USER MOD reduce.3.24.130724 H: found=0, std=0, add=981, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 979 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: A1179 LYS NZ :NH3+ 173:sc= 1.28 (180deg=1.23) USER MOD Set 1.2: A1191 ASN : amide:sc= 1.18 K(o=2.5,f=1.2) USER MOD Set 2.1: A1112 GLN : amide:sc= -1.3! C(o=-1.4!,f=-5.3!) USER MOD Set 2.2: A1122 LYS NZ :NH3+ -176:sc= -0.0724 (180deg=-0.0139) USER MOD Set 3.1: A1107 THR OG1 : rot 90:sc= 0.441 USER MOD Set 3.2: A1125 ASN : amide:sc= 0.465 K(o=0.91,f=-0.72!) USER MOD Set 4.1: A1102 THR OG1 : rot -86:sc= 0.642 USER MOD Set 4.2: A1104 THR OG1 : rot 180:sc= 0.578 USER MOD Single : A1053 THR OG1 : rot -33:sc= 0.22 USER MOD Single : A1057 ASN : amide:sc= 0.509 K(o=0.51,f=0) USER MOD Single : A1058 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A1060 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1063 THR OG1 : rot 117:sc= 1.23 USER MOD Single : A1065 SER OG : rot 180:sc= 0 USER MOD Single : A1066 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A1069 SER OG : rot 180:sc= 0 USER MOD Single : A1070 HIS : no HD1:sc= -0.0046 X(o=-0.0046,f=-0.067) USER MOD Single : A1071 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A1072 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1079 THR OG1 : rot -82:sc= 1.19 USER MOD Single : A1082 SER OG : rot 83:sc= 0.993 USER MOD Single : A1083 ASN : amide:sc= 1.03 K(o=1,f=-0.26) USER MOD Single : A1084 SER OG : rot 78:sc= 0.551 USER MOD Single : A1086 HIS : no HD1:sc= -0.265 X(o=-0.26,f=-0.0037) USER MOD Single : A1090 THR OG1 : rot 180:sc= 0 USER MOD Single : A1093 THR OG1 : rot 180:sc= -0.0452 USER MOD Single : A1094 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1095 TYR OH : rot 180:sc= -0.0448 USER MOD Single : A1096 CYS SG : rot 125:sc= 0.155 USER MOD Single : A1097 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1098 GLN : amide:sc= -0.0757 K(o=-0.076,f=-2.3!) USER MOD Single : A1108 CYS SG : rot 180:sc= 0 USER MOD Single : A1117 CYS SG : rot 180:sc= 0 USER MOD Single : A1120 SER OG : rot 180:sc= 0 USER MOD Single : A1121 CYS SG : rot -160:sc= -0.461 USER MOD Single : A1124 THR OG1 : rot 180:sc= -0.0138 USER MOD Single : A1177 GLN : amide:sc= -0.248 X(o=-0.25,f=0) USER MOD Single : A1178 TYR OH : rot 180:sc= 0 USER MOD Single : A1184 ASN : amide:sc= -0.0494 X(o=-0.049,f=-0.55) USER MOD Single : A1188 MET CE :methyl -172:sc= 0 (180deg=-0.171) USER MOD Single : A1196 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A1197 ASN : amide:sc= 0 K(o=0,f=-0.68) USER MOD Single : A1200 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A1203 MET CE :methyl 168:sc= -0.238 (180deg=-0.942) USER MOD Single : A1204 THR OG1 : rot 180:sc= 0 USER MOD Single : A1206 HIS : no HE2:sc= -0.266 K(o=-0.27,f=-1.9) USER MOD Single : A1209 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1212 THR OG1 : rot 180:sc= 0 USER MOD Single : A1223 CYS SG : rot -21:sc= 1.06 USER MOD ----------------------------------------------------------------- ATOM 89 N THR A1053 -7.839 -6.224 -15.830 1.00 1.78 N ATOM 90 CA THR A1053 -7.007 -6.368 -14.619 1.00 1.54 C ATOM 91 C THR A1053 -6.136 -5.140 -14.319 1.00 1.38 C ATOM 92 O THR A1053 -5.645 -4.515 -15.261 1.00 1.39 O ATOM 93 CB THR A1053 -6.078 -7.585 -14.732 1.00 1.60 C ATOM 94 OG1 THR A1053 -5.422 -7.595 -15.983 1.00 2.01 O ATOM 95 CG2 THR A1053 -6.852 -8.892 -14.603 1.00 2.59 C ATOM 0 HA THR A1053 -7.719 -6.490 -13.803 1.00 1.54 H new ATOM 0 HB THR A1053 -5.355 -7.505 -13.921 1.00 1.60 H new ATOM 0 HG1 THR A1053 -6.015 -7.218 -16.666 1.00 2.01 H new ATOM 0 HG21 THR A1053 -6.163 -9.733 -14.688 1.00 2.59 H new ATOM 0 HG22 THR A1053 -7.349 -8.926 -13.634 1.00 2.59 H new ATOM 0 HG23 THR A1053 -7.598 -8.953 -15.395 1.00 2.59 H new ATOM 103 N PRO A1054 -5.865 -4.827 -13.038 1.00 1.34 N ATOM 104 CA PRO A1054 -4.922 -3.781 -12.631 1.00 1.19 C ATOM 105 C PRO A1054 -3.461 -4.163 -12.938 1.00 1.13 C ATOM 106 O PRO A1054 -3.055 -5.309 -12.735 1.00 1.29 O ATOM 107 CB PRO A1054 -5.142 -3.595 -11.123 1.00 1.21 C ATOM 108 CG PRO A1054 -5.681 -4.947 -10.665 1.00 1.47 C ATOM 109 CD PRO A1054 -6.426 -5.494 -11.873 1.00 1.49 C ATOM 0 HA PRO A1054 -5.099 -2.859 -13.185 1.00 1.19 H new ATOM 0 HB2 PRO A1054 -4.214 -3.340 -10.612 1.00 1.21 H new ATOM 0 HB3 PRO A1054 -5.850 -2.792 -10.918 1.00 1.21 H new ATOM 0 HG2 PRO A1054 -4.873 -5.614 -10.362 1.00 1.47 H new ATOM 0 HG3 PRO A1054 -6.344 -4.839 -9.806 1.00 1.47 H new ATOM 0 HD2 PRO A1054 -6.304 -6.575 -11.948 1.00 1.49 H new ATOM 0 HD3 PRO A1054 -7.495 -5.299 -11.791 1.00 1.49 H new ATOM 117 N VAL A1055 -2.660 -3.184 -13.372 1.00 1.05 N ATOM 118 CA VAL A1055 -1.245 -3.312 -13.766 1.00 1.16 C ATOM 119 C VAL A1055 -0.398 -2.223 -13.079 1.00 1.04 C ATOM 120 O VAL A1055 -0.744 -1.034 -13.110 1.00 0.91 O ATOM 121 CB VAL A1055 -1.154 -3.317 -15.316 1.00 1.44 C ATOM 122 CG1 VAL A1055 -0.819 -1.980 -15.984 1.00 2.16 C ATOM 123 CG2 VAL A1055 -0.152 -4.359 -15.813 1.00 1.94 C ATOM 0 H VAL A1055 -2.997 -2.226 -13.464 1.00 1.05 H new ATOM 0 HA VAL A1055 -0.824 -4.258 -13.425 1.00 1.16 H new ATOM 0 HB VAL A1055 -2.174 -3.560 -15.613 1.00 1.44 H new ATOM 0 HG11 VAL A1055 -0.784 -2.112 -17.065 1.00 2.16 H new ATOM 0 HG12 VAL A1055 -1.585 -1.246 -15.733 1.00 2.16 H new ATOM 0 HG13 VAL A1055 0.150 -1.629 -15.630 1.00 2.16 H new ATOM 0 HG21 VAL A1055 -0.113 -4.336 -16.902 1.00 1.94 H new ATOM 0 HG22 VAL A1055 0.836 -4.135 -15.410 1.00 1.94 H new ATOM 0 HG23 VAL A1055 -0.463 -5.350 -15.482 1.00 1.94 H new ATOM 133 N VAL A1056 0.696 -2.597 -12.405 1.00 1.13 N ATOM 134 CA VAL A1056 1.439 -1.665 -11.529 1.00 1.01 C ATOM 135 C VAL A1056 2.304 -0.661 -12.300 1.00 0.94 C ATOM 136 O VAL A1056 3.246 -1.004 -13.019 1.00 1.00 O ATOM 137 CB VAL A1056 2.141 -2.357 -10.350 1.00 1.14 C ATOM 138 CG1 VAL A1056 3.185 -3.384 -10.772 1.00 1.37 C ATOM 139 CG2 VAL A1056 2.759 -1.320 -9.408 1.00 1.05 C ATOM 0 H VAL A1056 1.091 -3.536 -12.445 1.00 1.13 H new ATOM 0 HA VAL A1056 0.682 -1.044 -11.050 1.00 1.01 H new ATOM 0 HB VAL A1056 1.366 -2.914 -9.824 1.00 1.14 H new ATOM 0 HG11 VAL A1056 3.637 -3.829 -9.885 1.00 1.37 H new ATOM 0 HG12 VAL A1056 2.709 -4.163 -11.367 1.00 1.37 H new ATOM 0 HG13 VAL A1056 3.957 -2.895 -11.366 1.00 1.37 H new ATOM 0 HG21 VAL A1056 3.252 -1.829 -8.579 1.00 1.05 H new ATOM 0 HG22 VAL A1056 3.490 -0.723 -9.953 1.00 1.05 H new ATOM 0 HG23 VAL A1056 1.976 -0.669 -9.020 1.00 1.05 H new ATOM 149 N ASN A1057 1.967 0.620 -12.132 1.00 0.89 N ATOM 150 CA ASN A1057 2.484 1.730 -12.925 1.00 0.87 C ATOM 151 C ASN A1057 3.600 2.513 -12.206 1.00 0.76 C ATOM 152 O ASN A1057 4.644 2.743 -12.813 1.00 0.79 O ATOM 153 CB ASN A1057 1.269 2.583 -13.365 1.00 0.86 C ATOM 154 CG ASN A1057 0.812 2.218 -14.758 1.00 1.39 C ATOM 155 OD1 ASN A1057 0.967 2.966 -15.715 1.00 1.71 O ATOM 156 ND2 ASN A1057 0.272 1.040 -14.926 1.00 2.39 N ATOM 0 H ASN A1057 1.305 0.919 -11.416 1.00 0.89 H new ATOM 0 HA ASN A1057 2.994 1.364 -13.816 1.00 0.87 H new ATOM 0 HB2 ASN A1057 0.448 2.439 -12.662 1.00 0.86 H new ATOM 0 HB3 ASN A1057 1.534 3.640 -13.333 1.00 0.86 H new ATOM 0 HD21 ASN A1057 -0.022 0.742 -15.856 1.00 2.39 H new