USER MOD reduce.3.24.130724 H: found=0, std=0, add=1419, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1415 hydrogens (21 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 120 THR OG1 : rot -170:sc= 1.36 USER MOD Set 1.2: A 134 SER OG : rot -97:sc= 1.21 USER MOD Set 2.1: A 92 HIS : no HE2:sc= -1.06 K(o=-2,f=-4.3) USER MOD Set 2.2: A 94 MET CE :methyl -167:sc= -0.913 (180deg=-1.15) USER MOD Set 3.1: A 33 GLN : amide:sc= 0.441 K(o=2.1,f=-2) USER MOD Set 3.2: A 153 LYS NZ :NH3+ -161:sc= 1.68 (180deg=0.554) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 154:sc= 0.687 (180deg=0.346) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 4 LYS NZ :NH3+ -175:sc= 0.522 (180deg=0.508) USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 12 THR OG1 : rot 75:sc= 0.589 USER MOD Single : A 13 MET CE :methyl 149:sc= 0 (180deg=-0.576) USER MOD Single : A 18 GLN : amide:sc= 1.01 K(o=1,f=0) USER MOD Single : A 20 MET CE :methyl -177:sc= 0 (180deg=-0.0337) USER MOD Single : A 22 THR OG1 : rot 180:sc= -0.0253 USER MOD Single : A 27 TYR OH : rot 180:sc= 0 USER MOD Single : A 28 HIS : no HD1:sc= -0.258 X(o=-0.26,f=-0.0036) USER MOD Single : A 35 GLN : amide:sc= -0.449 X(o=-0.45,f=-0.76) USER MOD Single : A 36 GLN : amide:sc= -0.158 X(o=-0.16,f=-0.16) USER MOD Single : A 39 TYR OH : rot 30:sc= 0 USER MOD Single : A 41 TYR OH : rot 180:sc= 0 USER MOD Single : A 42 TYR OH : rot 167:sc= -0.409 USER MOD Single : A 43 SER OG : rot 150:sc= 0 USER MOD Single : A 45 CYS SG : rot 23:sc= 0.21 USER MOD Single : A 48 HIS : no HE2:sc= -0.0196 K(o=-0.02,f=-7.9!) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 LYS NZ :NH3+ 166:sc= 1.27 (180deg=1.18) USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 61 THR OG1 : rot -147:sc= 1.44 USER MOD Single : A 62 ASN : amide:sc= 1.1 K(o=1.1,f=-0.038) USER MOD Single : A 63 TYR OH : rot 150:sc= 0 USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 70 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 TYR OH : rot -176:sc= 1.28 USER MOD Single : A 72 GLN : amide:sc= -0.1 X(o=-0.1,f=0) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 84 ASN : amide:sc= 0.955 K(o=0.95,f=0) USER MOD Single : A 87 ASN : amide:sc= -0.0449 K(o=-0.045,f=-3.4!) USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 90 GLN : amide:sc= -0.0265 K(o=-0.026,f=-0.78) USER MOD Single : A 96 ASN : amide:sc= 0 X(o=0,f=-0.0035) USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 104 GLN : amide:sc= 1 K(o=1,f=0) USER MOD Single : A 113 HIS : no HE2:sc= 0.515 K(o=0.51,f=-2.7!) USER MOD Single : A 121 GLN : amide:sc= 0.442 K(o=0.44,f=-3.9!) USER MOD Single : A 122 TYR OH : rot 180:sc= 0 USER MOD Single : A 124 MET CE :methyl -150:sc= -0.159 (180deg=-1.54!) USER MOD Single : A 136 SER OG : rot -81:sc= 0.521 USER MOD Single : A 138 CYS SG : rot -67:sc= 0.175 USER MOD Single : A 139 SER OG : rot 180:sc= 0 USER MOD Single : A 147 SER OG : rot 74:sc= 0.292 USER MOD Single : A 151 GLN : amide:sc= 0 X(o=0,f=0.18) USER MOD Single : A 154 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 155 GLN : amide:sc= 0 X(o=0,f=-0.1) USER MOD Single : A 161 SER OG : rot -170:sc= -0.0032 USER MOD Single : A 163 MET CE :methyl -148:sc= -0.0337 (180deg=-1.83) USER MOD Single : A 166 MET CE :methyl -165:sc= -0.594 (180deg=-1.18) USER MOD Single : A 169 ASN : amide:sc= 0.605 K(o=0.61,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 2.618 31.892 19.614 1.00 11.37 N ATOM 2 CA MET A 1 2.404 30.458 19.301 1.00 10.37 C ATOM 3 C MET A 1 2.218 30.263 17.797 1.00 8.85 C ATOM 4 O MET A 1 1.390 30.931 17.178 1.00 9.30 O ATOM 5 CB MET A 1 1.183 29.855 20.031 1.00 11.66 C ATOM 6 CG MET A 1 1.371 29.634 21.537 1.00 13.12 C ATOM 7 SD MET A 1 1.430 31.129 22.567 1.00 14.66 S ATOM 8 CE MET A 1 1.271 30.365 24.204 1.00 16.68 C ATOM 0 H1 MET A 1 2.311 32.084 20.589 1.00 11.37 H new ATOM 0 H2 MET A 1 3.628 32.122 19.517 1.00 11.37 H new ATOM 0 H3 MET A 1 2.065 32.477 18.956 1.00 11.37 H new ATOM 0 HA MET A 1 3.295 29.937 19.650 1.00 10.37 H new ATOM 0 HB2 MET A 1 0.327 30.513 19.880 1.00 11.66 H new ATOM 0 HB3 MET A 1 0.937 28.900 19.567 1.00 11.66 H new ATOM 0 HG2 MET A 1 0.557 29.004 21.895 1.00 13.12 H new ATOM 0 HG3 MET A 1 2.296 29.077 21.689 1.00 13.12 H new ATOM 0 HE1 MET A 1 1.288 31.140 24.970 1.00 16.68 H new ATOM 0 HE2 MET A 1 0.329 29.819 24.261 1.00 16.68 H new ATOM 0 HE3 MET A 1 2.100 29.676 24.366 1.00 16.68 H new ATOM 20 N SER A 2 2.944 29.310 17.221 1.00 7.47 N ATOM 21 CA SER A 2 2.676 28.714 15.904 1.00 6.27 C ATOM 22 C SER A 2 2.554 27.196 16.126 1.00 5.16 C ATOM 23 O SER A 2 1.634 26.756 16.818 1.00 6.12 O ATOM 24 CB SER A 2 3.771 29.129 14.901 1.00 6.65 C ATOM 25 OG SER A 2 3.742 30.531 14.655 1.00 7.59 O ATOM 0 H SER A 2 3.768 28.912 17.671 1.00 7.47 H new ATOM 0 HA SER A 2 1.747 29.070 15.459 1.00 6.27 H new ATOM 0 HB2 SER A 2 4.749 28.846 15.289 1.00 6.65 H new ATOM 0 HB3 SER A 2 3.632 28.590 13.964 1.00 6.65 H new ATOM 0 HG SER A 2 4.448 30.766 14.017 1.00 7.59 H new ATOM 31 N ASP A 3 3.513 26.397 15.642 1.00 3.80 N ATOM 32 CA ASP A 3 3.930 25.136 16.284 1.00 3.85 C ATOM 33 C ASP A 3 2.866 24.020 16.177 1.00 3.39 C ATOM 34 O ASP A 3 2.599 23.310 17.151 1.00 4.40 O ATOM 35 CB ASP A 3 4.356 25.399 17.749 1.00 5.33 C ATOM 36 CG ASP A 3 5.370 26.546 17.883 1.00 5.70 C ATOM 37 OD1 ASP A 3 6.559 26.338 17.545 1.00 5.94 O ATOM 38 OD2 ASP A 3 4.970 27.653 18.324 1.00 6.29 O ATOM 0 H ASP A 3 4.028 26.606 14.787 1.00 3.80 H new ATOM 0 HA ASP A 3 4.794 24.760 15.736 1.00 3.85 H new ATOM 0 HB2 ASP A 3 3.472 25.632 18.342 1.00 5.33 H new ATOM 0 HB3 ASP A 3 4.788 24.489 18.165 1.00 5.33 H new ATOM 43 N LYS A 4 2.195 23.906 15.020 1.00 2.26 N ATOM 44 CA LYS A 4 0.977 23.079 14.902 1.00 1.86 C ATOM 45 C LYS A 4 0.581 22.581 13.503 1.00 1.58 C ATOM 46 O LYS A 4 -0.318 21.747 13.424 1.00 1.44 O ATOM 47 CB LYS A 4 -0.199 23.844 15.557 1.00 1.84 C ATOM 48 CG LYS A 4 -0.814 23.050 16.721 1.00 2.57 C ATOM 49 CD LYS A 4 -1.578 23.930 17.724 1.00 2.68 C ATOM 50 CE LYS A 4 -0.725 25.029 18.385 1.00 3.21 C ATOM 51 NZ LYS A 4 0.523 24.506 19.004 1.00 3.93 N ATOM 0 H LYS A 4 2.471 24.372 14.156 1.00 2.26 H new ATOM 0 HA LYS A 4 1.222 22.151 15.420 1.00 1.86 H new ATOM 0 HB2 LYS A 4 0.152 24.810 15.920 1.00 1.84 H new ATOM 0 HB3 LYS A 4 -0.965 24.045 14.808 1.00 1.84 H new ATOM 0 HG2 LYS A 4 -1.492 22.297 16.319 1.00 2.57 H new ATOM 0 HG3 LYS A 4 -0.021 22.517 17.246 1.00 2.57 H new ATOM 0 HD2 LYS A 4 -2.418 24.398 17.211 1.00 2.68 H new ATOM 0 HD3 LYS A 4 -1.995 23.293 18.504 1.00 2.68 H new ATOM 0 HE2 LYS A 4 -0.466 25.779 17.637 1.00 3.21 H new ATOM 0 HE3 LYS A 4 -1.319 25.532 19.148 1.00 3.21 H new ATOM 0 HZ1 LYS A 4 1.011 25.276 19.505 1.00 3.93 H new ATOM 0 HZ2 LYS A 4 0.286 23.750 19.678 1.00 3.93 H new ATOM 0 HZ3 LYS A 4 1.145 24.126 18.263 1.00 3.93 H new ATOM 65 N ASP A 5 1.196 23.030 12.407 1.00 1.68 N ATOM 66 CA ASP A 5 0.708 22.726 11.047 1.00 1.58 C ATOM 67 C ASP A 5 0.704 21.219 10.721 1.00 1.42 C ATOM 68 O ASP A 5 -0.276 20.710 10.182 1.00 1.28 O ATOM 69 CB ASP A 5 1.544 23.510 10.027 1.00 1.87 C ATOM 70 CG ASP A 5 1.011 23.345 8.594 1.00 2.22 C ATOM 71 OD1 ASP A 5 -0.028 23.968 8.267 1.00 2.83 O ATOM 72 OD2 ASP A 5 1.644 22.615 7.796 1.00 2.79 O ATOM 0 H ASP A 5 2.036 23.608 12.428 1.00 1.68 H new ATOM 0 HA ASP A 5 -0.335 23.037 10.993 1.00 1.58 H new ATOM 0 HB2 ASP A 5 1.544 24.567 10.294 1.00 1.87 H new ATOM 0 HB3 ASP A 5 2.579 23.171 10.070 1.00 1.87 H new ATOM 77 N PHE A 6 1.760 20.495 11.109 1.00 1.48 N ATOM 78 CA PHE A 6 1.878 19.039 10.952 1.00 1.37 C ATOM 79 C PHE A 6 0.887 18.291 11.856 1.00 1.22 C ATOM 80 O PHE A 6 0.222 17.357 11.409 1.00 1.08 O ATOM 81 CB PHE A 6 3.334 18.627 11.243 1.00 1.52 C ATOM 82 CG PHE A 6 3.523 17.165 11.617 1.00 1.76 C ATOM 83 CD1 PHE A 6 3.425 16.156 10.638 1.00 2.57 C ATOM 84 CD2 PHE A 6 3.768 16.811 12.959 1.00 2.41 C ATOM 85 CE1 PHE A 6 3.574 14.805 11.000 1.00 3.39 C ATOM 86 CE2 PHE A 6 3.915 15.460 13.319 1.00 3.09 C ATOM 87 CZ PHE A 6 3.821 14.456 12.339 1.00 3.43 C ATOM 0 H PHE A 6 2.577 20.915 11.552 1.00 1.48 H new ATOM 0 HA PHE A 6 1.624 18.765 9.928 1.00 1.37 H new ATOM 0 HB2 PHE A 6 3.940 18.843 10.363 1.00 1.52 H new ATOM 0 HB3 PHE A 6 3.717 19.247 12.054 1.00 1.52 H new ATOM 0 HD1 PHE A 6 3.235 16.420 9.608 1.00 2.57 H new ATOM 0 HD2 PHE A 6 3.843 17.580 13.713 1.00 2.41 H new ATOM 0 HE1 PHE A 6 3.498 14.034 10.247 1.00 3.39 H new ATOM 0 HE2 PHE A 6 4.100 15.193 14.349 1.00 3.09 H new ATOM 0 HZ PHE A 6 3.938 13.418 12.615 1.00 3.43 H new ATOM 97 N PHE A 7 0.769 18.719 13.116 1.00 1.28 N ATOM 98 CA PHE A 7 -0.114 18.116 14.113 1.00 1.22 C ATOM 99 C PHE A 7 -1.583 18.302 13.724 1.00 1.12 C ATOM 100 O PHE A 7 -2.367 17.367 13.806 1.00 1.00 O ATOM 101 CB PHE A 7 0.181 18.756 15.481 1.00 1.38 C ATOM 102 CG PHE A 7 -0.805 18.387 16.577 1.00 1.41 C ATOM 103 CD1 PHE A 7 -0.609 17.231 17.356 1.00 2.50 C ATOM 104 CD2 PHE A 7 -1.928 19.204 16.813 1.00 1.70 C ATOM 105 CE1 PHE A 7 -1.529 16.901 18.369 1.00 2.62 C ATOM 106 CE2 PHE A 7 -2.848 18.873 17.824 1.00 1.67 C ATOM 107 CZ PHE A 7 -2.647 17.721 18.604 1.00 1.57 C ATOM 0 H PHE A 7 1.298 19.513 13.478 1.00 1.28 H new ATOM 0 HA PHE A 7 0.071 17.043 14.166 1.00 1.22 H new ATOM 0 HB2 PHE A 7 1.182 18.462 15.797 1.00 1.38 H new ATOM 0 HB3 PHE A 7 0.188 19.840 15.367 1.00 1.38 H new ATOM 0 HD1 PHE A 7 0.247 16.597 17.176 1.00 2.50 H new ATOM 0 HD2 PHE A 7 -2.083 20.089 16.214 1.00 1.70 H new ATOM 0 HE1 PHE A 7 -1.376 16.015 18.968 1.00 2.62 H new ATOM 0 HE2 PHE A 7 -3.707 19.503 18.001 1.00 1.67 H new ATOM 0 HZ PHE A 7 -3.350 17.466 19.383 1.00 1.57 H new ATOM 117 N SER A 8 -1.953 19.504 13.290 1.00 1.19 N ATOM 118 CA SER A 8 -3.314 19.855 12.873 1.00 1.12 C ATOM 119 C SER A 8 -3.706 19.163 11.559 1.00 0.98 C ATOM 120 O SER A 8 -4.820 18.651 11.428 1.00 0.86 O ATOM 121 CB SER A 8 -3.416 21.381 12.751 1.00 1.30 C ATOM 122 OG SER A 8 -4.763 21.794 12.573 1.00 1.27 O ATOM 0 H SER A 8 -1.300 20.284 13.215 1.00 1.19 H new ATOM 0 HA SER A 8 -4.017 19.502 13.627 1.00 1.12 H new ATOM 0 HB2 SER A 8 -3.005 21.848 13.646 1.00 1.30 H new ATOM 0 HB3 SER A 8 -2.814 21.722 11.909 1.00 1.30 H new ATOM 0 HG SER A 8 -4.799 22.771 12.500 1.00 1.27 H new ATOM 128 N TRP A 9 -2.769 19.057 10.606 1.00 1.01 N ATOM 129 CA TRP A 9 -2.961 18.300 9.364 1.00 0.96 C ATOM 130 C TRP A 9 -3.177 16.815 9.671 1.00 0.79 C ATOM 131 O TRP A 9 -4.131 16.205 9.183 1.00 0.72 O ATOM 132 CB TRP A 9 -1.741 18.500 8.452 1.00 1.09 C ATOM 133 CG TRP A 9 -1.753 17.708 7.180 1.00 1.12 C ATOM 134 CD1 TRP A 9 -2.352 18.087 6.029 1.00 1.99 C ATOM 135 CD2 TRP A 9 -1.152 16.401 6.904 1.00 2.06 C ATOM 136 NE1 TRP A 9 -2.161 17.119 5.062 1.00 1.60 N ATOM 137 CE2 TRP A 9 -1.439 16.050 5.550 1.00 1.59 C ATOM 138 CE3 TRP A 9 -0.393 15.477 7.657 1.00 3.95 C ATOM 139 CZ2 TRP A 9 -1.015 14.840 4.978 1.00 2.66 C ATOM 140 CZ3 TRP A 9 0.047 14.264 7.091 1.00 5.23 C ATOM 141 CH2 TRP A 9 -0.271 13.940 5.759 1.00 4.56 C ATOM 0 H TRP A 9 -1.852 19.497 10.677 1.00 1.01 H new ATOM 0 HA TRP A 9 -3.850 18.667 8.850 1.00 0.96 H new ATOM 0 HB2 TRP A 9 -1.666 19.558 8.201 1.00 1.09 H new ATOM 0 HB3 TRP A 9 -0.843 18.241 9.013 1.00 1.09 H new ATOM 0 HD1 TRP A 9 -2.898 19.008 5.887 1.00 1.99 H new ATOM 0 HE1 TRP A 9 -2.510 17.186 4.106 1.00 1.60 H new ATOM 0 HE3 TRP A 9 -0.146 15.704 8.684 1.00 3.95 H new ATOM 0 HZ2 TRP A 9 -1.257 14.604 3.952 1.00 2.66 H new ATOM 0 HZ3 TRP A 9 0.633 13.577 7.684 1.00 5.23 H new ATOM 0 HH2 TRP A 9 0.056 13.001 5.338 1.00 4.56 H new ATOM 152 N ARG A 10 -2.347 16.254 10.559 1.00 0.76 N ATOM 153 CA ARG A 10 -2.470 14.869 11.016 1.00 0.65 C ATOM 154 C ARG A 10 -3.788 14.660 11.768 1.00 0.59 C ATOM 155 O ARG A 10 -4.475 13.679 11.504 1.00 0.55 O ATOM 156 CB ARG A 10 -1.233 14.473 11.839 1.00 0.69 C ATOM 157 CG ARG A 10 -1.213 12.971 12.182 1.00 0.79 C ATOM 158 CD ARG A 10 -1.563 12.653 13.641 1.00 1.90 C ATOM 159 NE ARG A 10 -0.464 13.034 14.548 1.00 2.03 N ATOM 160 CZ ARG A 10 -0.370 12.749 15.842 1.00 2.72 C ATOM 161 NH1 ARG A 10 -1.307 12.082 16.483 1.00 3.78 N ATOM 162 NH2 ARG A 10 0.692 13.132 16.516 1.00 3.53 N ATOM 0 H ARG A 10 -1.566 16.755 10.982 1.00 0.76 H new ATOM 0 HA ARG A 10 -2.504 14.202 10.154 1.00 0.65 H new ATOM 0 HB2 ARG A 10 -0.332 14.728 11.281 1.00 0.69 H new ATOM 0 HB3 ARG A 10 -1.212 15.054 12.761 1.00 0.69 H new ATOM 0 HG2 ARG A 10 -1.916 12.452 11.530 1.00 0.79 H new ATOM 0 HG3 ARG A 10 -0.222 12.573 11.963 1.00 0.79 H new ATOM 0 HD2 ARG A 10 -2.472 13.184 13.924 1.00 1.90 H new ATOM 0 HD3 ARG A 10 -1.771 11.588 13.744 1.00 1.90 H new ATOM 0 HE ARG A 10 0.301 13.571 14.140 1.00 2.03 H new ATOM 0 HH11 ARG A 10 -2.139 11.766 15.985 1.00 3.78 H new ATOM 0 HH12 ARG A 10 -1.201 11.881 17.477 1.00 3.78 H new ATOM 0 HH21 ARG A 10 1.437 13.645 16.045 1.00 3.53 H new ATOM 0 HH22 ARG A 10 0.770 12.916 17.510 1.00 3.53 H new ATOM 176 N ARG A 11 -4.191 15.599 12.634 1.00 0.64 N ATOM 177 CA ARG A 11 -5.464 15.574 13.371 1.00 0.64 C ATOM 178 C ARG A 11 -6.671 15.606 12.422 1.00 0.58 C ATOM 179 O ARG A 11 -7.604 14.824 12.605 1.00 0.58 O ATOM 180 CB ARG A 11 -5.523 16.743 14.377 1.00 0.79 C ATOM 181 CG ARG A 11 -6.755 16.613 15.282 1.00 1.16 C ATOM 182 CD ARG A 11 -6.925 17.755 16.288 1.00 1.77 C ATOM 183 NE ARG A 11 -8.181 17.569 17.041 1.00 2.12 N ATOM 184 CZ ARG A 11 -8.627 18.303 18.054 1.00 2.85 C ATOM 185 NH1 ARG A 11 -7.950 19.326 18.530 1.00 3.93 N ATOM 186 NH2 ARG A 11 -9.784 18.009 18.609 1.00 3.21 N ATOM 0 H ARG A 11 -3.626 16.421 12.848 1.00 0.64 H new ATOM 0 HA ARG A 11 -5.513 14.635 13.922 1.00 0.64 H new ATOM 0 HB2 ARG A 11 -4.618 16.754 14.984 1.00 0.79 H new ATOM 0 HB3 ARG A 11 -5.558 17.691 13.840 1.00 0.79 H new ATOM 0 HG2 ARG A 11 -7.646 16.561 14.657 1.00 1.16 H new ATOM 0 HG3 ARG A 11 -6.692 15.671 15.827 1.00 1.16 H new ATOM 0 HD2 ARG A 11 -6.078 17.778 16.974 1.00 1.77 H new ATOM 0 HD3 ARG A 11 -6.940 18.713 15.767 1.00 1.77 H new ATOM 0 HE ARG A 11 -8.772 16.790 16.751 1.00 2.12 H new ATOM 0 HH11 ARG A 11 -7.051 19.578 18.119 1.00 3.93 H new ATOM 0 HH12 ARG A 11 -8.324 19.867 19.309 1.00 3.93 H new ATOM 0 HH21 ARG A 11 -10.331 17.222 18.261 1.00 3.21 H new ATOM 0 HH22 ARG A 11 -10.133 18.568 19.387 1.00 3.21 H new ATOM 200 N THR A 12 -6.634 16.454 11.385 1.00 0.59 N ATOM 201 CA THR A 12 -7.677 16.546 10.344 1.00 0.60 C ATOM 202 C THR A 12 -7.820 15.221 9.617 1.00 0.57 C ATOM 203 O THR A 12 -8.935 14.742 9.430 1.00 0.60 O ATOM 204 CB THR A 12 -7.366 17.680 9.357 1.00 0.69 C ATOM 205 OG1 THR A 12 -7.399 18.901 10.062 1.00 0.75 O ATOM 206 CG2 THR A 12 -8.390 17.759 8.219 1.00 0.75 C ATOM 0 H THR A 12 -5.866 17.109 11.240 1.00 0.59 H new ATOM 0 HA THR A 12 -8.626 16.775 10.829 1.00 0.60 H new ATOM 0 HB THR A 12 -6.387 17.484 8.919 1.00 0.69 H new ATOM 0 HG1 THR A 12 -6.591 18.985 10.610 1.00 0.75 H new ATOM 0 HG21 THR A 12 -8.126 18.577 7.548 1.00 0.75 H new ATOM 0 HG22 THR A 12 -8.391 16.821 7.665 1.00 0.75 H new ATOM 0 HG23 THR A 12 -9.382 17.936 8.634 1.00 0.75 H new ATOM 214 N MET A 13 -6.698 14.594 9.264 1.00 0.54 N ATOM 215 CA MET A 13 -6.698 13.267 8.650 1.00 0.53 C ATOM 216 C MET A 13 -7.223 12.202 9.619 1.00 0.49 C ATOM 217 O MET A 13 -8.089 11.430 9.229 1.00 0.52 O ATOM 218 CB MET A 13 -5.306 12.935 8.079 1.00 0.55 C ATOM 219 CG MET A 13 -5.365 12.708 6.560 1.00 0.80 C ATOM 220 SD MET A 13 -6.100 14.018 5.533 1.00 1.09 S ATOM 221 CE MET A 13 -5.071 15.428 5.999 1.00 1.69 C ATOM 0 H MET A 13 -5.767 14.990 9.395 1.00 0.54 H new ATOM 0 HA MET A 13 -7.391 13.270 7.808 1.00 0.53 H new ATOM 0 HB2 MET A 13 -4.616 13.749 8.301 1.00 0.55 H new ATOM 0 HB3 MET A 13 -4.914 12.043 8.567 1.00 0.55 H new ATOM 0 HG2 MET A 13 -4.348 12.537 6.207 1.00 0.80 H new ATOM 0 HG3 MET A 13 -5.923 11.789 6.380 1.00 0.80 H new ATOM 0 HE1 MET A 13 -4.984 16.110 5.153 1.00 1.69 H new ATOM 0 HE2 MET A 13 -5.528 15.950 6.840 1.00 1.69 H new ATOM 0 HE3 MET A 13 -4.080 15.076 6.285 1.00 1.69 H new ATOM 231 N LEU A 14 -6.801 12.198 10.888 1.00 0.49 N ATOM 232 CA LEU A 14 -7.270 11.246 11.911 1.00 0.54 C ATOM 233 C LEU A 14 -8.793 11.327 12.086 1.00 0.55 C ATOM 234 O LEU A 14 -9.473 10.302 12.139 1.00 0.60 O ATOM 235 CB LEU A 14 -6.529 11.501 13.247 1.00 0.62 C ATOM 236 CG LEU A 14 -5.946 10.224 13.883 1.00 0.94 C ATOM 237 CD1 LEU A 14 -5.066 10.565 15.093 1.00 1.98 C ATOM 238 CD2 LEU A 14 -7.013 9.207 14.303 1.00 2.22 C ATOM 0 H LEU A 14 -6.114 12.864 11.242 1.00 0.49 H new ATOM 0 HA LEU A 14 -7.041 10.233 11.580 1.00 0.54 H new ATOM 0 HB2 LEU A 14 -5.721 12.212 13.075 1.00 0.62 H new ATOM 0 HB3 LEU A 14 -7.218 11.966 13.952 1.00 0.62 H new ATOM 0 HG LEU A 14 -5.344 9.759 13.102 1.00 0.94 H new ATOM 0 HD11 LEU A 14 -4.667 9.646 15.523 1.00 1.98 H new ATOM 0 HD12 LEU A 14 -4.242 11.204 14.775 1.00 1.98 H new ATOM 0 HD13 LEU A 14 -5.663 11.087 15.841 1.00 1.98 H new ATOM 0 HD21 LEU A 14 -6.531 8.334 14.743 1.00 2.22 H new ATOM 0 HD22 LEU A 14 -7.680 9.661 15.036 1.00 2.22 H new ATOM 0 HD23 LEU A 14 -7.589 8.902 13.429 1.00 2.22 H new ATOM 250 N LEU A 15 -9.335 12.550 12.099 1.00 0.53 N ATOM 251 CA LEU A 15 -10.772 12.814 12.154 1.00 0.57 C ATOM 252 C LEU A 15 -11.453 12.279 10.890 1.00 0.59 C ATOM 253 O LEU A 15 -12.404 11.514 11.020 1.00 0.65 O ATOM 254 CB LEU A 15 -10.970 14.329 12.388 1.00 0.59 C ATOM 255 CG LEU A 15 -12.367 14.811 12.837 1.00 0.72 C ATOM 256 CD1 LEU A 15 -13.444 14.625 11.764 1.00 0.84 C ATOM 257 CD2 LEU A 15 -12.826 14.148 14.143 1.00 0.81 C ATOM 0 H LEU A 15 -8.772 13.400 12.071 1.00 0.53 H new ATOM 0 HA LEU A 15 -11.250 12.290 12.982 1.00 0.57 H new ATOM 0 HB2 LEU A 15 -10.248 14.649 13.139 1.00 0.59 H new ATOM 0 HB3 LEU A 15 -10.718 14.847 11.462 1.00 0.59 H new ATOM 0 HG LEU A 15 -12.246 15.880 13.010 1.00 0.72 H new ATOM 0 HD11 LEU A 15 -14.401 14.983 12.143 1.00 0.84 H new ATOM 0 HD12 LEU A 15 -13.172 15.191 10.873 1.00 0.84 H new ATOM 0 HD13 LEU A 15 -13.527 13.568 11.511 1.00 0.84 H new ATOM 0 HD21 LEU A 15 -13.813 14.522 14.413 1.00 0.81 H new ATOM 0 HD22 LEU A 15 -12.872 13.068 14.006 1.00 0.81 H new ATOM 0 HD23 LEU A 15 -12.119 14.383 14.938 1.00 0.81 H new ATOM 269 N ARG A 16 -10.916 12.546 9.691 1.00 0.58 N ATOM 270 CA ARG A 16 -11.443 12.024 8.415 1.00 0.66 C ATOM 271 C ARG A 16 -11.467 10.489 8.398 1.00 0.67 C ATOM 272 O ARG A 16 -12.483 9.889 8.048 1.00 0.74 O ATOM 273 CB ARG A 16 -10.589 12.527 7.239 1.00 0.69 C ATOM 274 CG ARG A 16 -10.869 13.981 6.834 1.00 0.81 C ATOM 275 CD ARG A 16 -9.673 14.519 6.037 1.00 1.00 C ATOM 276 NE ARG A 16 -10.040 15.647 5.165 1.00 1.79 N ATOM 277 CZ ARG A 16 -10.102 15.630 3.835 1.00 2.15 C ATOM 278 NH1 ARG A 16 -9.944 14.534 3.123 1.00 3.04 N ATOM 279 NH2 ARG A 16 -10.332 16.750 3.185 1.00 3.12 N ATOM 0 H ARG A 16 -10.093 13.138 9.575 1.00 0.58 H new ATOM 0 HA ARG A 16 -12.465 12.388 8.314 1.00 0.66 H new ATOM 0 HB2 ARG A 16 -9.536 12.432 7.503 1.00 0.69 H new ATOM 0 HB3 ARG A 16 -10.762 11.882 6.377 1.00 0.69 H new ATOM 0 HG2 ARG A 16 -11.777 14.036 6.233 1.00 0.81 H new ATOM 0 HG3 ARG A 16 -11.036 14.593 7.720 1.00 0.81 H new ATOM 0 HD2 ARG A 16 -8.893 14.837 6.729 1.00 1.00 H new ATOM 0 HD3 ARG A 16 -9.254 13.716 5.431 1.00 1.00 H new ATOM 0 HE ARG A 16 -10.269 16.528 5.625 1.00 1.79 H new ATOM 0 HH11 ARG A 16 -9.765 13.645 3.589 1.00 3.04 H new ATOM 0 HH12 ARG A 16 -10.001 14.574 2.105 1.00 3.04 H new ATOM 0 HH21 ARG A 16 -10.461 17.621 3.700 1.00 3.12 H new ATOM 0 HH22 ARG A 16 -10.381 16.747 2.166 1.00 3.12 H new ATOM 293 N PHE A 17 -10.382 9.847 8.831 1.00 0.63 N ATOM 294 CA PHE A 17 -10.241 8.392 8.889 1.00 0.68 C ATOM 295 C PHE A 17 -11.192 7.746 9.906 1.00 0.74 C ATOM 296 O PHE A 17 -11.715 6.666 9.638 1.00 0.82 O ATOM 297 CB PHE A 17 -8.772 8.039 9.160 1.00 0.64 C ATOM 298 CG PHE A 17 -7.860 8.235 7.961 1.00 0.66 C ATOM 299 CD1 PHE A 17 -8.094 7.505 6.781 1.00 1.61 C ATOM 300 CD2 PHE A 17 -6.735 9.079 8.036 1.00 1.83 C ATOM 301 CE1 PHE A 17 -7.220 7.628 5.690 1.00 1.59 C ATOM 302 CE2 PHE A 17 -5.843 9.187 6.955 1.00 1.92 C ATOM 303 CZ PHE A 17 -6.094 8.469 5.772 1.00 0.83 C ATOM 0 H PHE A 17 -9.552 10.340 9.161 1.00 0.63 H new ATOM 0 HA PHE A 17 -10.532 7.977 7.924 1.00 0.68 H new ATOM 0 HB2 PHE A 17 -8.408 8.651 9.985 1.00 0.64 H new ATOM 0 HB3 PHE A 17 -8.712 7.000 9.484 1.00 0.64 H new ATOM 0 HD1 PHE A 17 -8.949 6.848 6.715 1.00 1.61 H new ATOM 0 HD2 PHE A 17 -6.555 9.650 8.935 1.00 1.83 H new ATOM 0 HE1 PHE A 17 -7.412 7.075 4.783 1.00 1.59 H new ATOM 0 HE2 PHE A 17 -4.970 9.818 7.032 1.00 1.92 H new ATOM 0 HZ PHE A 17 -5.425 8.563 4.929 1.00 0.83 H new ATOM 313 N GLN A 18 -11.477 8.412 11.031 1.00 0.72 N ATOM 314 