USER MOD reduce.3.24.130724 H: found=0, std=0, add=1147, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1146 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 100 MET CE :methyl 159:sc= -2.7 (180deg=0) USER MOD Set 1.2: A 102 ASN : amide:sc= -1.41 K(o=-11,f=-14) USER MOD Set 1.3: A 108 ASN : amide:sc= -6.6! C(o=-11!,f=-17!) USER MOD Set 2.1: A 92 HIS : no HE2:sc= -1.49 K(o=0.33,f=-8.6!) USER MOD Set 2.2: A 99 SER OG : rot 142:sc= 0.827 USER MOD Set 2.3: A 115 CYS SG : rot -129:sc= 0.0366 USER MOD Set 2.4: A 119 THR OG1 : rot 45:sc= 0.957 USER MOD Set 3.1: A 61 MET CE :methyl 153:sc= -0.156 (180deg=0) USER MOD Set 3.2: A 63 GLN : amide:sc= -1.46 X(o=-1.6,f=-1.1) USER MOD Set 4.1: A 52 CYS SG : rot -40:sc= 0.153 USER MOD Set 4.2: A 155 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0204) USER MOD Single : A 3 ASN : amide:sc= 0.333 K(o=0.33,f=-8.6!) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 SER OG : rot 180:sc= -0.263 USER MOD Single : A 28 LYS NZ :NH3+ -158:sc= 1.2 (180deg=0.828) USER MOD Single : A 31 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0515) USER MOD Single : A 32 THR OG1 : rot -77:sc= 1.09 USER MOD Single : A 35 ASN : amide:sc= 0.986 K(o=0.99,f=-1.8) USER MOD Single : A 40 SER OG : rot 100:sc= -1.44 USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 44 LYS NZ :NH3+ -162:sc= 0 (180deg=-0.328) USER MOD Single : A 48 TYR OH : rot 13:sc= 1.6 USER MOD Single : A 49 LYS NZ :NH3+ -175:sc= 1.91 (180deg=1.7) USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 54 HIS :FLIP no HD1:sc= -0.254 F(o=-1.4,f=-0.25) USER MOD Single : A 62 CYS SG : rot -8:sc= -0.556 USER MOD Single : A 77 SER OG : rot -68:sc= 1.38 USER MOD Single : A 79 TYR OH : rot 92:sc= 0.921 USER MOD Single : A 82 LYS NZ :NH3+ -146:sc= 1.2 (180deg=-0.775) USER MOD Single : A 87 ASN : amide:sc= 0.151 K(o=0.15,f=-6.2!) USER MOD Single : A 91 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.031) USER MOD Single : A 93 THR OG1 : rot 180:sc= 0.063 USER MOD Single : A 106 ASN : amide:sc= -1.24 K(o=-1.2,f=-4.8!) USER MOD Single : A 107 THR OG1 : rot -96:sc=-0.000347 USER MOD Single : A 110 SER OG : rot 48:sc= 0.395 USER MOD Single : A 111 GLN : amide:sc= -0.253 K(o=-0.25,f=-5.8!) USER MOD Single : A 116 THR OG1 : rot 130:sc= 0.0724 USER MOD Single : A 118 LYS NZ :NH3+ -164:sc= 1.2 (180deg=1.02) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 HIS : no HE2:sc= -1.44 K(o=-1.4,f=-4.4!) USER MOD Single : A 131 LYS NZ :NH3+ -140:sc= 2.41 (180deg=0.332) USER MOD Single : A 133 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 MET CE :methyl -156:sc= -0.296 (180deg=-1.33!) USER MOD Single : A 137 ASN : amide:sc= 0 X(o=0,f=-0.0089) USER MOD Single : A 142 MET CE :methyl 165:sc= -0.0595 (180deg=-0.598) USER MOD Single : A 147 SER OG : rot 18:sc= 0.37 USER MOD Single : A 149 ASN : amide:sc= 1.65 K(o=1.7,f=-5.3!) USER MOD Single : A 151 LYS NZ :NH3+ -172:sc= 1.92 (180deg=1.71) USER MOD Single : A 152 THR OG1 : rot 180:sc= -0.235 USER MOD Single : A 153 SER OG : rot 180:sc= 0 USER MOD Single : A 154 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 157 THR OG1 : rot 180:sc= 0.0118 USER MOD Single : A 161 CYS SG : rot 127:sc= 0.0654 USER MOD Single : A 163 GLN : amide:sc= 0 X(o=0,f=-0.36) USER MOD ----------------------------------------------------------------- ATOM 34 N ASN A 3 0.762 -17.008 -6.529 1.00 2.03 N ATOM 35 CA ASN A 3 0.227 -15.860 -5.818 1.00 1.48 C ATOM 36 C ASN A 3 0.262 -16.138 -4.314 1.00 1.20 C ATOM 37 O ASN A 3 -0.682 -16.703 -3.761 1.00 1.15 O ATOM 38 CB ASN A 3 -1.226 -15.593 -6.216 1.00 1.22 C ATOM 39 CG ASN A 3 -1.369 -15.495 -7.737 1.00 1.58 C ATOM 40 OD1 ASN A 3 -0.707 -14.713 -8.398 1.00 2.76 O ATOM 41 ND2 ASN A 3 -2.266 -16.330 -8.250 1.00 1.47 N ATOM 0 HA ASN A 3 0.835 -14.992 -6.072 1.00 1.48 H new ATOM 0 HB2 ASN A 3 -1.863 -16.393 -5.838 1.00 1.22 H new ATOM 0 HB3 ASN A 3 -1.569 -14.667 -5.754 1.00 1.22 H new ATOM 0 HD21 ASN A 3 -2.435 -16.342 -9.256 1.00 1.47 H new ATOM 0 HD22 ASN A 3 -2.786 -16.959 -7.638 1.00 1.47 H new ATOM 48 N PRO A 4 1.387 -15.717 -3.676 1.00 1.24 N ATOM 49 CA PRO A 4 1.571 -15.944 -2.253 1.00 1.14 C ATOM 50 C PRO A 4 0.705 -14.989 -1.428 1.00 0.95 C ATOM 51 O PRO A 4 0.209 -13.991 -1.947 1.00 1.02 O ATOM 52 CB PRO A 4 3.059 -15.753 -2.014 1.00 1.49 C ATOM 53 CG PRO A 4 3.578 -14.974 -3.212 1.00 1.73 C ATOM 54 CD PRO A 4 2.509 -15.015 -4.292 1.00 1.58 C ATOM 0 HA PRO A 4 1.255 -16.940 -1.942 1.00 1.14 H new ATOM 0 HB2 PRO A 4 3.239 -15.209 -1.087 1.00 1.49 H new ATOM 0 HB3 PRO A 4 3.566 -16.713 -1.923 1.00 1.49 H new ATOM 0 HG2 PRO A 4 3.798 -13.944 -2.932 1.00 1.73 H new ATOM 0 HG3 PRO A 4 4.507 -15.410 -3.578 1.00 1.73 H new ATOM 0 HD2 PRO A 4 2.224 -14.011 -4.605 1.00 1.58 H new ATOM 0 HD3 PRO A 4 2.863 -15.538 -5.180 1.00 1.58 H new ATOM 62 N THR A 5 0.551 -15.331 -0.158 1.00 0.97 N ATOM 63 CA THR A 5 -0.256 -14.523 0.741 1.00 0.91 C ATOM 64 C THR A 5 0.578 -14.057 1.935 1.00 0.98 C ATOM 65 O THR A 5 1.374 -14.823 2.477 1.00 1.14 O ATOM 66 CB THR A 5 -1.484 -15.345 1.141 1.00 0.89 C ATOM 67 OG1 THR A 5 -2.038 -15.769 -0.102 1.00 1.26 O ATOM 68 CG2 THR A 5 -2.585 -14.485 1.766 1.00 0.86 C ATOM 0 H THR A 5 0.971 -16.156 0.270 1.00 0.97 H new ATOM 0 HA THR A 5 -0.601 -13.612 0.252 1.00 0.91 H new ATOM 0 HB THR A 5 -1.187 -16.123 1.845 1.00 0.89 H new ATOM 0 HG1 THR A 5 -2.838 -16.310 0.064 1.00 1.26 H new ATOM 0 HG21 THR A 5 -3.433 -15.116 2.032 1.00 0.86 H new ATOM 0 HG22 THR A 5 -2.201 -13.997 2.662 1.00 0.86 H new ATOM 0 HG23 THR A 5 -2.906 -13.728 1.050 1.00 0.86 H new ATOM 76 N VAL A 6 0.368 -12.804 2.311 1.00 0.95 N ATOM 77 CA VAL A 6 1.121 -12.215 3.405 1.00 1.02 C ATOM 78 C VAL A 6 0.151 -11.579 4.401 1.00 0.94 C ATOM 79 O VAL A 6 -1.020 -11.372 4.088 1.00 0.94 O ATOM 80 CB VAL A 6 2.150 -11.223 2.856 1.00 1.14 C ATOM 81 CG1 VAL A 6 2.979 -11.856 1.737 1.00 1.37 C ATOM 82 CG2 VAL A 6 1.472 -9.938 2.378 1.00 1.45 C ATOM 0 H VAL A 6 -0.313 -12.180 1.877 1.00 0.95 H new ATOM 0 HA VAL A 6 1.681 -12.982 3.941 1.00 1.02 H new ATOM 0 HB VAL A 6 2.829 -10.961 3.667 1.00 1.14 H new ATOM 0 HG11 VAL A 6 3.702 -11.130 1.365 1.00 1.37 H new ATOM 0 HG12 VAL A 6 3.506 -12.728 2.124 1.00 1.37 H new ATOM 0 HG13 VAL A 6 2.320 -12.161 0.924 1.00 1.37 H new ATOM 0 HG21 VAL A 6 2.225 -9.251 1.993 1.00 1.45 H new ATOM 0 HG22 VAL A 6 0.759 -10.175 1.588 1.00 1.45 H new ATOM 0 HG23 VAL A 6 0.948 -9.471 3.212 1.00 1.45 H new ATOM 92 N PHE A 7 0.674 -11.286 5.583 1.00 0.99 N ATOM 93 CA PHE A 7 -0.109 -10.605 6.601 1.00 0.94 C ATOM 94 C PHE A 7 0.509 -9.250 6.953 1.00 0.62 C ATOM 95 O PHE A 7 1.706 -9.042 6.762 1.00 0.65 O ATOM 96 CB PHE A 7 -0.097 -11.496 7.845 1.00 1.31 C ATOM 97 CG PHE A 7 1.270 -11.594 8.527 1.00 1.22 C ATOM 98 CD1 PHE A 7 1.691 -10.597 9.351 1.00 2.53 C ATOM 99 CD2 PHE A 7 2.063 -12.677 8.310 1.00 1.94 C ATOM 100 CE1 PHE A 7 2.959 -10.688 9.984 1.00 2.83 C ATOM 101 CE2 PHE A 7 3.331 -12.768 8.942 1.00 2.33 C ATOM 102 CZ PHE A 7 3.752 -11.771 9.767 1.00 2.16 C ATOM 0 H PHE A 7 1.631 -11.508 5.859 1.00 0.99 H new ATOM 0 HA PHE A 7 -1.121 -10.429 6.236 1.00 0.94 H new ATOM 0 HB2 PHE A 7 -0.823 -11.112 8.562 1.00 1.31 H new ATOM 0 HB3 PHE A 7 -0.425 -12.497 7.565 1.00 1.31 H new ATOM 0 HD1 PHE A 7 1.061 -9.737 9.524 1.00 2.53 H new ATOM 0 HD2 PHE A 7 1.728 -13.469 7.656 1.00 1.94 H new ATOM 0 HE1 PHE A 7 3.294 -9.896 10.638 1.00 2.83 H new ATOM 0 HE2 PHE A 7 3.961 -13.628 8.768 1.00 2.33 H new ATOM 0 HZ PHE A 7 4.716 -11.840 10.249 1.00 2.16 H new ATOM 112 N PHE A 8 -0.336 -8.364 7.460 1.00 0.64 N ATOM 113 CA PHE A 8 0.072 -6.989 7.692 1.00 0.75 C ATOM 114 C PHE A 8 -0.614 -6.417 8.935 1.00 0.72 C ATOM 115 O PHE A 8 -1.802 -6.103 8.904 1.00 0.93 O ATOM 116 CB PHE A 8 -0.363 -6.182 6.467 1.00 1.29 C ATOM 117 CG PHE A 8 0.251 -4.782 6.395 1.00 1.54 C ATOM 118 CD1 PHE A 8 1.596 -4.623 6.517 1.00 2.18 C ATOM 119 CD2 PHE A 8 -0.548 -3.697 6.208 1.00 3.10 C ATOM 120 CE1 PHE A 8 2.166 -3.324 6.450 1.00 3.42 C ATOM 121 CE2 PHE A 8 0.022 -2.399 6.142 1.00 4.20 C ATOM 122 CZ PHE A 8 1.368 -2.239 6.263 1.00 4.13 C ATOM 0 H PHE A 8 -1.301 -8.572 7.716 1.00 0.64 H new ATOM 0 HA PHE A 8 1.149 -6.941 7.850 1.00 0.75 H new ATOM 0 HB2 PHE A 8 -0.092 -6.733 5.566 1.00 1.29 H new ATOM 0 HB3 PHE A 8 -1.449 -6.092 6.471 1.00 1.29 H new ATOM 0 HD1 PHE A 8 2.231 -5.484 6.665 1.00 2.18 H new ATOM 0 HD2 PHE A 8 -1.616 -3.823 6.110 1.00 3.10 H new ATOM 0 HE1 PHE A 8 3.234 -3.198 6.548 1.00 3.42 H new ATOM 0 HE2 PHE A 8 -0.613 -1.538 5.996 1.00 4.20 H new ATOM 0 HZ PHE A 8 1.802 -1.251 6.211 1.00 4.13 H new ATOM 132 N ASP A 9 0.167 -6.299 9.999 1.00 0.66 N ATOM 133 CA ASP A 9 -0.388 -5.968 11.300 1.00 0.66 C ATOM 134 C ASP A 9 -0.260 -4.461 11.536 1.00 0.68 C ATOM 135 O ASP A 9 0.818 -3.894 11.375 1.00 0.75 O ATOM 136 CB ASP A 9 0.365 -6.687 12.420 1.00 0.77 C ATOM 137 CG ASP A 9 -0.445 -6.926 13.696 1.00 1.07 C ATOM 138 OD1 ASP A 9 -1.207 -6.007 14.065 1.00 2.11 O ATOM 139 OD2 ASP A 9 -0.285 -8.023 14.273 1.00 1.91 O ATOM 0 H ASP A 9 1.179 -6.427 9.986 1.00 0.66 H new ATOM 0 HA ASP A 9 -1.432 -6.280 11.310 1.00 0.66 H new ATOM 0 HB2 ASP A 9 0.713 -7.649 12.044 1.00 0.77 H new ATOM 0 HB3 ASP A 9 1.251 -6.104 12.674 1.00 0.77 H new ATOM 144 N ILE A 10 -1.377 -3.857 11.915 1.00 0.69 N ATOM 145 CA ILE A 10 -1.396 -2.433 12.204 1.00 0.74 C ATOM 146 C ILE A 10 -1.539 -2.226 13.713 1.00 0.75 C ATOM 147 O ILE A 10 -2.306 -2.926 14.370 1.00 0.79 O ATOM 148 CB ILE A 10 -2.481 -1.735 11.381 1.00 0.83 C ATOM 149 CG1 ILE A 10 -1.952 -1.338 10.001 1.00 1.44 C ATOM 150 CG2 ILE A 10 -3.059 -0.537 12.140 1.00 0.90 C ATOM 151 CD1 ILE A 10 -1.646 -2.575 9.156 1.00 1.07 C ATOM 0 H ILE A 10 -2.275 -4.328 12.029 1.00 0.69 H new ATOM 0 HA ILE A 10 -0.455 -1.970 11.906 1.00 0.74 H new ATOM 0 HB ILE A 10 -3.297 -2.440 11.222 1.00 0.83 H new ATOM 0 HG12 ILE A 10 -2.688 -0.717 9.490 1.00 1.44 H new ATOM 0 HG13 ILE A 10 -1.050 -0.737 10.112 1.00 1.44 H new ATOM 0 HG21 ILE A 10 -3.828 -0.059 11.533 1.00 0.90 H new ATOM 0 HG22 ILE A 10 -3.497 -0.878 13.078 1.00 0.90 H new ATOM 0 HG23 ILE A 10 -2.264 0.179 12.349 1.00 0.90 H new ATOM 0 HD11 ILE A 10 -1.272 -2.266 8.180 1.00 1.07 H new ATOM 0 HD12 ILE A 10 -0.892 -3.181 9.658 1.00 1.07 H new ATOM 0 HD13 ILE A 10 -2.556 -3.161 9.026 1.00 1.07 H new ATOM 163 N ALA A 11 -0.788 -1.259 14.218 1.00 0.78 N ATOM 164 CA ALA A 11 -0.855 -0.918 15.629 1.00 0.82 C ATOM 165 C ALA A 11 -1.269 0.549 15.777 1.00 0.78 C ATOM 166 O ALA A 11 -0.636 1.436 15.206 1.00 0.86 O ATOM 167 CB ALA A 11 0.493 -1.212 16.290 1.00 0.95 C ATOM 0 H ALA A 11 -0.129 -0.700 13.675 1.00 0.78 H new ATOM 0 HA ALA A 11 -1.606 -1.525 16.135 1.00 0.82 H new ATOM 0 HB1 ALA A 11 0.443 -0.956 17.348 1.00 0.95 H new ATOM 0 HB2 ALA A 11 0.727 -2.271 16.183 1.00 0.95 H new ATOM 0 HB3 ALA A 11 1.271 -0.618 15.810 1.00 0.95 H new ATOM 173 N VAL A 12 -2.327 0.756 16.546 1.00 0.77 N ATOM 174 CA VAL A 12 -2.798 2.102 16.822 1.00 0.81 C ATOM 175 C VAL A 12 -2.486 2.459 18.277 1.00 0.89 C ATOM 176 O VAL A 12 -3.218 2.069 19.186 1.00 0.94 O ATOM 177 CB VAL A 12 -4.286 2.216 16.484 1.00 0.81 C ATOM 178 CG1 VAL A 12 -4.781 3.652 16.665 1.00 0.91 C ATOM 179 CG2 VAL A 12 -4.566 1.714 15.068 1.00 0.75 C ATOM 0 H VAL A 12 -2.871 0.014 16.987 1.00 0.77 H new ATOM 0 HA VAL A 12 -2.279 2.824 16.192 1.00 0.81 H new ATOM 0 HB VAL A 12 -4.837 1.582 17.179 1.00 0.81 H new ATOM 0 HG11 VAL A 12 -5.841 3.705 16.418 1.00 0.91 H new ATOM 0 HG12 VAL A 12 -4.633 3.960 17.700 1.00 0.91 H new ATOM 0 HG13 VAL A 12 -4.221 4.316 16.006 1.00 0.91 H new ATOM 0 HG21 VAL A 12 -5.631 1.806 14.853 1.00 0.75 H new ATOM 0 HG22 VAL A 12 -3.999 2.309 14.352 1.00 0.75 H new ATOM 0 HG23 VAL A 12 -4.269 0.668 14.987 1.00 0.75 H new ATOM 189 N ASP A 13 -1.399 3.195 18.453 1.00 0.95 N ATOM 190 CA ASP A 13 -0.991 3.624 19.780 1.00 1.06 C ATOM 191 C ASP A 13 -0.954 2.412 20.714 1.00 1.09 C ATOM 192 O ASP A 13 -1.909 2.161 21.448 1.00 1.13 O ATOM 193 CB ASP A 13 -1.981 4.637 20.359 1.00 1.13 C ATOM 194 CG ASP A 13 -1.957 6.015 19.696 1.00 1.45 C ATOM 195 OD1 ASP A 13 -1.054 6.227 18.858 1.00 2.21 O ATOM 196 OD2 ASP A 13 -2.844 6.827 20.042 1.00 2.58 O ATOM 0 H ASP A 13 -0.788 3.506 17.698 1.00 0.95 H new ATOM 0 HA ASP A 13 -0.007 4.087 19.698 1.00 1.06 H new ATOM 0 HB2 ASP A 13 -2.988 4.227 20.275 1.00 1.13 H new ATOM 0 HB3 ASP A 13 -1.774 4.758 21.422 1.00 1.13 H new ATOM 201 N GLY A 14 0.157 1.695 20.656 1.00 1.13 N ATOM 202 CA GLY A 14 0.378 0.582 21.564 1.00 1.21 C ATOM 203 C GLY A 14 -0.870 -0.297 21.669 1.00 1.17 C ATOM 204 O GLY A 14 -1.257 -0.702 22.764 1.00 1.28 O ATOM 0 H GLY A 14 0.915 1.862 19.994 1.00 1.13 H new ATOM 0 HA2 GLY A 14 1.220 -0.016 21.214 1.00 1.21 H new ATOM 0 HA3 GLY A 14 0.644 0.961 22.551 1.00 1.21 H new ATOM 208 N GLU A 15 -1.464 -0.565 20.516 1.00 1.05 N ATOM 209 CA GLU A 15 -2.632 -1.429 20.458 1.00 1.05 C ATOM 210 C GLU A 15 -2.750 -2.069 19.074 1.00 0.94 C ATOM 211 O GLU A 15 -2.873 -1.369 18.070 1.00 0.96 O ATOM 212 CB GLU A 15 -3.903 -0.657 20.816 1.00 1.09 C ATOM 213 CG GLU A 15 -5.032 -1.612 21.207 1.00 1.22 C ATOM 214 CD GLU A 15 -4.896 -2.052 22.666 1.00 2.18 C ATOM 215 OE1 GLU A 15 -5.425 -1.322 23.532 1.00 2.79 O ATOM 216 OE2 GLU A 15 -4.266 -3.111 22.883 1.00 3.52 O ATOM 0 H GLU A 15 -1.159 -0.199 19.614 1.00 1.05 H new ATOM 0 HA GLU A 15 -2.510 -2.223 21.194 1.00 1.05 H new ATOM 0 HB2 GLU A 15 -3.698 0.026 21.640 1.00 1.09 H new ATOM 0 HB3 GLU A 15 -4.214 -0.048 19.967 1.00 1.09 H new ATOM 0 HG2 GLU A 15 -5.995 -1.123 21.059 1.00 1.22 H new ATOM 0 HG3 GLU A 15 -5.015 -2.486 20.556 1.00 1.22 H new ATOM 223 N PRO A 16 -2.705 -3.428 19.063 1.00 0.87 N ATOM 224 CA PRO A 16 -2.835 -4.172 17.823 1.00 0.80 C ATOM 225 C PRO A 16 -4.287 -4.181 17.338 1.00 0.77 C ATOM 226 O PRO A 16 -5.158 -4.759 17.985 1.00 0.79 O ATOM 227 CB PRO A 16 -2.307 -5.563 18.140 1.00 0.79 C ATOM 228 CG PRO A 16 -2.335 -5.682 19.655 1.00 0.85 C ATOM 229 CD PRO A 16 -2.533 -4.290 20.230 1.00 0.90 C ATOM 0 HA PRO A 16 -2.273 -3.724 17.004 1.00 0.80 H new ATOM 0 HB2 PRO A 16 -2.926 -6.331 17.676 1.00 0.79 H new ATOM 0 HB3 PRO A 16 -1.295 -5.694 17.756 1.00 0.79 H new ATOM 0 HG2 PRO A 16 -3.142 -6.343 19.971 1.00 0.85 H new ATOM 0 HG3 PRO A 16 -1.405 -6.117 20.021 1.00 0.85 H new ATOM 0 HD2 PRO A 16 -3.405 -4.252 20.883 1.00 0.90 H new ATOM 0 HD3 PRO A 16 -1.674 -3.982 20.827 1.00 0.90 H new ATOM 237 N LEU A 17 -4.502 -3.533 16.202 1.00 0.79 N ATOM 238 CA LEU A 17 -5.838 -3.426 15.643 1.00 0.84 C ATOM 239 C LEU A 17 -6.229 -4.760 15.006 1.00 0.79 C ATOM 240 O LEU A 17 -7.351 -5.233 15.185 1.00 0.86 O ATOM 241 CB LEU A 17 -5.923 -2.237 14.682 1.00 0.95 C ATOM 242 CG LEU A 17 -7.322 -1.887 14.171 1.00 0.85 C ATOM 243 CD1 LEU A 17 -8.186 -1.304 15.292 1.00 0.99 C ATOM 244 CD2 LEU A 17 -7.245 -0.954 12.962 1.00 2.27 C ATOM 0 H LEU A 17 -3.773 -3.077 15.654 1.00 0.79 H new ATOM 0 HA LEU A 17 -6.565 -3.224 16.430 1.00 0.84 H new ATOM 0 HB2 LEU A 17 -5.511 -1.361 15.182 1.00 0.95 H new ATOM 0 HB3 LEU A 17 -5.285 -2.443 13.823 1.00 0.95 H new ATOM 0 HG LEU A 17 -7.805 -2.806 13.839 1.00 0.85 H new ATOM 0 HD11 LEU A 17 -9.175 -1.064 14.902 1.00 0.99 H new ATOM 0 HD12 LEU A 17 -8.280 -2.034 16.096 1.00 0.99 H new ATOM 0 HD13 LEU A 17 -7.719 -0.398 15.678 1.00 0.99 H new ATOM 0 HD21 LEU A 17 -8.253 -0.720 12.618 1.00 2.27 H new ATOM 0 HD22 LEU A 17 -6.736 -0.033 13.245 1.00 2.27 H new ATOM 0 HD23 LEU A 17 -6.692 -1.443 12.160 1.00 2.27 H new ATOM 256 N GLY A 18 -5.282 -5.330 14.276 1.00 0.74 N ATOM 257 CA GLY A 18 -5.523 -6.589 13.590 1.00 0.79 C ATOM 258 C GLY A 18 -4.661 -6.700 12.330 1.00 0.78 C ATOM 259 O GLY A 18 -3.845 -5.822 12.053 1.00 0.83 O ATOM 0 H GLY A 18 -4.347 -4.944 14.144 1.00 0.74 H new ATOM 0 HA2 GLY A 18 -5.303 -7.420 14.260 1.00 0.79 H new ATOM 0 HA3 GLY A 18 -6.577 -6.666 13.322 1.00 0.79 H new ATOM 263 N ARG A 19 -4.873 -7.785 11.600 1.00 0.86 N ATOM 264 CA ARG A 19 -4.093 -8.046 10.403 1.00 0.94 C ATOM 265 C ARG A 19 -4.975 -7.937 9.159 1.00 0.81 C ATOM 266 O ARG A 19 -6.067 -8.502 9.116 1.00 0.78 O ATOM 267 CB ARG A 19 -3.461 -9.438 10.450 1.00 1.16 C ATOM 268 CG ARG A 19 -2.080 -9.393 11.110 1.00 1.45 C ATOM 269 CD ARG A 19 -1.840 -10.638 11.965 1.00 1.87 C ATOM 270 NE ARG A 19 -0.940 -10.310 13.093 1.00 2.93 N ATOM 271 CZ ARG A 19 -0.844 -11.038 14.215 1.00 3.73 C ATOM 272 NH1 ARG A 19 -1.301 -12.297 14.238 1.00 4.15 N ATOM 273 NH2 ARG A 19 -0.293 -10.505 15.314 1.00 4.91 N ATOM 0 H ARG A 19 -5.574 -8.494 11.815 1.00 0.86 H new ATOM 0 HA ARG A 19 -3.300 -7.300 10.356 1.00 0.94 H new ATOM 0 HB2 ARG A 19 -4.110 -10.117 11.003 1.00 1.16 H new ATOM 0 HB3 ARG A 19 -3.372 -9.835 9.439 