ATOM 0 HD22 ASN A1057 0.144 0.419 -14.127 1.00 2.39 H new ATOM 163 N GLN A1058 3.419 2.875 -10.929 1.00 0.68 N ATOM 164 CA GLN A1058 4.422 3.566 -10.095 1.00 0.64 C ATOM 165 C GLN A1058 4.206 3.308 -8.590 1.00 0.68 C ATOM 166 O GLN A1058 3.073 3.100 -8.152 1.00 0.70 O ATOM 167 CB GLN A1058 4.351 5.093 -10.339 1.00 0.58 C ATOM 168 CG GLN A1058 5.123 5.581 -11.569 1.00 1.66 C ATOM 169 CD GLN A1058 5.281 7.097 -11.579 1.00 1.38 C ATOM 170 OE1 GLN A1058 6.346 7.635 -11.309 1.00 1.61 O ATOM 171 NE2 GLN A1058 4.242 7.852 -11.857 1.00 2.77 N ATOM 0 H GLN A1058 2.548 2.692 -10.430 1.00 0.68 H new ATOM 0 HA GLN A1058 5.397 3.171 -10.380 1.00 0.64 H new ATOM 0 HB2 GLN A1058 3.305 5.382 -10.445 1.00 0.58 H new ATOM 0 HB3 GLN A1058 4.736 5.606 -9.458 1.00 0.58 H new ATOM 0 HG2 GLN A1058 6.108 5.114 -11.588 1.00 1.66 H new ATOM 0 HG3 GLN A1058 4.602 5.265 -12.473 1.00 1.66 H new ATOM 0 HE21 GLN A1058 3.345 7.422 -12.085 1.00 2.77 H new ATOM 0 HE22 GLN A1058 4.332 8.868 -11.845 1.00 2.77 H new ATOM 180 N VAL A1059 5.271 3.395 -7.786 1.00 0.71 N ATOM 181 CA VAL A1059 5.216 3.432 -6.308 1.00 0.74 C ATOM 182 C VAL A1059 6.092 4.577 -5.782 1.00 0.73 C ATOM 183 O VAL A1059 7.144 4.858 -6.360 1.00 0.83 O ATOM 184 CB VAL A1059 5.599 2.088 -5.641 1.00 0.82 C ATOM 185 CG1 VAL A1059 4.948 0.881 -6.330 1.00 0.86 C ATOM 186 CG2 VAL A1059 7.108 1.835 -5.552 1.00 0.81 C ATOM 0 H VAL A1059 6.223 3.443 -8.148 1.00 0.71 H new ATOM 0 HA VAL A1059 4.176 3.610 -6.034 1.00 0.74 H new ATOM 0 HB VAL A1059 5.213 2.191 -4.627 1.00 0.82 H new ATOM 0 HG11 VAL A1059 5.250 -0.035 -5.822 1.00 0.86 H new ATOM 0 HG12 VAL A1059 3.863 0.979 -6.287 1.00 0.86 H new ATOM 0 HG13 VAL A1059 5.267 0.841 -7.371 1.00 0.86 H new ATOM 0 HG21 VAL A1059 7.288 0.873 -5.072 1.00 0.81 H new ATOM 0 HG22 VAL A1059 7.535 1.826 -6.555 1.00 0.81 H new ATOM 0 HG23 VAL A1059 7.576 2.626 -4.966 1.00 0.81 H new ATOM 196 N LYS A1060 5.678 5.259 -4.706 1.00 0.64 N ATOM 197 CA LYS A1060 6.438 6.377 -4.110 1.00 0.64 C ATOM 198 C LYS A1060 6.390 6.387 -2.578 1.00 0.62 C ATOM 199 O LYS A1060 5.378 6.021 -1.978 1.00 0.56 O ATOM 200 CB LYS A1060 5.965 7.699 -4.723 1.00 0.64 C ATOM 201 CG LYS A1060 7.133 8.684 -4.693 1.00 0.82 C ATOM 202 CD LYS A1060 6.742 10.058 -5.211 1.00 1.06 C ATOM 203 CE LYS A1060 8.046 10.852 -5.200 1.00 1.42 C ATOM 204 NZ LYS A1060 7.864 12.273 -5.578 1.00 1.95 N ATOM 0 H LYS A1060 4.805 5.054 -4.220 1.00 0.64 H new ATOM 0 HA LYS A1060 7.492 6.238 -4.352 1.00 0.64 H new ATOM 0 HB2 LYS A1060 5.625 7.543 -5.747 1.00 0.64 H new ATOM 0 HB3 LYS A1060 5.118 8.096 -4.163 1.00 0.64 H new ATOM 0 HG2 LYS A1060 7.503 8.775 -3.672 1.00 0.82 H new ATOM 0 HG3 LYS A1060 7.952 8.291 -5.295 1.00 0.82 H new ATOM 0 HD2 LYS A1060 6.321 9.999 -6.215 1.00 1.06 H new ATOM 0 HD3 LYS A1060 5.988 10.523 -4.575 1.00 1.06 H new ATOM 0 HE2 LYS A1060 8.487 10.801 -4.205 1.00 1.42 H new ATOM 0 HE3 LYS A1060 8.753 10.387 -5.887 1.00 1.42 H new ATOM 0 HZ1 LYS A1060 8.783 12.759 -5.552 1.00 1.95 H new ATOM 0 HZ2 LYS A1060 7.469 12.329 -6.539 1.00 1.95 H new ATOM 0 HZ3 LYS A1060 7.212 12.729 -4.909 1.00 1.95 H new ATOM 218 N VAL A1061 7.473 6.836 -1.944 1.00 0.68 N ATOM 219 CA VAL A1061 7.599 6.985 -0.486 1.00 0.68 C ATOM 220 C VAL A1061 7.148 8.375 -0.016 1.00 0.68 C ATOM 221 O VAL A1061 7.533 9.404 -0.580 1.00 0.76 O ATOM 222 CB VAL A1061 9.043 6.684 -0.043 1.00 0.76 C ATOM 223 CG1 VAL A1061 9.212 6.826 1.471 1.00 0.80 C ATOM 224 CG2 VAL A1061 9.452 5.247 -0.403 1.00 0.82 C ATOM 0 H VAL A1061 8.317 7.116 -2.443 1.00 0.68 H new ATOM 0 HA VAL A1061 6.935 6.261 -0.013 1.00 0.68 H new ATOM 0 HB VAL A1061 9.670 7.407 -0.565 1.00 0.76 H new ATOM 0 HG11 VAL A1061 10.244 6.606 1.744 1.00 0.80 H new ATOM 0 HG12 VAL A1061 8.967 7.845 1.770 1.00 0.80 H new ATOM 0 HG13 VAL A1061 8.546 6.129 1.978 1.00 0.80 H new ATOM 0 HG21 VAL A1061 10.476 5.068 -0.076 1.00 0.82 H new ATOM 0 HG22 VAL A1061 8.784 4.543 0.094 1.00 0.82 H new ATOM 0 HG23 VAL A1061 9.386 5.109 -1.482 1.00 0.82 H new ATOM 234 N LEU A1062 6.354 8.399 1.057 1.00 0.68 N ATOM 235 CA LEU A1062 5.763 9.596 1.671 1.00 0.73 C ATOM 236 C LEU A1062 6.314 9.893 3.082 1.00 0.78 C ATOM 237 O LEU A1062 6.276 11.035 3.534 1.00 0.96 O ATOM 238 CB LEU A1062 4.233 9.411 1.635 1.00 0.86 C ATOM 239 CG LEU A1062 3.408 10.648 2.022 1.00 1.05 C ATOM 240 CD1 LEU A1062 3.730 11.891 1.193 1.00 1.18 C ATOM 241 CD2 LEU A1062 1.946 10.294 1.789 1.00 1.25 C ATOM 0 H LEU A1062 6.091 7.544 1.547 1.00 0.68 H new ATOM 0 HA LEU A1062 6.042 10.485 1.105 1.00 0.73 H new ATOM 0 HB2 LEU A1062 3.945 9.104 0.630 1.00 0.86 H new ATOM 0 HB3 LEU A1062 3.967 8.594 2.306 1.00 0.86 H new ATOM 0 HG LEU A1062 3.641 10.893 3.058 1.00 1.05 H new ATOM 0 HD11 LEU A1062 3.107 12.722 1.526 1.00 1.18 H new ATOM 0 HD12 LEU A1062 4.781 12.151 1.321 1.00 1.18 H new ATOM 0 HD13 LEU A1062 3.532 11.688 0.141 1.00 1.18 H new ATOM 0 HD21 LEU A1062 1.319 11.146 2.051 1.00 1.25 H new ATOM 0 HD22 LEU A1062 1.795 10.042 0.739 1.00 1.25 H new ATOM 0 HD23 LEU A1062 1.675 9.440 2.409 1.00 1.25 H new ATOM 253 N THR A1063 6.846 8.874 3.758 1.00 0.79 N ATOM 254 CA THR A1063 7.625 8.974 5.012 1.00 0.83 C ATOM 255 C THR A1063 8.914 8.159 4.868 1.00 1.17 C ATOM 256 O THR A1063 8.835 6.960 4.606 1.00 1.84 O ATOM 257 CB THR A1063 6.795 8.446 6.192 1.00 0.74 C ATOM 258 OG1 THR A1063 5.699 9.299 6.468 1.00 1.53 O ATOM 259 CG2 THR A1063 7.566 8.269 7.497 1.00 1.38 C ATOM 0 H THR A1063 6.746 7.910 3.440 1.00 0.79 H new ATOM 0 HA THR A1063 7.874 10.018 5.204 1.00 0.83 H new ATOM 0 HB THR A1063 6.473 7.460 5.857 1.00 0.74 H new ATOM 0 HG1 THR A1063 4.861 8.813 6.321 1.00 1.53 H new ATOM 0 HG21 THR A1063 6.894 7.893 8.268 1.00 1.38 H new ATOM 0 HG22 THR A1063 8.379 7.559 7.346 1.00 1.38 H new ATOM 0 HG23 THR A1063 7.976 9.229 7.810 1.00 1.38 H new ATOM 267 N GLU A1064 10.088 8.782 5.022 1.00 1.35 N ATOM 268 CA GLU A1064 11.388 8.150 4.722 1.00 1.68 C ATOM 269 C GLU A1064 12.464 8.397 5.803 1.00 1.81 C ATOM 270 O GLU A1064 12.649 9.530 6.259 1.00 1.90 O ATOM 271 CB GLU A1064 11.877 8.673 3.358 1.00 1.97 C ATOM 272 CG GLU A1064 12.961 7.801 2.713 1.00 2.49 C ATOM 273 CD GLU A1064 13.678 8.552 1.586 1.00 2.74 C ATOM 274 OE1 GLU A1064 13.035 9.013 0.611 1.00 3.06 O ATOM 275 OE2 GLU A1064 14.922 8.704 1.676 1.00 3.53 O ATOM 0 H GLU A1064 10.169 9.741 5.359 1.00 1.35 H new ATOM 0 HA GLU A1064 11.233 7.071 4.702 1.00 1.68 H new ATOM 0 HB2 GLU A1064 11.027 8.741 2.679 1.00 1.97 H new ATOM 0 HB3 GLU A1064 12.265 9.684 3.485 1.00 1.97 H new ATOM 0 HG2 GLU A1064 13.685 7.497 3.469 1.00 2.49 H new ATOM 0 HG3 GLU A1064 12.511 6.890 2.318 1.00 2.49 H new ATOM 282 N SER A1065 13.234 7.354 6.147 1.00 1.96 N ATOM 283 CA SER A1065 14.259 7.264 7.212 1.00 2.22 C ATOM 284 C SER A1065 13.744 7.488 8.631 1.00 2.30 C ATOM 285 O SER A1065 13.992 6.665 9.513 1.00 3.43 O ATOM 286 CB SER A1065 15.472 8.161 6.945 1.00 2.46 C ATOM 287 OG SER A1065 16.357 7.536 6.031 1.00 2.85 O ATOM 0 H SER A1065 13.152 6.470 5.645 1.00 1.96 H new ATOM 0 HA SER A1065 14.572 6.221 7.164 1.00 2.22 H new ATOM 0 HB2 SER A1065 15.142 9.119 6.544 1.00 2.46 H new ATOM 0 HB3 SER A1065 15.992 8.368 7.880 1.00 2.46 H new