -0.746 -10.357 2.881 1.00 0.00 C ATOM 0 H VAL A 91 -2.473 -9.105 1.094 1.00 0.00 H new ATOM 0 HA VAL A 91 -3.317 -10.887 3.108 1.00 0.00 H new ATOM 0 HB VAL A 91 -1.587 -8.385 3.110 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -0.794 -9.158 5.328 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -2.532 -8.777 5.368 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -1.994 -10.472 5.299 1.00 0.00 H new ATOM 0 HG21 VAL A 91 0.240 -10.061 3.240 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -0.963 -11.373 3.212 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -0.761 -10.319 1.792 1.00 0.00 H new ATOM 264 N PHE A 92 -4.502 -7.810 3.270 1.00 0.00 N ATOM 265 CA PHE A 92 -5.510 -6.978 3.921 1.00 0.00 C ATOM 266 C PHE A 92 -6.899 -7.225 3.328 1.00 0.00 C ATOM 267 O PHE A 92 -7.908 -7.025 4.002 1.00 0.00 O ATOM 268 CB PHE A 92 -5.152 -5.499 3.760 1.00 0.00 C ATOM 269 CG PHE A 92 -3.698 -5.274 4.118 1.00 0.00 C ATOM 270 CD1 PHE A 92 -3.208 -5.651 5.378 1.00 0.00 C ATOM 271 CD2 PHE A 92 -2.836 -4.676 3.188 1.00 0.00 C ATOM 272 CE1 PHE A 92 -1.864 -5.430 5.702 1.00 0.00 C ATOM 273 CE2 PHE A 92 -1.495 -4.458 3.516 1.00 0.00 C ATOM 274 CZ PHE A 92 -1.008 -4.835 4.772 1.00 0.00 C ATOM 0 H PHE A 92 -4.016 -7.362 2.493 1.00 0.00 H new ATOM 0 HA PHE A 92 -5.529 -7.243 4.978 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -5.335 -5.182 2.733 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -5.791 -4.890 4.400 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -3.868 -6.112 6.098 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -3.208 -4.384 2.217 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -1.488 -5.720 6.672 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -0.833 -3.997 2.798 1.00 0.00 H new ATOM 0 HZ PHE A 92 0.029 -4.666 5.023 1.00 0.00 H new ATOM 284 N ASP A 93 -6.949 -7.674 2.075 1.00 0.00 N ATOM 285 CA ASP A 93 -8.234 -7.952 1.437 1.00 0.00 C ATOM 286 C ASP A 93 -8.655 -9.387 1.727 1.00 0.00 C ATOM 287 O ASP A 93 -8.539 -10.261 0.867 1.00 0.00 O ATOM 288 CB ASP A 93 -8.150 -7.750 -0.077 1.00 0.00 C ATOM 289 CG ASP A 93 -9.545 -7.854 -0.687 1.00 0.00 C ATOM 290 OD1 ASP A 93 -10.474 -8.128 0.055 1.00 0.00 O ATOM 291 OD2 ASP A 93 -9.663 -7.664 -1.886 1.00 0.00 O ATOM 0 H ASP A 93 -6.132 -7.850 1.491 1.00 0.00 H new ATOM 0 HA ASP A 93 -8.970 -7.258 1.843 1.00 0.00 H new ATOM 0 HB2 ASP A 93 -7.717 -6.775 -0.300 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -7.493 -8.500 -0.518 1.00 0.00 H new ATOM 296 N LYS A 94 -9.134 -9.628 2.941 1.00 0.00 N ATOM 297 CA LYS A 94 -9.563 -10.964 3.338 1.00 0.00 C ATOM 298 C LYS A 94 -10.852 -11.372 2.642 1.00 0.00 C ATOM 299 O LYS A 94 -11.161 -12.559 2.535 1.00 0.00 O ATOM 300 CB LYS A 94 -9.785 -11.001 4.847 1.00 0.00 C ATOM 301 CG LYS A 94 -10.610 -9.786 5.276 1.00 0.00 C ATOM 302 CD LYS A 94 -11.080 -9.970 6.720 1.00 0.00 C ATOM 303 CE LYS A 94 -12.508 -10.517 6.724 1.00 0.00 C ATOM 304 NZ LYS A 94 -13.442 -9.464 6.230 1.00 0.00 N ATOM 0 H LYS A 94 -9.235 -8.918 3.666 1.00 0.00 H new ATOM 0 HA LYS A 94 -8.779 -11.663 3.047 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -10.301 -11.920 5.126 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -8.826 -11.003 5.366 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -10.012 -8.879 5.190 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -11.469 -9.665 4.616 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -10.415 -10.655 7.246 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -11.042 -9.019 7.250 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -12.572 -11.402 6.091 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -12.789 -10.825 7.731 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -14.054 -9.150 7.010 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -12.895 -8.655 5.872 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -14.029 -9.852 5.464 1.00 0.00 H new ATOM 318 N ASP A 95 -11.601 -10.389 2.168 1.00 0.00 N ATOM 319 CA ASP A 95 -12.857 -10.670 1.483 1.00 0.00 C ATOM 320 C ASP A 95 -12.609 -11.021 0.020 1.00 0.00 C ATOM 321 O ASP A 95 -13.408 -11.721 -0.603 1.00 0.00 O ATOM 322 CB ASP A 95 -13.783 -9.456 1.567 1.00 0.00 C ATOM 323 CG ASP A 95 -14.271 -9.270 2.999 1.00 0.00 C ATOM 324 OD1 ASP A 95 -14.109 -10.190 3.784 1.00 0.00 O ATOM 325 OD2 ASP A 95 -14.803 -8.211 3.291 1.00 0.00 O ATOM 0 H ASP A 95 -11.367 -9.399 2.243 1.00 0.00 H new ATOM 0 HA ASP A 95 -13.328 -11.522 1.973 1.00 0.00 H new ATOM 0 HB2 ASP A 95 -13.255 -8.562 1.235 1.00 0.00 H new ATOM 0 HB3 ASP A 95 -14.634 -9.590 0.899 1.00 0.00 H new ATOM 330 N GLY A 96 -11.502 -10.529 -0.527 1.00 0.00 N ATOM 331 CA GLY A 96 -11.175 -10.802 -1.921 1.00 0.00 C ATOM 332 C GLY A 96 -12.167 -10.106 -2.848 1.00 0.00 C ATOM 333 O GLY A 96 -12.486 -10.612 -3.923 1.00 0.00 O ATOM 0 H GLY A 96 -10.825 -9.947 -0.034 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -10.163 -10.459 -2.137 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -11.192 -11.877 -2.101 1.00 0.00 H new ATOM 337 N ASN A 97 -12.653 -8.945 -2.420 1.00 0.00 N ATOM 338 CA ASN A 97 -13.610 -8.188 -3.219 1.00 0.00 C ATOM 339 C ASN A 97 -12.901 -7.116 -4.040 1.00 0.00 C ATOM 340 O ASN A 97 -13.535 -6.386 -4.802 1.00 0.00 O ATOM 341 CB ASN A 97 -14.649 -7.531 -2.307 1.00 0.00 C ATOM 342 CG ASN A 97 -15.887 -7.154 -3.113 1.00 0.00 C ATOM 343 OD1 ASN A 97 -16.271 -7.874 -4.035 1.00 0.00 O ATOM 344 ND2 ASN A 97 -16.536 -6.060 -2.820 1.00 0.00 N ATOM 0 H ASN A 97 -12.402 -8.511 -1.532 1.00 0.00 H new ATOM 0 HA ASN A 97 -14.108 -8.878 -3.900 1.00 0.00 H new ATOM 0 HB2 ASN A 97 -14.923 -8.214 -1.503 1.00 0.00 H new ATOM 0 HB3 ASN A 97 -14.225 -6.642 -1.840 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -17.364 -5.799 -3.355 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -16.215 -5.466 -2.056 1.00 0.00 H new ATOM 351 N GLY A 98 -11.583 -7.031 -3.886 1.00 0.00 N ATOM 352 CA GLY A 98 -10.801 -6.044 -4.624 1.00 0.00 C ATOM 353 C GLY A 98 -10.595 -4.767 -3.809 1.00 0.00 C ATOM 354 O GLY A 98 -10.059 -3.782 -4.318 1.00 0.00 O ATOM 0 H GLY A 98 -11.038 -7.627 -3.263 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -9.832 -6.469 -4.887 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -11.307 -5.802 -5.559 1.00 0.00 H new ATOM 358 N TYR A 99 -11.027 -4.786 -2.548 1.00 0.00 N ATOM 359 CA TYR A 99 -10.883 -3.608 -1.689 1.00 0.00 C ATOM 360 C TYR A 99 -10.362 -3.981 -0.305 1.00 0.00 C ATOM 361 O TYR A 99 -10.496 -5.120 0.141 1.00 0.00 O ATOM 362 CB TYR A 99 -12.225 -2.898 -1.530 1.00 0.00 C ATOM 363 CG TYR A 99 -12.796 -2.556 -2.881 1.00 0.00 C ATOM 364 CD1 TYR A 99 -13.319 -3.570 -3.685 1.00 0.00 C ATOM 365 CD2 TYR A 99 -12.791 -1.232 -3.334 1.00 0.00 C ATOM 366 CE1 TYR A 99 -13.844 -3.266 -4.946 1.00 0.00 C ATOM 367 CE2 TYR A 99 -13.316 -0.925 -4.596 1.00 0.00 C ATOM 368 CZ TYR A 99 -13.843 -1.942 -5.402 1.00 0.00 C ATOM 369 OH TYR A 99 -14.359 -1.640 -6.645 1.00 0.00 O ATOM 0 H TYR A 99 -11.472 -5.589 -2.103 1.00 0.00 H new ATOM 0 HA TYR A 99 -10.163 -2.947 -2.171 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -12.920 -3.536 -0.984 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -12.097 -1.990 -0.941 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -13.318 -4.591 -3.333 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -12.383 -0.449 -2.712 1.00 0.00 H new ATOM 0 HE1 TYR A 99 -14.249 -4.051 -5.567 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -13.314 0.096 -4.948 1.00 0.00 H new ATOM 0 HH TYR A 99 -14.282 -0.676 -6.806 1.00 0.00 H new ATOM 379 N ILE A 100 -9.795 -2.988 0.379 1.00 0.00 N ATOM 380 CA ILE A 100 -9.280 -3.175 1.734 1.00 0.00 C ATOM 381 C ILE A 100 -9.794 -2.027 2.595 1.00 0.00 C ATOM 382 O ILE A 100 -10.004 -0.927 2.088 1.00 0.00 O ATOM 383 CB ILE A 100 -7.740 -3.158 1.738 1.00 0.00 C ATOM 384 CG1 ILE A 100 -7.232 -1.721 1.884 1.00 0.00 C ATOM 385 CG2 ILE A 100 -7.209 -3.711 0.420 1.00 0.00 C ATOM 386 CD1 ILE A 100 -5.751 -1.664 1.509 1.00 0.00 C ATOM 0 H ILE A 100 -9.681 -2.042 0.015 1.00 0.00 H new ATOM 0 HA ILE A 100 -9.615 -4.137 2.122 1.00 0.00 H new ATOM 0 HB ILE A 100 -7.394 -3.769 2.572 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -7.807 -1.054 1.242 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -7.372 -1.377 2.909 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -6.119 -3.695 0.432 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -7.556 -4.736 0.289 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -7.572 -3.097 -0.405 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -5.389 -0.641 1.613 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -5.183 -2.319 2.170 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -5.624 -1.991 0.477 1.00 0.00 H new ATOM 398 N SER A 101 -9.999 -2.256 3.885 1.00 0.00 N ATOM 399 CA SER A 101 -10.490 -1.183 4.739 1.00 0.00 C ATOM 400 C SER A 101 -9.501 -0.017 4.733 1.00 0.00 C ATOM 401 O SER A 101 -8.305 -0.209 4.900 1.00 0.00 O ATOM 402 CB SER A 101 -10.672 -1.693 6.168 1.00 0.00 C ATOM 403 OG SER A 101 -11.666 -2.708 6.181 1.00 0.00 O ATOM 0 H SER A 101 -9.839 -3.148 4.353 1.00 0.00 H new ATOM 0 HA SER A 101 -11.451 -0.841 4.356 1.00 0.00 H new ATOM 0 HB2 SER A 101 -9.729 -2.086 6.549 1.00 0.00 H new ATOM 0 HB3 SER A 101 -10.964 -0.873 6.825 1.00 0.00 H new ATOM 0 HG SER A 101 -11.784 -3.039 7.096 1.00 0.00 H new ATOM 409 N ALA A 102 -10.009 1.190 4.536 1.00 0.00 N ATOM 410 CA ALA A 102 -9.155 2.373 4.518 1.00 0.00 C ATOM 411 C ALA A 102 -8.550 2.636 5.900 1.00 0.00 C ATOM 412 O ALA A 102 -7.407 3.072 6.016 1.00 0.00 O ATOM 413 CB ALA A 102 -9.959 3.593 4.064 1.00 0.00 C ATOM 0 H ALA A 102 -11.000 1.378 4.387 1.00 0.00 H new ATOM 0 HA ALA A 102 -8.341 2.193 3.815 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -9.313 4.471 4.054 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -10.350 