1.00 1.16 H new ATOM 0 HG2 ARG A 19 -1.309 -9.320 10.343 1.00 1.45 H new ATOM 0 HG3 ARG A 19 -1.998 -8.500 11.730 1.00 1.45 H new ATOM 0 HD2 ARG A 19 -2.789 -11.018 12.344 1.00 1.87 H new ATOM 0 HD3 ARG A 19 -1.401 -11.428 11.356 1.00 1.87 H new ATOM 0 HE ARG A 19 -0.356 -9.478 13.012 1.00 2.93 H new ATOM 0 HH11 ARG A 19 -1.722 -12.702 13.402 1.00 4.15 H new ATOM 0 HH12 ARG A 19 -1.228 -12.851 15.092 1.00 4.15 H new ATOM 0 HH21 ARG A 19 0.053 -9.546 15.297 1.00 4.91 H new ATOM 0 HH22 ARG A 19 -0.220 -11.059 16.168 1.00 4.91 H new ATOM 287 N VAL A 20 -4.471 -7.206 8.176 1.00 0.95 N ATOM 288 CA VAL A 20 -5.230 -6.954 6.963 1.00 1.01 C ATOM 289 C VAL A 20 -5.031 -8.121 5.992 1.00 1.18 C ATOM 290 O VAL A 20 -5.991 -8.796 5.622 1.00 2.94 O ATOM 291 CB VAL A 20 -4.830 -5.604 6.365 1.00 0.98 C ATOM 292 CG1 VAL A 20 -5.429 -5.425 4.967 1.00 1.04 C ATOM 293 CG2 VAL A 20 -5.237 -4.454 7.287 1.00 1.24 C ATOM 0 H VAL A 20 -3.545 -6.779 8.195 1.00 0.95 H new ATOM 0 HA VAL A 20 -6.295 -6.892 7.185 1.00 1.01 H new ATOM 0 HB VAL A 20 -3.744 -5.588 6.269 1.00 0.98 H new ATOM 0 HG11 VAL A 20 -5.130 -4.457 4.564 1.00 1.04 H new ATOM 0 HG12 VAL A 20 -5.068 -6.218 4.312 1.00 1.04 H new ATOM 0 HG13 VAL A 20 -6.516 -5.472 5.028 1.00 1.04 H new ATOM 0 HG21 VAL A 20 -4.941 -3.506 6.838 1.00 1.24 H new ATOM 0 HG22 VAL A 20 -6.318 -4.467 7.429 1.00 1.24 H new ATOM 0 HG23 VAL A 20 -4.743 -4.569 8.252 1.00 1.24 H new ATOM 303 N SER A 21 -3.780 -8.322 5.607 1.00 1.26 N ATOM 304 CA SER A 21 -3.438 -9.420 4.719 1.00 1.02 C ATOM 305 C SER A 21 -3.897 -9.103 3.294 1.00 0.82 C ATOM 306 O SER A 21 -4.997 -8.590 3.093 1.00 0.86 O ATOM 307 CB SER A 21 -4.062 -10.731 5.198 1.00 1.15 C ATOM 308 OG SER A 21 -4.142 -10.797 6.620 1.00 2.16 O ATOM 0 H SER A 21 -2.990 -7.743 5.894 1.00 1.26 H new ATOM 0 HA SER A 21 -2.355 -9.541 4.727 1.00 1.02 H new ATOM 0 HB2 SER A 21 -5.061 -10.833 4.774 1.00 1.15 H new ATOM 0 HB3 SER A 21 -3.472 -11.570 4.829 1.00 1.15 H new ATOM 0 HG SER A 21 -4.548 -11.649 6.886 1.00 2.16 H new ATOM 314 N PHE A 22 -3.030 -9.420 2.343 1.00 0.69 N ATOM 315 CA PHE A 22 -3.319 -9.143 0.946 1.00 0.57 C ATOM 316 C PHE A 22 -3.001 -10.357 0.070 1.00 0.52 C ATOM 317 O PHE A 22 -2.288 -11.264 0.496 1.00 0.71 O ATOM 318 CB PHE A 22 -2.422 -7.978 0.527 1.00 0.59 C ATOM 319 CG PHE A 22 -2.501 -6.765 1.455 1.00 0.70 C ATOM 320 CD1 PHE A 22 -3.589 -5.949 1.417 1.00 1.48 C ATOM 321 CD2 PHE A 22 -1.484 -6.501 2.319 1.00 1.87 C ATOM 322 CE1 PHE A 22 -3.663 -4.823 2.279 1.00 1.52 C ATOM 323 CE2 PHE A 22 -1.558 -5.375 3.181 1.00 1.99 C ATOM 324 CZ PHE A 22 -2.647 -4.561 3.143 1.00 1.04 C ATOM 0 H PHE A 22 -2.128 -9.866 2.512 1.00 0.69 H new ATOM 0 HA PHE A 22 -4.376 -8.907 0.824 1.00 0.57 H new ATOM 0 HB2 PHE A 22 -1.389 -8.325 0.487 1.00 0.59 H new ATOM 0 HB3 PHE A 22 -2.694 -7.668 -0.482 1.00 0.59 H new ATOM 0 HD1 PHE A 22 -4.397 -6.158 0.731 1.00 1.48 H new ATOM 0 HD2 PHE A 22 -0.620 -7.148 2.349 1.00 1.87 H new ATOM 0 HE1 PHE A 22 -4.526 -4.175 2.248 1.00 1.52 H new ATOM 0 HE2 PHE A 22 -0.750 -5.165 3.866 1.00 1.99 H new ATOM 0 HZ PHE A 22 -2.704 -3.706 3.800 1.00 1.04 H new ATOM 334 N GLU A 23 -3.547 -10.335 -1.137 1.00 0.60 N ATOM 335 CA GLU A 23 -3.196 -11.330 -2.135 1.00 0.63 C ATOM 336 C GLU A 23 -2.433 -10.677 -3.290 1.00 0.80 C ATOM 337 O GLU A 23 -2.869 -9.664 -3.833 1.00 1.63 O ATOM 338 CB GLU A 23 -4.440 -12.059 -2.644 1.00 0.71 C ATOM 339 CG GLU A 23 -5.336 -12.493 -1.481 1.00 1.53 C ATOM 340 CD GLU A 23 -6.476 -13.387 -1.971 1.00 1.75 C ATOM 341 OE1 GLU A 23 -6.164 -14.365 -2.685 1.00 2.29 O ATOM 342 OE2 GLU A 23 -7.634 -13.072 -1.622 1.00 2.30 O ATOM 0 H GLU A 23 -4.230 -9.643 -1.446 1.00 0.60 H new ATOM 0 HA GLU A 23 -2.547 -12.071 -1.668 1.00 0.63 H new ATOM 0 HB2 GLU A 23 -4.999 -11.407 -3.315 1.00 0.71 H new ATOM 0 HB3 GLU A 23 -4.142 -12.933 -3.224 1.00 0.71 H new ATOM 0 HG2 GLU A 23 -4.742 -13.028 -0.740 1.00 1.53 H new ATOM 0 HG3 GLU A 23 -5.746 -11.613 -0.986 1.00 1.53 H new ATOM 349 N LEU A 24 -1.305 -11.285 -3.630 1.00 0.79 N ATOM 350 CA LEU A 24 -0.422 -10.716 -4.634 1.00 0.86 C ATOM 351 C LEU A 24 -0.608 -11.466 -5.954 1.00 0.89 C ATOM 352 O LEU A 24 -0.234 -12.632 -6.068 1.00 1.27 O ATOM 353 CB LEU A 24 1.023 -10.704 -4.131 1.00 0.97 C ATOM 354 CG LEU A 24 1.245 -10.103 -2.742 1.00 1.21 C ATOM 355 CD1 LEU A 24 2.687 -10.315 -2.277 1.00 2.49 C ATOM 356 CD2 LEU A 24 0.844 -8.627 -2.711 1.00 1.71 C ATOM 0 H LEU A 24 -0.983 -12.165 -3.228 1.00 0.79 H new ATOM 0 HA LEU A 24 -0.679 -9.673 -4.821 1.00 0.86 H new ATOM 0 HB2 LEU A 24 1.393 -11.729 -4.125 1.00 0.97 H new ATOM 0 HB3 LEU A 24 1.631 -10.150 -4.846 1.00 0.97 H new ATOM 0 HG LEU A 24 0.599 -10.626 -2.037 1.00 1.21 H new ATOM 0 HD11 LEU A 24 2.818 -9.878 -1.287 1.00 2.49 H new ATOM 0 HD12 LEU A 24 2.902 -11.383 -2.234 1.00 2.49 H new ATOM 0 HD13 LEU A 24 3.370 -9.835 -2.978 1.00 2.49 H new ATOM 0 HD21 LEU A 24 1.012 -8.225 -1.712 1.00 1.71 H new ATOM 0 HD22 LEU A 24 1.445 -8.072 -3.431 1.00 1.71 H new ATOM 0 HD23 LEU A 24 -0.211 -8.531 -2.968 1.00 1.71 H new ATOM 368 N PHE A 25 -1.186 -10.765 -6.919 1.00 0.70 N ATOM 369 CA PHE A 25 -1.437 -11.355 -8.223 1.00 0.69 C ATOM 370 C PHE A 25 -0.153 -11.419 -9.053 1.00 0.69 C ATOM 371 O PHE A 25 0.052 -10.603 -9.950 1.00 0.87 O ATOM 372 CB PHE A 25 -2.446 -10.452 -8.936 1.00 0.75 C ATOM 373 CG PHE A 25 -3.907 -10.794 -8.637 1.00 0.66 C ATOM 374 CD1 PHE A 25 -4.321 -10.945 -7.350 1.00 1.82 C ATOM 375 CD2 PHE A 25 -4.793 -10.946 -9.658 1.00 2.08 C ATOM 376 CE1 PHE A 25 -5.676 -11.263 -7.072 1.00 1.79 C ATOM 377 CE2 PHE A 25 -6.149 -11.262 -9.380 1.00 2.39 C ATOM 378 CZ PHE A 25 -6.561 -11.415 -8.093 1.00 1.29 C ATOM 0 H PHE A 25 -1.487 -9.795 -6.824 1.00 0.70 H new ATOM 0 HA PHE A 25 -1.812 -12.371 -8.105 1.00 0.69 H new ATOM 0 HB2 PHE A 25 -2.259 -9.417 -8.648 1.00 0.75 H new ATOM 0 HB3 PHE A 25 -2.281 -10.518 -10.011 1.00 0.75 H new ATOM 0 HD1 PHE A 25 -3.618 -10.823 -6.539 1.00 1.82 H new ATOM 0 HD2 PHE A 25 -4.465 -10.826 -10.680 1.00 2.08 H new ATOM 0 HE1 PHE A 25 -6.004 -11.384 -6.050 1.00 1.79 H new ATOM 0 HE2 PHE A 25 -6.853 -11.381 -10.190 1.00 2.39 H new ATOM 0 HZ PHE A 25 -7.592 -11.657 -7.882 1.00 1.29 H new ATOM 388 N ALA A 26 0.678 -12.397 -8.724 1.00 0.58 N ATOM 389 CA ALA A 26 1.942 -12.570 -9.419 1.00 0.62 C ATOM 390 C ALA A 26 1.687 -13.217 -10.781 1.00 0.68 C ATOM 391 O ALA A 26 2.526 -13.136 -11.678 1.00 0.89 O ATOM 392 CB ALA A 26 2.893 -13.395 -8.549 1.00 0.71 C ATOM 0 H ALA A 26 0.501 -13.078 -7.985 1.00 0.58 H new ATOM 0 HA ALA A 26 2.417 -11.605 -9.598 1.00 0.62 H new ATOM 0 HB1 ALA A 26 3.842 -13.525 -9.070 1.00 0.71 H new ATOM 0 HB2 ALA A 26 3.065 -12.877 -7.606 1.00 0.71 H new ATOM 0 HB3 ALA A 26 2.451 -14.371 -8.351 1.00 0.71 H new ATOM 398 N ASP A 27 0.526 -13.846 -10.894 1.00 0.71 N ATOM 399 CA ASP A 27 0.151 -14.509 -12.131 1.00 0.79 C ATOM 400 C ASP A 27 0.242 -13.511 -13.287 1.00 0.85 C ATOM 401 O ASP A 27 0.732 -13.845 -14.365 1.00 1.29 O ATOM 402 CB ASP A 27 -1.287 -15.026 -12.064 1.00 0.99 C ATOM 403 CG ASP A 27 -1.891 -15.431 -13.411 1.00 1.37 C ATOM 404 OD1 ASP A 27 -1.306 -16.335 -14.047 1.00 1.54 O ATOM 405 OD2 ASP A 27 -2.924 -14.829 -13.773 1.00 2.57 O ATOM 0 H ASP A 27 -0.167 -13.910 -10.149 1.00 0.71 H new ATOM 0 HA ASP A 27 0.829 -15.349 -12.283 1.00 0.79 H new ATOM 0 HB2 ASP A 27 -1.317 -15.886 -11.396 1.00 0.99 H new ATOM 0 HB3 ASP A 27 -1.915 -14.254 -11.619 1.00 0.99 H new ATOM 410 N LYS A 28 -0.237 -12.304 -13.023 1.00 0.87 N ATOM 411 CA LYS A 28 -0.395 -11.315 -14.077 1.00 0.96 C ATOM 412 C LYS A 28 0.765 -10.319 -14.013 1.00 0.87 C ATOM 413 O LYS A 28 1.268 -9.880 -15.046 1.00 0.97 O ATOM 414 CB LYS A 28 -1.775 -10.658 -13.992 1.00 1.14 C ATOM 415 CG LYS A 28 -2.881 -11.713 -13.925 1.00 1.26 C ATOM 416 CD LYS A 28 -4.252 -11.088 -14.191 1.00 1.88 C ATOM 417 CE LYS A 28 -5.377 -12.070 -13.858 1.00 2.14 C ATOM 418 NZ LYS A 28 -5.125 -13.381 -14.496 1.00 3.04 N ATOM 0 H LYS A 28 -0.521 -11.988 -12.095 1.00 0.87 H new ATOM 0 HA LYS A 28 -0.354 -11.791 -15.057 1.00 0.96 H new ATOM 0 HB2 LYS A 28 -1.824 -10.018 -13.111 1.00 1.14 H new ATOM 0 HB3 LYS A 28 -1.931 -10.017 -14.860 1.00 1.14 H new ATOM 0 HG2 LYS A 28 -2.686 -12.496 -14.658 1.00 1.26 H new ATOM 0 HG3 LYS A 28 -2.878 -12.187 -12.943 1.00 1.26 H new ATOM 0 HD2 LYS A 28 -4.365 -10.184 -13.593 1.00 1.88 H new ATOM 0 HD3 LYS A 28 -4.323 -10.790 -15.237 1.00 1.88 H new ATOM 0 HE2 LYS A 28 -5.453 -12.193 -12.778 1.00 2.14 H new ATOM 0 HE3 LYS A 28 -6.331 -11.669 -14.201 1.00 2.14 H new ATOM 0 HZ1 LYS A 28 -6.021 -13.901 -14.587 1.00 3.04 H new ATOM 0 HZ2 LYS A 28 -4.713 -13.234 -15.440 1.00 3.04 H new ATOM 0 HZ3 LYS A 28 -4.464 -13.930 -13.911 1.00 3.04 H new ATOM 432 N VAL A 29 1.156 -9.992 -12.790 1.00 0.77 N ATOM 433 CA VAL A 29 2.204 -9.008 -12.578 1.00 0.75 C ATOM 434 C VAL A 29 3.131 -9.490 -11.461 1.00 0.78 C ATOM 435 O VAL A 29 2.956 -9.120 -10.301 1.00 0.81 O ATOM 436 CB VAL A 29 1.585 -7.638 -12.292 1.00 0.75 C ATOM 437 CG1 VAL A 29 1.203 -6.927 -13.592 1.00 0.85 C ATOM 438 CG2 VAL A 29 0.378 -7.765 -11.360 1.00 0.88 C ATOM 0 H VAL A 29 0.766 -10.391 -11.936 1.00 0.77 H new ATOM 0 HA VAL A 29 2.810 -8.895 -13.477 1.00 0.75 H new ATOM 0 HB VAL A 29 2.335 -7.030 -11.786 1.00 0.75 H new ATOM 0 HG11 VAL A 29 0.765 -5.956 -13.361 1.00 0.85 H new ATOM 0 HG12 VAL A 29 2.093 -6.787 -14.205 1.00 0.85 H new ATOM 0 HG13 VAL A 29 0.478 -7.531 -14.138 1.00 0.85 H new ATOM 0 HG21 VAL A 29 -0.043 -6.777 -11.173 1.00 0.88 H new ATOM 0 HG22 VAL A 29 -0.377 -8.399 -11.826 1.00 0.88 H new ATOM 0 HG23 VAL A 29 0.692 -8.210 -10.416 1.00 0.88 H new ATOM 448 N PRO A 30 4.123 -10.331 -11.859 1.00 0.90 N ATOM 449 CA PRO A 30 5.036 -10.922 -10.896 1.00 1.05 C ATOM 450 C PRO A 30 6.057 -9.894 -10.407 1.00 1.29 C ATOM 451 O PRO A 30 6.549 -9.988 -9.283 1.00 2.46 O ATOM 452 CB PRO A 30 5.674 -12.094 -11.625 1.00 1.18 C ATOM 453 CG PRO A 30 5.445 -11.837 -13.105 1.00 1.21 C ATOM 454 CD PRO A 30 4.399 -10.741 -13.234 1.00 1.04 C ATOM 0 HA PRO A 30 4.531 -11.261 -9.991 1.00 1.05 H new ATOM 0 HB2 PRO A 30 6.738 -12.161 -11.400 1.00 1.18 H new ATOM 0 HB3 PRO A 30 5.223 -13.038 -11.318 1.00 1.18 H new ATOM 0 HG2 PRO A 30 6.375 -11.536 -13.588 1.00 1.21 H new ATOM 0 HG3 PRO A 30 5.108 -12.746 -13.602 1.00 1.21 H new ATOM 0 HD2 PRO A 30 4.770 -9.907 -13.829 1.00 1.04 H new ATOM 0 HD3 PRO A 30 3.499 -11.108 -13.726 1.00 1.04 H new ATOM 462 N LYS A 31 6.347 -8.937 -11.275 1.00 1.00 N ATOM 463 CA LYS A 31 7.338 -7.920 -10.964 1.00 1.06 C ATOM 464 C LYS A 31 6.854 -7.087 -9.776 1.00 0.97 C ATOM 465 O LYS A 31 7.524 -7.021 -8.747 1.00 1.06 O ATOM 466 CB LYS A 31 7.661 -7.089 -12.208 1.00 1.25 C ATOM 467 CG LYS A 31 8.537 -7.878 -13.183 1.00 1.81 C ATOM 468 CD LYS A 31 8.844 -7.053 -14.435 1.00 2.27 C ATOM 469 CE LYS A 31 9.904 -7.741 -15.297 1.00 3.03 C ATOM 470 NZ LYS A 31 9.384 -9.017 -15.837 1.00 4.31 N ATOM 0 H LYS A 31 5.914 -8.844 -12.194 1.00 1.00 H new ATOM 0 HA LYS A 31 8.278 -8.383 -10.665 1.00 1.06 H new ATOM 0 HB2 LYS A 31 6.736 -6.794 -12.703 1.00 1.25 H new ATOM 0 HB3 LYS A 31 8.172 -6.172 -11.914 1.00 1.25 H new ATOM 0 HG2 LYS A 31 9.468 -8.162 -12.693 1.00 1.81 H new ATOM 0 HG3 LYS A 31 8.032 -8.801 -13.466 1.00 1.81 H new ATOM 0 HD2 LYS A 31 7.932 -6.913 -15.016 1.00 2.27 H new ATOM 0 HD3 LYS A 31 9.193 -6.062 -14.145 1.00 2.27 H new ATOM 0 HE2 LYS A 31 10.197 -7.085 -16.117 1.00 3.03 H new ATOM 0 HE3 LYS A 31 10.799 -7.928 -14.703 1.00 3.03 H new ATOM 0 HZ1 LYS A 31 10.068 -9.413 -16.513 1.00 4.31 H new ATOM 0 HZ2 LYS A 31 9.238 -9.690 -15.058 1.00 4.31 H new ATOM 0 HZ3 LYS A 31 8.479 -8.846 -16.321 1.00 4.31 H new ATOM 484 N THR A 32 5.694 -6.473 -9.959 1.00 0.94 N ATOM 485 CA THR A 32 5.128 -5.623 -8.926 1.00 0.91 C ATOM 486 C THR A 32 4.834 -6.438 -7.665 1.00 0.79 C ATOM 487 O THR A 32 5.042 -5.960 -6.551 1.00 0.85 O ATOM 488 CB THR A 32 3.890 -4.935 -9.506 1.00 0.99 C ATOM 489 OG1 THR A 32 4.117 -4.940 -10.913 1.00 1.12 O ATOM 490 CG2 THR A 32 3.821 -3.450 -9.145 1.00 0.95 C ATOM 0 H THR A 32 5.131 -6.547 -10.807 1.00 0.94 H new ATOM 0 HA THR A 32 5.834 -4.851 -8.619 1.00 0.91 H new ATOM 0 HB THR A 32 2.993 -5.438 -9.144 1.00 0.99 H new ATOM 0 HG1 THR A 32 4.762 -4.239 -11.143 1.00 1.12 H new ATOM 0 HG21 THR A 32 2.924 -3.011 -9.581 1.00 0.95 H new ATOM 0 HG22 THR A 32 3.788 -3.340 -8.061 1.00 0.95 H new ATOM 0 HG23 THR A 32 4.702 -2.939 -9.535 1.00 0.95 H new ATOM 498 N ALA A 33 4.358 -7.654 -7.883 1.00 0.71 N ATOM 499 CA ALA A 33 3.988 -8.523 -6.779 1.00 0.70 C ATOM 500 C ALA A 33 5.237 -8.857 -5.959 1.00 0.71 C ATOM 501 O ALA A 33 5.197 -8.853 -4.730 1.00 0.77 O ATOM 502 CB ALA A 33 3.294 -9.773 -7.321 1.00 0.73 C ATOM 0 H ALA A 33 4.220 -8.059 -8.809 1.00 0.71 H new ATOM 0 HA ALA A 33 3.282 -8.022 -6.116 1.00 0.70 H new ATOM 0 HB1 ALA A 33 3.017 -10.424 -6.492 1.00 0.73 H new ATOM 0 HB2 ALA A 33 2.398 -9.483 -7.869 1.00 0.73 H new ATOM 0 HB3 ALA A 33 3.972 -10.305 -7.989 1.00 0.73 H new ATOM 508 N GLU A 34 6.317 -9.138 -6.674 1.00 0.72 N ATOM 509 CA GLU A 34 7.554 -9.546 -6.031 1.00 0.81 C ATOM 510 C GLU A 34 8.080 -8.424 -5.134 1.00 0.77 C ATOM 511 O GLU A 34 8.524 -8.676 -4.015 1.00 0.80 O ATOM 512 CB GLU A 34 8.601 -9.956 -7.069 1.00 0.95 C ATOM 513 CG GLU A 34 9.955 -10.219 -6.406 1.00 1.09 C ATOM 514 CD GLU A 34 10.810 -11.159 -7.259 1.00 1.74 C ATOM 515 OE1 GLU A 34 11.259 -10.701 -8.332 1.00 2.86 O ATOM 516 OE2 GLU A 34 10.994 -12.314 -6.819 1.00 2.63 O ATOM 0 H GLU A 34 6.361 -9.091 -7.692 1.00 0.72 H new ATOM 0 HA GLU A 34 7.348 -10.416 -5.408 1.00 0.81 H new ATOM 0 HB2 GLU A 34 8.268 -10.852 -7.593 1.00 0.95 H new ATOM 0 HB3 GLU A 34 8.705 -9.170 -7.817 1.00 0.95 H new ATOM 0 HG2 GLU A 34 10.481 -9.276 -6.259 1.00 1.09 H new ATOM 0 HG3 GLU A 34 9.802 -10.656 -5.419 1.00 1.09 H new ATOM 523 N ASN A 35 8.014 -7.209 -5.659 1.00 0.81 N ATOM 524 CA ASN A 35 8.478 -6.048 -4.918 1.00 0.90 C ATOM 525 C ASN A 35 7.840 -6.048 -3.528 1.00 0.95 C ATOM 526 O ASN A 35 8.526 -5.841 -2.528 1.00 1.54 O ATOM 527 CB ASN A 35 8.077 -4.751 -5.623 1.00 1.13 C ATOM 528 CG ASN A 35 8.720 -3.538 -4.947 1.00 1.89 C ATOM 529 OD1 ASN A 35 9.703 -3.643 -4.232 1.00 2.50 O ATOM 530 ND2 ASN A 35 8.112 -2.385 -5.211 1.00 2.87 N ATOM 0 H ASN A 35 7.646 -7.003 -6.588 1.00 0.81 H new ATOM 0 HA ASN A 35 9.565 -6.101 -4.851 1.00 0.90 H new ATOM 0 HB2 ASN A 35 8.381 -4.792 -6.669 1.00 1.13 H new ATOM 0 HB3 ASN A 35 6.992 -4.646 -5.610 1.00 1.13 H new ATOM 0 HD21 ASN A 35 8.465 -1.518 -4.806 1.00 2.87 H new ATOM 0 HD22 ASN A 35 7.293 -2.368 -5.818 1.00 2.87 H new ATOM 537 N PHE A 36 6.537 -6.281 -3.509 1.00 0.83 N ATOM 538 CA PHE A 36 5.799 -6.310 -2.257 1.00 0.86 C ATOM 539 C PHE A 36 6.125 -7.575 -1.459 1.00 0.75 C ATOM 540 O PHE A 36 6.250 -7.526 -0.237 1.00 0.84 O ATOM 541 CB PHE A 36 4.312 -6.315 -2.614 1.00 1.00 C ATOM 542 CG PHE A 36 3.396 -5.888 -1.466 1.00 1.61 C ATOM 543 CD1 PHE A 36 3.173 -6.733 -0.423 1.00 2.92 C ATOM 544 CD2 PHE A 36 2.802 -4.664 -1.489 1.00 2.39 C ATOM 545 CE1 PHE A 36 2.322 -6.337 0.642 1.00 3.64 C ATOM 546 CE2 PHE A 36 1.951 -4.268 -0.423 1.00 3.05 C ATOM 547 CZ PHE A 36 1.729 -5.112 0.620 1.00 3.28 C ATOM 0 H PHE A 36 5.972 -6.452 -4.341 1.00 0.83 H new ATOM 0 HA PHE A 36 6.067 -5.448 -1.646 1.00 0.86 H new ATOM 0 HB2 PHE A 36 4.150 -5.649 -3.462 1.00 1.00 H new ATOM 0 HB3 PHE A 36 4.030 -7.317 -2.937 1.00 1.00 H new ATOM 0 HD1 PHE A 36 3.643 -7.705 -0.405 1.00 2.92 H new ATOM 0 HD2 PHE A 36 2.978 -3.994 -2.318 1.00 2.39 H new ATOM 0 HE1 PHE A 36 2.145 -7.008 1.470 1.00 3.64 H new ATOM 0 HE2 PHE A 36 1.480 -3.296 -0.441 1.00 3.05 H new ATOM 0 HZ PHE A 36 1.082 -4.810 1.431 1.00 3.28 H new ATOM 557 N ARG A 37 6.251 -8.677 -2.183 1.00 0.68 N ATOM 558 CA ARG A 37 6.572 -9.950 -1.560 1.00 0.78 C ATOM 559 C ARG A 37 7.852 -9.828 -0.731 1.00 0.73 C ATOM 560 O ARG A 37 7.913 -10.308 0.399 1.00 0.82 O ATOM 561 CB ARG A 37 6.754 -11.047 -2.610 1.00 0.92 C ATOM 562 CG ARG A 37 6.901 -12.419 -1.948 1.00 1.26 C ATOM 563 CD ARG A 37 7.588 -13.411 -2.889 1.00 2.08 C ATOM 564 NE ARG A 37 9.038 -13.121 -2.959 1.00 3.22 N ATOM 565 CZ ARG A 37 9.744 -13.092 -4.097 1.00 4.66 C ATOM 566 NH1 ARG A 37 9.241 -13.638 -5.213 1.00 5.02 N ATOM 567 NH2 ARG A 37 10.954 -12.518 -4.120 1.00 6.39 N ATOM 0 H ARG A 37 6.137 -8.715 -3.196 1.00 0.68 H new ATOM 0 HA ARG A 37 5.740 -10.220 -0.910 1.00 0.78 H new ATOM 0 HB2 ARG A 37 5.899 -11.055 -3.285 1.00 0.92 H new ATOM 0 HB3 ARG A 37 7.636 -10.834 -3.215 1.00 0.92 H new ATOM 0 HG2 ARG A 37 7.480 -12.323 -1.029 1.00 1.26 H new ATOM 0 HG3 ARG A 37 5.918 -12.799 -1.668 1.00 1.26 H new ATOM 0 HD2 ARG A 37 7.429 -14.430 -2.536 1.00 2.08 H new ATOM 0 HD3 ARG A 37 