CA GLN A 18 -12.508 7.960 11.974 1.00 0.80 C ATOM 315 C GLN A 18 -13.933 8.277 11.470 1.00 0.82 C ATOM 316 O GLN A 18 -14.882 7.605 11.876 1.00 0.94 O ATOM 317 CB GLN A 18 -12.219 8.552 13.371 1.00 0.81 C ATOM 318 CG GLN A 18 -12.507 7.585 14.540 1.00 1.22 C ATOM 319 CD GLN A 18 -13.810 7.854 15.302 1.00 1.94 C ATOM 320 OE1 GLN A 18 -13.810 8.184 16.482 1.00 2.37 O ATOM 321 NE2 GLN A 18 -14.967 7.719 14.690 1.00 3.36 N ATOM 0 H GLN A 18 -11.005 9.271 11.312 1.00 0.72 H new ATOM 0 HA GLN A 18 -12.467 6.874 12.052 1.00 0.80 H new ATOM 0 HB2 GLN A 18 -11.173 8.856 13.415 1.00 0.81 H new ATOM 0 HB3 GLN A 18 -12.819 9.453 13.503 1.00 0.81 H new ATOM 0 HG2 GLN A 18 -12.536 6.567 14.150 1.00 1.22 H new ATOM 0 HG3 GLN A 18 -11.676 7.633 15.244 1.00 1.22 H new ATOM 0 HE21 GLN A 18 -14.996 7.445 13.708 1.00 3.36 H new ATOM 0 HE22 GLN A 18 -15.835 7.888 15.198 1.00 3.36 H new ATOM 330 N ARG A 19 -14.096 9.249 10.559 1.00 0.78 N ATOM 331 CA ARG A 19 -15.386 9.654 9.983 1.00 0.87 C ATOM 332 C ARG A 19 -15.948 8.636 8.977 1.00 0.91 C ATOM 333 O ARG A 19 -17.163 8.613 8.766 1.00 1.02 O ATOM 334 CB ARG A 19 -15.247 11.035 9.298 1.00 0.94 C ATOM 335 CG ARG A 19 -16.531 11.875 9.350 1.00 1.29 C ATOM 336 CD ARG A 19 -16.788 12.410 10.769 1.00 1.10 C ATOM 337 NE ARG A 19 -18.194 12.804 10.969 1.00 1.66 N ATOM 338 CZ ARG A 19 -19.223 11.985 11.171 1.00 2.25 C ATOM 339 NH1 ARG A 19 -19.112 10.674 11.083 1.00 2.89 N ATOM 340 NH2 ARG A 19 -20.402 12.483 11.471 1.00 2.83 N ATOM 0 H ARG A 19 -13.312 9.789 10.193 1.00 0.78 H new ATOM 0 HA ARG A 19 -16.093 9.707 10.811 1.00 0.87 H new ATOM 0 HB2 ARG A 19 -14.440 11.590 9.776 1.00 0.94 H new ATOM 0 HB3 ARG A 19 -14.960 10.888 8.257 1.00 0.94 H new ATOM 0 HG2 ARG A 19 -16.452 12.709 8.653 1.00 1.29 H new ATOM 0 HG3 ARG A 19 -17.378 11.270 9.028 1.00 1.29 H new ATOM 0 HD2 ARG A 19 -16.519 11.645 11.498 1.00 1.10 H new ATOM 0 HD3 ARG A 19 -16.142 13.268 10.955 1.00 1.10 H new ATOM 0 HE ARG A 19 -18.398 13.803 10.951 1.00 1.66 H new ATOM 0 HH11 ARG A 19 -18.212 10.253 10.853 1.00 2.89 H new ATOM 0 HH12 ARG A 19 -19.926 10.081 11.245 1.00 2.89 H new ATOM 0 HH21 ARG A 19 -20.525 13.493 11.548 1.00 2.83 H new ATOM 0 HH22 ARG A 19 -21.194 11.860 11.627 1.00 2.83 H new ATOM 354 N MET A 20 -15.090 7.813 8.359 1.00 0.87 N ATOM 355 CA MET A 20 -15.462 6.837 7.324 1.00 0.91 C ATOM 356 C MET A 20 -16.576 5.893 7.792 1.00 1.07 C ATOM 357 O MET A 20 -16.453 5.253 8.839 1.00 1.96 O ATOM 358 CB MET A 20 -14.241 6.012 6.880 1.00 0.84 C ATOM 359 CG MET A 20 -13.052 6.864 6.428 1.00 0.78 C ATOM 360 SD MET A 20 -13.410 8.145 5.205 1.00 1.04 S ATOM 361 CE MET A 20 -11.716 8.712 4.954 1.00 0.72 C ATOM 0 H MET A 20 -14.092 7.807 8.570 1.00 0.87 H new ATOM 0 HA MET A 20 -15.838 7.411 6.477 1.00 0.91 H new ATOM 0 HB2 MET A 20 -13.926 5.374 7.705 1.00 0.84 H new ATOM 0 HB3 MET A 20 -14.536 5.354 6.063 1.00 0.84 H new ATOM 0 HG2 MET A 20 -12.618 7.341 7.307 1.00 0.78 H new ATOM 0 HG3 MET A 20 -12.291 6.200 6.017 1.00 0.78 H new ATOM 0 HE1 MET A 20 -11.713 9.554 4.261 1.00 0.72 H new ATOM 0 HE2 MET A 20 -11.292 9.026 5.908 1.00 0.72 H new ATOM 0 HE3 MET A 20 -11.118 7.900 4.541 1.00 0.72 H new ATOM 371 N GLU A 21 -17.653 5.795 7.012 1.00 1.35 N ATOM 372 CA GLU A 21 -18.807 4.942 7.333 1.00 1.46 C ATOM 373 C GLU A 21 -18.685 3.537 6.721 1.00 1.41 C ATOM 374 O GLU A 21 -19.287 2.589 7.234 1.00 1.38 O ATOM 375 CB GLU A 21 -20.103 5.629 6.869 1.00 1.63 C ATOM 376 CG GLU A 21 -21.339 5.062 7.584 1.00 2.09 C ATOM 377 CD GLU A 21 -22.571 5.951 7.365 1.00 2.60 C ATOM 378 OE1 GLU A 21 -23.273 5.782 6.338 1.00 3.92 O ATOM 379 OE2 GLU A 21 -22.859 6.816 8.225 1.00 2.39 O ATOM 0 H GLU A 21 -17.754 6.306 6.135 1.00 1.35 H new ATOM 0 HA GLU A 21 -18.833 4.809 8.415 1.00 1.46 H new ATOM 0 HB2 GLU A 21 -20.034 6.700 7.058 1.00 1.63 H new ATOM 0 HB3 GLU A 21 -20.216 5.502 5.792 1.00 1.63 H new ATOM 0 HG2 GLU A 21 -21.544 4.057 7.216 1.00 2.09 H new ATOM 0 HG3 GLU A 21 -21.136 4.976 8.651 1.00 2.09 H new ATOM 386 N THR A 22 -17.896 3.395 5.644 1.00 1.45 N ATOM 387 CA THR A 22 -17.690 2.136 4.916 1.00 1.48 C ATOM 388 C THR A 22 -16.211 1.872 4.683 1.00 1.38 C ATOM 389 O THR A 22 -15.404 2.800 4.589 1.00 1.25 O ATOM 390 CB THR A 22 -18.449 2.114 3.582 1.00 1.54 C ATOM 391 OG1 THR A 22 -17.931 3.079 2.699 1.00 1.52 O ATOM 392 CG2 THR A 22 -19.942 2.371 3.765 1.00 1.62 C ATOM 0 H THR A 22 -17.371 4.174 5.246 1.00 1.45 H new ATOM 0 HA THR A 22 -18.092 1.340 5.543 1.00 1.48 H new ATOM 0 HB THR A 22 -18.316 1.115 3.166 1.00 1.54 H new ATOM 0 HG1 THR A 22 -18.426 3.049 1.854 1.00 1.52 H new ATOM 0 HG21 THR A 22 -20.437 2.346 2.794 1.00 1.62 H new ATOM 0 HG22 THR A 22 -20.367 1.602 4.409 1.00 1.62 H new ATOM 0 HG23 THR A 22 -20.089 3.349 4.222 1.00 1.62 H new ATOM 400 N ALA A 23 -15.863 0.591 4.570 1.00 1.43 N ATOM 401 CA ALA A 23 -14.503 0.113 4.320 1.00 1.28 C ATOM 402 C ALA A 23 -13.895 0.799 3.099 1.00 1.11 C ATOM 403 O ALA A 23 -12.794 1.346 3.145 1.00 1.14 O ATOM 404 CB ALA A 23 -14.604 -1.395 4.070 1.00 1.62 C ATOM 0 H ALA A 23 -16.541 -0.167 4.652 1.00 1.43 H new ATOM 0 HA ALA A 23 -13.861 0.337 5.172 1.00 1.28 H new ATOM 0 HB1 ALA A 23 -13.610 -1.799 3.878 1.00 1.62 H new ATOM 0 HB2 ALA A 23 -15.030 -1.882 4.947 1.00 1.62 H new ATOM 0 HB3 ALA A 23 -15.244 -1.579 3.207 1.00 1.62 H new ATOM 410 N GLU A 24 -14.649 0.794 2.008 1.00 1.16 N ATOM 411 CA GLU A 24 -14.244 1.358 0.736 1.00 1.15 C ATOM 412 C GLU A 24 -14.010 2.868 0.789 1.00 1.09 C ATOM 413 O GLU A 24 -13.106 3.349 0.113 1.00 1.12 O ATOM 414 CB GLU A 24 -15.133 0.884 -0.419 1.00 1.53 C ATOM 415 CG GLU A 24 -16.632 0.932 -0.141 1.00 2.13 C ATOM 416 CD GLU A 24 -17.179 -0.399 0.389 1.00 1.52 C ATOM 417 OE1 GLU A 24 -17.096 -0.625 1.618 1.00 3.08 O ATOM 418 OE2 GLU A 24 -17.695 -1.214 -0.414 1.00 1.69 O ATOM 0 H GLU A 24 -15.583 0.386 1.987 1.00 1.16 H new ATOM 0 HA GLU A 24 -13.256 0.954 0.514 1.00 1.15 H new ATOM 0 HB2 GLU A 24 -14.922 1.497 -1.295 1.00 1.53 H new ATOM 0 HB3 GLU A 24 -14.858 -0.140 -0.672 1.00 1.53 H new ATOM 0 HG2 GLU A 24 -16.838 1.719 0.584 1.00 2.13 H new ATOM 0 HG3 GLU A 24 -17.159 1.197 -1.058 1.00 2.13 H new ATOM 425 N GLU A 25 -14.730 3.614 1.632 1.00 1.04 N ATOM 426 CA GLU A 25 -14.436 5.031 1.871 1.00 0.96 C ATOM 427 C GLU A 25 -13.020 5.231 2.451 1.00 0.87 C ATOM 428 O GLU A 25 -12.345 6.195 2.081 1.00 0.84 O ATOM 429 CB GLU A 25 -15.509 5.627 2.794 1.00 0.95 C ATOM 430 CG GLU A 25 -15.716 7.133 2.598 1.00 1.26 C ATOM 431 CD GLU A 25 -16.825 7.697 3.510 1.00 1.83 C ATOM 432 OE1 GLU A 25 -17.287 7.008 4.454 1.00 2.84 O ATOM 433 OE2 GLU A 25 -17.258 8.850 3.267 1.00 2.95 O ATOM 0 H GLU A 25 -15.525 3.258 2.163 1.00 1.04 H new ATOM 0 HA GLU A 25 -14.458 5.557 0.916 1.00 0.96 H new ATOM 0 HB2 GLU A 25 -16.454 5.113 2.619 1.00 0.95 H new ATOM 0 HB3 GLU A 25 -15.231 5.438 3.831 1.00 0.95 H new ATOM 0 HG2 GLU A 25 -14.781 7.655 2.802 1.00 1.26 H new ATOM 0 HG3 GLU A 25 -15.971 7.330 1.557 1.00 1.26 H new ATOM 440 N VAL A 26 -12.533 4.298 3.289 1.00 0.87 N ATOM 441 CA VAL A 26 -11.144 4.330 3.805 1.00 0.82 C ATOM 442 C VAL A 26 -10.144 4.200 2.649 1.00 0.84 C ATOM 443 O VAL A 26 -9.236 5.024 2.528 1.00 0.85 O ATOM 444 CB VAL A 26 -10.833 3.241 4.864 1.00 0.84 C ATOM 445 CG1 VAL A 26 -9.434 3.456 5.471 1.00 0.85 C ATOM 446 CG2 VAL A 26 -11.854 3.198 6.014 1.00 0.91 C ATOM 0 H VAL A 26 -13.081 3.507 3.627 1.00 0.87 H new ATOM 0 HA VAL A 26 -11.043 5.294 4.304 1.00 0.82 H new ATOM 0 HB VAL A 26 -10.884 2.292 4.330 1.00 0.84 H new ATOM 0 HG11 VAL A 26 -9.236 2.681 6.212 1.00 0.85 H new ATOM 0 HG12 VAL A 26 -8.683 3.405 4.682 1.00 0.85 H new ATOM 0 HG13 VAL A 26 -9.391 4.435 5.949 1.00 0.85 H new ATOM 0 HG21 VAL A 26 -11.576 2.414 6.718 1.00 0.91 H new ATOM 0 HG22 VAL A 26 -11.865 4.160 6.527 1.00 0.91 H new ATOM 0 HG23 VAL A 26 -12.846 2.990 5.612 1.00 0.91 H new ATOM 456 N TYR A 27 -10.315 3.189 1.784 1.00 0.86 N ATOM 457 CA TYR A 27 -9.382 2.939 0.675 1.00 0.84 C ATOM 458 C TYR A 27 -9.485 4.042 -0.404 1.00 0.84 C ATOM 459 O TYR A 27 -8.490 4.466 -0.986 1.00 0.80 O ATOM 460 CB TYR A 27 -9.523 1.495 0.129 1.00 0.97 C ATOM 461 CG TYR A 27 -10.287 1.301 -1.172 1.00 1.09 C ATOM 462 CD1 TYR A 27 -9.808 1.860 -2.372 1.00 2.00 C ATOM 463 CD2 TYR A 27 -11.466 0.538 -1.191 1.00 1.57 C ATOM 464 CE1 TYR A 27 -10.572 1.769 -3.551 1.00 2.16 C ATOM 465 CE2 TYR A 27 -12.266 0.479 -2.350 1.00 1.60 C ATOM 466 CZ TYR A 27 -11.821 1.106 -3.536 1.00 1.40 C ATOM 467 OH TYR A 27 -12.577 1.060 -4.669 1.00 1.58 O ATOM 0 H TYR A 27 -11.092 2.530 1.831 1.00 0.86 H new ATOM 0 HA TYR A 27 -8.363 3.001 1.056 1.00 0.84 H new ATOM 0 HB2 TYR A 27 -8.521 1.089 -0.007 1.00 0.97 H new ATOM 0 HB3 TYR A 27 -10.009 0.893 0.896 1.00 0.97 H new ATOM 0 HD1 TYR A 27 -8.851 2.360 -2.388 1.00 2.00 H new ATOM 0 HD2 TYR A 27 -11.763 -0.009 -0.308 1.00 1.57 H new ATOM 0 HE1 TYR A 27 -10.204 2.206 -4.468 1.00 2.16 H new ATOM 0 HE2 TYR A 27 -13.212 -0.042 -2.332 1.00 1.60 H new ATOM 0 HH TYR A 27 -13.405 0.567 -4.490 1.00 1.58 H new ATOM 477 N HIS A 28 -10.692 4.538 -0.661 1.00 0.93 N ATOM 478 CA HIS A 28 -10.990 5.604 -1.613 1.00 0.97 C ATOM 479 C HIS A 28 -10.321 6.930 -1.225 1.00 0.86 C ATOM 480 O HIS A 28 -9.777 7.579 -2.105 1.00 0.88 O ATOM 481 CB HIS A 28 -12.516 5.729 -1.716 1.00 1.08 C ATOM 482 CG HIS A 28 -13.040 6.832 -2.599 1.00 1.17 C ATOM 483 ND1 HIS A 28 -13.985 7.762 -2.229 1.00 1.25 N ATOM 484 CD2 HIS A 28 -12.778 7.032 -3.929 1.00 1.26 C ATOM 485 CE1 HIS A 28 -14.293 8.496 -3.309 1.00 1.38 C ATOM 486 NE2 HIS A 28 -13.580 8.092 -4.378 1.00 1.38 N ATOM 0 H HIS A 28 -11.528 4.192 -0.189 1.00 0.93 H new ATOM 0 HA HIS A 28 -10.577 5.353 -2.590 1.00 0.97 H new ATOM 0 HB2 HIS A 28 -12.912 4.782 -2.081 1.00 1.08 H new ATOM 0 HB3 HIS A 28 -12.915 5.876 -0.712 1.00 1.08 H new ATOM 0 HD2 HIS A 28 -12.076 6.471 -4.528 1.00 1.26 H new ATOM 0 HE1 HIS A 28 -15.014 9.300 -3.320 1.00 1.38 H new ATOM 0 HE2 HIS A 28 -13.616 8.478 -5.321 1.00 1.38 H new ATOM 494 N GLU A 29 -10.310 7.334 0.052 1.00 0.77 N ATOM 495 CA GLU A 29 -9.602 8.552 0.501 1.00 0.67 C ATOM 496 C GLU A 29 -8.099 8.496 0.163 1.00 0.63 C ATOM 497 O GLU A 29 -7.530 9.437 -0.397 1.00 0.65 O ATOM 498 CB GLU A 29 -9.817 8.685 2.023 1.00 0.61 C ATOM 499 CG GLU A 29 -8.999 9.754 2.772 1.00 0.99 C ATOM 500 CD GLU A 29 -9.566 11.176 2.647 1.00 1.09 C ATOM 501 OE1 GLU A 29 -9.755 11.676 1.516 1.00 2.30 O ATOM 502 OE2 GLU A 29 -9.801 11.818 3.699 1.00 2.04 O ATOM 0 H GLU A 29 -10.786 6.834 0.802 1.00 0.77 H new ATOM 0 HA GLU A 29 -10.003 9.422 -0.020 1.00 0.67 H new ATOM 0 HB2 GLU A 29 -10.874 8.890 2.196 1.00 0.61 H new ATOM 0 HB3 GLU A 29 -9.601 7.718 2.478 1.00 0.61 H new ATOM 0 HG2 GLU A 29 -8.949 9.485 3.827 1.00 0.99 H new ATOM 0 HG3 GLU A 29 -7.977 9.747 2.393 1.00 0.99 H new ATOM 509 N ILE A 30 -7.437 7.382 0.484 1.00 0.59 N ATOM 510 CA ILE A 30 -5.991 7.213 0.226 1.00 0.58 C ATOM 511 C ILE A 30 -5.675 7.011 -1.261 1.00 0.62 C ATOM 512 O ILE A 30 -4.641 7.473 -1.740 1.00 0.64 O ATOM 513 CB ILE A 30 -5.389 6.115 1.123 1.00 0.57 C ATOM 514 CG1 ILE A 30 -6.080 4.763 0.881 1.00 0.63 C ATOM 515 CG2 ILE A 30 -5.523 6.567 2.586 1.00 0.64 C ATOM 516 CD1 ILE A 30 -5.692 3.651 1.840 1.00 0.73 C ATOM 0 H ILE A 30 -7.876 6.574 0.926 1.00 0.59 H new ATOM 0 HA ILE A 30 -5.503 8.149 0.499 1.00 0.58 H new ATOM 0 HB ILE A 30 -4.336 5.970 0.882 1.00 0.57 H new ATOM 0 HG12 ILE A 30 -7.158 4.910 0.939 1.00 0.63 H new ATOM 0 HG13 ILE A 30 -5.857 4.437 -0.135 1.00 0.63 H new ATOM 0 HG21 ILE A 30 -5.103 5.805 3.242 1.00 0.64 H new ATOM 0 HG22 ILE A 30 -4.985 7.504 2.728 1.00 0.64 H new ATOM 0 HG23 ILE A 30 -6.576 6.713 2.827 1.00 0.64 H new ATOM 0 HD11 ILE A 30 -6.235 2.742 1.582 1.00 0.73 H new ATOM 0 HD12 ILE A 30 -4.620 3.466 1.768 1.00 0.73 H new ATOM 0 HD13 ILE A 30 -5.942 3.946 2.859 1.00 0.73 H new ATOM 528 N GLU A 31 -6.591 6.400 -2.012 1.00 0.67 N ATOM 529 CA GLU A 31 -6.541 6.334 -3.468 1.00 0.72 C ATOM 530 C GLU A 31 -6.775 7.707 -4.105 1.00 0.74 C ATOM 531 O GLU A 31 -6.069 8.056 -5.039 1.00 0.74 O ATOM 532 CB GLU A 31 -7.566 5.305 -3.949 1.00 0.80 C ATOM 533 CG GLU A 31 -7.783 5.309 -5.459 1.00 1.97 C ATOM 534 CD GLU A 31 -8.764 4.223 -5.896 1.00 1.91 C ATOM 535 OE1 GLU A 31 -8.321 3.085 -6.172 1.00 2.82 O ATOM 536 OE2 GLU A 31 -9.973 4.530 -6.005 1.00 2.42 O ATOM 0 H GLU A 31 -7.404 5.928 -1.615 1.00 0.67 H new ATOM 0 HA GLU A 31 -5.545 6.021 -3.780 1.00 0.72 H new ATOM 0 HB2 GLU A 31 -7.241 4.311 -3.641 1.00 0.80 H new ATOM 0 HB3 GLU A 31 -8.518 5.496 -3.454 1.00 0.80 H new ATOM 0 HG2 GLU A 31 -8.159 6.284 -5.769 1.00 1.97 H new ATOM 0 HG3 GLU A 31 -6.828 5.160 -5.963 1.00 1.97 H new ATOM 543 N LEU A 32 -7.709 8.525 -3.619 1.00 0.79 N ATOM 544 CA LEU A 32 -7.927 9.887 -4.109 1.00 0.84 C ATOM 545 C LEU A 32 -6.667 10.733 -3.933 1.00 0.80 C ATOM 546 O LEU A 32 -6.302 11.475 -4.839 1.00 0.88 O ATOM 547 CB LEU A 32 -9.112 10.516 -3.346 1.00 0.90 C ATOM 548 CG LEU A 32 -10.506 10.205 -3.919 1.00 1.07 C ATOM 549 CD1 LEU A 32 -11.562 10.783 -2.966 1.00 1.12 C ATOM 550 CD2 LEU A 32 -10.698 10.813 -5.316 1.00 1.27 C ATOM 0 H LEU A 32 -8.343 8.258 -2.866 1.00 0.79 H new ATOM 0 HA LEU A 32 -8.159 9.852 -5.173 1.00 0.84 H new ATOM 0 HB2 LEU A 32 -9.079 10.174 -2.312 1.00 0.90 H new ATOM 0 HB3 LEU A 32 -8.978 11.598 -3.329 1.00 0.90 H new ATOM 0 HG LEU A 32 -10.609 9.124 -4.011 1.00 1.07 H new ATOM 0 HD11 LEU A 32 -12.558 10.572 -3.356 1.00 1.12 H new ATOM 0 HD12 LEU A 32 -11.453 10.326 -1.982 1.00 1.12 H new ATOM 0 HD13 LEU A 32 -11.426 11.861 -2.883 1.00 1.12 H new ATOM 0 HD21 LEU A 32 -11.695 10.570 -5.685 1.00 1.27 H new ATOM 0 HD22 LEU A 32 -10.585 11.896 -5.260 1.00 1.27 H new ATOM 0 HD23 LEU A 32 -9.950 10.405 -5.996 1.00 1.27 H new ATOM 562 N GLN A 33 -5.959 10.571 -2.816 1.00 0.71 N ATOM 563 CA GLN A 33 -4.658 11.198 -2.596 1.00 0.71 C ATOM 564 C GLN A 33 -3.600 10.712 -3.612 1.00 0.69 C ATOM 565 O GLN A 33 -2.730 11.493 -3.988 1.00 0.84 O ATOM 566 CB GLN A 33 -4.254 10.928 -1.134 1.00 0.66 C ATOM 567 CG GLN A 33 -3.054 11.750 -0.648 1.00 0.81 C ATOM 568 CD GLN A 33 -3.286 13.263 -0.693 1.00 1.70 C ATOM 569 OE1 GLN A 33 -2.573 14.003 -1.359 1.00 2.84 O ATOM 570 NE2 GLN A 33 -4.268 13.786 0.012 1.00 3.11 N ATOM 0 H GLN A 33 -6.275 9.997 -2.034 1.00 0.71 H new ATOM 0 HA GLN A 33 -4.724 12.273 -2.761 1.00 0.71 H new ATOM 0 HB2 GLN A 33 -5.108 11.137 -0.489 1.00 0.66 H new ATOM 0 HB3 GLN A 33 -4.023 9.869 -1.023 1.00 0.66 H new ATOM 0 HG2 GLN A 33 -2.815 11.458 0.375 1.00 0.81 H new ATOM 0 HG3 GLN A 33 -2.186 11.506 -1.260 1.00 0.81 H new ATOM 0 HE21 GLN A 33 -4.871 13.183 0.572 1.00 3.11 H new ATOM 0 HE22 GLN A 33 -4.426 14.794 -0.002 1.00 3.11 H new ATOM 579 N ALA A 34 -3.693 9.473 -4.113 1.00 0.57 N ATOM 580 CA ALA A 34 -2.903 8.973 -5.245 1.00 0.54 C ATOM 581 C ALA A 34 -3.362 9.555 -6.603 1.00 0.58 C ATOM 582 O ALA A 34 -2.530 9.985 -7.406 1.00 0.62 O ATOM 583 CB ALA A 34 -2.948 7.433 -5.227 1.00 0.52 C ATOM 0 H ALA A 34 -4.334 8.776 -3.734 1.00 0.57 H new ATOM 0 HA ALA A 34 -1.873 9.310 -5.132 1.00 0.54 H new ATOM 0 HB1 ALA A 34 -2.366 7.042 -6.062 1.00 0.52 H new ATOM 0 HB2 ALA A 34 -2.529 7.068 -4.290 1.00 0.52 H new ATOM 0 HB3 ALA A 34 -3.981 7.098 -5.317 1.00 0.52 H new ATOM 589 N GLN A 35 -4.677 9.614 -6.858 1.00 0.62 N ATOM 590 CA GLN A 35 -5.265 10.166 -8.087 1.00 0.72 C ATOM 591 C GLN A 35 -4.945 11.659 -8.249 1.00 0.84 C ATOM 592 O GLN A 35 -4.711 12.126 -9.363 1.00 0.89 O ATOM 593 CB GLN A 35 -6.800 10.004 -8.115 1.00 0.88 C ATOM 594 CG GLN A 35 -7.323 8.555 -8.088 1.00 0.82 C ATOM 595 CD GLN A 35 -8.775 8.406 -8.563 1.00 1.49 C ATOM 596 OE1 GLN A 35 -9.280 9.140 -9.405 1.00 2.01 O ATOM 597 NE2 GLN A 35 -9.518 7.442 -8.053 1.00 2.15 N ATOM 0 H GLN A 35 -5.377 9.271 -6.200 1.00 0.62 H new ATOM 0 HA GLN A 35 -4.821 9.600 -8.906 1.00 0.72 H new ATOM 0 HB2 GLN A 35 -7.218 10.537 -7.261 1.00 0.88 H new ATOM 0 HB3 GLN A 35 -7.181 10.491 -9.012 1.00 0.88 H new ATOM 0 HG2 GLN A 35 -6.681 7.936 -8.715 1.00 0.82 H new ATOM 0 HG3 GLN A 35 -7.243 8.170 -7.072 1.00 0.82 H new ATOM 0 HE21 GLN A 35 -9.127 6.814 -7.350 1.00 2.15 H new ATOM 0 HE22 GLN A 35 -10.483 7.325 -8.361 1.00 2.15 H new ATOM 606 N GLN A 36 -4.900 12.403 -7.140 1.00 0.90 N ATOM 607 CA GLN A 36 -4.606 13.837 -7.101 1.00 1.02 C ATOM 608 C GLN A 36 -3.191 14.154 -7.611 1.00 1.02 C ATOM 609 O GLN A 36 -2.950 15.255 -8.107 1.00 1.15 O ATOM 610 CB GLN A 36 -4.845 14.358 -5.672 1.00 1.05 C ATOM 611 CG GLN A 36 -6.328 14.673 -5.397 1.00 1.21 C ATOM 612 CD GLN A 36 -6.849 15.866 -6.205 1.00 1.55 C ATOM 613 OE1 GLN A 36 -6.551 17.021 -5.927 1.00 2.19 O ATOM 614 NE2 GLN A 36 -7.628 15.643 -7.248 1.00 2.17 N ATOM 0 H GLN A 36 -5.073 12.010 -6.215 1.00 0.90 H new ATOM 0 HA GLN A 36 -5.281 14.356 -7.782 1.00 1.02 H new ATOM 0 HB2 GLN A 36 -4.496 13.615 -4.955 1.00 1.05 H new ATOM 0 HB3 GLN A 36 -4.251 15.258 -5.513 1.00 1.05 H new ATOM 0 HG2 GLN A 36 -6.929 13.794 -5.630 1.00 1.21 H new ATOM 0 HG3 GLN A 36 -6.459 14.877 -4.334 1.00 1.21 H new ATOM 0 HE21 GLN A 36 -7.887 14.688 -7.496 1.00 2.17 H new ATOM 0 HE22 GLN A 36 -7.970 16.426 -7.806 1.00 2.17 H new ATOM 623 N LEU A 37 -2.264 13.191 -7.514 1.00 0.91 N ATOM 624 CA LEU A 37 -0.898 13.292 -8.036 1.00 0.94 C ATOM 625 C LEU A 37 -0.743 12.706 -9.456 1.00 0.85 C ATOM 626 O LEU A 37 0.362 12.750 -10.000 1.00 0.92 O ATOM 627 CB LEU A 37 0.048 12.600 -7.037 1.00 0.96 C ATOM 628 CG LEU A 37 -0.038 13.098 -5.582 1.00 1.05 C ATOM 629 CD1 LEU A 37 0.968 12.318 -4.725 1.00 1.52 C ATOM 630 CD2 LEU A 37 0.203 14.608 -5.456 1.00 1.27 C ATOM 0 H LEU A 37 -2.450 12.298 -7.058 1.00 0.91 H new ATOM 0 HA LEU A 37 -0.643 14.347 -8.136 1.00 0.94 H new ATOM 0 HB2 LEU A 37 -0.161 11.530 -7.049 1.00 0.96 H new ATOM 0 HB3 LEU A 37 1.073 12.729 -7.386 1.00 0.96 H new ATOM 0 HG LEU A 37 -1.053 12.920 -5.227 1.00 1.05 H new ATOM 0 HD11 LEU A 37 0.913 12.665 -3.693 1.00 1.52 H new ATOM 0 HD12 LEU A 37 0.731 11.255 -4.763 1.00 1.52 H new ATOM 0 HD13 LEU A 37 1.975 12.479 -5.109 1.00 1.52 H new ATOM 0 HD21 LEU A 37 0.130 14.902 -4.409 1.00 1.27 H new ATOM 0 HD22 LEU A 37 1.197 14.851 -5.833 1.00 1.27 H new ATOM 0 HD23 LEU A 37 -0.546 15.146 -6.037 1.00 1.27 H new ATOM 642 N GLU A 38 -1.818 12.177 -10.055 1.00 0.77 N ATOM 643 CA GLU A 38 -1.868 11.602 -11.412 1.00 0.72 C ATOM 644 C GLU A 38 -1.016 10.313 -11.542 1.00 0.63 C ATOM 645 O GLU A 38 -0.396 10.061 -12.577 1.00 0.81 O ATOM 646 CB GLU A 38 -1.501 12.691 -12.449 1.00 0.98 C ATOM 647 CG GLU A 38 -2.009 12.416 -13.872 1.00 1.89 C ATOM 648 CD GLU A 38 -1.426 13.436 -14.862 1.00 2.35 C ATOM 649 OE1 GLU A 38 -0.207 13.380 -15.154 1.00 3.35 O ATOM 650 OE2 GLU A 38 -2.185 14.299 -15.368 1.00 2.31 O ATOM 0 H GLU A 38 -2.723 12.135 -9.586 1.00 0.77 H new ATOM 0 HA GLU A 38 -2.887 11.276 -11.619 1.00 0.72 H new ATOM 0 HB2 GLU A 38 -1.904 13.646 -12.112 1.00 0.98 H new ATOM 0 HB3 GLU A 38 -0.416 12.795 -12.478 1.00 0.98 H new ATOM 0 HG2 GLU A 38 -1.730 11.407 -14.175 1.00 1.89 H new ATOM 0 HG3 GLU A 38 -3.098 12.464 -13.891 1.00 1.89 H new ATOM 657 N TYR A 39 -0.924 9.501 -10.477 1.00 0.54 N ATOM 658 CA TYR A 39 0.084 8.432 -10.376 1.00 0.55 C ATOM 659 C TYR A 39 -0.083 7.292 -11.409 1.00 0.55 C ATOM 660 O TYR A 39 0.754 7.206 -12.308 1.00 0.56 O ATOM 661 CB TYR A 39 0.157 7.958 -8.907 1.00 0.57 C ATOM 662 CG TYR A 39 1.314 8.552 -8.111 1.00 0.78 C ATOM 663 CD1 TYR A 39 1.695 9.896 -8.301 1.00 1.96 C ATOM 664 CD2 TYR A 39 2.043 7.753 -7.205 1.00 1.85 C ATOM 665 CE1 TYR A 39 2.825 10.421 -7.651 1.00 2.24 C ATOM 666 CE2 TYR A 39 3.158 8.282 -6.521 1.00 1.99 C ATOM 667 CZ TYR A 39 3.574 9.608 -6.778 1.00 1.54 C ATOM 668 OH TYR A 39 4.707 10.099 -6.207 1.00 2.02 O ATOM 0 H TYR A 39 -1.541 9.565 -9.667 1.00 0.54 H new ATOM 0 HA TYR A 39 1.053 8.845 -10.655 1.00 0.55 H new ATOM 0 HB2 TYR A 39 -0.779 8.212 -8.409 1.00 0.57 H new ATOM 0 HB3 TYR A 39 0.242 6.871 -8.892 1.00 0.57 H new ATOM 0 HD1 TYR A 39 1.112 10.529 -8.953 1.00 1.96 H new ATOM 0 HD2 TYR A 39 1.745 6.729 -7.034 1.00 1.85 H new ATOM 0 HE1 TYR A 39 3.119 11.446 -7.821 1.00 2.24 H new ATOM 0 HE2 TYR A 39 3.692 7.676 -5.804 1.00 1.99 H new ATOM 0 HH TYR A 39 4.622 11.069 -6.093 1.00 2.02 H new ATOM 678 N ASP A 40 -1.163 6.496 -11.342 1.00 0.54 N ATOM 679 CA ASP A 40 -1.506 5.327 -12.191 1.00 0.48 C ATOM 680 C ASP A 40 -2.595 4.478 -11.507 1.00 0.50 C ATOM 681 O ASP A 40 -3.771 4.592 -11.853 1.00 0.57 O ATOM 682 CB ASP A 40 -0.279 4.465 -12.570 1.00 0.55 C ATOM 683 CG ASP A 40 -0.616 3.155 -13.295 1.00 0.89 C ATOM 684 OD1 ASP A 40 -1.278 3.216 -14.358 1.00 1.74 O ATOM 685 OD2 ASP A 40 -0.161 2.095 -12.808 