3.419 3.062 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -10.787 3.760 4.753 1.00 0.00 H new ATOM 419 N ALA A 103 -9.345 2.402 6.940 1.00 0.00 N ATOM 420 CA ALA A 103 -8.903 2.652 8.314 1.00 0.00 C ATOM 421 C ALA A 103 -7.679 1.818 8.703 1.00 0.00 C ATOM 422 O ALA A 103 -6.768 2.327 9.358 1.00 0.00 O ATOM 423 CB ALA A 103 -10.046 2.342 9.281 1.00 0.00 C ATOM 0 H ALA A 103 -10.296 2.041 6.861 1.00 0.00 H new ATOM 0 HA ALA A 103 -8.617 3.702 8.373 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -9.718 2.528 10.304 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -10.899 2.980 9.052 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -10.337 1.297 9.178 1.00 0.00 H new ATOM 429 N GLU A 104 -7.657 0.543 8.326 1.00 0.00 N ATOM 430 CA GLU A 104 -6.528 -0.312 8.683 1.00 0.00 C ATOM 431 C GLU A 104 -5.281 0.109 7.921 1.00 0.00 C ATOM 432 O GLU A 104 -4.159 -0.093 8.384 1.00 0.00 O ATOM 433 CB GLU A 104 -6.849 -1.775 8.373 1.00 0.00 C ATOM 434 CG GLU A 104 -6.595 -2.058 6.895 1.00 0.00 C ATOM 435 CD GLU A 104 -7.410 -3.265 6.444 1.00 0.00 C ATOM 436 OE1 GLU A 104 -7.972 -3.929 7.299 1.00 0.00 O ATOM 437 OE2 GLU A 104 -7.465 -3.505 5.250 1.00 0.00 O ATOM 0 H GLU A 104 -8.391 0.086 7.785 1.00 0.00 H new ATOM 0 HA GLU A 104 -6.344 -0.206 9.752 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -6.233 -2.430 8.989 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -7.889 -1.989 8.620 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -6.863 -1.186 6.299 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -5.534 -2.244 6.730 1.00 0.00 H new ATOM 444 N LEU A 105 -5.485 0.702 6.750 1.00 0.00 N ATOM 445 CA LEU A 105 -4.360 1.153 5.938 1.00 0.00 C ATOM 446 C LEU A 105 -3.577 2.202 6.718 1.00 0.00 C ATOM 447 O LEU A 105 -2.348 2.174 6.762 1.00 0.00 O ATOM 448 CB LEU A 105 -4.859 1.764 4.624 1.00 0.00 C ATOM 449 CG LEU A 105 -3.665 2.137 3.730 1.00 0.00 C ATOM 450 CD1 LEU A 105 -2.917 0.870 3.303 1.00 0.00 C ATOM 451 CD2 LEU A 105 -4.171 2.871 2.487 1.00 0.00 C ATOM 0 H LEU A 105 -6.404 0.880 6.346 1.00 0.00 H new ATOM 0 HA LEU A 105 -3.721 0.301 5.707 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -5.504 1.055 4.106 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -5.460 2.650 4.830 1.00 0.00 H new ATOM 0 HG LEU A 105 -2.987 2.783 4.288 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -2.072 1.142 2.670 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -2.554 0.346 4.187 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -3.592 0.219 2.748 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -3.326 3.136 1.852 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -4.851 2.224 1.934 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -4.697 3.777 2.788 1.00 0.00 H new ATOM 463 N ARG A 106 -4.309 3.140 7.315 1.00 0.00 N ATOM 464 CA ARG A 106 -3.682 4.214 8.075 1.00 0.00 C ATOM 465 C ARG A 106 -2.805 3.636 9.178 1.00 0.00 C ATOM 466 O ARG A 106 -1.643 4.010 9.314 1.00 0.00 O ATOM 467 CB ARG A 106 -4.778 5.096 8.700 1.00 0.00 C ATOM 468 CG ARG A 106 -4.162 6.281 9.462 1.00 0.00 C ATOM 469 CD ARG A 106 -3.884 7.421 8.490 1.00 0.00 C ATOM 470 NE ARG A 106 -5.043 8.303 8.407 1.00 0.00 N ATOM 471 CZ ARG A 106 -4.954 9.503 7.844 1.00 0.00 C ATOM 472 NH1 ARG A 106 -3.806 9.929 7.393 1.00 0.00 N ATOM 473 NH2 ARG A 106 -6.011 10.263 7.755 1.00 0.00 N ATOM 0 H ARG A 106 -5.328 3.177 7.287 1.00 0.00 H new ATOM 0 HA ARG A 106 -3.061 4.810 7.407 1.00 0.00 H new ATOM 0 HB2 ARG A 106 -5.441 5.467 7.919 1.00 0.00 H new ATOM 0 HB3 ARG A 106 -5.387 4.499 9.379 1.00 0.00 H new ATOM 0 HG2 ARG A 106 -4.841 6.615 10.246 1.00 0.00 H new ATOM 0 HG3 ARG A 106 -3.238 5.972 9.951 1.00 0.00 H new ATOM 0 HD2 ARG A 106 -3.011 7.985 8.819 1.00 0.00 H new ATOM 0 HD3 ARG A 106 -3.651 7.020 7.504 1.00 0.00 H new ATOM 0 HE ARG A 106 -5.937 7.993 8.788 1.00 0.00 H new ATOM 0 HH11 ARG A 106 -2.977 9.341 7.473 1.00 0.00 H new ATOM 0 HH12 ARG A 106 -3.738 10.850 6.961 1.00 0.00 H new ATOM 0 HH21 ARG A 106 -6.906 9.936 8.118 1.00 0.00 H new ATOM 0 HH22 ARG A 106 -5.942 11.184 7.323 1.00 0.00 H new ATOM 487 N HIS A 107 -3.356 2.721 9.958 1.00 0.00 N ATOM 488 CA HIS A 107 -2.591 2.107 11.033 1.00 0.00 C ATOM 489 C HIS A 107 -1.403 1.337 10.466 1.00 0.00 C ATOM 490 O HIS A 107 -0.288 1.406 10.983 1.00 0.00 O ATOM 491 CB HIS A 107 -3.480 1.158 11.831 1.00 0.00 C ATOM 492 CG HIS A 107 -2.658 0.511 12.905 1.00 0.00 C ATOM 493 ND1 HIS A 107 -2.374 1.140 14.106 1.00 0.00 N ATOM 494 CD2 HIS A 107 -2.025 -0.702 12.957 1.00 0.00 C ATOM 495 CE1 HIS A 107 -1.599 0.308 14.826 1.00 0.00 C ATOM 496 NE2 HIS A 107 -1.356 -0.830 14.171 1.00 0.00 N ATOM 0 H HIS A 107 -4.317 2.390 9.870 1.00 0.00 H new ATOM 0 HA HIS A 107 -2.223 2.895 11.690 1.00 0.00 H new ATOM 0 HB2 HIS A 107 -4.314 1.704 12.272 1.00 0.00 H new ATOM 0 HB3 HIS A 107 -3.907 0.400 11.175 1.00 0.00 H new ATOM 0 HD2 HIS A 107 -2.042 -1.447 12.175 1.00 0.00 H new ATOM 0 HE1 HIS A 107 -1.220 0.533 15.812 1.00 0.00 H new ATOM 0 HE2 HIS A 107 -0.800 -1.623 14.491 1.00 0.00 H new ATOM 505 N VAL A 108 -1.675 0.589 9.409 1.00 0.00 N ATOM 506 CA VAL A 108 -0.669 -0.237 8.749 1.00 0.00 C ATOM 507 C VAL A 108 0.483 0.602 8.178 1.00 0.00 C ATOM 508 O VAL A 108 1.635 0.169 8.204 1.00 0.00 O ATOM 509 CB VAL A 108 -1.339 -1.034 7.622 1.00 0.00 C ATOM 510 CG1 VAL A 108 -0.288 -1.780 6.795 1.00 0.00 C ATOM 511 CG2 VAL A 108 -2.312 -2.047 8.231 1.00 0.00 C ATOM 0 H VAL A 108 -2.600 0.535 8.982 1.00 0.00 H new ATOM 0 HA VAL A 108 -0.242 -0.911 9.492 1.00 0.00 H new ATOM 0 HB VAL A 108 -1.874 -0.343 6.971 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -0.781 -2.340 6.000 1.00 0.00 H new ATOM 0 HG12 VAL A 108 0.406 -1.063 6.357 1.00 0.00 H new ATOM 0 HG13 VAL A 108 0.260 -2.469 7.438 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -2.791 -2.616 7.434 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -1.767 -2.727 8.885 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -3.072 -1.520 8.808 1.00 0.00 H new ATOM 521 N MET A 109 0.172 1.785 7.647 1.00 0.00 N ATOM 522 CA MET A 109 1.211 2.635 7.059 1.00 0.00 C ATOM 523 C MET A 109 1.940 3.450 8.117 1.00 0.00 C ATOM 524 O MET A 109 3.064 3.892 7.886 1.00 0.00 O ATOM 525 CB MET A 109 0.591 3.586 6.028 1.00 0.00 C ATOM 526 CG MET A 109 0.609 2.948 4.634 1.00 0.00 C ATOM 527 SD MET A 109 0.323 1.164 4.749 1.00 0.00 S ATOM 528 CE MET A 109 0.583 0.776 3.002 1.00 0.00 C ATOM 0 H MET A 109 -0.771 2.172 7.611 1.00 0.00 H new ATOM 0 HA MET A 109 1.934 1.978 6.575 1.00 0.00 H new ATOM 0 HB2 MET A 109 -0.434 3.824 6.313 1.00 0.00 H new ATOM 0 HB3 MET A 109 1.143 4.526 6.012 1.00 0.00 H new ATOM 0 HG2 MET A 109 -0.157 3.405 4.008 1.00 0.00 H new ATOM 0 HG3 MET A 109 1.568 3.138 4.153 1.00 0.00 H new ATOM 0 HE1 MET A 109 -0.075 -0.042 2.709 1.00 0.00 H new ATOM 0 HE2 MET A 109 0.361 1.655 2.397 1.00 0.00 H new ATOM 0 HE3 MET A 109 1.620 0.480 2.845 1.00 0.00 H new ATOM 538 N THR A 110 1.304 3.661 9.261 1.00 0.00 N ATOM 539 CA THR A 110 1.926 4.449 10.318 1.00 0.00 C ATOM 540 C THR A 110 2.460 3.555 11.438 1.00 0.00 C ATOM 541 O THR A 110 3.266 3.998 12.256 1.00 0.00 O ATOM 542 CB THR A 110 0.910 5.445 10.890 1.00 0.00 C ATOM 543 OG1 THR A 110 -0.128 4.739 11.553 1.00 0.00 O ATOM 544 CG2 THR A 110 0.313 6.279 9.758 1.00 0.00 C ATOM 0 H THR A 110 0.374 3.305 9.480 1.00 0.00 H new ATOM 0 HA THR A 110 2.768 4.990 9.885 1.00 0.00 H new ATOM 0 HB THR A 110 1.413 6.103 11.599 1.00 0.00 H new ATOM 0 HG1 THR A 110 -0.770 4.405 10.892 1.00 0.00 H new ATOM 0 HG21 THR A 110 -0.409 6.986 10.168 1.00 0.00 H new ATOM 0 HG22 THR A 110 1.108 6.825 9.250 1.00 0.00 H new ATOM 0 HG23 THR A 110 -0.187 5.622 9.047 1.00 0.00 H new ATOM 552 N ASN A 111 2.003 2.300 11.478 1.00 0.00 N ATOM 553 CA ASN A 111 2.446 1.369 12.518 1.00 0.00 C ATOM 554 C ASN A 111 3.347 0.269 11.949 1.00 0.00 C ATOM 555 O ASN A 111 4.410 -0.014 12.499 1.00 0.00 O ATOM 556 CB ASN A 111 1.231 0.728 13.194 1.00 0.00 C ATOM 557 CG ASN A 111 1.659 0.020 14.475 1.00 0.00 C ATOM 558 OD1 ASN A 111 2.384 -0.973 14.425 1.00 0.00 O ATOM 559 ND2 ASN A 111 1.253 0.477 15.629 1.00 0.00 N ATOM 0 H ASN A 111 1.336 1.910 10.812 1.00 0.00 H new ATOM 0 HA ASN A 111 3.023 1.939 13.246 1.00 0.00 H new ATOM 0 HB2 ASN A 111 0.487 1.491 13.422 1.00 0.00 H new ATOM 0 HB3 ASN A 111 0.760 0.016 12.515 1.00 0.00 H new ATOM 0 HD21 ASN A 111 1.537 0.011 16.491 1.00 0.00 H new ATOM 0 HD22 ASN A 111 0.652 1.300 15.669 1.00 0.00 H new ATOM 566 N LEU A 112 2.911 -0.358 10.861 1.00 0.00 N ATOM 567 CA LEU A 112 3.685 -1.439 10.247 1.00 0.00 C ATOM 568 C LEU A 112 4.568 -0.929 9.110 1.00 0.00 C ATOM 569 O LEU A 112 4.494 0.235 8.715 1.00 0.00 O ATOM 570 CB LEU A 112 2.751 -2.516 9.683 1.00 0.00 C ATOM 571 CG LEU A 112 1.876 -3.110 10.791 1.00 0.00 C ATOM 572 CD1 LEU A 112 0.921 -4.140 10.178 1.00 0.00 C ATOM 573 CD2 LEU A 112 2.757 -3.803 11.835 1.00 0.00 C ATOM 0 H LEU A 112 2.034 -0.141 10.387 1.00 0.00 H new ATOM 0 HA LEU A 112 4.317 -1.857 11.030 1.00 0.00 H new ATOM 0 HB2 LEU A 112 2.119 -2.086 8.906 1.00 0.00 H new ATOM 0 HB3 LEU A 112 3.339 -3.305 9.215 1.00 0.00 H new ATOM 0 HG LEU A 112 1.309 -2.312 11.270 1.00 0.00 H new ATOM 0 HD11 LEU A 112 0.295 -4.567 10.961 1.00 0.00 H new ATOM 0 HD12 LEU A 112 0.290 -3.654 9.434 1.00 0.00 H new ATOM 0 HD13 LEU A 112 1.498 -4.933 9.702 1.00 0.00 H new ATOM 0 HD21 LEU A 112 2.129 -4.223 12.620 1.00 0.00 H new ATOM 0 HD22 LEU A 112 3.326 -4.602 11.359 1.00 0.00 H new ATOM 0 HD23 LEU A 112 3.445 -3.078 12.270 1.00 0.00 H new ATOM 585 N GLY A 113 5.384 -1.837 8.581 1.00 0.00 N ATOM 586 CA GLY A 113 6.275 -1.522 7.466 1.00 0.00 C ATOM 587 C GLY A 113 7.421 -0.595 7.864 1.00 0.00 C ATOM 588 O GLY A 113 8.207 -0.906 8.759 1.00 0.00 O ATOM 0 H GLY A 113 5.447 -2.801 8.908 1.00 0.00 H new ATOM 0 HA2 GLY A 113 6.686 -2.448 7.064 1.00 0.00 H new ATOM 