7.147 -13.346 -3.884 1.00 2.08 H new ATOM 0 HE ARG A 37 9.530 -12.931 -2.086 1.00 3.22 H new ATOM 0 HH11 ARG A 37 8.320 -14.076 -5.196 1.00 5.02 H new ATOM 0 HH12 ARG A 37 9.779 -13.615 -6.079 1.00 5.02 H new ATOM 0 HH21 ARG A 37 11.338 -12.103 -3.271 1.00 6.39 H new ATOM 0 HH22 ARG A 37 11.492 -12.496 -4.987 1.00 6.39 H new ATOM 581 N ALA A 38 8.845 -9.182 -1.327 1.00 0.69 N ATOM 582 CA ALA A 38 10.155 -9.090 -0.706 1.00 0.75 C ATOM 583 C ALA A 38 10.045 -8.279 0.588 1.00 0.81 C ATOM 584 O ALA A 38 10.767 -8.539 1.550 1.00 0.90 O ATOM 585 CB ALA A 38 11.147 -8.474 -1.696 1.00 0.77 C ATOM 0 H ALA A 38 8.768 -8.718 -2.232 1.00 0.69 H new ATOM 0 HA ALA A 38 10.526 -10.081 -0.445 1.00 0.75 H new ATOM 0 HB1 ALA A 38 12.130 -8.405 -1.230 1.00 0.77 H new ATOM 0 HB2 ALA A 38 11.210 -9.101 -2.585 1.00 0.77 H new ATOM 0 HB3 ALA A 38 10.808 -7.477 -1.978 1.00 0.77 H new ATOM 591 N LEU A 39 9.139 -7.314 0.569 1.00 0.88 N ATOM 592 CA LEU A 39 8.979 -6.415 1.699 1.00 1.06 C ATOM 593 C LEU A 39 8.256 -7.147 2.831 1.00 1.20 C ATOM 594 O LEU A 39 8.093 -6.605 3.923 1.00 1.56 O ATOM 595 CB LEU A 39 8.286 -5.123 1.263 1.00 1.13 C ATOM 596 CG LEU A 39 9.046 -4.263 0.250 1.00 1.11 C ATOM 597 CD1 LEU A 39 8.135 -3.192 -0.353 1.00 1.33 C ATOM 598 CD2 LEU A 39 10.305 -3.661 0.877 1.00 1.26 C ATOM 0 H LEU A 39 8.507 -7.134 -0.211 1.00 0.88 H new ATOM 0 HA LEU A 39 9.953 -6.113 2.084 1.00 1.06 H new ATOM 0 HB2 LEU A 39 7.316 -5.380 0.836 1.00 1.13 H new ATOM 0 HB3 LEU A 39 8.094 -4.520 2.150 1.00 1.13 H new ATOM 0 HG LEU A 39 9.371 -4.905 -0.568 1.00 1.11 H new ATOM 0 HD11 LEU A 39 8.700 -2.595 -1.069 1.00 1.33 H new ATOM 0 HD12 LEU A 39 7.297 -3.670 -0.860 1.00 1.33 H new ATOM 0 HD13 LEU A 39 7.758 -2.546 0.440 1.00 1.33 H new ATOM 0 HD21 LEU A 39 10.826 -3.055 0.136 1.00 1.26 H new ATOM 0 HD22 LEU A 39 10.026 -3.036 1.726 1.00 1.26 H new ATOM 0 HD23 LEU A 39 10.961 -4.462 1.217 1.00 1.26 H new ATOM 610 N SER A 40 7.843 -8.371 2.532 1.00 1.19 N ATOM 611 CA SER A 40 7.295 -9.246 3.554 1.00 1.47 C ATOM 612 C SER A 40 8.318 -10.322 3.925 1.00 1.77 C ATOM 613 O SER A 40 8.512 -10.620 5.103 1.00 2.20 O ATOM 614 CB SER A 40 5.991 -9.894 3.083 1.00 1.38 C ATOM 615 OG SER A 40 5.222 -10.398 4.172 1.00 2.75 O ATOM 0 H SER A 40 7.877 -8.777 1.597 1.00 1.19 H new ATOM 0 HA SER A 40 7.073 -8.645 4.436 1.00 1.47 H new ATOM 0 HB2 SER A 40 5.401 -9.162 2.531 1.00 1.38 H new ATOM 0 HB3 SER A 40 6.218 -10.707 2.393 1.00 1.38 H new ATOM 0 HG SER A 40 4.510 -9.762 4.392 1.00 2.75 H new ATOM 621 N THR A 41 8.946 -10.875 2.898 1.00 1.77 N ATOM 622 CA THR A 41 9.995 -11.859 3.105 1.00 2.21 C ATOM 623 C THR A 41 11.154 -11.614 2.135 1.00 3.11 C ATOM 624 O THR A 41 11.205 -12.208 1.060 1.00 4.58 O ATOM 625 CB THR A 41 9.372 -13.250 2.966 1.00 2.16 C ATOM 626 OG1 THR A 41 10.453 -14.141 3.224 1.00 2.81 O ATOM 627 CG2 THR A 41 8.962 -13.568 1.528 1.00 2.89 C ATOM 0 H THR A 41 8.749 -10.661 1.920 1.00 1.77 H new ATOM 0 HA THR A 41 10.424 -11.776 4.104 1.00 2.21 H new ATOM 0 HB THR A 41 8.500 -13.323 3.616 1.00 2.16 H new ATOM 0 HG1 THR A 41 10.137 -15.066 3.156 1.00 2.81 H new ATOM 0 HG21 THR A 41 8.526 -14.566 1.486 1.00 2.89 H new ATOM 0 HG22 THR A 41 8.228 -12.837 1.189 1.00 2.89 H new ATOM 0 HG23 THR A 41 9.839 -13.528 0.882 1.00 2.89 H new ATOM 635 N GLY A 42 12.057 -10.738 2.552 1.00 2.67 N ATOM 636 CA GLY A 42 13.160 -10.336 1.697 1.00 3.46 C ATOM 637 C GLY A 42 14.414 -10.041 2.523 1.00 2.59 C ATOM 638 O GLY A 42 14.657 -8.896 2.902 1.00 2.45 O ATOM 0 H GLY A 42 12.047 -10.296 3.471 1.00 2.67 H new ATOM 0 HA2 GLY A 42 13.372 -11.125 0.976 1.00 3.46 H new ATOM 0 HA3 GLY A 42 12.879 -9.451 1.127 1.00 3.46 H new ATOM 642 N GLU A 43 15.177 -11.094 2.775 1.00 2.91 N ATOM 643 CA GLU A 43 16.527 -10.933 3.290 1.00 3.01 C ATOM 644 C GLU A 43 17.370 -10.104 2.320 1.00 2.88 C ATOM 645 O GLU A 43 18.360 -9.492 2.719 1.00 3.59 O ATOM 646 CB GLU A 43 17.177 -12.292 3.559 1.00 4.12 C ATOM 647 CG GLU A 43 16.517 -12.991 4.750 1.00 4.69 C ATOM 648 CD GLU A 43 16.829 -12.258 6.056 1.00 5.74 C ATOM 649 OE1 GLU A 43 18.009 -12.307 6.465 1.00 6.81 O ATOM 650 OE2 GLU A 43 15.881 -11.667 6.616 1.00 6.15 O ATOM 0 H GLU A 43 14.887 -12.061 2.633 1.00 2.91 H new ATOM 0 HA GLU A 43 16.472 -10.400 4.239 1.00 3.01 H new ATOM 0 HB2 GLU A 43 17.094 -12.921 2.672 1.00 4.12 H new ATOM 0 HB3 GLU A 43 18.241 -12.158 3.756 1.00 4.12 H new ATOM 0 HG2 GLU A 43 15.438 -13.032 4.600 1.00 4.69 H new ATOM 0 HG3 GLU A 43 16.869 -14.021 4.813 1.00 4.69 H new ATOM 657 N LYS A 44 16.947 -10.110 1.064 1.00 2.88 N ATOM 658 CA LYS A 44 17.645 -9.358 0.036 1.00 2.94 C ATOM 659 C LYS A 44 16.989 -7.984 -0.119 1.00 3.18 C ATOM 660 O LYS A 44 17.632 -7.030 -0.554 1.00 3.45 O ATOM 661 CB LYS A 44 17.707 -10.160 -1.265 1.00 3.83 C ATOM 662 CG LYS A 44 16.346 -10.178 -1.963 1.00 3.64 C ATOM 663 CD LYS A 44 16.275 -9.110 -3.057 1.00 3.19 C ATOM 664 CE LYS A 44 17.254 -9.420 -4.191 1.00 3.41 C ATOM 665 NZ LYS A 44 16.576 -9.320 -5.503 1.00 4.01 N ATOM 0 H LYS A 44 16.129 -10.624 0.736 1.00 2.88 H new ATOM 0 HA LYS A 44 18.681 -9.186 0.327 1.00 2.94 H new ATOM 0 HB2 LYS A 44 18.454 -9.726 -1.929 1.00 3.83 H new ATOM 0 HB3 LYS A 44 18.024 -11.181 -1.052 1.00 3.83 H new ATOM 0 HG2 LYS A 44 16.170 -11.162 -2.398 1.00 3.64 H new ATOM 0 HG3 LYS A 44 15.556 -10.007 -1.232 1.00 3.64 H new ATOM 0 HD2 LYS A 44 15.261 -9.056 -3.452 1.00 3.19 H new ATOM 0 HD3 LYS A 44 16.504 -8.133 -2.632 1.00 3.19 H new ATOM 0 HE2 LYS A 44 18.093 -8.725 -4.155 1.00 3.41 H new ATOM 0 HE3 LYS A 44 17.664 -10.422 -4.062 1.00 3.41 H new ATOM 0 HZ1 LYS A 44 17.139 -9.815 -6.224 1.00 4.01 H new ATOM 0 HZ2 LYS A 44 15.634 -9.755 -5.441 1.00 4.01 H new ATOM 0 HZ3 LYS A 44 16.478 -8.319 -5.768 1.00 4.01 H new ATOM 679 N GLY A 45 15.717 -7.927 0.247 1.00 3.61 N ATOM 680 CA GLY A 45 14.910 -6.750 -0.030 1.00 4.73 C ATOM 681 C GLY A 45 14.333 -6.164 1.260 1.00 4.19 C ATOM 682 O GLY A 45 13.409 -5.354 1.219 1.00 5.31 O ATOM 0 H GLY A 45 15.225 -8.677 0.733 1.00 3.61 H new ATOM 0 HA2 GLY A 45 15.518 -5.999 -0.535 1.00 4.73 H new ATOM 0 HA3 GLY A 45 14.099 -7.013 -0.709 1.00 4.73 H new ATOM 686 N PHE A 46 14.903 -6.597 2.375 1.00 2.95 N ATOM 687 CA PHE A 46 14.453 -6.131 3.676 1.00 2.82 C ATOM 688 C PHE A 46 12.925 -6.116 3.753 1.00 2.32 C ATOM 689 O PHE A 46 12.248 -6.555 2.826 1.00 2.15 O ATOM 690 CB PHE A 46 14.975 -4.703 3.844 1.00 2.67 C ATOM 691 CG PHE A 46 14.689 -3.792 2.649 1.00 2.10 C ATOM 692 CD1 PHE A 46 13.517 -3.105 2.582 1.00 2.40 C ATOM 693 CD2 PHE A 46 15.608 -3.667 1.653 1.00 2.50 C ATOM 694 CE1 PHE A 46 13.251 -2.258 1.473 1.00 2.59 C ATOM 695 CE2 PHE A 46 15.342 -2.820 0.544 1.00 2.31 C ATOM 696 CZ PHE A 46 14.170 -2.135 0.477 1.00 2.11 C ATOM 0 H PHE A 46 15.673 -7.266 2.404 1.00 2.95 H new ATOM 0 HA PHE A 46 14.823 -6.794 4.458 1.00 2.82 H new ATOM 0 HB2 PHE A 46 14.527 -4.266 4.736 1.00 2.67 H new ATOM 0 HB3 PHE A 46 16.051 -4.738 4.012 1.00 2.67 H new ATOM 0 HD1 PHE A 46 12.788 -3.204 3.373 1.00 2.40 H new ATOM 0 HD2 PHE A 46 16.539 -4.212 1.706 1.00 2.50 H new ATOM 0 HE1 PHE A 46 12.320 -1.712 1.420 1.00 2.59 H new ATOM 0 HE2 PHE A 46 16.071 -2.720 -0.246 1.00 2.31 H new ATOM 0 HZ PHE A 46 13.968 -1.493 -0.367 1.00 2.11 H new ATOM 706 N GLY A 47 12.426 -5.603 4.868 1.00 2.41 N ATOM 707 CA GLY A 47 10.994 -5.600 5.116 1.00 2.27 C ATOM 708 C GLY A 47 10.448 -4.172 5.158 1.00 1.79 C ATOM 709 O GLY A 47 11.214 -3.212 5.228 1.00 2.60 O ATOM 0 H GLY A 47 12.988 -5.186 5.610 1.00 2.41 H new ATOM 0 HA2 GLY A 47 10.485 -6.165 4.335 1.00 2.27 H new ATOM 0 HA3 GLY A 47 10.784 -6.101 6.061 1.00 2.27 H new ATOM 713 N TYR A 48 9.127 -4.076 5.114 1.00 1.53 N ATOM 714 CA TYR A 48 8.471 -2.780 5.124 1.00 1.92 C ATOM 715 C TYR A 48 8.762 -2.028 6.425 1.00 2.02 C ATOM 716 O TYR A 48 9.449 -1.007 6.415 1.00 3.72 O ATOM 717 CB TYR A 48 6.970 -3.067 5.041 1.00 1.99 C ATOM 718 CG TYR A 48 6.129 -1.862 4.613 1.00 3.02 C ATOM 719 CD1 TYR A 48 6.715 -0.617 4.497 1.00 4.22 C ATOM 720 CD2 TYR A 48 4.784 -2.019 4.346 1.00 3.93 C ATOM 721 CE1 TYR A 48 5.923 0.515 4.094 1.00 5.68 C ATOM 722 CE2 TYR A 48 3.992 -0.886 3.944 1.00 5.41 C ATOM 723 CZ TYR A 48 4.601 0.326 3.838 1.00 6.02 C ATOM 724 OH TYR A 48 3.854 1.397 3.458 1.00 7.61 O ATOM 0 H TYR A 48 8.494 -4.875 5.071 1.00 1.53 H new ATOM 0 HA TYR A 48 8.826 -2.164 4.298 1.00 1.92 H new ATOM 0 HB2 TYR A 48 6.805 -3.881 4.336 1.00 1.99 H new ATOM 0 HB3 TYR A 48 6.622 -3.413 6.014 1.00 1.99 H new ATOM 0 HD1 TYR A 48 7.767 -0.493 4.709 1.00 4.22 H new ATOM 0 HD2 TYR A 48 4.325 -2.992 4.439 1.00 3.93 H new ATOM 0 HE1 TYR A 48 6.369 1.494 3.997 1.00 5.68 H new ATOM 0 HE2 TYR A 48 2.939 -0.996 3.731 1.00 5.41 H new ATOM 0 HH TYR A 48 4.446 2.142 3.225 1.00 7.61 H new ATOM 734 N LYS A 49 8.226 -2.561 7.513 1.00 1.39 N ATOM 735 CA LYS A 49 8.279 -1.870 8.789 1.00 1.75 C ATOM 736 C LYS A 49 8.330 -0.361 8.545 1.00 2.56 C ATOM 737 O LYS A 49 9.150 0.340 9.137 1.00 2.81 O ATOM 738 CB LYS A 49 9.439 -2.396 9.636 1.00 1.87 C ATOM 739 CG LYS A 49 9.072 -3.721 10.307 1.00 1.94 C ATOM 740 CD LYS A 49 10.109 -4.106 11.365 1.00 1.90 C ATOM 741 CE LYS A 49 9.617 -5.282 12.212 1.00 2.09 C ATOM 742 NZ LYS A 49 8.718 -4.807 13.287 1.00 2.69 N ATOM 0 H LYS A 49 7.753 -3.464 7.537 1.00 1.39 H new ATOM 0 HA LYS A 49 7.377 -2.069 9.368 1.00 1.75 H new ATOM 0 HB2 LYS A 49 10.319 -2.534 9.008 1.00 1.87 H new ATOM 0 HB3 LYS A 49 9.702 -1.660 10.396 1.00 1.87 H new ATOM 0 HG2 LYS A 49 8.089 -3.638 10.770 1.00 1.94 H new ATOM 0 HG3 LYS A 49 9.005 -4.507 9.555 1.00 1.94 H new ATOM 0 HD2 LYS A 49 11.048 -4.371 10.879 1.00 1.90 H new ATOM 0 HD3 LYS A 49 10.313 -3.250 12.008 1.00 1.90 H new ATOM 0 HE2 LYS A 49 9.091 -5.998 11.580 1.00 2.09 H new ATOM 0 HE3 LYS A 49 10.468 -5.806 12.647 1.00 2.09 H new ATOM 0 HZ1 LYS A 49 8.461 -5.605 13.903 1.00 2.69 H new ATOM 0 HZ2 LYS A 49 9.203 -4.078 13.849 1.00 2.69 H new ATOM 0 HZ3 LYS A 49 7.857 -4.403 12.866 1.00 2.69 H new ATOM 756 N GLY A 50 7.445 0.096 7.671 1.00 3.29 N ATOM 757 CA GLY A 50 7.362 1.513 7.360 1.00 4.21 C ATOM 758 C GLY A 50 6.710 2.289 8.507 1.00 2.98 C ATOM 759 O GLY A 50 5.572 2.739 8.388 1.00 4.06 O ATOM 0 H GLY A 50 6.779 -0.490 7.168 1.00 3.29 H new ATOM 0 HA2 GLY A 50 8.361 1.907 7.171 1.00 4.21 H new ATOM 0 HA3 GLY A 50 6.785 1.655 6.446 1.00 4.21 H new ATOM 763 N SER A 51 7.460 2.421 9.591 1.00 1.75 N ATOM 764 CA SER A 51 6.974 3.146 10.753 1.00 2.27 C ATOM 765 C SER A 51 6.072 4.300 10.310 1.00 2.13 C ATOM 766 O SER A 51 6.473 5.126 9.489 1.00 3.49 O ATOM 767 CB SER A 51 8.136 3.674 11.598 1.00 4.20 C ATOM 768 OG SER A 51 8.993 2.625 12.041 1.00 5.13 O ATOM 0 H SER A 51 8.400 2.038 9.689 1.00 1.75 H new ATOM 0 HA SER A 51 6.396 2.457 11.369 1.00 2.27 H new ATOM 0 HB2 SER A 51 8.713 4.391 11.014 1.00 4.20 H new ATOM 0 HB3 SER A 51 7.742 4.210 12.462 1.00 4.20 H new ATOM 0 HG SER A 51 9.723 3.002 12.575 1.00 5.13 H new ATOM 774 N CYS A 52 4.873 4.322 10.872 1.00 1.93 N ATOM 775 CA CYS A 52 3.956 5.424 10.638 1.00 2.09 C ATOM 776 C CYS A 52 3.292 5.216 9.276 1.00 1.48 C ATOM 777 O CYS A 52 3.399 4.142 8.686 1.00 2.20 O ATOM 778 CB CYS A 52 4.665 6.777 10.727 1.00 3.02 C ATOM 779 SG CYS A 52 3.589 7.995 11.567 1.00 4.35 S ATOM 0 H CYS A 52 4.515 3.593 11.490 1.00 1.93 H new ATOM 0 HA CYS A 52 3.192 5.436 11.415 1.00 2.09 H new ATOM 0 HB2 CYS A 52 5.602 6.670 11.273 1.00 3.02 H new ATOM 0 HB3 CYS A 52 4.917 7.131 9.727 1.00 3.02 H new ATOM 0 HG CYS A 52 2.360 7.832 11.175 1.00 4.35 H new ATOM 785 N PHE A 53 2.619 6.261 8.816 1.00 1.59 N ATOM 786 CA PHE A 53 1.821 6.163 7.606 1.00 1.42 C ATOM 787 C PHE A 53 1.745 7.513 6.888 1.00 1.28 C ATOM 788 O PHE A 53 2.039 8.550 7.480 1.00 2.00 O ATOM 789 CB PHE A 53 0.413 5.744 8.031 1.00 2.25 C ATOM 790 CG PHE A 53 -0.324 6.795 8.864 1.00 3.62 C ATOM 791 CD1 PHE A 53 0.078 7.059 10.135 1.00 4.76 C ATOM 792 CD2 PHE A 53 -1.381 7.466 8.332 1.00 4.79 C ATOM 793 CE1 PHE A 53 -0.607 8.035 10.909 1.00 6.63 C ATOM 794 CE2 PHE A 53 -2.065 8.441 9.104 1.00 6.67 C ATOM 795 CZ PHE A 53 -1.663 8.706 10.376 1.00 7.43 C ATOM 0 H PHE A 53 2.610 7.179 9.260 1.00 1.59 H new ATOM 0 HA PHE A 53 2.270 5.443 6.922 1.00 1.42 H new ATOM 0 HB2 PHE A 53 -0.174 5.525 7.139 1.00 2.25 H new ATOM 0 HB3 PHE A 53 0.478 4.820 8.605 1.00 2.25 H new ATOM 0 HD1 PHE A 53 0.918 6.527 10.557 1.00 4.76 H new ATOM 0 HD2 PHE A 53 -1.700 7.257 7.322 1.00 4.79 H new ATOM 0 HE1 PHE A 53 -0.289 8.244 11.920 1.00 6.63 H new ATOM 0 HE2 PHE A 53 -2.905 8.973 8.681 1.00 6.67 H new ATOM 0 HZ PHE A 53 -2.182 9.449 10.963 1.00 7.43 H new ATOM 805 N HIS A 54 1.347 7.454 5.626 1.00 1.24 N ATOM 806 CA HIS A 54 1.187 8.662 4.836 1.00 1.47 C ATOM 807 C HIS A 54 0.085 9.533 5.444 1.00 1.21 C ATOM 808 O HIS A 54 0.364 10.428 6.240 1.00 1.77 O ATOM 809 CB HIS A 54 0.930 8.320 3.367 1.00 2.35 C ATOM 810 CG HIS A 54 2.121 7.725 2.657 1.00 1.99 C ATOM 811 ND1 HIS A 54 2.510 6.426 2.504 1.00 2.11 N flip ATOM 812 CD2 HIS A 54 3.068 8.496 2.005 1.00 3.12 C flip ATOM 813 CE1 HIS A 54 3.633 6.405 1.796 1.00 2.09 C flip ATOM 814 NE2 HIS A 54 3.981 7.687 1.487 1.00 2.98 N flip ATOM 0 H HIS A 54 1.131 6.589 5.131 1.00 1.24 H new ATOM 0 HA HIS A 54 2.111 9.240 4.858 1.00 1.47 H new ATOM 0 HB2 HIS A 54 0.098 7.619 3.308 1.00 2.35 H new ATOM 0 HB3 HIS A 54 0.622 9.225 2.843 1.00 2.35 H new ATOM 0 HD2 HIS A 54 3.064 9.573 1.931 1.00 3.12 H new ATOM 0 HE1 HIS A 54 4.181 5.519 1.512 1.00 2.09 H new ATOM 0 HE2 HIS A 54 4.800 7.973 0.951 1.00 2.98 H new ATOM 822 N ARG A 55 -1.144 9.237 5.047 1.00 1.04 N ATOM 823 CA ARG A 55 -2.293 9.954 5.575 1.00 1.27 C ATOM 824 C ARG A 55 -3.586 9.214 5.224 1.00 1.10 C ATOM 825 O ARG A 55 -3.761 8.765 4.093 1.00 1.47 O ATOM 826 CB ARG A 55 -2.359 11.377 5.017 1.00 2.16 C ATOM 827 CG ARG A 55 -2.142 11.382 3.503 1.00 1.27 C ATOM 828 CD ARG A 55 -3.048 12.409 2.821 1.00 1.79 C ATOM 829 NE ARG A 55 -2.286 13.157 1.797 1.00 1.68 N ATOM 830 CZ ARG A 55 -2.402 14.475 1.588 1.00 2.85 C ATOM 831 NH1 ARG A 55 -3.541 15.106 1.904 1.00 4.04 N ATOM 832 NH2 ARG A 55 -1.378 15.163 1.065 1.00 3.62 N ATOM 0 H ARG A 55 -1.369 8.511 4.367 1.00 1.04 H new ATOM 0 HA ARG A 55 -2.183 10.007 6.658 1.00 1.27 H new ATOM 0 HB2 ARG A 55 -3.328 11.819 5.251 1.00 2.16 H new ATOM 0 HB3 ARG A 55 -1.602 11.996 5.499 1.00 2.16 H new ATOM 0 HG2 ARG A 55 -1.099 11.609 3.283 1.00 1.27 H new ATOM 0 HG3 ARG A 55 -2.344 10.390 3.100 1.00 1.27 H new ATOM 0 HD2 ARG A 55 -3.897 11.906 2.359 1.00 1.79 H new ATOM 0 HD3 ARG A 55 -3.451 13.099 3.562 1.00 1.79 H new ATOM 0 HE ARG A 55 -1.631 12.636 1.213 1.00 1.68 H new ATOM 0 HH11 ARG A 55 -4.320 14.583 2.304 1.00 4.04 H new ATOM 0 HH12 ARG A 55 -3.629 16.110 1.745 1.00 4.04 H new ATOM 0 HH21 ARG A 55 -0.510 14.683 0.826 1.00 3.62 H new ATOM 0 HH22 ARG A 55 -1.466 16.167 0.906 1.00 3.62 H new ATOM 846 N ILE A 56 -4.458 9.111 6.216 1.00 0.98 N ATOM 847 CA ILE A 56 -5.689 8.355 6.054 1.00 0.81 C ATOM 848 C ILE A 56 -6.847 9.323 5.806 1.00 0.78 C ATOM 849 O ILE A 56 -6.968 10.340 6.486 1.00 0.87 O ATOM 850 CB ILE A 56 -5.908 7.427 7.250 1.00 0.95 C ATOM 851 CG1 ILE A 56 -4.919 6.259 7.227 1.00 1.16 C ATOM 852 CG2 ILE A 56 -7.360 6.947 7.313 1.00 1.07 C ATOM 853 CD1 ILE A 56 -4.723 5.679 8.629 1.00 0.99 C ATOM 0 H ILE A 56 -4.337 9.538 7.134 1.00 0.98 H new ATOM 0 HA ILE A 56 -5.625 7.704 5.182 1.00 0.81 H new ATOM 0 HB ILE A 56 -5.716 7.994 8.161 1.00 0.95 H new ATOM 0 HG12 ILE A 56 -5.284 5.482 6.556 1.00 1.16 H new ATOM 0 HG13 ILE A 56 -3.961 6.597 6.832 1.00 1.16 H new ATOM 0 HG21 ILE A 56 -7.489 6.289 8.172 1.00 1.07 H new ATOM 0 HG22 ILE A 56 -8.023 7.806 7.412 1.00 1.07 H new ATOM 0 HG23 ILE A 56 -7.603 6.404 6.400 1.00 1.07 H new ATOM 0 HD11 ILE A 56 -4.016 4.851 8.585 1.00 0.99 H new ATOM 0 HD12 ILE A 56 -4.335 6.452 9.292 1.00 0.99 H new ATOM 0 HD13 ILE A 56 -5.679 5.320 9.011 1.00 0.99 H new ATOM 865 N ILE A 57 -7.671 8.970 4.830 1.00 0.75 N ATOM 866 CA ILE A 57 -8.883 9.727 4.563 1.00 0.77 C ATOM 867 C ILE A 57 -10.079 8.774 4.546 1.00 0.75 C ATOM 868 O ILE A 57 -10.063 7.762 3.847 1.00 0.72 O ATOM 869 CB ILE A 57 -8.732 10.547 3.280 1.00 0.77 C ATOM 870 CG1 ILE A 57 -7.557 11.523 3.388 1.00 0.81 C ATOM 871 CG2 ILE A 57 -10.038 11.260 2.928 1.00 0.82 C ATOM 872 CD1 ILE A 57 -7.382 12.316 2.092 1.00 0.95 C ATOM 0 H ILE A 57 -7.523 8.170 4.215 1.00 0.75 H new ATOM 0 HA ILE A 57 -9.062 10.452 5.357 1.00 0.77 H new ATOM 0 HB ILE A 57 -8.508 9.863 2.462 1.00 0.77 H new ATOM 0 HG12 ILE A 57 -7.725 12.209 4.218 1.00 0.81 H new ATOM 0 HG13 ILE A 57 -6.642 10.973 3.608 1.00 0.81 H new ATOM 0 HG21 ILE A 57 -9.903 11.835 2.012 1.00 0.82 H new ATOM 0 HG22 ILE A 57 -10.827 10.522 2.780 1.00 0.82 H new ATOM 0 HG23 ILE