1.00 1.81 O ATOM 0 H ASP A 40 -1.882 6.661 -10.637 1.00 0.54 H new ATOM 0 HA ASP A 40 -1.894 5.719 -13.131 1.00 0.48 H new ATOM 0 HB2 ASP A 40 0.381 5.056 -13.204 1.00 0.55 H new ATOM 0 HB3 ASP A 40 0.277 4.230 -11.663 1.00 0.55 H new ATOM 690 N TYR A 41 -2.213 3.669 -10.512 1.00 0.51 N ATOM 691 CA TYR A 41 -3.103 2.798 -9.730 1.00 0.47 C ATOM 692 C TYR A 41 -2.672 2.691 -8.253 1.00 0.43 C ATOM 693 O TYR A 41 -1.521 2.937 -7.887 1.00 0.44 O ATOM 694 CB TYR A 41 -3.170 1.385 -10.341 1.00 0.51 C ATOM 695 CG TYR A 41 -3.800 1.245 -11.718 1.00 0.58 C ATOM 696 CD1 TYR A 41 -5.152 1.590 -11.924 1.00 1.31 C ATOM 697 CD2 TYR A 41 -3.062 0.682 -12.779 1.00 1.69 C ATOM 698 CE1 TYR A 41 -5.745 1.418 -13.191 1.00 1.29 C ATOM 699 CE2 TYR A 41 -3.641 0.524 -14.052 1.00 1.78 C ATOM 700 CZ TYR A 41 -4.985 0.906 -14.265 1.00 0.78 C ATOM 701 OH TYR A 41 -5.561 0.744 -15.489 1.00 0.89 O ATOM 0 H TYR A 41 -1.239 3.599 -10.217 1.00 0.51 H new ATOM 0 HA TYR A 41 -4.090 3.260 -9.764 1.00 0.47 H new ATOM 0 HB2 TYR A 41 -2.154 0.993 -10.394 1.00 0.51 H new ATOM 0 HB3 TYR A 41 -3.722 0.746 -9.652 1.00 0.51 H new ATOM 0 HD1 TYR A 41 -5.736 1.988 -11.107 1.00 1.31 H new ATOM 0 HD2 TYR A 41 -2.042 0.369 -12.613 1.00 1.69 H new ATOM 0 HE1 TYR A 41 -6.782 1.678 -13.341 1.00 1.29 H new ATOM 0 HE2 TYR A 41 -3.060 0.112 -14.864 1.00 1.78 H new ATOM 0 HH TYR A 41 -4.900 0.383 -16.116 1.00 0.89 H new ATOM 711 N TYR A 42 -3.618 2.289 -7.406 1.00 0.45 N ATOM 712 CA TYR A 42 -3.479 2.090 -5.959 1.00 0.46 C ATOM 713 C TYR A 42 -3.737 0.618 -5.573 1.00 0.43 C ATOM 714 O TYR A 42 -4.553 -0.050 -6.210 1.00 0.49 O ATOM 715 CB TYR A 42 -4.495 3.028 -5.280 1.00 0.60 C ATOM 716 CG TYR A 42 -4.943 2.572 -3.909 1.00 1.55 C ATOM 717 CD1 TYR A 42 -6.057 1.718 -3.789 1.00 2.17 C ATOM 718 CD2 TYR A 42 -4.194 2.921 -2.773 1.00 3.44 C ATOM 719 CE1 TYR A 42 -6.415 1.205 -2.533 1.00 3.33 C ATOM 720 CE2 TYR A 42 -4.554 2.421 -1.511 1.00 4.89 C ATOM 721 CZ TYR A 42 -5.672 1.569 -1.394 1.00 4.57 C ATOM 722 OH TYR A 42 -6.041 1.097 -0.180 1.00 6.05 O ATOM 0 H TYR A 42 -4.562 2.080 -7.729 1.00 0.45 H new ATOM 0 HA TYR A 42 -2.464 2.320 -5.634 1.00 0.46 H new ATOM 0 HB2 TYR A 42 -4.054 4.021 -5.194 1.00 0.60 H new ATOM 0 HB3 TYR A 42 -5.370 3.123 -5.923 1.00 0.60 H new ATOM 0 HD1 TYR A 42 -6.635 1.458 -4.663 1.00 2.17 H new ATOM 0 HD2 TYR A 42 -3.340 3.575 -2.870 1.00 3.44 H new ATOM 0 HE1 TYR A 42 -7.256 0.534 -2.441 1.00 3.33 H new ATOM 0 HE2 TYR A 42 -3.979 2.687 -0.636 1.00 4.89 H new ATOM 0 HH TYR A 42 -5.324 1.263 0.467 1.00 6.05 H new ATOM 732 N SER A 43 -3.113 0.120 -4.503 1.00 0.40 N ATOM 733 CA SER A 43 -3.402 -1.208 -3.943 1.00 0.39 C ATOM 734 C SER A 43 -3.185 -1.290 -2.419 1.00 0.36 C ATOM 735 O SER A 43 -2.316 -0.613 -1.860 1.00 0.34 O ATOM 736 CB SER A 43 -2.553 -2.261 -4.661 1.00 0.50 C ATOM 737 OG SER A 43 -2.937 -3.569 -4.269 1.00 1.90 O ATOM 0 H SER A 43 -2.388 0.628 -3.996 1.00 0.40 H new ATOM 0 HA SER A 43 -4.462 -1.401 -4.108 1.00 0.39 H new ATOM 0 HB2 SER A 43 -2.665 -2.152 -5.740 1.00 0.50 H new ATOM 0 HB3 SER A 43 -1.499 -2.103 -4.433 1.00 0.50 H new ATOM 0 HG SER A 43 -2.778 -4.192 -5.009 1.00 1.90 H new ATOM 743 N LEU A 44 -3.958 -2.156 -1.756 1.00 0.47 N ATOM 744 CA LEU A 44 -3.884 -2.496 -0.330 1.00 0.59 C ATOM 745 C LEU A 44 -4.145 -3.988 -0.143 1.00 0.50 C ATOM 746 O LEU A 44 -4.944 -4.593 -0.857 1.00 0.51 O ATOM 747 CB LEU A 44 -4.853 -1.605 0.473 1.00 0.93 C ATOM 748 CG LEU A 44 -5.337 -2.076 1.871 1.00 0.89 C ATOM 749 CD1 LEU A 44 -5.523 -0.882 2.816 1.00 1.47 C ATOM 750 CD2 LEU A 44 -6.658 -2.842 1.782 1.00 1.57 C ATOM 0 H LEU A 44 -4.699 -2.671 -2.230 1.00 0.47 H new ATOM 0 HA LEU A 44 -2.884 -2.298 0.056 1.00 0.59 H new ATOM 0 HB2 LEU A 44 -4.375 -0.634 0.602 1.00 0.93 H new ATOM 0 HB3 LEU A 44 -5.738 -1.445 -0.143 1.00 0.93 H new ATOM 0 HG LEU A 44 -4.567 -2.741 2.263 1.00 0.89 H new ATOM 0 HD11 LEU A 44 -5.862 -1.237 3.789 1.00 1.47 H new ATOM 0 HD12 LEU A 44 -4.574 -0.358 2.932 1.00 1.47 H new ATOM 0 HD13 LEU A 44 -6.265 -0.201 2.400 1.00 1.47 H new ATOM 0 HD21 LEU A 44 -6.965 -3.155 2.780 1.00 1.57 H new ATOM 0 HD22 LEU A 44 -7.424 -2.197 1.353 1.00 1.57 H new ATOM 0 HD23 LEU A 44 -6.527 -3.720 1.150 1.00 1.57 H new ATOM 762 N CYS A 45 -3.472 -4.570 0.844 1.00 0.53 N ATOM 763 CA CYS A 45 -3.621 -5.960 1.245 1.00 0.52 C ATOM 764 C CYS A 45 -3.605 -6.084 2.775 1.00 0.50 C ATOM 765 O CYS A 45 -2.937 -5.306 3.460 1.00 0.58 O ATOM 766 CB CYS A 45 -2.488 -6.737 0.581 1.00 0.73 C ATOM 767 SG CYS A 45 -2.702 -8.518 0.832 1.00 1.42 S ATOM 0 H CYS A 45 -2.784 -4.067 1.405 1.00 0.53 H new ATOM 0 HA CYS A 45 -4.579 -6.370 0.925 1.00 0.52 H new ATOM 0 HB2 CYS A 45 -2.464 -6.515 -0.486 1.00 0.73 H new ATOM 0 HB3 CYS A 45 -1.531 -6.419 0.994 1.00 0.73 H new ATOM 0 HG CYS A 45 -3.954 -8.776 1.067 1.00 1.42 H new ATOM 773 N VAL A 46 -4.335 -7.064 3.297 1.00 0.52 N ATOM 774 CA VAL A 46 -4.521 -7.334 4.729 1.00 0.67 C ATOM 775 C VAL A 46 -4.157 -8.792 5.024 1.00 0.80 C ATOM 776 O VAL A 46 -4.387 -9.665 4.186 1.00 0.88 O ATOM 777 CB VAL A 46 -5.977 -6.995 5.165 1.00 0.82 C ATOM 778 CG1 VAL A 46 -6.925 -8.199 5.293 1.00 1.82 C ATOM 779 CG2 VAL A 46 -5.971 -6.220 6.491 1.00 2.24 C ATOM 0 H VAL A 46 -4.840 -7.727 2.709 1.00 0.52 H new ATOM 0 HA VAL A 46 -3.858 -6.695 5.312 1.00 0.67 H new ATOM 0 HB VAL A 46 -6.371 -6.388 4.350 1.00 0.82 H new ATOM 0 HG11 VAL A 46 -7.912 -7.854 5.601 1.00 1.82 H new ATOM 0 HG12 VAL A 46 -7.002 -8.706 4.331 1.00 1.82 H new ATOM 0 HG13 VAL A 46 -6.534 -8.892 6.038 1.00 1.82 H new ATOM 0 HG21 VAL A 46 -6.996 -5.990 6.783 1.00 2.24 H new ATOM 0 HG22 VAL A 46 -5.501 -6.827 7.265 1.00 2.24 H new ATOM 0 HG23 VAL A 46 -5.412 -5.292 6.368 1.00 2.24 H new ATOM 789 N ARG A 47 -3.597 -9.045 6.212 1.00 0.87 N ATOM 790 CA ARG A 47 -3.175 -10.372 6.675 1.00 0.99 C ATOM 791 C ARG A 47 -3.413 -10.503 8.180 1.00 1.09 C ATOM 792 O ARG A 47 -2.889 -9.720 8.975 1.00 1.16 O ATOM 793 CB ARG A 47 -1.689 -10.601 6.322 1.00 1.06 C ATOM 794 CG ARG A 47 -1.536 -11.662 5.225 1.00 1.59 C ATOM 795 CD ARG A 47 -0.075 -11.812 4.784 1.00 1.67 C ATOM 796 NE ARG A 47 0.084 -12.956 3.870 1.00 2.66 N ATOM 797 CZ ARG A 47 1.215 -13.353 3.294 1.00 3.03 C ATOM 798 NH1 ARG A 47 2.339 -12.681 3.423 1.00 2.86 N ATOM 799 NH2 ARG A 47 1.229 -14.452 2.571 1.00 4.02 N ATOM 0 H ARG A 47 -3.420 -8.311 6.898 1.00 0.87 H new ATOM 0 HA ARG A 47 -3.767 -11.137 6.173 1.00 0.99 H new ATOM 0 HB2 ARG A 47 -1.243 -9.664 5.990 1.00 1.06 H new ATOM 0 HB3 ARG A 47 -1.145 -10.914 7.213 1.00 1.06 H new ATOM 0 HG2 ARG A 47 -1.906 -12.620 5.590 1.00 1.59 H new ATOM 0 HG3 ARG A 47 -2.150 -11.389 4.366 1.00 1.59 H new ATOM 0 HD2 ARG A 47 0.255 -10.898 4.290 1.00 1.67 H new ATOM 0 HD3 ARG A 47 0.561 -11.949 5.659 1.00 1.67 H new ATOM 0 HE ARG A 47 -0.755 -13.496 3.658 1.00 2.66 H new ATOM 0 HH11 ARG A 47 2.361 -11.826 3.979 1.00 2.86 H new ATOM 0 HH12 ARG A 47 3.188 -13.015 2.967 1.00 2.86 H new ATOM 0 HH21 ARG A 47 0.374 -14.996 2.454 1.00 4.02 H new ATOM 0 HH22 ARG A 47 2.094 -14.760 2.128 1.00 4.02 H new ATOM 813 N HIS A 48 -4.190 -11.506 8.586 1.00 1.13 N ATOM 814 CA HIS A 48 -4.630 -11.669 9.976 1.00 1.13 C ATOM 815 C HIS A 48 -4.303 -13.071 10.546 1.00 1.16 C ATOM 816 O HIS A 48 -4.850 -14.078 10.077 1.00 1.24 O ATOM 817 CB HIS A 48 -6.109 -11.256 10.109 1.00 1.21 C ATOM 818 CG HIS A 48 -7.187 -12.134 9.520 1.00 2.10 C ATOM 819 ND1 HIS A 48 -8.490 -12.128 9.946 1.00 2.73 N ATOM 820 CD2 HIS A 48 -7.118 -13.020 8.478 1.00 3.42 C ATOM 821 CE1 HIS A 48 -9.192 -12.994 9.204 1.00 4.08 C ATOM 822 NE2 HIS A 48 -8.391 -13.574 8.296 1.00 4.56 N ATOM 0 H HIS A 48 -4.535 -12.233 7.959 1.00 1.13 H new ATOM 0 HA HIS A 48 -4.054 -10.993 10.609 1.00 1.13 H new ATOM 0 HB2 HIS A 48 -6.322 -11.147 11.172 1.00 1.21 H new ATOM 0 HB3 HIS A 48 -6.213 -10.268 9.661 1.00 1.21 H new ATOM 0 HD1 HIS A 48 -8.864 -11.557 10.704 1.00 2.73 H new ATOM 0 HD2 HIS A 48 -6.236 -13.251 7.898 1.00 3.42 H new ATOM 0 HE1 HIS A 48 -10.247 -13.196 9.319 1.00 4.08 H new ATOM 830 N PRO A 49 -3.408 -13.176 11.551 1.00 1.20 N ATOM 831 CA PRO A 49 -2.969 -14.460 12.082 1.00 1.34 C ATOM 832 C PRO A 49 -3.980 -14.989 13.115 1.00 1.38 C ATOM 833 O PRO A 49 -3.708 -15.027 14.315 1.00 1.62 O ATOM 834 CB PRO A 49 -1.569 -14.189 12.649 1.00 1.44 C ATOM 835 CG PRO A 49 -1.682 -12.755 13.162 1.00 1.38 C ATOM 836 CD PRO A 49 -2.608 -12.101 12.137 1.00 1.22 C ATOM 0 HA PRO A 49 -2.918 -15.251 11.333 1.00 1.34 H new ATOM 0 HB2 PRO A 49 -1.315 -14.885 13.448 1.00 1.44 H new ATOM 0 HB3 PRO A 49 -0.798 -14.285 11.885 1.00 1.44 H new ATOM 0 HG2 PRO A 49 -2.101 -12.717 14.168 1.00 1.38 H new ATOM 0 HG3 PRO A 49 -0.711 -12.262 13.202 1.00 1.38 H new ATOM 0 HD2 PRO A 49 -3.247 -11.357 12.612 1.00 1.22 H new ATOM 0 HD3 PRO A 49 -2.032 -11.584 11.369 1.00 1.22 H new ATOM 844 N VAL A 50 -5.167 -15.391 12.647 1.00 1.31 N ATOM 845 CA VAL A 50 -6.254 -15.884 13.520 1.00 1.35 C ATOM 846 C VAL A 50 -5.846 -17.223 14.172 1.00 1.48 C ATOM 847 O VAL A 50 -5.341 -18.098 13.465 1.00 1.54 O ATOM 848 CB VAL A 50 -7.592 -16.068 12.762 1.00 1.34 C ATOM 849 CG1 VAL A 50 -8.746 -16.455 13.704 1.00 1.42 C ATOM 850 CG2 VAL A 50 -8.009 -14.790 12.023 1.00 1.31 C ATOM 0 H VAL A 50 -5.407 -15.386 11.656 1.00 1.31 H new ATOM 0 HA VAL A 50 -6.412 -15.124 14.286 1.00 1.35 H new ATOM 0 HB VAL A 50 -7.411 -16.873 12.050 1.00 1.34 H new ATOM 0 HG11 VAL A 50 -9.663 -16.573 13.127 1.00 1.42 H new ATOM 0 HG12 VAL A 50 -8.509 -17.394 14.204 1.00 1.42 H new ATOM 0 HG13 VAL A 50 -8.885 -15.672 14.450 1.00 1.42 H new ATOM 0 HG21 VAL A 50 -8.952 -14.961 11.504 1.00 1.31 H new ATOM 0 HG22 VAL A 50 -8.131 -13.978 12.740 1.00 1.31 H new ATOM 0 HG23 VAL A 50 -7.240 -14.521 11.299 1.00 1.31 H new ATOM 860 N PRO A 51 -6.050 -17.407 15.495 1.00 1.56 N ATOM 861 CA PRO A 51 -5.734 -18.655 16.189 1.00 1.70 C ATOM 862 C PRO A 51 -6.892 -19.669 16.187 1.00 1.77 C ATOM 863 O PRO A 51 -6.652 -20.874 16.241 1.00 1.86 O ATOM 864 CB PRO A 51 -5.364 -18.217 17.608 1.00 1.83 C ATOM 865 CG PRO A 51 -6.193 -16.959 17.847 1.00 1.78 C ATOM 866 CD PRO A 51 -6.385 -16.360 16.452 1.00 1.60 C ATOM 0 HA PRO A 51 -4.927 -19.189 15.688 1.00 1.70 H new ATOM 0 HB2 PRO A 51 -5.600 -18.992 18.337 1.00 1.83 H new ATOM 0 HB3 PRO A 51 -4.297 -18.012 17.695 1.00 1.83 H new ATOM 0 HG2 PRO A 51 -7.149 -17.196 18.313 1.00 1.78 H new ATOM 0 HG3 PRO A 51 -5.679 -16.264 18.511 1.00 1.78 H new ATOM 0 HD2 PRO A 51 -7.413 -16.024 16.314 1.00 1.60 H new ATOM 0 HD3 PRO A 51 -5.744 -15.490 16.313 1.00 1.60 H new ATOM 874 N PHE A 52 -8.140 -19.194 16.104 1.00 1.76 N ATOM 875 CA PHE A 52 -9.369 -20.005 16.103 1.00 1.89 C ATOM 876 C PHE A 52 -9.748 -20.582 14.722 1.00 1.87 C ATOM 877 O PHE A 52 -10.655 -21.414 14.632 1.00 2.05 O ATOM 878 CB PHE A 52 -10.519 -19.140 16.648 1.00 1.97 C ATOM 879 CG PHE A 52 -10.409 -18.813 18.126 1.00 2.11 C ATOM 880 CD1 PHE A 52 -10.942 -19.700 19.080 1.00 2.42 C ATOM 881 CD2 PHE A 52 -9.779 -17.628 18.551 1.00 3.31 C ATOM 882 CE1 PHE A 52 -10.848 -19.403 20.451 1.00 2.50 C ATOM 883 CE2 PHE A 52 -9.682 -17.333 19.923 1.00 3.53 C ATOM 884 CZ PHE A 52 -10.218 -18.220 20.874 1.00 2.53 C ATOM 0 H PHE A 52 -8.332 -18.195 16.033 1.00 1.76 H new ATOM 0 HA PHE A 52 -9.183 -20.873 16.736 1.00 1.89 H new ATOM 0 HB2 PHE A 52 -10.556 -18.208 16.084 1.00 1.97 H new ATOM 0 HB3 PHE A 52 -11.462 -19.657 16.472 1.00 1.97 H new ATOM 0 HD1 PHE A 52 -11.424 -20.611 18.758 1.00 2.42 H new ATOM 0 HD2 PHE A 52 -9.369 -16.944 17.822 1.00 3.31 H new ATOM 0 HE1 PHE A 52 -11.260 -20.085 21.180 1.00 2.50 H new ATOM 0 HE2 PHE A 52 -9.196 -16.425 20.246 1.00 3.53 H new ATOM 0 HZ PHE A 52 -10.146 -17.992 21.927 1.00 2.53 H new ATOM 894 N THR A 53 -9.085 -20.132 13.650 1.00 1.70 N ATOM 895 CA THR A 53 -9.355 -20.484 12.244 1.00 1.68 C ATOM 896 C THR A 53 -8.059 -20.410 11.439 1.00 1.55 C ATOM 897 O THR A 53 -7.088 -19.822 11.915 1.00 1.51 O ATOM 898 CB THR A 53 -10.497 -19.593 11.705 1.00 1.72 C ATOM 899 OG1 THR A 53 -11.438 -20.436 11.081 1.00 2.15 O ATOM 900 CG2 THR A 53 -10.124 -18.503 10.698 1.00 1.42 C ATOM 0 H THR A 53 -8.306 -19.480 13.740 1.00 1.70 H new ATOM 0 HA THR A 53 -9.704 -21.513 12.151 1.00 1.68 H new ATOM 0 HB THR A 53 -10.863 -19.055 12.580 1.00 1.72 H new ATOM 0 HG1 THR A 53 -12.177 -19.897 10.730 1.00 2.15 H new ATOM 0 HG21 THR A 53 -11.020 -17.956 10.405 1.00 1.42 H new ATOM 0 HG22 THR A 53 -9.412 -17.815 11.154 1.00 1.42 H new ATOM 0 HG23 THR A 53 -9.674 -18.960 9.817 1.00 1.42 H new ATOM 908 N ARG A 54 -8.018 -20.959 10.220 1.00 1.58 N ATOM 909 CA ARG A 54 -6.833 -20.812 9.356 1.00 1.53 C ATOM 910 C ARG A 54 -6.634 -19.329 8.979 1.00 1.38 C ATOM 911 O ARG A 54 -7.607 -18.673 8.595 1.00 1.36 O ATOM 912 CB ARG A 54 -6.954 -21.654 8.077 1.00 1.66 C ATOM 913 CG ARG A 54 -6.577 -23.134 8.244 1.00 1.90 C ATOM 914 CD ARG A 54 -5.075 -23.314 8.518 1.00 2.47 C ATOM 915 NE ARG A 54 -4.649 -24.709 8.318 1.00 2.90 N ATOM 916 CZ ARG A 54 -3.393 -25.146 8.302 1.00 3.57 C ATOM 917 NH1 ARG A 54 -2.370 -24.350 8.539 1.00 4.08 N ATOM 918 NH2 ARG A 54 -3.146 -26.411 8.039 1.00 3.96 N ATOM 0 H ARG A 54 -8.778 -21.502 9.810 1.00 1.58 H new ATOM 0 HA ARG A 54 -5.970 -21.170 9.918 1.00 1.53 H new ATOM 0 HB2 ARG A 54 -7.980 -21.593 7.714 1.00 1.66 H new ATOM 0 HB3 ARG A 54 -6.318 -21.216 7.308 1.00 1.66 H new ATOM 0 HG2 ARG A 54 -7.150 -23.565 9.065 1.00 1.90 H new ATOM 0 HG3 ARG A 54 -6.850 -23.682 7.343 1.00 1.90 H new ATOM 0 HD2 ARG A 54 -4.504 -22.661 7.858 1.00 2.47 H new ATOM 0 HD3 ARG A 54 -4.852 -23.008 9.540 1.00 2.47 H new ATOM 0 HE ARG A 54 -5.383 -25.403 8.179 1.00 2.90 H new ATOM 0 HH11 ARG A 54 -2.528 -23.363 8.743 1.00 4.08 H new ATOM 0 HH12 ARG A 54 -1.420 -24.721 8.518 1.00 4.08 H new ATOM 0 HH21 ARG A 54 -3.916 -27.052 7.848 1.00 3.96 H new ATOM 0 HH22 ARG A 54 -2.184 -26.751 8.026 1.00 3.96 H new ATOM 932 N PRO A 55 -5.399 -18.797 9.066 1.00 1.37 N ATOM 933 CA PRO A 55 -5.111 -17.394 8.807 1.00 1.23 C ATOM 934 C PRO A 55 -5.197 -17.112 7.304 1.00 1.16 C ATOM 935 O PRO A 55 -4.895 -17.977 6.481 1.00 1.32 O ATOM 936 CB PRO A 55 -3.719 -17.161 9.392 1.00 1.44 C ATOM 937 CG PRO A 55 -3.031 -18.516 9.238 1.00 1.65 C ATOM 938 CD PRO A 55 -4.179 -19.514 9.407 1.00 1.57 C ATOM 0 HA PRO A 55 -5.826 -16.711 9.265 1.00 1.23 H new ATOM 0 HB2 PRO A 55 -3.185 -16.377 8.855 1.00 1.44 H new ATOM 0 HB3 PRO A 55 -3.770 -16.854 10.437 1.00 1.44 H new ATOM 0 HG2 PRO A 55 -2.551 -18.615 8.264 1.00 1.65 H new ATOM 0 HG3 PRO A 55 -2.257 -18.662 9.991 1.00 1.65 H new ATOM 0 HD2 PRO A 55 -4.042 -20.378 8.757 1.00 1.57 H new ATOM 0 HD3 PRO A 55 -4.221 -19.888 10.430 1.00 1.57 H new ATOM 946 N LYS A 56 -5.644 -15.903 6.953 1.00 0.99 N ATOM 947 CA LYS A 56 -6.030 -15.548 5.573 1.00 0.95 C ATOM 948 C LYS A 56 -5.330 -14.276 5.053 1.00 0.78 C ATOM 949 O LYS A 56 -4.700 -13.530 5.810 1.00 0.81 O ATOM 950 CB LYS A 56 -7.568 -15.394 5.453 1.00 1.07 C ATOM 951 CG LYS A 56 -8.394 -16.546 6.056 1.00 1.58 C ATOM 952 CD LYS A 56 -9.909 -16.388 5.829 1.00 2.57 C ATOM 953 CE LYS A 56 -10.468 -15.195 6.620 1.00 4.09 C ATOM 954 NZ LYS A 56 -11.942 -15.065 6.508 1.00 5.23 N ATOM 0 H LYS A 56 -5.751 -15.136 7.616 1.00 0.99 H new ATOM 0 HA LYS A 56 -5.696 -16.374 4.945 1.00 0.95 H new ATOM 0 HB2 LYS A 56 -7.863 -14.464 5.940 1.00 1.07 H new ATOM 0 HB3 LYS A 56 -7.826 -15.297 4.398 1.00 1.07 H new ATOM 0 HG2 LYS A 56 -8.064 -17.489 5.620 1.00 1.58 H new ATOM 0 HG3 LYS A 56 -8.197 -16.604 7.127 1.00 1.58 H new ATOM 0 HD2 LYS A 56 -10.108 -16.248 4.766 1.00 2.57 H new ATOM 0 HD3 LYS A 56 -10.422 -17.301 6.132 1.00 2.57 H new ATOM 0 HE2 LYS A 56 -10.197 -15.303 7.670 1.00 4.09 H new ATOM 0 HE3 LYS A 56 -10.000 -14.278 6.263 1.00 4.09 H new ATOM 0 HZ1 LYS A 56 -12.289 -14.407 7.235 1.00 5.23 H new ATOM 0 HZ2 LYS A 56 -12.188 -14.701 5.565 1.00 5.23 H new ATOM 0 HZ3 LYS A 56 -12.384 -15.996 6.646 1.00 5.23 H new ATOM 968 N VAL A 57 -5.497 -14.021 3.753 1.00 0.71 N ATOM 969 CA VAL A 57 -5.059 -12.816 3.032 1.00 0.62 C ATOM 970 C VAL A 57 -6.218 -12.275 2.183 1.00 0.61 C ATOM 971 O VAL A 57 -6.957 -13.051 1.578 1.00 0.78 O ATOM 972 CB VAL A 57 -3.788 -13.097 2.191 1.00 0.72 C ATOM 973 CG1 VAL A 57 -3.977 -14.187 1.123 1.00 2.29 C ATOM 974 CG2 VAL A 57 -3.243 -11.831 1.518 1.00 1.89 C ATOM 0 H VAL A 57 -5.967 -14.685 3.138 1.00 0.71 H new ATOM 0 HA VAL A 57 -4.783 -12.046 3.752 1.00 0.62 H new ATOM 0 HB VAL A 57 -3.064 -13.464 2.919 1.00 0.72 H new ATOM 0 HG11 VAL A 57 -3.044 -14.326 0.576 1.00 2.29 H new ATOM 0 HG12 VAL A 57 -4.259 -15.123 1.605 1.00 2.29 H new ATOM 0 HG13 VAL A 57 -4.762 -13.885 0.430 1.00 2.29 H new ATOM 0 HG21 VAL A 57 -2.353 -12.080 0.941 1.00 1.89 H new ATOM 0 HG22 VAL A 57 -4.002 -11.417 0.854 1.00 1.89 H new ATOM 0 HG23 VAL A 57 -2.987 -11.095 2.280 1.00 1.89 H new ATOM 984 N ALA A 58 -6.375 -10.948 2.143 1.00 0.53 N ATOM 985 CA ALA A 58 -7.333 -10.248 1.280 1.00 0.54 C ATOM 986 C ALA A 58 -6.694 -8.985 0.687 1.00 0.49 C ATOM 987 O ALA A 58 -5.966 -8.279 1.389 1.00 0.52 O ATOM 988 CB ALA A 58 -8.596 -9.893 2.079 1.00 0.66 C ATOM 0 H ALA A 58 -5.826 -10.315 2.724 1.00 0.53 H new ATOM 0 HA ALA A 58 -7.615 -10.905 0.457 1.00 0.54 H new ATOM 0 HB1 ALA A 58 -9.302 -9.374 1.431 1.00 0.66 H new ATOM 0 HB2 ALA A 58 -9.055 -10.806 2.458 1.00 0.66 H new ATOM 0 HB3 ALA A 58 -8.328 -9.247 2.915 1.00 0.66 H new ATOM 994 N PHE A 59 -6.983 -8.704 -0.586 1.00 0.54 N ATOM 995 CA PHE A 59 -6.390 -7.612 -1.362 1.00 0.50 C ATOM 996 C PHE A 59 -7.443 -6.845 -2.177 1.00 0.49 C ATOM 997 O PHE A 59 -8.405 -7.425 -2.686 1.00 0.53 O ATOM 998 CB PHE A 59 -5.246 -8.158 -2.240 1.00 0.48 C ATOM 999 CG PHE A 59 -5.491 -9.491 -2.937 1.00 0.51 C ATOM 1000 CD1 PHE A 59 -6.360 -9.572 -4.043 1.00 1.71 C ATOM 1001 CD2 PHE A 59 -4.796 -10.647 -2.522 1.00 1.97 C ATOM 1002 CE1 PHE A 59 -6.554 -10.797 -4.708 1.00 1.73 C ATOM 1003 CE2 PHE A 59 -4.990 -11.872 -3.186 1.00 1.99 C ATOM 1004 CZ PHE A 59 -5.873 -11.948 -4.277 1.00 0.67 C ATOM 0 H PHE A 59 -7.658 -9.248 -1.123 1.00 0.54 H new ATOM 0 HA PHE A 59 -5.967 -6.883 -0.670 1.00 0.50 H new ATOM 0 HB2 PHE A 59 -5.018 -7.413 -3.002 1.00 0.48 H new ATOM 0 HB3 PHE A 59 -4.358 -8.259 -1.616 1.00 0.48 H new ATOM 0 HD1 PHE A 59 -6.880 -8.689 -4.383 1.00 1.71 H new ATOM 0 HD2 PHE A 59 -4.111 -10.591 -1.689 1.00 1.97 H new ATOM 0 HE1 PHE A 59 -7.227 -10.852 -5.551 1.00 1.73 H new ATOM 0 HE2 PHE A 59 -4.460 -12.754 -2.857 1.00 1.99 H new ATOM 0 HZ PHE A 59 -6.028 -12.889 -4.783 1.00 0.67 H new ATOM 1014 N TYR A 60 -7.244 -5.530 -2.298 1.00 0.48 N ATOM 1015 CA TYR A 60 -8.159 -4.569 -2.927 1.00 0.54 C ATOM 1016 C TYR A 60 -7.375 -3.532 -3.759 1.00 0.55 C ATOM 1017 O TYR A 60 -6.378 -2.974 -3.287 1.00 0.57 O ATOM 1018 CB TYR A 60 -8.990 -3.865 -1.838 1.00 0.65 C ATOM 1019 CG TYR A 60 -9.734 -4.810 -0.909 1.00 0.66 C ATOM 1020 CD1 TYR A 60 -10.738 -5.653 -1.422 1.00 1.99 C ATOM 1021 CD2 TYR A 60 -9.394 -4.884 0.457 1.00 2.09 C ATOM 1022 CE1 TYR A 60 -11.385 -6.579 -0.584 1.00 2.08 C ATOM 1023 CE2 TYR A 60 -10.048 -5.797 1.306 1.00 2.04 C ATOM 1024 CZ TYR A 60 -11.045 -6.653 0.786 1.00 0.73 C ATOM 1025 OH TYR A 60 -11.678 -7.547 1.596 1.00 0.80 O ATOM 0 H TYR A 60 -6.399 -5.083 -1.943 1.00 0.48 H new ATOM 0 HA TYR A 60 -8.827 -5.105 -3.601 1.00 0.54 H new ATOM 0 HB2 TYR A 60 -8.328 -3.236 -1.243 1.00 0.65 H new ATOM 0 HB3 TYR A 60 -9.711 -3.204 -2.319 1.00 0.65 H new ATOM 0 HD1 TYR A 60 -11.013 -5.588 -2.464 1.00 1.99 H new ATOM 0 HD2 TYR A 60 -8.627 -4.236 0.855 1.00 2.09 H new ATOM 0 HE1 TYR A 60 -12.143 -7.234 -0.988 1.00 2.08 H new ATOM 0 HE2 TYR A 60 -9.788 -5.843 2.353 1.00 2.04 H new ATOM 0 HH TYR A 60 -11.326 -7.469 2.507 1.00 0.80 H new ATOM 1035 N THR A 61 -7.824 -3.271 -4.994 1.00 0.55 N ATOM 1036 CA THR A 61 -7.104 -2.472 -6.005 1.00 0.54 C ATOM 1037 C THR A 61 -7.991 -2.153 -7.207 1.00 0.59 C ATOM 1038 O THR A 61 -8.944 -2.879 -7.493 1.00 0.66 O ATOM 1039 CB THR A 61 -5.795 -3.172 -6.418 1.00 0.54 C ATOM 1040 OG1 THR A 61 -5.143 -2.395 -7.386 1.00 0.77 O ATOM 1041 CG2 THR A 61 -5.966 -4.571 -7.013 1.00 0.68 C ATOM 0 H THR A 61 -8.722 -3.618 -5.330 1.00 0.55 H new ATOM 0 HA THR A 61 -6.838 -1.515 -5.555 1.00 0.54 H new ATOM 0 HB THR A 61 -5.229 -3.279 -5.493 1.00 0.54 H new ATOM 0 HG1 THR A 61 -4.667 -2.982 -8.010 1.00 0.77 H new ATOM 0 HG21 THR A 61 -4.989 -4.979 -7.271 1.00 0.68 H new ATOM 0 HG22 THR A 61 -6.448 -5.221 -6.283 1.00 0.68 H new ATOM 0 HG23 THR A 61 -6.583 -4.512 -7.910 1.00 0.68 H new ATOM 1049 N ASN A 62 -7.657 -1.070 -7.914 1.00 0.59 N ATOM 1050 CA ASN A 62 -8.242 -0.688 -9.204 1.00 0.67 C ATOM 1051 C ASN A 62 -7.377 -1.118 -10.414 1.00 