0 HA3 GLY A 113 5.698 -1.056 6.667 1.00 0.00 H new ATOM 592 N GLU A 114 7.513 0.538 7.173 1.00 0.00 N ATOM 593 CA GLU A 114 8.576 1.506 7.436 1.00 0.00 C ATOM 594 C GLU A 114 8.051 2.718 8.190 1.00 0.00 C ATOM 595 O GLU A 114 8.728 3.740 8.292 1.00 0.00 O ATOM 596 CB GLU A 114 9.216 1.953 6.121 1.00 0.00 C ATOM 597 CG GLU A 114 9.950 0.771 5.486 1.00 0.00 C ATOM 598 CD GLU A 114 10.546 1.187 4.145 1.00 0.00 C ATOM 599 OE1 GLU A 114 10.255 2.287 3.705 1.00 0.00 O ATOM 600 OE2 GLU A 114 11.286 0.399 3.578 1.00 0.00 O ATOM 0 H GLU A 114 6.868 0.808 6.430 1.00 0.00 H new ATOM 0 HA GLU A 114 9.325 1.017 8.059 1.00 0.00 H new ATOM 0 HB2 GLU A 114 8.451 2.328 5.441 1.00 0.00 H new ATOM 0 HB3 GLU A 114 9.912 2.772 6.302 1.00 0.00 H new ATOM 0 HG2 GLU A 114 10.739 0.422 6.152 1.00 0.00 H new ATOM 0 HG3 GLU A 114 9.261 -0.062 5.345 1.00 0.00 H new ATOM 607 N LYS A 115 6.849 2.591 8.716 1.00 0.00 N ATOM 608 CA LYS A 115 6.238 3.672 9.462 1.00 0.00 C ATOM 609 C LYS A 115 6.308 4.981 8.676 1.00 0.00 C ATOM 610 O LYS A 115 7.354 5.625 8.605 1.00 0.00 O ATOM 611 CB LYS A 115 6.958 3.818 10.792 1.00 0.00 C ATOM 612 CG LYS A 115 6.435 2.778 11.788 1.00 0.00 C ATOM 613 CD LYS A 115 7.157 2.950 13.126 1.00 0.00 C ATOM 614 CE LYS A 115 6.501 2.060 14.184 1.00 0.00 C ATOM 615 NZ LYS A 115 6.670 0.629 13.805 1.00 0.00 N ATOM 0 H LYS A 115 6.277 1.750 8.640 1.00 0.00 H new ATOM 0 HA LYS A 115 5.187 3.442 9.634 1.00 0.00 H new ATOM 0 HB2 LYS A 115 8.031 3.690 10.650 1.00 0.00 H new ATOM 0 HB3 LYS A 115 6.806 4.822 11.189 1.00 0.00 H new ATOM 0 HG2 LYS A 115 5.360 2.897 11.924 1.00 0.00 H new ATOM 0 HG3 LYS A 115 6.598 1.772 11.400 1.00 0.00 H new ATOM 0 HD2 LYS A 115 8.210 2.688 13.019 1.00 0.00 H new ATOM 0 HD3 LYS A 115 7.118 3.993 13.440 1.00 0.00 H new ATOM 0 HE2 LYS A 115 6.951 2.244 15.159 1.00 0.00 H new ATOM 0 HE3 LYS A 115 5.442 2.301 14.271 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 6.459 0.025 14.625 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 6.019 0.397 13.028 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 7.650 0.465 13.497 1.00 0.00 H new ATOM 629 N LEU A 116 5.175 5.372 8.102 1.00 0.00 N ATOM 630 CA LEU A 116 5.103 6.613 7.337 1.00 0.00 C ATOM 631 C LEU A 116 4.690 7.759 8.253 1.00 0.00 C ATOM 632 O LEU A 116 4.079 7.532 9.298 1.00 0.00 O ATOM 633 CB LEU A 116 4.066 6.495 6.209 1.00 0.00 C ATOM 634 CG LEU A 116 4.657 5.802 4.973 1.00 0.00 C ATOM 635 CD1 LEU A 116 5.789 6.641 4.373 1.00 0.00 C ATOM 636 CD2 LEU A 116 5.198 4.431 5.373 1.00 0.00 C ATOM 0 H LEU A 116 4.299 4.852 8.151 1.00 0.00 H new ATOM 0 HA LEU A 116 6.086 6.805 6.908 1.00 0.00 H new ATOM 0 HB2 LEU A 116 3.202 5.933 6.564 1.00 0.00 H new ATOM 0 HB3 LEU A 116 3.710 7.488 5.935 1.00 0.00 H new ATOM 0 HG LEU A 116 3.872 5.690 4.225 1.00 0.00 H new ATOM 0 HD11 LEU A 116 6.194 6.133 3.498 1.00 0.00 H new ATOM 0 HD12 LEU A 116 5.402 7.617 4.079 1.00 0.00 H new ATOM 0 HD13 LEU A 116 6.577 6.772 5.114 1.00 0.00 H new ATOM 0 HD21 LEU A 116 5.618 3.936 4.498 1.00 0.00 H new ATOM 0 HD22 LEU A 116 5.974 4.552 6.129 1.00 0.00 H new ATOM 0 HD23 LEU A 116 4.388 3.825 5.779 1.00 0.00 H new ATOM 648 N THR A 117 4.995 8.989 7.853 1.00 0.00 N ATOM 649 CA THR A 117 4.613 10.150 8.648 1.00 0.00 C ATOM 650 C THR A 117 3.260 10.662 8.169 1.00 0.00 C ATOM 651 O THR A 117 2.753 10.216 7.141 1.00 0.00 O ATOM 652 CB THR A 117 5.663 11.254 8.515 1.00 0.00 C ATOM 653 OG1 THR A 117 5.713 11.700 7.167 1.00 0.00 O ATOM 654 CG2 THR A 117 7.032 10.712 8.928 1.00 0.00 C ATOM 0 H THR A 117 5.500 9.206 6.994 1.00 0.00 H new ATOM 0 HA THR A 117 4.546 9.860 9.697 1.00 0.00 H new ATOM 0 HB THR A 117 5.396 12.089 9.163 1.00 0.00 H new ATOM 0 HG1 THR A 117 6.186 11.038 6.621 1.00 0.00 H new ATOM 0 HG21 THR A 117 7.779 11.500 8.833 1.00 0.00 H new ATOM 0 HG22 THR A 117 6.992 10.373 9.963 1.00 0.00 H new ATOM 0 HG23 THR A 117 7.302 9.876 8.283 1.00 0.00 H new ATOM 662 N ASP A 118 2.667 11.588 8.912 1.00 0.00 N ATOM 663 CA ASP A 118 1.364 12.119 8.531 1.00 0.00 C ATOM 664 C ASP A 118 1.427 12.757 7.145 1.00 0.00 C ATOM 665 O ASP A 118 0.508 12.599 6.341 1.00 0.00 O ATOM 666 CB ASP A 118 0.907 13.162 9.551 1.00 0.00 C ATOM 667 CG ASP A 118 0.524 12.481 10.861 1.00 0.00 C ATOM 668 OD1 ASP A 118 0.385 11.269 10.857 1.00 0.00 O ATOM 669 OD2 ASP A 118 0.374 13.182 11.849 1.00 0.00 O ATOM 0 H ASP A 118 3.059 11.982 9.768 1.00 0.00 H new ATOM 0 HA ASP A 118 0.651 11.295 8.508 1.00 0.00 H new ATOM 0 HB2 ASP A 118 1.705 13.884 9.727 1.00 0.00 H new ATOM 0 HB3 ASP A 118 0.055 13.717 9.158 1.00 0.00 H new ATOM 674 N GLU A 119 2.508 13.477 6.870 1.00 0.00 N ATOM 675 CA GLU A 119 2.658 14.126 5.573 1.00 0.00 C ATOM 676 C GLU A 119 2.720 13.095 4.449 1.00 0.00 C ATOM 677 O GLU A 119 2.094 13.271 3.403 1.00 0.00 O ATOM 678 CB GLU A 119 3.934 14.972 5.558 1.00 0.00 C ATOM 679 CG GLU A 119 3.753 16.188 6.469 1.00 0.00 C ATOM 680 CD GLU A 119 5.073 16.942 6.597 1.00 0.00 C ATOM 681 OE1 GLU A 119 6.086 16.398 6.187 1.00 0.00 O ATOM 682 OE2 GLU A 119 5.051 18.052 7.103 1.00 0.00 O ATOM 0 H GLU A 119 3.283 13.625 7.516 1.00 0.00 H new ATOM 0 HA GLU A 119 1.790 14.765 5.412 1.00 0.00 H new ATOM 0 HB2 GLU A 119 4.782 14.376 5.895 1.00 0.00 H new ATOM 0 HB3 GLU A 119 4.156 15.296 4.541 1.00 0.00 H new ATOM 0 HG2 GLU A 119 2.986 16.847 6.062 1.00 0.00 H new ATOM 0 HG3 GLU A 119 3.410 15.868 7.453 1.00 0.00 H new ATOM 689 N GLU A 120 3.470 12.016 4.667 1.00 0.00 N ATOM 690 CA GLU A 120 3.587 10.972 3.656 1.00 0.00 C ATOM 691 C GLU A 120 2.276 10.212 3.497 1.00 0.00 C ATOM 692 O GLU A 120 1.835 9.943 2.384 1.00 0.00 O ATOM 693 CB GLU A 120 4.701 9.997 4.042 1.00 0.00 C ATOM 694 CG GLU A 120 6.056 10.687 3.866 1.00 0.00 C ATOM 695 CD GLU A 120 7.185 9.755 4.292 1.00 0.00 C ATOM 696 OE1 GLU A 120 7.203 9.366 5.448 1.00 0.00 O ATOM 697 OE2 GLU A 120 8.022 9.449 3.457 1.00 0.00 O ATOM 0 H GLU A 120 3.998 11.845 5.523 1.00 0.00 H new ATOM 0 HA GLU A 120 3.827 11.447 2.705 1.00 0.00 H new ATOM 0 HB2 GLU A 120 4.576 9.673 5.075 1.00 0.00 H new ATOM 0 HB3 GLU A 120 4.651 9.104 3.420 1.00 0.00 H new ATOM 0 HG2 GLU A 120 6.190 10.979 2.824 1.00 0.00 H new ATOM 0 HG3 GLU A 120 6.086 11.601 4.460 1.00 0.00 H new ATOM 704 N VAL A 121 1.659 9.877 4.622 1.00 0.00 N ATOM 705 CA VAL A 121 0.394 9.147 4.606 1.00 0.00 C ATOM 706 C VAL A 121 -0.714 9.998 3.990 1.00 0.00 C ATOM 707 O VAL A 121 -1.524 9.501 3.212 1.00 0.00 O ATOM 708 CB VAL A 121 0.007 8.740 6.032 1.00 0.00 C ATOM 709 CG1 VAL A 121 -1.406 8.172 6.032 1.00 0.00 C ATOM 710 CG2 VAL A 121 0.966 7.667 6.565 1.00 0.00 C ATOM 0 H VAL A 121 2.010 10.097 5.554 1.00 0.00 H new ATOM 0 HA VAL A 121 0.521 8.252 3.997 1.00 0.00 H new ATOM 0 HB VAL A 121 0.062 9.622 6.670 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -1.682 7.882 7.046 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -2.102 8.928 5.669 1.00 0.00 H new ATOM 0 HG13 VAL A 121 -1.447 7.298 5.381 1.00 0.00 H new ATOM 0 HG21 VAL A 121 0.676 7.391 7.579 1.00 0.00 H new ATOM 0 HG22 VAL A 121 0.922 6.788 5.922 1.00 0.00 H new ATOM 0 HG23 VAL A 121 1.983 8.060 6.573 1.00 0.00 H new ATOM 720 N ASP A 122 -0.772 11.276 4.348 1.00 0.00 N ATOM 721 CA ASP A 122 -1.820 12.141 3.819 1.00 0.00 C ATOM 722 C ASP A 122 -1.804 12.091 2.298 1.00 0.00 C ATOM 723 O ASP A 122 -2.854 12.054 1.656 1.00 0.00 O ATOM 724 CB ASP A 122 -1.597 13.580 4.290 1.00 0.00 C ATOM 725 CG ASP A 122 -1.915 13.698 5.777 1.00 0.00 C ATOM 726 OD1 ASP A 122 -2.507 12.775 6.312 1.00 0.00 O ATOM 727 OD2 ASP A 122 -1.562 14.711 6.358 1.00 0.00 O ATOM 0 H ASP A 122 -0.120 11.729 4.989 1.00 0.00 H new ATOM 0 HA ASP A 122 -2.787 11.794 4.183 1.00 0.00 H new ATOM 0 HB2 ASP A 122 -0.564 13.875 4.106 1.00 0.00 H new ATOM 0 HB3 ASP A 122 -2.229 14.260 3.719 1.00 0.00 H new ATOM 732 N GLU A 123 -0.609 12.053 1.728 1.00 0.00 N ATOM 733 CA GLU A 123 -0.468 11.967 0.282 1.00 0.00 C ATOM 734 C GLU A 123 -1.064 10.655 -0.216 1.00 0.00 C ATOM 735 O GLU A 123 -1.678 10.597 -1.281 1.00 0.00 O ATOM 736 CB GLU A 123 1.010 12.014 -0.107 1.00 0.00 C ATOM 737 CG GLU A 123 1.585 13.397 0.183 1.00 0.00 C ATOM 738 CD GLU A 123 0.988 14.422 -0.775 1.00 0.00 C ATOM 739 OE1 GLU A 123 0.437 14.012 -1.783 1.00 0.00 O ATOM 740 OE2 GLU A 123 1.092 15.603 -0.486 1.00 0.00 O ATOM 0 H GLU A 123 0.272 12.080 2.241 1.00 0.00 H new ATOM 0 HA GLU A 123 -0.992 12.810 -0.169 1.00 0.00 H new ATOM 0 HB2 GLU A 123 1.564 11.257 0.448 1.00 0.00 H new ATOM 0 HB3 GLU A 123 1.123 11.779 -1.165 1.00 0.00 H new ATOM 0 HG2 GLU A 123 1.369 13.681 1.213 1.00 0.00 H new ATOM 0 HG3 GLU A 123 2.670 13.378 0.078 1.00 0.00 H new ATOM 747 N MET A 124 -0.873 9.600 0.574 1.00 0.00 N ATOM 748 CA MET A 124 -1.382 8.280 0.229 1.00 0.00 C ATOM 749 C MET A 124 -2.905 8.243 0.343 1.00 0.00 C ATOM 750 O MET A 124 -3.588 7.616 -0.467 1.00 0.00 O ATOM 751 CB MET A 124 -0.769 7.243 1.172 1.00 0.00 C ATOM 752 CG MET A 124 0.741 7.201 0.944 1.00 0.00 C ATOM 753 SD MET A 124 1.521 6.136 2.181 1.00 0.00 S ATOM 754 CE MET A 124 0.857 4.570 1.580 1.00 0.00 C ATOM 0 H MET A 124 -0.368 9.637 1.459 1.00 0.00 H new ATOM 0 HA MET A 124 -1.108 8.053 -0.801 1.00 0.00 H new ATOM 0 HB2 MET A 124 -0.987 7.500 2.209 1.00 0.00 H new ATOM 0 HB3 MET A 124 -1.206 6.261 0.988 1.00 0.00 H new ATOM 0 HG2 MET A 124 0.956 6.828 -0.057 1.00 0.00 H new ATOM 0 HG3 MET A 124 1.155 8.208 1.005 1.00 0.00 H new ATOM 0 HE1 MET A 124 1.487 3.751 1.926 1.00 0.00 H new ATOM 0 HE2 MET A 124 -0.155 4.434 1.960 1.00 0.00 H new ATOM 0 HE3 MET A 124 0.837 4.577 0.490 1.00 0.00 H new ATOM 764 N ILE A 125 -3.426 8.921 1.363 1.00 0.00 N ATOM 765 CA ILE A 125 -4.866 8.969 1.602 1.00 0.00 C ATOM 766 C ILE A 125 -5.590 9.563 0.395 1.00 0.00 C ATOM 767 O ILE A 125 -6.668 9.103 0.019 1.00 0.00 O ATOM 768 CB ILE A 125 -5.133 9.792 2.872 1.00 0.00 C ATOM 769 CG1 ILE A 125 -5.492 8.856 4.037 1.00 0.00 C ATOM 770 CG2 