A 57 -10.317 11.931 3.740 1.00 0.82 H new ATOM 0 HD11 ILE A 57 -6.541 13.002 2.196 1.00 0.95 H new ATOM 0 HD12 ILE A 57 -7.190 11.629 1.268 1.00 0.95 H new ATOM 0 HD13 ILE A 57 -8.290 12.884 1.887 1.00 0.95 H new ATOM 884 N PRO A 58 -11.117 9.141 5.345 1.00 0.82 N ATOM 885 CA PRO A 58 -12.297 8.302 5.473 1.00 0.85 C ATOM 886 C PRO A 58 -13.178 8.400 4.225 1.00 0.83 C ATOM 887 O PRO A 58 -13.542 9.497 3.804 1.00 0.86 O ATOM 888 CB PRO A 58 -12.994 8.791 6.731 1.00 0.98 C ATOM 889 CG PRO A 58 -12.436 10.180 7.004 1.00 1.02 C ATOM 890 CD PRO A 58 -11.195 10.359 6.146 1.00 0.93 C ATOM 0 HA PRO A 58 -12.052 7.243 5.556 1.00 0.85 H new ATOM 0 HB2 PRO A 58 -14.074 8.825 6.591 1.00 0.98 H new ATOM 0 HB3 PRO A 58 -12.802 8.121 7.569 1.00 0.98 H new ATOM 0 HG2 PRO A 58 -13.178 10.943 6.767 1.00 1.02 H new ATOM 0 HG3 PRO A 58 -12.190 10.292 8.060 1.00 1.02 H new ATOM 0 HD2 PRO A 58 -11.275 11.244 5.514 1.00 0.93 H new ATOM 0 HD3 PRO A 58 -10.304 10.486 6.761 1.00 0.93 H new ATOM 898 N GLY A 59 -13.494 7.240 3.670 1.00 0.84 N ATOM 899 CA GLY A 59 -14.353 7.180 2.500 1.00 0.84 C ATOM 900 C GLY A 59 -13.582 7.562 1.234 1.00 0.79 C ATOM 901 O GLY A 59 -14.081 8.321 0.405 1.00 0.85 O ATOM 0 H GLY A 59 -13.171 6.334 4.009 1.00 0.84 H new ATOM 0 HA2 GLY A 59 -14.759 6.174 2.393 1.00 0.84 H new ATOM 0 HA3 GLY A 59 -15.200 7.853 2.631 1.00 0.84 H new ATOM 905 N PHE A 60 -12.380 7.016 1.126 1.00 0.74 N ATOM 906 CA PHE A 60 -11.593 7.175 -0.086 1.00 0.73 C ATOM 907 C PHE A 60 -10.586 6.032 -0.240 1.00 0.74 C ATOM 908 O PHE A 60 -10.702 5.220 -1.155 1.00 0.81 O ATOM 909 CB PHE A 60 -10.831 8.495 0.048 1.00 0.70 C ATOM 910 CG PHE A 60 -9.848 8.763 -1.094 1.00 0.66 C ATOM 911 CD1 PHE A 60 -10.077 8.238 -2.328 1.00 1.98 C ATOM 912 CD2 PHE A 60 -8.743 9.527 -0.875 1.00 1.82 C ATOM 913 CE1 PHE A 60 -9.165 8.487 -3.387 1.00 1.93 C ATOM 914 CE2 PHE A 60 -7.831 9.776 -1.934 1.00 1.88 C ATOM 915 CZ PHE A 60 -8.061 9.250 -3.168 1.00 0.69 C ATOM 0 H PHE A 60 -11.932 6.463 1.857 1.00 0.74 H new ATOM 0 HA PHE A 60 -12.246 7.168 -0.959 1.00 0.73 H new ATOM 0 HB2 PHE A 60 -11.549 9.314 0.096 1.00 0.70 H new ATOM 0 HB3 PHE A 60 -10.285 8.494 0.991 1.00 0.70 H new ATOM 0 HD1 PHE A 60 -10.953 7.631 -2.502 1.00 1.98 H new ATOM 0 HD2 PHE A 60 -8.560 9.944 0.104 1.00 1.82 H new ATOM 0 HE1 PHE A 60 -9.348 8.070 -4.366 1.00 1.93 H new ATOM 0 HE2 PHE A 60 -6.955 10.383 -1.760 1.00 1.88 H new ATOM 0 HZ PHE A 60 -7.367 9.439 -3.973 1.00 0.69 H new ATOM 925 N MET A 61 -9.624 6.006 0.670 1.00 0.71 N ATOM 926 CA MET A 61 -8.556 5.025 0.603 1.00 0.77 C ATOM 927 C MET A 61 -7.648 5.116 1.830 1.00 0.70 C ATOM 928 O MET A 61 -7.681 6.107 2.559 1.00 0.66 O ATOM 929 CB MET A 61 -7.729 5.255 -0.663 1.00 0.89 C ATOM 930 CG MET A 61 -7.162 6.676 -0.694 1.00 1.37 C ATOM 931 SD MET A 61 -5.582 6.720 0.136 1.00 1.38 S ATOM 932 CE MET A 61 -5.690 8.319 0.921 1.00 1.12 C ATOM 0 H MET A 61 -9.562 6.650 1.459 1.00 0.71 H new ATOM 0 HA MET A 61 -9.003 4.031 0.580 1.00 0.77 H new ATOM 0 HB2 MET A 61 -6.914 4.533 -0.706 1.00 0.89 H new ATOM 0 HB3 MET A 61 -8.350 5.088 -1.543 1.00 0.89 H new ATOM 0 HG2 MET A 61 -7.050 7.009 -1.726 1.00 1.37 H new ATOM 0 HG3 MET A 61 -7.856 7.364 -0.210 1.00 1.37 H new ATOM 0 HE1 MET A 61 -5.072 8.326 1.819 1.00 1.12 H new ATOM 0 HE2 MET A 61 -5.338 9.087 0.232 1.00 1.12 H new ATOM 0 HE3 MET A 61 -6.726 8.522 1.192 1.00 1.12 H new ATOM 942 N CYS A 62 -6.860 4.069 2.024 1.00 0.80 N ATOM 943 CA CYS A 62 -5.827 4.088 3.045 1.00 0.84 C ATOM 944 C CYS A 62 -4.524 3.588 2.420 1.00 1.05 C ATOM 945 O CYS A 62 -4.519 3.104 1.288 1.00 1.51 O ATOM 946 CB CYS A 62 -6.226 3.261 4.269 1.00 0.95 C ATOM 947 SG CYS A 62 -7.769 3.923 4.996 1.00 2.40 S ATOM 0 H CYS A 62 -6.916 3.201 1.491 1.00 0.80 H new ATOM 0 HA CYS A 62 -5.688 5.107 3.406 1.00 0.84 H new ATOM 0 HB2 CYS A 62 -6.367 2.219 3.984 1.00 0.95 H new ATOM 0 HB3 CYS A 62 -5.427 3.283 5.010 1.00 0.95 H new ATOM 0 HG CYS A 62 -8.077 5.043 4.413 1.00 2.40 H new ATOM 953 N GLN A 63 -3.448 3.724 3.183 1.00 1.39 N ATOM 954 CA GLN A 63 -2.150 3.245 2.739 1.00 1.77 C ATOM 955 C GLN A 63 -1.199 3.109 3.928 1.00 1.89 C ATOM 956 O GLN A 63 -1.530 3.514 5.042 1.00 2.33 O ATOM 957 CB GLN A 63 -1.562 4.167 1.668 1.00 2.15 C ATOM 958 CG GLN A 63 -1.070 5.478 2.285 1.00 3.04 C ATOM 959 CD GLN A 63 -2.244 6.330 2.772 1.00 4.62 C ATOM 960 OE1 GLN A 63 -2.921 6.995 2.008 1.00 5.30 O ATOM 961 NE2 GLN A 63 -2.445 6.272 4.086 1.00 5.93 N ATOM 0 H GLN A 63 -3.449 4.159 4.106 1.00 1.39 H new ATOM 0 HA GLN A 63 -2.282 2.260 2.291 1.00 1.77 H new ATOM 0 HB2 GLN A 63 -0.736 3.665 1.164 1.00 2.15 H new ATOM 0 HB3 GLN A 63 -2.316 4.378 0.910 1.00 2.15 H new ATOM 0 HG2 GLN A 63 -0.402 5.263 3.119 1.00 3.04 H new ATOM 0 HG3 GLN A 63 -0.492 6.036 1.549 1.00 3.04 H new ATOM 0 HE21 GLN A 63 -1.840 5.694 4.669 1.00 5.93 H new ATOM 0 HE22 GLN A 63 -3.204 6.805 4.510 1.00 5.93 H new ATOM 970 N GLY A 64 -0.035 2.539 3.652 1.00 1.77 N ATOM 971 CA GLY A 64 0.984 2.385 4.677 1.00 2.13 C ATOM 972 C GLY A 64 1.770 3.683 4.868 1.00 2.16 C ATOM 973 O GLY A 64 1.183 4.746 5.062 1.00 3.59 O ATOM 0 H GLY A 64 0.225 2.178 2.734 1.00 1.77 H new ATOM 0 HA2 GLY A 64 0.517 2.097 5.619 1.00 2.13 H new ATOM 0 HA3 GLY A 64 1.665 1.581 4.400 1.00 2.13 H new ATOM 977 N GLY A 65 3.088 3.554 4.808 1.00 2.04 N ATOM 978 CA GLY A 65 3.964 4.677 5.098 1.00 3.06 C ATOM 979 C GLY A 65 5.294 4.540 4.356 1.00 2.13 C ATOM 980 O GLY A 65 5.435 3.690 3.477 1.00 2.23 O ATOM 0 H GLY A 65 3.570 2.689 4.563 1.00 2.04 H new ATOM 0 HA2 GLY A 65 3.476 5.608 4.808 1.00 3.06 H new ATOM 0 HA3 GLY A 65 4.146 4.733 6.171 1.00 3.06 H new ATOM 984 N ASP A 66 6.238 5.389 4.735 1.00 2.65 N ATOM 985 CA ASP A 66 7.568 5.340 4.154 1.00 2.30 C ATOM 986 C ASP A 66 8.457 4.426 5.001 1.00 1.84 C ATOM 987 O ASP A 66 8.057 3.994 6.081 1.00 2.42 O ATOM 988 CB ASP A 66 8.210 6.728 4.125 1.00 3.33 C ATOM 989 CG ASP A 66 7.251 7.876 3.802 1.00 4.33 C ATOM 990 OD1 ASP A 66 6.444 7.696 2.865 1.00 4.78 O ATOM 991 OD2 ASP A 66 7.347 8.909 4.500 1.00 5.53 O ATOM 0 H ASP A 66 6.107 6.116 5.439 1.00 2.65 H new ATOM 0 HA ASP A 66 7.476 4.965 3.135 1.00 2.30 H new ATOM 0 HB2 ASP A 66 8.669 6.920 5.095 1.00 3.33 H new ATOM 0 HB3 ASP A 66 9.012 6.726 3.387 1.00 3.33 H new ATOM 1142 N SER A 77 12.915 -0.393 -4.301 1.00 1.78 N ATOM 1143 CA SER A 77 12.529 -1.720 -4.750 1.00 1.80 C ATOM 1144 C SER A 77 13.764 -2.615 -4.860 1.00 1.80 C ATOM 1145 O SER A 77 14.893 -2.132 -4.792 1.00 2.03 O ATOM 1146 CB SER A 77 11.798 -1.656 -6.092 1.00 1.88 C ATOM 1147 OG SER A 77 12.703 -1.642 -7.193 1.00 2.44 O ATOM 0 HA SER A 77 11.845 -2.145 -4.015 1.00 1.80 H new ATOM 0 HB2 SER A 77 11.130 -2.513 -6.182 1.00 1.88 H new ATOM 0 HB3 SER A 77 11.175 -0.762 -6.123 1.00 1.88 H new ATOM 0 HG SER A 77 13.195 -0.794 -7.201 1.00 2.44 H new ATOM 1153 N ILE A 78 13.508 -3.904 -5.027 1.00 1.74 N ATOM 1154 CA ILE A 78 14.587 -4.870 -5.161 1.00 1.83 C ATOM 1155 C ILE A 78 15.314 -4.635 -6.487 1.00 1.78 C ATOM 1156 O ILE A 78 16.472 -5.018 -6.640 1.00 1.94 O ATOM 1157 CB ILE A 78 14.053 -6.294 -4.997 1.00 1.99 C ATOM 1158 CG1 ILE A 78 12.967 -6.596 -6.031 1.00 2.16 C ATOM 1159 CG2 ILE A 78 13.566 -6.535 -3.566 1.00 2.04 C ATOM 1160 CD1 ILE A 78 13.042 -8.051 -6.498 1.00 2.57 C ATOM 0 H ILE A 78 12.570 -4.303 -5.073 1.00 1.74 H new ATOM 0 HA ILE A 78 15.321 -4.735 -4.366 1.00 1.83 H new ATOM 0 HB ILE A 78 14.872 -6.989 -5.180 1.00 1.99 H new ATOM 0 HG12 ILE A 78 11.985 -6.399 -5.600 1.00 2.16 H new ATOM 0 HG13 ILE A 78 13.079 -5.930 -6.886 1.00 2.16 H new ATOM 0 HG21 ILE A 78 13.191 -7.555 -3.476 1.00 2.04 H new ATOM 0 HG22 ILE A 78 14.393 -6.390 -2.871 1.00 2.04 H new ATOM 0 HG23 ILE A 78 12.766 -5.833 -3.331 1.00 2.04 H new ATOM 0 HD11 ILE A 78 12.259 -8.238 -7.233 1.00 2.57 H new ATOM 0 HD12 ILE A 78 14.016 -8.238 -6.950 1.00 2.57 H new ATOM 0 HD13 ILE A 78 12.905 -8.715 -5.644 1.00 2.57 H new ATOM 1172 N TYR A 79 14.602 -4.006 -7.412 1.00 1.69 N ATOM 1173 CA TYR A 79 15.147 -3.762 -8.737 1.00 1.73 C ATOM 1174 C TYR A 79 15.887 -2.424 -8.787 1.00 1.71 C ATOM 1175 O TYR A 79 16.549 -2.113 -9.776 1.00 1.85 O ATOM 1176 CB TYR A 79 13.946 -3.701 -9.682 1.00 1.68 C ATOM 1177 CG TYR A 79 13.196 -5.029 -9.821 1.00 1.75 C ATOM 1178 CD1 TYR A 79 13.780 -6.084 -10.491 1.00 2.67 C ATOM 1179 CD2 TYR A 79 11.936 -5.169 -9.275 1.00 2.66 C ATOM 1180 CE1 TYR A 79 13.074 -7.332 -10.622 1.00 2.74 C ATOM 1181 CE2 TYR A 79 11.230 -6.418 -9.405 1.00 2.98 C ATOM 1182 CZ TYR A 79 11.834 -7.437 -10.073 1.00 2.26 C ATOM 1183 OH TYR A 79 11.168 -8.617 -10.196 1.00 2.62 O ATOM 0 H TYR A 79 13.654 -3.659 -7.270 1.00 1.69 H new ATOM 0 HA TYR A 79 15.856 -4.544 -9.010 1.00 1.73 H new ATOM 0 HB2 TYR A 79 13.253 -2.940 -9.324 1.00 1.68 H new ATOM 0 HB3 TYR A 79 14.287 -3.383 -10.667 1.00 1.68 H new ATOM 0 HD1 TYR A 79 14.766 -5.974 -10.917 1.00 2.67 H new ATOM 0 HD2 TYR A 79 11.480 -4.343 -8.751 1.00 2.66 H new ATOM 0 HE1 TYR A 79 13.519 -8.166 -11.144 1.00 2.74 H new ATOM 0 HE2 TYR A 79 10.244 -6.542 -8.982 1.00 2.98 H new ATOM 0 HH TYR A 79 11.359 -9.183 -9.419 1.00 2.62 H new ATOM 1193 N GLY A 80 15.751 -1.668 -7.707 1.00 1.64 N ATOM 1194 CA GLY A 80 16.412 -0.377 -7.608 1.00 1.68 C ATOM 1195 C GLY A 80 15.492 0.663 -6.970 1.00 1.71 C ATOM 1196 O GLY A 80 14.365 0.351 -6.589 1.00 2.86 O ATOM 0 H GLY A 80 15.193 -1.925 -6.893 1.00 1.64 H new ATOM 0 HA2 GLY A 80 17.322 -0.475 -7.016 1.00 1.68 H new ATOM 0 HA3 GLY A 80 16.713 -0.041 -8.601 1.00 1.68 H new ATOM 1200 N GLU A 81 16.006 1.881 -6.871 1.00 1.47 N ATOM 1201 CA GLU A 81 15.224 2.982 -6.336 1.00 1.46 C ATOM 1202 C GLU A 81 13.905 3.118 -7.099 1.00 1.35 C ATOM 1203 O GLU A 81 12.880 3.471 -6.517 1.00 1.39 O ATOM 1204 CB GLU A 81 16.019 4.289 -6.376 1.00 1.61 C ATOM 1205 CG GLU A 81 15.272 5.408 -5.648 1.00 2.07 C ATOM 1206 CD GLU A 81 16.165 6.637 -5.467 1.00 2.36 C ATOM 1207 OE1 GLU A 81 17.101 6.541 -4.643 1.00 3.39 O ATOM 1208 OE2 GLU A 81 15.892 7.643 -6.156 1.00 2.57 O ATOM 0 H GLU A 81 16.955 2.129 -7.152 1.00 1.47 H new ATOM 0 HA GLU A 81 14.995 2.766 -5.292 1.00 1.46 H new ATOM 0 HB2 GLU A 81 16.995 4.139 -5.915 1.00 1.61 H new ATOM 0 HB3 GLU A 81 16.196 4.579 -7.412 1.00 1.61 H new ATOM 0 HG2 GLU A 81 14.381 5.682 -6.212 1.00 2.07 H new ATOM 0 HG3 GLU A 81 14.936 5.052 -4.674 1.00 2.07 H new ATOM 1215 N LYS A 82 13.973 2.831 -8.391 1.00 1.32 N ATOM 1216 CA LYS A 82 12.788 2.869 -9.230 1.00 1.29 C ATOM 1217 C LYS A 82 12.872 1.756 -10.276 1.00 1.30 C ATOM 1218 O LYS A 82 13.949 1.212 -10.523 1.00 1.45 O ATOM 1219 CB LYS A 82 12.601 4.263 -9.830 1.00 1.35 C ATOM 1220 CG LYS A 82 13.035 5.348 -8.841 1.00 1.74 C ATOM 1221 CD LYS A 82 12.993 6.733 -9.492 1.00 2.20 C ATOM 1222 CE LYS A 82 13.565 7.797 -8.555 1.00 3.17 C ATOM 1223 NZ LYS A 82 15.044 7.764 -8.575 1.00 4.02 N ATOM 0 H LYS A 82 14.831 2.571 -8.877 1.00 1.32 H new ATOM 0 HA LYS A 82 11.894 2.681 -8.635 1.00 1.29 H new ATOM 0 HB2 LYS A 82 13.182 4.349 -10.748 1.00 1.35 H new ATOM 0 HB3 LYS A 82 11.555 4.409 -10.100 1.00 1.35 H new ATOM 0 HG2 LYS A 82 12.381 5.332 -7.969 1.00 1.74 H new ATOM 0 HG3 LYS A 82 14.044 5.139 -8.487 1.00 1.74 H new ATOM 0 HD2 LYS A 82 13.561 6.719 -10.422 1.00 2.20 H new ATOM 0 HD3 LYS A 82 11.965 6.986 -9.751 1.00 2.20 H new ATOM 0 HE2 LYS A 82 13.213 8.783 -8.857 1.00 3.17 H new ATOM 0 HE3 LYS A 82 13.205 7.628 -7.540 1.00 3.17 H new ATOM 0 HZ1 LYS A 82 15.409 8.005 -7.632 1.00 4.02 H new ATOM 0 HZ2 LYS A 82 15.366 6.811 -8.838 1.00 4.02 H new ATOM 0 HZ3 LYS A 82 15.397 8.453 -9.270 1.00 4.02 H new ATOM 1237 N PHE A 83 11.725 1.451 -10.863 1.00 1.25 N ATOM 1238 CA PHE A 83 11.686 0.574 -12.021 1.00 1.42 C ATOM 1239 C PHE A 83 10.354 0.702 -12.763 1.00 1.17 C ATOM 1240 O PHE A 83 9.359 1.135 -12.186 1.00 1.01 O ATOM 1241 CB PHE A 83 11.832 -0.859 -11.502 1.00 1.83 C ATOM 1242 CG PHE A 83 10.542 -1.445 -10.925 1.00 1.42 C ATOM 1243 CD1 PHE A 83 10.186 -1.172 -9.641 1.00 1.81 C ATOM 1244 CD2 PHE A 83 9.750 -2.238 -11.696 1.00 2.17 C ATOM 1245 CE1 PHE A 83 8.989 -1.717 -9.104 1.00 2.02 C ATOM 1246 CE2 PHE A 83 8.553 -2.782 -11.160 1.00 2.06 C ATOM 1247 CZ PHE A 83 8.197 -2.510 -9.875 1.00 1.54 C ATOM 0 H PHE A 83 10.815 1.796 -10.558 1.00 1.25 H new ATOM 0 HA PHE A 83 12.484 0.839 -12.715 1.00 1.42 H new ATOM 0 HB2 PHE A 83 12.176 -1.496 -12.316 1.00 1.83 H new ATOM 0 HB3 PHE A 83 12.604 -0.879 -10.733 1.00 1.83 H new ATOM 0 HD1 PHE A 83 10.814 -0.541 -9.029 1.00 1.81 H new ATOM 0 HD2 PHE A 83 10.032 -2.454 -12.716 1.00 2.17 H new ATOM 0 HE1 PHE A 83 8.708 -1.502 -8.084 1.00 2.02 H new ATOM 0 HE2 PHE A 83 7.925 -3.412 -11.772 1.00 2.06 H new ATOM 0 HZ PHE A 83 7.286 -2.923 -9.468 1.00 1.54 H new ATOM 1257 N GLU A 84 10.380 0.318 -14.030 1.00 1.33 N ATOM 1258 CA GLU A 84 9.264 0.596 -14.919 1.00 1.22 C ATOM 1259 C GLU A 84 7.989 -0.066 -14.392 1.00 1.06 C ATOM 1260 O GLU A 84 8.049 -0.935 -13.524 1.00 1.15 O ATOM 1261 CB GLU A 84 9.572 0.136 -16.346 1.00 1.51 C ATOM 1262 CG GLU A 84 9.938 -1.350 -16.376 1.00 1.90 C ATOM 1263 CD GLU A 84 11.446 -1.540 -16.552 1.00 2.31 C ATOM 1264 OE1 GLU A 84 12.178 -1.181 -15.604 1.00 3.35 O ATOM 1265 OE2 GLU A 84 11.833 -2.039 -17.631 1.00 2.84 O ATOM 0 H GLU A 84 11.156 -0.183 -14.463 1.00 1.33 H new ATOM 0 HA GLU A 84 9.106 1.674 -14.947 1.00 1.22 H new ATOM 0 HB2 GLU A 84 8.706 0.314 -16.984 1.00 1.51 H new ATOM 0 HB3 GLU A 84 10.394 0.725 -16.752 1.00 1.51 H new ATOM 0 HG2 GLU A 84 9.613 -1.827 -15.451 1.00 1.90 H new ATOM 0 HG3 GLU A 84 9.408 -1.842 -17.192 1.00 1.90 H new ATOM 1272 N ASP A 85 6.865 0.371 -14.940 1.00 1.06 N ATOM 1273 CA ASP A 85 5.582 -0.205 -14.575 1.00 1.00 C ATOM 1274 C ASP A 85 5.222 -1.310 -15.570 1.00 1.09 C ATOM 1275 O ASP A 85 5.588 -1.239 -16.742 1.00 1.97 O ATOM 1276 CB ASP A 85 4.474 0.849 -14.618 1.00 1.14 C ATOM 1277 CG ASP A 85 4.595 1.960 -13.573 1.00 2.14 C ATOM 1278 OD1 ASP A 85 5.398 2.885 -13.819 1.00 3.29 O ATOM 1279 OD2 ASP A 85 3.883 1.858 -12.551 1.00 2.96 O ATOM 0 H ASP A 85 6.816 1.117 -15.634 1.00 1.06 H new ATOM 0 HA ASP A 85 5.665 -0.600 -13.563 1.00 1.00 H new ATOM 0 HB2 ASP A 85 4.464 1.303 -15.609 1.00 1.14 H new ATOM 0 HB3 ASP A 85 3.514 0.350 -14.486 1.00 1.14 H new ATOM 1284 N GLU A 86 4.510 -2.307 -15.065 1.00 0.80 N ATOM 1285 CA GLU A 86 4.202 -3.484 -15.860 1.00 0.81 C ATOM 1286 C GLU A 86 3.157 -3.147 -16.926 1.00 0.82 C ATOM 1287 O GLU A 86 3.483 -3.040 -18.107 1.00 1.02 O ATOM 1288 CB GLU A 86 3.727 -4.636 -14.971 1.00 0.82 C ATOM 1289 CG GLU A 86 4.914 -5.403 -14.387 1.00 1.92 C ATOM 1290 CD GLU A 86 5.893 -4.453 -13.694 1.00 3.22 C ATOM 1291 OE1 GLU A 86 5.435 -3.733 -12.781 1.00 4.27 O ATOM 1292 OE2 GLU A 86 7.077 -4.468 -14.093 1.00 4.27 O ATOM 0 H GLU A 86 4.138 -2.324 -14.116 1.00 0.80 H new ATOM 0 HA GLU A 86 5.113 -3.808 -16.363 1.00 0.81 H new ATOM 0 HB2 GLU A 86 3.109 -4.245 -14.163 1.00 0.82 H new ATOM 0 HB3 GLU A 86 3.101 -5.314 -15.552 1.00 0.82 H new ATOM 0 HG2 GLU A 86 4.556 -6.146 -13.674 1.00 1.92 H new ATOM 0 HG3 GLU A 86 5.428 -5.945 -15.181 1.00 1.92 H new ATOM 1299 N ASN A 87 1.924 -2.989 -16.470 1.00 0.71 N ATOM 1300 CA ASN A 87 0.813 -2.763 -17.380 1.00 0.71 C ATOM 1301 C ASN A 87 -0.419 -2.338 -16.579 1.00 0.69 C ATOM 1302 O ASN A 87 -0.373 -2.273 -15.352 1.00 0.83 O ATOM 1303 CB ASN A 87 0.461 -4.041 -18.146 1.00 0.77 C ATOM 1304 CG ASN A 87 0.188 -5.198 -17.184 1.00 0.94 C ATOM 1305 OD1 ASN A 87 -0.795 -5.221 -16.462 1.00 2.22 O ATOM 1306 ND2 ASN A 87 1.110 -6.156 -17.215 1.00 1.12 N ATOM 0 H ASN A 87 1.669 -3.013 -15.483 1.00 0.71 H new ATOM 0 HA ASN A 87 1.108 -1.987 -18.087 1.00 0.71 H new ATOM 0 HB2 ASN A 87 -0.416 -3.866 -18.769 1.00 0.77 H new ATOM 0 HB3 ASN A 87 1.280 -4.305 -18.816 1.00 0.77 H new ATOM 0 HD21 ASN A 87 1.018 -6.972 -16.610 1.00 1.12 H new ATOM 0 HD22 ASN A 87 1.909 -6.074 -17.843 1.00 1.12 H new ATOM 1313 N PHE A 88 -1.491 -2.059 -17.306 1.00 0.65 N ATOM 1314 CA PHE A 88 -2.747 -1.690 -16.677 1.00 0.66 C ATOM 1315 C PHE A 88 -3.848 -2.697 -17.016 1.00 0.66 C ATOM 1316 O PHE A 88 -4.987 -2.313 -17.277 1.00 0.68 O ATOM 1317 CB PHE A 88 -3.140 -0.318 -17.230 1.00 0.72 C ATOM 1318 CG PHE A 88 -2.113 0.782 -16.951 1.00 0.73 C ATOM 1319 CD1 PHE A 88 -1.009 0.897 -17.737 1.00 2.09 C ATOM 1320 CD2 PHE A 88 -2.305 1.645 -15.918 1.00 1.83 C ATOM 1321 CE1 PHE A 88 -0.056 1.917 -17.478 1.00 2.08 C ATOM 1322 CE2 PHE A 88 -1.353 2.666 -15.659 1.00 1.90 C ATOM 1323 CZ PHE A 88 -0.248 2.781 -16.445 1.00 0.87 C ATOM 0 H PHE A 88 -1.515 -2.081 -18.325 1.00 0.65 H new ATOM 0 HA PHE A 88 -2.628 -1.673 -15.594 1.00 0.66 H new ATOM 0 HB2 PHE A 88 -3.286 -0.400 -18.307 1.00 0.72 H new ATOM 0 HB3 PHE A 88 -4.098 -0.025 -16.800 1.00 0.72 H new ATOM 0 HD1 