0.61 C ATOM 1052 O ASN A 62 -7.607 -0.663 -11.536 1.00 0.63 O ATOM 1053 CB ASN A 62 -8.580 0.819 -9.185 1.00 0.82 C ATOM 1054 CG ASN A 62 -10.030 1.043 -8.757 1.00 2.01 C ATOM 1055 OD1 ASN A 62 -10.965 0.637 -9.439 1.00 2.50 O ATOM 1056 ND2 ASN A 62 -10.272 1.678 -7.628 1.00 3.07 N ATOM 0 H ASN A 62 -6.947 -0.411 -7.593 1.00 0.59 H new ATOM 0 HA ASN A 62 -9.172 -1.239 -9.343 1.00 0.67 H new ATOM 0 HB2 ASN A 62 -7.909 1.338 -8.500 1.00 0.82 H new ATOM 0 HB3 ASN A 62 -8.418 1.245 -10.175 1.00 0.82 H new ATOM 0 HD21 ASN A 62 -11.234 1.830 -7.324 1.00 3.07 H new ATOM 0 HD22 ASN A 62 -9.497 2.017 -7.058 1.00 3.07 H new ATOM 1063 N TYR A 63 -6.411 -2.027 -10.218 1.00 0.58 N ATOM 1064 CA TYR A 63 -5.624 -2.644 -11.298 1.00 0.60 C ATOM 1065 C TYR A 63 -6.511 -3.271 -12.407 1.00 0.65 C ATOM 1066 O TYR A 63 -7.615 -3.749 -12.110 1.00 0.68 O ATOM 1067 CB TYR A 63 -4.751 -3.766 -10.707 1.00 0.61 C ATOM 1068 CG TYR A 63 -3.566 -3.423 -9.823 1.00 0.62 C ATOM 1069 CD1 TYR A 63 -2.999 -2.135 -9.791 1.00 1.59 C ATOM 1070 CD2 TYR A 63 -3.026 -4.442 -9.015 1.00 2.27 C ATOM 1071 CE1 TYR A 63 -1.931 -1.850 -8.920 1.00 1.56 C ATOM 1072 CE2 TYR A 63 -1.960 -4.167 -8.141 1.00 2.31 C ATOM 1073 CZ TYR A 63 -1.401 -2.868 -8.096 1.00 0.67 C ATOM 1074 OH TYR A 63 -0.357 -2.594 -7.264 1.00 0.75 O ATOM 0 H TYR A 63 -6.150 -2.360 -9.290 1.00 0.58 H new ATOM 0 HA TYR A 63 -5.025 -1.851 -11.746 1.00 0.60 H new ATOM 0 HB2 TYR A 63 -5.408 -4.417 -10.130 1.00 0.61 H new ATOM 0 HB3 TYR A 63 -4.372 -4.355 -11.542 1.00 0.61 H new ATOM 0 HD1 TYR A 63 -3.386 -1.362 -10.438 1.00 1.59 H new ATOM 0 HD2 TYR A 63 -3.433 -5.441 -9.067 1.00 2.27 H new ATOM 0 HE1 TYR A 63 -1.517 -0.853 -8.881 1.00 1.56 H new ATOM 0 HE2 TYR A 63 -1.568 -4.946 -7.504 1.00 2.31 H new ATOM 0 HH TYR A 63 -0.410 -3.169 -6.472 1.00 0.75 H new ATOM 1084 N PRO A 64 -6.034 -3.313 -13.671 1.00 0.67 N ATOM 1085 CA PRO A 64 -6.782 -3.868 -14.793 1.00 0.70 C ATOM 1086 C PRO A 64 -6.925 -5.385 -14.643 1.00 0.68 C ATOM 1087 O PRO A 64 -6.012 -6.054 -14.156 1.00 0.66 O ATOM 1088 CB PRO A 64 -6.007 -3.480 -16.058 1.00 0.72 C ATOM 1089 CG PRO A 64 -4.577 -3.242 -15.572 1.00 0.69 C ATOM 1090 CD PRO A 64 -4.752 -2.792 -14.124 1.00 0.68 C ATOM 0 HA PRO A 64 -7.798 -3.476 -14.840 1.00 0.70 H new ATOM 0 HB2 PRO A 64 -6.046 -4.272 -16.806 1.00 0.72 H new ATOM 0 HB3 PRO A 64 -6.424 -2.585 -16.520 1.00 0.72 H new ATOM 0 HG2 PRO A 64 -3.976 -4.149 -15.639 1.00 0.69 H new ATOM 0 HG3 PRO A 64 -4.073 -2.481 -16.169 1.00 0.69 H new ATOM 0 HD2 PRO A 64 -3.940 -3.169 -13.502 1.00 0.68 H new ATOM 0 HD3 PRO A 64 -4.730 -1.705 -14.052 1.00 0.68 H new ATOM 1098 N GLU A 65 -8.058 -5.942 -15.085 1.00 0.69 N ATOM 1099 CA GLU A 65 -8.363 -7.367 -14.916 1.00 0.68 C ATOM 1100 C GLU A 65 -7.329 -8.282 -15.596 1.00 0.65 C ATOM 1101 O GLU A 65 -7.079 -9.386 -15.120 1.00 0.64 O ATOM 1102 CB GLU A 65 -9.791 -7.665 -15.403 1.00 0.73 C ATOM 1103 CG GLU A 65 -9.921 -7.786 -16.928 1.00 0.77 C ATOM 1104 CD GLU A 65 -11.389 -7.956 -17.347 1.00 1.03 C ATOM 1105 OE1 GLU A 65 -11.903 -9.100 -17.318 1.00 2.46 O ATOM 1106 OE2 GLU A 65 -12.039 -6.949 -17.716 1.00 1.64 O ATOM 0 H GLU A 65 -8.788 -5.419 -15.569 1.00 0.69 H new ATOM 0 HA GLU A 65 -8.303 -7.590 -13.851 1.00 0.68 H new ATOM 0 HB2 GLU A 65 -10.133 -8.593 -14.945 1.00 0.73 H new ATOM 0 HB3 GLU A 65 -10.455 -6.874 -15.054 1.00 0.73 H new ATOM 0 HG2 GLU A 65 -9.505 -6.898 -17.403 1.00 0.77 H new ATOM 0 HG3 GLU A 65 -9.339 -8.638 -17.279 1.00 0.77 H new ATOM 1113 N ALA A 66 -6.683 -7.812 -16.668 1.00 0.65 N ATOM 1114 CA ALA A 66 -5.621 -8.534 -17.367 1.00 0.64 C ATOM 1115 C ALA A 66 -4.367 -8.707 -16.495 1.00 0.59 C ATOM 1116 O ALA A 66 -3.758 -9.777 -16.503 1.00 0.58 O ATOM 1117 CB ALA A 66 -5.311 -7.772 -18.661 1.00 0.67 C ATOM 0 H ALA A 66 -6.889 -6.902 -17.080 1.00 0.65 H new ATOM 0 HA ALA A 66 -5.957 -9.545 -17.599 1.00 0.64 H new ATOM 0 HB1 ALA A 66 -4.520 -8.287 -19.206 1.00 0.67 H new ATOM 0 HB2 ALA A 66 -6.207 -7.725 -19.279 1.00 0.67 H new ATOM 0 HB3 ALA A 66 -4.985 -6.761 -18.418 1.00 0.67 H new ATOM 1123 N TRP A 67 -4.027 -7.696 -15.688 1.00 0.57 N ATOM 1124 CA TRP A 67 -2.934 -7.767 -14.716 1.00 0.53 C ATOM 1125 C TRP A 67 -3.356 -8.563 -13.479 1.00 0.51 C ATOM 1126 O TRP A 67 -2.596 -9.399 -12.999 1.00 0.50 O ATOM 1127 CB TRP A 67 -2.489 -6.349 -14.329 1.00 0.53 C ATOM 1128 CG TRP A 67 -1.405 -6.256 -13.295 1.00 0.53 C ATOM 1129 CD1 TRP A 67 -1.451 -5.460 -12.203 1.00 0.66 C ATOM 1130 CD2 TRP A 67 -0.115 -6.950 -13.219 1.00 0.50 C ATOM 1131 NE1 TRP A 67 -0.306 -5.617 -11.454 1.00 0.68 N ATOM 1132 CE2 TRP A 67 0.572 -6.487 -12.053 1.00 0.58 C ATOM 1133 CE3 TRP A 67 0.558 -7.918 -14.001 1.00 0.50 C ATOM 1134 CZ2 TRP A 67 1.868 -6.902 -11.720 1.00 0.66 C ATOM 1135 CZ3 TRP A 67 1.818 -8.404 -13.613 1.00 0.59 C ATOM 1136 CH2 TRP A 67 2.497 -7.863 -12.516 1.00 0.68 C ATOM 0 H TRP A 67 -4.509 -6.797 -15.693 1.00 0.57 H new ATOM 0 HA TRP A 67 -2.091 -8.287 -15.172 1.00 0.53 H new ATOM 0 HB2 TRP A 67 -2.148 -5.838 -15.230 1.00 0.53 H new ATOM 0 HB3 TRP A 67 -3.359 -5.804 -13.964 1.00 0.53 H new ATOM 0 HD1 TRP A 67 -2.267 -4.798 -11.954 1.00 0.66 H new ATOM 0 HE1 TRP A 67 -0.132 -5.146 -10.566 1.00 0.68 H new ATOM 0 HE3 TRP A 67 0.098 -8.287 -14.906 1.00 0.50 H new ATOM 0 HZ2 TRP A 67 2.373 -6.486 -10.861 1.00 0.66 H new ATOM 0 HZ3 TRP A 67 2.271 -9.210 -14.172 1.00 0.59 H new ATOM 0 HH2 TRP A 67 3.501 -8.186 -12.286 1.00 0.68 H new ATOM 1147 N VAL A 68 -4.581 -8.340 -12.994 1.00 0.53 N ATOM 1148 CA VAL A 68 -5.112 -8.984 -11.780 1.00 0.53 C ATOM 1149 C VAL A 68 -5.316 -10.488 -11.985 1.00 0.57 C ATOM 1150 O VAL A 68 -5.003 -11.273 -11.089 1.00 0.59 O ATOM 1151 CB VAL A 68 -6.428 -8.307 -11.332 1.00 0.56 C ATOM 1152 CG1 VAL A 68 -7.158 -9.050 -10.206 1.00 0.60 C ATOM 1153 CG2 VAL A 68 -6.155 -6.879 -10.845 1.00 0.58 C ATOM 0 H VAL A 68 -5.242 -7.701 -13.435 1.00 0.53 H new ATOM 0 HA VAL A 68 -4.373 -8.857 -10.989 1.00 0.53 H new ATOM 0 HB VAL A 68 -7.068 -8.318 -12.214 1.00 0.56 H new ATOM 0 HG11 VAL A 68 -8.071 -8.513 -9.948 1.00 0.60 H new ATOM 0 HG12 VAL A 68 -7.411 -10.057 -10.539 1.00 0.60 H new ATOM 0 HG13 VAL A 68 -6.512 -9.109 -9.330 1.00 0.60 H new ATOM 0 HG21 VAL A 68 -7.091 -6.416 -10.533 1.00 0.58 H new ATOM 0 HG22 VAL A 68 -5.466 -6.908 -10.001 1.00 0.58 H new ATOM 0 HG23 VAL A 68 -5.714 -6.297 -11.654 1.00 0.58 H new ATOM 1163 N SER A 69 -5.810 -10.905 -13.154 1.00 0.61 N ATOM 1164 CA SER A 69 -5.892 -12.326 -13.505 1.00 0.66 C ATOM 1165 C SER A 69 -4.500 -12.937 -13.684 1.00 0.64 C ATOM 1166 O SER A 69 -4.215 -13.958 -13.073 1.00 0.66 O ATOM 1167 CB SER A 69 -6.734 -12.526 -14.770 1.00 0.71 C ATOM 1168 OG SER A 69 -7.042 -13.900 -14.963 1.00 0.77 O ATOM 0 H SER A 69 -6.161 -10.276 -13.876 1.00 0.61 H new ATOM 0 HA SER A 69 -6.381 -12.843 -12.679 1.00 0.66 H new ATOM 0 HB2 SER A 69 -7.656 -11.950 -14.693 1.00 0.71 H new ATOM 0 HB3 SER A 69 -6.192 -12.146 -15.636 1.00 0.71 H new ATOM 0 HG SER A 69 -7.581 -14.003 -15.775 1.00 0.77 H new ATOM 1174 N TYR A 70 -3.592 -12.307 -14.442 1.00 0.61 N ATOM 1175 CA TYR A 70 -2.239 -12.832 -14.677 1.00 0.61 C ATOM 1176 C TYR A 70 -1.448 -13.006 -13.372 1.00 0.55 C ATOM 1177 O TYR A 70 -0.823 -14.047 -13.164 1.00 0.57 O ATOM 1178 CB TYR A 70 -1.529 -11.886 -15.649 1.00 0.62 C ATOM 1179 CG TYR A 70 -0.103 -12.279 -15.955 1.00 0.64 C ATOM 1180 CD1 TYR A 70 0.160 -13.400 -16.760 1.00 2.21 C ATOM 1181 CD2 TYR A 70 0.957 -11.529 -15.423 1.00 1.79 C ATOM 1182 CE1 TYR A 70 1.489 -13.771 -17.038 1.00 2.25 C ATOM 1183 CE2 TYR A 70 2.288 -11.873 -15.719 1.00 1.79 C ATOM 1184 CZ TYR A 70 2.560 -13.000 -16.529 1.00 0.73 C ATOM 1185 OH TYR A 70 3.846 -13.342 -16.821 1.00 0.79 O ATOM 0 H TYR A 70 -3.774 -11.419 -14.910 1.00 0.61 H new ATOM 0 HA TYR A 70 -2.307 -13.830 -15.111 1.00 0.61 H new ATOM 0 HB2 TYR A 70 -2.093 -11.848 -16.581 1.00 0.62 H new ATOM 0 HB3 TYR A 70 -1.536 -10.879 -15.231 1.00 0.62 H new ATOM 0 HD1 TYR A 70 -0.658 -13.977 -17.166 1.00 2.21 H new ATOM 0 HD2 TYR A 70 0.750 -10.684 -14.783 1.00 1.79 H new ATOM 0 HE1 TYR A 70 1.691 -14.645 -17.640 1.00 2.25 H new ATOM 0 HE2 TYR A 70 3.100 -11.278 -15.329 1.00 1.79 H new ATOM 0 HH TYR A 70 4.458 -12.708 -16.393 1.00 0.79 H new ATOM 1195 N TYR A 71 -1.543 -12.036 -12.459 1.00 0.49 N ATOM 1196 CA TYR A 71 -0.922 -12.080 -11.137 1.00 0.45 C ATOM 1197 C TYR A 71 -1.424 -13.273 -10.304 1.00 0.49 C ATOM 1198 O TYR A 71 -0.632 -14.002 -9.708 1.00 0.52 O ATOM 1199 CB TYR A 71 -1.168 -10.731 -10.442 1.00 0.43 C ATOM 1200 CG TYR A 71 -0.425 -10.546 -9.134 1.00 0.73 C ATOM 1201 CD1 TYR A 71 -0.875 -11.196 -7.969 1.00 1.48 C ATOM 1202 CD2 TYR A 71 0.710 -9.713 -9.073 1.00 2.15 C ATOM 1203 CE1 TYR A 71 -0.179 -11.038 -6.760 1.00 1.68 C ATOM 1204 CE2 TYR A 71 1.400 -9.541 -7.857 1.00 2.65 C ATOM 1205 CZ TYR A 71 0.963 -10.215 -6.697 1.00 1.89 C ATOM 1206 OH TYR A 71 1.614 -10.059 -5.514 1.00 2.49 O ATOM 0 H TYR A 71 -2.068 -11.177 -12.625 1.00 0.49 H new ATOM 0 HA TYR A 71 0.152 -12.236 -11.241 1.00 0.45 H new ATOM 0 HB2 TYR A 71 -0.882 -9.930 -11.123 1.00 0.43 H new ATOM 0 HB3 TYR A 71 -2.237 -10.624 -10.255 1.00 0.43 H new ATOM 0 HD1 TYR A 71 -1.758 -11.817 -8.005 1.00 1.48 H new ATOM 0 HD2 TYR A 71 1.052 -9.204 -9.962 1.00 2.15 H new ATOM 0 HE1 TYR A 71 -0.521 -11.550 -5.873 1.00 1.68 H new ATOM 0 HE2 TYR A 71 2.263 -8.893 -7.813 1.00 2.65 H new ATOM 0 HH TYR A 71 2.342 -9.412 -5.624 1.00 2.49 H new ATOM 1216 N GLN A 72 -2.738 -13.497 -10.283 1.00 0.55 N ATOM 1217 CA GLN A 72 -3.362 -14.612 -9.564 1.00 0.63 C ATOM 1218 C GLN A 72 -3.126 -15.972 -10.244 1.00 0.70 C ATOM 1219 O GLN A 72 -2.866 -16.960 -9.561 1.00 0.75 O ATOM 1220 CB GLN A 72 -4.862 -14.308 -9.417 1.00 0.68 C ATOM 1221 CG GLN A 72 -5.111 -13.322 -8.262 1.00 0.70 C ATOM 1222 CD GLN A 72 -6.601 -13.050 -8.068 1.00 1.12 C ATOM 1223 OE1 GLN A 72 -7.273 -13.650 -7.237 1.00 1.36 O ATOM 1224 NE2 GLN A 72 -7.182 -12.157 -8.840 1.00 2.40 N ATOM 0 H GLN A 72 -3.409 -12.903 -10.770 1.00 0.55 H new ATOM 0 HA GLN A 72 -2.897 -14.699 -8.582 1.00 0.63 H new ATOM 0 HB2 GLN A 72 -5.245 -13.889 -10.347 1.00 0.68 H new ATOM 0 HB3 GLN A 72 -5.409 -15.233 -9.235 1.00 0.68 H new ATOM 0 HG2 GLN A 72 -4.691 -13.726 -7.341 1.00 0.70 H new ATOM 0 HG3 GLN A 72 -4.593 -12.385 -8.464 1.00 0.70 H new ATOM 0 HE21 GLN A 72 -6.634 -11.651 -9.536 1.00 2.40 H new ATOM 0 HE22 GLN A 72 -8.180 -11.971 -8.743 1.00 2.40 H new ATOM 1233 N ALA A 73 -3.199 -16.034 -11.576 1.00 0.72 N ATOM 1234 CA ALA A 73 -3.212 -17.275 -12.358 1.00 0.81 C ATOM 1235 C ALA A 73 -1.838 -17.967 -12.408 1.00 0.79 C ATOM 1236 O ALA A 73 -1.752 -19.194 -12.364 1.00 0.85 O ATOM 1237 CB ALA A 73 -3.733 -16.937 -13.764 1.00 0.91 C ATOM 0 H ALA A 73 -3.252 -15.198 -12.158 1.00 0.72 H new ATOM 0 HA ALA A 73 -3.870 -17.996 -11.873 1.00 0.81 H new ATOM 0 HB1 ALA A 73 -3.754 -17.842 -14.371 1.00 0.91 H new ATOM 0 HB2 ALA A 73 -4.740 -16.526 -13.690 1.00 0.91 H new ATOM 0 HB3 ALA A 73 -3.075 -16.203 -14.229 1.00 0.91 H new ATOM 1243 N LYS A 74 -0.762 -17.177 -12.480 1.00 0.73 N ATOM 1244 CA LYS A 74 0.635 -17.628 -12.371 1.00 0.76 C ATOM 1245 C LYS A 74 1.152 -17.649 -10.914 1.00 0.72 C ATOM 1246 O LYS A 74 2.303 -18.014 -10.666 1.00 0.76 O ATOM 1247 CB LYS A 74 1.473 -16.714 -13.281 1.00 0.82 C ATOM 1248 CG LYS A 74 1.684 -17.232 -14.711 1.00 0.93 C ATOM 1249 CD LYS A 74 0.471 -17.769 -15.486 1.00 1.09 C ATOM 1250 CE LYS A 74 -0.470 -16.644 -15.927 1.00 1.49 C ATOM 1251 NZ LYS A 74 -1.606 -17.173 -16.731 1.00 1.87 N ATOM 0 H LYS A 74 -0.839 -16.170 -12.621 1.00 0.73 H new ATOM 0 HA LYS A 74 0.717 -18.666 -12.695 1.00 0.76 H new ATOM 0 HB2 LYS A 74 0.990 -15.738 -13.333 1.00 0.82 H new ATOM 0 HB3 LYS A 74 2.448 -16.563 -12.819 1.00 0.82 H new ATOM 0 HG2 LYS A 74 2.118 -16.421 -15.296 1.00 0.93 H new ATOM 0 HG3 LYS A 74 2.428 -18.028 -14.668 1.00 0.93 H new ATOM 0 HD2 LYS A 74 0.815 -18.319 -16.362 1.00 1.09 H new ATOM 0 HD3 LYS A 74 -0.076 -18.475 -14.861 1.00 1.09 H new ATOM 0 HE2 LYS A 74 -0.854 -16.123 -15.050 1.00 1.49 H new ATOM 0 HE3 LYS A 74 0.085 -15.912 -16.515 1.00 1.49 H new ATOM 0 HZ1 LYS A 74 -2.226 -16.388 -17.015 1.00 1.87 H new ATOM 0 HZ2 LYS A 74 -1.239 -17.649 -17.580 1.00 1.87 H new ATOM 0 HZ3 LYS A 74 -2.148 -17.853 -16.161 1.00 1.87 H new ATOM 1265 N ASN A 75 0.305 -17.261 -9.953 1.00 0.68 N ATOM 1266 CA ASN A 75 0.535 -17.322 -8.503 1.00 0.69 C ATOM 1267 C ASN A 75 1.698 -16.416 -8.046 1.00 0.58 C ATOM 1268 O ASN A 75 2.567 -16.828 -7.274 1.00 0.57 O ATOM 1269 CB ASN A 75 0.681 -18.779 -8.025 1.00 0.87 C ATOM 1270 CG ASN A 75 -0.478 -19.676 -8.452 1.00 1.14 C ATOM 1271 OD1 ASN A 75 -0.349 -20.500 -9.350 1.00 2.01 O ATOM 1272 ND2 ASN A 75 -1.634 -19.547 -7.826 1.00 1.46 N ATOM 0 H ASN A 75 -0.611 -16.874 -10.178 1.00 0.68 H new ATOM 0 HA ASN A 75 -0.351 -16.915 -8.016 1.00 0.69 H new ATOM 0 HB2 ASN A 75 1.612 -19.190 -8.415 1.00 0.87 H new ATOM 0 HB3 ASN A 75 0.759 -18.791 -6.938 1.00 0.87 H new ATOM 0 HD21 ASN A 75 -2.425 -20.135 -8.089 1.00 1.46 H new ATOM 0 HD22 ASN A 75 -1.736 -18.860 -7.079 1.00 1.46 H new ATOM 1279 N PHE A 76 1.726 -15.163 -8.515 1.00 0.52 N ATOM 1280 CA PHE A 76 2.799 -14.202 -8.236 1.00 0.47 C ATOM 1281 C PHE A 76 2.918 -13.806 -6.755 1.00 0.47 C ATOM 1282 O PHE A 76 3.974 -13.311 -6.355 1.00 0.47 O ATOM 1283 CB PHE A 76 2.633 -12.977 -9.142 1.00 0.45 C ATOM 1284 CG PHE A 76 3.215 -13.160 -10.533 1.00 0.48 C ATOM 1285 CD1 PHE A 76 4.571 -12.865 -10.752 1.00 2.01 C ATOM 1286 CD2 PHE A 76 2.423 -13.604 -11.608 1.00 2.13 C ATOM 1287 CE1 PHE A 76 5.123 -12.960 -12.041 1.00 2.01 C ATOM 1288 CE2 PHE A 76 2.967 -13.673 -12.902 1.00 2.16 C ATOM 1289 CZ PHE A 76 4.315 -13.349 -13.120 1.00 0.59 C ATOM 0 H PHE A 76 0.990 -14.782 -9.110 1.00 0.52 H new ATOM 0 HA PHE A 76 3.742 -14.699 -8.461 1.00 0.47 H new ATOM 0 HB2 PHE A 76 1.572 -12.743 -9.230 1.00 0.45 H new ATOM 0 HB3 PHE A 76 3.110 -12.119 -8.668 1.00 0.45 H new ATOM 0 HD1 PHE A 76 5.194 -12.563 -9.923 1.00 2.01 H new ATOM 0 HD2 PHE A 76 1.396 -13.892 -11.439 1.00 2.13 H new ATOM 0 HE1 PHE A 76 6.167 -12.734 -12.201 1.00 2.01 H new ATOM 0 HE2 PHE A 76 2.346 -13.976 -13.732 1.00 2.16 H new ATOM 0 HZ PHE A 76 4.729 -13.399 -14.116 1.00 0.59 H new ATOM 1299 N LEU A 77 1.924 -14.129 -5.911 1.00 0.52 N ATOM 1300 CA LEU A 77 2.067 -14.071 -4.449 1.00 0.58 C ATOM 1301 C LEU A 77 3.240 -14.924 -3.914 1.00 0.60 C ATOM 1302 O LEU A 77 3.707 -14.692 -2.801 1.00 0.70 O ATOM 1303 CB LEU A 77 0.751 -14.453 -3.736 1.00 0.62 C ATOM 1304 CG LEU A 77 -0.350 -13.373 -3.820 1.00 0.62 C ATOM 1305 CD1 LEU A 77 -1.420 -13.729 -4.863 1.00 1.35 C ATOM 1306 CD2 LEU A 77 -1.062 -13.152 -2.481 1.00 1.00 C ATOM 0 H LEU A 77 1.003 -14.436 -6.223 1.00 0.52 H new ATOM 0 HA LEU A 77 2.303 -13.032 -4.218 1.00 0.58 H new ATOM 0 HB2 LEU A 77 0.371 -15.378 -4.170 1.00 0.62 H new ATOM 0 HB3 LEU A 77 0.965 -14.657 -2.687 1.00 0.62 H new ATOM 0 HG LEU A 77 0.170 -12.460 -4.109 1.00 0.62 H new ATOM 0 HD11 LEU A 77 -2.176 -12.944 -4.891 1.00 1.35 H new ATOM 0 HD12 LEU A 77 -0.955 -13.820 -5.845 1.00 1.35 H new ATOM 0 HD13 LEU A 77 -1.889 -14.675 -4.594 1.00 1.35 H new ATOM 0 HD21 LEU A 77 -1.826 -12.383 -2.598 1.00 1.00 H new ATOM 0 HD22 LEU A 77 -1.530 -14.083 -2.160 1.00 1.00 H new ATOM 0 HD23 LEU A 77 -0.337 -12.833 -1.732 1.00 1.00 H new ATOM 1318 N ALA A 78 3.749 -15.884 -4.695 1.00 0.55 N ATOM 1319 CA ALA A 78 4.941 -16.666 -4.360 1.00 0.58 C ATOM 1320 C ALA A 78 6.275 -15.918 -4.576 1.00 0.55 C ATOM 1321 O ALA A 78 7.279 -16.313 -3.980 1.00 0.60 O ATOM 1322 CB ALA A 78 4.898 -17.955 -5.191 1.00 0.62 C ATOM 0 H ALA A 78 3.336 -16.142 -5.591 1.00 0.55 H new ATOM 0 HA ALA A 78 4.916 -16.875 -3.291 1.00 0.58 H new ATOM 0 HB1 ALA A 78 5.774 -18.563 -4.965 1.00 0.62 H new ATOM 0 HB2 ALA A 78 3.995 -18.515 -4.947 1.00 0.62 H new ATOM 0 HB3 ALA A 78 4.894 -17.704 -6.252 1.00 0.62 H new ATOM 1328 N ILE A 79 6.321 -14.875 -5.425 1.00 0.49 N ATOM 1329 CA ILE A 79 7.588 -14.235 -5.861 1.00 0.50 C ATOM 1330 C ILE A 79 7.658 -12.714 -5.641 1.00 0.50 C ATOM 1331 O ILE A 79 8.750 -12.147 -5.663 1.00 0.55 O ATOM 1332 CB ILE A 79 7.947 -14.626 -7.322 1.00 0.53 C ATOM 1333 CG1 ILE A 79 7.132 -13.942 -8.445 1.00 0.54 C ATOM 1334 CG2 ILE A 79 7.840 -16.146 -7.534 1.00 0.55 C ATOM 1335 CD1 ILE A 79 7.701 -12.589 -8.884 1.00 0.52 C ATOM 0 H ILE A 79 5.487 -14.449 -5.830 1.00 0.49 H new ATOM 0 HA ILE A 79 8.351 -14.640 -5.196 1.00 0.50 H new ATOM 0 HB ILE A 79 8.970 -14.262 -7.416 1.00 0.53 H new ATOM 0 HG12 ILE A 79 7.092 -14.606 -9.308 1.00 0.54 H new ATOM 0 HG13 ILE A 79 6.107 -13.801 -8.103 1.00 0.54 H new ATOM 0 HG21 ILE A 79 8.097 -16.389 -8.565 1.00 0.55 H new ATOM 0 HG22 ILE A 79 8.527 -16.657 -6.859 1.00 0.55 H new ATOM 0 HG23 ILE A 79 6.820 -16.471 -7.328 1.00 0.55 H new ATOM 0 HD11 ILE A 79 7.077 -12.171 -9.674 1.00 0.52 H new ATOM 0 HD12 ILE A 79 7.716 -11.907 -8.034 1.00 0.52 H new ATOM 0 HD13 ILE A 79 8.716 -12.725 -9.258 1.00 0.52 H new ATOM 1347 N ASP A 80 6.528 -12.048 -5.403 1.00 0.49 N ATOM 1348 CA ASP A 80 6.448 -10.609 -5.135 1.00 0.54 C ATOM 1349 C ASP A 80 6.971 -10.297 -3.709 1.00 0.52 C ATOM 1350 O ASP A 80 6.506 -10.928 -2.753 1.00 0.57 O ATOM 1351 CB ASP A 80 4.982 -10.185 -5.336 1.00 0.65 C ATOM 1352 CG ASP A 80 4.683 -8.695 -5.125 1.00 0.97 C ATOM 1353 OD1 ASP A 80 5.458 -8.003 -4.426 1.00 2.10 O ATOM 1354 OD2 ASP A 80 3.637 -8.243 -5.642 1.00 1.74 O ATOM 0 H ASP A 80 5.617 -12.506 -5.391 1.00 0.49 H new ATOM 0 HA ASP A 80 7.079 -10.040 -5.818 1.00 0.54 H new ATOM 0 HB2 ASP A 80 4.680 -10.457 -6.347 1.00 0.65 H new ATOM 0 HB3 ASP A 80 4.360 -10.762 -4.652 1.00 0.65 H new ATOM 1359 N PRO A 81 7.907 -9.337 -3.527 1.00 0.53 N ATOM 1360 CA PRO A 81 8.477 -9.036 -2.219 1.00 0.60 C ATOM 1361 C PRO A 81 7.590 -8.115 -1.367 1.00 0.61 C ATOM 1362 O PRO A 81 7.800 -8.051 -0.159 1.00 0.67 O ATOM 1363 CB PRO A 81 9.822 -8.375 -2.525 1.00 0.64 C ATOM 1364 CG PRO A 81 9.556 -7.626 -3.829 1.00 0.60 C ATOM 1365 CD PRO A 81 8.527 -8.499 -4.548 1.00 0.55 C ATOM 0 HA PRO A 81 8.575 -9.943 -1.623 1.00 0.60 H new ATOM 0 HB2 PRO A 81 10.128 -7.698 -1.727 1.00 0.64 H new ATOM 0 HB3 PRO A 81 10.616 -9.113 -2.640 1.00 0.64 H new ATOM 0 HG2 PRO A 81 9.170 -6.624 -3.643 1.00 0.60 H new ATOM 0 HG3 PRO A 81 10.466 -7.513 -4.418 1.00 0.60 H new ATOM 0 HD2 PRO A 81 7.780 -7.884 -5.051 1.00 0.55 H new ATOM 0 HD3 PRO A 81 9.005 -9.110 -5.314 1.00 0.55 H new ATOM 1373 N VAL A 82 6.605 -7.415 -1.947 1.00 0.59 N ATOM 1374 CA VAL A 82 5.786 -6.399 -1.265 1.00 0.62 C ATOM 1375 C VAL A 82 4.804 -7.015 -0.244 1.00 0.65 C ATOM 1376 O VAL A 82 4.335 -6.326 0.660 1.00 0.78 O ATOM 1377 CB VAL A 82 5.084 -5.525 -2.337 1.00 0.74 C ATOM 1378 CG1 VAL A 82 3.936 -4.661 -1.820 1.00 1.97 C ATOM 1379 CG2 VAL A 82 6.137 -4.681 -3.085 1.00 2.29 C ATOM 0 H VAL A 82 6.348 -7.541 -2.926 1.00 0.59 H new ATOM 0 HA VAL A 82 6.433 -5.760 -0.665 1.00 0.62 H new ATOM 0 HB VAL A 82 4.600 -6.218 -3.025 1.00 0.74 H new ATOM 0 HG11 VAL A 82 3.511 -4.089 -2.645 1.00 1.97 H new ATOM 0 HG12 VAL A 82 3.166 -5.300 -1.388 1.00 1.97 H new ATOM 0 HG13 VAL A 82 4.310 -3.977 -1.058 1.00 1.97 H new ATOM 0 HG21 VAL A 82 5.643 -4.067 -3.838 1.00 2.29 H new ATOM 0 HG22 VAL A 82 6.657 -4.037 -2.376 1.00 2.29 H new ATOM 0 HG23 VAL A 82 6.855 -5.342 -3.570 1.00 2.29 H new ATOM 1389 N LEU A 83 4.548 -8.326 -0.324 1.00 0.65 N ATOM 1390 CA LEU A 83 3.753 -9.070 0.665 1.00 0.73 C ATOM 1391 C LEU A 83 4.589 -9.775 1.749 1.00 0.70 C ATOM 1392 O LEU A 83 4.025 -10.277 2.722 1.00 0.74 O ATOM 1393 CB LEU A 83 2.810 -10.022 -0.092 1.00 0.82 C ATOM 1394 CG LEU A 83 3.520 -11.165 -0.848 1.00 0.83 C ATOM 1395 CD1 LEU A 83 3.460 -12.477 -0.054 1.00 0.85 C ATOM 1396 CD2 LEU A 83 2.880 -11.353 -2.225 1.00 1.30 C ATOM 0 H LEU A 83 4.891 -8.909 -1.087 1.00 0.65 H new ATOM 0 HA LEU A 83 3.164 -8.356 1.241 1.00 0.73 H new ATOM 0 HB2 LEU A 83 2.107 -10.456 0.619 1.00 0.82 H new ATOM 0 HB3 LEU A 83 2.225 -9.441 -0.805 1.00 0.82 H new ATOM 0 HG LEU A 83 4.569 -10.894 -0.971 1.00 0.83 H new ATOM 0 HD11 LEU A 83 3.968 -13.263 -0.612 1.00 0.85 H new ATOM 0 HD12 LEU A 83 3.950 -12.341 0.910 1.00 0.85 H new ATOM 0 HD13 LEU A 83 2.419 -12.759 0.104 1.00 0.85 H new ATOM 0 HD21 LEU A 83 3.385 -12.161 -2.754 1.00 1.30 H new ATOM 0 HD22 LEU A 83 1.825 -11.601 -2.105 1.00 1.30 H new ATOM 0 HD23 LEU A 83 2.973 -10.431 -2.798 1.00 1.30 H new ATOM 1408 N ASN A 84 5.916 -9.822 1.599 1.00 0.69 N ATOM 1409 CA ASN A 84 6.832 -10.554 2.479 1.00 0.68 C ATOM 1410 C ASN A 84 7.628 -9.598 3.396 1.00 0.66 C ATOM 1411 O ASN A 84 8.514 -8.901 2.892 1.00 0.70 O ATOM 1412 CB ASN A 84 