ILE A 125 -6.265 10.807 2.662 1.00 0.00 C ATOM 771 CD1 ILE A 125 -4.326 7.901 4.325 1.00 0.00 C ATOM 0 H ILE A 125 -2.871 9.446 2.039 1.00 0.00 H new ATOM 0 HA ILE A 125 -5.249 7.959 1.746 1.00 0.00 H new ATOM 0 HB ILE A 125 -4.223 10.344 3.106 1.00 0.00 H new ATOM 0 HG12 ILE A 125 -5.721 9.442 4.927 1.00 0.00 H new ATOM 0 HG13 ILE A 125 -6.388 8.285 3.792 1.00 0.00 H new ATOM 0 HG21 ILE A 125 -6.424 11.370 3.582 1.00 0.00 H new ATOM 0 HG22 ILE A 125 -5.994 11.493 1.859 1.00 0.00 H new ATOM 0 HG23 ILE A 125 -7.181 10.280 2.396 1.00 0.00 H new ATOM 0 HD11 ILE A 125 -4.591 7.242 5.152 1.00 0.00 H new ATOM 0 HD12 ILE A 125 -4.117 7.303 3.438 1.00 0.00 H new ATOM 0 HD13 ILE A 125 -3.440 8.478 4.590 1.00 0.00 H new ATOM 783 N ARG A 126 -4.991 10.582 -0.210 1.00 0.00 N ATOM 784 CA ARG A 126 -5.591 11.224 -1.376 1.00 0.00 C ATOM 785 C ARG A 126 -5.588 10.271 -2.566 1.00 0.00 C ATOM 786 O ARG A 126 -6.427 10.375 -3.460 1.00 0.00 O ATOM 787 CB ARG A 126 -4.819 12.495 -1.733 1.00 0.00 C ATOM 788 CG ARG A 126 -5.044 13.550 -0.647 1.00 0.00 C ATOM 789 CD ARG A 126 -4.180 14.776 -0.939 1.00 0.00 C ATOM 790 NE ARG A 126 -4.588 15.391 -2.198 1.00 0.00 N ATOM 791 CZ ARG A 126 -3.885 16.380 -2.740 1.00 0.00 C ATOM 792 NH1 ARG A 126 -2.809 16.818 -2.145 1.00 0.00 N ATOM 793 NH2 ARG A 126 -4.270 16.913 -3.866 1.00 0.00 N ATOM 0 H ARG A 126 -4.099 10.979 0.083 1.00 0.00 H new ATOM 0 HA ARG A 126 -6.621 11.486 -1.134 1.00 0.00 H new ATOM 0 HB2 ARG A 126 -3.756 12.274 -1.825 1.00 0.00 H new ATOM 0 HB3 ARG A 126 -5.151 12.876 -2.699 1.00 0.00 H new ATOM 0 HG2 ARG A 126 -6.096 13.833 -0.613 1.00 0.00 H new ATOM 0 HG3 ARG A 126 -4.793 13.140 0.331 1.00 0.00 H new ATOM 0 HD2 ARG A 126 -4.272 15.497 -0.127 1.00 0.00 H new ATOM 0 HD3 ARG A 126 -3.130 14.487 -0.990 1.00 0.00 H new ATOM 0 HE ARG A 126 -5.428 15.056 -2.670 1.00 0.00 H new ATOM 0 HH11 ARG A 126 -2.508 16.401 -1.264 1.00 0.00 H new ATOM 0 HH12 ARG A 126 -2.269 17.577 -2.561 1.00 0.00 H new ATOM 0 HH21 ARG A 126 -5.111 16.571 -4.331 1.00 0.00 H new ATOM 0 HH22 ARG A 126 -3.730 17.672 -4.282 1.00 0.00 H new ATOM 807 N GLU A 127 -4.644 9.338 -2.563 1.00 0.00 N ATOM 808 CA GLU A 127 -4.545 8.360 -3.640 1.00 0.00 C ATOM 809 C GLU A 127 -5.259 7.066 -3.259 1.00 0.00 C ATOM 810 O GLU A 127 -5.330 6.127 -4.052 1.00 0.00 O ATOM 811 CB GLU A 127 -3.074 8.065 -3.942 1.00 0.00 C ATOM 812 CG GLU A 127 -2.366 9.357 -4.354 1.00 0.00 C ATOM 813 CD GLU A 127 -2.921 9.854 -5.685 1.00 0.00 C ATOM 814 OE1 GLU A 127 -3.509 9.054 -6.396 1.00 0.00 O ATOM 815 OE2 GLU A 127 -2.749 11.026 -5.976 1.00 0.00 O ATOM 0 H GLU A 127 -3.940 9.238 -1.832 1.00 0.00 H new ATOM 0 HA GLU A 127 -5.022 8.775 -4.528 1.00 0.00 H new ATOM 0 HB2 GLU A 127 -2.591 7.638 -3.064 1.00 0.00 H new ATOM 0 HB3 GLU A 127 -2.997 7.326 -4.739 1.00 0.00 H new ATOM 0 HG2 GLU A 127 -2.504 10.118 -3.586 1.00 0.00 H new ATOM 0 HG3 GLU A 127 -1.294 9.182 -4.440 1.00 0.00 H new ATOM 822 N ALA A 128 -5.770 7.017 -2.031 1.00 0.00 N ATOM 823 CA ALA A 128 -6.456 5.822 -1.546 1.00 0.00 C ATOM 824 C ALA A 128 -7.949 5.843 -1.895 1.00 0.00 C ATOM 825 O ALA A 128 -8.361 5.182 -2.843 1.00 0.00 O ATOM 826 CB ALA A 128 -6.261 5.703 -0.029 1.00 0.00 C ATOM 0 H ALA A 128 -5.723 7.783 -1.359 1.00 0.00 H new ATOM 0 HA ALA A 128 -6.022 4.953 -2.041 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -6.772 4.812 0.335 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -5.197 5.628 0.196 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -6.675 6.584 0.461 1.00 0.00 H new ATOM 832 N ASP A 129 -8.740 6.612 -1.131 1.00 0.00 N ATOM 833 CA ASP A 129 -10.193 6.724 -1.361 1.00 0.00 C ATOM 834 C ASP A 129 -10.885 7.336 -0.147 1.00 0.00 C ATOM 835 O ASP A 129 -10.951 8.555 0.006 1.00 0.00 O ATOM 836 CB ASP A 129 -10.826 5.347 -1.619 1.00 0.00 C ATOM 837 CG ASP A 129 -12.349 5.441 -1.559 1.00 0.00 C ATOM 838 OD1 ASP A 129 -12.862 6.544 -1.647 1.00 0.00 O ATOM 839 OD2 ASP A 129 -12.980 4.404 -1.432 1.00 0.00 O ATOM 0 H ASP A 129 -8.399 7.167 -0.346 1.00 0.00 H new ATOM 0 HA ASP A 129 -10.326 7.361 -2.236 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -10.517 4.975 -2.596 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -10.470 4.631 -0.878 1.00 0.00 H new ATOM 844 N ILE A 130 -11.413 6.459 0.699 1.00 0.00 N ATOM 845 CA ILE A 130 -12.127 6.870 1.902 1.00 0.00 C ATOM 846 C ILE A 130 -13.343 7.714 1.545 1.00 0.00 C ATOM 847 O ILE A 130 -13.479 8.850 2.003 1.00 0.00 O ATOM 848 CB ILE A 130 -11.217 7.648 2.861 1.00 0.00 C ATOM 849 CG1 ILE A 130 -9.800 7.044 2.885 1.00 0.00 C ATOM 850 CG2 ILE A 130 -11.811 7.579 4.267 1.00 0.00 C ATOM 851 CD1 ILE A 130 -8.779 8.071 2.393 1.00 0.00 C ATOM 0 H ILE A 130 -11.359 5.448 0.572 1.00 0.00 H new ATOM 0 HA ILE A 130 -12.458 5.963 2.407 1.00 0.00 H new ATOM 0 HB ILE A 130 -11.149 8.681 2.521 1.00 0.00 H new ATOM 0 HG12 ILE A 130 -9.549 6.727 3.897 1.00 0.00 H new ATOM 0 HG13 ILE A 130 -9.765 6.155 2.255 1.00 0.00 H new ATOM 0 HG21 ILE A 130 -11.173 8.129 4.959 1.00 0.00 H new ATOM 0 HG22 ILE A 130 -12.807 8.021 4.263 1.00 0.00 H new ATOM 0 HG23 ILE A 130 -11.877 6.538 4.583 1.00 0.00 H new ATOM 0 HD11 ILE A 130 -7.782 7.632 2.415 1.00 0.00 H new ATOM 0 HD12 ILE A 130 -9.023 8.367 1.373 1.00 0.00 H new ATOM 0 HD13 ILE A 130 -8.804 8.948 3.040 1.00 0.00 H new ATOM 863 N ASP A 131 -14.236 7.146 0.739 1.00 0.00 N ATOM 864 CA ASP A 131 -15.449 7.850 0.345 1.00 0.00 C ATOM 865 C ASP A 131 -16.510 7.674 1.426 1.00 0.00 C ATOM 866 O ASP A 131 -17.516 6.993 1.227 1.00 0.00 O ATOM 867 CB ASP A 131 -15.967 7.299 -0.986 1.00 0.00 C ATOM 868 CG ASP A 131 -17.144 8.136 -1.473 1.00 0.00 C ATOM 869 OD1 ASP A 131 -17.613 8.964 -0.711 1.00 0.00 O ATOM 870 OD2 ASP A 131 -17.559 7.936 -2.603 1.00 0.00 O ATOM 0 H ASP A 131 -14.143 6.208 0.350 1.00 0.00 H new ATOM 0 HA ASP A 131 -15.226 8.910 0.223 1.00 0.00 H new ATOM 0 HB2 ASP A 131 -15.170 7.311 -1.729 1.00 0.00 H new ATOM 0 HB3 ASP A 131 -16.274 6.260 -0.864 1.00 0.00 H new ATOM 875 N GLY A 132 -16.269 8.304 2.568 1.00 0.00 N ATOM 876 CA GLY A 132 -17.202 8.229 3.685 1.00 0.00 C ATOM 877 C GLY A 132 -17.654 6.788 3.909 1.00 0.00 C ATOM 878 O GLY A 132 -18.775 6.547 4.358 1.00 0.00 O ATOM 0 H GLY A 132 -15.439 8.870 2.745 1.00 0.00 H new ATOM 0 HA2 GLY A 132 -16.728 8.612 4.589 1.00 0.00 H new ATOM 0 HA3 GLY A 132 -18.068 8.861 3.486 1.00 0.00 H new ATOM 882 N ASP A 133 -16.781 5.837 3.582 1.00 0.00 N ATOM 883 CA ASP A 133 -17.112 4.422 3.742 1.00 0.00 C ATOM 884 C ASP A 133 -15.984 3.673 4.452 1.00 0.00 C ATOM 885 O ASP A 133 -16.210 2.628 5.062 1.00 0.00 O ATOM 886 CB ASP A 133 -17.376 3.799 2.370 1.00 0.00 C ATOM 887 CG ASP A 133 -17.894 2.373 2.525 1.00 0.00 C ATOM 888 OD1 ASP A 133 -17.937 1.895 3.646 1.00 0.00 O ATOM 889 OD2 ASP A 133 -18.242 1.778 1.518 1.00 0.00 O ATOM 0 H ASP A 133 -15.849 6.017 3.209 1.00 0.00 H new ATOM 0 HA ASP A 133 -18.009 4.342 4.356 1.00 0.00 H new ATOM 0 HB2 ASP A 133 -18.104 4.400 1.825 1.00 0.00 H new ATOM 0 HB3 ASP A 133 -16.459 3.798 1.781 1.00 0.00 H new ATOM 894 N GLY A 134 -14.775 4.222 4.395 1.00 0.00 N ATOM 895 CA GLY A 134 -13.638 3.601 5.064 1.00 0.00 C ATOM 896 C GLY A 134 -13.052 2.423 4.279 1.00 0.00 C ATOM 897 O GLY A 134 -12.460 1.526 4.877 1.00 0.00 O ATOM 0 H GLY A 134 -14.559 5.086 3.898 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -12.861 4.350 5.219 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -13.948 3.255 6.050 1.00 0.00 H new ATOM 901 N GLN A 135 -13.209 2.426 2.950 1.00 0.00 N ATOM 902 CA GLN A 135 -12.664 1.340 2.124 1.00 0.00 C ATOM 903 C GLN A 135 -11.735 1.890 1.047 1.00 0.00 C ATOM 904 O GLN A 135 -11.919 3.008 0.565 1.00 0.00 O ATOM 905 CB GLN A 135 -13.782 0.530 1.468 1.00 0.00 C ATOM 906 CG GLN A 135 -15.002 1.421 1.242 1.00 0.00 C ATOM 907 CD GLN A 135 -14.614 2.629 0.395 1.00 0.00 C ATOM 908 OE1 GLN A 135 -14.169 3.645 0.930 1.00 0.00 O ATOM 909 NE2 GLN A 135 -14.756 2.580 -0.900 1.00 0.00 N ATOM 0 H GLN A 135 -13.700 3.154 2.430 1.00 0.00 H new ATOM 0 HA GLN A 135 -12.096 0.684 2.784 1.00 0.00 H new ATOM 0 HB2 GLN A 135 -13.438 0.121 0.518 1.00 0.00 H new ATOM 0 HB3 GLN A 135 -14.050 -0.316 2.101 1.00 0.00 H new ATOM 0 HG2 GLN A 135 -15.789 0.855 0.744 1.00 0.00 H new ATOM 0 HG3 GLN A 135 -15.404 1.752 2.200 1.00 0.00 H new ATOM 0 HE21 GLN A 135 -15.125 1.737 -1.341 1.00 0.00 H new ATOM 0 HE22 GLN A 135 -14.498 3.384 -1.472 1.00 0.00 H new ATOM 918 N VAL A 136 -10.727 1.098 0.685 1.00 0.00 N ATOM 919 CA VAL A 136 -9.757 1.506 -0.324 1.00 0.00 C ATOM 920 C VAL A 136 -9.502 0.405 -1.347 1.00 0.00 C ATOM 921 O VAL A 136 -9.311 -0.758 -0.993 1.00 0.00 O ATOM 922 CB VAL A 136 -8.438 1.879 0.353 1.00 0.00 C ATOM 923 CG1 VAL A 136 -7.299 1.817 -0.669 1.00 0.00 C ATOM 924 CG2 VAL A 136 -8.544 3.300 0.905 1.00 0.00 C ATOM 0 H VAL A 136 -10.563 0.171 1.077 1.00 0.00 H new ATOM 0 HA VAL A 136 -10.171 2.366 -0.850 1.00 0.00 H new ATOM 0 HB VAL A 136 -8.234 1.180 1.164 1.00 0.00 H new ATOM 0 HG11 VAL A 136 -6.360 2.083 -0.184 1.00 0.00 H new ATOM 0 HG12 VAL A 136 -7.226 0.807 -1.071 1.00 0.00 H new ATOM 0 HG13 VAL A 136 -7.500 2.517 -1.480 1.00 0.00 H new ATOM 0 HG21 VAL A 136 -7.607 3.573 1.389 1.00 0.00 H new ATOM 0 HG22 VAL A 136 -8.746 3.993 0.089 1.00 0.00 H new ATOM 0 HG23 VAL A 136 -9.355 3.349 1.631 1.00 0.00 H new ATOM 934 N ASN A 137 -9.477 0.794 -2.616 1.00 0.00 N ATOM 935 CA ASN A 137 -9.218 -0.151 -3.691 1.00 0.00 C ATOM 936 C ASN A 137 -7.716 -0.216 -3.975 1.00 0.00 C ATOM 937 O ASN A 137 -7.134 0.744 -4.478 1.00 0.00 O ATOM 938 CB ASN A 137 -9.956 0.282 -4.958 1.00 0.00 C ATOM 939 CG ASN A 137 -10.324 1.760 -4.867 1.00 0.00 C ATOM 940 OD1 ASN A 137 -9.480 2.626 -5.098 1.00 0.00 O ATOM 941 ND2 ASN A 137 -11.539 2.099 -4.538 1.00 0.00 N ATOM 0 H ASN A 137 -9.633 1.754 -2.923 1.00 0.00 H new ATOM 0 HA ASN A 137 -9.573 -1.136 -3.387 1.00 0.00 H new ATOM 0 HB2 