PHE A 88 -0.857 0.212 -18.558 1.00 2.09 H new ATOM 0 HD2 PHE A 88 -3.182 1.554 -15.294 1.00 1.83 H new ATOM 0 HE1 PHE A 88 0.821 2.007 -18.101 1.00 2.08 H new ATOM 0 HE2 PHE A 88 -1.506 3.351 -14.838 1.00 1.90 H new ATOM 0 HZ PHE A 88 0.476 3.558 -16.249 1.00 0.87 H new ATOM 1333 N ILE A 89 -3.469 -3.967 -17.000 1.00 0.67 N ATOM 1334 CA ILE A 89 -4.416 -5.034 -17.274 1.00 0.71 C ATOM 1335 C ILE A 89 -5.534 -4.998 -16.229 1.00 0.68 C ATOM 1336 O ILE A 89 -6.709 -5.116 -16.568 1.00 0.79 O ATOM 1337 CB ILE A 89 -3.697 -6.381 -17.359 1.00 0.78 C ATOM 1338 CG1 ILE A 89 -2.842 -6.468 -18.624 1.00 0.85 C ATOM 1339 CG2 ILE A 89 -4.689 -7.540 -17.256 1.00 0.85 C ATOM 1340 CD1 ILE A 89 -1.875 -7.651 -18.554 1.00 0.85 C ATOM 0 H ILE A 89 -2.519 -4.281 -16.801 1.00 0.67 H new ATOM 0 HA ILE A 89 -4.884 -4.887 -18.248 1.00 0.71 H new ATOM 0 HB ILE A 89 -3.020 -6.461 -16.508 1.00 0.78 H new ATOM 0 HG12 ILE A 89 -3.487 -6.573 -19.496 1.00 0.85 H new ATOM 0 HG13 ILE A 89 -2.281 -5.542 -18.752 1.00 0.85 H new ATOM 0 HG21 ILE A 89 -4.151 -8.486 -17.319 1.00 0.85 H new ATOM 0 HG22 ILE A 89 -5.215 -7.485 -16.303 1.00 0.85 H new ATOM 0 HG23 ILE A 89 -5.409 -7.477 -18.072 1.00 0.85 H new ATOM 0 HD11 ILE A 89 -1.280 -7.689 -19.466 1.00 0.85 H new ATOM 0 HD12 ILE A 89 -1.215 -7.531 -17.695 1.00 0.85 H new ATOM 0 HD13 ILE A 89 -2.440 -8.577 -18.451 1.00 0.85 H new ATOM 1352 N LEU A 90 -5.126 -4.834 -14.978 1.00 0.61 N ATOM 1353 CA LEU A 90 -6.079 -4.758 -13.885 1.00 0.59 C ATOM 1354 C LEU A 90 -6.651 -3.341 -13.811 1.00 0.69 C ATOM 1355 O LEU A 90 -6.114 -2.418 -14.423 1.00 0.88 O ATOM 1356 CB LEU A 90 -5.436 -5.231 -12.580 1.00 0.56 C ATOM 1357 CG LEU A 90 -5.131 -6.727 -12.486 1.00 0.75 C ATOM 1358 CD1 LEU A 90 -3.733 -7.036 -13.025 1.00 1.49 C ATOM 1359 CD2 LEU A 90 -5.318 -7.235 -11.055 1.00 2.23 C ATOM 0 H LEU A 90 -4.149 -4.752 -14.698 1.00 0.61 H new ATOM 0 HA LEU A 90 -6.917 -5.432 -14.062 1.00 0.59 H new ATOM 0 HB2 LEU A 90 -4.506 -4.681 -12.436 1.00 0.56 H new ATOM 0 HB3 LEU A 90 -6.096 -4.962 -11.755 1.00 0.56 H new ATOM 0 HG LEU A 90 -5.844 -7.261 -13.114 1.00 0.75 H new ATOM 0 HD11 LEU A 90 -3.541 -8.106 -12.947 1.00 1.49 H new ATOM 0 HD12 LEU A 90 -3.670 -6.732 -14.070 1.00 1.49 H new ATOM 0 HD13 LEU A 90 -2.990 -6.491 -12.443 1.00 1.49 H new ATOM 0 HD21 LEU A 90 -5.095 -8.301 -11.015 1.00 2.23 H new ATOM 0 HD22 LEU A 90 -4.644 -6.698 -10.387 1.00 2.23 H new ATOM 0 HD23 LEU A 90 -6.348 -7.068 -10.741 1.00 2.23 H new ATOM 1371 N LYS A 91 -7.732 -3.213 -13.056 1.00 0.68 N ATOM 1372 CA LYS A 91 -8.420 -1.936 -12.945 1.00 0.79 C ATOM 1373 C LYS A 91 -8.937 -1.765 -11.514 1.00 0.60 C ATOM 1374 O LYS A 91 -8.741 -2.638 -10.671 1.00 0.45 O ATOM 1375 CB LYS A 91 -9.510 -1.819 -14.011 1.00 1.09 C ATOM 1376 CG LYS A 91 -10.558 -2.922 -13.847 1.00 1.76 C ATOM 1377 CD LYS A 91 -11.625 -2.830 -14.939 1.00 1.70 C ATOM 1378 CE LYS A 91 -12.672 -3.934 -14.776 1.00 2.89 C ATOM 1379 NZ LYS A 91 -12.116 -5.241 -15.190 1.00 4.82 N ATOM 0 H LYS A 91 -8.149 -3.971 -12.515 1.00 0.68 H new ATOM 0 HA LYS A 91 -7.731 -1.113 -13.137 1.00 0.79 H new ATOM 0 HB2 LYS A 91 -9.990 -0.843 -13.940 1.00 1.09 H new ATOM 0 HB3 LYS A 91 -9.062 -1.882 -15.003 1.00 1.09 H new ATOM 0 HG2 LYS A 91 -10.074 -3.898 -13.888 1.00 1.76 H new ATOM 0 HG3 LYS A 91 -11.028 -2.840 -12.867 1.00 1.76 H new ATOM 0 HD2 LYS A 91 -12.110 -1.855 -14.897 1.00 1.70 H new ATOM 0 HD3 LYS A 91 -11.155 -2.911 -15.919 1.00 1.70 H new ATOM 0 HE2 LYS A 91 -12.998 -3.984 -13.737 1.00 2.89 H new ATOM 0 HE3 LYS A 91 -13.552 -3.700 -15.375 1.00 2.89 H new ATOM 0 HZ1 LYS A 91 -12.867 -5.960 -15.170 1.00 4.82 H new ATOM 0 HZ2 LYS A 91 -11.734 -5.166 -16.154 1.00 4.82 H new ATOM 0 HZ3 LYS A 91 -11.355 -5.517 -14.537 1.00 4.82 H new ATOM 1393 N HIS A 92 -9.587 -0.633 -11.287 1.00 0.70 N ATOM 1394 CA HIS A 92 -10.151 -0.344 -9.979 1.00 0.59 C ATOM 1395 C HIS A 92 -11.636 -0.710 -9.968 1.00 0.62 C ATOM 1396 O HIS A 92 -12.477 0.082 -10.391 1.00 0.73 O ATOM 1397 CB HIS A 92 -9.896 1.112 -9.588 1.00 0.57 C ATOM 1398 CG HIS A 92 -8.433 1.475 -9.489 1.00 0.70 C ATOM 1399 ND1 HIS A 92 -7.541 1.281 -10.528 1.00 1.31 N ATOM 1400 CD2 HIS A 92 -7.718 2.022 -8.465 1.00 2.11 C ATOM 1401 CE1 HIS A 92 -6.345 1.695 -10.136 1.00 0.92 C ATOM 1402 NE2 HIS A 92 -6.456 2.154 -8.857 1.00 1.64 N ATOM 0 H HIS A 92 -9.736 0.095 -11.986 1.00 0.70 H new ATOM 0 HA HIS A 92 -9.657 -0.954 -9.223 1.00 0.59 H new ATOM 0 HB2 HIS A 92 -10.372 1.763 -10.321 1.00 0.57 H new ATOM 0 HB3 HIS A 92 -10.374 1.309 -8.628 1.00 0.57 H new ATOM 0 HD1 HIS A 92 -7.766 0.886 -11.441 1.00 1.31 H new ATOM 0 HD2 HIS A 92 -8.111 2.301 -7.499 1.00 2.11 H new ATOM 0 HE1 HIS A 92 -5.441 1.673 -10.726 1.00 0.92 H new ATOM 1410 N THR A 93 -11.914 -1.911 -9.482 1.00 0.59 N ATOM 1411 CA THR A 93 -13.279 -2.409 -9.453 1.00 0.65 C ATOM 1412 C THR A 93 -14.074 -1.722 -8.341 1.00 0.59 C ATOM 1413 O THR A 93 -15.234 -1.363 -8.534 1.00 0.72 O ATOM 1414 CB THR A 93 -13.223 -3.931 -9.309 1.00 0.73 C ATOM 1415 OG1 THR A 93 -12.292 -4.145 -8.251 1.00 0.67 O ATOM 1416 CG2 THR A 93 -12.577 -4.611 -10.518 1.00 0.88 C ATOM 0 H THR A 93 -11.217 -2.554 -9.105 1.00 0.59 H new ATOM 0 HA THR A 93 -13.806 -2.174 -10.378 1.00 0.65 H new ATOM 0 HB THR A 93 -14.232 -4.320 -9.171 1.00 0.73 H new ATOM 0 HG1 THR A 93 -12.196 -5.107 -8.089 1.00 0.67 H new ATOM 0 HG21 THR A 93 -12.563 -5.690 -10.364 1.00 0.88 H new ATOM 0 HG22 THR A 93 -13.151 -4.380 -11.415 1.00 0.88 H new ATOM 0 HG23 THR A 93 -11.556 -4.248 -10.637 1.00 0.88 H new ATOM 1424 N GLY A 94 -13.418 -1.558 -7.202 1.00 0.50 N ATOM 1425 CA GLY A 94 -14.052 -0.930 -6.056 1.00 0.51 C ATOM 1426 C GLY A 94 -13.173 -1.045 -4.810 1.00 0.47 C ATOM 1427 O GLY A 94 -11.952 -0.912 -4.892 1.00 0.43 O ATOM 0 H GLY A 94 -12.453 -1.850 -7.048 1.00 0.50 H new ATOM 0 HA2 GLY A 94 -14.245 0.121 -6.273 1.00 0.51 H new ATOM 0 HA3 GLY A 94 -15.018 -1.399 -5.868 1.00 0.51 H new ATOM 1431 N PRO A 95 -13.844 -1.299 -3.654 1.00 0.53 N ATOM 1432 CA PRO A 95 -13.139 -1.405 -2.388 1.00 0.52 C ATOM 1433 C PRO A 95 -12.390 -2.736 -2.286 1.00 0.52 C ATOM 1434 O PRO A 95 -12.784 -3.723 -2.905 1.00 0.64 O ATOM 1435 CB PRO A 95 -14.215 -1.246 -1.325 1.00 0.61 C ATOM 1436 CG PRO A 95 -15.535 -1.523 -2.025 1.00 0.68 C ATOM 1437 CD PRO A 95 -15.285 -1.493 -3.524 1.00 0.62 C ATOM 0 HA PRO A 95 -12.366 -0.645 -2.272 1.00 0.52 H new ATOM 0 HB2 PRO A 95 -14.056 -1.942 -0.501 1.00 0.61 H new ATOM 0 HB3 PRO A 95 -14.201 -0.242 -0.901 1.00 0.61 H new ATOM 0 HG2 PRO A 95 -15.930 -2.493 -1.724 1.00 0.68 H new ATOM 0 HG3 PRO A 95 -16.278 -0.776 -1.747 1.00 0.68 H new ATOM 0 HD2 PRO A 95 -15.604 -2.421 -3.998 1.00 0.62 H new ATOM 0 HD3 PRO A 95 -15.838 -0.685 -4.002 1.00 0.62 H new ATOM 1445 N GLY A 96 -11.323 -2.719 -1.501 1.00 0.50 N ATOM 1446 CA GLY A 96 -10.557 -3.928 -1.253 1.00 0.52 C ATOM 1447 C GLY A 96 -9.549 -4.179 -2.376 1.00 0.52 C ATOM 1448 O GLY A 96 -9.212 -5.325 -2.669 1.00 0.74 O ATOM 0 H GLY A 96 -10.971 -1.887 -1.028 1.00 0.50 H new ATOM 0 HA2 GLY A 96 -10.032 -3.842 -0.301 1.00 0.52 H new ATOM 0 HA3 GLY A 96 -11.232 -4.780 -1.169 1.00 0.52 H new ATOM 1452 N ILE A 97 -9.098 -3.087 -2.977 1.00 0.43 N ATOM 1453 CA ILE A 97 -8.184 -3.177 -4.104 1.00 0.42 C ATOM 1454 C ILE A 97 -6.855 -2.516 -3.731 1.00 0.43 C ATOM 1455 O ILE A 97 -6.837 -1.413 -3.187 1.00 0.50 O ATOM 1456 CB ILE A 97 -8.827 -2.594 -5.364 1.00 0.45 C ATOM 1457 CG1 ILE A 97 -9.954 -3.497 -5.871 1.00 0.78 C ATOM 1458 CG2 ILE A 97 -7.777 -2.326 -6.443 1.00 0.57 C ATOM 1459 CD1 ILE A 97 -9.394 -4.678 -6.665 1.00 0.69 C ATOM 0 H ILE A 97 -9.348 -2.136 -2.705 1.00 0.43 H new ATOM 0 HA ILE A 97 -7.969 -4.220 -4.337 1.00 0.42 H new ATOM 0 HB ILE A 97 -9.274 -1.634 -5.107 1.00 0.45 H new ATOM 0 HG12 ILE A 97 -10.537 -3.865 -5.027 1.00 0.78 H new ATOM 0 HG13 ILE A 97 -10.632 -2.920 -6.500 1.00 0.78 H new ATOM 0 HG21 ILE A 97 -8.261 -1.912 -7.327 1.00 0.57 H new ATOM 0 HG22 ILE A 97 -7.041 -1.615 -6.066 1.00 0.57 H new ATOM 0 HG23 ILE A 97 -7.279 -3.259 -6.706 1.00 0.57 H new ATOM 0 HD11 ILE A 97 -10.215 -5.304 -7.014 1.00 0.69 H new ATOM 0 HD12 ILE A 97 -8.832 -4.307 -7.522 1.00 0.69 H new ATOM 0 HD13 ILE A 97 -8.735 -5.266 -6.026 1.00 0.69 H new ATOM 1471 N LEU A 98 -5.775 -3.219 -4.037 1.00 0.48 N ATOM 1472 CA LEU A 98 -4.445 -2.717 -3.736 1.00 0.55 C ATOM 1473 C LEU A 98 -3.856 -2.065 -4.989 1.00 0.52 C ATOM 1474 O LEU A 98 -3.395 -2.756 -5.896 1.00 0.56 O ATOM 1475 CB LEU A 98 -3.571 -3.829 -3.153 1.00 0.65 C ATOM 1476 CG LEU A 98 -2.302 -3.376 -2.429 1.00 0.84 C ATOM 1477 CD1 LEU A 98 -1.948 -4.335 -1.292 1.00 1.01 C ATOM 1478 CD2 LEU A 98 -1.143 -3.199 -3.412 1.00 2.11 C ATOM 0 H LEU A 98 -5.794 -4.132 -4.490 1.00 0.48 H new ATOM 0 HA LEU A 98 -4.494 -1.946 -2.967 1.00 0.55 H new ATOM 0 HB2 LEU A 98 -4.175 -4.411 -2.456 1.00 0.65 H new ATOM 0 HB3 LEU A 98 -3.284 -4.500 -3.963 1.00 0.65 H new ATOM 0 HG LEU A 98 -2.494 -2.402 -1.980 1.00 0.84 H new ATOM 0 HD11 LEU A 98 -1.042 -3.990 -0.794 1.00 1.01 H new ATOM 0 HD12 LEU A 98 -2.768 -4.366 -0.574 1.00 1.01 H new ATOM 0 HD13 LEU A 98 -1.782 -5.333 -1.697 1.00 1.01 H new ATOM 0 HD21 LEU A 98 -0.253 -2.877 -2.871 1.00 2.11 H new ATOM 0 HD22 LEU A 98 -0.941 -4.147 -3.911 1.00 2.11 H new ATOM 0 HD23 LEU A 98 -1.408 -2.447 -4.155 1.00 2.11 H new ATOM 1490 N SER A 99 -3.890 -0.740 -4.998 1.00 0.66 N ATOM 1491 CA SER A 99 -3.490 0.010 -6.176 1.00 0.71 C ATOM 1492 C SER A 99 -2.105 0.624 -5.961 1.00 0.71 C ATOM 1493 O SER A 99 -1.546 0.533 -4.869 1.00 0.71 O ATOM 1494 CB SER A 99 -4.509 1.102 -6.507 1.00 0.76 C ATOM 1495 OG SER A 99 -4.000 2.038 -7.453 1.00 1.80 O ATOM 0 H SER A 99 -4.188 -0.167 -4.208 1.00 0.66 H new ATOM 0 HA SER A 99 -3.448 -0.678 -7.020 1.00 0.71 H new ATOM 0 HB2 SER A 99 -5.416 0.644 -6.902 1.00 0.76 H new ATOM 0 HB3 SER A 99 -4.789 1.626 -5.593 1.00 0.76 H new ATOM 0 HG SER A 99 -4.714 2.298 -8.072 1.00 1.80 H new ATOM 1501 N MET A 100 -1.592 1.234 -7.019 1.00 0.89 N ATOM 1502 CA MET A 100 -0.234 1.751 -7.000 1.00 0.92 C ATOM 1503 C MET A 100 -0.203 3.228 -7.398 1.00 0.94 C ATOM 1504 O MET A 100 -0.920 3.643 -8.306 1.00 1.18 O ATOM 1505 CB MET A 100 0.633 0.942 -7.967 1.00 1.08 C ATOM 1506 CG MET A 100 2.120 1.161 -7.683 1.00 1.92 C ATOM 1507 SD MET A 100 2.561 0.415 -6.123 1.00 2.20 S ATOM 1508 CE MET A 100 4.322 0.237 -6.351 1.00 1.31 C ATOM 0 H MET A 100 -2.092 1.382 -7.895 1.00 0.89 H new ATOM 0 HA MET A 100 0.155 1.660 -5.986 1.00 0.92 H new ATOM 0 HB2 MET A 100 0.394 -0.118 -7.876 1.00 1.08 H new ATOM 0 HB3 MET A 100 0.408 1.233 -8.993 1.00 1.08 H new ATOM 0 HG2 MET A 100 2.719 0.728 -8.484 1.00 1.92 H new ATOM 0 HG3 MET A 100 2.341 2.228 -7.660 1.00 1.92 H new ATOM 0 HE1 MET A 100 4.807 0.145 -5.379 1.00 1.31 H new ATOM 0 HE2 MET A 100 4.524 -0.655 -6.944 1.00 1.31 H new ATOM 0 HE3 MET A 100 4.712 1.113 -6.870 1.00 1.31 H new ATOM 1518 N ALA A 101 0.635 3.979 -6.699 1.00 0.88 N ATOM 1519 CA ALA A 101 0.655 5.423 -6.856 1.00 0.87 C ATOM 1520 C ALA A 101 1.748 5.808 -7.854 1.00 1.12 C ATOM 1521 O ALA A 101 1.530 5.770 -9.065 1.00 2.73 O ATOM 1522 CB ALA A 101 0.854 6.083 -5.490 1.00 0.82 C ATOM 0 H ALA A 101 1.305 3.614 -6.022 1.00 0.88 H new ATOM 0 HA ALA A 101 -0.295 5.779 -7.254 1.00 0.87 H new ATOM 0 HB1 ALA A 101 0.869 7.166 -5.608 1.00 0.82 H new ATOM 0 HB2 ALA A 101 0.036 5.802 -4.827 1.00 0.82 H new ATOM 0 HB3 ALA A 101 1.799 5.752 -5.060 1.00 0.82 H new ATOM 1528 N ASN A 102 2.901 6.170 -7.312 1.00 1.14 N ATOM 1529 CA ASN A 102 4.043 6.515 -8.140 1.00 1.24 C ATOM 1530 C ASN A 102 3.868 7.938 -8.675 1.00 1.11 C ATOM 1531 O ASN A 102 2.895 8.228 -9.369 1.00 1.22 O ATOM 1532 CB ASN A 102 4.161 5.569 -9.337 1.00 1.45 C ATOM 1533 CG ASN A 102 3.993 4.112 -8.904 1.00 2.94 C ATOM 1534 OD1 ASN A 102 4.182 3.754 -7.753 1.00 4.40 O ATOM 1535 ND2 ASN A 102 3.627 3.295 -9.887 1.00 3.21 N ATOM 0 H ASN A 102 3.069 6.232 -6.308 1.00 1.14 H new ATOM 0 HA ASN A 102 4.941 6.434 -7.528 1.00 1.24 H new ATOM 0 HB2 ASN A 102 3.404 5.821 -10.080 1.00 1.45 H new ATOM 0 HB3 ASN A 102 5.132 5.700 -9.814 1.00 1.45 H new ATOM 0 HD21 ASN A 102 3.487 2.302 -9.700 1.00 3.21 H new ATOM 0 HD22 ASN A 102 3.486 3.661 -10.828 1.00 3.21 H new ATOM 1542 N ALA A 103 4.827 8.787 -8.334 1.00 1.29 N ATOM 1543 CA ALA A 103 4.790 10.171 -8.771 1.00 1.21 C ATOM 1544 C ALA A 103 5.259 10.256 -10.224 1.00 1.22 C ATOM 1545 O ALA A 103 6.243 10.931 -10.525 1.00 1.52 O ATOM 1546 CB ALA A 103 5.644 11.026 -7.832 1.00 1.29 C ATOM 0 H ALA A 103 5.634 8.542 -7.760 1.00 1.29 H new ATOM 0 HA ALA A 103 3.772 10.559 -8.730 1.00 1.21 H new ATOM 0 HB1 ALA A 103 5.616 12.065 -8.160 1.00 1.29 H new ATOM 0 HB2 ALA A 103 5.252 10.955 -6.818 1.00 1.29 H new ATOM 0 HB3 ALA A 103 6.673 10.668 -7.849 1.00 1.29 H new ATOM 1552 N GLY A 104 4.534 9.562 -11.088 1.00 1.11 N ATOM 1553 CA GLY A 104 4.878 9.530 -12.499 1.00 1.16 C ATOM 1554 C GLY A 104 5.223 8.108 -12.947 1.00 1.19 C ATOM 1555 O GLY A 104 5.161 7.171 -12.153 1.00 1.24 O ATOM 0 H GLY A 104 3.709 9.017 -10.838 1.00 1.11 H new ATOM 0 HA2 GLY A 104 4.043 9.909 -13.089 1.00 1.16 H new ATOM 0 HA3 GLY A 104 5.725 10.190 -12.685 1.00 1.16 H new ATOM 1559 N PRO A 105 5.589 7.988 -14.252 1.00 1.24 N ATOM 1560 CA PRO A 105 5.956 6.699 -14.811 1.00 1.33 C ATOM 1561 C PRO A 105 7.352 6.277 -14.346 1.00 1.28 C ATOM 1562 O PRO A 105 8.277 7.088 -14.334 1.00 1.27 O ATOM 1563 CB PRO A 105 5.863 6.883 -16.318 1.00 1.48 C ATOM 1564 CG PRO A 105 5.900 8.383 -16.558 1.00 1.47 C ATOM 1565 CD PRO A 105 5.661 9.075 -15.225 1.00 1.31 C ATOM 0 HA PRO A 105 5.300 5.895 -14.479 1.00 1.33 H new ATOM 0 HB2 PRO A 105 6.691 6.386 -16.824 1.00 1.48 H new ATOM 0 HB3 PRO A 105 4.943 6.448 -16.709 1.00 1.48 H new ATOM 0 HG2 PRO A 105 6.863 8.679 -16.975 1.00 1.47 H new ATOM 0 HG3 PRO A 105 5.137 8.673 -17.281 1.00 1.47 H new ATOM 0 HD2 PRO A 105 6.469 9.767 -14.987 1.00 1.31 H new ATOM 0 HD3 PRO A 105 4.739 9.655 -15.240 1.00 1.31 H new ATOM 1573 N ASN A 106 7.459 5.010 -13.977 1.00 1.36 N ATOM 1574 CA ASN A 106 8.756 4.423 -13.685 1.00 1.38 C ATOM 1575 C ASN A 106 9.376 5.139 -12.483 1.00 1.34 C ATOM 1576 O ASN A 106 10.578 5.400 -12.464 1.00 1.41 O ATOM 1577 CB ASN A 106 9.710 4.577 -14.871 1.00 1.47 C ATOM 1578 CG ASN A 106 9.096 4.000 -16.147 1.00 2.14 C ATOM 1579 OD1 ASN A 106 7.907 3.742 -16.234 1.00 3.06 O ATOM 1580 ND2 ASN A 106 9.970 3.812 -17.132 1.00 2.77 N ATOM 0 H ASN A 106 6.669 4.373 -13.873 1.00 1.36 H new ATOM 0 HA ASN A 106 8.608 3.363 -13.477 1.00 1.38 H new ATOM 0 HB2 ASN A 106 9.943 5.631 -15.020 1.00 1.47 H new ATOM 0 HB3 ASN A 106 10.650 4.070 -14.654 1.00 1.47 H new ATOM 0 HD21 ASN A 106 9.658 3.431 -18.025 1.00 2.77 H new ATOM 0 HD22 ASN A 106 10.952 4.049 -16.994 1.00 2.77 H new ATOM 1587 N THR A 107 8.528 5.434 -11.509 1.00 1.34 N ATOM 1588 CA THR A 107 9.003 5.924 -10.226 1.00 1.40 C ATOM 1589 C THR A 107 8.607 4.960 -9.106 1.00 1.53 C ATOM 1590 O THR A 107 8.895 5.209 -7.937 1.00 2.21 O ATOM 1591 CB THR A 107 8.458 7.340 -10.030 1.00 1.52 C ATOM 1592 OG1 THR A 107 7.101 7.140 -9.644 1.00 2.96 O ATOM 1593 CG2 THR A 107 8.362 8.118 -11.344 1.00 1.41 C ATOM 0 H THR A 107 7.515 5.343 -11.582 1.00 1.34 H new ATOM 0 HA THR A 107 10.092 5.972 -10.200 1.00 1.40 H new ATOM 0 HB THR A 107 9.098 7.882 -9.334 1.00 1.52 H new ATOM 0 HG1 THR A 107 6.522 7.220 -10.431 1.00 2.96 H new ATOM 0 HG21 THR A 107 7.970 9.116 -11.148 1.00 1.41 H new ATOM 0 HG22 THR A 107 9.352 8.199 -11.792 1.00 1.41 H new ATOM 0 HG23 THR A 107 7.696 7.594 -12.029 1.00 1.41 H new ATOM 1601 N ASN A 108 7.952 3.880 -9.504 1.00 1.24 N ATOM 1602 CA ASN A 108 7.518 2.873 -8.550 1.00 1.49 C ATOM 1603 C ASN A 108 8.734 2.336 -7.792 1.00 1.56 C ATOM 1604 O ASN A 108 9.615 1.716 -8.385 1.00 1.78 O ATOM 1605 CB ASN A 108 6.844 1.697 -9.257 1.00 1.86 C ATOM 1606 CG ASN A 108 6.690 0.503 -8.312 1.00 3.30 C ATOM 1607 OD1 ASN A 108 7.014 0.563 -7.137 1.00 4.52 O ATOM 1608 ND2 ASN A 108 6.181 -0.581 -8.888 1.00 4.10 N ATOM 0 H ASN A 108 7.711 3.680 -10.475 1.00 1.24 H new ATOM 0 HA ASN A 108 6.806 3.340 -7.869 1.00 1.49 H new ATOM 0 HB2 ASN A 108 5.865 2.002 -9.625 1.00 1.86 H new ATOM 0 HB3 ASN A 108 7.434 1.404 -10.126 1.00 1.86 H new ATOM 0 HD21 ASN A 108 6.040 -1.431 -8.341 1.00 4.10 H new ATOM 0 HD22 ASN A 108 5.931 -0.563 -9.877 1.00 4.10 H new ATOM 1615 N GLY A 109 8.743 2.594 -6.492 1.00 1.67 N ATOM 1616 CA GLY A 109 9.779 2.054 -5.629 1.00 1.94 C ATOM 1617 C GLY A 109 9.172 1.203 -4.511 1.00 1.72 C ATOM 1618 O GLY A 109 9.444 0.007 -4.419 1.00 2.57 O ATOM 0 H GLY A 109 8.049 3.170 -6.016 1.00 1.67 H new ATOM 0 HA2 GLY A 109 10.469 1.449 -6.217 1.00 1.94 H new ATOM 0 HA3 GLY A 109 10.359 2.869 -5.196 1.00 1.94 H new ATOM 