ATOM 0 HG SER A1065 17.126 8.121 5.868 1.00 2.85 H new ATOM 293 N ASN A1066 13.012 8.575 8.863 1.00 1.59 N ATOM 294 CA ASN A1066 12.287 8.782 10.105 1.00 1.69 C ATOM 295 C ASN A1066 11.042 7.881 10.084 1.00 1.48 C ATOM 296 O ASN A1066 10.341 7.791 9.075 1.00 3.14 O ATOM 297 CB ASN A1066 12.011 10.279 10.320 1.00 2.10 C ATOM 298 CG ASN A1066 13.314 11.050 10.473 1.00 2.76 C ATOM 299 OD1 ASN A1066 13.910 11.106 11.541 1.00 3.58 O ATOM 300 ND2 ASN A1066 13.835 11.612 9.406 1.00 2.94 N ATOM 0 H ASN A1066 12.907 9.336 8.191 1.00 1.59 H new ATOM 0 HA ASN A1066 12.873 8.489 10.976 1.00 1.69 H new ATOM 0 HB2 ASN A1066 11.446 10.674 9.476 1.00 2.10 H new ATOM 0 HB3 ASN A1066 11.395 10.416 11.209 1.00 2.10 H new ATOM 0 HD21 ASN A1066 14.733 12.092 9.469 1.00 2.94 H new ATOM 0 HD22 ASN A1066 13.342 11.568 8.514 1.00 2.94 H new ATOM 307 N ARG A1067 10.803 7.176 11.191 1.00 1.64 N ATOM 308 CA ARG A1067 9.827 6.081 11.363 1.00 1.33 C ATOM 309 C ARG A1067 10.097 4.814 10.520 1.00 1.20 C ATOM 310 O ARG A1067 10.160 3.725 11.101 1.00 1.58 O ATOM 311 CB ARG A1067 8.381 6.611 11.205 1.00 1.22 C ATOM 312 CG ARG A1067 7.363 5.734 11.959 1.00 1.49 C ATOM 313 CD ARG A1067 6.666 6.472 13.113 1.00 2.03 C ATOM 314 NE ARG A1067 7.609 7.125 14.047 1.00 2.97 N ATOM 315 CZ ARG A1067 7.283 7.708 15.185 1.00 3.90 C ATOM 316 NH1 ARG A1067 6.085 7.647 15.680 1.00 4.04 N ATOM 317 NH2 ARG A1067 8.167 8.387 15.851 1.00 5.38 N ATOM 0 H ARG A1067 11.316 7.362 12.053 1.00 1.64 H new ATOM 0 HA ARG A1067 9.959 5.728 12.386 1.00 1.33 H new ATOM 0 HB2 ARG A1067 8.326 7.634 11.578 1.00 1.22 H new ATOM 0 HB3 ARG A1067 8.120 6.643 10.147 1.00 1.22 H new ATOM 0 HG2 ARG A1067 6.610 5.378 11.257 1.00 1.49 H new ATOM 0 HG3 ARG A1067 7.872 4.855 12.354 1.00 1.49 H new ATOM 0 HD2 ARG A1067 5.995 7.225 12.700 1.00 2.03 H new ATOM 0 HD3 ARG A1067 6.049 5.765 13.667 1.00 2.03 H new ATOM 0 HE ARG A1067 8.596 7.125 13.789 1.00 2.97 H new ATOM 0 HH11 ARG A1067 5.355 7.134 15.186 1.00 4.04 H new ATOM 0 HH12 ARG A1067 5.874 8.112 16.563 1.00 4.04 H new ATOM 0 HH21 ARG A1067 9.119 8.472 15.495 1.00 5.38 H new ATOM 0 HH22 ARG A1067 7.909 8.836 16.730 1.00 5.38 H new ATOM 331 N ILE A1068 10.253 4.913 9.193 1.00 1.13 N ATOM 332 CA ILE A1068 10.343 3.773 8.256 1.00 0.95 C ATOM 333 C ILE A1068 11.278 4.081 7.067 1.00 1.14 C ATOM 334 O ILE A1068 11.426 5.238 6.677 1.00 1.53 O ATOM 335 CB ILE A1068 8.947 3.368 7.700 1.00 0.89 C ATOM 336 CG1 ILE A1068 7.729 3.774 8.566 1.00 1.55 C ATOM 337 CG2 ILE A1068 8.911 1.842 7.477 1.00 1.00 C ATOM 338 CD1 ILE A1068 6.424 3.744 7.781 1.00 2.49 C ATOM 0 H ILE A1068 10.323 5.815 8.722 1.00 1.13 H new ATOM 0 HA ILE A1068 10.754 2.944 8.832 1.00 0.95 H new ATOM 0 HB ILE A1068 8.842 3.929 6.772 1.00 0.89 H new ATOM 0 HG12 ILE A1068 7.652 3.100 9.419 1.00 1.55 H new ATOM 0 HG13 ILE A1068 7.887 4.776 8.964 1.00 1.55 H new ATOM 0 HG21 ILE A1068 7.935 1.554 7.087 1.00 1.00 H new ATOM 0 HG22 ILE A1068 9.684 1.560 6.762 1.00 1.00 H new ATOM 0 HG23 ILE A1068 9.089 1.332 8.424 1.00 1.00 H new ATOM 0 HD11 ILE A1068 5.601 4.036 8.433 1.00 2.49 H new ATOM 0 HD12 ILE A1068 6.488 4.438 6.943 1.00 2.49 H new ATOM 0 HD13 ILE A1068 6.249 2.736 7.405 1.00 2.49 H new ATOM 350 N SER A1069 11.866 3.055 6.442 1.00 1.03 N ATOM 351 CA SER A1069 12.760 3.175 5.274 1.00 1.24 C ATOM 352 C SER A1069 12.282 2.395 4.040 1.00 1.07 C ATOM 353 O SER A1069 11.582 1.391 4.155 1.00 0.89 O ATOM 354 CB SER A1069 14.179 2.771 5.662 1.00 1.55 C ATOM 355 OG SER A1069 14.711 3.749 6.535 1.00 2.01 O ATOM 0 H SER A1069 11.732 2.089 6.740 1.00 1.03 H new ATOM 0 HA SER A1069 12.744 4.223 4.976 1.00 1.24 H new ATOM 0 HB2 SER A1069 14.174 1.795 6.147 1.00 1.55 H new ATOM 0 HB3 SER A1069 14.802 2.681 4.772 1.00 1.55 H new ATOM 0 HG SER A1069 15.623 3.497 6.792 1.00 2.01 H new ATOM 361 N HIS A1070 12.680 2.858 2.848 1.00 1.20 N ATOM 362 CA HIS A1070 12.136 2.435 1.546 1.00 1.17 C ATOM 363 C HIS A1070 12.053 0.913 1.290 1.00 1.01 C ATOM 364 O HIS A1070 10.980 0.415 0.941 1.00 0.96 O ATOM 365 CB HIS A1070 12.884 3.183 0.422 1.00 1.38 C ATOM 366 CG HIS A1070 14.381 2.958 0.329 1.00 2.23 C ATOM 367 ND1 HIS A1070 15.006 1.932 -0.343 1.00 2.57 N ATOM 368 CD2 HIS A1070 15.371 3.798 0.771 1.00 3.58 C ATOM 369 CE1 HIS A1070 16.333 2.129 -0.289 1.00 3.49 C ATOM 370 NE2 HIS A1070 16.608 3.276 0.356 1.00 4.17 N ATOM 0 H HIS A1070 13.414 3.561 2.758 1.00 1.20 H new ATOM 0 HA HIS A1070 11.083 2.715 1.559 1.00 1.17 H new ATOM 0 HB2 HIS A1070 12.438 2.898 -0.531 1.00 1.38 H new ATOM 0 HB3 HIS A1070 12.708 4.251 0.550 1.00 1.38 H new ATOM 0 HD2 HIS A1070 15.225 4.704 1.340 1.00 3.58 H new ATOM 0 HE1 HIS A1070 17.074 1.462 -0.704 1.00 3.49 H new ATOM 0 HE2 HIS A1070 17.529 3.685 0.513 1.00 4.17 H new ATOM 378 N HIS A1071 13.130 0.151 1.501 1.00 0.97 N ATOM 379 CA HIS A1071 13.124 -1.299 1.248 1.00 0.86 C ATOM 380 C HIS A1071 12.341 -2.070 2.329 1.00 0.83 C ATOM 381 O HIS A1071 11.724 -3.099 2.048 1.00 0.82 O ATOM 382 CB HIS A1071 14.570 -1.790 1.099 1.00 0.89 C ATOM 383 CG HIS A1071 14.686 -3.241 0.699 1.00 1.32 C ATOM 384 ND1 HIS A1071 14.674 -3.738 -0.584 1.00 1.88 N ATOM 385 CD2 HIS A1071 14.851 -4.306 1.542 1.00 2.69 C ATOM 386 CE1 HIS A1071 14.830 -5.072 -0.514 1.00 2.47 C ATOM 387 NE2 HIS A1071 14.939 -5.470 0.767 1.00 2.98 N ATOM 0 H HIS A1071 14.019 0.511 1.847 1.00 0.97 H new ATOM 0 HA HIS A1071 12.597 -1.497 0.315 1.00 0.86 H new ATOM 0 HB2 HIS A1071 15.077 -1.176 0.354 1.00 0.89 H new ATOM 0 HB3 HIS A1071 15.093 -1.641 2.044 1.00 0.89 H new ATOM 0 HD2 HIS A1071 14.904 -4.258 2.620 1.00 2.69 H new ATOM 0 HE1 HIS A1071 14.863 -5.733 -1.368 1.00 2.47 H new ATOM 0 HE2 HIS A1071 15.061 -6.425 1.105 1.00 2.98 H new ATOM 395 N LYS A1072 12.291 -1.548 3.560 1.00 0.85 N ATOM 396 CA LYS A1072 11.473 -2.122 4.640 1.00 0.86 C ATOM 397 C LYS A1072 9.973 -1.860 4.428 1.00 0.86 C ATOM 398 O LYS A1072 9.194 -2.789 4.633 1.00 0.86 O ATOM 399 CB LYS A1072 12.015 -1.663 6.006 1.00 0.94 C ATOM 400 CG LYS A1072 13.394 -2.297 6.282 1.00 1.56 C ATOM 401 CD LYS A1072 13.997 -1.817 7.607 1.00 1.94 C ATOM 402 CE LYS A1072 15.383 -2.428 7.842 1.00 2.57 C ATOM 403 NZ LYS A1072 16.021 -1.863 9.052 1.00 3.23 N ATOM 0 H LYS A1072 12.814 -0.718 3.837 1.00 0.85 H new ATOM 0 HA LYS A1072 11.559 -3.208 4.621 1.00 0.86 H new ATOM 0 HB2 LYS A1072 12.098 -0.576 6.024 1.00 0.94 H new ATOM 0 HB3 LYS A1072 11.316 -1.943 6.794 1.00 0.94 H new ATOM 0 HG2 LYS A1072 13.296 -3.382 6.302 1.00 1.56 H new ATOM 0 HG3 LYS A1072 14.074 -2.053 5.466 1.00 1.56 H new ATOM 0 HD2 LYS A1072 14.073 -0.730 7.602 1.00 1.94 H new ATOM 0 HD3 LYS A1072 13.334 -2.086 8.429 1.00 1.94 H new ATOM 0 HE2 LYS A1072 15.293 -3.509 7.947 1.00 2.57 H new ATOM 0 HE3 LYS A1072 16.016 -2.243 6.974 1.00 2.57 H new ATOM 0 HZ1 LYS A1072 16.957 -2.296 9.185 1.00 3.23 H new ATOM 0 HZ2 LYS A1072 16.128 -0.835 8.940 1.00 3.23 H new ATOM 0 HZ3 LYS A1072 15.427 -2.061 9.882 1.00 3.23 H new ATOM 417 N ILE A1073 9.574 -0.682 3.915 1.00 0.87 N ATOM 418 CA ILE A1073 8.184 -0.391 3.491 1.00 0.86 C ATOM 419 C ILE A1073 7.700 -1.437 2.466 1.00 0.87 C ATOM 420 O ILE A1073 6.682 -2.093 2.695 1.00 0.90 O ATOM 421 CB ILE A1073 