ASN A 137 -9.328 0.108 -5.832 1.00 0.00 H new ATOM 0 HB3 ASN A 137 -10.856 -0.318 -5.088 1.00 0.00 H new ATOM 0 HD21 ASN A 137 -11.793 3.085 -4.471 1.00 0.00 H new ATOM 0 HD22 ASN A 137 -12.236 1.379 -4.347 1.00 0.00 H new ATOM 948 N TYR A 138 -7.087 -1.339 -3.636 1.00 0.00 N ATOM 949 CA TYR A 138 -5.648 -1.485 -3.849 1.00 0.00 C ATOM 950 C TYR A 138 -5.291 -1.488 -5.332 1.00 0.00 C ATOM 951 O TYR A 138 -4.119 -1.378 -5.693 1.00 0.00 O ATOM 952 CB TYR A 138 -5.128 -2.775 -3.208 1.00 0.00 C ATOM 953 CG TYR A 138 -5.823 -3.983 -3.798 1.00 0.00 C ATOM 954 CD1 TYR A 138 -5.392 -4.515 -5.020 1.00 0.00 C ATOM 955 CD2 TYR A 138 -6.889 -4.579 -3.116 1.00 0.00 C ATOM 956 CE1 TYR A 138 -6.031 -5.641 -5.556 1.00 0.00 C ATOM 957 CE2 TYR A 138 -7.523 -5.703 -3.646 1.00 0.00 C ATOM 958 CZ TYR A 138 -7.096 -6.237 -4.869 1.00 0.00 C ATOM 959 OH TYR A 138 -7.720 -7.349 -5.395 1.00 0.00 O ATOM 0 H TYR A 138 -7.542 -2.151 -3.219 1.00 0.00 H new ATOM 0 HA TYR A 138 -5.173 -0.625 -3.377 1.00 0.00 H new ATOM 0 HB2 TYR A 138 -4.052 -2.856 -3.363 1.00 0.00 H new ATOM 0 HB3 TYR A 138 -5.293 -2.744 -2.131 1.00 0.00 H new ATOM 0 HD1 TYR A 138 -4.568 -4.058 -5.548 1.00 0.00 H new ATOM 0 HD2 TYR A 138 -7.223 -4.167 -2.175 1.00 0.00 H new ATOM 0 HE1 TYR A 138 -5.702 -6.050 -6.500 1.00 0.00 H new ATOM 0 HE2 TYR A 138 -8.343 -6.162 -3.114 1.00 0.00 H new ATOM 0 HH TYR A 138 -8.063 -7.907 -4.666 1.00 0.00 H new ATOM 969 N GLU A 139 -6.291 -1.642 -6.189 1.00 0.00 N ATOM 970 CA GLU A 139 -6.025 -1.689 -7.621 1.00 0.00 C ATOM 971 C GLU A 139 -5.337 -0.407 -8.088 1.00 0.00 C ATOM 972 O GLU A 139 -4.335 -0.464 -8.797 1.00 0.00 O ATOM 973 CB GLU A 139 -7.335 -1.878 -8.397 1.00 0.00 C ATOM 974 CG GLU A 139 -7.892 -3.291 -8.166 1.00 0.00 C ATOM 975 CD GLU A 139 -8.623 -3.363 -6.828 1.00 0.00 C ATOM 976 OE1 GLU A 139 -8.734 -2.338 -6.175 1.00 0.00 O ATOM 977 OE2 GLU A 139 -9.060 -4.445 -6.475 1.00 0.00 O ATOM 0 H GLU A 139 -7.272 -1.735 -5.927 1.00 0.00 H new ATOM 0 HA GLU A 139 -5.363 -2.533 -7.814 1.00 0.00 H new ATOM 0 HB2 GLU A 139 -8.066 -1.135 -8.077 1.00 0.00 H new ATOM 0 HB3 GLU A 139 -7.162 -1.717 -9.461 1.00 0.00 H new ATOM 0 HG2 GLU A 139 -8.573 -3.557 -8.974 1.00 0.00 H new ATOM 0 HG3 GLU A 139 -7.079 -4.017 -8.183 1.00 0.00 H new ATOM 984 N GLU A 140 -5.866 0.748 -7.696 1.00 0.00 N ATOM 985 CA GLU A 140 -5.269 2.020 -8.107 1.00 0.00 C ATOM 986 C GLU A 140 -3.844 2.153 -7.575 1.00 0.00 C ATOM 987 O GLU A 140 -2.943 2.574 -8.296 1.00 0.00 O ATOM 988 CB GLU A 140 -6.125 3.184 -7.600 1.00 0.00 C ATOM 989 CG GLU A 140 -5.533 4.513 -8.079 1.00 0.00 C ATOM 990 CD GLU A 140 -6.429 5.667 -7.642 1.00 0.00 C ATOM 991 OE1 GLU A 140 -7.437 5.402 -7.009 1.00 0.00 O ATOM 992 OE2 GLU A 140 -6.093 6.799 -7.949 1.00 0.00 O ATOM 0 H GLU A 140 -6.693 0.833 -7.104 1.00 0.00 H new ATOM 0 HA GLU A 140 -5.231 2.044 -9.196 1.00 0.00 H new ATOM 0 HB2 GLU A 140 -7.148 3.080 -7.962 1.00 0.00 H new ATOM 0 HB3 GLU A 140 -6.169 3.167 -6.511 1.00 0.00 H new ATOM 0 HG2 GLU A 140 -4.531 4.644 -7.670 1.00 0.00 H new ATOM 0 HG3 GLU A 140 -5.436 4.508 -9.165 1.00 0.00 H new ATOM 999 N PHE A 141 -3.651 1.776 -6.317 1.00 0.00 N ATOM 1000 CA PHE A 141 -2.325 1.847 -5.706 1.00 0.00 C ATOM 1001 C PHE A 141 -1.342 1.001 -6.499 1.00 0.00 C ATOM 1002 O PHE A 141 -0.253 1.453 -6.833 1.00 0.00 O ATOM 1003 CB PHE A 141 -2.377 1.328 -4.265 1.00 0.00 C ATOM 1004 CG PHE A 141 -2.444 2.476 -3.287 1.00 0.00 C ATOM 1005 CD1 PHE A 141 -1.388 3.392 -3.225 1.00 0.00 C ATOM 1006 CD2 PHE A 141 -3.539 2.615 -2.425 1.00 0.00 C ATOM 1007 CE1 PHE A 141 -1.423 4.445 -2.306 1.00 0.00 C ATOM 1008 CE2 PHE A 141 -3.574 3.669 -1.507 1.00 0.00 C ATOM 1009 CZ PHE A 141 -2.517 4.584 -1.446 1.00 0.00 C ATOM 0 H PHE A 141 -4.385 1.422 -5.704 1.00 0.00 H new ATOM 0 HA PHE A 141 -2.000 2.888 -5.707 1.00 0.00 H new ATOM 0 HB2 PHE A 141 -3.246 0.683 -4.137 1.00 0.00 H new ATOM 0 HB3 PHE A 141 -1.496 0.720 -4.060 1.00 0.00 H new ATOM 0 HD1 PHE A 141 -0.543 3.285 -3.889 1.00 0.00 H new ATOM 0 HD2 PHE A 141 -4.355 1.909 -2.469 1.00 0.00 H new ATOM 0 HE1 PHE A 141 -0.606 5.150 -2.260 1.00 0.00 H new ATOM 0 HE2 PHE A 141 -4.419 3.777 -0.843 1.00 0.00 H new ATOM 0 HZ PHE A 141 -2.546 5.397 -0.735 1.00 0.00 H new ATOM 1019 N VAL A 142 -1.735 -0.225 -6.806 1.00 0.00 N ATOM 1020 CA VAL A 142 -0.873 -1.115 -7.566 1.00 0.00 C ATOM 1021 C VAL A 142 -0.627 -0.566 -8.968 1.00 0.00 C ATOM 1022 O VAL A 142 0.502 -0.580 -9.456 1.00 0.00 O ATOM 1023 CB VAL A 142 -1.488 -2.507 -7.621 1.00 0.00 C ATOM 1024 CG1 VAL A 142 -0.708 -3.377 -8.606 1.00 0.00 C ATOM 1025 CG2 VAL A 142 -1.408 -3.118 -6.221 1.00 0.00 C ATOM 0 H VAL A 142 -2.637 -0.623 -6.544 1.00 0.00 H new ATOM 0 HA VAL A 142 0.093 -1.182 -7.066 1.00 0.00 H new ATOM 0 HB VAL A 142 -2.525 -2.448 -7.950 1.00 0.00 H new ATOM 0 HG11 VAL A 142 -1.151 -4.372 -8.642 1.00 0.00 H new ATOM 0 HG12 VAL A 142 -0.745 -2.927 -9.598 1.00 0.00 H new ATOM 0 HG13 VAL A 142 0.330 -3.454 -8.281 1.00 0.00 H new ATOM 0 HG21 VAL A 142 -1.843 -4.117 -6.235 1.00 0.00 H new ATOM 0 HG22 VAL A 142 -0.365 -3.181 -5.910 1.00 0.00 H new ATOM 0 HG23 VAL A 142 -1.959 -2.492 -5.519 1.00 0.00 H new ATOM 1035 N GLN A 143 -1.677 -0.054 -9.603 1.00 0.00 N ATOM 1036 CA GLN A 143 -1.517 0.521 -10.935 1.00 0.00 C ATOM 1037 C GLN A 143 -0.555 1.699 -10.842 1.00 0.00 C ATOM 1038 O GLN A 143 0.318 1.880 -11.690 1.00 0.00 O ATOM 1039 CB GLN A 143 -2.865 0.985 -11.492 1.00 0.00 C ATOM 1040 CG GLN A 143 -3.722 -0.229 -11.843 1.00 0.00 C ATOM 1041 CD GLN A 143 -3.134 -0.941 -13.052 1.00 0.00 C ATOM 1042 OE1 GLN A 143 -3.081 -0.377 -14.144 1.00 0.00 O ATOM 1043 NE2 GLN A 143 -2.664 -2.145 -12.911 1.00 0.00 N ATOM 0 H GLN A 143 -2.625 -0.025 -9.229 1.00 0.00 H new ATOM 0 HA GLN A 143 -1.119 -0.236 -11.611 1.00 0.00 H new ATOM 0 HB2 GLN A 143 -3.379 1.605 -10.757 1.00 0.00 H new ATOM 0 HB3 GLN A 143 -2.711 1.602 -12.377 1.00 0.00 H new ATOM 0 HG2 GLN A 143 -3.768 -0.911 -10.994 1.00 0.00 H new ATOM 0 HG3 GLN A 143 -4.744 0.085 -12.055 1.00 0.00 H new ATOM 0 HE21 GLN A 143 -2.711 -2.608 -12.003 1.00 0.00 H new ATOM 0 HE22 GLN A 143 -2.249 -2.627 -13.708 1.00 0.00 H new ATOM 1052 N MET A 144 -0.718 2.479 -9.781 1.00 0.00 N ATOM 1053 CA MET A 144 0.137 3.631 -9.529 1.00 0.00 C ATOM 1054 C MET A 144 1.568 3.178 -9.222 1.00 0.00 C ATOM 1055 O MET A 144 2.526 3.686 -9.802 1.00 0.00 O ATOM 1056 CB MET A 144 -0.463 4.434 -8.363 1.00 0.00 C ATOM 1057 CG MET A 144 0.625 5.084 -7.513 1.00 0.00 C ATOM 1058 SD MET A 144 -0.110 6.423 -6.540 1.00 0.00 S ATOM 1059 CE MET A 144 0.805 6.122 -5.010 1.00 0.00 C ATOM 0 H MET A 144 -1.441 2.333 -9.076 1.00 0.00 H new ATOM 0 HA MET A 144 0.186 4.266 -10.413 1.00 0.00 H new ATOM 0 HB2 MET A 144 -1.129 5.203 -8.754 1.00 0.00 H new ATOM 0 HB3 MET A 144 -1.068 3.776 -7.740 1.00 0.00 H new ATOM 0 HG2 MET A 144 1.080 4.345 -6.853 1.00 0.00 H new ATOM 0 HG3 MET A 144 1.419 5.473 -8.150 1.00 0.00 H new ATOM 0 HE1 MET A 144 0.503 6.849 -4.256 1.00 0.00 H new ATOM 0 HE2 MET A 144 0.591 5.116 -4.650 1.00 0.00 H new ATOM 0 HE3 MET A 144 1.874 6.220 -5.200 1.00 0.00 H new ATOM 1069 N MET A 145 1.701 2.219 -8.311 1.00 0.00 N ATOM 1070 CA MET A 145 3.011 1.694 -7.930 1.00 0.00 C ATOM 1071 C MET A 145 3.683 0.955 -9.081 1.00 0.00 C ATOM 1072 O MET A 145 4.905 0.986 -9.218 1.00 0.00 O ATOM 1073 CB MET A 145 2.877 0.732 -6.750 1.00 0.00 C ATOM 1074 CG MET A 145 2.511 1.500 -5.482 1.00 0.00 C ATOM 1075 SD MET A 145 2.237 0.316 -4.143 1.00 0.00 S ATOM 1076 CE MET A 145 1.549 1.479 -2.945 1.00 0.00 C ATOM 0 H MET A 145 0.917 1.788 -7.821 1.00 0.00 H new ATOM 0 HA MET A 145 3.626 2.550 -7.654 1.00 0.00 H new ATOM 0 HB2 MET A 145 2.112 -0.015 -6.965 1.00 0.00 H new ATOM 0 HB3 MET A 145 3.814 0.195 -6.601 1.00 0.00 H new ATOM 0 HG2 MET A 145 3.310 2.192 -5.216 1.00 0.00 H new ATOM 0 HG3 MET A 145 1.614 2.097 -5.648 1.00 0.00 H new ATOM 0 HE1 MET A 145 2.111 1.417 -2.013 1.00 0.00 H new ATOM 0 HE2 MET A 145 1.615 2.492 -3.342 1.00 0.00 H new ATOM 0 HE3 MET A 145 0.505 1.231 -2.756 1.00 0.00 H new ATOM 1086 N THR A 146 2.885 0.273 -9.898 1.00 0.00 N ATOM 1087 CA THR A 146 3.432 -0.483 -11.018 1.00 0.00 C ATOM 1088 C THR A 146 4.013 0.470 -12.058 1.00 0.00 C ATOM 1089 O THR A 146 5.063 0.199 -12.640 1.00 0.00 O ATOM 1090 CB THR A 146 2.323 -1.347 -11.639 1.00 0.00 C ATOM 1091 OG1 THR A 146 1.773 -2.178 -10.626 1.00 0.00 O ATOM 1092 CG2 THR A 146 2.892 -2.248 -12.746 1.00 0.00 C ATOM 0 H THR A 146 1.870 0.229 -9.807 1.00 0.00 H new ATOM 0 HA THR A 146 4.232 -1.132 -10.663 1.00 0.00 H new ATOM 0 HB THR A 146 1.564 -0.691 -12.066 1.00 0.00 H new ATOM 0 HG1 THR A 146 1.377 -1.620 -9.924 1.00 0.00 H new ATOM 0 HG21 THR A 146 2.090 -2.851 -13.172 1.00 0.00 H new ATOM 0 HG22 THR A 146 3.335 -1.630 -13.527 1.00 0.00 H new ATOM 0 HG23 THR A 146 3.655 -2.903 -12.326 1.00 0.00 H new ATOM 1100 N ALA A 147 3.330 1.586 -12.287 1.00 0.00 N ATOM 1101 CA ALA A 147 3.799 2.565 -13.261 1.00 0.00 C ATOM 1102 C ALA A 147 5.220 3.005 -12.925 1.00 0.00 C ATOM 1103 O ALA A 147 5.425 3.945 -12.157 1.00 0.00 O ATOM 1104 CB ALA A 147 2.872 3.782 -13.268 1.00 0.00 C ATOM 0 H ALA A 147 2.459 1.834 -11.817 1.00 0.00 H new ATOM 0 HA ALA A 147 3.794 2.104 -14.249 1.00 0.00 H new ATOM 0 HB1 ALA A 147 3.230 4.508 -13.998 1.00 0.00 H new ATOM 0 HB2 ALA A 147 1.862 3.469 -13.533 1.00 0.00 H new ATOM 0 HB3 ALA A 147 2.863 4.238 -12.278 1.00 0.00 H new ATOM 1110 N LYS A 148 6.194 2.313 -13.503 1.00 0.00 N ATOM 1111 CA LYS A 148 7.595 2.629 -13.260 1.00 0.00 C ATOM 1112 C LYS A 148 8.468 2.146 -14.417 1.00 0.00 C ATOM 1113 O LYS A 148 8.087 1.181 -15.059 1.00 0.00 O ATOM 1114 CB LYS A 148 8.038 2.010 -11.922 1.00 0.00 C ATOM 1115 CG LYS A 148 8.568 0.584 -12.119 1.00 0.00 C ATOM 1116 CD LYS A 148 10.081 0.610 -12.358 1.00 0.00 C ATOM 1117 CE LYS A 148 10.471 -0.552 -13.274 1.00 0.00 C ATOM 1118 NZ LYS A 148 9.987 -0.278 -14.656 1.00 0.00 N ATOM 1119 OXT LYS A 148 9.502 2.752 -14.644 1.00 0.00 O ATOM 0 H LYS A 148 6.040 1.532 -14.141 1.00 0.00 H new ATOM 0 HA LYS A 148 7.714 3.711 -13.196 1.00 0.00 H new ATOM 0 HB2 LYS A 148 8.813 2.630 -11.470 1.00 0.00 H new ATOM 0 HB3 LYS A 148 7.197 1.996 -11.229 1.00 0.00 H new ATOM 0 HG2 LYS A 148 8.342 -0.020 -11.241 1.00 0.00 H new ATOM 0 HG3 LYS A 148 8.067 0.116 -12.966 1.00 0.00 H new ATOM 0 HD2 LYS A 148 10.373 1.558 -12.810 1.00 0.00 H new ATOM 0 HD3 LYS A 148 10.612 0.533 -11.409 1.00 0.00 H new ATOM 0 HE2 LYS A 148 11.553 -0.681 -13.275 1.00 0.00 H new ATOM 0 HE3 LYS A 148 10.040 -1.482 -12.904 1.00 0.00 H new ATOM 0 HZ1 LYS A 148 10.176 -1.103 -15.260 1.00 0.00 H new ATOM 0 HZ2 LYS A 148 8.964 -0.092 -14.635 1.00 0.00 H new ATOM 0 HZ3 LYS A 148 10.482 0.552 -15.039 1.00 0.00 H new TER 1133 LYS A 148 ATOM 1134 N PHE B 30 -9.479 -4.552 12.778 1.00 0.00 N ATOM 1135 CA PHE B 30 -8.797 -4.558 11.452 1.00 0.00 C ATOM 1136 C PHE B 30 -8.923 -5.940 10.825 1.00 0.00 C ATOM 1137 O PHE B 30 -8.821 -6.085 9.610 1.00 0.00 O ATOM 1138 CB PHE B 30 -7.314 -4.218 11.639 1.00 0.00 C ATOM 1139 CG PHE B 30 -7.180 -3.065 12.604 1.00 0.00 C ATOM 1140 CD1 PHE B 30 -7.655 -1.796 12.248 1.00 0.00 C ATOM 1141 CD2 PHE B 30 -6.583 -3.261 13.856 1.00 0.00 C ATOM 1142 CE1 PHE B 30 -7.533 -0.726 13.142 1.00 0.00 C ATOM 1143 CE2 PHE B 30 -6.461 -2.191 14.750 1.00 0.00 C ATOM 1144 CZ PHE B 30 -6.935 -0.924 14.393 1.00 0.00 C ATOM 0 HA PHE B 30 -9.261 -3.817 10.801 1.00 0.00 H new ATOM 0 HB2 PHE B 30 -6.776 -5.087 12.017 1.00 0.00 H new ATOM 0 HB3 PHE B 30 -6.866 -3.958 10.680 1.00 0.00 H new ATOM 0 HD1 PHE B 30 -8.116 -1.643 11.283 1.00 0.00 H new ATOM 0 HD2 PHE B 30 -6.216 -4.239 14.132 1.00 0.00 H new ATOM 0 HE1 PHE B 30 -7.900 0.252 12.867 1.00 0.00 H new ATOM 0 HE2 PHE B 30 -6.001 -2.343 15.715 1.00 0.00 H new ATOM 0 HZ PHE B 30 -6.840 -0.098 15.082 1.00 0.00 H new ATOM 1154 N ASP B 31 -9.125 -6.950 11.669 1.00 0.00 N ATOM 1155 CA ASP B 31 -9.237 -8.328 11.197 1.00 0.00 C ATOM 1156 C ASP B 31 -7.966 -8.718 10.447 1.00 0.00 C ATOM 1157 O ASP B 31 -8.001 -9.482 9.483 1.00 0.00 O ATOM 1158 CB ASP B 31 -10.458 -8.492 10.286 1.00 0.00 C ATOM 1159 CG ASP B 31 -11.738 -8.346 11.102 1.00 0.00 C ATOM 1160 OD1 ASP B 31 -11.654 -8.416 12.318 1.00 0.00 O ATOM 1161 OD2 ASP B 31 -12.784 -8.167 10.501 1.00 0.00 O ATOM 0 H ASP B 31 -9.214 -6.841 12.679 1.00 0.00 H new ATOM 0 HA ASP B 31 -9.364 -8.984 12.058 1.00 0.00 H new ATOM 0 HB2 ASP B 31 -10.434 -7.744 9.494 1.00 0.00 H new ATOM 0 HB3 ASP B 31 -10.434 -9.469 9.803 1.00 0.00 H new ATOM 1166 N ILE B 32 -6.845 -8.179 10.917 1.00 0.00 N ATOM 1167 CA ILE B 32 -5.539 -8.449 10.322 1.00 0.00 C ATOM 1168 C ILE B 32 -4.560 -8.925 11.391 1.00 0.00 C ATOM 1169 O ILE B 32 -4.425 -8.296 12.441 1.00 0.00 O ATOM 1170 CB ILE B 32 -5.009 -7.176 9.657 1.00 0.00 C ATOM 1171 CG1 ILE B 32 -5.868 -6.844 8.439 1.00 0.00 C ATOM 1172 CG2 ILE B 32 -3.563 -7.381 9.218 1.00 0.00 C ATOM 1173 CD1 ILE B 32 -5.591 -5.406 7.997 1.00 0.00 C ATOM 0 H ILE B 32 -6.815 -7.546 11.716 1.00 0.00 H new ATOM 0 HA ILE B 32 -5.643 -9.233 9.572 1.00 0.00 H new ATOM 0 HB ILE B 32 -5.052 -6.354 10.372 1.00 0.00 H new ATOM 0 HG12 ILE B 32 -5.647 -7.535 7.625 1.00 0.00 H new ATOM 0 HG13 ILE B 32 -6.924 -6.964 8.681 1.00 0.00 H new ATOM 0 HG21 ILE B 32 -3.194 -6.471 8.746 1.00 0.00 H new ATOM 0 HG22 ILE B 32 -2.948 -7.614 10.087 1.00 0.00 H new ATOM 0 HG23 ILE B 32 -3.512 -8.205 8.506 1.00 0.00 H new ATOM 0 HD11 ILE B 32 -6.204 -5.168 7.128 1.00 0.00 H new ATOM 0 HD12 ILE B 32 -5.834 -4.722 8.810 1.00 0.00 H new ATOM 0 HD13 ILE B 32 -4.537 -5.302 7.738 1.00 0.00 H new ATOM 1185 N ASP B 33 -3.883 -10.038 11.126 1.00 0.00 N ATOM 1186 CA ASP B 33 -2.928 -10.578 12.088 1.00 0.00 C ATOM 1187 C ASP B 33 -1.565 -9.910 11.933 1.00 0.00 C ATOM 1188 O ASP B 33 -0.961 -9.948 10.861 1.00 0.00 O ATOM 1189 CB ASP B 33 -2.784 -12.088 11.887 1.00 0.00 C ATOM 1190 CG ASP B 33 -4.049 -12.799 12.355 1.00 0.00 C ATOM 1191 OD1 ASP B 33 -4.847 -12.167 13.027 1.00 0.00 O ATOM 1192 OD2 ASP B 33 -4.203 -13.965 12.034 1.00 0.00 O ATOM 0 H ASP B 33 -3.975 -10.578 10.265 1.00 0.00 H new ATOM 0 HA ASP B 33 -3.302 -10.377 13.092 1.00 0.00 H new ATOM 0 HB2 ASP B 33 -2.602 -12.307 10.835 1.00 0.00 H new ATOM 0 HB3 ASP B 33 -1.922 -12.457 12.444 1.00 0.00 H new ATOM 1197 N MET B 34 -1.087 -9.303 13.015 1.00 0.00 N ATOM 1198 CA MET B 34 0.208 -8.630 12.998 1.00 0.00 C ATOM 1199 C MET B 34 1.302 -9.556 13.514 1.00 0.00 C ATOM 1200 O MET B 34 2.482 -9.205 13.509 1.00 0.00 O ATOM 1201 CB MET B 34 0.145 -7.372 13.858 1.00 0.00 C ATOM 1202 CG MET B 34 -0.840 -6.392 13.229 1.00 0.00 C ATOM 1203 SD MET B 34 -0.976 -4.918 14.263 1.00 0.00 S ATOM 1204 CE MET B 34 -2.098 -4.009 13.176 1.00 0.00 C ATOM 0 H MET B 34 -1.574 -9.263 13.910 1.00 0.00 H new ATOM 0 HA MET B 34 0.445 -8.355 11.970 1.00 0.00 H new ATOM 0 HB2 MET B 34 -0.169 -7.623 14.871 1.00 0.00 H new ATOM 0 HB3 MET B 34 1.133 -6.917 13.934 1.00 0.00 H new ATOM 0 HG2 MET B 34 -0.505 -6.117 12.229 1.00 0.00 H new ATOM 0 HG3 MET B 34 -1.817 -6.863 13.120 1.00 0.00 H new ATOM 0 HE1 MET B 34 -2.682 -3.302 13.765 1.00 0.00 H new ATOM 0 HE2 MET B 34 -1.520 -3.467 12.427 1.00 0.00 H new ATOM 0 HE3 MET B 34 -2.770 -4.709 12.679 1.00 0.00 H new ATOM 1214 N ASP B 35 0.900 -10.741 13.953 1.00 0.00 N ATOM 1215 CA ASP B 35 1.851 -11.718 14.467 1.00 0.00 C ATOM 1216 C ASP B 35 2.426 -12.538 13.319 1.00 0.00 C ATOM 1217 O ASP B 35 3.190 -13.478 13.531 1.00 0.00 O ATOM 1218 CB ASP B 35 1.161 -12.644 15.473 1.00 0.00 C ATOM 1219 CG ASP B 35 0.096 -13.482 14.772 1.00 0.00 C ATOM 1220 OD1 ASP B 35 -0.052 -13.336 13.571 1.00 0.00 O ATOM 1221 OD2 ASP B 35 -0.557 -14.259 15.450 1.00 0.00 O ATOM 0 H ASP B 35 -0.073 -11.048 13.964 1.00 0.00 H new ATOM 0 HA ASP B 35 2.662 -11.190 14.969 1.00 0.00 H new ATOM 0 HB2 ASP B 35 1.897 -13.297 15.942 1.00 0.00 H new ATOM 0 HB3 ASP B 35 0.705 -12.054 16.268 1.00 0.00 H new ATOM 1226 N ALA B 36 2.048 -12.167 12.102 1.00 0.00 N ATOM 1227 CA ALA B 36 2.524 -12.862 10.914 1.00 0.00 C ATOM 1228 C ALA B 36 3.630 -12.045 10.228 1.00 0.00 C ATOM 1229 O ALA B 36 3.342 -10.996 9.653 1.00 0.00 O ATOM 1230 CB ALA B 36 1.362 -13.048 9.935 1.00 0.00 C ATOM 0 H ALA B 36 1.415 -11.390 11.913 1.00 0.00 H new ATOM 0 HA ALA B 36 2.924 -13.832 11.209 1.00 0.00 H new ATOM 0 HB1 ALA B 36 1.716 -13.568 9.045 1.00 0.00 H new ATOM 0 HB2 ALA B 36 0.576 -13.635 10.410 1.00 0.00 H new ATOM 0 HB3 ALA B 36 0.965 -12.073 9.652 1.00 0.00 H new ATOM 1236 N PRO B 37 4.874 -12.484 10.255 1.00 0.00 N ATOM 1237 CA PRO B 37 5.988 -11.737 9.595 1.00 0.00 C ATOM 1238 C PRO B 37 5.655 -11.377 8.149 1.00 0.00 C ATOM 1239 O PRO B 37 6.130 -10.371 7.624 1.00 0.00 O ATOM 1240 CB PRO B 37 7.157 -12.720 9.647 1.00 0.00 C ATOM 1241 CG PRO B 37 6.889 -13.565 10.842 1.00 0.00 C ATOM 1242 CD PRO B 37 5.371 -13.712 10.915 1.00 0.00 C ATOM 0 HA PRO B 37 6.196 -10.788 10.088 1.00 0.00 H new ATOM 0 HB2 PRO B 37 7.208 -13.322 8.740 1.00 0.00 H new ATOM 0 HB3 PRO B 37 8.109 -12.198 9.737 1.00 0.00 H new ATOM 0 HG2 PRO B 37 7.372 -14.538 10.749 1.00 0.00 H new ATOM 0 HG3 PRO B 37 7.281 -13.099 11.746 1.00 0.00 H new ATOM 0 HD2 PRO B 37 5.029 -14.610 10.401 1.00 0.00 H new ATOM 0 HD3 PRO B 37 5.023 -13.783 11.946 1.00 0.00 H new ATOM 1250 N GLU B 38 4.838 -12.210 7.512 1.00 0.00 N ATOM 1251 CA GLU B 38 4.451 -11.973 6.126 1.00 0.00 C ATOM 1252 C GLU B 38 3.725 -10.637 5.994 1.00 0.00 C ATOM 1253 O GLU B 38 3.963 -9.885 5.049 1.00 0.00 O ATOM 1254 CB GLU B 38 3.538 -13.106 5.644 1.00 0.00 C ATOM 1255 CG GLU B 38 3.175 -12.893 4.172 1.00 0.00 C ATOM 1256 CD GLU B 38 2.323 -14.055 3.674 1.00 0.00 C ATOM 1257 OE1 GLU B 38 2.059 -14.949 4.462 1.00 0.00 O ATOM 1258 OE2 GLU B 38 1.946 -14.034 2.515 1.00 0.00 O ATOM 0 H GLU B 38 4.434 -13.048 7.929 1.00 0.00 H new ATOM 0 HA GLU B 38 5.351 -11.944 5.512 1.00 0.00 H new ATOM 0 HB2 GLU B 38 4.039 -14.066 5.769 1.00 0.00 H new ATOM 0 HB3 GLU B 38 2.632 -13.138 6.250 1.00 0.00 H new ATOM 0 HG2 GLU B 38 2.631 -11.956 4.055 1.00 0.00 H new ATOM 0 HG3 GLU B 38 4.082 -12.813 3.573 1.00 0.00 H new ATOM 1265 N THR B 39 2.841 -10.344 6.945 1.00 0.00 N ATOM 1266 CA THR B 39 2.094 -9.091 6.912 1.00 0.00 C ATOM 1267 C THR B 39 3.046 -7.903 6.984 1.00 0.00 C ATOM 1268 O THR B 39 2.913 -6.941 6.227 1.00 0.00 O ATOM 1269 CB THR B 39 1.115 -9.029 8.086 1.00 0.00 C ATOM 1270 OG1 THR B 39 0.195 -10.108 7.992 1.00 0.00 O ATOM 1271 CG2 THR B 39 0.354 -7.703 8.047 1.00 0.00 C ATOM 0 H THR B 39 2.627 -10.949 7.738 1.00 0.00 H new ATOM 0 HA THR B 39 1.538 -9.048 5.975 1.00 0.00 H new ATOM 0 HB THR B 39 1.666 -9.102 9.023 1.00 0.00 H new ATOM 0 HG1 THR B 39 -0.278 -10.209 8.844 1.00 0.00 H new ATOM 0 HG21 THR B 39 -0.343 -7.659 8.883 1.00 0.00 H new ATOM 0 HG22 THR B 39 1.060 -6.876 8.120 1.00 0.00 H new ATOM 0 HG23 THR B 39 -0.198 -7.628 7.110 1.00 0.00 H new ATOM 1279 N GLU B 40 4.007 -7.976 7.900 1.00 0.00 N ATOM 1280 CA GLU B 40 4.975 -6.897 8.060 1.00 0.00 C ATOM 1281 C GLU B 40 5.789 -6.719 6.782 1.00 0.00 C ATOM 1282 O GLU B 40 6.013 -5.596 6.331 1.00 0.00 O ATOM 1283 CB GLU B 40 5.911 -7.208 9.232 1.00 0.00 C ATOM 1284 CG GLU B 40 6.893 -6.049 9.433 1.00 0.00 C ATOM 1285 CD GLU B 40 7.778 -6.320 10.645 1.00 0.00 C ATOM 1286 OE1 GLU B 40 7.600 -7.356 11.264 1.00 0.00 O ATOM 1287 OE2 GLU B 40 8.619 -5.486 10.937 1.00 0.00 O ATOM 0 H GLU B 40 4.136 -8.763 8.537 1.00 0.00 H new ATOM 0 HA GLU B 40 4.436 -5.972 8.264 1.00 0.00 H new ATOM 0 HB2 GLU B 40 5.331 -7.367 10.141 1.00 0.00 H new ATOM 0 HB3 GLU B 40 6.458 -8.131 9.038 1.00 0.00 H new ATOM 0 HG2 GLU B 40 7.509 -5.925 8.543 1.00 0.00 H new ATOM 0 HG3 GLU B 40 6.345 -5.117 9.573 1.00 0.00 H new ATOM 1294 N ARG B 41 6.226 -7.833 6.202 1.00 0.00 N ATOM 1295 CA ARG B 41 7.012 -7.782 4.976 1.00 0.00 C ATOM 1296 C ARG B 41 6.185 -7.189 3.840 1.00 0.00 C ATOM 1297 O ARG B 41 6.687 -6.399 3.041 1.00 0.00 O ATOM 1298 CB ARG B 41 7.478 -9.191 4.593 1.00 0.00 C ATOM 1299 CG ARG B 41 8.512 -9.703 5.607 1.00 0.00 C ATOM 1300 CD ARG B 41 9.914 -9.201 5.238 1.00 0.00 C ATOM 1301 NE ARG B 41 10.892 -9.692 6.202 1.00 0.00 N ATOM 1302 CZ ARG B 41 11.445 -10.893 6.070 1.00 0.00 C ATOM 1303 NH1 ARG B 41 11.109 -11.662 5.071 1.00 0.00 N ATOM 1304 NH2 ARG B 41 12.325 -11.305 6.942 1.00 0.00 N ATOM 0 H ARG B 41 6.051 -8.773 6.558 1.00 0.00 H new ATOM 0 HA ARG B 41 7.883 -7.149 5.148 1.00 0.00 H new ATOM 0 HB2 ARG B 41 6.624 -9.868 4.560 1.00 0.00 H new ATOM 0 HB3 ARG B 41 7.913 -9.179 3.594 1.00 0.00 H new ATOM 0 HG2 ARG B 41 8.249 -9.363 6.608 1.00 0.00 H new ATOM 0 HG3 ARG B 41 8.502 -10.793 5.628 1.00 0.00 H new ATOM 0 HD2 ARG B 41 10.178 -9.539 4.236 1.00 0.00 H new ATOM 0 HD3 ARG B 41 9.925 -8.111 5.220 1.00 0.00 H new ATOM 0 HE ARG B 41 11.156 -9.103 6.992 1.00 0.00 H new ATOM 0 HH11 ARG B 41 10.421 -11.342 4.390 1.00 0.00 H new ATOM 0 HH12 ARG B 41 11.535 -12.584 4.971 1.00 0.00 H new ATOM 0 HH21 ARG B 41 12.588 -10.705 7.724 1.00 0.00 H new ATOM 0 HH22 ARG B 41 12.750 -12.227 6.841 1.00 0.00 H new ATOM 1318 N ALA B 42 4.913 -7.567 3.782 1.00 0.00 N ATOM 1319 CA ALA B 42 4.023 -7.058 2.746 1.00 0.00 C ATOM 1320 C ALA B 42 3.887 -5.546 2.867 1.00 0.00 C ATOM 1321 O ALA B 42 3.863 -4.829 1.867 1.00 0.00 O ATOM 1322 CB ALA B 42 2.645 -7.710 2.871 1.00 0.00 C ATOM 0 H ALA B 42 4.478 -8.219 4.435 1.00 0.00 H new ATOM 0 HA ALA B 42 4.447 -7.301 1.772 1.00 0.00 H new ATOM 0 HB1 ALA B 42 1.987 -7.323 2.093 1.00 0.00 H new ATOM 0 HB2 ALA B 42 2.742 -8.790 2.760 1.00 0.00 H new ATOM 0 HB3 ALA B 42 2.222 -7.482 3.849 1.00 0.00 H new ATOM 1328 N ALA B 43 3.801 -5.070 4.104 1.00 0.00 N ATOM 1329 CA ALA B 43 3.671 -3.641 4.361 1.00 0.00 C ATOM 1330 C ALA B 43 4.886 -2.886 3.830 1.00 0.00 C ATOM 1331 O ALA B 43 4.760 -1.789 3.284 1.00 0.00 O ATOM 1332 CB ALA B 43 3.534 -3.394 5.865 1.00 0.00 C ATOM 0 H ALA B 43 3.819 -5.651 4.942 1.00 0.00 H new ATOM 0 HA ALA B 43 2.780 -3.278 3.848 1.00 0.00 H new ATOM 0 HB1 ALA B 43 3.437 -2.324 6.051 1.00 0.00 H new ATOM 0 HB2 ALA B 43 2.649 -3.909 6.239 1.00 0.00 H new ATOM 0 HB3 ALA B 43 4.418 -3.773 6.378 1.00 0.00 H new ATOM 1338 N VAL B 44 6.065 -3.476 4.009 1.00 0.00 N ATOM 1339 CA VAL B 44 7.305 -2.848 3.559 1.00 0.00 C ATOM 1340 C VAL B 44 7.319 -2.645 2.045 1.00 0.00 C ATOM 1341 O VAL B 44 7.688 -1.575 1.563 1.00 0.00 O ATOM 1342 CB VAL B 44 8.501 -3.712 3.962 1.00 0.00 C ATOM 1343 CG1 VAL B 44 9.766 -3.175 3.291 1.00 0.00 C ATOM 1344 CG2 VAL B 44 8.676 -3.668 5.482 1.00 0.00 C ATOM 0 H VAL B 44 6.188 -4.383 4.460 1.00 0.00 H new ATOM 0 HA VAL B 44 7.370 -1.870 4.035 1.00 0.00 H new ATOM 0 HB VAL B 44 8.327 -4.740 3.645 1.00 0.00 H new ATOM 0 HG11 VAL B 44 10.619 -3.790 3.578 1.00 0.00 H new ATOM 0 HG12 VAL B 44 9.644 -3.205 2.208 1.00 0.00 H new ATOM 0 HG13 VAL B 44 9.938 -2.146 3.608 1.00 0.00 H new ATOM 0 HG21 VAL B 44 9.529 -4.284 5.768 1.00 0.00 H new ATOM 0 HG22 VAL B 44 8.849 -2.639 5.799 1.00 0.00 H new ATOM 0 HG23 VAL B 44 7.775 -4.049 5.963 1.00 0.00 H new ATOM 1354 N ALA B 45 6.935 -3.674 1.297 1.00 0.00 N ATOM 1355 CA ALA B 45 6.932 -3.575 -0.161 1.00 0.00 C ATOM 1356 C ALA B 45 5.983 -2.479 -0.628 1.00 0.00 C ATOM 1357 O ALA B 45 6.319 -1.690 -1.511 1.00 0.00 O ATOM 1358 CB ALA B 45 6.509 -4.908 -0.778 1.00 0.00 C ATOM 0 H ALA B 45 6.626 -4.573 1.667 1.00 0.00 H new ATOM 0 HA ALA B 45 7.943 -3.327 -0.485 1.00 0.00 H new ATOM 0 HB1 ALA B 45 6.510 -4.823 -1.865 1.00 0.00 H new ATOM 0 HB2 ALA B 45 7.208 -5.687 -0.474 1.00 0.00 H new ATOM 0 HB3 ALA B 45 5.507 -5.166 -0.436 1.00 0.00 H new ATOM 1364 N ILE B 46 4.801 -2.429 -0.032 1.00 0.00 N ATOM 1365 CA ILE B 46 3.821 -1.418 -0.401 1.00 0.00 C ATOM 1366 C ILE B 46 4.371 -0.029 -0.095 1.00 0.00 C ATOM 1367 O ILE B 46 4.313 0.875 -0.929 1.00 0.00 O ATOM 1368 CB ILE B 46 2.522 -1.666 0.373 1.00 0.00 C ATOM 1369 CG1 ILE B 46 1.905 -2.981 -0.105 1.00 0.00 C ATOM 1370 CG2 ILE B 46 1.525 -0.532 0.112 1.00 0.00 C ATOM 1371 CD1 ILE B 46 0.794 -3.403 0.854 1.00 0.00 C ATOM 0 H ILE B 46 4.499 -3.070 0.702 1.00 0.00 H new ATOM 0 HA ILE B 46 3.614 -1.479 -1.469 1.00 0.00 H new ATOM 0 HB ILE B 46 2.745 -1.711 1.439 1.00 0.00 H new ATOM 0 HG12 ILE B 46 1.505 -2.862 -1.112 1.00 0.00 H new ATOM 0 HG13 ILE B 46 2.670 -3.756 -0.156 1.00 0.00 H new ATOM 0 HG21 ILE B 46 0.606 -0.720 0.668 1.00 0.00 H new ATOM 0 HG22 ILE B 46 1.958 0.415 0.436 1.00 0.00 H new ATOM 0 HG23 ILE B 46 1.301 -0.483 -0.954 1.00 0.00 H new ATOM 0 HD11 ILE B 46 0.355 -4.340 0.512 1.00 0.00 H new ATOM 0 HD12 ILE B 46 1.208 -3.539 1.853 1.00 0.00 H new ATOM 0 HD13 ILE B 46 0.025 -2.631 0.882 1.00 0.00 H new ATOM 1383 N GLN B 47 4.918 0.126 1.108 1.00 0.00 N ATOM 1384 CA GLN B 47 5.495 1.400 1.526 1.00 0.00 C ATOM 1385 C GLN B 47 6.736 1.744 0.706 1.00 0.00 C ATOM 1386 O GLN B 47 6.950 2.902 0.348 1.00 0.00 O ATOM 1387 CB GLN B 47 5.855 1.346 3.011 1.00 0.00 C ATOM 1388 CG GLN B 47 4.568 1.355 3.842 1.00 0.00 C ATOM 1389 CD GLN B 47 4.902 1.319 5.327 1.00 0.00 C ATOM 1390 OE1 GLN B 47 5.893 1.908 5.758 1.00 0.00 O ATOM 1391 NE2 GLN B 47 4.120 0.667 6.144 1.00 0.00 N ATOM 0 H GLN B 47 4.974 -0.613 1.809 1.00 0.00 H new ATOM 0 HA GLN B 47 4.751 2.178 1.358 1.00 0.00 H new ATOM 0 HB2 GLN B 47 6.434 0.447 3.225 1.00 0.00 H new ATOM 0 HB3 GLN B 47 6.480 2.198 3.277 1.00 0.00 H new ATOM 0 HG2 GLN B 47 3.985 2.248 3.614 1.00 0.00 H new ATOM 0 HG3 GLN B 47 3.951 0.496 3.579 1.00 0.00 H new ATOM 0 HE21 GLN B 47 3.299 0.180 5.784 1.00 0.00 H new ATOM 0 HE22 GLN B 47 4.330 0.645 7.142 1.00 0.00 H new ATOM 1400 N SER B 48 7.554 0.737 0.418 1.00 0.00 N ATOM 1401 CA SER B 48 8.773 0.956 -0.352 1.00 0.00 C ATOM 1402 C SER B 48 8.443 1.504 -1.735 1.00 0.00 C ATOM 1403 O SER B 48 9.065 2.460 -2.200 1.00 0.00 O ATOM 1404 CB SER B 48 9.544 -0.357 -0.493 1.00 0.00 C ATOM 1405 OG SER B 48 10.724 -0.130 -1.252 1.00 0.00 O ATOM 0 H SER B 48 7.397 -0.230 0.703 1.00 0.00 H new ATOM 0 HA SER B 48 9.388 1.684 0.177 1.00 0.00 H new ATOM 0 HB2 SER B 48 9.801 -0.749 0.491 1.00 0.00 H new ATOM 0 HB3 SER B 48 8.922 -1.107 -0.982 1.00 0.00 H new ATOM 0 HG SER B 48 11.221 -0.970 -1.343 1.00 0.00 H new ATOM 1411 N GLN B 49 7.457 0.898 -2.386 1.00 0.00 N ATOM 1412 CA GLN B 49 7.048 1.339 -3.714 1.00 0.00 C ATOM 1413 C GLN B 49 6.459 2.746 -3.663 1.00 0.00 C ATOM 1414 O GLN B 49 6.651 3.538 -4.586 1.00 0.00 O ATOM 1415 CB GLN B 49 6.028 0.364 -4.304 1.00 0.00 C ATOM 1416 CG GLN B 49 6.748 -0.640 -5.209 1.00 0.00 C ATOM 1417 CD GLN B 49 7.821 -1.386 -4.424 1.00 0.00 C ATOM 1418 OE1 GLN B 49 9.012 -1.156 -4.627 1.00 0.00 O ATOM 1419 NE2 GLN B 49 7.468 -2.280 -3.540 1.00 0.00 N ATOM 0 H GLN B 49 6.929 0.106 -2.019 1.00 0.00 H new ATOM 0 HA GLN B 49 7.931 1.360 -4.353 1.00 0.00 H new ATOM 0 HB2 GLN B 49 5.505 -0.160 -3.504 1.00 0.00 H new ATOM 0 HB3 GLN B 49 5.275 0.909 -4.874 1.00 0.00 H new ATOM 0 HG2 GLN B 49 6.030 -1.349 -5.620 1.00 0.00 H new ATOM 0 HG3 GLN B 49 7.201 -0.119 -6.053 1.00 0.00 H new ATOM 0 HE21 GLN B 49 6.480 -2.469 -3.373 1.00 0.00 H new ATOM 0 HE22 GLN B 49 8.180 -2.789 -3.017 1.00 0.00 H new ATOM 1428 N PHE B 50 5.742 3.053 -2.586 1.00 0.00 N ATOM 1429 CA PHE B 50 5.138 4.373 -2.446 1.00 0.00 C ATOM 1430 C PHE B 50 6.208 5.460 -2.486 1.00 0.00 C ATOM 1431 O PHE B 50 6.076 6.443 -3.213 1.00 0.00 O ATOM 1432 CB PHE B 50 4.341 4.469 -1.137 1.00 0.00 C ATOM 1433 CG PHE B 50 3.904 5.902 -0.927 1.00 0.00 C ATOM 1434 CD1 PHE B 50 3.071 6.521 -1.867 1.00 0.00 C ATOM 1435 CD2 PHE B 50 4.361 6.624 0.186 1.00 0.00 C ATOM 1436 CE1 PHE B 50 2.687 7.857 -1.694 1.00 0.00 C ATOM 1437 CE2 PHE B 50 3.980 7.962 0.353 1.00 0.00 C ATOM 1438 CZ PHE B 50 3.145 8.577 -0.585 1.00 0.00 C ATOM 0 H PHE B 50 5.567 2.416 -1.809 1.00 0.00 H new ATOM 0 HA PHE B 50 4.455 4.522 -3.282 1.00 0.00 H new ATOM 0 HB2 PHE B 50 3.472 3.813 -1.177 1.00 0.00 H new ATOM 0 HB3 PHE B 50 4.953 4.136 -0.299 1.00 0.00 H new ATOM 0 HD1 PHE B 50 2.724 5.967 -2.727 1.00 0.00 H new ATOM 0 HD2 PHE B 50 5.005 6.150 0.912 1.00 0.00 H new ATOM 0 HE1 PHE B 50 2.038 8.331 -2.416 1.00 0.00 H new ATOM 0 HE2 PHE B 50 4.332 8.520 1.208 1.00 0.00 H new ATOM 0 HZ PHE B 50 2.853 9.609 -0.453 1.00 0.00 H new ATOM 1448 N ARG B 51 7.268 5.279 -1.706 1.00 0.00 N ATOM 1449 CA ARG B 51 8.350 6.256 -1.675 1.00 0.00 C ATOM 1450 C ARG B 51 9.014 6.365 -3.046 1.00 0.00 C ATOM 1451 O ARG B 51 9.357 7.460 -3.495 1.00 0.00 O ATOM 1452 CB ARG B 51 9.394 5.846 -0.634 1.00 0.00 C ATOM 1453 CG ARG B 51 8.810 6.005 0.771 1.00 0.00 C ATOM 1454 CD ARG B 51 9.848 5.567 1.804 1.00 0.00 C ATOM 1455 NE ARG B 51 9.313 5.713 3.153 1.00 0.00 N ATOM 1456 CZ ARG B 51 10.041 5.392 4.219 1.00 0.00 C ATOM 1457 NH1 ARG B 51 11.255 4.937 4.067 1.00 0.00 N ATOM 1458 NH2 ARG B 51 9.540 5.529 5.415 1.00 0.00 N ATOM 0 H ARG B 51 7.401 4.474 -1.093 1.00 0.00 H new ATOM 0 HA ARG B 51 7.930 7.226 -1.408 1.00 0.00 H new ATOM 0 HB2 ARG B 51 9.698 4.812 -0.797 1.00 0.00 H new ATOM 0 HB3 ARG B 51 10.288 6.461 -0.739 1.00 0.00 H new ATOM 0 HG2 ARG B 51 8.525 7.043 0.943 1.00 0.00 H new ATOM 0 HG3 ARG B 51 7.905 5.405 0.871 1.00 0.00 H new ATOM 0 HD2 ARG B 51 10.131 4.529 1.628 1.00 0.00 H new ATOM 0 HD3 ARG B 51 10.752 6.166 1.697 1.00 0.00 H new ATOM 0 HE ARG B 51 8.365 6.067 3.281 1.00 0.00 H new ATOM 0 HH11 ARG B 51 11.645 4.828 3.131 1.00 0.00 H new ATOM 0 HH12 ARG B 51 11.813 4.691 4.884 1.00 0.00 H new ATOM 0 HH21 ARG B 51 8.590 5.882 5.533 1.00 0.00 H new ATOM 0 HH22 ARG B 51 10.098 5.283 6.233 1.00 0.00 H new ATOM 1472 N LYS B 52 9.189 5.225 -3.707 1.00 0.00 N ATOM 1473 CA LYS B 52 9.810 5.201 -5.028 1.00 0.00 C ATOM 1474 C LYS B 52 8.973 5.999 -6.023 1.00 0.00 C ATOM 1475 O LYS B 52 9.508 6.732 -6.855 1.00 0.00 O ATOM 1476 CB LYS B 52 9.953 3.755 -5.514 1.00 0.00 C ATOM 1477 CG LYS B 