1622 N SER A 110 8.362 1.854 -3.690 1.00 1.48 N ATOM 1623 CA SER A 110 7.642 1.154 -2.640 1.00 1.49 C ATOM 1624 C SER A 110 6.557 2.062 -2.055 1.00 1.67 C ATOM 1625 O SER A 110 6.730 2.626 -0.976 1.00 3.21 O ATOM 1626 CB SER A 110 8.592 0.685 -1.536 1.00 1.85 C ATOM 1627 OG SER A 110 9.219 -0.552 -1.863 1.00 2.86 O ATOM 0 H SER A 110 8.188 2.858 -3.730 1.00 1.48 H new ATOM 0 HA SER A 110 7.174 0.272 -3.077 1.00 1.49 H new ATOM 0 HB2 SER A 110 9.355 1.445 -1.367 1.00 1.85 H new ATOM 0 HB3 SER A 110 8.039 0.576 -0.603 1.00 1.85 H new ATOM 0 HG SER A 110 9.567 -0.511 -2.778 1.00 2.86 H new ATOM 1633 N GLN A 111 5.463 2.175 -2.795 1.00 1.08 N ATOM 1634 CA GLN A 111 4.380 3.060 -2.399 1.00 1.33 C ATOM 1635 C GLN A 111 3.055 2.575 -2.990 1.00 1.32 C ATOM 1636 O GLN A 111 2.758 2.839 -4.154 1.00 1.88 O ATOM 1637 CB GLN A 111 4.672 4.503 -2.815 1.00 1.66 C ATOM 1638 CG GLN A 111 5.102 4.574 -4.281 1.00 3.18 C ATOM 1639 CD GLN A 111 6.614 4.768 -4.400 1.00 3.88 C ATOM 1640 OE1 GLN A 111 7.367 4.577 -3.459 1.00 4.06 O ATOM 1641 NE2 GLN A 111 7.017 5.158 -5.607 1.00 5.27 N ATOM 0 H GLN A 111 5.303 1.669 -3.666 1.00 1.08 H new ATOM 0 HA GLN A 111 4.299 3.040 -1.312 1.00 1.33 H new ATOM 0 HB2 GLN A 111 3.784 5.116 -2.663 1.00 1.66 H new ATOM 0 HB3 GLN A 111 5.457 4.916 -2.182 1.00 1.66 H new ATOM 0 HG2 GLN A 111 4.808 3.659 -4.795 1.00 3.18 H new ATOM 0 HG3 GLN A 111 4.586 5.397 -4.776 1.00 3.18 H new ATOM 0 HE21 GLN A 111 6.334 5.300 -6.351 1.00 5.27 H new ATOM 0 HE22 GLN A 111 8.009 5.315 -5.788 1.00 5.27 H new ATOM 1650 N PHE A 112 2.295 1.874 -2.162 1.00 0.95 N ATOM 1651 CA PHE A 112 1.029 1.314 -2.601 1.00 0.87 C ATOM 1652 C PHE A 112 -0.120 1.789 -1.708 1.00 0.81 C ATOM 1653 O PHE A 112 0.079 2.058 -0.525 1.00 1.14 O ATOM 1654 CB PHE A 112 1.149 -0.207 -2.488 1.00 1.12 C ATOM 1655 CG PHE A 112 2.397 -0.679 -1.741 1.00 1.89 C ATOM 1656 CD1 PHE A 112 2.378 -0.790 -0.386 1.00 2.18 C ATOM 1657 CD2 PHE A 112 3.529 -0.987 -2.431 1.00 3.32 C ATOM 1658 CE1 PHE A 112 3.536 -1.228 0.309 1.00 2.96 C ATOM 1659 CE2 PHE A 112 4.687 -1.425 -1.737 1.00 4.18 C ATOM 1660 CZ PHE A 112 4.666 -1.536 -0.382 1.00 3.72 C ATOM 0 H PHE A 112 2.532 1.681 -1.189 1.00 0.95 H new ATOM 0 HA PHE A 112 0.817 1.631 -3.622 1.00 0.87 H new ATOM 0 HB2 PHE A 112 0.266 -0.594 -1.980 1.00 1.12 H new ATOM 0 HB3 PHE A 112 1.154 -0.636 -3.490 1.00 1.12 H new ATOM 0 HD1 PHE A 112 1.481 -0.545 0.163 1.00 2.18 H new ATOM 0 HD2 PHE A 112 3.546 -0.898 -3.507 1.00 3.32 H new ATOM 0 HE1 PHE A 112 3.519 -1.316 1.385 1.00 2.96 H new ATOM 0 HE2 PHE A 112 5.585 -1.670 -2.285 1.00 4.18 H new ATOM 0 HZ PHE A 112 5.547 -1.869 0.146 1.00 3.72 H new ATOM 1670 N PHE A 113 -1.297 1.879 -2.311 1.00 0.78 N ATOM 1671 CA PHE A 113 -2.452 2.426 -1.619 1.00 0.82 C ATOM 1672 C PHE A 113 -3.664 1.504 -1.761 1.00 0.82 C ATOM 1673 O PHE A 113 -3.969 1.040 -2.859 1.00 1.48 O ATOM 1674 CB PHE A 113 -2.769 3.771 -2.275 1.00 1.07 C ATOM 1675 CG PHE A 113 -1.761 4.876 -1.951 1.00 1.94 C ATOM 1676 CD1 PHE A 113 -0.506 4.825 -2.472 1.00 3.62 C ATOM 1677 CD2 PHE A 113 -2.120 5.908 -1.142 1.00 2.84 C ATOM 1678 CE1 PHE A 113 0.430 5.850 -2.172 1.00 5.06 C ATOM 1679 CE2 PHE A 113 -1.183 6.933 -0.841 1.00 4.25 C ATOM 1680 CZ PHE A 113 0.071 6.882 -1.364 1.00 5.08 C ATOM 0 H PHE A 113 -1.475 1.582 -3.271 1.00 0.78 H new ATOM 0 HA PHE A 113 -2.234 2.532 -0.556 1.00 0.82 H new ATOM 0 HB2 PHE A 113 -2.809 3.636 -3.356 1.00 1.07 H new ATOM 0 HB3 PHE A 113 -3.760 4.094 -1.957 1.00 1.07 H new ATOM 0 HD1 PHE A 113 -0.221 4.005 -3.114 1.00 3.62 H new ATOM 0 HD2 PHE A 113 -3.117 5.949 -0.728 1.00 2.84 H new ATOM 0 HE1 PHE A 113 1.427 5.809 -2.586 1.00 5.06 H new ATOM 0 HE2 PHE A 113 -1.467 7.752 -0.197 1.00 4.25 H new ATOM 0 HZ PHE A 113 0.782 7.662 -1.137 1.00 5.08 H new ATOM 1690 N ILE A 114 -4.321 1.265 -0.636 1.00 0.70 N ATOM 1691 CA ILE A 114 -5.482 0.391 -0.618 1.00 0.63 C ATOM 1692 C ILE A 114 -6.752 1.234 -0.750 1.00 0.61 C ATOM 1693 O ILE A 114 -6.919 2.226 -0.040 1.00 0.95 O ATOM 1694 CB ILE A 114 -5.462 -0.502 0.625 1.00 0.73 C ATOM 1695 CG1 ILE A 114 -4.177 -1.331 0.683 1.00 0.90 C ATOM 1696 CG2 ILE A 114 -6.713 -1.378 0.690 1.00 0.80 C ATOM 1697 CD1 ILE A 114 -3.509 -1.211 2.054 1.00 1.07 C ATOM 0 H ILE A 114 -4.072 1.661 0.270 1.00 0.70 H new ATOM 0 HA ILE A 114 -5.460 -0.288 -1.470 1.00 0.63 H new ATOM 0 HB ILE A 114 -5.472 0.139 1.507 1.00 0.73 H new ATOM 0 HG12 ILE A 114 -4.405 -2.377 0.476 1.00 0.90 H new ATOM 0 HG13 ILE A 114 -3.488 -0.995 -0.092 1.00 0.90 H new ATOM 0 HG21 ILE A 114 -6.674 -2.003 1.582 1.00 0.80 H new ATOM 0 HG22 ILE A 114 -7.599 -0.745 0.729 1.00 0.80 H new ATOM 0 HG23 ILE A 114 -6.759 -2.012 -0.195 1.00 0.80 H new ATOM 0 HD11 ILE A 114 -2.598 -1.810 2.069 1.00 1.07 H new ATOM 0 HD12 ILE A 114 -3.261 -0.167 2.248 1.00 1.07 H new ATOM 0 HD13 ILE A 114 -4.192 -1.570 2.824 1.00 1.07 H new ATOM 1709 N CYS A 115 -7.614 0.810 -1.662 1.00 0.61 N ATOM 1710 CA CYS A 115 -8.822 1.561 -1.956 1.00 0.64 C ATOM 1711 C CYS A 115 -9.961 0.992 -1.106 1.00 0.67 C ATOM 1712 O CYS A 115 -10.102 -0.224 -0.985 1.00 0.92 O ATOM 1713 CB CYS A 115 -9.156 1.533 -3.449 1.00 0.74 C ATOM 1714 SG CYS A 115 -7.752 2.199 -4.416 1.00 1.36 S ATOM 0 H CYS A 115 -7.500 -0.044 -2.207 1.00 0.61 H new ATOM 0 HA CYS A 115 -8.671 2.611 -1.704 1.00 0.64 H new ATOM 0 HB2 CYS A 115 -9.373 0.512 -3.763 1.00 0.74 H new ATOM 0 HB3 CYS A 115 -10.053 2.122 -3.641 1.00 0.74 H new ATOM 0 HG CYS A 115 -8.184 3.109 -5.237 1.00 1.36 H new ATOM 1720 N THR A 116 -10.743 1.898 -0.539 1.00 0.59 N ATOM 1721 CA THR A 116 -11.904 1.503 0.239 1.00 0.63 C ATOM 1722 C THR A 116 -13.193 1.907 -0.480 1.00 0.67 C ATOM 1723 O THR A 116 -14.248 2.012 0.142 1.00 0.89 O ATOM 1724 CB THR A 116 -11.769 2.117 1.635 1.00 0.78 C ATOM 1725 OG1 THR A 116 -11.543 3.501 1.384 1.00 2.39 O ATOM 1726 CG2 THR A 116 -10.501 1.657 2.357 1.00 1.62 C ATOM 0 H THR A 116 -10.595 2.905 -0.603 1.00 0.59 H new ATOM 0 HA THR A 116 -11.956 0.420 0.347 1.00 0.63 H new ATOM 0 HB THR A 116 -12.642 1.855 2.233 1.00 0.78 H new ATOM 0 HG1 THR A 116 -12.159 4.037 1.926 1.00 2.39 H new ATOM 0 HG21 THR A 116 -10.454 2.122 3.342 1.00 1.62 H new ATOM 0 HG22 THR A 116 -10.518 0.573 2.468 1.00 1.62 H new ATOM 0 HG23 THR A 116 -9.626 1.948 1.776 1.00 1.62 H new ATOM 1734 N ALA A 117 -13.063 2.123 -1.781 1.00 0.58 N ATOM 1735 CA ALA A 117 -14.158 2.675 -2.561 1.00 0.57 C ATOM 1736 C ALA A 117 -13.767 2.690 -4.040 1.00 0.52 C ATOM 1737 O ALA A 117 -12.612 2.443 -4.384 1.00 0.49 O ATOM 1738 CB ALA A 117 -14.505 4.069 -2.035 1.00 0.67 C ATOM 0 H ALA A 117 -12.216 1.926 -2.314 1.00 0.58 H new ATOM 0 HA ALA A 117 -15.051 2.057 -2.463 1.00 0.57 H new ATOM 0 HB1 ALA A 117 -15.326 4.484 -2.619 1.00 0.67 H new ATOM 0 HB2 ALA A 117 -14.803 3.999 -0.989 1.00 0.67 H new ATOM 0 HB3 ALA A 117 -13.634 4.718 -2.122 1.00 0.67 H new ATOM 1744 N LYS A 118 -14.753 2.982 -4.876 1.00 0.65 N ATOM 1745 CA LYS A 118 -14.545 2.962 -6.314 1.00 0.74 C ATOM 1746 C LYS A 118 -13.857 4.260 -6.744 1.00 0.62 C ATOM 1747 O LYS A 118 -14.521 5.217 -7.139 1.00 1.11 O ATOM 1748 CB LYS A 118 -15.864 2.695 -7.042 1.00 1.09 C ATOM 1749 CG LYS A 118 -15.617 2.325 -8.506 1.00 1.43 C ATOM 1750 CD LYS A 118 -16.938 2.135 -9.255 1.00 1.60 C ATOM 1751 CE LYS A 118 -16.707 1.482 -10.618 1.00 2.49 C ATOM 1752 NZ LYS A 118 -16.639 0.009 -10.482 1.00 3.89 N ATOM 0 H LYS A 118 -15.698 3.234 -4.585 1.00 0.65 H new ATOM 0 HA LYS A 118 -13.882 2.142 -6.592 1.00 0.74 H new ATOM 0 HB2 LYS A 118 -16.401 1.887 -6.545 1.00 1.09 H new ATOM 0 HB3 LYS A 118 -16.498 3.580 -6.989 1.00 1.09 H new ATOM 0 HG2 LYS A 118 -15.031 3.107 -8.988 1.00 1.43 H new ATOM 0 HG3 LYS A 118 -15.030 1.408 -8.559 1.00 1.43 H new ATOM 0 HD2 LYS A 118 -17.611 1.517 -8.661 1.00 1.60 H new ATOM 0 HD3 LYS A 118 -17.426 3.100 -9.388 1.00 1.60 H new ATOM 0 HE2 LYS A 118 -17.513 1.753 -11.299 1.00 2.49 H new ATOM 0 HE3 LYS A 118 -15.781 1.856 -11.055 1.00 2.49 H new ATOM 0 HZ1 LYS A 118 -16.220 -0.400 -11.342 1.00 3.89 H new ATOM 0 HZ2 LYS A 118 -16.052 -0.237 -9.660 1.00 3.89 H new ATOM 0 HZ3 LYS A 118 -17.598 -0.372 -10.349 1.00 3.89 H new ATOM 1766 N THR A 119 -12.536 4.250 -6.651 1.00 0.70 N ATOM 1767 CA THR A 119 -11.745 5.379 -7.111 1.00 0.74 C ATOM 1768 C THR A 119 -11.296 5.161 -8.557 1.00 0.79 C ATOM 1769 O THR A 119 -10.193 4.674 -8.802 1.00 0.97 O ATOM 1770 CB THR A 119 -10.582 5.571 -6.135 1.00 0.96 C ATOM 1771 OG1 THR A 119 -9.885 4.330 -6.179 1.00 1.09 O ATOM 1772 CG2 THR A 119 -11.050 5.685 -4.683 1.00 0.95 C ATOM 0 H THR A 119 -11.993 3.478 -6.264 1.00 0.70 H new ATOM 0 HA THR A 119 -12.333 6.296 -7.121 1.00 0.74 H new ATOM 0 HB THR A 119 -10.023 6.466 -6.407 1.00 0.96 H new ATOM 0 HG1 THR A 119 -9.785 4.044 -7.111 1.00 1.09 H new ATOM 0 HG21 THR A 119 -10.186 5.820 -4.032 1.00 0.95 H new ATOM 0 HG22 THR A 119 -11.718 6.541 -4.582 1.00 0.95 H new ATOM 0 HG23 THR A 119 -11.580 4.776 -4.399 1.00 0.95 H new ATOM 1780 N GLU A 120 -12.172 5.533 -9.478 1.00 0.75 N ATOM 1781 CA GLU A 120 -11.976 5.195 -10.878 1.00 0.86 C ATOM 1782 C GLU A 120 -11.492 6.420 -11.657 1.00 0.74 C ATOM 1783 O GLU A 120 -11.524 6.430 -12.886 1.00 0.91 O ATOM 1784 CB GLU A 120 -13.258 4.627 -11.489 1.00 1.18 C ATOM 1785 CG GLU A 120 -14.390 5.655 -11.442 1.00 1.63 C ATOM 1786 CD GLU A 120 -15.608 5.168 -12.231 1.00 1.90 C ATOM 1787 OE1 GLU A 120 -16.289 4.255 -11.716 1.00 2.65 O ATOM 1788 OE2 GLU A 120 -15.829 5.719 -13.330 1.00 2.75 O ATOM 0 H GLU A 120 -13.020 6.065 -9.283 1.00 0.75 H new ATOM 0 HA GLU A 120 -11.209 4.423 -10.942 1.00 0.86 H new ATOM 0 HB2 GLU A 120 -13.073 4.332 -12.522 1.00 1.18 H new ATOM 0 HB3 GLU A 120 -13.555 3.728 -10.949 1.00 1.18 H new ATOM 0 HG2 GLU A 120 -14.674 5.841 -10.406 1.00 1.63 H new ATOM 0 HG3 GLU A 120 -14.042 6.603 -11.852 1.00 1.63 H new ATOM 1795 N TRP A 121 -11.056 7.422 -10.909 1.00 0.75 N ATOM 1796 CA TRP A 121 -10.432 8.589 -11.511 1.00 0.83 C ATOM 1797 C TRP A 121 -8.916 8.442 -11.366 1.00 0.87 C ATOM 1798 O TRP A 121 -8.162 9.324 -11.773 1.00 1.07 O ATOM 1799 CB TRP A 121 -10.969 9.879 -10.889 1.00 0.91 C ATOM 1800 CG TRP A 121 -10.445 10.156 -9.478 1.00 0.86 C ATOM 1801 CD1 TRP A 121 -9.306 10.768 -9.127 1.00 0.89 C ATOM 1802 CD2 TRP A 121 -11.090 9.803 -8.237 1.00 0.82 C ATOM 1803 NE1 TRP A 121 -9.171 10.836 -7.756 1.00 0.87 N ATOM 1804 CE2 TRP A 121 -10.291 10.231 -7.197 1.00 0.82 C ATOM 1805 CE3 TRP A 121 -12.310 9.145 -8.001 1.00 0.85 C ATOM 1806 CZ2 TRP A 121 -10.621 10.047 -5.849 1.00 0.82 C ATOM 1807 CZ3 TRP A 121 -12.627 8.968 -6.648 1.00 0.87 C ATOM 1808 CH2 TRP A 121 -11.833 9.393 -5.589 1.00 0.85 C ATOM 0 H TRP A 121 -11.122 7.451 -9.892 1.00 0.75 H new ATOM 0 HA TRP A 121 -10.676 8.653 -12.571 1.00 0.83 H new ATOM 0 HB2 TRP A 121 -10.707 10.718 -11.534 1.00 0.91 H new ATOM 0 HB3 TRP A 121 -12.057 9.829 -10.858 1.00 0.91 H new ATOM 0 HD1 TRP A 121 -8.584 11.159 -9.829 1.00 0.89 H new ATOM 0 HE1 TRP A 121 -8.393 11.253 -7.246 1.00 0.87 H new ATOM 0 HE3 TRP A 121 -12.952 8.803 -8.800 1.00 0.85 H new ATOM 0 HZ2 TRP A 121 -9.977 10.390 -5.053 1.00 0.82 H new ATOM 0 HZ3 TRP A 121 -13.553 8.466 -6.411 1.00 0.87 H new ATOM 0 HH2 TRP A 121 -12.149 9.220 -4.571 1.00 0.85 H new ATOM 1819 N LEU A 122 -8.515 7.320 -10.786 1.00 0.78 N ATOM 1820 CA LEU A 122 -7.102 7.006 -10.661 1.00 0.93 C ATOM 1821 C LEU A 122 -6.765 5.822 -11.570 1.00 1.08 C ATOM 1822 O LEU A 122 -5.598 5.469 -11.731 1.00 1.40 O ATOM 1823 CB LEU A 122 -6.729 6.781 -9.195 1.00 0.89 C ATOM 1824 CG LEU A 122 -7.128 7.894 -8.224 1.00 0.78 C ATOM 1825 CD1 LEU A 122 -7.057 7.409 -6.775 1.00 0.72 C ATOM 1826 CD2 LEU A 122 -6.281 9.148 -8.450 1.00 1.02 C ATOM 0 H LEU A 122 -9.144 6.617 -10.398 1.00 0.78 H new ATOM 0 HA LEU A 122 -6.495 7.848 -10.994 1.00 0.93 H new ATOM 0 HB2 LEU A 122 -7.191 5.852 -8.861 1.00 0.89 H new ATOM 0 HB3 LEU A 122 -5.650 6.641 -9.132 1.00 0.89 H new ATOM 0 HG LEU A 122 -8.165 8.165 -8.423 1.00 0.78 H new ATOM 0 HD11 LEU A 122 -7.345 8.219 -6.106 1.00 0.72 H new ATOM 0 HD12 LEU A 122 -7.736 6.567 -6.639 1.00 0.72 H new ATOM 0 HD13 LEU A 122 -6.039 7.094 -6.546 1.00 0.72 H new ATOM 0 HD21 LEU A 122 -6.585 9.924 -7.747 1.00 1.02 H new ATOM 0 HD22 LEU A 122 -5.229 8.909 -8.295 1.00 1.02 H new ATOM 0 HD23 LEU A 122 -6.425 9.506 -9.470 1.00 1.02 H new ATOM 1838 N ASP A 123 -7.810 5.239 -12.141 1.00 0.93 N ATOM 1839 CA ASP A 123 -7.701 3.913 -12.724 1.00 1.01 C ATOM 1840 C ASP A 123 -6.516 3.881 -13.690 1.00 1.26 C ATOM 1841 O ASP A 123 -5.569 3.121 -13.492 1.00 2.30 O ATOM 1842 CB ASP A 123 -8.963 3.552 -13.511 1.00 1.02 C ATOM 1843 CG ASP A 123 -9.010 2.115 -14.032 1.00 1.12 C ATOM 1844 OD1 ASP A 123 -8.881 1.200 -13.190 1.00 2.02 O ATOM 1845 OD2 ASP A 123 -9.174 1.962 -15.262 1.00 1.79 O ATOM 0 H ASP A 123 -8.736 5.661 -12.212 1.00 0.93 H new ATOM 0 HA ASP A 123 -7.565 3.198 -11.913 1.00 1.01 H new ATOM 0 HB2 ASP A 123 -9.831 3.720 -12.874 1.00 1.02 H new ATOM 0 HB3 ASP A 123 -9.052 4.233 -14.358 1.00 1.02 H new ATOM 1850 N GLY A 124 -6.606 4.715 -14.715 1.00 1.61 N ATOM 1851 CA GLY A 124 -5.660 4.654 -15.816 1.00 1.64 C ATOM 1852 C GLY A 124 -4.330 5.307 -15.434 1.00 1.59 C ATOM 1853 O GLY A 124 -3.355 5.218 -16.178 1.00 1.99 O ATOM 0 H GLY A 124 -7.320 5.437 -14.806 1.00 1.61 H new ATOM 0 HA2 GLY A 124 -5.491 3.615 -16.098 1.00 1.64 H new ATOM 0 HA3 GLY A 124 -6.079 5.157 -16.688 1.00 1.64 H new ATOM 1857 N LYS A 125 -4.334 5.948 -14.275 1.00 1.69 N ATOM 1858 CA LYS A 125 -3.165 6.682 -13.822 1.00 1.66 C ATOM 1859 C LYS A 125 -2.414 5.848 -12.783 1.00 1.57 C ATOM 1860 O LYS A 125 -1.308 6.204 -12.378 1.00 2.13 O ATOM 1861 CB LYS A 125 -3.567 8.072 -13.321 1.00 1.74 C ATOM 1862 CG LYS A 125 -4.077 8.942 -14.471 1.00 2.29 C ATOM 1863 CD LYS A 125 -2.920 9.653 -15.176 1.00 3.18 C ATOM 1864 CE LYS A 125 -2.560 10.957 -14.461 1.00 4.00 C ATOM 1865 NZ LYS A 125 -3.471 12.045 -14.877 1.00 5.44 N ATOM 0 H LYS A 125 -5.128 5.974 -13.636 1.00 1.69 H new ATOM 0 HA LYS A 125 -2.478 6.852 -14.651 1.00 1.66 H new ATOM 0 HB2 LYS A 125 -4.342 7.978 -12.560 1.00 1.74 H new ATOM 0 HB3 LYS A 125 -2.711 8.554 -12.848 1.00 1.74 H new ATOM 0 HG2 LYS A 125 -4.619 8.324 -15.187 1.00 2.29 H new ATOM 0 HG3 LYS A 125 -4.783 9.679 -14.088 1.00 2.29 H new ATOM 0 HD2 LYS A 125 -2.049 8.998 -15.205 1.00 3.18 H new ATOM 0 HD3 LYS A 125 -3.194 9.865 -16.210 1.00 3.18 H new ATOM 0 HE2 LYS A 125 -2.622 10.816 -13.382 1.00 4.00 H new ATOM 0 HE3 LYS A 125 -1.530 11.231 -14.688 1.00 4.00 H new ATOM 0 HZ1 LYS A 125 -3.212 12.922 -14.382 1.00 5.44 H new ATOM 0 HZ2 LYS A 125 -3.392 12.190 -15.904 1.00 5.44 H new ATOM 0 HZ3 LYS A 125 -4.450 11.788 -14.638 1.00 5.44 H new ATOM 1879 N HIS A 126 -3.044 4.753 -12.382 1.00 1.08 N ATOM 1880 CA HIS A 126 -2.496 3.919 -11.327 1.00 0.96 C ATOM 1881 C HIS A 126 -2.363 2.479 -11.828 1.00 1.12 C ATOM 1882 O HIS A 126 -2.852 2.146 -12.907 1.00 2.07 O ATOM 1883 CB HIS A 126 -3.339 4.026 -10.054 1.00 0.92 C ATOM 1884 CG HIS A 126 -3.060 5.265 -9.236 1.00 0.92 C ATOM 1885 ND1 HIS A 126 -2.194 6.260 -9.654 1.00 0.91 N ATOM 1886 CD2 HIS A 126 -3.542 5.658 -8.022 1.00 2.08 C ATOM 1887 CE1 HIS A 126 -2.162 7.205 -8.726 1.00 0.76 C ATOM 1888 NE2 HIS A 126 -2.998 6.830 -7.715 1.00 1.86 N ATOM 0 H HIS A 126 -3.929 4.425 -12.769 1.00 1.08 H new ATOM 0 HA HIS A 126 -1.499 4.271 -11.064 1.00 0.96 H new ATOM 0 HB2 HIS A 126 -4.394 4.013 -10.327 1.00 0.92 H new ATOM 0 HB3 HIS A 126 -3.159 3.147 -9.436 1.00 0.92 H new ATOM 0 HD1 HIS A 126 -1.669 6.265 -10.529 1.00 0.91 H new ATOM 0 HD2 HIS A 126 -4.246 5.109 -7.414 1.00 2.08 H new ATOM 0 HE1 HIS A 126 -1.577 8.112 -8.763 1.00 0.76 H new ATOM 1896 N VAL A 127 -1.697 1.665 -11.023 1.00 0.80 N ATOM 1897 CA VAL A 127 -1.498 0.268 -11.369 1.00 0.77 C ATOM 1898 C VAL A 127 -2.004 -0.614 -10.226 1.00 0.70 C ATOM 1899 O VAL A 127 -1.768 -0.316 -9.056 1.00 0.91 O ATOM 1900 CB VAL A 127 -0.027 0.019 -11.710 1.00 0.95 C ATOM 1901 CG1 VAL A 127 0.383 -1.413 -11.358 1.00 0.94 C ATOM 1902 CG2 VAL A 127 0.254 0.323 -13.182 1.00 1.08 C ATOM 0 H VAL A 127 -1.288 1.946 -10.132 1.00 0.80 H new ATOM 0 HA VAL A 127 -2.073 0.009 -12.258 1.00 0.77 H new ATOM 0 HB VAL A 127 0.576 0.698 -11.107 1.00 0.95 H new ATOM 0 HG11 VAL A 127 1.433 -1.563 -11.610 1.00 0.94 H new ATOM 0 HG12 VAL A 127 0.239 -1.581 -10.291 1.00 0.94 H new ATOM 0 HG13 VAL A 127 -0.230 -2.116 -11.922 1.00 0.94 H new ATOM 0 HG21 VAL A 127 1.306 0.138 -13.397 1.00 1.08 H new ATOM 0 HG22 VAL A 127 -0.363 -0.319 -13.810 1.00 1.08 H new ATOM 0 HG23 VAL A 127 0.020 1.367 -13.389 1.00 1.08 H new ATOM 1912 N VAL A 128 -2.689 -1.683 -10.605 1.00 0.58 N ATOM 1913 CA VAL A 128 -3.231 -2.609 -9.626 1.00 0.55 C ATOM 1914 C VAL A 