7.781 -11.395 1.605 1.00 0.79 C ATOM 1413 CG ASN A 84 7.314 -12.843 1.511 1.00 1.64 C ATOM 1414 OD1 ASN A 84 6.778 -13.284 0.502 1.00 2.99 O ATOM 1415 ND2 ASN A 84 7.486 -13.617 2.567 1.00 2.63 N ATOM 0 H ASN A 84 6.396 -9.338 0.840 1.00 0.69 H new ATOM 0 HA ASN A 84 6.254 -11.206 3.134 1.00 0.68 H new ATOM 0 HB2 ASN A 84 7.836 -10.963 0.606 1.00 0.79 H new ATOM 0 HB3 ASN A 84 8.787 -11.362 2.022 1.00 0.79 H new ATOM 0 HD21 ASN A 84 7.172 -14.587 2.545 1.00 2.63 H new ATOM 0 HD22 ASN A 84 7.933 -13.245 3.405 1.00 2.63 H new ATOM 1422 N PRO A 85 7.371 -9.566 4.724 1.00 0.71 N ATOM 1423 CA PRO A 85 7.996 -8.610 5.645 1.00 0.82 C ATOM 1424 C PRO A 85 9.517 -8.784 5.796 1.00 0.81 C ATOM 1425 O PRO A 85 10.187 -7.860 6.250 1.00 0.93 O ATOM 1426 CB PRO A 85 7.271 -8.792 6.982 1.00 0.95 C ATOM 1427 CG PRO A 85 6.768 -10.230 6.929 1.00 0.91 C ATOM 1428 CD PRO A 85 6.428 -10.406 5.452 1.00 0.82 C ATOM 0 HA PRO A 85 7.894 -7.598 5.252 1.00 0.82 H new ATOM 0 HB2 PRO A 85 7.942 -8.634 7.826 1.00 0.95 H new ATOM 0 HB3 PRO A 85 6.449 -8.084 7.091 1.00 0.95 H new ATOM 0 HG2 PRO A 85 7.528 -10.938 7.258 1.00 0.91 H new ATOM 0 HG3 PRO A 85 5.897 -10.379 7.567 1.00 0.91 H new ATOM 0 HD2 PRO A 85 6.521 -11.450 5.151 1.00 0.82 H new ATOM 0 HD3 PRO A 85 5.400 -10.106 5.249 1.00 0.82 H new ATOM 1436 N GLU A 86 10.077 -9.929 5.389 1.00 0.77 N ATOM 1437 CA GLU A 86 11.518 -10.210 5.418 1.00 0.90 C ATOM 1438 C GLU A 86 12.336 -9.259 4.526 1.00 0.92 C ATOM 1439 O GLU A 86 13.508 -9.000 4.806 1.00 1.06 O ATOM 1440 CB GLU A 86 11.785 -11.658 4.981 1.00 1.02 C ATOM 1441 CG GLU A 86 11.039 -12.692 5.836 1.00 1.21 C ATOM 1442 CD GLU A 86 9.759 -13.209 5.159 1.00 2.22 C ATOM 1443 OE1 GLU A 86 8.949 -12.383 4.672 1.00 3.69 O ATOM 1444 OE2 GLU A 86 9.556 -14.444 5.110 1.00 2.81 O ATOM 0 H GLU A 86 9.527 -10.705 5.021 1.00 0.77 H new ATOM 0 HA GLU A 86 11.840 -10.054 6.448 1.00 0.90 H new ATOM 0 HB2 GLU A 86 11.490 -11.777 3.938 1.00 1.02 H new ATOM 0 HB3 GLU A 86 12.856 -11.856 5.034 1.00 1.02 H new ATOM 0 HG2 GLU A 86 11.701 -13.533 6.042 1.00 1.21 H new ATOM 0 HG3 GLU A 86 10.782 -12.246 6.797 1.00 1.21 H new ATOM 1451 N ASN A 87 11.729 -8.727 3.457 1.00 0.81 N ATOM 1452 CA ASN A 87 12.387 -7.816 2.514 1.00 0.83 C ATOM 1453 C ASN A 87 12.389 -6.345 2.998 1.00 0.86 C ATOM 1454 O ASN A 87 13.221 -5.547 2.559 1.00 0.92 O ATOM 1455 CB ASN A 87 11.705 -7.978 1.145 1.00 0.83 C ATOM 1456 CG ASN A 87 12.594 -7.485 0.005 1.00 1.22 C ATOM 1457 OD1 ASN A 87 12.569 -6.326 -0.383 1.00 2.49 O ATOM 1458 ND2 ASN A 87 13.416 -8.352 -0.561 1.00 1.65 N ATOM 0 H ASN A 87 10.756 -8.920 3.221 1.00 0.81 H new ATOM 0 HA ASN A 87 13.442 -8.081 2.437 1.00 0.83 H new ATOM 0 HB2 ASN A 87 11.457 -9.027 0.985 1.00 0.83 H new ATOM 0 HB3 ASN A 87 10.766 -7.424 1.139 1.00 0.83 H new ATOM 0 HD21 ASN A 87 14.028 -8.054 -1.320 1.00 1.65 H new ATOM 0 HD22 ASN A 87 13.438 -9.319 -0.238 1.00 1.65 H new ATOM 1465 N PHE A 88 11.492 -5.984 3.929 1.00 0.84 N ATOM 1466 CA PHE A 88 11.293 -4.624 4.452 1.00 0.90 C ATOM 1467 C PHE A 88 12.366 -4.280 5.504 1.00 1.01 C ATOM 1468 O PHE A 88 12.084 -4.140 6.695 1.00 1.06 O ATOM 1469 CB PHE A 88 9.869 -4.492 5.036 1.00 0.84 C ATOM 1470 CG PHE A 88 8.744 -4.524 4.023 1.00 0.69 C ATOM 1471 CD1 PHE A 88 8.399 -5.727 3.387 1.00 1.82 C ATOM 1472 CD2 PHE A 88 8.056 -3.342 3.691 1.00 1.75 C ATOM 1473 CE1 PHE A 88 7.370 -5.761 2.431 1.00 1.77 C ATOM 1474 CE2 PHE A 88 7.027 -3.369 2.738 1.00 1.75 C ATOM 1475 CZ PHE A 88 6.685 -4.576 2.106 1.00 0.50 C ATOM 0 H PHE A 88 10.859 -6.661 4.356 1.00 0.84 H new ATOM 0 HA PHE A 88 11.398 -3.910 3.635 1.00 0.90 H new ATOM 0 HB2 PHE A 88 9.713 -5.299 5.752 1.00 0.84 H new ATOM 0 HB3 PHE A 88 9.808 -3.556 5.591 1.00 0.84 H new ATOM 0 HD1 PHE A 88 8.929 -6.635 3.635 1.00 1.82 H new ATOM 0 HD2 PHE A 88 8.321 -2.412 4.171 1.00 1.75 H new ATOM 0 HE1 PHE A 88 7.107 -6.691 1.949 1.00 1.77 H new ATOM 0 HE2 PHE A 88 6.497 -2.461 2.490 1.00 1.75 H new ATOM 0 HZ PHE A 88 5.895 -4.594 1.370 1.00 0.50 H new ATOM 1485 N SER A 89 13.621 -4.149 5.076 1.00 1.06 N ATOM 1486 CA SER A 89 14.782 -4.054 5.987 1.00 1.16 C ATOM 1487 C SER A 89 14.877 -2.713 6.746 1.00 1.26 C ATOM 1488 O SER A 89 15.550 -2.627 7.775 1.00 1.38 O ATOM 1489 CB SER A 89 16.088 -4.312 5.219 1.00 1.18 C ATOM 1490 OG SER A 89 16.184 -5.661 4.773 1.00 1.08 O ATOM 0 H SER A 89 13.871 -4.105 4.088 1.00 1.06 H new ATOM 0 HA SER A 89 14.629 -4.825 6.743 1.00 1.16 H new ATOM 0 HB2 SER A 89 16.143 -3.641 4.362 1.00 1.18 H new ATOM 0 HB3 SER A 89 16.938 -4.080 5.860 1.00 1.18 H new ATOM 0 HG SER A 89 17.026 -5.786 4.288 1.00 1.08 H new ATOM 1496 N GLN A 90 14.178 -1.675 6.272 1.00 1.22 N ATOM 1497 CA GLN A 90 13.964 -0.396 6.968 1.00 1.30 C ATOM 1498 C GLN A 90 12.460 -0.144 7.231 1.00 1.12 C ATOM 1499 O GLN A 90 12.031 1.005 7.367 1.00 1.11 O ATOM 1500 CB GLN A 90 14.618 0.738 6.149 1.00 1.45 C ATOM 1501 CG GLN A 90 16.159 0.715 6.188 1.00 1.62 C ATOM 1502 CD GLN A 90 16.767 1.091 7.548 1.00 1.37 C ATOM 1503 OE1 GLN A 90 16.094 1.429 8.517 1.00 2.04 O ATOM 1504 NE2 GLN A 90 18.079 1.061 7.680 1.00 2.23 N ATOM 0 H GLN A 90 13.727 -1.702 5.357 1.00 1.22 H new ATOM 0 HA GLN A 90 14.438 -0.429 7.949 1.00 1.30 H new ATOM 0 HB2 GLN A 90 14.288 0.664 5.113 1.00 1.45 H new ATOM 0 HB3 GLN A 90 14.267 1.698 6.528 1.00 1.45 H new ATOM 0 HG2 GLN A 90 16.502 -0.283 5.914 1.00 1.62 H new ATOM 0 HG3 GLN A 90 16.539 1.402 5.432 1.00 1.62 H new ATOM 0 HE21 GLN A 90 18.665 0.784 6.892 1.00 2.23 H new ATOM 0 HE22 GLN A 90 18.508 1.315 8.570 1.00 2.23 H new ATOM 1513 N GLY A 91 11.634 -1.198 7.259 1.00 1.01 N ATOM 1514 CA GLY A 91 10.173 -1.089 7.413 1.00 0.92 C ATOM 1515 C GLY A 91 9.459 -0.618 6.141 1.00 0.79 C ATOM 1516 O GLY A 91 8.304 -0.215 6.198 1.00 0.78 O ATOM 0 H GLY A 91 11.962 -2.160 7.175 1.00 1.01 H new ATOM 0 HA2 GLY A 91 9.773 -2.059 7.707 1.00 0.92 H new ATOM 0 HA3 GLY A 91 9.952 -0.394 8.223 1.00 0.92 H new ATOM 1520 N HIS A 92 10.146 -0.626 4.999 1.00 0.76 N ATOM 1521 CA HIS A 92 9.737 0.045 3.762 1.00 0.70 C ATOM 1522 C HIS A 92 10.253 -0.710 2.519 1.00 0.71 C ATOM 1523 O HIS A 92 11.274 -1.400 2.598 1.00 0.80 O ATOM 1524 CB HIS A 92 10.301 1.472 3.819 1.00 0.78 C ATOM 1525 CG HIS A 92 10.129 2.265 2.550 1.00 0.78 C ATOM 1526 ND1 HIS A 92 8.944 2.656 1.967 1.00 0.78 N ATOM 1527 CD2 HIS A 92 11.135 2.633 1.700 1.00 0.80 C ATOM 1528 CE1 HIS A 92 9.236 3.257 0.803 1.00 0.78 C ATOM 1529 NE2 HIS A 92 10.564 3.288 0.608 1.00 0.79 N ATOM 0 H HIS A 92 11.035 -1.117 4.905 1.00 0.76 H new ATOM 0 HA HIS A 92 8.650 0.065 3.678 1.00 0.70 H new ATOM 0 HB2 HIS A 92 9.817 2.008 4.635 1.00 0.78 H new ATOM 0 HB3 HIS A 92 11.363 1.420 4.058 1.00 0.78 H new ATOM 0 HD1 HIS A 92 8.010 2.514 2.352 1.00 0.78 H new ATOM 0 HD2 HIS A 92 12.189 2.449 1.848 1.00 0.80 H new ATOM 0 HE1 HIS A 92 8.504 3.660 0.118 1.00 0.78 H new ATOM 1537 N LEU A 93 9.563 -0.554 1.379 1.00 0.67 N ATOM 1538 CA LEU A 93 9.911 -1.157 0.089 1.00 0.70 C ATOM 1539 C LEU A 93 9.879 -0.119 -1.045 1.00 0.62 C ATOM 1540 O LEU A 93 9.012 0.756 -1.079 1.00 0.54 O ATOM 1541 CB LEU A 93 8.931 -2.318 -0.216 1.00 0.79 C ATOM 1542 CG LEU A 93 9.524 -3.737 -0.278 1.00 0.70 C ATOM 1543 CD1 LEU A 93 10.369 -3.933 -1.535 1.00 1.74 C ATOM 1544 CD2 LEU A 93 10.374 -4.085 0.945 1.00 1.96 C ATOM 0 H LEU A 93 8.718 0.016 1.331 1.00 0.67 H new ATOM 0 HA LEU A 93 10.929 -1.542 0.151 1.00 0.70 H new ATOM 0 HB2 LEU A 93 8.150 -2.310 0.545 1.00 0.79 H new ATOM 0 HB3 LEU A 93 8.448 -2.111 -1.171 1.00 0.79 H new ATOM 0 HG LEU A 93 8.666 -4.408 -0.298 1.00 0.70 H new ATOM 0 HD11 LEU A 93 10.773 -4.945 -1.548 1.00 1.74 H new ATOM 0 HD12 LEU A 93 9.749 -3.779 -2.418 1.00 1.74 H new ATOM 0 HD13 LEU A 93 11.189 -3.215 -1.538 1.00 1.74 H new ATOM 0 HD21 LEU A 93 10.763 -5.098 0.841 1.00 1.96 H new ATOM 0 HD22 LEU A 93 11.204 -3.383 1.023 1.00 1.96 H new ATOM 0 HD23 LEU A 93 9.761 -4.022 1.844 1.00 1.96 H new ATOM 1556 N MET A 94 10.791 -0.267 -2.008 1.00 0.68 N ATOM 1557 CA MET A 94 10.837 0.516 -3.251 1.00 0.74 C ATOM 1558 C MET A 94 10.848 -0.383 -4.486 1.00 0.82 C ATOM 1559 O MET A 94 11.246 -1.549 -4.430 1.00 1.10 O ATOM 1560 CB MET A 94 12.081 1.414 -3.281 1.00 0.90 C ATOM 1561 CG MET A 94 11.942 2.598 -2.334 1.00 0.86 C ATOM 1562 SD MET A 94 13.296 3.784 -2.501 1.00 1.08 S ATOM 1563 CE MET A 94 12.434 5.181 -1.763 1.00 0.98 C ATOM 0 H MET A 94 11.542 -0.955 -1.945 1.00 0.68 H new ATOM 0 HA MET A 94 9.936 1.130 -3.271 1.00 0.74 H new ATOM 0 HB2 MET A 94 12.959 0.829 -3.007 1.00 0.90 H new ATOM 0 HB3 MET A 94 12.244 1.777 -4.296 1.00 0.90 H new ATOM 0 HG2 MET A 94 10.996 3.103 -2.526 1.00 0.86 H new ATOM 0 HG3 MET A 94 11.907 2.235 -1.307 1.00 0.86 H new ATOM 0 HE1 MET A 94 12.989 6.098 -1.962 1.00 0.98 H new ATOM 0 HE2 MET A 94 11.436 5.261 -2.193 1.00 0.98 H new ATOM 0 HE3 MET A 94 12.354 5.032 -0.686 1.00 0.98 H new ATOM 1573 N TRP A 95 10.422 0.184 -5.615 1.00 0.69 N ATOM 1574 CA TRP A 95 10.391 -0.491 -6.906 1.00 0.73 C ATOM 1575 C TRP A 95 11.661 -0.126 -7.690 1.00 0.76 C ATOM 1576 O TRP A 95 11.837 1.014 -8.126 1.00 0.74 O ATOM 1577 CB TRP A 95 9.108 -0.100 -7.651 1.00 0.63 C ATOM 1578 CG TRP A 95 7.786 -0.510 -7.052 1.00 0.58 C ATOM 1579 CD1 TRP A 95 7.411 -0.414 -5.751 1.00 0.69 C ATOM 1580 CD2 TRP A 95 6.600 -1.007 -7.750 1.00 0.57 C ATOM 1581 NE1 TRP A 95 6.097 -0.799 -5.600 1.00 0.63 N ATOM 1582 CE2 TRP A 95 5.528 -1.120 -6.811 1.00 0.58 C ATOM 1583 CE3 TRP A 95 6.311 -1.331 -9.094 1.00 0.76 C ATOM 1584 CZ2 TRP A 95 4.228 -1.471 -7.196 1.00 0.69 C ATOM 1585 CZ3 TRP A 95 5.018 -1.729 -9.482 1.00 0.96 C ATOM 1586 CH2 TRP A 95 3.974 -1.783 -8.544 1.00 0.90 C ATOM 0 H TRP A 95 10.083 1.145 -5.655 1.00 0.69 H new ATOM 0 HA TRP A 95 10.378 -1.574 -6.782 1.00 0.73 H new ATOM 0 HB2 TRP A 95 9.103 0.985 -7.760 1.00 0.63 H new ATOM 0 HB3 TRP A 95 9.164 -0.521 -8.655 1.00 0.63 H new ATOM 0 HD1 TRP A 95 8.052 -0.083 -4.948 1.00 0.69 H new ATOM 0 HE1 TRP A 95 5.609 -0.841 -4.705 1.00 0.63 H new ATOM 0 HE3 TRP A 95 7.094 -1.272 -9.835 1.00 0.76 H new ATOM 0 HZ2 TRP A 95 3.431 -1.502 -6.468 1.00 0.69 H new ATOM 0 HZ3 TRP A 95 4.827 -1.995 -10.511 1.00 0.96 H new ATOM 0 HH2 TRP A 95 2.979 -2.063 -8.857 1.00 0.90 H new ATOM 1597 N ASN A 96 12.543 -1.111 -7.864 1.00 0.81 N ATOM 1598 CA ASN A 96 13.846 -0.980 -8.516 1.00 0.72 C ATOM 1599 C ASN A 96 14.109 -2.208 -9.395 1.00 0.69 C ATOM 1600 O ASN A 96 13.795 -3.327 -8.995 1.00 0.66 O ATOM 1601 CB ASN A 96 14.958 -0.868 -7.455 1.00 0.85 C ATOM 1602 CG ASN A 96 14.891 0.424 -6.648 1.00 1.39 C ATOM 1603 OD1 ASN A 96 14.222 0.506 -5.625 1.00 2.71 O ATOM 1604 ND2 ASN A 96 15.588 1.465 -7.072 1.00 1.77 N ATOM 0 H ASN A 96 12.361 -2.061 -7.541 1.00 0.81 H new ATOM 0 HA ASN A 96 13.843 -0.081 -9.132 1.00 0.72 H new ATOM 0 HB2 ASN A 96 14.889 -1.717 -6.775 1.00 0.85 H new ATOM 0 HB3 ASN A 96 15.928 -0.931 -7.947 1.00 0.85 H new ATOM 0 HD21 ASN A 96 15.570 2.339 -6.547 1.00 1.77 H new ATOM 0 HD22 ASN A 96 16.144 1.394 -7.924 1.00 1.77 H new ATOM 1611 N ASP A 97 14.743 -2.012 -10.551 1.00 0.73 N ATOM 1612 CA ASP A 97 15.139 -3.077 -11.482 1.00 0.71 C ATOM 1613 C ASP A 97 16.055 -4.125 -10.817 1.00 0.72 C ATOM 1614 O ASP A 97 16.006 -5.307 -11.154 1.00 0.73 O ATOM 1615 CB ASP A 97 15.867 -2.431 -12.672 1.00 0.75 C ATOM 1616 CG ASP A 97 15.002 -1.407 -13.423 1.00 1.35 C ATOM 1617 OD1 ASP A 97 14.781 -0.296 -12.877 1.00 2.07 O ATOM 1618 OD2 ASP A 97 14.567 -1.722 -14.555 1.00 2.35 O ATOM 0 H ASP A 97 15.004 -1.082 -10.878 1.00 0.73 H new ATOM 0 HA ASP A 97 14.241 -3.601 -11.809 1.00 0.71 H new ATOM 0 HB2 ASP A 97 16.772 -1.940 -12.314 1.00 0.75 H new ATOM 0 HB3 ASP A 97 16.181 -3.211 -13.366 1.00 0.75 H new ATOM 1623 N ASP A 98 16.862 -3.689 -9.843 1.00 0.75 N ATOM 1624 CA ASP A 98 17.754 -4.519 -9.030 1.00 0.86 C ATOM 1625 C ASP A 98 16.992 -5.374 -8.001 1.00 0.82 C ATOM 1626 O ASP A 98 17.265 -6.564 -7.852 1.00 0.91 O ATOM 1627 CB ASP A 98 18.731 -3.599 -8.283 1.00 0.98 C ATOM 1628 CG ASP A 98 19.547 -2.696 -9.220 1.00 2.01 C ATOM 1629 OD1 ASP A 98 20.598 -3.149 -9.734 1.00 2.60 O ATOM 1630 OD2 ASP A 98 19.139 -1.526 -9.422 1.00 3.18 O ATOM 0 H ASP A 98 16.912 -2.702 -9.590 1.00 0.75 H new ATOM 0 HA ASP A 98 18.277 -5.201 -9.700 1.00 0.86 H new ATOM 0 HB2 ASP A 98 18.172 -2.976 -7.585 1.00 0.98 H new ATOM 0 HB3 ASP A 98 19.413 -4.209 -7.691 1.00 0.98 H new ATOM 1635 N LEU A 99 16.016 -4.779 -7.304 1.00 0.72 N ATOM 1636 CA LEU A 99 15.192 -5.456 -6.295 1.00 0.77 C ATOM 1637 C LEU A 99 14.227 -6.452 -6.954 1.00 0.63 C ATOM 1638 O LEU A 99 14.017 -7.555 -6.448 1.00 0.78 O ATOM 1639 CB LEU A 99 14.500 -4.369 -5.445 1.00 0.85 C ATOM 1640 CG LEU A 99 13.801 -4.901 -4.173 1.00 1.01 C ATOM 1641 CD1 LEU A 99 13.872 -3.849 -3.056 1.00 2.23 C ATOM 1642 CD2 LEU A 99 12.327 -5.252 -4.424 1.00 2.05 C ATOM 0 H LEU A 99 15.773 -3.796 -7.428 1.00 0.72 H new ATOM 0 HA LEU A 99 15.800 -6.066 -5.627 1.00 0.77 H new ATOM 0 HB2 LEU A 99 15.242 -3.626 -5.153 1.00 0.85 H new ATOM 0 HB3 LEU A 99 13.762 -3.857 -6.063 1.00 0.85 H new ATOM 0 HG LEU A 99 14.325 -5.810 -3.879 1.00 1.01 H new ATOM 0 HD11 LEU A 99 13.377 -4.232 -2.164 1.00 2.23 H new ATOM 0 HD12 LEU A 99 14.915 -3.631 -2.827 1.00 2.23 H new ATOM 0 HD13 LEU A 99 13.374 -2.936 -3.384 1.00 2.23 H new ATOM 0 HD21 LEU A 99 11.879 -5.621 -3.502 1.00 2.05 H new ATOM 0 HD22 LEU A 99 11.793 -4.362 -4.756 1.00 2.05 H new ATOM 0 HD23 LEU A 99 12.262 -6.022 -5.193 1.00 2.05 H new ATOM 1654 N PHE A 100 13.715 -6.094 -8.134 1.00 0.46 N ATOM 1655 CA PHE A 100 12.873 -6.922 -8.992 1.00 0.44 C ATOM 1656 C PHE A 100 13.708 -7.818 -9.939 1.00 0.48 C ATOM 1657 O PHE A 100 13.168 -8.395 -10.879 1.00 0.52 O ATOM 1658 CB PHE A 100 11.891 -6.013 -9.756 1.00 0.48 C ATOM 1659 CG PHE A 100 10.705 -5.491 -8.954 1.00 0.52 C ATOM 1660 CD1 PHE A 100 10.888 -4.714 -7.791 1.00 1.34 C ATOM 1661 CD2 PHE A 100 9.393 -5.779 -9.383 1.00 1.39 C ATOM 1662 CE1 PHE A 100 9.778 -4.251 -7.063 1.00 1.37 C ATOM 1663 CE2 PHE A 100 8.285 -5.280 -8.678 1.00 1.44 C ATOM 1664 CZ PHE A 100 8.474 -4.519 -7.512 1.00 0.72 C ATOM 0 H PHE A 100 13.887 -5.172 -8.534 1.00 0.46 H new ATOM 0 HA PHE A 100 12.301 -7.612 -8.372 1.00 0.44 H new ATOM 0 HB2 PHE A 100 12.445 -5.159 -10.146 1.00 0.48 H new ATOM 0 HB3 PHE A 100 11.509 -6.565 -10.615 1.00 0.48 H new ATOM 0 HD1 PHE A 100 11.887 -4.473 -7.458 1.00 1.34 H new ATOM 0 HD2 PHE A 100 9.239 -6.388 -10.261 1.00 1.39 H new ATOM 0 HE1 PHE A 100 9.928 -3.687 -6.154 1.00 1.37 H new ATOM 0 HE2 PHE A 100 7.285 -5.482 -9.033 1.00 1.44 H new ATOM 0 HZ PHE A 100 7.622 -4.143 -6.965 1.00 0.72 H new ATOM 1674 N SER A 101 15.021 -7.965 -9.722 1.00 0.58 N ATOM 1675 CA SER A 101 15.893 -8.787 -10.583 1.00 0.70 C ATOM 1676 C SER A 101 15.567 -10.295 -10.496 1.00 0.68 C ATOM 1677 O SER A 101 15.671 -11.010 -11.495 1.00 0.86 O ATOM 1678 CB SER A 101 17.365 -8.496 -10.253 1.00 0.85 C ATOM 1679 OG SER A 101 18.251 -9.197 -11.117 1.00 1.00 O ATOM 0 H SER A 101 15.512 -7.520 -8.947 1.00 0.58 H new ATOM 0 HA SER A 101 15.704 -8.509 -11.620 1.00 0.70 H new ATOM 0 HB2 SER A 101 17.550 -7.425 -10.334 1.00 0.85 H new ATOM 0 HB3 SER A 101 17.568 -8.777 -9.220 1.00 0.85 H new ATOM 0 HG SER A 101 19.177 -8.985 -10.877 1.00 1.00 H new ATOM 1685 N GLU A 102 15.079 -10.782 -9.347 1.00 0.56 N ATOM 1686 CA GLU A 102 14.446 -12.108 -9.251 1.00 0.56 C ATOM 1687 C GLU A 102 13.020 -12.071 -9.824 1.00 0.55 C ATOM 1688 O GLU A 102 12.639 -12.925 -10.627 1.00 0.64 O ATOM 1689 CB GLU A 102 14.419 -12.594 -7.791 1.00 0.60 C ATOM 1690 CG GLU A 102 15.821 -12.932 -7.269 1.00 1.86 C ATOM 1691 CD GLU A 102 15.753 -13.530 -5.857 1.00 2.03 C ATOM 1692 OE1 GLU A 102 15.623 -14.772 -5.727 1.00 2.30 O ATOM 1693 OE2 GLU A 102 15.841 -12.767 -4.866 1.00 2.89 O ATOM 0 H GLU A 102 15.110 -10.274 -8.463 1.00 0.56 H new ATOM 0 HA GLU A 102 15.039 -12.809 -9.839 1.00 0.56 H new ATOM 0 HB2 GLU A 102 13.974 -11.824 -7.161 1.00 0.60 H new ATOM 0 HB3 GLU A 102 13.782 -13.475 -7.715 1.00 0.60 H new ATOM 0 HG2 GLU A 102 16.304 -13.639 -7.944 1.00 1.86 H new ATOM 0 HG3 GLU A 102 16.435 -12.032 -7.257 1.00 1.86 H new ATOM 1700 N ALA A 103 12.238 -11.045 -9.469 1.00 0.47 N ATOM 1701 CA ALA A 103 10.863 -10.827 -9.918 1.00 0.47 C ATOM 1702 C ALA A 103 10.761 -10.208 -11.332 1.00 0.46 C ATOM 1703 O ALA A 103 9.890 -9.382 -11.599 1.00 0.48 O ATOM 1704 CB ALA A 103 10.134 -10.026 -8.826 1.00 0.46 C ATOM 0 H ALA A 103 12.562 -10.315 -8.835 1.00 0.47 H new ATOM 0 HA ALA A 103 10.365 -11.788 -10.046 1.00 0.47 H new ATOM 0 HB1 ALA A 103 9.103 -9.847 -9.133 1.00 0.46 H new ATOM 0 HB2 ALA A 103 10.142 -10.591 -7.894 1.00 0.46 H new ATOM 0 HB3 ALA A 103 10.639 -9.072 -8.677 1.00 0.46 H new ATOM 1710 N GLN A 104 11.622 -10.624 -12.263 1.00 0.47 N ATOM 1711 CA GLN A 104 11.592 -10.180 -13.662 1.00 0.49 C ATOM 1712 C GLN A 104 10.258 -10.442 -14.396 1.00 0.50 C ATOM 1713 O GLN A 104 9.833 -9.535 -15.119 1.00 0.52 O ATOM 1714 CB GLN A 104 12.775 -10.787 -14.435 1.00 0.54 C ATOM 1715 CG GLN A 104 14.028 -9.906 -14.317 1.00 0.74 C ATOM 1716 CD GLN A 104 15.234 -10.534 -15.017 1.00 0.79 C ATOM 1717 OE1 GLN A 104 15.406 -10.440 -16.228 1.00 0.96 O ATOM 1718 NE2 GLN A 104 16.107 -11.211 -14.300 1.00 1.10 N ATOM 0 H GLN A 104 12.371 -11.288 -12.066 1.00 0.47 H new ATOM 0 HA GLN A 104 11.684 -9.094 -13.631 1.00 0.49 H new ATOM 0 HB2 GLN A 104 12.991 -11.784 -14.050 1.00 0.54 H new ATOM 0 HB3 GLN A 104 12.506 -10.902 -15.485 1.00 0.54 H new ATOM 0 HG2 GLN A 104 13.826 -8.927 -14.751 1.00 0.74 H new ATOM 0 HG3 GLN A 104 14.262 -9.746 -13.264 1.00 0.74 H new ATOM 0 HE21 GLN A 104 15.980 -11.299 -13.292 1.00 1.10 H new ATOM 0 HE22 GLN A 104 16.910 -11.647 -14.753 1.00 1.10 H new ATOM 1727 N PRO A 105 9.556 -11.590 -14.233 1.00 0.52 N ATOM 1728 CA PRO A 105 8.275 -11.800 -14.905 1.00 0.54 C ATOM 1729 C PRO A 105 7.136 -10.981 -14.277 1.00 0.49 C ATOM 1730 O PRO A 105 6.119 -10.768 -14.935 1.00 0.50 O ATOM 1731 CB PRO A 105 8.027 -13.310 -14.860 1.00 0.61 C ATOM 1732 CG PRO A 105 8.761 -13.768 -13.604 1.00 0.59 C ATOM 1733 CD PRO A 105 9.920 -12.783 -13.468 1.00 0.53 C ATOM 0 HA PRO A 105 8.306 -11.445 -15.935 1.00 0.54 H new ATOM 0 HB2 PRO A 105 6.963 -13.538 -14.806 1.00 0.61 H new ATOM 0 HB3 PRO A 105 8.414 -13.805 -15.751 1.00 0.61 H new ATOM 0 HG2 PRO A 105 8.110 -13.741 -12.730 1.00 0.59 H new ATOM 0 HG3 PRO A 105 9.119 -14.793 -13.703 1.00 0.59 H new ATOM 0 HD2 PRO A 105 10.093 -12.533 -12.421 1.00 0.53 H new ATOM 0 HD3 PRO A 105 10.844 -13.219 -13.849 1.00 0.53 H new ATOM 1741 N LEU A 106 7.317 -10.471 -13.048 1.00 0.46 N ATOM 1742 CA LEU A 106 6.426 -9.481 -12.442 1.00 0.43 C ATOM 1743 C LEU A 106 6.723 -8.099 -13.020 1.00 0.42 C ATOM 1744 O LEU A 106 5.814 -7.419 -13.484 1.00 0.43 O ATOM 1745 CB LEU A 106 6.610 -9.516 -10.910 1.00 0.43 C ATOM 1746 CG LEU A 106 5.571 -8.717 -10.107 1.00 0.56 C ATOM 1747 CD1 LEU A 106 4.239 -9.470 -10.016 1.00 1.62 C ATOM 1748 CD2 LEU A 106 6.089 -8.481 -8.680 1.00 1.21 C ATOM 0 H LEU A 106 8.095 -10.740 -12.445 1.00 0.46 H new ATOM 0 HA LEU A 106 5.385 -9.713 -12.668 1.00 0.43 H new ATOM 0 HB2 LEU A 106 6.580 -10.554 -10.580 1.00 0.43 H new ATOM 0 HB3 LEU A 106 7.602 -9.134 -10.671 1.00 0.43 H new ATOM 0 HG LEU A 106 5.412 -7.769 -10.622 1.00 0.56 H new ATOM 0 HD11 LEU A 106 3.525 -8.879 -9.442 1.00 1.62 H new ATOM 0 HD12 LEU A 106 3.847 -9.639 -11.019 1.00 1.62 H new ATOM 0 HD13 LEU A 106 4.396 -10.429 -9.522 1.00 1.62 H new ATOM 0 HD21 LEU A 106 5.350 -7.914 -8.114 1.00 1.21 H new ATOM 0 HD22 LEU A 106 6.262 -9.440 -8.192 1.00 1.21 H new ATOM 0 HD23 LEU A 106 7.023 -7.921 -8.720 1.00 1.21 H new ATOM 1760 N TRP A 107 8.000 -7.711 -13.046 1.00 0.43 N ATOM 1761 CA TRP A 107 8.467 -6.413 -13.521 1.00 0.45 C ATOM 1762 C TRP A 107 8.091 -6.184 -14.987 1.00 0.46 C ATOM 1763 O TRP A 107 7.551 -5.133 -15.316 1.00 0.46 O ATOM 1764 CB TRP A 107 9.986 -6.336 -13.313 1.00 0.51 C ATOM 1765 CG TRP A 107 10.709 -5.095 -13.757 1.00 0.63 C ATOM 1766 CD1 TRP A 107 12.017 -5.070 -14.103 1.00 0.84 C ATOM 1767 CD2 TRP A 107 10.233 -3.715 -13.931 1.00 0.97 C ATOM 1768 NE1 TRP A 107 12.373 -3.802 -14.513 1.00 1.16 N ATOM 1769 CE2 TRP A 107 11.301 -2.944 -14.485 1.00 1.24 C ATOM 1770 CE3 TRP A 107 9.019 -3.026 -13.702 1.00 1.31 C ATOM 1771 CZ2 TRP A 107 11.152 -1.604 -14.869 1.00 1.67 C ATOM 1772 CZ3 TRP A 107 8.857 -1.683 -14.086 1.00 1.73 C ATOM 1773 CH2 TRP A 107 9.911 -0.979 -14.692 1.00 1.87 C ATOM 0 H TRP A 107 8.759 -8.313 -12.726 1.00 0.43 H new ATOM 0 HA TRP A 107 7.981 -5.621 -12.951 1.00 0.45 H new ATOM 0 HB2 TRP A 107 10.182 -6.471 -12.249 1.00 0.51 H new ATOM 0 HB3 TRP A 107 