8.005 1.054 2.933 1.00 0.86 C ATOM 422 CG1 ILE A1073 8.211 2.149 4.012 1.00 0.80 C ATOM 423 CG2 ILE A1073 6.607 1.220 2.294 1.00 0.82 C ATOM 424 CD1 ILE A1073 8.137 3.594 3.483 1.00 0.75 C ATOM 0 H ILE A1073 10.210 0.104 3.780 1.00 0.87 H new ATOM 0 HA ILE A1073 7.565 -0.454 4.386 1.00 0.86 H new ATOM 0 HB ILE A1073 8.780 1.188 2.178 1.00 0.86 H new ATOM 0 HG12 ILE A1073 7.457 2.021 4.789 1.00 0.80 H new ATOM 0 HG13 ILE A1073 9.182 1.998 4.483 1.00 0.80 H new ATOM 0 HG21 ILE A1073 6.501 2.235 1.910 1.00 0.82 H new ATOM 0 HG22 ILE A1073 6.494 0.509 1.476 1.00 0.82 H new ATOM 0 HG23 ILE A1073 5.839 1.034 3.045 1.00 0.82 H new ATOM 0 HD11 ILE A1073 8.292 4.291 4.306 1.00 0.75 H new ATOM 0 HD12 ILE A1073 8.909 3.745 2.729 1.00 0.75 H new ATOM 0 HD13 ILE A1073 7.157 3.769 3.039 1.00 0.75 H new ATOM 436 N LEU A1074 8.415 -1.622 1.345 1.00 0.83 N ATOM 437 CA LEU A1074 7.937 -2.511 0.269 1.00 0.78 C ATOM 438 C LEU A1074 7.859 -3.984 0.709 1.00 0.68 C ATOM 439 O LEU A1074 6.999 -4.733 0.237 1.00 0.65 O ATOM 440 CB LEU A1074 8.738 -2.264 -1.029 1.00 0.81 C ATOM 441 CG LEU A1074 10.111 -2.960 -1.136 1.00 0.77 C ATOM 442 CD1 LEU A1074 10.014 -4.342 -1.787 1.00 0.69 C ATOM 443 CD2 LEU A1074 11.063 -2.127 -1.995 1.00 0.85 C ATOM 0 H LEU A1074 9.313 -1.176 1.159 1.00 0.83 H new ATOM 0 HA LEU A1074 6.902 -2.257 0.040 1.00 0.78 H new ATOM 0 HB2 LEU A1074 8.127 -2.584 -1.873 1.00 0.81 H new ATOM 0 HB3 LEU A1074 8.891 -1.190 -1.136 1.00 0.81 H new ATOM 0 HG LEU A1074 10.479 -3.063 -0.115 1.00 0.77 H new ATOM 0 HD11 LEU A1074 11.006 -4.790 -1.839 1.00 0.69 H new ATOM 0 HD12 LEU A1074 9.359 -4.979 -1.193 1.00 0.69 H new ATOM 0 HD13 LEU A1074 9.608 -4.242 -2.793 1.00 0.69 H new ATOM 0 HD21 LEU A1074 12.028 -2.630 -2.062 1.00 0.85 H new ATOM 0 HD22 LEU A1074 10.644 -2.011 -2.995 1.00 0.85 H new ATOM 0 HD23 LEU A1074 11.197 -1.145 -1.542 1.00 0.85 H new ATOM 455 N ALA A1075 8.707 -4.390 1.660 1.00 0.67 N ATOM 456 CA ALA A1075 8.666 -5.722 2.246 1.00 0.61 C ATOM 457 C ALA A1075 7.433 -5.945 3.147 1.00 0.65 C ATOM 458 O ALA A1075 6.752 -6.962 2.993 1.00 0.70 O ATOM 459 CB ALA A1075 9.983 -5.964 2.988 1.00 0.60 C ATOM 0 H ALA A1075 9.443 -3.796 2.043 1.00 0.67 H new ATOM 0 HA ALA A1075 8.559 -6.456 1.448 1.00 0.61 H new ATOM 0 HB1 ALA A1075 9.972 -6.958 3.435 1.00 0.60 H new ATOM 0 HB2 ALA A1075 10.814 -5.891 2.287 1.00 0.60 H new ATOM 0 HB3 ALA A1075 10.102 -5.216 3.772 1.00 0.60 H new ATOM 465 N ILE A1076 7.090 -5.018 4.056 1.00 0.67 N ATOM 466 CA ILE A1076 5.938 -5.204 4.970 1.00 0.71 C ATOM 467 C ILE A1076 4.579 -5.129 4.260 1.00 0.75 C ATOM 468 O ILE A1076 3.648 -5.820 4.668 1.00 0.84 O ATOM 469 CB ILE A1076 6.000 -4.301 6.225 1.00 0.73 C ATOM 470 CG1 ILE A1076 5.963 -2.789 5.900 1.00 0.79 C ATOM 471 CG2 ILE A1076 7.225 -4.724 7.055 1.00 0.70 C ATOM 472 CD1 ILE A1076 6.042 -1.855 7.119 1.00 0.76 C ATOM 0 H ILE A1076 7.587 -4.136 4.182 1.00 0.67 H new ATOM 0 HA ILE A1076 6.030 -6.228 5.332 1.00 0.71 H new ATOM 0 HB ILE A1076 5.098 -4.448 6.819 1.00 0.73 H new ATOM 0 HG12 ILE A1076 6.791 -2.557 5.231 1.00 0.79 H new ATOM 0 HG13 ILE A1076 5.044 -2.573 5.356 1.00 0.79 H new ATOM 0 HG21 ILE A1076 7.292 -4.102 7.947 1.00 0.70 H new ATOM 0 HG22 ILE A1076 7.123 -5.769 7.348 1.00 0.70 H new ATOM 0 HG23 ILE A1076 8.129 -4.601 6.458 1.00 0.70 H new ATOM 0 HD11 ILE A1076 6.009 -0.818 6.785 1.00 0.76 H new ATOM 0 HD12 ILE A1076 5.199 -2.050 7.782 1.00 0.76 H new ATOM 0 HD13 ILE A1076 6.974 -2.034 7.655 1.00 0.76 H new ATOM 484 N VAL A1077 4.474 -4.379 3.156 1.00 0.72 N ATOM 485 CA VAL A1077 3.284 -4.406 2.284 1.00 0.73 C ATOM 486 C VAL A1077 3.195 -5.732 1.519 1.00 0.76 C ATOM 487 O VAL A1077 2.174 -6.417 1.573 1.00 0.85 O ATOM 488 CB VAL A1077 3.265 -3.201 1.320 1.00 0.74 C ATOM 489 CG1 VAL A1077 2.034 -3.208 0.400 1.00 0.78 C ATOM 490 CG2 VAL A1077 3.248 -1.879 2.100 1.00 0.78 C ATOM 0 H VAL A1077 5.203 -3.740 2.840 1.00 0.72 H new ATOM 0 HA VAL A1077 2.403 -4.327 2.921 1.00 0.73 H new ATOM 0 HB VAL A1077 4.169 -3.287 0.717 1.00 0.74 H new ATOM 0 HG11 VAL A1077 2.067 -2.340 -0.259 1.00 0.78 H new ATOM 0 HG12 VAL A1077 2.033 -4.119 -0.199 1.00 0.78 H new ATOM 0 HG13 VAL A1077 1.128 -3.170 1.004 1.00 0.78 H new ATOM 0 HG21 VAL A1077 3.235 -1.044 1.400 1.00 0.78 H new ATOM 0 HG22 VAL A1077 2.359 -1.839 2.729 1.00 0.78 H new ATOM 0 HG23 VAL A1077 4.138 -1.814 2.725 1.00 0.78 H new ATOM 500 N GLY A1078 4.271 -6.137 0.831 1.00 0.69 N ATOM 501 CA GLY A1078 4.249 -7.321 -0.036 1.00 0.66 C ATOM 502 C GLY A1078 4.108 -8.649 0.715 1.00 0.65 C ATOM 503 O GLY A1078 3.507 -9.586 0.193 1.00 0.66 O ATOM 0 H GLY A1078 5.171 -5.659 0.859 1.00 0.69 H new ATOM 0 HA2 GLY A1078 3.423 -7.226 -0.741 1.00 0.66 H new ATOM 0 HA3 GLY A1078 5.167 -7.344 -0.623 1.00 0.66 H new ATOM 507 N THR A1079 4.613 -8.747 1.948 1.00 0.63 N ATOM 508 CA THR A1079 4.518 -9.975 2.763 1.00 0.61 C ATOM 509 C THR A1079 3.092 -10.262 3.242 1.00 0.61 C ATOM 510 O THR A1079 2.628 -11.393 3.103 1.00 0.64 O ATOM 511 CB THR A1079 5.485 -9.947 3.956 1.00 0.64 C ATOM 512 OG1 THR A1079 5.466 -8.723 4.633 1.00 0.60 O ATOM 513 CG2 THR A1079 6.927 -10.167 3.532 1.00 0.72 C ATOM 0 H THR A1079 5.100 -7.982 2.415 1.00 0.63 H new ATOM 0 HA THR A1079 4.810 -10.790 2.101 1.00 0.61 H new ATOM 0 HB THR A1079 5.139 -10.753 4.603 1.00 0.64 H new ATOM 0 HG1 THR A1079 6.038 -8.081 4.164 1.00 0.60 H new ATOM 0 HG21 THR A1079 7.573 -10.139 4.410 1.00 0.72 H new ATOM 0 HG22 THR A1079 7.019 -11.138 3.045 1.00 0.72 H new ATOM 0 HG23 THR A1079 7.225 -9.383 2.837 1.00 0.72 H new ATOM 521 N ALA A1080 2.365 -9.252 3.723 1.00 0.72 N ATOM 522 CA ALA A1080 0.938 -9.352 4.025 1.00 0.73 C ATOM 523 C ALA A1080 0.114 -9.678 2.764 1.00 0.59 C ATOM 524 O ALA A1080 -0.660 -10.637 2.742 1.00 0.71 O ATOM 525 CB ALA A1080 0.496 -8.026 4.655 1.00 0.92 C ATOM 0 H ALA A1080 2.757 -8.330 3.916 1.00 0.72 H new ATOM 0 HA ALA A1080 0.764 -10.172 4.722 1.00 0.73 H new ATOM 0 HB1 ALA A1080 -0.567 -8.072 4.891 1.00 0.92 H new ATOM 0 HB2 ALA A1080 1.064 -7.850 5.569 1.00 0.92 H new ATOM 0 HB3 ALA A1080 0.677 -7.212 3.953 1.00 0.92 H new ATOM 531 N GLU A1081 0.335 -8.932 1.677 1.00 0.61 N ATOM 532 CA GLU A1081 -0.420 -9.081 0.427 1.00 0.72 C ATOM 533 C GLU A1081 -0.173 -10.441 -0.267 1.00 0.72 C ATOM 534 O GLU A1081 -1.038 -10.928 -0.996 1.00 0.86 O ATOM 535 CB GLU A1081 -0.095 -7.880 -0.472 1.00 1.05 C ATOM 536 CG GLU A1081 -1.077 -7.618 -1.623 1.00 1.30 C ATOM 537 CD GLU A1081 -2.555 -7.487 -1.233 1.00 1.18 C ATOM 538 OE1 GLU A1081 -2.888 -6.714 -0.313 1.00 2.07 O ATOM 539 OE2 GLU A1081 -3.389 -8.142 -1.904 1.00 1.96 O ATOM 0 H GLU A1081 1.047 -8.203 1.639 1.00 0.61 H new ATOM 0 HA GLU A1081 -1.487 -9.087 0.647 1.00 0.72 H new ATOM 0 HB2 GLU A1081 -0.049 -6.987 0.151 1.00 1.05 H new ATOM 0 HB3 GLU A1081 0.899 -8.026 -0.894 1.00 1.05 H new ATOM 0 HG2 GLU A1081 -0.774 -6.702 -2.131 1.00 1.30 H new ATOM 0 HG3 GLU A1081 -0.983 -8.429 -2.345 1.00 1.30 H new ATOM 546 N SER A1082 0.959 -11.106 0.016 1.00 0.66 N ATOM 547 CA SER A1082 1.266 -12.474 -0.440 1.00 0.72 C ATOM 548 C SER A1082 0.368 -13.555 0.173 1.00 0.70 C ATOM 549 O SER A1082 0.007 -14.506 -0.526 1.00 0.85 O ATOM 550 CB SER