128 -2.558 -3.973 -9.794 1.00 0.62 C ATOM 1915 O VAL A 128 -2.418 -4.467 -10.913 1.00 0.80 O ATOM 1916 CB VAL A 128 -4.755 -2.676 -9.755 1.00 0.52 C ATOM 1917 CG1 VAL A 128 -5.385 -3.282 -8.499 1.00 0.70 C ATOM 1918 CG2 VAL A 128 -5.340 -1.292 -10.050 1.00 0.60 C ATOM 0 H VAL A 128 -2.881 -1.928 -11.576 1.00 0.58 H new ATOM 0 HA VAL A 128 -3.018 -2.262 -8.615 1.00 0.55 H new ATOM 0 HB VAL A 128 -4.993 -3.327 -10.596 1.00 0.52 H new ATOM 0 HG11 VAL A 128 -6.468 -3.318 -8.616 1.00 0.70 H new ATOM 0 HG12 VAL A 128 -5.002 -4.292 -8.351 1.00 0.70 H new ATOM 0 HG13 VAL A 128 -5.134 -2.668 -7.634 1.00 0.70 H new ATOM 0 HG21 VAL A 128 -6.424 -1.366 -10.137 1.00 0.60 H new ATOM 0 HG22 VAL A 128 -5.087 -0.610 -9.239 1.00 0.60 H new ATOM 0 HG23 VAL A 128 -4.926 -0.914 -10.985 1.00 0.60 H new ATOM 1928 N PHE A 129 -2.159 -4.543 -8.667 1.00 0.62 N ATOM 1929 CA PHE A 129 -1.389 -5.775 -8.683 1.00 0.70 C ATOM 1930 C PHE A 129 -1.592 -6.565 -7.388 1.00 0.74 C ATOM 1931 O PHE A 129 -0.704 -7.301 -6.961 1.00 0.95 O ATOM 1932 CB PHE A 129 0.085 -5.381 -8.800 1.00 0.86 C ATOM 1933 CG PHE A 129 0.628 -4.632 -7.581 1.00 1.46 C ATOM 1934 CD1 PHE A 129 0.284 -3.333 -7.373 1.00 2.72 C ATOM 1935 CD2 PHE A 129 1.453 -5.267 -6.706 1.00 2.43 C ATOM 1936 CE1 PHE A 129 0.788 -2.638 -6.241 1.00 3.44 C ATOM 1937 CE2 PHE A 129 1.957 -4.572 -5.574 1.00 3.22 C ATOM 1938 CZ PHE A 129 1.613 -3.273 -5.366 1.00 3.29 C ATOM 0 H PHE A 129 -2.354 -4.174 -7.736 1.00 0.62 H new ATOM 0 HA PHE A 129 -1.709 -6.403 -9.515 1.00 0.70 H new ATOM 0 HB2 PHE A 129 0.680 -6.281 -8.955 1.00 0.86 H new ATOM 0 HB3 PHE A 129 0.215 -4.757 -9.684 1.00 0.86 H new ATOM 0 HD1 PHE A 129 -0.372 -2.830 -8.068 1.00 2.72 H new ATOM 0 HD2 PHE A 129 1.725 -6.299 -6.872 1.00 2.43 H new ATOM 0 HE1 PHE A 129 0.516 -1.606 -6.075 1.00 3.44 H new ATOM 0 HE2 PHE A 129 2.613 -5.075 -4.879 1.00 3.22 H new ATOM 0 HZ PHE A 129 1.995 -2.745 -4.505 1.00 3.29 H new ATOM 1948 N GLY A 130 -2.765 -6.384 -6.800 1.00 0.63 N ATOM 1949 CA GLY A 130 -3.107 -7.094 -5.580 1.00 0.69 C ATOM 1950 C GLY A 130 -4.470 -6.647 -5.048 1.00 0.65 C ATOM 1951 O GLY A 130 -5.080 -5.726 -5.590 1.00 0.66 O ATOM 0 H GLY A 130 -3.490 -5.756 -7.146 1.00 0.63 H new ATOM 0 HA2 GLY A 130 -3.122 -8.167 -5.772 1.00 0.69 H new ATOM 0 HA3 GLY A 130 -2.342 -6.916 -4.825 1.00 0.69 H new ATOM 1955 N LYS A 131 -4.910 -7.320 -3.996 1.00 0.72 N ATOM 1956 CA LYS A 131 -6.187 -7.000 -3.382 1.00 0.79 C ATOM 1957 C LYS A 131 -6.154 -7.400 -1.905 1.00 0.85 C ATOM 1958 O LYS A 131 -5.215 -8.056 -1.458 1.00 1.19 O ATOM 1959 CB LYS A 131 -7.335 -7.639 -4.167 1.00 0.87 C ATOM 1960 CG LYS A 131 -7.295 -9.164 -4.051 1.00 1.81 C ATOM 1961 CD LYS A 131 -8.656 -9.775 -4.394 1.00 1.70 C ATOM 1962 CE LYS A 131 -8.784 -11.186 -3.815 1.00 2.74 C ATOM 1963 NZ LYS A 131 -9.177 -11.126 -2.389 1.00 3.32 N ATOM 0 H LYS A 131 -4.404 -8.087 -3.552 1.00 0.72 H new ATOM 0 HA LYS A 131 -6.367 -5.926 -3.417 1.00 0.79 H new ATOM 0 HB2 LYS A 131 -8.288 -7.267 -3.792 1.00 0.87 H new ATOM 0 HB3 LYS A 131 -7.270 -7.348 -5.216 1.00 0.87 H new ATOM 0 HG2 LYS A 131 -6.534 -9.564 -4.721 1.00 1.81 H new ATOM 0 HG3 LYS A 131 -7.009 -9.448 -3.038 1.00 1.81 H new ATOM 0 HD2 LYS A 131 -9.452 -9.143 -4.001 1.00 1.70 H new ATOM 0 HD3 LYS A 131 -8.781 -9.809 -5.476 1.00 1.70 H new ATOM 0 HE2 LYS A 131 -9.525 -11.751 -4.379 1.00 2.74 H new ATOM 0 HE3 LYS A 131 -7.836 -11.714 -3.915 1.00 2.74 H new ATOM 0 HZ1 LYS A 131 -8.654 -11.849 -1.854 1.00 3.32 H new ATOM 0 HZ2 LYS A 131 -8.955 -10.185 -2.007 1.00 3.32 H new ATOM 0 HZ3 LYS A 131 -10.198 -11.303 -2.303 1.00 3.32 H new ATOM 1977 N VAL A 132 -7.191 -6.988 -1.190 1.00 0.60 N ATOM 1978 CA VAL A 132 -7.333 -7.364 0.206 1.00 0.59 C ATOM 1979 C VAL A 132 -7.877 -8.791 0.293 1.00 0.89 C ATOM 1980 O VAL A 132 -8.702 -9.195 -0.526 1.00 1.31 O ATOM 1981 CB VAL A 132 -8.209 -6.344 0.936 1.00 0.50 C ATOM 1982 CG1 VAL A 132 -8.510 -6.802 2.365 1.00 0.63 C ATOM 1983 CG2 VAL A 132 -7.560 -4.959 0.929 1.00 0.74 C ATOM 0 H VAL A 132 -7.940 -6.398 -1.551 1.00 0.60 H new ATOM 0 HA VAL A 132 -6.364 -7.355 0.704 1.00 0.59 H new ATOM 0 HB VAL A 132 -9.156 -6.272 0.401 1.00 0.50 H new ATOM 0 HG11 VAL A 132 -9.134 -6.059 2.861 1.00 0.63 H new ATOM 0 HG12 VAL A 132 -9.035 -7.757 2.338 1.00 0.63 H new ATOM 0 HG13 VAL A 132 -7.576 -6.917 2.915 1.00 0.63 H new ATOM 0 HG21 VAL A 132 -8.203 -4.253 1.454 1.00 0.74 H new ATOM 0 HG22 VAL A 132 -6.592 -5.008 1.428 1.00 0.74 H new ATOM 0 HG23 VAL A 132 -7.422 -4.627 -0.100 1.00 0.74 H new ATOM 1993 N LYS A 133 -7.395 -9.515 1.293 1.00 1.05 N ATOM 1994 CA LYS A 133 -7.800 -10.898 1.478 1.00 1.34 C ATOM 1995 C LYS A 133 -9.065 -10.944 2.338 1.00 0.91 C ATOM 1996 O LYS A 133 -10.162 -11.152 1.824 1.00 1.73 O ATOM 1997 CB LYS A 133 -6.643 -11.723 2.042 1.00 1.99 C ATOM 1998 CG LYS A 133 -6.926 -13.222 1.918 1.00 2.03 C ATOM 1999 CD LYS A 133 -6.163 -14.014 2.981 1.00 3.08 C ATOM 2000 CE LYS A 133 -6.931 -14.039 4.304 1.00 4.01 C ATOM 2001 NZ LYS A 133 -6.197 -14.833 5.315 1.00 5.59 N ATOM 0 H LYS A 133 -6.728 -9.170 1.983 1.00 1.05 H new ATOM 0 HA LYS A 133 -8.049 -11.354 0.520 1.00 1.34 H new ATOM 0 HB2 LYS A 133 -5.724 -11.478 1.510 1.00 1.99 H new ATOM 0 HB3 LYS A 133 -6.484 -11.465 3.089 1.00 1.99 H new ATOM 0 HG2 LYS A 133 -7.996 -13.404 2.022 1.00 2.03 H new ATOM 0 HG3 LYS A 133 -6.639 -13.569 0.925 1.00 2.03 H new ATOM 0 HD2 LYS A 133 -6.000 -15.034 2.632 1.00 3.08 H new ATOM 0 HD3 LYS A 133 -5.180 -13.569 3.135 1.00 3.08 H new ATOM 0 HE2 LYS A 133 -7.075 -13.021 4.667 1.00 4.01 H new ATOM 0 HE3 LYS A 133 -7.922 -14.465 4.148 1.00 4.01 H new ATOM 0 HZ1 LYS A 133 -6.732 -14.840 6.207 1.00 5.59 H new ATOM 0 HZ2 LYS A 133 -6.081 -15.808 4.973 1.00 5.59 H new ATOM 0 HZ3 LYS A 133 -5.261 -14.410 5.476 1.00 5.59 H new ATOM 2015 N GLU A 134 -8.868 -10.747 3.634 1.00 1.04 N ATOM 2016 CA GLU A 134 -9.969 -10.830 4.578 1.00 0.85 C ATOM 2017 C GLU A 134 -9.732 -9.880 5.754 1.00 1.04 C ATOM 2018 O GLU A 134 -9.733 -10.302 6.909 1.00 2.57 O ATOM 2019 CB GLU A 134 -10.166 -12.266 5.065 1.00 1.06 C ATOM 2020 CG GLU A 134 -10.698 -13.158 3.942 1.00 2.20 C ATOM 2021 CD GLU A 134 -11.026 -14.559 4.463 1.00 2.38 C ATOM 2022 OE1 GLU A 134 -10.071 -15.242 4.894 1.00 2.81 O ATOM 2023 OE2 GLU A 134 -12.223 -14.915 4.418 1.00 2.97 O ATOM 0 H GLU A 134 -7.963 -10.530 4.052 1.00 1.04 H new ATOM 0 HA GLU A 134 -10.883 -10.525 4.068 1.00 0.85 H new ATOM 0 HB2 GLU A 134 -9.219 -12.663 5.431 1.00 1.06 H new ATOM 0 HB3 GLU A 134 -10.862 -12.277 5.904 1.00 1.06 H new ATOM 0 HG2 GLU A 134 -11.592 -12.709 3.509 1.00 2.20 H new ATOM 0 HG3 GLU A 134 -9.957 -13.227 3.145 1.00 2.20 H new ATOM 2030 N GLY A 135 -9.534 -8.613 5.419 1.00 0.92 N ATOM 2031 CA GLY A 135 -9.227 -7.611 6.427 1.00 0.79 C ATOM 2032 C GLY A 135 -9.875 -6.270 6.081 1.00 0.77 C ATOM 2033 O GLY A 135 -9.382 -5.217 6.484 1.00 0.92 O ATOM 0 H GLY A 135 -9.580 -8.257 4.464 1.00 0.92 H new ATOM 0 HA2 GLY A 135 -9.581 -7.949 7.401 1.00 0.79 H new ATOM 0 HA3 GLY A 135 -8.147 -7.488 6.505 1.00 0.79 H new ATOM 2037 N MET A 136 -10.968 -6.350 5.338 1.00 0.79 N ATOM 2038 CA MET A 136 -11.702 -5.156 4.954 1.00 1.00 C ATOM 2039 C MET A 136 -12.195 -4.395 6.186 1.00 0.89 C ATOM 2040 O MET A 136 -12.165 -3.165 6.213 1.00 0.89 O ATOM 2041 CB MET A 136 -12.897 -5.549 4.083 1.00 1.24 C ATOM 2042 CG MET A 136 -12.438 -6.022 2.703 1.00 1.36 C ATOM 2043 SD MET A 136 -11.501 -4.735 1.897 1.00 1.92 S ATOM 2044 CE MET A 136 -12.714 -3.425 1.891 1.00 1.27 C ATOM 0 H MET A 136 -11.364 -7.224 4.991 1.00 0.79 H new ATOM 0 HA MET A 136 -11.032 -4.505 4.393 1.00 1.00 H new ATOM 0 HB2 MET A 136 -13.464 -6.341 4.573 1.00 1.24 H new ATOM 0 HB3 MET A 136 -13.568 -4.697 3.975 1.00 1.24 H new ATOM 0 HG2 MET A 136 -11.828 -6.920 2.802 1.00 1.36 H new ATOM 0 HG3 MET A 136 -13.302 -6.289 2.095 1.00 1.36 H new ATOM 0 HE1 MET A 136 -12.488 -2.723 1.088 1.00 1.27 H new ATOM 0 HE2 MET A 136 -13.706 -3.848 1.734 1.00 1.27 H new ATOM 0 HE3 MET A 136 -12.690 -2.902 2.847 1.00 1.27 H new ATOM 2054 N ASN A 137 -12.638 -5.157 7.174 1.00 0.85 N ATOM 2055 CA ASN A 137 -13.152 -4.569 8.400 1.00 0.80 C ATOM 2056 C ASN A 137 -12.027 -3.810 9.107 1.00 0.74 C ATOM 2057 O ASN A 137 -12.259 -2.754 9.692 1.00 0.74 O ATOM 2058 CB ASN A 137 -13.666 -5.648 9.355 1.00 0.80 C ATOM 2059 CG ASN A 137 -13.859 -5.086 10.765 1.00 1.71 C ATOM 2060 OD1 ASN A 137 -13.274 -5.548 11.730 1.00 2.87 O ATOM 2061 ND2 ASN A 137 -14.711 -4.067 10.829 1.00 3.05 N ATOM 0 H ASN A 137 -12.652 -6.177 7.151 1.00 0.85 H new ATOM 0 HA ASN A 137 -13.972 -3.901 8.136 1.00 0.80 H new ATOM 0 HB2 ASN A 137 -14.611 -6.045 8.986 1.00 0.80 H new ATOM 0 HB3 ASN A 137 -12.961 -6.479 9.384 1.00 0.80 H new ATOM 0 HD21 ASN A 137 -14.909 -3.623 11.726 1.00 3.05 H new ATOM 0 HD22 ASN A 137 -15.167 -3.729 9.981 1.00 3.05 H new ATOM 2068 N ILE A 138 -10.833 -4.378 9.029 1.00 0.74 N ATOM 2069 CA ILE A 138 -9.684 -3.803 9.707 1.00 0.75 C ATOM 2070 C ILE A 138 -9.274 -2.510 9.000 1.00 0.76 C ATOM 2071 O ILE A 138 -8.933 -1.523 9.651 1.00 0.81 O ATOM 2072 CB ILE A 138 -8.555 -4.829 9.815 1.00 0.79 C ATOM 2073 CG1 ILE A 138 -9.050 -6.124 10.465 1.00 1.14 C ATOM 2074 CG2 ILE A 138 -7.349 -4.243 10.551 1.00 0.77 C ATOM 2075 CD1 ILE A 138 -9.758 -5.835 11.790 1.00 0.84 C ATOM 0 H ILE A 138 -10.636 -5.231 8.506 1.00 0.74 H new ATOM 0 HA ILE A 138 -9.941 -3.538 10.733 1.00 0.75 H new ATOM 0 HB ILE A 138 -8.225 -5.080 8.807 1.00 0.79 H new ATOM 0 HG12 ILE A 138 -9.733 -6.637 9.788 1.00 1.14 H new ATOM 0 HG13 ILE A 138 -8.208 -6.794 10.637 1.00 1.14 H new ATOM 0 HG21 ILE A 138 -6.561 -4.994 10.614 1.00 0.77 H new ATOM 0 HG22 ILE A 138 -6.979 -3.373 10.008 1.00 0.77 H new ATOM 0 HG23 ILE A 138 -7.646 -3.944 11.556 1.00 0.77 H new ATOM 0 HD11 ILE A 138 -10.100 -6.771 12.231 1.00 0.84 H new ATOM 0 HD12 ILE A 138 -9.065 -5.343 12.473 1.00 0.84 H new ATOM 0 HD13 ILE A 138 -10.614 -5.184 11.611 1.00 0.84 H new ATOM 2087 N VAL A 139 -9.321 -2.556 7.677 1.00 0.75 N ATOM 2088 CA VAL A 139 -8.960 -1.400 6.874 1.00 0.77 C ATOM 2089 C VAL A 139 -9.987 -0.288 7.099 1.00 0.81 C ATOM 2090 O VAL A 139 -9.621 0.867 7.303 1.00 0.82 O ATOM 2091 CB VAL A 139 -8.828 -1.805 5.404 1.00 0.78 C ATOM 2092 CG1 VAL A 139 -8.760 -0.571 4.501 1.00 0.88 C ATOM 2093 CG2 VAL A 139 -7.611 -2.708 5.192 1.00 0.75 C ATOM 0 H VAL A 139 -9.604 -3.376 7.141 1.00 0.75 H new ATOM 0 HA VAL A 139 -7.988 -1.011 7.178 1.00 0.77 H new ATOM 0 HB VAL A 139 -9.717 -2.372 5.130 1.00 0.78 H new ATOM 0 HG11 VAL A 139 -8.666 -0.885 3.462 1.00 0.88 H new ATOM 0 HG12 VAL A 139 -9.669 0.018 4.621 1.00 0.88 H new ATOM 0 HG13 VAL A 139 -7.896 0.034 4.776 1.00 0.88 H new ATOM 0 HG21 VAL A 139 -7.540 -2.982 4.139 1.00 0.75 H new ATOM 0 HG22 VAL A 139 -6.707 -2.177 5.491 1.00 0.75 H new ATOM 0 HG23 VAL A 139 -7.718 -3.610 5.795 1.00 0.75 H new ATOM 2103 N GLU A 140 -11.253 -0.677 7.051 1.00 0.88 N ATOM 2104 CA GLU A 140 -12.336 0.284 7.163 1.00 0.99 C ATOM 2105 C GLU A 140 -12.365 0.887 8.569 1.00 1.07 C ATOM 2106 O GLU A 140 -12.603 2.084 8.730 1.00 1.11 O ATOM 2107 CB GLU A 140 -13.680 -0.360 6.815 1.00 1.13 C ATOM 2108 CG GLU A 140 -14.598 0.637 6.106 1.00 1.34 C ATOM 2109 CD GLU A 140 -16.068 0.333 6.400 1.00 2.19 C ATOM 2110 OE1 GLU A 140 -16.574 0.890 7.400 1.00 2.71 O ATOM 2111 OE2 GLU A 140 -16.654 -0.448 5.620 1.00 3.57 O ATOM 0 H GLU A 140 -11.552 -1.645 6.936 1.00 0.88 H new ATOM 0 HA GLU A 140 -12.160 1.087 6.447 1.00 0.99 H new ATOM 0 HB2 GLU A 140 -13.517 -1.228 6.176 1.00 1.13 H new ATOM 0 HB3 GLU A 140 -14.161 -0.720 7.724 1.00 1.13 H new ATOM 0 HG2 GLU A 140 -14.360 1.650 6.431 1.00 1.34 H new ATOM 0 HG3 GLU A 140 -14.423 0.597 5.031 1.00 1.34 H new ATOM 2118 N ALA A 141 -12.121 0.033 9.551 1.00 1.15 N ATOM 2119 CA ALA A 141 -12.094 0.471 10.937 1.00 1.28 C ATOM 2120 C ALA A 141 -11.033 1.560 11.101 1.00 1.22 C ATOM 2121 O ALA A 141 -11.211 2.494 11.882 1.00 1.27 O ATOM 2122 CB ALA A 141 -11.842 -0.731 11.848 1.00 1.38 C ATOM 0 H ALA A 141 -11.940 -0.962 9.415 1.00 1.15 H new ATOM 0 HA ALA A 141 -13.054 0.900 11.223 1.00 1.28 H new ATOM 0 HB1 ALA A 141 -11.822 -0.402 12.887 1.00 1.38 H new ATOM 0 HB2 ALA A 141 -12.639 -1.462 11.714 1.00 1.38 H new ATOM 0 HB3 ALA A 141 -10.885 -1.187 11.593 1.00 1.38 H new ATOM 2128 N MET A 142 -9.950 1.406 10.351 1.00 1.19 N ATOM 2129 CA MET A 142 -8.831 2.327 10.453 1.00 1.17 C ATOM 2130 C MET A 142 -9.254 3.747 10.074 1.00 1.15 C ATOM 2131 O MET A 142 -8.654 4.720 10.528 1.00 1.15 O ATOM 2132 CB MET A 142 -7.704 1.865 9.528 1.00 1.30 C ATOM 2133 CG MET A 142 -6.342 2.334 10.046 1.00 1.23 C ATOM 2134 SD MET A 142 -5.035 1.452 9.210 1.00 1.21 S ATOM 2135 CE MET A 142 -5.332 1.976 7.531 1.00 1.71 C ATOM 0 H MET A 142 -9.825 0.657 9.670 1.00 1.19 H new ATOM 0 HA MET A 142 -8.484 2.335 11.486 1.00 1.17 H new ATOM 0 HB2 MET A 142 -7.714 0.778 9.452 1.00 1.30 H new ATOM 0 HB3 MET A 142 -7.869 2.256 8.524 1.00 1.30 H new ATOM 0 HG2 MET A 142 -6.231 3.406 9.883 1.00 1.23 H new ATOM 0 HG3 MET A 142 -6.275 2.167 11.121 1.00 1.23 H new ATOM 0 HE1 MET A 142 -4.463 1.741 6.917 1.00 1.71 H new ATOM 0 HE2 MET A 142 -6.206 1.457 7.137 1.00 1.71 H new ATOM 0 HE3 MET A 142 -5.509 3.051 7.511 1.00 1.71 H new ATOM 2145 N GLU A 143 -10.284 3.822 9.244 1.00 1.28 N ATOM 2146 CA GLU A 143 -10.754 5.104 8.746 1.00 1.41 C ATOM 2147 C GLU A 143 -11.393 5.911 9.879 1.00 1.42 C ATOM 2148 O GLU A 143 -11.503 7.132 9.790 1.00 1.61 O ATOM 2149 CB GLU A 143 -11.733 4.917 7.586 1.00 1.67 C ATOM 2150 CG GLU A 143 -11.023 4.355 6.354 1.00 1.38 C ATOM 2151 CD GLU A 143 -11.874 4.542 5.096 1.00 1.54 C ATOM 2152 OE1 GLU A 143 -13.075 4.845 5.264 1.00 2.74 O ATOM 2153 OE2 GLU A 143 -11.304 4.378 3.996 1.00 2.03 O ATOM 0 H GLU A 143 -10.807 3.015 8.903 1.00 1.28 H new ATOM 0 HA GLU A 143 -9.897 5.661 8.367 1.00 1.41 H new ATOM 0 HB2 GLU A 143 -12.535 4.243 7.887 1.00 1.67 H new ATOM 0 HB3 GLU A 143 -12.196 5.872 7.339 1.00 1.67 H new ATOM 0 HG2 GLU A 143 -10.062 4.854 6.225 1.00 1.38 H new ATOM 0 HG3 GLU A 143 -10.815 3.295 6.502 1.00 1.38 H new ATOM 2160 N ARG A 144 -11.797 5.194 10.917 1.00 1.34 N ATOM 2161 CA ARG A 144 -12.478 5.820 12.039 1.00 1.57 C ATOM 2162 C ARG A 144 -11.536 6.785 12.760 1.00 1.31 C ATOM 2163 O ARG A 144 -11.986 7.704 13.443 1.00 1.49 O ATOM 2164 CB ARG A 144 -12.982 4.771 13.032 1.00 1.89 C ATOM 2165 CG ARG A 144 -11.884 4.384 14.025 1.00 3.30 C ATOM 2166 CD ARG A 144 -12.266 3.122 14.800 1.00 4.48 C ATOM 2167 NE ARG A 144 -13.527 3.346 15.541 1.00 4.71 N ATOM 2168 CZ ARG A 144 -13.597 3.932 16.745 1.00 6.04 C ATOM 2169 NH1 ARG A 144 -12.496 4.455 17.301 1.00 7.16 N ATOM 2170 NH2 ARG A 144 -14.768 3.994 17.393 1.00 6.79 N ATOM 0 H ARG A 144 -11.666 4.186 11.005 1.00 1.34 H new ATOM 0 HA ARG A 144 -13.333 6.369 11.644 1.00 1.57 H new ATOM 0 HB2 ARG A 144 -13.845 5.161 13.572 1.00 1.89 H new ATOM 0 HB3 ARG A 144 -13.318 3.886 12.492 1.00 1.89 H new ATOM 0 HG2 ARG A 144 -10.948 4.218 13.491 1.00 3.30 H new ATOM 0 HG3 ARG A 144 -11.713 5.205 14.721 1.00 3.30 H new ATOM 0 HD2 ARG A 144 -12.382 2.284 14.112 1.00 4.48 H new ATOM 0 HD3 ARG A 144 -11.469 2.856 15.494 1.00 4.48 H new ATOM 0 HE ARG A 144 -14.397 3.035 15.109 1.00 4.71 H new ATOM 0 HH11 ARG A 144 -11.604 4.408 16.808 1.00 7.16 H new ATOM 0 HH12 ARG A 144 -12.550 4.901 18.217 1.00 7.16 H new ATOM 0 HH21 ARG A 144 -15.606 3.595 16.970 1.00 6.79 H new ATOM 0 HH22 ARG A 144 -14.821 4.440 18.309 1.00 6.79 H new ATOM 2184 N PHE A 145 -10.245 6.543 12.585 1.00 1.03 N ATOM 2185 CA PHE A 145 -9.235 7.389 13.198 1.00 0.96 C ATOM 2186 C PHE A 145 -8.919 8.595 12.313 1.00 1.05 C ATOM 2187 O PHE A 145 -8.485 9.635 12.806 1.00 1.45 O ATOM 2188 CB PHE A 145 -7.972 6.538 13.351 1.00 1.14 C ATOM 2189 CG PHE A 145 -8.163 5.290 14.216 1.00 1.50 C ATOM 2190 CD1 PHE A 145 -8.605 5.410 15.496 1.00 2.02 C ATOM 2191 CD2 PHE A 145 -7.892 4.060 13.702 1.00 2.74 C ATOM 2192 CE1 PHE A 145 -8.782 4.252 16.298 1.00 2.38 C ATOM 2193 CE2 PHE A 145 -8.069 2.901 14.504 1.00 3.37 C ATOM 2194 CZ PHE A 145 -8.511 3.022 15.785 1.00 2.75 C ATOM 0 H PHE A 145 -9.875 5.773 12.027 1.00 1.03 H new ATOM 0 HA PHE A 145 -9.594 7.761 14.158 1.00 0.96 H new ATOM 0 HB2 PHE A 145 -7.630 6.233 12.362 1.00 1.14 H new ATOM 0 HB3 PHE A 145 -7.183 7.152 13.786 1.00 1.14 H new ATOM 0 HD1 PHE A 145 -8.822 6.387 15.903 1.00 2.02 H new ATOM 0 HD2 PHE A 145 -7.542 3.965 12.685 1.00 2.74 H new ATOM 0 HE1 PHE A 145 -9.132 4.348 17.315 1.00 2.38 H new ATOM 0 HE2 PHE A 145 -7.853 1.924 14.097 1.00 3.37 H new ATOM 0 HZ PHE A 145 -8.647 2.141 16.395 1.00 2.75 H new ATOM 2204 N GLY A 146 -9.148 8.417 11.021 1.00 1.00 N ATOM 2205 CA GLY A 146 -8.971 9.503 10.072 1.00 1.33 