10.435 -7.184 -13.830 1.00 0.51 H new ATOM 0 HD1 TRP A 107 12.684 -5.918 -14.064 1.00 0.84 H new ATOM 0 HE1 TRP A 107 13.314 -3.535 -14.801 1.00 1.16 H new ATOM 0 HE3 TRP A 107 8.200 -3.542 -13.223 1.00 1.31 H new ATOM 0 HZ2 TRP A 107 11.983 -1.061 -15.295 1.00 1.67 H new ATOM 0 HZ3 TRP A 107 7.913 -1.188 -13.913 1.00 1.73 H new ATOM 0 HH2 TRP A 107 9.765 0.040 -15.020 1.00 1.87 H new ATOM 1784 N GLU A 108 8.307 -7.171 -15.859 1.00 0.48 N ATOM 1785 CA GLU A 108 8.023 -7.033 -17.290 1.00 0.51 C ATOM 1786 C GLU A 108 6.515 -6.866 -17.545 1.00 0.47 C ATOM 1787 O GLU A 108 6.087 -5.981 -18.288 1.00 0.47 O ATOM 1788 CB GLU A 108 8.587 -8.254 -18.039 1.00 0.60 C ATOM 1789 CG GLU A 108 8.539 -8.126 -19.568 1.00 0.74 C ATOM 1790 CD GLU A 108 9.557 -7.102 -20.097 1.00 1.65 C ATOM 1791 OE1 GLU A 108 9.272 -5.883 -20.069 1.00 3.21 O ATOM 1792 OE2 GLU A 108 10.649 -7.513 -20.555 1.00 2.16 O ATOM 0 H GLU A 108 8.681 -8.083 -15.596 1.00 0.48 H new ATOM 0 HA GLU A 108 8.509 -6.132 -17.665 1.00 0.51 H new ATOM 0 HB2 GLU A 108 9.620 -8.411 -17.730 1.00 0.60 H new ATOM 0 HB3 GLU A 108 8.027 -9.140 -17.741 1.00 0.60 H new ATOM 0 HG2 GLU A 108 8.737 -9.099 -20.019 1.00 0.74 H new ATOM 0 HG3 GLU A 108 7.536 -7.830 -19.875 1.00 0.74 H new ATOM 1799 N ALA A 109 5.694 -7.695 -16.897 1.00 0.45 N ATOM 1800 CA ALA A 109 4.238 -7.603 -16.973 1.00 0.44 C ATOM 1801 C ALA A 109 3.689 -6.291 -16.384 1.00 0.40 C ATOM 1802 O ALA A 109 2.826 -5.653 -16.987 1.00 0.41 O ATOM 1803 CB ALA A 109 3.684 -8.858 -16.327 1.00 0.48 C ATOM 0 H ALA A 109 6.025 -8.454 -16.301 1.00 0.45 H new ATOM 0 HA ALA A 109 3.907 -7.557 -18.010 1.00 0.44 H new ATOM 0 HB1 ALA A 109 2.595 -8.834 -16.360 1.00 0.48 H new ATOM 0 HB2 ALA A 109 4.044 -9.734 -16.866 1.00 0.48 H new ATOM 0 HB3 ALA A 109 4.014 -8.909 -15.289 1.00 0.48 H new ATOM 1809 N ALA A 110 4.211 -5.848 -15.242 1.00 0.38 N ATOM 1810 CA ALA A 110 3.849 -4.582 -14.607 1.00 0.37 C ATOM 1811 C ALA A 110 4.200 -3.374 -15.495 1.00 0.39 C ATOM 1812 O ALA A 110 3.359 -2.505 -15.728 1.00 0.40 O ATOM 1813 CB ALA A 110 4.566 -4.548 -13.250 1.00 0.39 C ATOM 0 H ALA A 110 4.914 -6.371 -14.720 1.00 0.38 H new ATOM 0 HA ALA A 110 2.771 -4.514 -14.462 1.00 0.37 H new ATOM 0 HB1 ALA A 110 4.326 -3.618 -12.735 1.00 0.39 H new ATOM 0 HB2 ALA A 110 4.239 -5.393 -12.644 1.00 0.39 H new ATOM 0 HB3 ALA A 110 5.643 -4.609 -13.406 1.00 0.39 H new ATOM 1819 N ARG A 111 5.409 -3.377 -16.066 1.00 0.42 N ATOM 1820 CA ARG A 111 5.930 -2.384 -17.016 1.00 0.48 C ATOM 1821 C ARG A 111 5.048 -2.261 -18.266 1.00 0.46 C ATOM 1822 O ARG A 111 4.784 -1.146 -18.728 1.00 0.51 O ATOM 1823 CB ARG A 111 7.371 -2.814 -17.349 1.00 0.63 C ATOM 1824 CG ARG A 111 8.166 -1.991 -18.370 1.00 0.85 C ATOM 1825 CD ARG A 111 9.547 -2.656 -18.498 1.00 1.43 C ATOM 1826 NE ARG A 111 10.420 -1.988 -19.479 1.00 2.38 N ATOM 1827 CZ ARG A 111 11.169 -2.579 -20.409 1.00 3.00 C ATOM 1828 NH1 ARG A 111 11.083 -3.861 -20.699 1.00 3.13 N ATOM 1829 NH2 ARG A 111 12.051 -1.866 -21.077 1.00 4.17 N ATOM 0 H ARG A 111 6.089 -4.111 -15.868 1.00 0.42 H new ATOM 0 HA ARG A 111 5.923 -1.386 -16.578 1.00 0.48 H new ATOM 0 HB2 ARG A 111 7.937 -2.822 -16.418 1.00 0.63 H new ATOM 0 HB3 ARG A 111 7.335 -3.842 -17.709 1.00 0.63 H new ATOM 0 HG2 ARG A 111 7.655 -1.972 -19.333 1.00 0.85 H new ATOM 0 HG3 ARG A 111 8.264 -0.957 -18.041 1.00 0.85 H new ATOM 0 HD2 ARG A 111 10.036 -2.654 -17.524 1.00 1.43 H new ATOM 0 HD3 ARG A 111 9.416 -3.699 -18.787 1.00 1.43 H new ATOM 0 HE ARG A 111 10.454 -0.969 -19.442 1.00 2.38 H new ATOM 0 HH11 ARG A 111 10.418 -4.453 -20.201 1.00 3.13 H new ATOM 0 HH12 ARG A 111 11.682 -4.262 -21.421 1.00 3.13 H new ATOM 0 HH21 ARG A 111 12.156 -0.871 -20.881 1.00 4.17 H new ATOM 0 HH22 ARG A 111 12.629 -2.309 -21.791 1.00 4.17 H new ATOM 1843 N ALA A 112 4.542 -3.388 -18.770 1.00 0.44 N ATOM 1844 CA ALA A 112 3.592 -3.453 -19.883 1.00 0.46 C ATOM 1845 C ALA A 112 2.210 -2.885 -19.510 1.00 0.46 C ATOM 1846 O ALA A 112 1.635 -2.101 -20.268 1.00 0.50 O ATOM 1847 CB ALA A 112 3.496 -4.917 -20.329 1.00 0.48 C ATOM 0 H ALA A 112 4.789 -4.308 -18.405 1.00 0.44 H new ATOM 0 HA ALA A 112 3.951 -2.829 -20.702 1.00 0.46 H new ATOM 0 HB1 ALA A 112 2.794 -4.999 -21.159 1.00 0.48 H new ATOM 0 HB2 ALA A 112 4.478 -5.265 -20.648 1.00 0.48 H new ATOM 0 HB3 ALA A 112 3.147 -5.529 -19.497 1.00 0.48 H new ATOM 1853 N HIS A 113 1.678 -3.266 -18.348 1.00 0.43 N ATOM 1854 CA HIS A 113 0.360 -2.829 -17.860 1.00 0.47 C ATOM 1855 C HIS A 113 0.304 -1.361 -17.376 1.00 0.52 C ATOM 1856 O HIS A 113 -0.789 -0.830 -17.170 1.00 0.56 O ATOM 1857 CB HIS A 113 -0.132 -3.811 -16.786 1.00 0.45 C ATOM 1858 CG HIS A 113 -0.598 -5.124 -17.367 1.00 0.46 C ATOM 1859 ND1 HIS A 113 0.131 -6.285 -17.443 1.00 0.46 N ATOM 1860 CD2 HIS A 113 -1.822 -5.386 -17.924 1.00 0.50 C ATOM 1861 CE1 HIS A 113 -0.629 -7.225 -18.030 1.00 0.49 C ATOM 1862 NE2 HIS A 113 -1.836 -6.723 -18.347 1.00 0.52 N ATOM 0 H HIS A 113 2.155 -3.898 -17.705 1.00 0.43 H new ATOM 0 HA HIS A 113 -0.317 -2.845 -18.714 1.00 0.47 H new ATOM 0 HB2 HIS A 113 0.672 -3.998 -16.075 1.00 0.45 H new ATOM 0 HB3 HIS A 113 -0.950 -3.354 -16.229 1.00 0.45 H new ATOM 0 HD1 HIS A 113 1.087 -6.412 -17.110 1.00 0.46 H new ATOM 0 HD2 HIS A 113 -2.636 -4.683 -18.021 1.00 0.50 H new ATOM 0 HE1 HIS A 113 -0.315 -8.241 -18.220 1.00 0.49 H new ATOM 1870 N GLY A 114 1.459 -0.695 -17.211 1.00 0.53 N ATOM 1871 CA GLY A 114 1.560 0.725 -16.831 1.00 0.61 C ATOM 1872 C GLY A 114 2.011 0.979 -15.390 1.00 0.71 C ATOM 1873 O GLY A 114 2.203 2.133 -15.013 1.00 0.80 O ATOM 0 H GLY A 114 2.369 -1.138 -17.341 1.00 0.53 H new ATOM 0 HA2 GLY A 114 2.259 1.217 -17.507 1.00 0.61 H new ATOM 0 HA3 GLY A 114 0.588 1.195 -16.980 1.00 0.61 H new ATOM 1877 N LEU A 115 2.262 -0.074 -14.607 1.00 0.71 N ATOM 1878 CA LEU A 115 2.806 -0.024 -13.249 1.00 0.76 C ATOM 1879 C LEU A 115 4.344 0.117 -13.319 1.00 0.84 C ATOM 1880 O LEU A 115 5.099 -0.744 -12.866 1.00 1.20 O ATOM 1881 CB LEU A 115 2.356 -1.277 -12.471 1.00 0.77 C ATOM 1882 CG LEU A 115 0.845 -1.452 -12.204 1.00 0.73 C ATOM 1883 CD1 LEU A 115 0.022 -1.871 -13.435 1.00 1.00 C ATOM 1884 CD2 LEU A 115 0.701 -2.549 -11.141 1.00 1.19 C ATOM 0 H LEU A 115 2.083 -1.029 -14.918 1.00 0.71 H new ATOM 0 HA LEU A 115 2.425 0.844 -12.711 1.00 0.76 H new ATOM 0 HB2 LEU A 115 2.704 -2.154 -13.017 1.00 0.77 H new ATOM 0 HB3 LEU A 115 2.869 -1.277 -11.509 1.00 0.77 H new ATOM 0 HG LEU A 115 0.457 -0.482 -11.893 1.00 0.73 H new ATOM 0 HD11 LEU A 115 -1.027 -1.970 -13.155 1.00 1.00 H new ATOM 0 HD12 LEU A 115 0.120 -1.114 -14.213 1.00 1.00 H new ATOM 0 HD13 LEU A 115 0.389 -2.826 -13.810 1.00 1.00 H new ATOM 0 HD21 LEU A 115 -0.355 -2.706 -10.921 1.00 1.19 H new ATOM 0 HD22 LEU A 115 1.136 -3.476 -11.514 1.00 1.19 H new ATOM 0 HD23 LEU A 115 1.220 -2.245 -10.232 1.00 1.19 H new ATOM 1896 N ARG A 116 4.808 1.182 -13.980 1.00 0.80 N ATOM 1897 CA ARG A 116 6.196 1.346 -14.441 1.00 0.89 C ATOM 1898 C ARG A 116 7.192 1.699 -13.330 1.00 0.69 C ATOM 1899 O ARG A 116 8.374 1.413 -13.482 1.00 0.69 O ATOM 1900 CB ARG A 116 6.240 2.345 -15.591 1.00 1.19 C ATOM 1901 CG ARG A 116 5.394 1.776 -16.749 1.00 1.66 C ATOM 1902 CD ARG A 116 5.952 2.152 -18.116 1.00 1.23 C ATOM 1903 NE ARG A 116 5.043 3.067 -18.824 1.00 1.56 N ATOM 1904 CZ ARG A 116 3.996 2.705 -19.559 1.00 2.43 C ATOM 1905 NH1 ARG A 116 3.683 1.439 -19.773 1.00 3.41 N ATOM 1906 NH2 ARG A 116 3.225 3.628 -20.091 1.00 2.97 N ATOM 0 H ARG A 116 4.215 1.977 -14.217 1.00 0.80 H new ATOM 0 HA ARG A 116 6.529 0.371 -14.798 1.00 0.89 H new ATOM 0 HB2 ARG A 116 5.849 3.311 -15.272 1.00 1.19 H new ATOM 0 HB3 ARG A 116 7.268 2.509 -15.915 1.00 1.19 H new ATOM 0 HG2 ARG A 116 5.350 0.690 -16.664 1.00 1.66 H new ATOM 0 HG3 ARG A 116 4.372 2.144 -16.663 1.00 1.66 H new ATOM 0 HD2 ARG A 116 6.928 2.623 -17.997 1.00 1.23 H new ATOM 0 HD3 ARG A 116 6.103 1.251 -18.711 1.00 1.23 H new ATOM 0 HE ARG A 116 5.233 4.066 -18.744 1.00 1.56 H new ATOM 0 HH11 ARG A 116 4.254 0.697 -19.368 1.00 3.41 H new ATOM 0 HH12 ARG A 116 2.871 1.204 -20.343 1.00 3.41 H new ATOM 0 HH21 ARG A 116 3.432 4.615 -19.939 1.00 2.97 H new ATOM 0 HH22 ARG A 116 2.420 3.357 -20.656 1.00 2.97 H new ATOM 1920 N ARG A 117 6.728 2.269 -12.217 1.00 0.64 N ATOM 1921 CA ARG A 117 7.417 2.413 -10.921 1.00 0.52 C ATOM 1922 C ARG A 117 6.363 2.313 -9.808 1.00 0.60 C ATOM 1923 O ARG A 117 5.162 2.256 -10.084 1.00 0.91 O ATOM 1924 CB ARG A 117 8.182 3.756 -10.817 1.00 0.67 C ATOM 1925 CG ARG A 117 9.188 4.059 -11.940 1.00 1.06 C ATOM 1926 CD ARG A 117 10.344 3.057 -12.097 1.00 0.82 C ATOM 1927 NE ARG A 117 11.532 3.368 -11.289 1.00 1.16 N ATOM 1928 CZ ARG A 117 12.657 2.656 -11.321 1.00 1.20 C ATOM 1929 NH1 ARG A 117 12.777 1.592 -12.092 1.00 1.81 N ATOM 1930 NH2 ARG A 117 13.686 3.013 -10.585 1.00 1.67 N ATOM 0 H ARG A 117 5.792 2.674 -12.189 1.00 0.64 H new ATOM 0 HA ARG A 117 8.159 1.621 -10.823 1.00 0.52 H new ATOM 0 HB2 ARG A 117 7.451 4.564 -10.786 1.00 0.67 H new ATOM 0 HB3 ARG A 117 8.716 3.772 -9.867 1.00 0.67 H new ATOM 0 HG2 ARG A 117 8.645 4.108 -12.884 1.00 1.06 H new ATOM 0 HG3 ARG A 117 9.612 5.048 -11.764 1.00 1.06 H new ATOM 0 HD2 ARG A 117 9.986 2.063 -11.827 1.00 0.82 H new ATOM 0 HD3 ARG A 117 10.634 3.017 -13.147 1.00 0.82 H new ATOM 0 HE ARG A 117 11.492 4.176 -10.668 1.00 1.16 H new ATOM 0 HH11 ARG A 117 11.998 1.299 -12.681 1.00 1.81 H new ATOM 0 HH12 ARG A 117 13.649 1.063 -12.099 1.00 1.81 H new ATOM 0 HH21 ARG A 117 13.624 3.837 -9.987 1.00 1.67 H new ATOM 0 HH22 ARG A 117 14.546 2.466 -10.612 1.00 1.67 H new ATOM 1944 N GLY A 118 6.787 2.315 -8.546 1.00 0.44 N ATOM 1945 CA GLY A 118 5.879 2.422 -7.401 1.00 0.43 C ATOM 1946 C GLY A 118 6.557 2.745 -6.075 1.00 0.41 C ATOM 1947 O GLY A 118 7.778 2.883 -5.996 1.00 0.46 O ATOM 0 H GLY A 118 7.771 2.242 -8.286 1.00 0.44 H new ATOM 0 HA2 GLY A 118 5.140 3.195 -7.613 1.00 0.43 H new ATOM 0 HA3 GLY A 118 5.337 1.482 -7.296 1.00 0.43 H new ATOM 1951 N VAL A 119 5.730 2.849 -5.037 1.00 0.38 N ATOM 1952 CA VAL A 119 6.104 3.135 -3.642 1.00 0.38 C ATOM 1953 C VAL A 119 5.212 2.324 -2.693 1.00 0.37 C ATOM 1954 O VAL A 119 4.028 2.150 -2.982 1.00 0.41 O ATOM 1955 CB VAL A 119 6.001 4.643 -3.314 1.00 0.44 C ATOM 1956 CG1 VAL A 119 7.126 5.437 -4.000 1.00 0.72 C ATOM 1957 CG2 VAL A 119 4.651 5.279 -3.688 1.00 0.65 C ATOM 0 H VAL A 119 4.723 2.730 -5.146 1.00 0.38 H new ATOM 0 HA VAL A 119 7.146 2.844 -3.507 1.00 0.38 H new ATOM 0 HB VAL A 119 6.097 4.698 -2.230 1.00 0.44 H new ATOM 0 HG11 VAL A 119 7.029 6.494 -3.752 1.00 0.72 H new ATOM 0 HG12 VAL A 119 8.093 5.071 -3.655 1.00 0.72 H new ATOM 0 HG13 VAL A 119 7.055 5.310 -5.080 1.00 0.72 H new ATOM 0 HG21 VAL A 119 4.662 6.337 -3.425 1.00 0.65 H new ATOM 0 HG22 VAL A 119 4.483 5.173 -4.760 1.00 0.65 H new ATOM 0 HG23 VAL A 119 3.850 4.778 -3.144 1.00 0.65 H new ATOM 1967 N THR A 120 5.776 1.816 -1.587 1.00 0.37 N ATOM 1968 CA THR A 120 5.185 0.732 -0.779 1.00 0.34 C ATOM 1969 C THR A 120 5.463 0.928 0.712 1.00 0.36 C ATOM 1970 O THR A 120 6.550 1.360 1.095 1.00 0.43 O ATOM 1971 CB THR A 120 5.783 -0.594 -1.269 1.00 0.33 C ATOM 1972 OG1 THR A 120 5.416 -0.809 -2.614 1.00 0.36 O ATOM 1973 CG2 THR A 120 5.357 -1.831 -0.482 1.00 0.42 C ATOM 0 H THR A 120 6.668 2.149 -1.221 1.00 0.37 H new ATOM 0 HA THR A 120 4.102 0.733 -0.900 1.00 0.34 H new ATOM 0 HB THR A 120 6.858 -0.480 -1.132 1.00 0.33 H new ATOM 0 HG1 THR A 120 5.660 -1.721 -2.878 1.00 0.36 H new ATOM 0 HG21 THR A 120 5.833 -2.715 -0.907 1.00 0.42 H new ATOM 0 HG22 THR A 120 5.659 -1.721 0.560 1.00 0.42 H new ATOM 0 HG23 THR A 120 4.274 -1.941 -0.536 1.00 0.42 H new ATOM 1981 N GLN A 121 4.507 0.579 1.574 1.00 0.36 N ATOM 1982 CA GLN A 121 4.648 0.659 3.033 1.00 0.36 C ATOM 1983 C GLN A 121 3.891 -0.465 3.759 1.00 0.39 C ATOM 1984 O GLN A 121 2.926 -1.030 3.248 1.00 0.47 O ATOM 1985 CB GLN A 121 4.206 2.050 3.541 1.00 0.43 C ATOM 1986 CG GLN A 121 5.378 2.970 3.948 1.00 1.29 C ATOM 1987 CD GLN A 121 6.176 2.467 5.151 1.00 2.12 C ATOM 1988 OE1 GLN A 121 5.744 1.612 5.903 1.00 2.83 O ATOM 1989 NE2 GLN A 121 7.370 2.971 5.383 1.00 3.06 N ATOM 0 H GLN A 121 3.597 0.227 1.276 1.00 0.36 H new ATOM 0 HA GLN A 121 5.704 0.521 3.266 1.00 0.36 H new ATOM 0 HB2 GLN A 121 3.624 2.542 2.762 1.00 0.43 H new ATOM 0 HB3 GLN A 121 3.545 1.920 4.398 1.00 0.43 H new ATOM 0 HG2 GLN A 121 6.052 3.080 3.098 1.00 1.29 H new ATOM 0 HG3 GLN A 121 4.986 3.962 4.174 1.00 1.29 H new ATOM 0 HE21 GLN A 121 7.750 3.688 4.765 1.00 3.06 H new ATOM 0 HE22 GLN A 121 7.915 2.644 6.181 1.00 3.06 H new ATOM 1998 N TYR A 122 4.347 -0.758 4.979 1.00 0.46 N ATOM 1999 CA TYR A 122 3.926 -1.848 5.867 1.00 0.48 C ATOM 2000 C TYR A 122 4.167 -1.415 7.325 1.00 0.54 C ATOM 2001 O TYR A 122 5.245 -0.920 7.662 1.00 0.99 O ATOM 2002 CB TYR A 122 4.700 -3.137 5.498 1.00 0.78 C ATOM 2003 CG TYR A 122 5.293 -3.968 6.629 1.00 0.70 C ATOM 2004 CD1 TYR A 122 6.590 -3.669 7.097 1.00 1.89 C ATOM 2005 CD2 TYR A 122 4.592 -5.061 7.178 1.00 2.15 C ATOM 2006 CE1 TYR A 122 7.182 -4.443 8.113 1.00 2.15 C ATOM 2007 CE2 TYR A 122 5.187 -5.847 8.186 1.00 2.05 C ATOM 2008 CZ TYR A 122 6.481 -5.538 8.660 1.00 1.03 C ATOM 2009 OH TYR A 122 7.055 -6.296 9.638 1.00 1.29 O ATOM 0 H TYR A 122 5.080 -0.194 5.408 1.00 0.46 H new ATOM 0 HA TYR A 122 2.864 -2.063 5.751 1.00 0.48 H new ATOM 0 HB2 TYR A 122 4.026 -3.779 4.931 1.00 0.78 H new ATOM 0 HB3 TYR A 122 5.513 -2.857 4.828 1.00 0.78 H new ATOM 0 HD1 TYR A 122 7.134 -2.838 6.672 1.00 1.89 H new ATOM 0 HD2 TYR A 122 3.598 -5.296 6.826 1.00 2.15 H new ATOM 0 HE1 TYR A 122 8.171 -4.199 8.473 1.00 2.15 H new ATOM 0 HE2 TYR A 122 4.651 -6.689 8.598 1.00 2.05 H new ATOM 0 HH TYR A 122 6.437 -7.009 9.904 1.00 1.29 H new ATOM 2019 N LEU A 123 3.171 -1.599 8.197 1.00 0.52 N ATOM 2020 CA LEU A 123 3.259 -1.228 9.615 1.00 0.61 C ATOM 2021 C LEU A 123 2.854 -2.426 10.477 1.00 0.70 C ATOM 2022 O LEU A 123 1.828 -3.065 10.235 1.00 0.81 O ATOM 2023 CB LEU A 123 2.399 0.033 9.874 1.00 0.66 C ATOM 2024 CG LEU A 123 2.973 1.100 10.831 1.00 0.95 C ATOM 2025 CD1 LEU A 123 3.184 0.579 12.258 1.00 1.60 C ATOM 2026 CD2 LEU A 123 4.280 1.715 10.302 1.00 2.63 C ATOM 0 H LEU A 123 2.275 -2.012 7.938 1.00 0.52 H new ATOM 0 HA LEU A 123 4.282 -0.971 9.888 1.00 0.61 H new ATOM 0 HB2 LEU A 123 2.205 0.511 8.914 1.00 0.66 H new ATOM 0 HB3 LEU A 123 1.436 -0.291 10.269 1.00 0.66 H new ATOM 0 HG LEU A 123 2.212 1.880 10.872 1.00 0.95 H new ATOM 0 HD11 LEU A 123 3.589 1.377 12.880 1.00 1.60 H new ATOM 0 HD12 LEU A 123 2.231 0.247 12.669 1.00 1.60 H new ATOM 0 HD13 LEU A 123 3.883 -0.258 12.240 1.00 1.60 H new ATOM 0 HD21 LEU A 123 4.644 2.460 11.010 1.00 2.63 H new ATOM 0 HD22 LEU A 123 5.028 0.932 10.182 1.00 2.63 H new ATOM 0 HD23 LEU A 123 4.095 2.190 9.339 1.00 2.63 H new ATOM 2038 N MET A 124 3.681 -2.727 11.478 1.00 0.93 N ATOM 2039 CA MET A 124 3.537 -3.876 12.372 1.00 1.10 C ATOM 2040 C MET A 124 3.223 -3.374 13.786 1.00 1.38 C ATOM 2041 O MET A 124 3.945 -2.537 14.333 1.00 1.59 O ATOM 2042 CB MET A 124 4.839 -4.690 12.317 1.00 1.23 C ATOM 2043 CG MET A 124 4.748 -6.057 13.003 1.00 1.31 C ATOM 2044 SD MET A 124 3.686 -7.284 12.202 1.00 2.26 S ATOM 2045 CE MET A 124 2.200 -7.193 13.235 1.00 1.30 C ATOM 0 H MET A 124 4.498 -2.157 11.696 1.00 0.93 H new ATOM 0 HA MET A 124 2.715 -4.523 12.066 1.00 1.10 H new ATOM 0 HB2 MET A 124 5.120 -4.836 11.274 1.00 1.23 H new ATOM 0 HB3 MET A 124 5.637 -4.113 12.784 1.00 1.23 H new ATOM 0 HG2 MET A 124 5.754 -6.471 13.077 1.00 1.31 H new ATOM 0 HG3 MET A 124 4.389 -5.906 14.021 1.00 1.31 H new ATOM 0 HE1 MET A 124 1.705 -8.164 13.247 1.00 1.30 H new ATOM 0 HE2 MET A 124 2.480 -6.916 14.251 1.00 1.30 H new ATOM 0 HE3 MET A 124 1.520 -6.444 12.829 1.00 1.30 H new ATOM 2055 N LEU A 125 2.118 -3.859 14.357 1.00 1.42 N ATOM 2056 CA LEU A 125 1.502 -3.342 15.583 1.00 1.59 C ATOM 2057 C LEU A 125 0.771 -4.457 16.366 1.00 1.10 C ATOM 2058 O LEU A 125 0.257 -5.384 15.735 1.00 1.19 O ATOM 2059 CB LEU A 125 0.561 -2.169 15.217 1.00 2.35 C ATOM 2060 CG LEU A 125 -0.535 -2.497 14.166 1.00 1.48 C ATOM 2061 CD1 LEU A 125 -1.943 -2.366 14.762 1.00 1.81 C ATOM 2062 CD2 LEU A 125 -0.408 -1.580 12.940 1.00 2.66 C ATOM 0 H LEU A 125 1.609 -4.651 13.965 1.00 1.42 H new ATOM 0 HA LEU A 125 2.280 -2.970 16.250 1.00 1.59 H new ATOM 0 HB2 LEU A 125 0.074 -1.818 16.127 1.00 2.35 H new ATOM 0 HB3 LEU A 125 1.166 -1.344 14.841 1.00 2.35 H new ATOM 0 HG LEU A 125 -0.385 -3.531 13.857 1.00 1.48 H new ATOM 0 HD11 LEU A 125 -2.685 -2.603 13.999 1.00 1.81 H new ATOM 0 HD12 LEU A 125 -2.050 -3.057 15.598 1.00 1.81 H new ATOM 0 HD13 LEU A 125 -2.096 -1.345 15.113 1.00 1.81 H new ATOM 0 HD21 LEU A 125 -1.186 -1.828 12.218 1.00 2.66 H new ATOM 0 HD22 LEU A 125 -0.519 -0.541 13.250 1.00 2.66 H new ATOM 0 HD23 LEU A 125 0.571 -1.719 12.481 1.00 2.66 H new ATOM 2074 N PRO A 126 0.694 -4.373 17.712 1.00 1.00 N ATOM 2075 CA PRO A 126 -0.003 -5.355 18.546 1.00 1.18 C ATOM 2076 C PRO A 126 -1.517 -5.095 18.669 1.00 1.73 C ATOM 2077 O PRO A 126 -2.242 -5.972 19.134 1.00 2.31 O ATOM 2078 CB PRO A 126 0.679 -5.239 19.913 1.00 1.32 C ATOM 2079 CG PRO A 126 1.024 -3.754 19.999 1.00 1.34 C ATOM 2080 CD PRO A 126 1.400 -3.414 18.556 1.00 1.33 C ATOM 0 HA PRO A 126 0.064 -6.351 18.108 1.00 1.18 H new ATOM 0 HB2 PRO A 126 0.017 -5.547 20.722 1.00 1.32 H new ATOM 0 HB3 PRO A 126 1.570 -5.865 19.974 1.00 1.32 H new ATOM 0 HG2 PRO A 126 0.179 -3.161 20.348 1.00 1.34 H new ATOM 0 HG3 PRO A 126 1.849 -3.569 20.687 1.00 1.34 H new ATOM 0 HD2 PRO A 126 1.111 -2.392 18.309 1.00 1.33 H new ATOM 0 HD3 PRO A 126 2.478 -3.485 18.408 1.00 1.33 H new ATOM 2088 N GLU A 127 -2.004 -3.905 18.286 1.00 2.05 N ATOM 2089 CA GLU A 127 -3.380 -3.454 18.552 1.00 3.01 C ATOM 2090 C GLU A 127 -4.457 -4.186 17.718 1.00 3.44 C ATOM 2091 O GLU A 127 -5.635 -4.120 18.071 1.00 4.44 O ATOM 2092 CB GLU A 127 -3.456 -1.926 18.323 1.00 3.76 C ATOM 2093 CG GLU A 127 -4.488 -1.199 19.214 1.00 3.81 C ATOM 2094 CD GLU A 127 -5.566 -0.425 18.437 1.00 4.01 C ATOM 2095 OE1 GLU A 127 -5.269 0.230 17.414 1.00 5.04 O ATOM 2096 OE2 GLU A 127 -6.756 -0.482 18.824 1.00 4.26 O ATOM 0 H GLU A 127 -1.447 -3.219 17.776 1.00 2.05 H new ATOM 0 HA GLU A 127 -3.606 -3.703 19.589 1.00 3.01 H new ATOM 0 HB2 GLU A 127 -2.471 -1.494 18.502 1.00 3.76 H new ATOM 0 HB3 GLU A 127 -3.701 -1.739 17.277 1.00 3.76 H new ATOM 0 HG2 GLU A 127 -4.976 -1.932 19.856 1.00 3.81 H new ATOM 0 HG3 GLU A 127 -3.960 -0.505 19.868 1.00 3.81 H new ATOM 2103 N ARG A 128 -4.059 -4.881 16.637 1.00 3.05 N ATOM 2104 CA ARG A 128 -4.891 -5.613 15.656 1.00 3.62 C ATOM 2105 C ARG A 128 -4.006 -6.317 14.603 1.00 2.36 C ATOM 2106 O ARG A 128 -2.779 -6.211 14.645 1.00 2.97 O ATOM 2107 CB ARG A 128 -5.933 -4.675 14.989 1.00 5.49 C ATOM 2108 CG ARG A 128 -7.377 -5.002 15.432 1.00 6.74 C ATOM 2109 CD ARG A 128 -8.476 -4.084 14.857 1.00 8.63 C ATOM 2110 NE ARG A 128 -8.065 -2.664 14.749 1.00 10.20 N ATOM 2111 CZ ARG A 128 -7.665 -1.888 15.747 1.00 11.05 C ATOM 2112 NH1 ARG A 128 -7.789 -2.258 16.999 1.00 10.71 N ATOM 2113 NH2 ARG A 128 -7.119 -0.719 15.504 1.00 12.55 N ATOM 0 H ARG A 128 -3.068 -4.953 16.405 1.00 3.05 H new ATOM 0 HA ARG A 128 -5.446 -6.383 16.192 1.00 3.62 H new ATOM 0 HB2 ARG A 128 -5.702 -3.640 15.241 1.00 5.49 H new ATOM 0 HB3 ARG A 128 -5.858 -4.763 13.905 1.00 5.49 H new ATOM 0 HG2 ARG A 128 -7.601 -6.030 15.147 1.00 6.74 H new ATOM 0 HG3 ARG A 128 -7.423 -4.956 16.520 1.00 6.74 H new ATOM 0 HD2 ARG A 128 -8.762 -4.447 13.870 1.00 8.63 H new ATOM 0 HD3 ARG A 128 -9.361 -4.150 15.489 1.00 8.63 H new ATOM 0 HE ARG A 128 -8.092 -2.244 13.820 1.00 10.20 H new ATOM 0 HH11 ARG A 128 -8.202 -3.163 17.225 1.00 10.71 H new ATOM 0 HH12 ARG A 128 -7.473 -1.641 17.747 1.00 10.71 H new ATOM 0 HH21 ARG A 128 -7.000 -0.402 14.542 1.00 12.55 H new ATOM 0 HH22 ARG A 128 -6.814 -0.128 16.277 1.00 12.55 H new ATOM 2127 N ALA A 129 -4.629 -7.022 13.651 1.00 1.94 N ATOM 2128 CA ALA A 129 -3.975 -7.590 12.464 1.00 1.08 C ATOM 2129 C ALA A 129 -3.261 -6.531 11.591 1.00 1.40 C ATOM 2130 O ALA A 129 -3.492 -5.326 11.731 1.00 2.61 O ATOM 2131 CB ALA A 129 -5.031 -8.353 11.662 1.00 1.86 C ATOM 0 H ALA A 129 -5.629 -7.219 13.685 1.00 1.94 H new ATOM 0 HA ALA A 129 -3.183 -8.263 12.794 1.00 1.08 H new ATOM 0 HB1 ALA A 129 -4.571 -8.786 10.774 1.00 1.86 H new ATOM 0 HB2 ALA A 129 -5.450 -9.149 12.277 1.00 1.86 H new ATOM 0 HB3 ALA A 129 -5.825 -7.669 11.363 1.00 1.86 H new ATOM 2137 N LEU A 130 -2.387 -6.997 10.689 1.00 0.75 N ATOM 2138 CA LEU A 130 -1.473 -6.166 9.896 1.00 0.90 C ATOM 2139 C