A1082 2.713 -12.857 -0.103 1.00 0.83 C ATOM 551 OG SER A1082 3.647 -12.038 -0.766 1.00 2.63 O ATOM 0 H SER A1082 1.704 -10.699 0.581 1.00 0.66 H new ATOM 0 HA SER A1082 1.093 -12.443 -1.516 1.00 0.72 H new ATOM 0 HB2 SER A1082 2.866 -12.782 0.974 1.00 0.83 H new ATOM 0 HB3 SER A1082 2.885 -13.898 -0.378 1.00 0.83 H new ATOM 0 HG SER A1082 3.767 -11.205 -0.263 1.00 2.63 H new ATOM 557 N ASN A1083 0.023 -13.426 1.461 1.00 0.79 N ATOM 558 CA ASN A1083 -0.809 -14.377 2.217 1.00 0.96 C ATOM 559 C ASN A1083 -2.302 -13.952 2.238 1.00 0.99 C ATOM 560 O ASN A1083 -3.190 -14.764 2.521 1.00 1.13 O ATOM 561 CB ASN A1083 -0.141 -14.570 3.593 1.00 1.47 C ATOM 562 CG ASN A1083 -0.744 -15.653 4.481 1.00 1.15 C ATOM 563 OD1 ASN A1083 -1.418 -16.579 4.052 1.00 2.51 O ATOM 564 ND2 ASN A1083 -0.471 -15.591 5.760 1.00 0.97 N ATOM 0 H ASN A1083 0.324 -12.632 2.026 1.00 0.79 H new ATOM 0 HA ASN A1083 -0.854 -15.353 1.734 1.00 0.96 H new ATOM 0 HB2 ASN A1083 0.912 -14.802 3.434 1.00 1.47 H new ATOM 0 HB3 ASN A1083 -0.181 -13.623 4.131 1.00 1.47 H new ATOM 0 HD21 ASN A1083 -0.820 -16.312 6.391 1.00 0.97 H new ATOM 0 HD22 ASN A1083 0.091 -14.822 6.125 1.00 0.97 H new ATOM 571 N SER A1084 -2.588 -12.696 1.878 1.00 1.11 N ATOM 572 CA SER A1084 -3.928 -12.185 1.546 1.00 1.17 C ATOM 573 C SER A1084 -4.443 -12.857 0.247 1.00 1.21 C ATOM 574 O SER A1084 -3.733 -13.636 -0.398 1.00 1.48 O ATOM 575 CB SER A1084 -3.826 -10.661 1.382 1.00 1.15 C ATOM 576 OG SER A1084 -5.077 -10.063 1.105 1.00 1.32 O ATOM 0 H SER A1084 -1.867 -11.978 1.806 1.00 1.11 H new ATOM 0 HA SER A1084 -4.639 -12.418 2.339 1.00 1.17 H new ATOM 0 HB2 SER A1084 -3.413 -10.227 2.293 1.00 1.15 H new ATOM 0 HB3 SER A1084 -3.130 -10.431 0.575 1.00 1.15 H new ATOM 0 HG SER A1084 -5.594 -9.988 1.934 1.00 1.32 H new ATOM 582 N GLU A1085 -5.680 -12.576 -0.166 1.00 1.15 N ATOM 583 CA GLU A1085 -6.328 -13.169 -1.352 1.00 1.25 C ATOM 584 C GLU A1085 -7.190 -12.164 -2.147 1.00 1.11 C ATOM 585 O GLU A1085 -8.339 -12.435 -2.513 1.00 1.43 O ATOM 586 CB GLU A1085 -7.049 -14.474 -0.973 1.00 1.62 C ATOM 587 CG GLU A1085 -8.081 -14.338 0.149 1.00 2.19 C ATOM 588 CD GLU A1085 -8.862 -15.645 0.294 1.00 2.81 C ATOM 589 OE1 GLU A1085 -8.294 -16.623 0.841 1.00 3.69 O ATOM 590 OE2 GLU A1085 -10.018 -15.694 -0.201 1.00 3.30 O ATOM 0 H GLU A1085 -6.280 -11.913 0.324 1.00 1.15 H new ATOM 0 HA GLU A1085 -5.547 -13.440 -2.063 1.00 1.25 H new ATOM 0 HB2 GLU A1085 -7.547 -14.867 -1.859 1.00 1.62 H new ATOM 0 HB3 GLU A1085 -6.303 -15.210 -0.673 1.00 1.62 H new ATOM 0 HG2 GLU A1085 -7.582 -14.096 1.087 1.00 2.19 H new ATOM 0 HG3 GLU A1085 -8.764 -13.517 -0.070 1.00 2.19 H new ATOM 597 N HIS A1086 -6.633 -10.979 -2.403 1.00 0.88 N ATOM 598 CA HIS A1086 -7.295 -9.862 -3.095 1.00 0.78 C ATOM 599 C HIS A1086 -7.037 -9.829 -4.622 1.00 0.81 C ATOM 600 O HIS A1086 -6.131 -10.512 -5.107 1.00 1.11 O ATOM 601 CB HIS A1086 -6.888 -8.558 -2.390 1.00 0.77 C ATOM 602 CG HIS A1086 -7.840 -8.199 -1.277 1.00 0.88 C ATOM 603 ND1 HIS A1086 -8.733 -7.151 -1.282 1.00 1.62 N ATOM 604 CD2 HIS A1086 -8.052 -8.905 -0.124 1.00 1.30 C ATOM 605 CE1 HIS A1086 -9.471 -7.232 -0.165 1.00 1.50 C ATOM 606 NE2 HIS A1086 -9.097 -8.291 0.575 1.00 1.24 N ATOM 0 H HIS A1086 -5.676 -10.759 -2.127 1.00 0.88 H new ATOM 0 HA HIS A1086 -8.374 -9.997 -3.025 1.00 0.78 H new ATOM 0 HB2 HIS A1086 -5.881 -8.663 -1.986 1.00 0.77 H new ATOM 0 HB3 HIS A1086 -6.857 -7.747 -3.117 1.00 0.77 H new ATOM 0 HD2 HIS A1086 -7.508 -9.783 0.191 1.00 1.30 H new ATOM 0 HE1 HIS A1086 -10.257 -6.542 0.103 1.00 1.50 H new ATOM 0 HE2 HIS A1086 -9.495 -8.587 1.466 1.00 1.24 H new ATOM 614 N PRO A1087 -7.820 -9.050 -5.405 1.00 0.77 N ATOM 615 CA PRO A1087 -7.699 -8.986 -6.870 1.00 0.91 C ATOM 616 C PRO A1087 -6.670 -7.959 -7.389 1.00 0.90 C ATOM 617 O PRO A1087 -6.148 -8.116 -8.495 1.00 1.20 O ATOM 618 CB PRO A1087 -9.110 -8.613 -7.344 1.00 1.10 C ATOM 619 CG PRO A1087 -9.632 -7.715 -6.223 1.00 0.94 C ATOM 620 CD PRO A1087 -9.042 -8.373 -4.976 1.00 0.82 C ATOM 0 HA PRO A1087 -7.331 -9.937 -7.255 1.00 0.91 H new ATOM 0 HB2 PRO A1087 -9.088 -8.091 -8.300 1.00 1.10 H new ATOM 0 HB3 PRO A1087 -9.736 -9.495 -7.477 1.00 1.10 H new ATOM 0 HG2 PRO A1087 -9.295 -6.685 -6.337 1.00 0.94 H new ATOM 0 HG3 PRO A1087 -10.721 -7.693 -6.194 1.00 0.94 H new ATOM 0 HD2 PRO A1087 -8.825 -7.629 -4.210 1.00 0.82 H new ATOM 0 HD3 PRO A1087 -9.746 -9.082 -4.541 1.00 0.82 H new ATOM 628 N LEU A1088 -6.391 -6.901 -6.615 1.00 0.73 N ATOM 629 CA LEU A1088 -5.623 -5.717 -7.039 1.00 0.81 C ATOM 630 C LEU A1088 -4.254 -5.629 -6.361 1.00 0.73 C ATOM 631 O LEU A1088 -3.237 -5.469 -7.034 1.00 0.86 O ATOM 632 CB LEU A1088 -6.534 -4.497 -6.781 1.00 0.95 C ATOM 633 CG LEU A1088 -6.041 -3.087 -7.154 1.00 0.67 C ATOM 634 CD1 LEU A1088 -7.242 -2.145 -7.209 1.00 0.63 C ATOM 635 CD2 LEU A1088 -5.090 -2.458 -6.133 1.00 0.77 C ATOM 0 H LEU A1088 -6.702 -6.842 -5.646 1.00 0.73 H new ATOM 0 HA LEU A1088 -5.368 -5.769 -8.097 1.00 0.81 H new ATOM 0 HB2 LEU A1088 -7.468 -4.668 -7.317 1.00 0.95 H new ATOM 0 HB3 LEU A1088 -6.774 -4.488 -5.718 1.00 0.95 H new ATOM 0 HG LEU A1088 -5.515 -3.208 -8.101 1.00 0.67 H new ATOM 0 HD11 LEU A1088 -6.906 -1.142 -7.472 1.00 0.63 H new ATOM 0 HD12 LEU A1088 -7.949 -2.500 -7.959 1.00 0.63 H new ATOM 0 HD13 LEU A1088 -7.730 -2.120 -6.235 1.00 0.63 H new ATOM 0 HD21 LEU A1088 -4.793 -1.467 -6.475 1.00 0.77 H new ATOM 0 HD22 LEU A1088 -5.594 -2.373 -5.170 1.00 0.77 H new ATOM 0 HD23 LEU A1088 -4.205 -3.085 -6.025 1.00 0.77 H new ATOM 647 N GLY A1089 -4.219 -5.783 -5.034 1.00 0.64 N ATOM 648 CA GLY A1089 -2.973 -5.735 -4.258 1.00 0.82 C ATOM 649 C GLY A1089 -1.914 -6.755 -4.711 1.00 0.87 C ATOM 650 O GLY A1089 -0.717 -6.497 -4.592 1.00 0.97 O ATOM 0 H GLY A1089 -5.051 -5.944 -4.467 1.00 0.64 H new ATOM 0 HA2 GLY A1089 -2.551 -4.733 -4.329 1.00 0.82 H new ATOM 0 HA3 GLY A1089 -3.204 -5.909 -3.207 1.00 0.82 H new ATOM 654 N THR A1090 -2.318 -7.857 -5.352 1.00 0.86 N ATOM 655 CA THR A1090 -1.404 -8.880 -5.890 1.00 0.96 C ATOM 656 C THR A1090 -0.424 -8.369 -6.955 1.00 0.90 C ATOM 657 O THR A1090 0.608 -9.008 -7.178 1.00 0.92 O ATOM 658 CB THR A1090 -2.166 -10.087 -6.441 1.00 1.12 C ATOM 659 OG1 THR A1090 -3.152 -9.689 -7.367 1.00 1.30 O ATOM 660 CG2 THR A1090 -2.835 -10.868 -5.317 1.00 1.38 C ATOM 0 H THR A1090 -3.302 -8.070 -5.516 1.00 0.86 H new ATOM 0 HA THR A1090 -0.805 -9.178 -5.030 1.00 0.96 H new ATOM 0 HB THR A1090 -1.437 -10.723 -6.943 1.00 1.12 H new ATOM 0 HG1 THR A1090 -3.622 -10.480 -7.704 1.00 1.30 H new ATOM 0 HG21 THR A1090 -3.370 -11.721 -5.735 1.00 1.38 H new ATOM 0 HG22 THR A1090 -2.077 -11.222 -4.619 1.00 1.38 H new ATOM 0 HG23 THR A1090 -3.538 -10.221 -4.792 1.00 1.38 H new ATOM 668 N ALA A1091 -0.668 -7.206 -7.568 1.00 0.87 N ATOM 669 CA ALA A1091 0.331 -6.542 -8.408 1.00 0.89 C ATOM 670 C ALA A1091 1.554 -6.088 -7.578 1.00 0.80 C ATOM 671 O ALA A1091 2.698 -6.220 -8.016 1.00 0.80 O ATOM 672 CB ALA A1091 -0.352 -5.364 -9.112 1.00 0.93 C ATOM 0 H ALA A1091 -1.553 -6.704 -7.497 1.00 0.87 H new ATOM 0 HA ALA A1091 0.716 -7.238 -9.153 1.00 0.89 H new ATOM 0 HB1 ALA A1091 0.371 -4.850 -9.746 1.00 0.93 H new ATOM 0 HB2 