52 10.654 3.731 -6.876 1.00 0.00 C ATOM 1478 CD LYS B 52 10.842 2.282 -7.330 1.00 0.00 C ATOM 1479 CE LYS B 52 11.570 2.259 -8.675 1.00 0.00 C ATOM 1480 NZ LYS B 52 10.729 2.930 -9.707 1.00 0.00 N ATOM 0 H LYS B 52 8.911 4.310 -3.352 1.00 0.00 H new ATOM 0 HA LYS B 52 10.798 5.655 -4.956 1.00 0.00 H new ATOM 0 HB2 LYS B 52 10.525 3.174 -4.791 1.00 0.00 H new ATOM 0 HB3 LYS B 52 8.971 3.289 -5.592 1.00 0.00 H new ATOM 0 HG2 LYS B 52 10.064 4.279 -7.610 1.00 0.00 H new ATOM 0 HG3 LYS B 52 11.621 4.230 -6.808 1.00 0.00 H new ATOM 0 HD2 LYS B 52 11.414 1.728 -6.586 1.00 0.00 H new ATOM 0 HD3 LYS B 52 9.874 1.789 -7.420 1.00 0.00 H new ATOM 0 HE2 LYS B 52 12.532 2.765 -8.589 1.00 0.00 H new ATOM 0 HE3 LYS B 52 11.777 1.231 -8.971 1.00 0.00 H new ATOM 0 HZ1 LYS B 52 10.980 2.568 -10.649 1.00 0.00 H new ATOM 0 HZ2 LYS B 52 9.725 2.735 -9.518 1.00 0.00 H new ATOM 0 HZ3 LYS B 52 10.894 3.956 -9.675 1.00 0.00 H new ATOM 1494 N PHE B 53 7.659 5.842 -5.931 1.00 0.00 N ATOM 1495 CA PHE B 53 6.745 6.541 -6.827 1.00 0.00 C ATOM 1496 C PHE B 53 6.920 8.052 -6.692 1.00 0.00 C ATOM 1497 O PHE B 53 6.933 8.777 -7.689 1.00 0.00 O ATOM 1498 CB PHE B 53 5.300 6.163 -6.494 1.00 0.00 C ATOM 1499 CG PHE B 53 4.366 6.779 -7.509 1.00 0.00 C ATOM 1500 CD1 PHE B 53 4.060 6.087 -8.688 1.00 0.00 C ATOM 1501 CD2 PHE B 53 3.806 8.040 -7.272 1.00 0.00 C ATOM 1502 CE1 PHE B 53 3.194 6.656 -9.629 1.00 0.00 C ATOM 1503 CE2 PHE B 53 2.940 8.610 -8.214 1.00 0.00 C ATOM 1504 CZ PHE B 53 2.634 7.917 -9.392 1.00 0.00 C ATOM 0 H PHE B 53 7.202 5.239 -5.247 1.00 0.00 H new ATOM 0 HA PHE B 53 6.971 6.248 -7.852 1.00 0.00 H new ATOM 0 HB2 PHE B 53 5.188 5.079 -6.494 1.00 0.00 H new ATOM 0 HB3 PHE B 53 5.045 6.510 -5.493 1.00 0.00 H new ATOM 0 HD1 PHE B 53 4.492 5.114 -8.871 1.00 0.00 H new ATOM 0 HD2 PHE B 53 4.042 8.573 -6.363 1.00 0.00 H new ATOM 0 HE1 PHE B 53 2.958 6.122 -10.538 1.00 0.00 H new ATOM 0 HE2 PHE B 53 2.509 9.583 -8.032 1.00 0.00 H new ATOM 0 HZ PHE B 53 1.966 8.356 -10.118 1.00 0.00 H new ATOM 1514 N GLN B 54 7.043 8.520 -5.455 1.00 0.00 N ATOM 1515 CA GLN B 54 7.206 9.948 -5.198 1.00 0.00 C ATOM 1516 C GLN B 54 8.479 10.473 -5.855 1.00 0.00 C ATOM 1517 O GLN B 54 8.497 11.576 -6.402 1.00 0.00 O ATOM 1518 CB GLN B 54 7.281 10.200 -3.691 1.00 0.00 C ATOM 1519 CG GLN B 54 5.922 9.920 -3.052 1.00 0.00 C ATOM 1520 CD GLN B 54 6.007 10.127 -1.543 1.00 0.00 C ATOM 1521 OE1 GLN B 54 5.963 11.262 -1.068 1.00 0.00 O ATOM 1522 NE2 GLN B 54 6.133 9.093 -0.758 1.00 0.00 N ATOM 0 H GLN B 54 7.033 7.936 -4.618 1.00 0.00 H new ATOM 0 HA GLN B 54 6.347 10.470 -5.619 1.00 0.00 H new ATOM 0 HB2 GLN B 54 8.042 9.561 -3.243 1.00 0.00 H new ATOM 0 HB3 GLN B 54 7.578 11.231 -3.500 1.00 0.00 H new ATOM 0 HG2 GLN B 54 5.167 10.582 -3.477 1.00 0.00 H new ATOM 0 HG3 GLN B 54 5.611 8.899 -3.271 1.00 0.00 H new ATOM 0 HE21 GLN B 54 6.169 8.154 -1.154 1.00 0.00 H new ATOM 0 HE22 GLN B 54 6.195 9.224 0.252 1.00 0.00 H new ATOM 1531 N LYS B 55 9.546 9.681 -5.792 1.00 0.00 N ATOM 1532 CA LYS B 55 10.816 10.085 -6.381 1.00 0.00 C ATOM 1533 C LYS B 55 10.666 10.315 -7.880 1.00 0.00 C ATOM 1534 O LYS B 55 11.157 11.309 -8.414 1.00 0.00 O ATOM 1535 CB LYS B 55 11.875 9.007 -6.125 1.00 0.00 C ATOM 1536 CG LYS B 55 13.208 9.429 -6.751 1.00 0.00 C ATOM 1537 CD LYS B 55 13.436 8.660 -8.057 1.00 0.00 C ATOM 1538 CE LYS B 55 14.783 9.063 -8.658 1.00 0.00 C ATOM 1539 NZ LYS B 55 15.001 8.322 -9.932 1.00 0.00 N ATOM 0 H LYS B 55 9.556 8.765 -5.343 1.00 0.00 H new ATOM 0 HA LYS B 55 11.130 11.020 -5.916 1.00 0.00 H new ATOM 0 HB2 LYS B 55 11.999 8.853 -5.053 1.00 0.00 H new ATOM 0 HB3 LYS B 55 11.549 8.057 -6.548 1.00 0.00 H new ATOM 0 HG2 LYS B 55 13.205 10.501 -6.946 1.00 0.00 H new ATOM 0 HG3 LYS B 55 14.025 9.233 -6.056 1.00 0.00 H new ATOM 0 HD2 LYS B 55 13.417 7.587 -7.868 1.00 0.00 H new ATOM 0 HD3 LYS B 55 12.633 8.874 -8.762 1.00 0.00 H new ATOM 0 HE2 LYS B 55 14.804 10.137 -8.842 1.00 0.00 H new ATOM 0 HE3 LYS B 55 15.587 8.844 -7.955 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 15.917 8.596 -10.341 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 14.998 7.299 -9.744 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 14.240 8.553 -10.602 1.00 0.00 H new ATOM 1553 N LYS B 56 9.984 9.396 -8.557 1.00 0.00 N ATOM 1554 CA LYS B 56 9.786 9.530 -9.994 1.00 0.00 C ATOM 1555 C LYS B 56 9.022 10.812 -10.303 1.00 0.00 C ATOM 1556 O LYS B 56 9.413 11.583 -11.179 1.00 0.00 O ATOM 1557 CB LYS B 56 9.001 8.330 -10.529 1.00 0.00 C ATOM 1558 CG LYS B 56 8.811 8.482 -12.044 1.00 0.00 C ATOM 1559 CD LYS B 56 8.219 7.199 -12.646 1.00 0.00 C ATOM 1560 CE LYS B 56 6.710 7.138 -12.385 1.00 0.00 C ATOM 1561 NZ LYS B 56 6.046 8.296 -13.050 1.00 0.00 N ATOM 0 H LYS B 56 9.566 8.564 -8.141 1.00 0.00 H new ATOM 0 HA LYS B 56 10.763 9.569 -10.477 1.00 0.00 H new ATOM 0 HB2 LYS B 56 9.534 7.405 -10.309 1.00 0.00 H new ATOM 0 HB3 LYS B 56 8.032 8.265 -10.034 1.00 0.00 H new ATOM 0 HG2 LYS B 56 8.152 9.325 -12.250 1.00 0.00 H new ATOM 0 HG3 LYS B 56 9.768 8.703 -12.516 1.00 0.00 H new ATOM 0 HD2 LYS B 56 8.411 7.170 -13.719 1.00 0.00 H new ATOM 0 HD3 LYS B 56 8.706 6.326 -12.211 1.00 0.00 H new ATOM 0 HE2 LYS B 56 6.301 6.202 -12.766 1.00 0.00 H new ATOM 0 HE3 LYS B 56 6.514 7.158 -11.313 1.00 0.00 H new ATOM 0 HZ1 LYS B 56 5.079 8.031 -13.325 1.00 0.00 H new ATOM 0 HZ2 LYS B 56 6.010 9.101 -12.392 1.00 0.00 H new ATOM 0 HZ3 LYS B 56 6.585 8.566 -13.898 1.00 0.00 H new ATOM 1575 N LYS B 57 7.933 11.037 -9.574 1.00 0.00 N ATOM 1576 CA LYS B 57 7.127 12.233 -9.778 1.00 0.00 C ATOM 1577 C LYS B 57 7.944 13.472 -9.419 1.00 0.00 C ATOM 1578 O LYS B 57 7.927 14.472 -10.136 1.00 0.00 O ATOM 1579 CB LYS B 57 5.867 12.167 -8.903 1.00 0.00 C ATOM 1580 CG LYS B 57 4.909 13.332 -9.217 1.00 0.00 C ATOM 1581 CD LYS B 57 4.172 13.080 -10.543 1.00 0.00 C ATOM 1582 CE LYS B 57 3.063 14.117 -10.716 1.00 0.00 C ATOM 1583 NZ LYS B 57 2.310 13.833 -11.970 1.00 0.00 N ATOM 0 H LYS B 57 7.592 10.412 -8.843 1.00 0.00 H new ATOM 0 HA LYS B 57 6.830 12.291 -10.825 1.00 0.00 H new ATOM 0 HB2 LYS B 57 5.356 11.218 -9.067 1.00 0.00 H new ATOM 0 HB3 LYS B 57 6.150 12.199 -7.851 1.00 0.00 H new ATOM 0 HG2 LYS B 57 4.187 13.445 -8.408 1.00 0.00 H new ATOM 0 HG3 LYS B 57 5.469 14.265 -9.277 1.00 0.00 H new ATOM 0 HD2 LYS B 57 4.872 13.138 -11.377 1.00 0.00 H new ATOM 0 HD3 LYS B 57 3.749 12.075 -10.551 1.00 0.00 H new ATOM 0 HE2 LYS B 57 2.389 14.090 -9.860 1.00 0.00 H new ATOM 0 HE3 LYS B 57 3.490 15.119 -10.754 1.00 0.00 H new ATOM 0 HZ1 LYS B 57 1.555 14.538 -12.089 1.00 0.00 H new ATOM 0 HZ2 LYS B 57 2.958 13.879 -12.782 1.00 0.00 H new ATOM 0 HZ3 LYS B 57 1.891 12.883 -11.916 1.00 0.00 H new ATOM 1597 N ALA B 58 8.665 13.384 -8.302 1.00 0.00 N ATOM 1598 CA ALA B 58 9.498 14.490 -7.839 1.00 0.00 C ATOM 1599 C ALA B 58 8.807 15.829 -8.077 1.00 0.00 C ATOM 1600 O ALA B 58 9.417 16.774 -8.579 1.00 0.00 O ATOM 1601 CB ALA B 58 10.844 14.465 -8.564 1.00 0.00 C ATOM 0 H ALA B 58 8.688 12.559 -7.703 1.00 0.00 H new ATOM 0 HA ALA B 58 9.660 14.373 -6.768 1.00 0.00 H new ATOM 0 HB1 ALA B 58 11.461 15.293 -8.214 1.00 0.00 H new ATOM 0 HB2 ALA B 58 11.351 13.522 -8.358 1.00 0.00 H new ATOM 0 HB3 ALA B 58 10.681 14.562 -9.637 1.00 0.00 H new ATOM 1607 N GLY B 59 7.530 15.903 -7.716 1.00 0.00 N ATOM 1608 CA GLY B 59 6.764 17.132 -7.897 1.00 0.00 C ATOM 1609 C GLY B 59 7.366 18.283 -7.098 1.00 0.00 C ATOM 1610 O GLY B 59 7.433 19.415 -7.578 1.00 0.00 O ATOM 0 H GLY B 59 7.006 15.133 -7.299 1.00 0.00 H new ATOM 0 HA2 GLY B 59 6.739 17.395 -8.955 1.00 0.00 H new ATOM 0 HA3 GLY B 59 5.733 16.970 -7.584 1.00 0.00 H new ATOM 1614 N SER B 60 7.800 17.991 -5.875 1.00 0.00 N ATOM 1615 CA SER B 60 8.390 19.019 -5.022 1.00 0.00 C ATOM 1616 C SER B 60 9.431 18.414 -4.085 1.00 0.00 C ATOM 1617 O SER B 60 9.263 17.299 -3.591 1.00 0.00 O ATOM 1618 CB SER B 60 7.299 19.704 -4.200 1.00 0.00 C ATOM 1619 OG SER B 60 7.889 20.696 -3.371 1.00 0.00 O ATOM 0 H SER B 60 7.756 17.062 -5.456 1.00 0.00 H new ATOM 0 HA SER B 60 8.880 19.753 -5.661 1.00 0.00 H new ATOM 0 HB2 SER B 60 6.561 20.158 -4.861 1.00 0.00 H new ATOM 0 HB3 SER B 60 6.772 18.970 -3.590 1.00 0.00 H new ATOM 0 HG SER B 60 7.192 21.139 -2.844 1.00 0.00 H new ATOM 1625 N GLN B 61 10.503 19.161 -3.842 1.00 0.00 N ATOM 1626 CA GLN B 61 11.567 18.693 -2.960 1.00 0.00 C ATOM 1627 C GLN B 61 11.188 18.917 -1.499 1.00 0.00 C ATOM 1628 O GLN B 61 10.506 19.887 -1.167 1.00 0.00 O ATOM 1629 CB GLN B 61 12.867 19.437 -3.270 1.00 0.00 C ATOM 1630 CG GLN B 61 13.391 19.001 -4.640 1.00 0.00 C ATOM 1631 CD GLN B 61 14.566 19.880 -5.053 1.00 0.00 C ATOM 1632 OE1 GLN B 61 14.638 21.046 -4.663 1.00 0.00 O ATOM 1633 NE2 GLN B 61 15.498 19.389 -5.825 1.00 0.00 N ATOM 0 H GLN B 61 10.658 20.087 -4.240 1.00 0.00 H new ATOM 0 HA GLN B 61 11.710 17.626 -3.128 1.00 0.00 H new ATOM 0 HB2 GLN B 61 12.694 20.513 -3.261 1.00 0.00 H new ATOM 0 HB3 GLN B 61 13.611 19.227 -2.501 1.00 0.00 H new ATOM 0 HG2 GLN B 61 13.702 17.957 -4.604 1.00 0.00 H new ATOM 0 HG3 GLN B 61 12.595 19.071 -5.382 1.00 0.00 H new ATOM 0 HE21 GLN B 61 15.437 18.423 -6.147 1.00 0.00 H new ATOM 0 HE22 GLN B 61 16.287 19.971 -6.106 1.00 0.00 H new ATOM 1642 N SER B 62 11.635 18.016 -0.630 1.00 0.00 N ATOM 1643 CA SER B 62 11.336 18.127 0.793 1.00 0.00 C ATOM 1644 C SER B 62 9.831 18.211 1.020 1.00 0.00 C ATOM 1645 O SER B 62 9.419 18.128 2.165 1.00 0.00 O ATOM 1646 CB SER B 62 12.012 19.370 1.373 1.00 0.00 C ATOM 1647 OG SER B 62 12.107 19.237 2.785 1.00 0.00 O ATOM 1648 OXT SER B 62 9.112 18.357 0.046 1.00 0.00 O ATOM 0 H SER B 62 12.201 17.207 -0.884 1.00 0.00 H new ATOM 0 HA SER B 62 11.718 17.238 1.295 1.00 0.00 H new ATOM 0 HB2 SER B 62 13.005 19.494 0.940 1.00 0.00 H new ATOM 0 HB3 SER B 62 11.440 20.262 1.118 1.00 0.00 H new ATOM 0 HG SER B 62 11.291 18.818 3.130 1.00 0.00 H new TER 1654 SER B 62