LEU A 130 -1.855 -6.102 8.408 1.00 0.57 C ATOM 2140 O LEU A 130 -2.682 -6.873 7.921 1.00 0.56 O ATOM 2141 CB LEU A 130 -0.014 -6.604 10.162 1.00 1.48 C ATOM 2142 CG LEU A 130 0.614 -7.603 9.154 1.00 0.96 C ATOM 2143 CD1 LEU A 130 1.800 -6.931 8.451 1.00 1.70 C ATOM 2144 CD2 LEU A 130 1.114 -8.879 9.835 1.00 2.00 C ATOM 0 H LEU A 130 -2.294 -7.992 10.485 1.00 0.75 H new ATOM 0 HA LEU A 130 -1.566 -5.131 10.224 1.00 0.90 H new ATOM 0 HB2 LEU A 130 0.609 -5.710 10.187 1.00 1.48 H new ATOM 0 HB3 LEU A 130 0.030 -7.051 11.155 1.00 1.48 H new ATOM 0 HG LEU A 130 -0.164 -7.880 8.442 1.00 0.96 H new ATOM 0 HD11 LEU A 130 2.245 -7.629 7.741 1.00 1.70 H new ATOM 0 HD12 LEU A 130 1.453 -6.045 7.920 1.00 1.70 H new ATOM 0 HD13 LEU A 130 2.546 -6.642 9.192 1.00 1.70 H new ATOM 0 HD21 LEU A 130 1.544 -9.546 9.088 1.00 2.00 H new ATOM 0 HD22 LEU A 130 1.874 -8.623 10.574 1.00 2.00 H new ATOM 0 HD23 LEU A 130 0.281 -9.378 10.329 1.00 2.00 H new ATOM 2156 N GLY A 131 -1.240 -5.170 7.683 1.00 0.59 N ATOM 2157 CA GLY A 131 -1.406 -4.995 6.239 1.00 0.69 C ATOM 2158 C GLY A 131 -0.272 -4.205 5.591 1.00 0.66 C ATOM 2159 O GLY A 131 0.648 -3.737 6.267 1.00 0.70 O ATOM 0 H GLY A 131 -0.594 -4.496 8.094 1.00 0.59 H new ATOM 0 HA2 GLY A 131 -1.472 -5.975 5.767 1.00 0.69 H new ATOM 0 HA3 GLY A 131 -2.350 -4.485 6.048 1.00 0.69 H new ATOM 2163 N PHE A 132 -0.332 -4.091 4.267 1.00 0.71 N ATOM 2164 CA PHE A 132 0.540 -3.228 3.468 1.00 0.54 C ATOM 2165 C PHE A 132 -0.259 -2.480 2.387 1.00 0.53 C ATOM 2166 O PHE A 132 -1.319 -2.943 1.955 1.00 0.69 O ATOM 2167 CB PHE A 132 1.692 -4.064 2.885 1.00 0.82 C ATOM 2168 CG PHE A 132 1.290 -5.211 1.981 1.00 1.54 C ATOM 2169 CD1 PHE A 132 1.166 -5.003 0.595 1.00 3.27 C ATOM 2170 CD2 PHE A 132 1.073 -6.496 2.517 1.00 2.42 C ATOM 2171 CE1 PHE A 132 0.840 -6.077 -0.251 1.00 4.71 C ATOM 2172 CE2 PHE A 132 0.740 -7.569 1.671 1.00 3.78 C ATOM 2173 CZ PHE A 132 0.641 -7.362 0.283 1.00 4.72 C ATOM 0 H PHE A 132 -1.006 -4.609 3.703 1.00 0.71 H new ATOM 0 HA PHE A 132 0.975 -2.459 4.106 1.00 0.54 H new ATOM 0 HB2 PHE A 132 2.349 -3.399 2.325 1.00 0.82 H new ATOM 0 HB3 PHE A 132 2.276 -4.467 3.712 1.00 0.82 H new ATOM 0 HD1 PHE A 132 1.321 -4.018 0.181 1.00 3.27 H new ATOM 0 HD2 PHE A 132 1.163 -6.657 3.581 1.00 2.42 H new ATOM 0 HE1 PHE A 132 0.742 -5.915 -1.314 1.00 4.71 H new ATOM 0 HE2 PHE A 132 0.561 -8.550 2.086 1.00 3.78 H new ATOM 0 HZ PHE A 132 0.412 -8.190 -0.372 1.00 4.72 H new ATOM 2183 N LEU A 133 0.253 -1.328 1.939 1.00 0.42 N ATOM 2184 CA LEU A 133 -0.308 -0.557 0.821 1.00 0.37 C ATOM 2185 C LEU A 133 0.778 -0.090 -0.150 1.00 0.34 C ATOM 2186 O LEU A 133 1.943 0.065 0.223 1.00 0.37 O ATOM 2187 CB LEU A 133 -1.210 0.607 1.308 1.00 0.42 C ATOM 2188 CG LEU A 133 -0.529 1.974 1.563 1.00 0.52 C ATOM 2189 CD1 LEU A 133 -1.590 3.051 1.832 1.00 1.81 C ATOM 2190 CD2 LEU A 133 0.441 1.938 2.748 1.00 1.82 C ATOM 0 H LEU A 133 1.082 -0.897 2.349 1.00 0.42 H new ATOM 0 HA LEU A 133 -0.956 -1.232 0.262 1.00 0.37 H new ATOM 0 HB2 LEU A 133 -1.998 0.755 0.569 1.00 0.42 H new ATOM 0 HB3 LEU A 133 -1.695 0.294 2.233 1.00 0.42 H new ATOM 0 HG LEU A 133 0.041 2.209 0.664 1.00 0.52 H new ATOM 0 HD11 LEU A 133 -1.100 4.008 2.010 1.00 1.81 H new ATOM 0 HD12 LEU A 133 -2.249 3.136 0.968 1.00 1.81 H new ATOM 0 HD13 LEU A 133 -2.175 2.774 2.709 1.00 1.81 H new ATOM 0 HD21 LEU A 133 0.890 2.922 2.881 1.00 1.82 H new ATOM 0 HD22 LEU A 133 -0.100 1.660 3.653 1.00 1.82 H new ATOM 0 HD23 LEU A 133 1.225 1.205 2.555 1.00 1.82 H new ATOM 2202 N SER A 134 0.377 0.175 -1.387 1.00 0.35 N ATOM 2203 CA SER A 134 1.243 0.706 -2.439 1.00 0.42 C ATOM 2204 C SER A 134 0.504 1.649 -3.393 1.00 0.47 C ATOM 2205 O SER A 134 -0.682 1.470 -3.691 1.00 0.59 O ATOM 2206 CB SER A 134 1.858 -0.422 -3.281 1.00 0.51 C ATOM 2207 OG SER A 134 2.724 -1.235 -2.512 1.00 1.32 O ATOM 0 H SER A 134 -0.583 0.024 -1.697 1.00 0.35 H new ATOM 0 HA SER A 134 2.022 1.262 -1.917 1.00 0.42 H new ATOM 0 HB2 SER A 134 1.063 -1.036 -3.704 1.00 0.51 H new ATOM 0 HB3 SER A 134 2.409 0.007 -4.118 1.00 0.51 H new ATOM 0 HG SER A 134 3.651 -0.946 -2.648 1.00 1.32 H new ATOM 2213 N PHE A 135 1.251 2.614 -3.936 1.00 0.43 N ATOM 2214 CA PHE A 135 0.890 3.336 -5.152 1.00 0.42 C ATOM 2215 C PHE A 135 1.847 2.907 -6.271 1.00 0.37 C ATOM 2216 O PHE A 135 3.064 2.847 -6.073 1.00 0.35 O ATOM 2217 CB PHE A 135 0.959 4.859 -4.934 1.00 0.48 C ATOM 2218 CG PHE A 135 0.408 5.385 -3.618 1.00 0.51 C ATOM 2219 CD1 PHE A 135 -0.848 4.960 -3.147 1.00 1.61 C ATOM 2220 CD2 PHE A 135 1.161 6.303 -2.858 1.00 1.81 C ATOM 2221 CE1 PHE A 135 -1.336 5.424 -1.912 1.00 1.63 C ATOM 2222 CE2 PHE A 135 0.674 6.766 -1.624 1.00 1.94 C ATOM 2223 CZ PHE A 135 -0.569 6.320 -1.148 1.00 0.92 C ATOM 0 H PHE A 135 2.138 2.918 -3.534 1.00 0.43 H new ATOM 0 HA PHE A 135 -0.137 3.096 -5.427 1.00 0.42 H new ATOM 0 HB2 PHE A 135 2.001 5.168 -5.014 1.00 0.48 H new ATOM 0 HB3 PHE A 135 0.419 5.344 -5.747 1.00 0.48 H new ATOM 0 HD1 PHE A 135 -1.440 4.275 -3.736 1.00 1.61 H new ATOM 0 HD2 PHE A 135 2.115 6.651 -3.225 1.00 1.81 H new ATOM 0 HE1 PHE A 135 -2.298 5.092 -1.552 1.00 1.63 H new ATOM 0 HE2 PHE A 135 1.256 7.465 -1.042 1.00 1.94 H new ATOM 0 HZ PHE A 135 -0.936 6.666 -0.193 1.00 0.92 H new ATOM 2233 N SER A 136 1.306 2.642 -7.452 1.00 0.40 N ATOM 2234 CA SER A 136 2.057 2.489 -8.702 1.00 0.42 C ATOM 2235 C SER A 136 2.049 3.817 -9.478 1.00 0.54 C ATOM 2236 O SER A 136 1.156 4.641 -9.276 1.00 0.79 O ATOM 2237 CB SER A 136 1.425 1.380 -9.560 1.00 0.58 C ATOM 2238 OG SER A 136 1.275 0.170 -8.830 1.00 2.15 O ATOM 0 H SER A 136 0.301 2.523 -7.576 1.00 0.40 H new ATOM 0 HA SER A 136 3.086 2.216 -8.469 1.00 0.42 H new ATOM 0 HB2 SER A 136 0.451 1.710 -9.921 1.00 0.58 H new ATOM 0 HB3 SER A 136 2.046 1.201 -10.438 1.00 0.58 H new ATOM 0 HG SER A 136 2.128 -0.312 -8.818 1.00 2.15 H new ATOM 2244 N ARG A 137 3.006 4.025 -10.392 1.00 0.52 N ATOM 2245 CA ARG A 137 3.039 5.174 -11.305 1.00 0.62 C ATOM 2246 C ARG A 137 3.605 4.804 -12.684 1.00 0.70 C ATOM 2247 O ARG A 137 4.567 4.045 -12.792 1.00 0.68 O ATOM 2248 CB ARG A 137 3.687 6.406 -10.632 1.00 0.67 C ATOM 2249 CG ARG A 137 4.004 7.551 -11.613 1.00 2.20 C ATOM 2250 CD ARG A 137 3.901 8.970 -11.034 1.00 2.96 C ATOM 2251 NE ARG A 137 3.084 9.813 -11.930 1.00 4.49 N ATOM 2252 CZ ARG A 137 2.845 11.114 -11.842 1.00 5.55 C ATOM 2253 NH1 ARG A 137 3.337 11.858 -10.878 1.00 5.50 N ATOM 2254 NH2 ARG A 137 2.087 11.683 -12.749 1.00 7.07 N ATOM 0 H ARG A 137 3.792 3.388 -10.519 1.00 0.52 H new ATOM 0 HA ARG A 137 2.014 5.478 -11.518 1.00 0.62 H new ATOM 0 HB2 ARG A 137 3.019 6.779 -9.856 1.00 0.67 H new ATOM 0 HB3 ARG A 137 4.608 6.097 -10.138 1.00 0.67 H new ATOM 0 HG2 ARG A 137 5.014 7.407 -11.997 1.00 2.20 H new ATOM 0 HG3 ARG A 137 3.326 7.475 -12.463 1.00 2.20 H new ATOM 0 HD2 ARG A 137 3.453 8.937 -10.041 1.00 2.96 H new ATOM 0 HD3 ARG A 137 4.896 9.400 -10.920 1.00 2.96 H new ATOM 0 HE ARG A 137 2.648 9.333 -12.717 1.00 4.49 H new ATOM 0 HH11 ARG A 137 3.928 11.438 -10.160 1.00 5.50 H new ATOM 0 HH12 ARG A 137 3.129 12.856 -10.847 1.00 5.50 H new ATOM 0 HH21 ARG A 137 1.692 11.125 -13.506 1.00 7.07 H new ATOM 0 HH22 ARG A 137 1.893 12.683 -12.697 1.00 7.07 H new ATOM 2268 N CYS A 138 2.991 5.344 -13.741 1.00 0.86 N ATOM 2269 CA CYS A 138 3.356 5.140 -15.148 1.00 1.06 C ATOM 2270 C CYS A 138 4.593 5.933 -15.612 1.00 1.17 C ATOM 2271 O CYS A 138 5.241 5.543 -16.584 1.00 1.36 O ATOM 2272 CB CYS A 138 2.111 5.443 -15.997 1.00 1.31 C ATOM 2273 SG CYS A 138 1.571 7.163 -15.751 1.00 1.95 S ATOM 0 H CYS A 138 2.188 5.964 -13.635 1.00 0.86 H new ATOM 0 HA CYS A 138 3.668 4.103 -15.276 1.00 1.06 H new ATOM 0 HB2 CYS A 138 2.333 5.273 -17.051 1.00 1.31 H new ATOM 0 HB3 CYS A 138 1.305 4.761 -15.727 1.00 1.31 H new ATOM 0 HG CYS A 138 1.130 7.310 -14.537 1.00 1.95 H new ATOM 2279 N SER A 139 4.957 7.005 -14.911 1.00 1.17 N ATOM 2280 CA SER A 139 6.214 7.737 -15.109 1.00 1.35 C ATOM 2281 C SER A 139 7.421 6.881 -14.675 1.00 1.09 C ATOM 2282 O SER A 139 7.461 6.367 -13.557 1.00 1.07 O ATOM 2283 CB SER A 139 6.188 9.063 -14.330 1.00 1.60 C ATOM 2284 OG SER A 139 4.992 9.785 -14.595 1.00 2.80 O ATOM 0 H SER A 139 4.376 7.401 -14.172 1.00 1.17 H new ATOM 0 HA SER A 139 6.318 7.958 -16.171 1.00 1.35 H new ATOM 0 HB2 SER A 139 6.267 8.863 -13.261 1.00 1.60 H new ATOM 0 HB3 SER A 139 7.051 9.668 -14.606 1.00 1.60 H new ATOM 0 HG SER A 139 4.997 10.623 -14.088 1.00 2.80 H new ATOM 2290 N ALA A 140 8.421 6.727 -15.550 1.00 0.97 N ATOM 2291 CA ALA A 140 9.514 5.746 -15.431 1.00 0.95 C ATOM 2292 C ALA A 140 10.679 6.189 -14.510 1.00 0.91 C ATOM 2293 O ALA A 140 11.813 5.727 -14.656 1.00 1.03 O ATOM 2294 CB ALA A 140 9.991 5.434 -16.858 1.00 1.00 C ATOM 0 H ALA A 140 8.497 7.300 -16.390 1.00 0.97 H new ATOM 0 HA ALA A 140 9.132 4.853 -14.936 1.00 0.95 H new ATOM 0 HB1 ALA A 140 10.804 4.709 -16.820 1.00 1.00 H new ATOM 0 HB2 ALA A 140 9.164 5.022 -17.436 1.00 1.00 H new ATOM 0 HB3 ALA A 140 10.344 6.350 -17.332 1.00 1.00 H new ATOM 2300 N ARG A 141 10.422 7.151 -13.620 1.00 0.86 N ATOM 2301 CA ARG A 141 11.428 7.985 -12.958 1.00 0.87 C ATOM 2302 C ARG A 141 12.174 7.279 -11.810 1.00 0.89 C ATOM 2303 O ARG A 141 11.668 6.364 -11.156 1.00 1.05 O ATOM 2304 CB ARG A 141 10.744 9.288 -12.497 1.00 0.96 C ATOM 2305 CG ARG A 141 10.815 10.432 -13.526 1.00 1.11 C ATOM 2306 CD ARG A 141 10.252 10.075 -14.909 1.00 1.47 C ATOM 2307 NE ARG A 141 10.106 11.279 -15.748 1.00 2.23 N ATOM 2308 CZ ARG A 141 10.558 11.472 -16.985 1.00 3.03 C ATOM 2309 NH1 ARG A 141 11.253 10.563 -17.638 1.00 3.78 N ATOM 2310 NH2 ARG A 141 10.309 12.612 -17.591 1.00 3.69 N ATOM 0 H ARG A 141 9.471 7.379 -13.330 1.00 0.86 H new ATOM 0 HA ARG A 141 12.215 8.207 -13.679 1.00 0.87 H new ATOM 0 HB2 ARG A 141 9.698 9.078 -12.275 1.00 0.96 H new ATOM 0 HB3 ARG A 141 11.207 9.620 -11.568 1.00 0.96 H new ATOM 0 HG2 ARG A 141 10.269 11.291 -13.135 1.00 1.11 H new ATOM 0 HG3 ARG A 141 11.855 10.740 -13.638 1.00 1.11 H new ATOM 0 HD2 ARG A 141 10.913 9.362 -15.402 1.00 1.47 H new ATOM 0 HD3 ARG A 141 9.284 9.587 -14.796 1.00 1.47 H new ATOM 0 HE ARG A 141 9.597 12.058 -15.330 1.00 2.23 H new ATOM 0 HH11 ARG A 141 11.464 9.668 -17.196 1.00 3.78 H new ATOM 0 HH12 ARG A 141 11.580 10.754 -18.585 1.00 3.78 H new ATOM 0 HH21 ARG A 141 9.774 13.337 -17.113 1.00 3.69 H new ATOM 0 HH22 ARG A 141 10.650 12.771 -18.539 1.00 3.69 H new ATOM 2324 N GLU A 142 13.398 7.742 -11.562 1.00 0.84 N ATOM 2325 CA GLU A 142 14.256 7.325 -10.445 1.00 0.81 C ATOM 2326 C GLU A 142 13.724 7.858 -9.100 1.00 0.77 C ATOM 2327 O GLU A 142 13.037 8.882 -9.059 1.00 0.84 O ATOM 2328 CB GLU A 142 15.697 7.810 -10.683 1.00 0.91 C ATOM 2329 CG GLU A 142 16.350 7.103 -11.877 1.00 2.50 C ATOM 2330 CD GLU A 142 17.764 7.646 -12.135 1.00 2.91 C ATOM 2331 OE1 GLU A 142 18.731 7.158 -11.503 1.00 2.89 O ATOM 2332 OE2 GLU A 142 17.919 8.563 -12.977 1.00 3.96 O ATOM 0 H GLU A 142 13.840 8.445 -12.154 1.00 0.84 H new ATOM 0 HA GLU A 142 14.248 6.236 -10.396 1.00 0.81 H new ATOM 0 HB2 GLU A 142 15.694 8.886 -10.856 1.00 0.91 H new ATOM 0 HB3 GLU A 142 16.292 7.633 -9.787 1.00 0.91 H new ATOM 0 HG2 GLU A 142 16.398 6.031 -11.687 1.00 2.50 H new ATOM 0 HG3 GLU A 142 15.736 7.242 -12.767 1.00 2.50 H new ATOM 2339 N ILE A 143 14.044 7.178 -7.991 1.00 0.78 N ATOM 2340 CA ILE A 143 13.570 7.535 -6.640 1.00 0.77 C ATOM 2341 C ILE A 143 14.766 7.756 -5.678 1.00 0.73 C ATOM 2342 O ILE A 143 15.555 6.822 -5.504 1.00 0.81 O ATOM 2343 CB ILE A 143 12.614 6.446 -6.080 1.00 0.84 C ATOM 2344 CG1 ILE A 143 11.426 6.129 -7.023 1.00 1.06 C ATOM 2345 CG2 ILE A 143 12.088 6.948 -4.727 1.00 1.27 C ATOM 2346 CD1 ILE A 143 10.480 5.039 -6.491 1.00 1.92 C ATOM 0 H ILE A 143 14.646 6.355 -8.003 1.00 0.78 H new ATOM 0 HA ILE A 143 13.013 8.469 -6.716 1.00 0.77 H new ATOM 0 HB ILE A 143 13.172 5.515 -5.980 1.00 0.84 H new ATOM 0 HG12 ILE A 143 10.854 7.042 -7.190 1.00 1.06 H new ATOM 0 HG13 ILE A 143 11.817 5.816 -7.991 1.00 1.06 H new ATOM 0 HG21 ILE A 143 11.411 6.207 -4.302 1.00 1.27 H new ATOM 0 HG22 ILE A 143 12.925 7.107 -4.047 1.00 1.27 H new ATOM 0 HG23 ILE A 143 11.554 7.887 -4.870 1.00 1.27 H new ATOM 0 HD11 ILE A 143 9.675 4.875 -7.207 1.00 1.92 H new ATOM 0 HD12 ILE A 143 11.036 4.112 -6.351 1.00 1.92 H new ATOM 0 HD13 ILE A 143 10.058 5.357 -5.538 1.00 1.92 H new ATOM 2358 N PRO A 144 14.894 8.939 -5.029 1.00 0.75 N ATOM 2359 CA PRO A 144 15.910 9.199 -4.004 1.00 0.82 C ATOM 2360 C PRO A 144 15.471 8.749 -2.598 1.00 0.85 C ATOM 2361 O PRO A 144 16.179 7.987 -1.944 1.00 1.58 O ATOM 2362 CB PRO A 144 16.166 10.707 -4.080 1.00 0.94 C ATOM 2363 CG PRO A 144 14.837 11.296 -4.557 1.00 0.96 C ATOM 2364 CD PRO A 144 14.220 10.180 -5.400 1.00 0.85 C ATOM 0 HA PRO A 144 16.817 8.623 -4.188 1.00 0.82 H new ATOM 0 HB2 PRO A 144 16.454 11.110 -3.109 1.00 0.94 H new ATOM 0 HB3 PRO A 144 16.975 10.938 -4.773 1.00 0.94 H new ATOM 0 HG2 PRO A 144 14.195 11.564 -3.718 1.00 0.96 H new ATOM 0 HG3 PRO A 144 14.989 12.202 -5.144 1.00 0.96 H new ATOM 0 HD2 PRO A 144 13.148 10.106 -5.216 1.00 0.85 H new ATOM 0 HD3 PRO A 144 14.348 10.385 -6.463 1.00 0.85 H new ATOM 2372 N ILE A 145 14.308 9.217 -2.128 1.00 1.08 N ATOM 2373 CA ILE A 145 13.775 9.012 -0.759 1.00 1.00 C ATOM 2374 C ILE A 145 12.246 8.843 -0.769 1.00 1.01 C ATOM 2375 O ILE A 145 11.577 9.026 0.238 1.00 1.37 O ATOM 2376 CB ILE A 145 14.292 10.153 0.160 1.00 0.99 C ATOM 2377 CG1 ILE A 145 14.140 9.856 1.680 1.00 0.97 C ATOM 2378 CG2 ILE A 145 13.776 11.540 -0.269 1.00 1.08 C ATOM 2379 CD1 ILE A 145 13.077 10.635 2.478 1.00 0.88 C ATOM 0 H ILE A 145 13.680 9.773 -2.709 1.00 1.08 H new ATOM 0 HA ILE A 145 14.146 8.075 -0.344 1.00 1.00 H new ATOM 0 HB ILE A 145 15.371 10.188 0.009 1.00 0.99 H new ATOM 0 HG12 ILE A 145 13.925 8.793 1.790 1.00 0.97 H new ATOM 0 HG13 ILE A 145 15.106 10.036 2.151 1.00 0.97 H new ATOM 0 HG21 ILE A 145 14.168 12.299 0.408 1.00 1.08 H new ATOM 0 HG22 ILE A 145 14.108 11.753 -1.285 1.00 1.08 H new ATOM 0 HG23 ILE A 145 12.687 11.550 -0.233 1.00 1.08 H new ATOM 0 HD11 ILE A 145 13.096 10.314 3.519 1.00 0.88 H new ATOM 0 HD12 ILE A 145 13.291 11.702 2.423 1.00 0.88 H new ATOM 0 HD13 ILE A 145 12.091 10.440 2.057 1.00 0.88 H new ATOM 2391 N LEU A 146 11.667 8.594 -1.949 1.00 1.05 N ATOM 2392 CA LEU A 146 10.221 8.548 -2.253 1.00 1.03 C ATOM 2393 C LEU A 146 9.536 9.928 -2.204 1.00 1.00 C ATOM 2394 O LEU A 146 8.569 10.154 -2.924 1.00 1.25 O ATOM 2395 CB LEU A 146 9.554 7.357 -1.530 1.00 1.45 C ATOM 2396 CG LEU A 146 8.606 7.594 -0.338 1.00 0.99 C ATOM 2397 CD1 LEU A 146 7.264 6.919 -0.634 1.00 1.92 C ATOM 2398 CD2 LEU A 146 9.144 6.918 0.934 1.00 2.39 C ATOM 0 H LEU A 146 12.230 8.405 -2.778 1.00 1.05 H new ATOM 0 HA LEU A 146 10.069 8.316 -3.307 1.00 1.03 H new ATOM 0 HB2 LEU A 146 8.994 6.799 -2.280 1.00 1.45 H new ATOM 0 HB3 LEU A 146 10.354 6.705 -1.179 1.00 1.45 H new ATOM 0 HG LEU A 146 8.514 8.670 -0.193 1.00 0.99 H new ATOM 0 HD11 LEU A 146 6.584 7.079 0.202 1.00 1.92 H new ATOM 0 HD12 LEU A 146 6.833 7.347 -1.539 1.00 1.92 H new ATOM 0 HD13 LEU A 146 7.418 5.849 -0.776 1.00 1.92 H new ATOM 0 HD21 LEU A 146 8.457 7.100 1.761 1.00 2.39 H new ATOM 0 HD22 LEU A 146 9.233 5.845 0.766 1.00 2.39 H new ATOM 0 HD23 LEU A 146 10.123 7.330 1.178 1.00 2.39 H new ATOM 2410 N SER A 147 10.137 10.847 -1.450 1.00 0.89 N ATOM 2411 CA SER A 147 10.019 12.317 -1.346 1.00 0.76 C ATOM 2412 C SER A 147 9.742 12.668 0.118 1.00 0.60 C ATOM 2413 O SER A 147 8.979 11.968 0.771 1.00 0.66 O ATOM 2414 CB SER A 147 8.981 12.976 -2.270 1.00 0.75 C ATOM 2415 OG SER A 147 9.328 12.827 -3.638 1.00 1.32 O ATOM 0 H SER A 147 10.839 10.528 -0.782 1.00 0.89 H new ATOM 0 HA SER A 147 10.967 12.728 -1.694 1.00 0.76 H new ATOM 0 HB2 SER A 147 8.001 12.532 -2.092 1.00 0.75 H new ATOM 0 HB3 SER A 147 8.899 14.036 -2.028 1.00 0.75 H new ATOM 0 HG SER A 147 9.162 11.903 -3.919 1.00 1.32 H new ATOM 2421 N ASP A 148 10.326 13.734 0.670 1.00 0.63 N ATOM 2422 CA ASP A 148 10.184 14.071 2.098 1.00 0.70 C ATOM 2423 C ASP A 148 8.724 14.328 2.529 1.00 0.67 C ATOM 2424 O ASP A 148 8.361 14.018 3.663 1.00 0.81 O ATOM 2425 CB ASP A 148 11.112 15.248 2.445 1.00 0.98 C ATOM 2426 CG ASP A 148 10.797 16.533 1.660 1.00 2.50 C ATOM 2427 OD1 ASP A 148 11.266 16.656 0.504 1.00 3.72 O ATOM 2428 OD2 ASP A 148 10.095 17.418 2.205 1.00 3.31 O ATOM 0 H ASP A 148 10.909 14.388 0.147 1.00 0.63 H new ATOM 0 HA ASP A 148 10.490 13.198 2.674 1.00 0.70 H new ATOM 0 HB2 ASP A 148 11.037 15.457 3.512 1.00 0.98 H new ATOM 0 HB3 ASP A 148 12.144 14.956 2.249 1.00 0.98 H new ATOM 2433 N GLU A 149 7.876 14.817 1.615 1.00 0.65 N ATOM 2434 CA GLU A 149 6.423 14.884 1.809 1.00 0.70 C ATOM 2435 C GLU A 149 5.800 13.482 1.756 1.00 0.70 C ATOM 2436 O GLU A 149 5.148 13.078 2.716 1.00 0.99 O ATOM 2437 CB GLU A 149 5.802 15.851 0.777 1.00 0.99 C ATOM 2438 CG GLU A 149 4.286 16.095 0.958 1.00 1.83 C ATOM 2439 CD GLU A 149 3.362 15.382 -0.051 1.00 2.70 C ATOM 2440 OE1 GLU A 149 3.762 14.392 -0.700 1.00 3.64 O ATOM 2441 OE2 GLU A 149 2.189 15.810 -0.188 1.00 3.26 O ATOM 0 H GLU A 149 8.183 15.180 0.712 1.00 0.65 H new ATOM 0 HA GLU A 149 6.206 15.280 2.801 1.00 0.70 H new ATOM 0 HB2 GLU A 149 6.321 16.808 0.837 1.00 0.99 H new ATOM 0 HB3 GLU A 149 5.977 15.455 -0.224 1.00 0.99 H new ATOM 0 HG2 GLU A 149 4.005 15.781 1.963 1.00 1.83 H new ATOM 0 HG3 GLU A 149 4.101 17.167 0.896 1.00 1.83 H new ATOM 2448 N LEU A 150 6.042 12.715 0.685 1.00 0.63 N ATOM 2449 CA LEU A 150 5.416 11.411 0.421 1.00 0.61 C ATOM 2450 C LEU A 150 5.828 10.361 1.458 1.00 0.56 C ATOM 2451 O LEU A 150 5.025 9.521 1.827 1.00 0.61 O ATOM 2452 CB LEU A 150 5.741 10.950 -1.015 1.00 0.66 C ATOM 2453 CG LEU A 150 4.589 10.249 -1.773 1.00 0.81 C ATOM 2454 CD1 LEU A 150 5.118 9.773 -3.129 1.00 1.75 C ATOM 2455 CD2 LEU A 150 3.946 9.043 -1.076 1.00 2.26 C ATOM 0 H LEU A 150 6.699 12.992 -0.044 1.00 0.63 H new ATOM 0 HA LEU A 150 4.336 11.527 0.510 1.00 0.61 H new ATOM 0 HB2 LEU A 150 6.056 11.819 -1.593 1.00 0.66 H new ATOM 0 HB3 LEU A 150 6.591 10.269 -0.974 1.00 0.66 H new ATOM 0 HG LEU A 150 3.804 11.002 -1.842 1.00 0.81 H new ATOM 0 HD11 LEU A 150 4.318 9.276 -3.677 1.00 1.75 H new ATOM 0 HD12 LEU A 150 5.473 10.630 -3.702 1.00 1.75 H new ATOM 0 HD13 LEU A 150 5.940 9.074 -2.974 1.00 1.75 H new ATOM 0 HD21 LEU A 150 3.153 8.639 -1.706 1.00 2.26 H new ATOM 0 HD22 LEU A 150 4.701 8.276 -0.906 1.00 2.26 H new ATOM 0 HD23 LEU A 150 3.526 9.356 -0.120 1.00 2.26 H new ATOM 2467 N GLN A 151 7.064 10.400 1.943 1.00 0.52 N ATOM 2468 CA GLN A 151 7.595 9.530 2.990 1.00 0.52 C ATOM 2469 C GLN A 151 6.833 9.724 4.307 1.00 0.51 C ATOM 2470 O GLN A 151 6.325 8.755 4.874 1.00 0.52 O ATOM 2471 CB GLN A 151 9.107 9.826 3.086 1.00 0.62 C ATOM 2472 CG GLN A 151 9.906 9.151 4.211 1.00 1.19 C ATOM 2473 CD GLN A 151 9.858 7.618 4.219 1.00 2.31 C ATOM 2474 OE1 GLN A 151 8.866 6.988 4.554 1.00 2.55 O ATOM 2475 NE2 GLN A 151 10.930 6.948 3.846 1.00 3.89 N ATOM 0 H GLN A 151 7.755 11.068 1.603 1.00 0.52 H new ATOM 0 HA GLN A 151 7.457 8.475 2.754 1.00 0.52 H new ATOM 0 HB2 GLN A 151 9.563 9.543 2.137 1.00 0.62 H new ATOM 0 HB3 GLN A 151 9.230 10.904 3.190 1.00 0.62 H new ATOM 0 HG2 GLN A 151 10.947 9.465 4.134 1.00 1.19 H new ATOM 0 HG3 GLN A 151 9.533 9.515 5.168 1.00 1.19 H new ATOM 0 HE21 GLN A 151 11.771 7.449 3.562 1.00 3.89 H new ATOM 0 HE22 GLN A 151 10.918 5.928 3.842 1.00 3.89 H new ATOM 2484 N LEU A 152 6.667 10.970 4.762 1.00 0.52 N ATOM 2485 CA LEU A 152 5.959 11.251 6.018 1.00 0.56 C ATOM 2486 C LEU A 152 4.459 10.986 5.862 1.00 0.55 C ATOM 2487 O LEU A 152 3.832 10.354 6.711 1.00 0.57 O ATOM 2488 CB LEU A 152 6.246 12.699 6.458 1.00 0.60 C ATOM 2489 CG LEU A 152 7.713 12.963 6.866 1.00 0.65 C ATOM 2490 CD1 LEU A 152 7.901 14.464 7.126 1.00 0.72 C ATOM 2491 CD2 LEU A 152 8.107 12.182 8.131 1.00 0.76 C ATOM 0 H LEU A 152 7.012 11.800 4.281 1.00 0.52 H new ATOM 0 HA LEU A 152 6.321 10.582 6.798 1.00 0.56 H new ATOM 0 HB2 LEU A 152 5.981 13.373 5.643 1.00 0.60 H new ATOM 0 HB3 LEU A 152 5.598 12.946 7.299 1.00 0.60 H new ATOM 0 HG LEU A 152 8.353 12.627 6.050 1.00 0.65 H new ATOM 0 HD11 LEU A 152 8.934 14.657 7.414 1.00 0.72 H new ATOM 0 HD12 LEU A 152 7.667 15.022 6.220 1.00 0.72 H new ATOM 0 HD13 LEU A 152 7.235 14.780 7.929 1.00 0.72 H new ATOM 0 HD21 LEU A 152 9.146 12.397 8.382 1.00 0.76 H new ATOM 0 HD22 LEU A 152 7.464 12.482 8.959 1.00 0.76 H new ATOM 0 HD23 LEU A 152 7.991 11.113 7.950 1.00 0.76 H new ATOM 2503 N LYS A 153 3.901 11.405 4.730 1.00 0.53 N ATOM 2504 CA LYS A 153 2.525 11.160 4.313 