C ATOM 2206 C GLY A 146 -9.980 10.624 10.327 1.00 1.53 C ATOM 2207 O GLY A 146 -10.924 10.450 11.096 1.00 2.05 O ATOM 0 H GLY A 146 -9.455 7.536 10.608 1.00 1.00 H new ATOM 0 HA2 GLY A 146 -7.958 9.897 10.149 1.00 1.33 H new ATOM 0 HA3 GLY A 146 -9.090 9.126 9.056 1.00 1.33 H new ATOM 2211 N SER A 147 -9.747 11.749 9.667 1.00 1.49 N ATOM 2212 CA SER A 147 -10.589 12.916 9.858 1.00 1.77 C ATOM 2213 C SER A 147 -10.554 13.797 8.607 1.00 1.98 C ATOM 2214 O SER A 147 -11.492 13.790 7.811 1.00 3.35 O ATOM 2215 CB SER A 147 -10.151 13.719 11.085 1.00 2.12 C ATOM 2216 OG SER A 147 -10.596 13.122 12.299 1.00 3.49 O ATOM 0 H SER A 147 -8.987 11.876 8.999 1.00 1.49 H new ATOM 0 HA SER A 147 -11.611 12.575 10.027 1.00 1.77 H new ATOM 0 HB2 SER A 147 -9.064 13.799 11.097 1.00 2.12 H new ATOM 0 HB3 SER A 147 -10.544 14.733 11.014 1.00 2.12 H new ATOM 0 HG SER A 147 -10.844 12.189 12.133 1.00 3.49 H new ATOM 2222 N ARG A 148 -9.462 14.537 8.474 1.00 1.64 N ATOM 2223 CA ARG A 148 -9.375 15.565 7.451 1.00 2.22 C ATOM 2224 C ARG A 148 -7.930 16.048 7.307 1.00 2.20 C ATOM 2225 O ARG A 148 -7.434 16.207 6.192 1.00 2.44 O ATOM 2226 CB ARG A 148 -10.272 16.756 7.790 1.00 2.94 C ATOM 2227 CG ARG A 148 -10.442 17.677 6.580 1.00 3.18 C ATOM 2228 CD ARG A 148 -11.460 18.782 6.870 1.00 3.96 C ATOM 2229 NE ARG A 148 -12.789 18.189 7.138 1.00 4.66 N ATOM 2230 CZ ARG A 148 -13.559 17.615 6.203 1.00 5.70 C ATOM 2231 NH1 ARG A 148 -13.217 17.700 4.911 1.00 6.13 N ATOM 2232 NH2 ARG A 148 -14.669 16.957 6.561 1.00 6.91 N ATOM 0 H ARG A 148 -8.631 14.445 9.058 1.00 1.64 H new ATOM 0 HA ARG A 148 -9.711 15.128 6.511 1.00 2.22 H new ATOM 0 HB2 ARG A 148 -11.248 16.399 8.119 1.00 2.94 H new ATOM 0 HB3 ARG A 148 -9.841 17.316 8.620 1.00 2.94 H new ATOM 0 HG2 ARG A 148 -9.482 18.122 6.319 1.00 3.18 H new ATOM 0 HG3 ARG A 148 -10.768 17.095 5.718 1.00 3.18 H new ATOM 0 HD2 ARG A 148 -11.136 19.370 7.728 1.00 3.96 H new ATOM 0 HD3 ARG A 148 -11.521 19.463 6.021 1.00 3.96 H new ATOM 0 HE ARG A 148 -13.141 18.219 8.095 1.00 4.66 H new ATOM 0 HH11 ARG A 148 -12.371 18.201 4.639 1.00 6.13 H new ATOM 0 HH12 ARG A 148 -13.802 17.264 4.199 1.00 6.13 H new ATOM 0 HH21 ARG A 148 -14.929 16.893 7.545 1.00 6.91 H new ATOM 0 HH22 ARG A 148 -15.255 16.520 5.849 1.00 6.91 H new ATOM 2246 N ASN A 149 -7.296 16.268 8.448 1.00 2.18 N ATOM 2247 CA ASN A 149 -5.924 16.746 8.463 1.00 2.47 C ATOM 2248 C ASN A 149 -5.010 15.677 7.862 1.00 2.18 C ATOM 2249 O ASN A 149 -3.857 15.953 7.536 1.00 2.63 O ATOM 2250 CB ASN A 149 -5.453 17.023 9.892 1.00 2.87 C ATOM 2251 CG ASN A 149 -5.235 15.718 10.661 1.00 2.66 C ATOM 2252 OD1 ASN A 149 -4.175 15.116 10.624 1.00 3.19 O ATOM 2253 ND2 ASN A 149 -6.296 15.317 11.355 1.00 3.13 N ATOM 0 H ASN A 149 -7.707 16.124 9.370 1.00 2.18 H new ATOM 0 HA ASN A 149 -5.882 17.669 7.885 1.00 2.47 H new ATOM 0 HB2 ASN A 149 -4.525 17.595 9.868 1.00 2.87 H new ATOM 0 HB3 ASN A 149 -6.191 17.635 10.410 1.00 2.87 H new ATOM 0 HD21 ASN A 149 -6.253 14.456 11.901 1.00 3.13 H new ATOM 0 HD22 ASN A 149 -7.153 15.870 11.342 1.00 3.13 H new ATOM 2260 N GLY A 150 -5.560 14.478 7.733 1.00 1.70 N ATOM 2261 CA GLY A 150 -4.882 13.418 7.006 1.00 1.79 C ATOM 2262 C GLY A 150 -4.187 12.451 7.968 1.00 1.62 C ATOM 2263 O GLY A 150 -4.149 11.247 7.723 1.00 2.75 O ATOM 0 H GLY A 150 -6.467 14.217 8.120 1.00 1.70 H new ATOM 0 HA2 GLY A 150 -5.602 12.874 6.394 1.00 1.79 H new ATOM 0 HA3 GLY A 150 -4.148 13.850 6.326 1.00 1.79 H new ATOM 2267 N LYS A 151 -3.654 13.017 9.041 1.00 1.45 N ATOM 2268 CA LYS A 151 -2.846 12.245 9.970 1.00 1.68 C ATOM 2269 C LYS A 151 -3.678 11.911 11.209 1.00 1.52 C ATOM 2270 O LYS A 151 -3.252 12.163 12.334 1.00 2.68 O ATOM 2271 CB LYS A 151 -1.542 12.979 10.285 1.00 2.38 C ATOM 2272 CG LYS A 151 -0.483 12.014 10.823 1.00 2.56 C ATOM 2273 CD LYS A 151 0.199 11.258 9.681 1.00 3.49 C ATOM 2274 CE LYS A 151 1.451 11.996 9.205 1.00 3.73 C ATOM 2275 NZ LYS A 151 2.051 11.305 8.042 1.00 4.71 N ATOM 0 H LYS A 151 -3.766 14.000 9.288 1.00 1.45 H new ATOM 0 HA LYS A 151 -2.550 11.297 9.520 1.00 1.68 H new ATOM 0 HB2 LYS A 151 -1.169 13.468 9.385 1.00 2.38 H new ATOM 0 HB3 LYS A 151 -1.730 13.763 11.018 1.00 2.38 H new ATOM 0 HG2 LYS A 151 0.262 12.568 11.394 1.00 2.56 H new ATOM 0 HG3 LYS A 151 -0.947 11.304 11.508 1.00 2.56 H new ATOM 0 HD2 LYS A 151 0.468 10.255 10.014 1.00 3.49 H new ATOM 0 HD3 LYS A 151 -0.497 11.142 8.850 1.00 3.49 H new ATOM 0 HE2 LYS A 151 1.195 13.020 8.934 1.00 3.73 H new ATOM 0 HE3 LYS A 151 2.177 12.052 10.016 1.00 3.73 H new ATOM 0 HZ1 LYS A 151 2.969 11.738 7.817 1.00 4.71 H new ATOM 0 HZ2 LYS A 151 2.188 10.299 8.269 1.00 4.71 H new ATOM 0 HZ3 LYS A 151 1.417 11.392 7.222 1.00 4.71 H new ATOM 2289 N THR A 152 -4.852 11.349 10.960 1.00 1.67 N ATOM 2290 CA THR A 152 -5.724 10.926 12.042 1.00 1.91 C ATOM 2291 C THR A 152 -5.669 11.930 13.195 1.00 2.27 C ATOM 2292 O THR A 152 -5.457 13.121 12.976 1.00 3.07 O ATOM 2293 CB THR A 152 -5.316 9.509 12.451 1.00 2.12 C ATOM 2294 OG1 THR A 152 -4.009 9.667 12.996 1.00 2.46 O ATOM 2295 CG2 THR A 152 -5.109 8.589 11.245 1.00 2.36 C ATOM 0 H THR A 152 -5.219 11.177 10.024 1.00 1.67 H new ATOM 0 HA THR A 152 -6.766 10.901 11.723 1.00 1.91 H new ATOM 0 HB THR A 152 -6.079 9.086 13.104 1.00 2.12 H new ATOM 0 HG1 THR A 152 -3.669 8.796 13.288 1.00 2.46 H new ATOM 0 HG21 THR A 152 -4.821 7.596 11.590 1.00 2.36 H new ATOM 0 HG22 THR A 152 -6.036 8.521 10.676 1.00 2.36 H new ATOM 0 HG23 THR A 152 -4.322 8.995 10.609 1.00 2.36 H new ATOM 2303 N SER A 153 -5.863 11.411 14.399 1.00 1.99 N ATOM 2304 CA SER A 153 -5.621 12.193 15.600 1.00 2.40 C ATOM 2305 C SER A 153 -4.814 11.372 16.607 1.00 2.02 C ATOM 2306 O SER A 153 -4.771 11.702 17.790 1.00 2.48 O ATOM 2307 CB SER A 153 -6.937 12.658 16.228 1.00 3.22 C ATOM 2308 OG SER A 153 -7.737 11.563 16.663 1.00 3.58 O ATOM 0 H SER A 153 -6.185 10.458 14.569 1.00 1.99 H new ATOM 0 HA SER A 153 -5.049 13.078 15.322 1.00 2.40 H new ATOM 0 HB2 SER A 153 -6.724 13.310 17.075 1.00 3.22 H new ATOM 0 HB3 SER A 153 -7.496 13.250 15.503 1.00 3.22 H new ATOM 0 HG SER A 153 -8.567 11.901 17.059 1.00 3.58 H new ATOM 2314 N LYS A 154 -4.193 10.317 16.098 1.00 1.51 N ATOM 2315 CA LYS A 154 -3.417 9.426 16.945 1.00 1.44 C ATOM 2316 C LYS A 154 -2.134 9.027 16.214 1.00 1.43 C ATOM 2317 O LYS A 154 -1.316 9.882 15.876 1.00 1.58 O ATOM 2318 CB LYS A 154 -4.267 8.235 17.390 1.00 1.63 C ATOM 2319 CG LYS A 154 -5.430 8.691 18.274 1.00 2.34 C ATOM 2320 CD LYS A 154 -6.065 7.503 19.001 1.00 2.43 C ATOM 2321 CE LYS A 154 -7.120 7.975 20.004 1.00 3.11 C ATOM 2322 NZ LYS A 154 -7.621 6.835 20.803 1.00 4.62 N ATOM 0 H LYS A 154 -4.211 10.060 15.111 1.00 1.51 H new ATOM 0 HA LYS A 154 -3.118 9.934 17.862 1.00 1.44 H new ATOM 0 HB2 LYS A 154 -4.654 7.713 16.515 1.00 1.63 H new ATOM 0 HB3 LYS A 154 -3.647 7.525 17.937 1.00 1.63 H new ATOM 0 HG2 LYS A 154 -5.074 9.420 19.002 1.00 2.34 H new ATOM 0 HG3 LYS A 154 -6.181 9.192 17.663 1.00 2.34 H new ATOM 0 HD2 LYS A 154 -6.523 6.830 18.276 1.00 2.43 H new ATOM 0 HD3 LYS A 154 -5.293 6.935 19.520 1.00 2.43 H new ATOM 0 HE2 LYS A 154 -6.691 8.729 20.664 1.00 3.11 H new ATOM 0 HE3 LYS A 154 -7.948 8.448 19.475 1.00 3.11 H new ATOM 0 HZ1 LYS A 154 -8.336 7.172 21.479 1.00 4.62 H new ATOM 0 HZ2 LYS A 154 -8.048 6.129 20.170 1.00 4.62 H new ATOM 0 HZ3 LYS A 154 -6.831 6.401 21.322 1.00 4.62 H new ATOM 2336 N LYS A 155 -1.996 7.728 15.993 1.00 1.42 N ATOM 2337 CA LYS A 155 -0.836 7.207 15.291 1.00 1.53 C ATOM 2338 C LYS A 155 -1.178 5.841 14.692 1.00 1.52 C ATOM 2339 O LYS A 155 -1.814 5.015 15.345 1.00 1.89 O ATOM 2340 CB LYS A 155 0.384 7.185 16.214 1.00 1.59 C ATOM 2341 CG LYS A 155 1.660 7.535 15.446 1.00 2.34 C ATOM 2342 CD LYS A 155 2.885 7.471 16.360 1.00 2.53 C ATOM 2343 CE LYS A 155 4.165 7.785 15.583 1.00 3.80 C ATOM 2344 NZ LYS A 155 4.244 9.231 15.276 1.00 4.92 N ATOM 0 H LYS A 155 -2.669 7.021 16.288 1.00 1.42 H new ATOM 0 HA LYS A 155 -0.568 7.861 14.462 1.00 1.53 H new ATOM 0 HB2 LYS A 155 0.240 7.894 17.029 1.00 1.59 H new ATOM 0 HB3 LYS A 155 0.486 6.198 16.664 1.00 1.59 H new ATOM 0 HG2 LYS A 155 1.788 6.845 14.612 1.00 2.34 H new ATOM 0 HG3 LYS A 155 1.570 8.535 15.021 1.00 2.34 H new ATOM 0 HD2 LYS A 155 2.769 8.180 17.179 1.00 2.53 H new ATOM 0 HD3 LYS A 155 2.960 6.479 16.805 1.00 2.53 H new ATOM 0 HE2 LYS A 155 5.035 7.483 16.166 1.00 3.80 H new ATOM 0 HE3 LYS A 155 4.186 7.209 14.658 1.00 3.80 H new ATOM 0 HZ1 LYS A 155 5.164 9.443 14.839 1.00 4.92 H new ATOM 0 HZ2 LYS A 155 3.481 9.488 14.618 1.00 4.92 H new ATOM 0 HZ3 LYS A 155 4.143 9.778 16.155 1.00 4.92 H new ATOM 2358 N ILE A 156 -0.740 5.647 13.456 1.00 1.24 N ATOM 2359 CA ILE A 156 -0.979 4.389 12.768 1.00 1.25 C ATOM 2360 C ILE A 156 0.355 3.812 12.291 1.00 1.27 C ATOM 2361 O ILE A 156 0.858 4.192 11.234 1.00 1.70 O ATOM 2362 CB ILE A 156 -2.003 4.578 11.646 1.00 1.31 C ATOM 2363 CG1 ILE A 156 -3.280 5.234 12.176 1.00 1.60 C ATOM 2364 CG2 ILE A 156 -2.289 3.254 10.936 1.00 1.55 C ATOM 2365 CD1 ILE A 156 -4.067 4.265 13.061 1.00 1.31 C ATOM 0 H ILE A 156 -0.222 6.339 12.914 1.00 1.24 H new ATOM 0 HA ILE A 156 -1.417 3.660 13.449 1.00 1.25 H new ATOM 0 HB ILE A 156 -1.578 5.254 10.904 1.00 1.31 H new ATOM 0 HG12 ILE A 156 -3.025 6.127 12.746 1.00 1.60 H new ATOM 0 HG13 ILE A 156 -3.902 5.556 11.340 1.00 1.60 H new ATOM 0 HG21 ILE A 156 -3.020 3.416 10.144 1.00 1.55 H new ATOM 0 HG22 ILE A 156 -1.366 2.866 10.505 1.00 1.55 H new ATOM 0 HG23 ILE A 156 -2.685 2.535 11.653 1.00 1.55 H new ATOM 0 HD11 ILE A 156 -4.970 4.756 13.425 1.00 1.31 H new ATOM 0 HD12 ILE A 156 -4.342 3.384 12.481 1.00 1.31 H new ATOM 0 HD13 ILE A 156 -3.451 3.964 13.908 1.00 1.31 H new ATOM 2377 N THR A 157 0.892 2.905 13.093 1.00 1.02 N ATOM 2378 CA THR A 157 2.237 2.405 12.867 1.00 1.10 C ATOM 2379 C THR A 157 2.193 0.957 12.375 1.00 1.01 C ATOM 2380 O THR A 157 1.365 0.169 12.828 1.00 0.86 O ATOM 2381 CB THR A 157 3.033 2.584 14.160 1.00 1.29 C ATOM 2382 OG1 THR A 157 2.264 1.889 15.139 1.00 1.33 O ATOM 2383 CG2 THR A 157 3.036 4.034 14.652 1.00 1.68 C ATOM 0 H THR A 157 0.419 2.503 13.902 1.00 1.02 H new ATOM 0 HA THR A 157 2.740 2.967 12.080 1.00 1.10 H new ATOM 0 HB THR A 157 4.059 2.252 14.003 1.00 1.29 H new ATOM 0 HG1 THR A 157 2.709 1.952 16.010 1.00 1.33 H new ATOM 0 HG21 THR A 157 3.615 4.105 15.573 1.00 1.68 H new ATOM 0 HG22 THR A 157 3.483 4.675 13.892 1.00 1.68 H new ATOM 0 HG23 THR A 157 2.012 4.356 14.842 1.00 1.68 H new ATOM 2391 N ILE A 158 3.095 0.651 11.454 1.00 1.20 N ATOM 2392 CA ILE A 158 3.313 -0.727 11.049 1.00 1.19 C ATOM 2393 C ILE A 158 4.055 -1.470 12.162 1.00 1.21 C ATOM 2394 O ILE A 158 5.197 -1.139 12.481 1.00 1.30 O ATOM 2395 CB ILE A 158 4.022 -0.782 9.694 1.00 1.35 C ATOM 2396 CG1 ILE A 158 3.195 -0.083 8.614 1.00 1.56 C ATOM 2397 CG2 ILE A 158 4.362 -2.224 9.312 1.00 1.43 C ATOM 2398 CD1 ILE A 158 3.954 -0.038 7.286 1.00 2.04 C ATOM 0 H ILE A 158 3.683 1.334 10.977 1.00 1.20 H new ATOM 0 HA ILE A 158 2.360 -1.237 10.905 1.00 1.19 H new ATOM 0 HB ILE A 158 4.964 -0.240 9.779 1.00 1.35 H new ATOM 0 HG12 ILE A 158 2.249 -0.607 8.479 1.00 1.56 H new ATOM 0 HG13 ILE A 158 2.955 0.931 8.934 1.00 1.56 H new ATOM 0 HG21 ILE A 158 4.865 -2.235 8.345 1.00 1.43 H new ATOM 0 HG22 ILE A 158 5.018 -2.655 10.068 1.00 1.43 H new ATOM 0 HG23 ILE A 158 3.445 -2.810 9.251 1.00 1.43 H new ATOM 0 HD11 ILE A 158 3.344 0.464 6.535 1.00 2.04 H new ATOM 0 HD12 ILE A 158 4.888 0.508 7.419 1.00 2.04 H new ATOM 0 HD13 ILE A 158 4.171 -1.054 6.957 1.00 2.04 H new ATOM 2410 N ALA A 159 3.377 -2.460 12.723 1.00 1.21 N ATOM 2411 CA ALA A 159 3.963 -3.262 13.784 1.00 1.26 C ATOM 2412 C ALA A 159 4.971 -4.240 13.180 1.00 1.25 C ATOM 2413 O ALA A 159 6.161 -4.180 13.488 1.00 1.43 O ATOM 2414 CB ALA A 159 2.852 -3.973 14.560 1.00 1.27 C ATOM 0 H ALA A 159 2.427 -2.725 12.463 1.00 1.21 H new ATOM 0 HA ALA A 159 4.500 -2.630 14.491 1.00 1.26 H new ATOM 0 HB1 ALA A 159 3.292 -4.574 15.356 1.00 1.27 H new ATOM 0 HB2 ALA A 159 2.180 -3.233 14.994 1.00 1.27 H new ATOM 0 HB3 ALA A 159 2.292 -4.619 13.884 1.00 1.27 H new ATOM 2420 N ASP A 160 4.459 -5.118 12.331 1.00 1.06 N ATOM 2421 CA ASP A 160 5.287 -6.154 11.734 1.00 1.01 C ATOM 2422 C ASP A 160 4.626 -6.651 10.448 1.00 0.92 C ATOM 2423 O ASP A 160 3.448 -6.390 10.210 1.00 0.93 O ATOM 2424 CB ASP A 160 5.442 -7.347 12.679 1.00 1.06 C ATOM 2425 CG ASP A 160 6.215 -7.057 13.967 1.00 2.26 C ATOM 2426 OD1 ASP A 160 7.461 -7.016 13.884 1.00 3.55 O ATOM 2427 OD2 ASP A 160 5.541 -6.883 15.006 1.00 2.94 O ATOM 0 H ASP A 160 3.481 -5.134 12.042 1.00 1.06 H new ATOM 0 HA ASP A 160 6.268 -5.726 11.530 1.00 1.01 H new ATOM 0 HB2 ASP A 160 4.450 -7.713 12.943 1.00 1.06 H new ATOM 0 HB3 ASP A 160 5.946 -8.152 12.144 1.00 1.06 H new ATOM 2432 N CYS A 161 5.414 -7.359 9.651 1.00 0.91 N ATOM 2433 CA CYS A 161 4.906 -7.935 8.417 1.00 0.84 C ATOM 2434 C CYS A 161 5.693 -9.215 8.126 1.00 0.90 C ATOM 2435 O CYS A 161 6.847 -9.344 8.530 1.00 1.28 O ATOM 2436 CB CYS A 161 4.984 -6.942 7.256 1.00 1.03 C ATOM 2437 SG CYS A 161 6.663 -6.222 7.158 1.00 2.00 S ATOM 0 H CYS A 161 6.399 -7.547 9.836 1.00 0.91 H new ATOM 0 HA CYS A 161 3.849 -8.177 8.533 1.00 0.84 H new ATOM 0 HB2 CYS A 161 4.740 -7.445 6.320 1.00 1.03 H new ATOM 0 HB3 CYS A 161 4.248 -6.150 7.394 1.00 1.03 H new ATOM 0 HG CYS A 161 7.130 -6.372 5.954 1.00 2.00 H new ATOM 2443 N GLY A 162 5.035 -10.129 7.429 1.00 0.78 N ATOM 2444 CA GLY A 162 5.653 -11.400 7.091 1.00 1.05 C ATOM 2445 C GLY A 162 4.750 -12.220 6.167 1.00 0.91 C ATOM 2446 O GLY A 162 3.587 -11.878 5.966 1.00 1.53 O ATOM 0 H GLY A 162 4.080 -10.015 7.089 1.00 0.78 H new ATOM 0 HA2 GLY A 162 6.613 -11.224 6.605 1.00 1.05 H new ATOM 0 HA3 GLY A 162 5.855 -11.964 8.002 1.00 1.05 H new ATOM 2450 N GLN A 163 5.322 -13.288 5.629 1.00 1.02 N ATOM 2451 CA GLN A 163 4.594 -14.140 4.703 1.00 1.04 C ATOM 2452 C GLN A 163 3.902 -15.275 5.460 1.00 1.32 C ATOM 2453 O GLN A 163 4.443 -15.799 6.433 1.00 1.54 O ATOM 2454 CB GLN A 163 5.523 -14.690 3.619 1.00 1.28 C ATOM 2455 CG GLN A 163 4.760 -15.601 2.655 1.00 1.74 C ATOM 2456 CD GLN A 163 5.637 -15.996 1.465 1.00 2.02 C ATOM 2457 OE1 GLN A 163 6.276 -17.035 1.448 1.00 3.01 O ATOM 2458 NE2 GLN A 163 5.632 -15.110 0.473 1.00 2.62 N ATOM 0 H GLN A 163 6.280 -13.583 5.816 1.00 1.02 H new ATOM 0 HA GLN A 163 3.830 -13.539 4.210 1.00 1.04 H new ATOM 0 HB2 GLN A 163 5.972 -13.865 3.067 1.00 1.28 H new ATOM 0 HB3 GLN A 163 6.339 -15.246 4.081 1.00 1.28 H new ATOM 0 HG2 GLN A 163 4.429 -16.497 3.181 1.00 1.74 H new ATOM 0 HG3 GLN A 163 3.865 -15.091 2.299 1.00 1.74 H new ATOM 0 HE21 GLN A 163 5.074 -14.260 0.552 1.00 2.62 H new ATOM 0 HE22 GLN A 163 6.186 -15.281 -0.366 1.00 2.62 H new ATOM 2467 N LEU A 164 2.715 -15.623 4.984 1.00 1.44 N ATOM 2468 CA LEU A 164 1.959 -16.712 5.579 1.00 1.84 C ATOM 2469 C LEU A 164 2.396 -18.034 4.945 1.00 2.39 C ATOM 2470 O LEU A 164 1.597 -18.710 4.297 1.00 2.89 O ATOM 2471 CB LEU A 164 0.457 -16.445 5.471 1.00 1.53 C ATOM 2472 CG LEU A 164 -0.077 -15.276 6.301 1.00 1.33 C ATOM 2473 CD1 LEU A 164 -1.381 -14.735 5.711 1.00 1.12 C ATOM 2474 CD2 LEU A 164 -0.234 -15.674 7.771 1.00 1.78 C ATOM 0 H LEU A 164 2.258 -15.170 4.193 1.00 1.44 H new ATOM 0 HA LEU A 164 2.169 -16.783 6.646 1.00 1.84 H new ATOM 0 HB2 LEU A 164 0.215 -16.262 4.424 1.00 1.53 H new ATOM 0 HB3 LEU A 164 -0.075 -17.349 5.768 1.00 1.53 H new ATOM 0 HG LEU A 164 0.653 -14.468 6.262 1.00 1.33 H new ATOM 0 HD11 LEU A 164 -1.739 -13.905 6.320 1.00 1.12 H new ATOM 0 HD12 LEU A 164 -1.203 -14.388 4.693 1.00 1.12 H new ATOM 0 HD13 LEU A 164 -2.131 -15.526 5.699 1.00 1.12 H new ATOM 0 HD21 LEU A 164 -0.615 -14.825 8.339 1.00 1.78 H new ATOM 0 HD22 LEU A 164 -0.933 -16.507 7.850 1.00 1.78 H new ATOM 0 HD23 LEU A 164 0.734 -15.974 8.172 1.00 1.78 H new ATOM 2486 N GLU A 165 3.661 -18.365 5.154 1.00 2.66 N ATOM 2487 CA GLU A 165 4.218 -19.585 4.594 1.00 3.25 C ATOM 2488 C GLU A 165 3.832 -20.789 5.455 1.00 4.30 C ATOM 2489 O GLU A 165 3.456 -20.633 6.616 1.00 5.46 O ATOM 2490 CB GLU A 165 5.738 -19.478 4.452 1.00 3.62 C ATOM 2491 CG GLU A 165 6.426 -19.590 5.813 1.00 5.36 C ATOM 2492 CD GLU A 165 7.886 -19.135 5.729 1.00 6.23 C ATOM 2493 OE1 GLU A 165 8.099 -17.904 5.775 1.00 6.90 O ATOM 2494 OE2 GLU A 165 8.752 -20.029 5.621 1.00 6.71 O ATOM 0 H GLU A 165 4.317 -17.810 5.704 1.00 2.66 H new ATOM 0 HA GLU A 165 3.801 -19.728 3.597 1.00 3.25 H new ATOM 0 HB2 GLU A 165 6.101 -20.265 3.791 1.00 3.62 H new ATOM 0 HB3 GLU A 165 5.997 -18.527 3.987 1.00 3.62 H new ATOM 0 HG2 GLU A 165 5.894 -18.982 6.545 1.00 5.36 H new ATOM 0 HG3 GLU A 165 6.382 -20.621 6.163 1.00 5.36 H new