ALA A1091 -1.174 -5.734 -9.725 1.00 0.93 H new ATOM 0 HB3 ALA A1091 -0.739 -4.669 -8.366 1.00 0.93 H new ATOM 678 N ILE A1092 1.325 -5.628 -6.341 1.00 0.73 N ATOM 679 CA ILE A1092 2.377 -5.273 -5.374 1.00 0.68 C ATOM 680 C ILE A1092 3.091 -6.538 -4.880 1.00 0.64 C ATOM 681 O ILE A1092 4.317 -6.546 -4.773 1.00 0.64 O ATOM 682 CB ILE A1092 1.826 -4.471 -4.167 1.00 0.65 C ATOM 683 CG1 ILE A1092 0.851 -3.343 -4.568 1.00 0.72 C ATOM 684 CG2 ILE A1092 3.003 -3.860 -3.391 1.00 0.70 C ATOM 685 CD1 ILE A1092 0.128 -2.695 -3.382 1.00 0.89 C ATOM 0 H ILE A1092 0.383 -5.489 -5.975 1.00 0.73 H new ATOM 0 HA ILE A1092 3.086 -4.630 -5.895 1.00 0.68 H new ATOM 0 HB ILE A1092 1.262 -5.174 -3.554 1.00 0.65 H new ATOM 0 HG12 ILE A1092 1.403 -2.574 -5.108 1.00 0.72 H new ATOM 0 HG13 ILE A1092 0.109 -3.746 -5.257 1.00 0.72 H new ATOM 0 HG21 ILE A1092 2.623 -3.294 -2.540 1.00 0.70 H new ATOM 0 HG22 ILE A1092 3.656 -4.656 -3.035 1.00 0.70 H new ATOM 0 HG23 ILE A1092 3.565 -3.195 -4.047 1.00 0.70 H new ATOM 0 HD11 ILE A1092 -0.538 -1.913 -3.745 1.00 0.89 H new ATOM 0 HD12 ILE A1092 -0.454 -3.450 -2.854 1.00 0.89 H new ATOM 0 HD13 ILE A1092 0.861 -2.260 -2.702 1.00 0.89 H new ATOM 697 N THR A1093 2.353 -7.631 -4.644 1.00 0.65 N ATOM 698 CA THR A1093 2.936 -8.952 -4.326 1.00 0.63 C ATOM 699 C THR A1093 3.976 -9.375 -5.363 1.00 0.64 C ATOM 700 O THR A1093 5.091 -9.735 -4.988 1.00 0.58 O ATOM 701 CB THR A1093 1.857 -10.039 -4.216 1.00 0.81 C ATOM 702 OG1 THR A1093 1.007 -9.709 -3.153 1.00 1.11 O ATOM 703 CG2 THR A1093 2.414 -11.422 -3.915 1.00 1.11 C ATOM 0 H THR A1093 1.333 -7.630 -4.667 1.00 0.65 H new ATOM 0 HA THR A1093 3.426 -8.845 -3.358 1.00 0.63 H new ATOM 0 HB THR A1093 1.353 -10.076 -5.182 1.00 0.81 H new ATOM 0 HG1 THR A1093 0.309 -10.392 -3.068 1.00 1.11 H new ATOM 0 HG21 THR A1093 1.595 -12.138 -3.852 1.00 1.11 H new ATOM 0 HG22 THR A1093 3.096 -11.721 -4.711 1.00 1.11 H new ATOM 0 HG23 THR A1093 2.951 -11.400 -2.967 1.00 1.11 H new ATOM 711 N LYS A1094 3.656 -9.270 -6.661 1.00 0.72 N ATOM 712 CA LYS A1094 4.592 -9.581 -7.751 1.00 0.75 C ATOM 713 C LYS A1094 5.795 -8.639 -7.768 1.00 0.72 C ATOM 714 O LYS A1094 6.933 -9.112 -7.769 1.00 0.73 O ATOM 715 CB LYS A1094 3.829 -9.578 -9.083 1.00 0.85 C ATOM 716 CG LYS A1094 4.769 -9.822 -10.275 1.00 0.81 C ATOM 717 CD LYS A1094 4.023 -10.561 -11.390 1.00 0.91 C ATOM 718 CE LYS A1094 4.973 -10.929 -12.529 1.00 2.02 C ATOM 719 NZ LYS A1094 4.366 -11.962 -13.395 1.00 2.32 N ATOM 0 H LYS A1094 2.738 -8.966 -6.985 1.00 0.72 H new ATOM 0 HA LYS A1094 5.007 -10.575 -7.586 1.00 0.75 H new ATOM 0 HB2 LYS A1094 3.058 -10.349 -9.063 1.00 0.85 H new ATOM 0 HB3 LYS A1094 3.321 -8.622 -9.210 1.00 0.85 H new ATOM 0 HG2 LYS A1094 5.149 -8.871 -10.649 1.00 0.81 H new ATOM 0 HG3 LYS A1094 5.632 -10.406 -9.954 1.00 0.81 H new ATOM 0 HD2 LYS A1094 3.562 -11.464 -10.989 1.00 0.91 H new ATOM 0 HD3 LYS A1094 3.217 -9.934 -11.771 1.00 0.91 H new ATOM 0 HE2 LYS A1094 5.205 -10.042 -13.118 1.00 2.02 H new ATOM 0 HE3 LYS A1094 5.915 -11.295 -12.121 1.00 2.02 H new ATOM 0 HZ1 LYS A1094 5.024 -12.201 -14.164 1.00 2.32 H new ATOM 0 HZ2 LYS A1094 4.167 -12.814 -12.832 1.00 2.32 H new ATOM 0 HZ3 LYS A1094 3.479 -11.599 -13.799 1.00 2.32 H new ATOM 733 N TYR A1095 5.545 -7.330 -7.710 1.00 0.72 N ATOM 734 CA TYR A1095 6.582 -6.294 -7.671 1.00 0.75 C ATOM 735 C TYR A1095 7.586 -6.541 -6.528 1.00 0.69 C ATOM 736 O TYR A1095 8.796 -6.442 -6.731 1.00 0.77 O ATOM 737 CB TYR A1095 5.875 -4.933 -7.532 1.00 0.75 C ATOM 738 CG TYR A1095 6.732 -3.678 -7.601 1.00 0.80 C ATOM 739 CD1 TYR A1095 7.611 -3.352 -6.546 1.00 1.70 C ATOM 740 CD2 TYR A1095 6.572 -2.775 -8.672 1.00 1.68 C ATOM 741 CE1 TYR A1095 8.336 -2.147 -6.573 1.00 1.76 C ATOM 742 CE2 TYR A1095 7.268 -1.550 -8.684 1.00 1.80 C ATOM 743 CZ TYR A1095 8.155 -1.236 -7.633 1.00 1.10 C ATOM 744 OH TYR A1095 8.815 -0.049 -7.615 1.00 1.33 O ATOM 0 H TYR A1095 4.598 -6.951 -7.688 1.00 0.72 H new ATOM 0 HA TYR A1095 7.169 -6.313 -8.589 1.00 0.75 H new ATOM 0 HB2 TYR A1095 5.120 -4.866 -8.315 1.00 0.75 H new ATOM 0 HB3 TYR A1095 5.347 -4.926 -6.579 1.00 0.75 H new ATOM 0 HD1 TYR A1095 7.727 -4.031 -5.714 1.00 1.70 H new ATOM 0 HD2 TYR A1095 5.911 -3.024 -9.489 1.00 1.68 H new ATOM 0 HE1 TYR A1095 9.033 -1.919 -5.780 1.00 1.76 H new ATOM 0 HE2 TYR A1095 7.123 -0.853 -9.496 1.00 1.80 H new ATOM 0 HH TYR A1095 8.584 0.466 -8.416 1.00 1.33 H new ATOM 754 N CYS A1096 7.087 -6.916 -5.344 1.00 0.60 N ATOM 755 CA CYS A1096 7.880 -7.258 -4.166 1.00 0.59 C ATOM 756 C CYS A1096 8.626 -8.592 -4.340 1.00 0.59 C ATOM 757 O CYS A1096 9.847 -8.617 -4.223 1.00 0.63 O ATOM 758 CB CYS A1096 6.941 -7.249 -2.949 1.00 0.57 C ATOM 759 SG CYS A1096 7.875 -7.484 -1.411 1.00 1.66 S ATOM 0 H CYS A1096 6.083 -6.991 -5.178 1.00 0.60 H new ATOM 0 HA CYS A1096 8.667 -6.520 -4.015 1.00 0.59 H new ATOM 0 HB2 CYS A1096 6.399 -6.304 -2.910 1.00 0.57 H new ATOM 0 HB3 CYS A1096 6.197 -8.039 -3.052 1.00 0.57 H new ATOM 0 HG CYS A1096 7.625 -6.501 -0.597 1.00 1.66 H new ATOM 765 N LYS A1097 7.947 -9.696 -4.684 1.00 0.57 N ATOM 766 CA LYS A1097 8.573 -11.030 -4.802 1.00 0.62 C ATOM 767 C LYS A1097 9.719 -11.034 -5.823 1.00 0.66 C ATOM 768 O LYS A1097 10.785 -11.572 -5.523 1.00 0.80 O ATOM 769 CB LYS A1097 7.472 -12.064 -5.120 1.00 0.60 C ATOM 770 CG LYS A1097 7.835 -13.558 -4.975 1.00 1.01 C ATOM 771 CD LYS A1097 8.838 -14.101 -6.005 1.00 1.25 C ATOM 772 CE LYS A1097 8.600 -15.589 -6.292 1.00 2.25 C ATOM 773 NZ LYS A1097 9.508 -16.071 -7.357 1.00 3.44 N ATOM 0 H LYS A1097 6.948 -9.694 -4.889 1.00 0.57 H new ATOM 0 HA LYS A1097 9.039 -11.305 -3.856 1.00 0.62 H new ATOM 0 HB2 LYS A1097 6.621 -11.860 -4.470 1.00 0.60 H new ATOM 0 HB3 LYS A1097 7.139 -11.897 -6.144 1.00 0.60 H new ATOM 0 HG2 LYS A1097 8.243 -13.719 -3.977 1.00 1.01 H new ATOM 0 HG3 LYS A1097 6.919 -14.144 -5.043 1.00 1.01 H new ATOM 0 HD2 LYS A1097 8.753 -13.533 -6.931 1.00 1.25 H new ATOM 0 HD3 LYS A1097 9.854 -13.959 -5.635 1.00 1.25 H new ATOM 0 HE2 LYS A1097 8.758 -16.169 -5.383 1.00 2.25 H new ATOM 0 HE3 LYS A1097 7.564 -15.745 -6.593 1.00 2.25 H new ATOM 0 HZ1 LYS A1097 9.330 -17.080 -7.535 1.00 3.44 H new ATOM 0 HZ2 LYS A1097 9.338 -15.530 -8.229 1.00 3.44 H new ATOM 0 HZ3 LYS A1097 10.495 -15.942 -7.056 1.00 3.44 H new ATOM 787 N GLN A1098 9.543 -10.386 -6.977 1.00 0.61 N ATOM 788 CA GLN A1098 10.580 -10.270 -8.011 1.00 0.65 C ATOM 789 C GLN A1098 11.746 -9.346 -7.594 1.00 0.67 C ATOM 790 O GLN A1098 12.895 -9.626 -7.947 1.00 0.73 O ATOM 791 CB GLN A1098 9.893 -9.855 -9.329 1.00 0.68 C ATOM 792 CG GLN A1098 10.811 -9.572 -10.534 1.00 0.89 C ATOM 793 CD GLN A1098 11.632 -10.751 -11.057 1.00 2.36 C ATOM 794 OE1 GLN A1098 11.724 -11.826 -10.474 1.00 3.67 O ATOM 795 NE2 GLN A1098 12.294 -10.596 -12.179 1.00 2.72 N ATOM 0 H GLN A1098 8.669 -9.922 -7.224 1.00 0.61 H new ATOM 0 HA GLN A1098 11.065 -11.235 -8.158 1.00 0.65 H new ATOM 0 HB2 GLN A1098 9.196 -10.644 -9.611 1.00 0.68 H new ATOM 0 HB3 GLN A1098 9.301 -8.960 -9.136 1.00 0.68 H new ATOM 0 HG2 GLN A1098 10.195 -9.196 -11.351 1.00 0.89 H new ATOM 0 HG3 GLN A1098 11.499 -8.773 -10.259 1.00 0.89 H new ATOM 0 HE21 GLN A1098 12.237 -9.713 -12.687 1.00 2.72 H new ATOM 0 HE22 GLN A1098 12.865 -11.358 -12.544 1.00 2.72 H new ATOM 804 N GLU A1099 11.496 -8.300 -6.795 1.00 0.67 N ATOM 805 CA GLU A1099 12.537 -7.457 -6.179 1.00 0.74 C ATOM 806 C GLU A1099 13.339 -8.227 -5.112 1.00 0.76 C ATOM 807 O GLU A1099 14.571 -8.226 -5.154 1.00 0.83 O ATOM 808 CB GLU A1099 11.882 -6.180 -5.613 1.00 0.76 C ATOM 809 CG GLU A1099 12.840 -5.166 -4.968 1.00 0.88 C ATOM 810 CD GLU A1099 13.749 -4.455 -5.980 1.00 1.02 C ATOM 811 OE1 GLU A1099 13.246 -3.638 -6.794 1.00 1.89 O ATOM 812 OE2 GLU A1099 14.984 -4.646 -5.916 1.00 1.86 O ATOM 0 H GLU A1099 10.549 -8.008 -6.553 1.00 0.67 H new ATOM 0 HA GLU A1099 13.261 -7.168 -6.940 1.00 0.74 H new ATOM 0 HB2 GLU A1099 11.345 -5.681 -6.420 1.00 0.76 H new ATOM 0 HB3 GLU A1099 11.140 -6.474 -4.870 1.00 0.76 H new ATOM 0 HG2 GLU A1099 12.257 -4.420 -4.428 1.00 0.88 H new ATOM 0 HG3 GLU A1099 13.460 -5.680 -4.233 1.00 0.88 H new ATOM 819 N LEU A1100 12.670 -8.927 -4.187 1.00 0.74 N ATOM 820 CA LEU A1100 13.315 -9.679 -3.100 1.00 0.83 C ATOM 821 C LEU A1100 14.041 -10.949 -3.574 1.00 0.89 C ATOM 822 O LEU A1100 15.031 -11.351 -2.958 1.00 1.01 O ATOM 823 CB LEU A1100 12.287 -10.029 -2.001 1.00 0.84 C ATOM 824 CG LEU A1100 11.550 -8.845 -1.339 1.00 0.87 C ATOM 825 CD1 LEU A1100 10.864 -9.311 -0.053 1.00 0.93 C ATOM 826 CD2 LEU A1100 12.463 -7.669 -1.014 1.00 0.95 C ATOM 0 H LEU A1100 11.652 -8.989 -4.171 1.00 0.74 H new ATOM 0 HA LEU A1100 14.083 -9.022 -2.692 1.00 0.83 H new ATOM 0 HB2 LEU A1100 11.541 -10.696 -2.433 1.00 0.84 H new ATOM 0 HB3 LEU A1100 12.801 -10.589 -1.220 1.00 0.84 H new ATOM 0 HG LEU A1100 10.818 -8.496 -2.067 1.00 0.87 H new ATOM 0 HD11 LEU A1100 10.346 -8.470 0.408 1.00 0.93 H new ATOM 0 HD12 LEU A1100 10.145 -10.095 -0.288 1.00 0.93 H new ATOM 0 HD13 LEU A1100 11.612 -9.700 0.638 1.00 0.93 H new ATOM 0 HD21 LEU A1100 11.880 -6.873 -0.551 1.00 0.95 H new ATOM 0 HD22 LEU A1100 13.244 -7.994 -0.326 1.00 0.95 H new ATOM 0 HD23 LEU A1100 12.919 -7.298 -1.932 1.00 0.95 H new ATOM 838 N ASP A1101 13.543 -11.590 -4.637 1.00 0.97 N ATOM 839 CA ASP A1101 14.065 -12.833 -5.230 1.00 1.12 C ATOM 840 C ASP A1101 14.221 -13.989 -4.211 1.00 1.21 C ATOM 841 O ASP A1101 15.094 -14.843 -4.334 1.00 1.21 O ATOM 842 CB ASP A1101 15.327 -12.510 -6.059 1.00 1.20 C ATOM 843 CG ASP A1101 15.815 -13.670 -6.935 1.00 1.55 C ATOM 844 OD1 ASP A1101 14.976 -14.419 -7.492 1.00 2.65 O ATOM 845 OD2 ASP A1101 17.049 -13.830 -7.101 1.00 2.44 O ATOM 0 H ASP A1101 12.724 -11.241 -5.134 1.00 0.97 H new ATOM 0 HA ASP A1101 13.323 -13.237 -5.919 1.00 1.12 H new ATOM 0 HB2 ASP A1101 15.120 -11.650 -6.696 1.00 1.20 H new ATOM 0 HB3 ASP A1101 16.129 -12.219 -5.381 1.00 1.20 H new ATOM 850 N THR A1102 13.383 -14.009 -3.169 1.00 1.50 N ATOM 851 CA THR A1102 13.541 -14.884 -1.989 1.00 1.87 C ATOM 852 C THR A1102 12.687 -16.162 -1.998 1.00 2.27 C ATOM 853 O THR A1102 13.031 -17.119 -1.313 1.00 4.03 O ATOM 854 CB THR A1102 13.310 -14.044 -0.718 1.00 1.80 C ATOM 855 OG1 THR A1102 13.690 -14.725 0.455 1.00 2.35 O ATOM 856 CG2 THR A1102 11.841 -13.659 -0.518 1.00 1.50 C ATOM 0 H THR A1102 12.560 -13.409 -3.115 1.00 1.50 H new ATOM 0 HA THR A1102 14.561 -15.268 -2.015 1.00 1.87 H new ATOM 0 HB THR A1102 13.925 -13.158 -0.876 1.00 1.80 H new ATOM 0 HG1 THR A1102 12.945 -15.279 0.768 1.00 2.35 H new ATOM 0 HG21 THR A1102 11.740 -13.069 0.393 1.00 1.50 H new ATOM 0 HG22 THR A1102 11.499 -13.072 -1.371 1.00 1.50 H new ATOM 0 HG23 THR A1102 11.236 -14.562 -0.434 1.00 1.50 H new ATOM 864 N GLU A1103 11.592 -16.218 -2.764 1.00 1.43 N ATOM 865 CA GLU A1103 10.615 -17.335 -2.834 1.00 1.55 C ATOM 866 C GLU A1103 10.011 -17.826 -1.485 1.00 1.73 C ATOM 867 O GLU A1103 9.514 -18.951 -1.380 1.00 2.52 O ATOM 868 CB GLU A1103 11.159 -18.483 -3.715 1.00 1.68 C ATOM 869 CG GLU A1103 10.036 -19.159 -4.518 1.00 1.90 C ATOM 870 CD GLU A1103 10.538 -20.356 -5.335 1.00 2.15 C ATOM 871 OE1 GLU A1103 11.261 -20.145 -6.338 1.00 2.88 O ATOM 872 OE2 GLU A1103 10.210 -21.519 -4.988 1.00 2.55 O ATOM 0 H GLU A1103 11.341 -15.451 -3.388 1.00 1.43 H new ATOM 0 HA GLU A1103 9.739 -16.904 -3.318 1.00 1.55 H new ATOM 0 HB2 GLU A1103 11.912 -18.092 -4.399 1.00 1.68 H new ATOM 0 HB3 GLU A1103 11.653 -19.223 -3.086 1.00 1.68 H new ATOM 0 HG2 GLU A1103 9.254 -19.491 -3.835 1.00 1.90 H new ATOM 0 HG3 GLU A1103 9.583 -18.429 -5.189 1.00 1.90 H new ATOM 879 N THR A1104 10.056 -17.009 -0.425 1.00 1.45 N ATOM 880 CA THR A1104 9.702 -17.400 0.965 1.00 1.75 C ATOM 881 C THR A1104 8.867 -16.366 1.733 1.00 1.41 C ATOM 882 O THR A1104 8.543 -16.581 2.905 1.00 2.47 O ATOM 883 CB THR A1104 10.973 -17.655 1.793 1.00 2.47 C ATOM 884 OG1 THR A1104 11.786 -16.508 1.756 1.00 3.57 O ATOM 885 CG2 THR A1104 11.795 -18.831 1.292 1.00 1.78 C ATOM 0 H THR A1104 10.345 -16.034 -0.501 1.00 1.45 H new ATOM 0 HA THR A1104 9.096 -18.298 0.844 1.00 1.75 H new ATOM 0 HB THR A1104 10.642 -17.890 2.805 1.00 2.47 H new ATOM 0 HG1 THR A1104 12.597 -16.665 2.284 1.00 3.57 H new ATOM 0 HG21 THR A1104 12.676 -18.954 1.922 1.00 1.78 H new ATOM 0 HG22 THR A1104 11.193 -19.739 1.330 1.00 1.78 H new ATOM 0 HG23 THR A1104 12.107 -18.646 0.264 1.00 1.78 H new ATOM 893 N LEU A1105 8.526 -15.229 1.120 1.00 1.06 N ATOM 894 CA LEU A1105 7.935 -14.088 1.830 1.00 0.70 C ATOM 895 C LEU A1105 6.494 -14.351 2.323 1.00 0.59 C ATOM 896 O LEU A1105 5.776 -15.181 1.754 1.00 0.83 O ATOM 897 CB LEU A1105 8.101 -12.802 0.985 1.00 0.70 C ATOM 898 CG LEU A1105 6.900 -12.378 0.121 1.00 0.67 C ATOM 899 CD1 LEU A1105 7.005 -10.904 -0.261 1.00 0.72 C ATOM 900 CD2 LEU A1105 6.842 -13.228 -1.144 1.00 0.86 C ATOM 0 H LEU A1105 8.651 -15.072 0.120 1.00 1.06 H new ATOM 0 HA LEU A1105 8.487 -13.936 2.758 1.00 0.70 H new ATOM 0 HB2 LEU A1105 8.340 -11.981 1.660 1.00 0.70 H new ATOM 0 HB3 LEU A1105 8.961 -12.936 0.329 1.00 0.70 H new ATOM 0 HG LEU A1105 5.990 -12.527 0.702 1.00 0.67 H new ATOM 0 HD11 LEU A1105 6.146 -10.624 -0.872 1.00 0.72 H new ATOM 0 HD12 LEU A1105 7.022 -10.294 0.642 1.00 0.72 H new ATOM 0 HD13 LEU A1105 7.922 -10.739 -0.827 1.00 0.72 H new ATOM 0 HD21 LEU A1105 5.989 -12.921 -1.750 1.00 0.86 H new ATOM 0 HD22 LEU A1105 7.760 -13.093 -1.716 1.00 0.86 H new ATOM 0 HD23 LEU A1105 6.735 -14.278 -0.872 1.00 0.86 H new ATOM 912 N GLY A1106 6.048 -13.601 3.336 1.00 0.60 N ATOM 913 CA GLY A1106 4.669 -13.635 3.835 1.00 0.89 C ATOM 914 C GLY A1106 4.363 -14.736 4.854 1.00 0.81 C ATOM 915 O GLY A1106 4.647 -15.920 4.645 1.00 1.09 O ATOM 0 H GLY A1106 6.643 -12.944 3.840 1.00 0.60 H new ATOM 0 HA2 GLY A1106 4.442 -12.671 4.289 1.00 0.89 H new ATOM 0 HA3 GLY A1106 3.997 -13.754 2.985 1.00 0.89 H new ATOM 919 N THR A1107 3.737 -14.316 5.952 1.00 0.78 N ATOM 920 CA THR A1107 3.377 -15.093 7.147 1.00 0.88 C ATOM 921 C THR A1107 2.019 -14.579 7.679 1.00 1.11 C ATOM 922 O THR A1107 1.339 -13.815 6.991 1.00 2.58 O ATOM 923 CB THR A1107 4.497 -15.003 8.214 1.00 1.03 C ATOM 924 OG1 THR A1107 5.779 -14.838 7.646 1.00 1.53 O ATOM 925 CG2 THR A1107 4.597 -16.271 9.052 1.00 0.99 C ATOM 0 H THR A1107 3.442 -13.344 6.041 1.00 0.78 H new ATOM 0 HA THR A1107 3.274 -16.148 6.895 1.00 0.88 H new ATOM 0 HB THR