1.00 0.49 C ATOM 2505 C LYS A 153 2.196 9.673 4.193 1.00 0.43 C ATOM 2506 O LYS A 153 1.165 9.263 4.707 1.00 0.44 O ATOM 2507 CB LYS A 153 2.370 11.914 2.992 1.00 0.69 C ATOM 2508 CG LYS A 153 1.038 11.849 2.242 1.00 1.33 C ATOM 2509 CD LYS A 153 1.242 12.758 1.022 1.00 2.05 C ATOM 2510 CE LYS A 153 0.013 12.900 0.135 1.00 3.02 C ATOM 2511 NZ LYS A 153 0.282 13.861 -0.966 1.00 3.85 N ATOM 0 H LYS A 153 4.423 11.952 4.045 1.00 0.53 H new ATOM 0 HA LYS A 153 1.813 11.515 5.059 1.00 0.49 H new ATOM 0 HB2 LYS A 153 2.584 12.965 3.188 1.00 0.69 H new ATOM 0 HB3 LYS A 153 3.144 11.552 2.316 1.00 0.69 H new ATOM 0 HG2 LYS A 153 0.800 10.828 1.942 1.00 1.33 H new ATOM 0 HG3 LYS A 153 0.214 12.198 2.864 1.00 1.33 H new ATOM 0 HD2 LYS A 153 1.543 13.747 1.367 1.00 2.05 H new ATOM 0 HD3 LYS A 153 2.064 12.365 0.424 1.00 2.05 H new ATOM 0 HE2 LYS A 153 -0.260 11.929 -0.279 1.00 3.02 H new ATOM 0 HE3 LYS A 153 -0.835 13.243 0.728 1.00 3.02 H new ATOM 0 HZ1 LYS A 153 -0.619 14.196 -1.362 1.00 3.85 H new ATOM 0 HZ2 LYS A 153 0.820 14.671 -0.596 1.00 3.85 H new ATOM 0 HZ3 LYS A 153 0.834 13.390 -1.711 1.00 3.85 H new ATOM 2525 N MET A 154 3.052 8.847 3.587 1.00 0.41 N ATOM 2526 CA MET A 154 2.884 7.389 3.521 1.00 0.40 C ATOM 2527 C MET A 154 2.973 6.752 4.911 1.00 0.43 C ATOM 2528 O MET A 154 2.162 5.881 5.220 1.00 0.47 O ATOM 2529 CB MET A 154 3.892 6.769 2.541 1.00 0.44 C ATOM 2530 CG MET A 154 3.575 5.295 2.267 1.00 1.93 C ATOM 2531 SD MET A 154 2.219 4.977 1.114 1.00 2.67 S ATOM 2532 CE MET A 154 3.211 4.531 -0.330 1.00 1.33 C ATOM 0 H MET A 154 3.897 9.176 3.120 1.00 0.41 H new ATOM 0 HA MET A 154 1.884 7.180 3.141 1.00 0.40 H new ATOM 0 HB2 MET A 154 3.879 7.325 1.604 1.00 0.44 H new ATOM 0 HB3 MET A 154 4.899 6.856 2.949 1.00 0.44 H new ATOM 0 HG2 MET A 154 4.475 4.816 1.880 1.00 1.93 H new ATOM 0 HG3 MET A 154 3.340 4.812 3.215 1.00 1.93 H new ATOM 0 HE1 MET A 154 2.552 4.295 -1.165 1.00 1.33 H new ATOM 0 HE2 MET A 154 3.855 5.367 -0.601 1.00 1.33 H new ATOM 0 HE3 MET A 154 3.825 3.661 -0.095 1.00 1.33 H new ATOM 2542 N GLN A 155 3.917 7.170 5.761 1.00 0.45 N ATOM 2543 CA GLN A 155 4.029 6.657 7.137 1.00 0.51 C ATOM 2544 C GLN A 155 2.810 7.017 8.004 1.00 0.54 C ATOM 2545 O GLN A 155 2.397 6.216 8.845 1.00 0.66 O ATOM 2546 CB GLN A 155 5.342 7.121 7.785 1.00 0.60 C ATOM 2547 CG GLN A 155 6.545 6.329 7.243 1.00 1.96 C ATOM 2548 CD GLN A 155 7.865 6.707 7.925 1.00 2.73 C ATOM 2549 OE1 GLN A 155 8.119 7.845 8.301 1.00 3.12 O ATOM 2550 NE2 GLN A 155 8.755 5.757 8.146 1.00 3.65 N ATOM 0 H GLN A 155 4.621 7.868 5.521 1.00 0.45 H new ATOM 0 HA GLN A 155 4.046 5.569 7.074 1.00 0.51 H new ATOM 0 HB2 GLN A 155 5.488 8.184 7.594 1.00 0.60 H new ATOM 0 HB3 GLN A 155 5.280 6.997 8.866 1.00 0.60 H new ATOM 0 HG2 GLN A 155 6.363 5.263 7.380 1.00 1.96 H new ATOM 0 HG3 GLN A 155 6.634 6.502 6.170 1.00 1.96 H new ATOM 0 HE21 GLN A 155 8.567 4.801 7.843 1.00 3.65 H new ATOM 0 HE22 GLN A 155 9.630 5.979 8.620 1.00 3.65 H new ATOM 2559 N LEU A 156 2.183 8.173 7.764 1.00 0.49 N ATOM 2560 CA LEU A 156 0.865 8.512 8.303 1.00 0.51 C ATOM 2561 C LEU A 156 -0.211 7.613 7.671 1.00 0.46 C ATOM 2562 O LEU A 156 -0.908 6.896 8.387 1.00 0.49 O ATOM 2563 CB LEU A 156 0.661 10.037 8.113 1.00 0.60 C ATOM 2564 CG LEU A 156 -0.663 10.687 8.575 1.00 0.80 C ATOM 2565 CD1 LEU A 156 -1.784 10.552 7.541 1.00 1.12 C ATOM 2566 CD2 LEU A 156 -1.145 10.189 9.939 1.00 1.89 C ATOM 0 H LEU A 156 2.583 8.909 7.182 1.00 0.49 H new ATOM 0 HA LEU A 156 0.783 8.313 9.372 1.00 0.51 H new ATOM 0 HB2 LEU A 156 1.474 10.543 8.634 1.00 0.60 H new ATOM 0 HB3 LEU A 156 0.779 10.253 7.051 1.00 0.60 H new ATOM 0 HG LEU A 156 -0.421 11.745 8.680 1.00 0.80 H new ATOM 0 HD11 LEU A 156 -2.689 11.027 7.921 1.00 1.12 H new ATOM 0 HD12 LEU A 156 -1.483 11.036 6.612 1.00 1.12 H new ATOM 0 HD13 LEU A 156 -1.980 9.496 7.353 1.00 1.12 H new ATOM 0 HD21 LEU A 156 -2.079 10.688 10.199 1.00 1.89 H new ATOM 0 HD22 LEU A 156 -1.308 9.112 9.896 1.00 1.89 H new ATOM 0 HD23 LEU A 156 -0.392 10.412 10.695 1.00 1.89 H new ATOM 2578 N LEU A 157 -0.318 7.582 6.338 1.00 0.43 N ATOM 2579 CA LEU A 157 -1.347 6.847 5.595 1.00 0.43 C ATOM 2580 C LEU A 157 -1.342 5.357 5.923 1.00 0.42 C ATOM 2581 O LEU A 157 -2.417 4.816 6.131 1.00 0.45 O ATOM 2582 CB LEU A 157 -1.224 7.079 4.069 1.00 0.44 C ATOM 2583 CG LEU A 157 -2.262 8.064 3.497 1.00 0.60 C ATOM 2584 CD1 LEU A 157 -2.173 9.481 4.070 1.00 1.74 C ATOM 2585 CD2 LEU A 157 -2.133 8.130 1.970 1.00 1.57 C ATOM 0 H LEU A 157 0.329 8.083 5.728 1.00 0.43 H new ATOM 0 HA LEU A 157 -2.308 7.246 5.919 1.00 0.43 H new ATOM 0 HB2 LEU A 157 -0.224 7.453 3.849 1.00 0.44 H new ATOM 0 HB3 LEU A 157 -1.326 6.122 3.557 1.00 0.44 H new ATOM 0 HG LEU A 157 -3.234 7.671 3.795 1.00 0.60 H new ATOM 0 HD11 LEU A 157 -2.939 10.107 3.613 1.00 1.74 H new ATOM 0 HD12 LEU A 157 -2.328 9.448 5.148 1.00 1.74 H new ATOM 0 HD13 LEU A 157 -1.189 9.898 3.857 1.00 1.74 H new ATOM 0 HD21 LEU A 157 -2.870 8.828 1.572 1.00 1.57 H new ATOM 0 HD22 LEU A 157 -1.132 8.468 1.704 1.00 1.57 H new ATOM 0 HD23 LEU A 157 -2.306 7.140 1.547 1.00 1.57 H new ATOM 2597 N VAL A 158 -0.190 4.695 6.032 1.00 0.44 N ATOM 2598 CA VAL A 158 -0.129 3.280 6.432 1.00 0.45 C ATOM 2599 C VAL A 158 -0.679 3.058 7.849 1.00 0.44 C ATOM 2600 O VAL A 158 -1.457 2.128 8.039 1.00 0.47 O ATOM 2601 CB VAL A 158 1.271 2.656 6.226 1.00 0.51 C ATOM 2602 CG1 VAL A 158 2.315 3.145 7.233 1.00 0.54 C ATOM 2603 CG2 VAL A 158 1.207 1.121 6.275 1.00 0.62 C ATOM 0 H VAL A 158 0.721 5.115 5.849 1.00 0.44 H new ATOM 0 HA VAL A 158 -0.790 2.739 5.755 1.00 0.45 H new ATOM 0 HB VAL A 158 1.589 2.987 5.237 1.00 0.51 H new ATOM 0 HG11 VAL A 158 3.272 2.665 7.027 1.00 0.54 H new ATOM 0 HG12 VAL A 158 2.425 4.226 7.147 1.00 0.54 H new ATOM 0 HG13 VAL A 158 1.992 2.893 8.243 1.00 0.54 H new ATOM 0 HG21 VAL A 158 2.206 0.710 6.127 1.00 0.62 H new ATOM 0 HG22 VAL A 158 0.824 0.804 7.245 1.00 0.62 H new ATOM 0 HG23 VAL A 158 0.546 0.759 5.488 1.00 0.62 H new ATOM 2613 N ARG A 159 -0.363 3.918 8.832 1.00 0.46 N ATOM 2614 CA ARG A 159 -0.967 3.810 10.173 1.00 0.53 C ATOM 2615 C ARG A 159 -2.480 3.997 10.109 1.00 0.53 C ATOM 2616 O ARG A 159 -3.229 3.175 10.636 1.00 0.63 O ATOM 2617 CB ARG A 159 -0.314 4.801 11.163 1.00 0.61 C ATOM 2618 CG ARG A 159 -0.919 4.773 12.590 1.00 1.05 C ATOM 2619 CD ARG A 159 -1.969 5.866 12.916 1.00 1.52 C ATOM 2620 NE ARG A 159 -1.429 7.234 12.851 1.00 2.70 N ATOM 2621 CZ ARG A 159 -0.547 7.805 13.663 1.00 3.17 C ATOM 2622 NH1 ARG A 159 -0.026 7.183 14.703 1.00 3.03 N ATOM 2623 NH2 ARG A 159 -0.174 9.045 13.431 1.00 4.89 N ATOM 0 H ARG A 159 0.299 4.687 8.727 1.00 0.46 H new ATOM 0 HA ARG A 159 -0.775 2.804 10.546 1.00 0.53 H new ATOM 0 HB2 ARG A 159 0.751 4.581 11.229 1.00 0.61 H new ATOM 0 HB3 ARG A 159 -0.407 5.810 10.762 1.00 0.61 H new ATOM 0 HG2 ARG A 159 -1.381 3.798 12.746 1.00 1.05 H new ATOM 0 HG3 ARG A 159 -0.104 4.858 13.308 1.00 1.05 H new ATOM 0 HD2 ARG A 159 -2.802 5.779 12.218 1.00 1.52 H new ATOM 0 HD3 ARG A 159 -2.369 5.688 13.914 1.00 1.52 H new ATOM 0 HE ARG A 159 -1.775 7.815 12.088 1.00 2.70 H new ATOM 0 HH11 ARG A 159 -0.298 6.222 14.911 1.00 3.03 H new ATOM 0 HH12 ARG A 159 0.649 7.663 15.299 1.00 3.03 H new ATOM 0 HH21 ARG A 159 -0.561 9.554 12.636 1.00 4.89 H new ATOM 0 HH22 ARG A 159 0.503 9.498 14.046 1.00 4.89 H new ATOM 2637 N GLU A 160 -2.925 5.058 9.444 1.00 0.47 N ATOM 2638 CA GLU A 160 -4.334 5.438 9.418 1.00 0.58 C ATOM 2639 C GLU A 160 -5.176 4.453 8.605 1.00 0.59 C ATOM 2640 O GLU A 160 -6.231 4.022 9.057 1.00 0.67 O ATOM 2641 CB GLU A 160 -4.499 6.814 8.779 1.00 0.85 C ATOM 2642 CG GLU A 160 -3.813 7.967 9.514 1.00 1.33 C ATOM 2643 CD GLU A 160 -4.389 8.294 10.885 1.00 1.63 C ATOM 2644 OE1 GLU A 160 -5.625 8.249 11.054 1.00 2.84 O ATOM 2645 OE2 GLU A 160 -3.570 8.616 11.776 1.00 2.25 O ATOM 0 H GLU A 160 -2.319 5.679 8.908 1.00 0.47 H new ATOM 0 HA GLU A 160 -4.675 5.441 10.453 1.00 0.58 H new ATOM 0 HB2 GLU A 160 -4.110 6.772 7.762 1.00 0.85 H new ATOM 0 HB3 GLU A 160 -5.564 7.036 8.705 1.00 0.85 H new ATOM 0 HG2 GLU A 160 -2.756 7.726 9.629 1.00 1.33 H new ATOM 0 HG3 GLU A 160 -3.870 8.860 8.891 1.00 1.33 H new ATOM 2652 N SER A 161 -4.706 4.074 7.419 1.00 0.56 N ATOM 2653 CA SER A 161 -5.379 3.133 6.528 1.00 0.63 C ATOM 2654 C SER A 161 -5.517 1.783 7.208 1.00 0.65 C ATOM 2655 O SER A 161 -6.627 1.268 7.298 1.00 0.73 O ATOM 2656 CB SER A 161 -4.592 2.963 5.221 1.00 0.64 C ATOM 2657 OG SER A 161 -5.189 1.985 4.386 1.00 1.03 O ATOM 0 H SER A 161 -3.824 4.422 7.042 1.00 0.56 H new ATOM 0 HA SER A 161 -6.367 3.531 6.297 1.00 0.63 H new ATOM 0 HB2 SER A 161 -4.547 3.916 4.694 1.00 0.64 H new ATOM 0 HB3 SER A 161 -3.565 2.675 5.447 1.00 0.64 H new ATOM 0 HG SER A 161 -4.588 1.782 3.638 1.00 1.03 H new ATOM 2663 N LEU A 162 -4.418 1.222 7.733 1.00 0.65 N ATOM 2664 CA LEU A 162 -4.482 -0.091 8.360 1.00 0.77 C ATOM 2665 C LEU A 162 -5.398 -0.053 9.572 1.00 0.76 C ATOM 2666 O LEU A 162 -6.255 -0.922 9.676 1.00 0.83 O ATOM 2667 CB LEU A 162 -3.078 -0.609 8.703 1.00 0.92 C ATOM 2668 CG LEU A 162 -2.196 -0.879 7.467 1.00 2.23 C ATOM 2669 CD1 LEU A 162 -0.834 -1.388 7.950 1.00 2.26 C ATOM 2670 CD2 LEU A 162 -2.840 -1.877 6.496 1.00 3.82 C ATOM 0 H LEU A 162 -3.494 1.653 7.733 1.00 0.65 H new ATOM 0 HA LEU A 162 -4.910 -0.799 7.650 1.00 0.77 H new ATOM 0 HB2 LEU A 162 -2.578 0.119 9.342 1.00 0.92 H new ATOM 0 HB3 LEU A 162 -3.171 -1.529 9.280 1.00 0.92 H new ATOM 0 HG LEU A 162 -2.078 0.051 6.910 1.00 2.23 H new ATOM 0 HD11 LEU A 162 -0.194 -1.586 7.090 1.00 2.26 H new ATOM 0 HD12 LEU A 162 -0.368 -0.634 8.584 1.00 2.26 H new ATOM 0 HD13 LEU A 162 -0.970 -2.307 8.520 1.00 2.26 H new ATOM 0 HD21 LEU A 162 -2.179 -2.033 5.643 1.00 3.82 H new ATOM 0 HD22 LEU A 162 -3.004 -2.826 7.006 1.00 3.82 H new ATOM 0 HD23 LEU A 162 -3.795 -1.482 6.148 1.00 3.82 H new ATOM 2682 N MET A 163 -5.303 0.959 10.441 1.00 0.73 N ATOM 2683 CA MET A 163 -6.153 0.999 11.631 1.00 0.82 C ATOM 2684 C MET A 163 -7.624 1.259 11.308 1.00 0.81 C ATOM 2685 O MET A 163 -8.474 0.591 11.887 1.00 0.90 O ATOM 2686 CB MET A 163 -5.585 1.950 12.697 1.00 0.85 C ATOM 2687 CG MET A 163 -5.921 3.423 12.495 1.00 1.06 C ATOM 2688 SD MET A 163 -5.084 4.496 13.679 1.00 1.55 S ATOM 2689 CE MET A 163 -5.962 6.012 13.262 1.00 0.90 C ATOM 0 H MET A 163 -4.660 1.745 10.345 1.00 0.73 H new ATOM 0 HA MET A 163 -6.137 -0.000 12.066 1.00 0.82 H new ATOM 0 HB2 MET A 163 -5.956 1.639 13.674 1.00 0.85 H new ATOM 0 HB3 MET A 163 -4.501 1.840 12.719 1.00 0.85 H new ATOM 0 HG2 MET A 163 -5.644 3.719 11.483 1.00 1.06 H new ATOM 0 HG3 MET A 163 -6.999 3.561 12.584 1.00 1.06 H new ATOM 0 HE1 MET A 163 -5.301 6.867 13.405 1.00 0.90 H new ATOM 0 HE2 MET A 163 -6.283 5.972 12.221 1.00 0.90 H new ATOM 0 HE3 MET A 163 -6.835 6.116 13.907 1.00 0.90 H new ATOM 2699 N ALA A 164 -7.946 2.171 10.387 1.00 0.75 N ATOM 2700 CA ALA A 164 -9.325 2.486 10.013 1.00 0.79 C ATOM 2701 C ALA A 164 -9.990 1.334 9.250 1.00 0.89 C ATOM 2702 O ALA A 164 -11.120 0.962 9.565 1.00 0.95 O ATOM 2703 CB ALA A 164 -9.346 3.800 9.211 1.00 0.73 C ATOM 0 H ALA A 164 -7.251 2.715 9.877 1.00 0.75 H new ATOM 0 HA ALA A 164 -9.914 2.620 10.920 1.00 0.79 H new ATOM 0 HB1 ALA A 164 -10.372 4.039 8.930 1.00 0.73 H new ATOM 0 HB2 ALA A 164 -8.940 4.606 9.823 1.00 0.73 H new ATOM 0 HB3 ALA A 164 -8.741 3.687 8.312 1.00 0.73 H new ATOM 2709 N LEU A 165 -9.274 0.732 8.294 1.00 0.92 N ATOM 2710 CA LEU A 165 -9.753 -0.393 7.482 1.00 1.08 C ATOM 2711 C LEU A 165 -9.927 -1.623 8.382 1.00 1.18 C ATOM 2712 O LEU A 165 -10.960 -2.289 8.314 1.00 1.30 O ATOM 2713 CB LEU A 165 -8.754 -0.580 6.311 1.00 1.08 C ATOM 2714 CG LEU A 165 -9.103 -1.445 5.083 1.00 1.15 C ATOM 2715 CD1 LEU A 165 -9.064 -2.951 5.368 1.00 1.30 C ATOM 2716 CD2 LEU A 165 -10.418 -1.023 4.416 1.00 2.10 C ATOM 0 H LEU A 165 -8.324 1.019 8.058 1.00 0.92 H new ATOM 0 HA LEU A 165 -10.734 -0.215 7.042 1.00 1.08 H new ATOM 0 HB2 LEU A 165 -8.513 0.416 5.939 1.00 1.08 H new ATOM 0 HB3 LEU A 165 -7.839 -0.991 6.738 1.00 1.08 H new ATOM 0 HG LEU A 165 -8.307 -1.253 4.364 1.00 1.15 H new ATOM 0 HD11 LEU A 165 -9.319 -3.500 4.461 1.00 1.30 H new ATOM 0 HD12 LEU A 165 -8.063 -3.234 5.693 1.00 1.30 H new ATOM 0 HD13 LEU A 165 -9.782 -3.192 6.152 1.00 1.30 H new ATOM 0 HD21 LEU A 165 -10.613 -1.666 3.558 1.00 2.10 H new ATOM 0 HD22 LEU A 165 -11.235 -1.115 5.132 1.00 2.10 H new ATOM 0 HD23 LEU A 165 -10.342 0.012 4.084 1.00 2.10 H new ATOM 2728 N MET A 166 -8.982 -1.869 9.300 1.00 1.16 N ATOM 2729 CA MET A 166 -9.128 -2.901 10.335 1.00 1.28 C ATOM 2730 C MET A 166 -10.289 -2.633 11.296 1.00 1.23 C ATOM 2731 O MET A 166 -11.040 -3.560 11.574 1.00 1.26 O ATOM 2732 CB MET A 166 -7.827 -3.106 11.123 1.00 1.32 C ATOM 2733 CG MET A 166 -6.788 -3.930 10.352 1.00 2.50 C ATOM 2734 SD MET A 166 -7.298 -5.600 9.855 1.00 3.37 S ATOM 2735 CE MET A 166 -8.038 -6.213 11.394 1.00 2.01 C ATOM 0 H MET A 166 -8.099 -1.361 9.346 1.00 1.16 H new ATOM 0 HA MET A 166 -9.361 -3.819 9.796 1.00 1.28 H new ATOM 0 HB2 MET A 166 -7.401 -2.134 11.371 1.00 1.32 H new ATOM 0 HB3 MET A 166 -8.053 -3.605 12.065 1.00 1.32 H new ATOM 0 HG2 MET A 166 -6.508 -3.376 9.456 1.00 2.50 H new ATOM 0 HG3 MET A 166 -5.892 -4.014 10.967 1.00 2.50 H new ATOM 0 HE1 MET A 166 -8.154 -7.295 11.336 1.00 2.01 H new ATOM 0 HE2 MET A 166 -7.391 -5.962 12.234 1.00 2.01 H new ATOM 0 HE3 MET A 166 -9.014 -5.750 11.538 1.00 2.01 H new ATOM 2745 N ARG A 167 -10.480 -1.403 11.789 1.00 1.13 N ATOM 2746 CA ARG A 167 -11.590 -1.054 12.697 1.00 1.08 C ATOM 2747 C ARG A 167 -12.973 -1.234 12.041 1.00 1.09 C ATOM 2748 O ARG A 167 -13.957 -1.468 12.746 1.00 1.09 O ATOM 2749 CB ARG A 167 -11.424 0.386 13.225 1.00 1.04 C ATOM 2750 CG ARG A 167 -10.444 0.516 14.408 1.00 1.36 C ATOM 2751 CD ARG A 167 -10.955 -0.109 15.715 1.00 1.76 C ATOM 2752 NE ARG A 167 -10.003 0.111 16.823 1.00 2.60 N ATOM 2753 CZ ARG A 167 -10.016 1.082 17.730 1.00 3.79 C ATOM 2754 NH1 ARG A 167 -10.961 1.999 17.761 1.00 4.55 N ATOM 2755 NH2 ARG A 167 -9.062 1.147 18.636 1.00 4.88 N ATOM 0 H ARG A 167 -9.869 -0.616 11.571 1.00 1.13 H new ATOM 0 HA ARG A 167 -11.545 -1.750 13.535 1.00 1.08 H new ATOM 0 HB2 ARG A 167 -11.079 1.022 12.410 1.00 1.04 H new ATOM 0 HB3 ARG A 167 -12.399 0.763 13.533 1.00 1.04 H new ATOM 0 HG2 ARG A 167 -9.499 0.045 14.137 1.00 1.36 H new ATOM 0 HG3 ARG A 167 -10.236 1.572 14.580 1.00 1.36 H new ATOM 0 HD2 ARG A 167 -11.922 0.322 15.973 1.00 1.76 H new ATOM 0 HD3 ARG A 167 -11.110 -1.178 15.573 1.00 1.76 H new ATOM 0 HE ARG A 167 -9.243 -0.565 16.901 1.00 2.60 H new ATOM 0 HH11 ARG A 167 -11.715 1.978 17.074 1.00 4.55 H new ATOM 0 HH12 ARG A 167 -10.939 2.730 18.472 1.00 4.55 H new ATOM 0 HH21 ARG A 167 -8.315 0.453 18.641 1.00 4.88 H new ATOM 0 HH22 ARG A 167 -9.070 1.892 19.333 1.00 4.88 H new ATOM 2769 N LEU A 168 -13.050 -1.151 10.709 1.00 1.14 N ATOM 2770 CA LEU A 168 -14.272 -1.371 9.922 1.00 1.22 C ATOM 2771 C LEU A 168 -14.487 -2.846 9.518 1.00 1.39 C ATOM 2772 O LEU A 168 -15.615 -3.228 9.210 1.00 1.61 O ATOM 2773 CB LEU A 168 -14.234 -0.404 8.715 1.00 1.23 C ATOM 2774 CG LEU A 168 -15.495 0.480 8.612 1.00 1.24 C ATOM 2775 CD1 LEU A 168 -15.156 1.782 7.880 1.00 2.31 C ATOM 2776 CD2 LEU A 168 -16.624 -0.270 7.897 1.00 1.81 C ATOM 0 H LEU A 168 -12.242 -0.922 10.130 1.00 1.14 H new ATOM 0 HA LEU A 168 -15.144 -1.152 10.538 1.00 1.22 H new ATOM 0 HB2 LEU A 168 -13.355 0.235 8.796 1.00 1.23 H new ATOM 0 HB3 LEU A 168 -14.126 -0.981 7.797 1.00 1.23 H new ATOM 0 HG LEU A 168 -15.840 0.723 9.617 1.00 1.24 H new ATOM 0 HD11 LEU A 168 -16.049 2.403 7.810 1.00 2.31 H new ATOM 0 HD12 LEU A 168 -14.383 2.319 8.431 1.00 2.31 H new ATOM 0 HD13 LEU A 168 -14.794 1.552 6.878 1.00 2.31 H new ATOM 0 HD21 LEU A 168 -17.504 0.370 7.835 1.00 1.81 H new ATOM 0 HD22 LEU A 168 -16.301 -0.542 6.892 1.00 1.81 H new ATOM 0 HD23 LEU A 168 -16.871 -1.173 8.455 1.00 1.81 H new ATOM 2788 N ASN A 169 -13.443 -3.689 9.543 1.00 1.34 N ATOM 2789 CA ASN A 169 -13.512 -5.113 9.175 1.00 1.50 C ATOM 2790 C ASN A 169 -13.523 -6.062 10.396 1.00 1.48 C ATOM 2791 O ASN A 169 -14.326 -6.994 10.460 1.00 1.57 O ATOM 2792 CB ASN A 169 -12.320 -5.425 8.255 1.00 1.69 C ATOM 2793 CG ASN A 169 -12.501 -6.754 7.529 1.00 1.69 C ATOM 2794 OD1 ASN A 169 -13.340 -6.880 6.644 1.00 2.41 O ATOM 2795 ND2 ASN A 169 -11.748 -7.785 7.865 1.00 1.69 N ATOM 0 H ASN A 169 -12.508 -3.394 9.825 1.00 1.34 H new ATOM 0 HA ASN A 169 -14.458 -5.288 8.663 1.00 1.50 H new ATOM 0 HB2 ASN A 169 -12.204 -4.624 7.525 1.00 1.69 H new ATOM 0 HB3 ASN A 169 -11.403 -5.454 8.844 1.00 1.69 H new ATOM 0 HD21 ASN A 169 -11.866 -8.679 7.389 1.00 1.69 H new ATOM 0 HD22 ASN A 169 -11.048 -7.687 8.600 1.00 1.69 H new ATOM 2802 N ASP A 170 -12.619 -5.821 11.347 1.00 1.44 N ATOM 2803 CA ASP A 170 -12.390 -6.456 12.659 1.00 1.47 C ATOM 2804 C ASP A 170 -12.014 -7.953 12.659 1.00 1.90 C ATOM 2805 O ASP A 170 -11.432 -8.435 13.633 1.00 2.12 O ATOM 2806 CB ASP A 170 -13.527 -6.117 13.641 1.00 1.85 C ATOM 2807 CG ASP A 170 -12.975 -5.670 15.008 1.00 1.96 C ATOM 2808 OD1 ASP A 170 -12.402 -4.556 15.088 1.00 2.67 O ATOM 2809 OD2 ASP A 170 -13.131 -6.417 16.003 1.00 2.71 O ATOM 0 H ASP A 170 -11.936 -5.077 11.201 1.00 1.44 H new ATOM 0 HA ASP A 170 -11.466 -6.002 13.017 1.00 1.47 H new ATOM 0 HB2 ASP A 170 -14.148 -5.326 13.221 1.00 1.85 H new ATOM 0 HB3 ASP A 170 -14.168 -6.989 13.773 1.00 1.85 H new ATOM 2814 N GLU A 171 -12.253 -8.668 11.552 1.00 2.46 N ATOM 2815 CA GLU A 171 -11.455 -9.837 11.146 1.00 3.41 C ATOM 2816 C GLU A 171 -10.020 -9.409 10.800 1.00 4.01 C ATOM 2817 O GLU A 171 -9.842 -8.612 9.851 1.00 4.92 O ATOM 2818 CB GLU A 171 -12.108 -10.569 9.950 1.00 4.02 C ATOM 2819 CG GLU A 171 -12.934 -11.793 10.366 1.00 4.19 C ATOM 2820 CD GLU A 171 -13.577 -12.491 9.144 1.00 4.99 C ATOM 2821 OE1 GLU A 171 -12.854 -13.171 8.371 1.00 5.99 O ATOM 2822 OE2 GLU A 171 -14.815 -12.388 8.954 1.00 5.14 O ATOM 2823 OXT GLU A 171 -9.095 -9.904 11.483 1.00 4.32 O ATOM 0 H GLU A 171 -13.012 -8.451 10.906 1.00 2.46 H new ATOM 0 HA GLU A 171 -11.420 -10.532 11.985 1.00 3.41 H new ATOM 0 HB2 GLU A 171 -12.750 -9.871 9.413 1.00 4.02 H new ATOM 0 HB3 GLU A 171 -11.329 -10.884 9.256 1.00 4.02 H new ATOM 0 HG2 GLU A 171 -12.295 -12.500 10.895 1.00 4.19 H new ATOM 0 HG3 GLU A 171 -13.714 -11.486 11.062 1.00 4.19 H new TER 2830 GLU A 171 HETATM 2831 C8 HTF A 172 -4.406 -8.001 -6.942 1.00 1.18 C HETATM 2832 C7 HTF A 172 -3.587 -9.251 -6.601 1.00 1.45 C HETATM 2833 C6 HTF A 172 -2.811 -9.133 -5.279 1.00 1.78 C HETATM 2834 C5 HTF A 172 -1.718 -8.061 -5.305 1.00 1.39 C HETATM 2835 C4 HTF A 172 -0.948 -8.009 -3.972 1.00 1.84 C HETATM 2836 C3 HTF A 172 0.291 -7.106 -4.061 1.00 1.73 C HETATM 2837 C2 HTF A 172 -0.056 -5.609 -4.217 1.00 1.94 C HETATM 2838 C1 HTF A 172 1.078 -4.783 -4.806 1.00 2.03 C HETATM 2839 O1 HTF A 172 1.509 -3.792 -4.221 1.00 3.30 O HETATM 2840 N HTF A 172 1.524 -5.178 -5.996 1.00 1.44 N HETATM 2841 CA HTF A 172 2.540 -4.500 -6.800 1.00 1.46 C HETATM 2842 C HTF A 172 2.604 -5.000 -8.239 1.00 1.86 C HETATM 2843 O HTF A 172 1.601 -5.103 -8.949 1.00 3.13 O HETATM 2844 OD HTF A 172 3.842 -5.328 -8.572 1.00 2.02 O HETATM 2845 CG HTF A 172 4.763 -5.002 -7.542 1.00 2.23 C HETATM 2846 CB HTF A 172 3.944 -4.782 -6.265 1.00 2.24 C HETATM 0 HN HTF A 172 1.120 -6.031 -6.382 1.00 1.44 H new HETATM 0 HG3 HTF A 172 5.487 -5.805 -7.403 1.00 2.23 H new HETATM 0 HG2 HTF A 172 5.327 -4.105 -7.798 1.00 2.23 H new HETATM 0 HB3 HTF A 172 4.328 -3.947 -5.679 1.00 2.24 H new HETATM 0 HB2 HTF A 172 3.961 -5.660 -5.619 1.00 2.24 H new HETATM 0 HA HTF A 172 2.254 -3.449 -6.753 1.00 1.46 H new HETATM 0 H83 HTF A 172 -5.134 -7.816 -6.152 1.00 1.18 H new HETATM 0 H82 HTF A 172 -3.740 -7.143 -7.030 1.00 1.18 H new HETATM 0 H81 HTF A 172 -4.927 -8.154 -7.887 1.00 1.18 H new HETATM 0 H73 HTF A 172 -4.256 -10.110 -6.545 1.00 1.45 H new HETATM 0 H72 HTF A 172 -2.883 -9.447 -7.410 1.00 1.45 H new HETATM 0 H63 HTF A 172 -3.511 -8.907 -4.475 1.00 1.78 H new HETATM 0 H62 HTF A 172 -2.358 -10.097 -5.046 1.00 1.78 H new HETATM 0 H53 HTF A 172 -1.024 -8.267 -6.120 1.00 1.39 H new HETATM 0 H52 HTF A 172 -2.166 -7.088 -5.506 1.00 1.39 H new HETATM 0 H43 HTF A 172 -1.608 -7.643 -3.186 1.00 1.84 H new HETATM 0 H42 HTF A 172 -0.643 -9.017 -3.689 1.00 1.84 H new HETATM 0 H33 HTF A 172 0.896 -7.240 -3.164 1.00 1.73 H new HETATM 0 H32 HTF A 172 0.902 -7.421 -4.907 1.00 1.73 H new HETATM 0 H23 HTF A 172 -0.935 -5.512 -4.854 1.00 1.94 H new HETATM 0 H22 HTF A 172 -0.323 -5.202 -3.242 1.00 1.94 H new