A1107 4.217 -14.140 8.817 1.00 1.03 H new ATOM 0 HG1 THR A1107 5.972 -13.882 7.545 1.00 1.53 H new ATOM 0 HG21 THR A1107 5.396 -16.160 9.786 1.00 0.99 H new ATOM 0 HG22 THR A1107 3.652 -16.442 9.567 1.00 0.99 H new ATOM 0 HG23 THR A1107 4.815 -17.119 8.403 1.00 0.99 H new ATOM 933 N CYS A1108 1.578 -14.991 8.869 1.00 0.90 N ATOM 934 CA CYS A1108 0.217 -14.770 9.378 1.00 0.90 C ATOM 935 C CYS A1108 -0.220 -13.292 9.533 1.00 0.94 C ATOM 936 O CYS A1108 0.499 -12.477 10.125 1.00 1.46 O ATOM 937 CB CYS A1108 0.117 -15.554 10.696 1.00 1.38 C ATOM 938 SG CYS A1108 -1.562 -15.527 11.383 1.00 1.72 S ATOM 0 H CYS A1108 2.170 -15.501 9.525 1.00 0.90 H new ATOM 0 HA CYS A1108 -0.491 -15.129 8.631 1.00 0.90 H new ATOM 0 HB2 CYS A1108 0.422 -16.587 10.527 1.00 1.38 H new ATOM 0 HB3 CYS A1108 0.812 -15.131 11.422 1.00 1.38 H new ATOM 0 HG CYS A1108 -1.588 -16.205 12.492 1.00 1.72 H new ATOM 944 N ILE A1109 -1.431 -12.983 9.028 1.00 0.67 N ATOM 945 CA ILE A1109 -2.177 -11.733 9.215 1.00 0.86 C ATOM 946 C ILE A1109 -3.547 -11.860 9.905 1.00 0.83 C ATOM 947 O ILE A1109 -4.296 -12.824 9.729 1.00 0.96 O ATOM 948 CB ILE A1109 -2.408 -10.945 7.896 1.00 1.25 C ATOM 949 CG1 ILE A1109 -2.886 -11.767 6.681 1.00 1.85 C ATOM 950 CG2 ILE A1109 -1.210 -10.066 7.562 1.00 2.96 C ATOM 951 CD1 ILE A1109 -1.787 -12.296 5.751 1.00 2.63 C ATOM 0 H ILE A1109 -1.942 -13.644 8.443 1.00 0.67 H new ATOM 0 HA ILE A1109 -1.506 -11.193 9.883 1.00 0.86 H new ATOM 0 HB ILE A1109 -3.267 -10.310 8.113 1.00 1.25 H new ATOM 0 HG12 ILE A1109 -3.464 -12.616 7.047 1.00 1.85 H new ATOM 0 HG13 ILE A1109 -3.565 -11.148 6.094 1.00 1.85 H new ATOM 0 HG21 ILE A1109 -1.401 -9.527 6.634 1.00 2.96 H new ATOM 0 HG22 ILE A1109 -1.046 -9.352 8.369 1.00 2.96 H new ATOM 0 HG23 ILE A1109 -0.323 -10.689 7.444 1.00 2.96 H new ATOM 0 HD11 ILE A1109 -2.241 -12.858 4.934 1.00 2.63 H new ATOM 0 HD12 ILE A1109 -1.220 -11.458 5.345 1.00 2.63 H new ATOM 0 HD13 ILE A1109 -1.118 -12.948 6.312 1.00 2.63 H new ATOM 963 N ASP A1110 -3.897 -10.800 10.632 1.00 0.99 N ATOM 964 CA ASP A1110 -5.262 -10.478 11.071 1.00 0.92 C ATOM 965 C ASP A1110 -5.848 -9.571 9.964 1.00 0.93 C ATOM 966 O ASP A1110 -5.099 -8.780 9.400 1.00 2.22 O ATOM 967 CB ASP A1110 -5.230 -9.772 12.437 1.00 1.11 C ATOM 968 CG ASP A1110 -6.541 -9.042 12.744 1.00 1.79 C ATOM 969 OD1 ASP A1110 -7.598 -9.688 12.561 1.00 2.46 O ATOM 970 OD2 ASP A1110 -6.485 -7.823 13.044 1.00 2.96 O ATOM 0 H ASP A1110 -3.213 -10.112 10.946 1.00 0.99 H new ATOM 0 HA ASP A1110 -5.877 -11.368 11.207 1.00 0.92 H new ATOM 0 HB2 ASP A1110 -5.034 -10.506 13.219 1.00 1.11 H new ATOM 0 HB3 ASP A1110 -4.406 -9.058 12.456 1.00 1.11 H new ATOM 975 N PHE A1111 -7.137 -9.667 9.630 1.00 1.23 N ATOM 976 CA PHE A1111 -7.772 -9.032 8.457 1.00 1.05 C ATOM 977 C PHE A1111 -8.934 -8.094 8.851 1.00 1.04 C ATOM 978 O PHE A1111 -9.821 -8.489 9.605 1.00 1.42 O ATOM 979 CB PHE A1111 -8.306 -10.147 7.528 1.00 1.70 C ATOM 980 CG PHE A1111 -7.637 -10.362 6.180 1.00 1.09 C ATOM 981 CD1 PHE A1111 -7.756 -9.389 5.167 1.00 1.89 C ATOM 982 CD2 PHE A1111 -7.076 -11.619 5.865 1.00 2.15 C ATOM 983 CE1 PHE A1111 -7.425 -9.714 3.839 1.00 2.47 C ATOM 984 CE2 PHE A1111 -6.726 -11.932 4.543 1.00 2.78 C ATOM 985 CZ PHE A1111 -6.940 -10.993 3.525 1.00 2.59 C ATOM 0 H PHE A1111 -7.799 -10.209 10.186 1.00 1.23 H new ATOM 0 HA PHE A1111 -7.022 -8.422 7.954 1.00 1.05 H new ATOM 0 HB2 PHE A1111 -8.252 -11.087 8.077 1.00 1.70 H new ATOM 0 HB3 PHE A1111 -9.361 -9.946 7.344 1.00 1.70 H new ATOM 0 HD1 PHE A1111 -8.101 -8.395 5.410 1.00 1.89 H new ATOM 0 HD2 PHE A1111 -6.915 -12.345 6.648 1.00 2.15 H new ATOM 0 HE1 PHE A1111 -7.544 -8.977 3.059 1.00 2.47 H new ATOM 0 HE2 PHE A1111 -6.293 -12.894 4.311 1.00 2.78 H new ATOM 0 HZ PHE A1111 -6.732 -11.254 2.498 1.00 2.59 H new ATOM 995 N GLN A1112 -8.976 -6.872 8.307 1.00 0.77 N ATOM 996 CA GLN A1112 -10.092 -5.914 8.369 1.00 0.78 C ATOM 997 C GLN A1112 -10.348 -5.337 6.964 1.00 0.72 C ATOM 998 O GLN A1112 -9.633 -4.441 6.518 1.00 0.76 O ATOM 999 CB GLN A1112 -9.799 -4.787 9.383 1.00 0.83 C ATOM 1000 CG GLN A1112 -10.064 -5.167 10.852 1.00 0.94 C ATOM 1001 CD GLN A1112 -8.801 -5.316 11.695 1.00 1.54 C ATOM 1002 OE1 GLN A1112 -8.597 -4.626 12.688 1.00 3.16 O ATOM 1003 NE2 GLN A1112 -7.917 -6.217 11.338 1.00 0.85 N ATOM 0 H GLN A1112 -8.186 -6.501 7.780 1.00 0.77 H new ATOM 0 HA GLN A1112 -10.987 -6.434 8.710 1.00 0.78 H new ATOM 0 HB2 GLN A1112 -8.757 -4.485 9.281 1.00 0.83 H new ATOM 0 HB3 GLN A1112 -10.408 -3.919 9.129 1.00 0.83 H new ATOM 0 HG2 GLN A1112 -10.701 -4.407 11.303 1.00 0.94 H new ATOM 0 HG3 GLN A1112 -10.619 -6.105 10.879 1.00 0.94 H new ATOM 0 HE21 GLN A1112 -8.081 -6.794 10.513 1.00 0.85 H new ATOM 0 HE22 GLN A1112 -7.065 -6.341 11.885 1.00 0.85 H new ATOM 1012 N VAL A1113 -11.345 -5.861 6.243 1.00 0.72 N ATOM 1013 CA VAL A1113 -11.566 -5.562 4.810 1.00 0.74 C ATOM 1014 C VAL A1113 -12.700 -4.557 4.569 1.00 0.77 C ATOM 1015 O VAL A1113 -13.692 -4.549 5.301 1.00 0.90 O ATOM 1016 CB VAL A1113 -11.817 -6.847 3.989 1.00 0.83 C ATOM 1017 CG1 VAL A1113 -10.625 -7.805 4.074 1.00 2.46 C ATOM 1018 CG2 VAL A1113 -13.071 -7.621 4.415 1.00 1.93 C ATOM 0 H VAL A1113 -12.029 -6.509 6.633 1.00 0.72 H new ATOM 0 HA VAL A1113 -10.642 -5.097 4.466 1.00 0.74 H new ATOM 0 HB VAL A1113 -11.963 -6.494 2.968 1.00 0.83 H new ATOM 0 HG11 VAL A1113 -10.834 -8.699 3.486 1.00 2.46 H new ATOM 0 HG12 VAL A1113 -9.734 -7.313 3.683 1.00 2.46 H new ATOM 0 HG13 VAL A1113 -10.457 -8.086 5.114 1.00 2.46 H new ATOM 0 HG21 VAL A1113 -13.179 -8.509 3.793 1.00 1.93 H new ATOM 0 HG22 VAL A1113 -12.978 -7.919 5.459 1.00 1.93 H new ATOM 0 HG23 VAL A1113 -13.949 -6.986 4.296 1.00 1.93 H new ATOM 1028 N VAL A1114 -12.607 -3.742 3.510 1.00 0.74 N ATOM 1029 CA VAL A1114 -13.701 -2.893 2.997 1.00 0.85 C ATOM 1030 C VAL A1114 -13.762 -3.077 1.470 1.00 0.87 C ATOM 1031 O VAL A1114 -12.824 -2.650 0.786 1.00 0.97 O ATOM 1032 CB VAL A1114 -13.504 -1.400 3.349 1.00 1.08 C ATOM 1033 CG1 VAL A1114 -14.742 -0.591 2.948 1.00 1.23 C ATOM 1034 CG2 VAL A1114 -13.243 -1.178 4.844 1.00 1.25 C ATOM 0 H VAL A1114 -11.747 -3.649 2.969 1.00 0.74 H new ATOM 0 HA VAL A1114 -14.636 -3.199 3.467 1.00 0.85 H new ATOM 0 HB VAL A1114 -12.628 -1.065 2.793 1.00 1.08 H new ATOM 0 HG11 VAL A1114 -14.589 0.458 3.202 1.00 1.23 H new ATOM 0 HG12 VAL A1114 -14.906 -0.685 1.874 1.00 1.23 H new ATOM 0 HG13 VAL A1114 -15.613 -0.970 3.482 1.00 1.23 H new ATOM 0 HG21 VAL A1114 -13.112 -0.113 5.036 1.00 1.25 H new ATOM 0 HG22 VAL A1114 -14.090 -1.549 5.420 1.00 1.25 H new ATOM 0 HG23 VAL A1114 -12.341 -1.714 5.139 1.00 1.25 H new ATOM 1044 N PRO A1115 -14.809 -3.713 0.902 1.00 0.94 N ATOM 1045 CA PRO A1115 -14.875 -4.015 -0.532 1.00 1.16 C ATOM 1046 C PRO A1115 -14.783 -2.770 -1.425 1.00 1.41 C ATOM 1047 O PRO A1115 -15.452 -1.765 -1.166 1.00 1.53 O ATOM 1048 CB PRO A1115 -16.191 -4.773 -0.744 1.00 1.22 C ATOM 1049 CG PRO A1115 -16.421 -5.442 0.609 1.00 1.59 C ATOM 1050 CD PRO A1115 -15.890 -4.403 1.596 1.00 1.04 C ATOM 0 HA PRO A1115 -14.013 -4.613 -0.827 1.00 1.16 H new ATOM 0 HB2 PRO A1115 -17.007 -4.100 -1.006 1.00 1.22 H new ATOM 0 HB3 PRO A1115 -16.111 -5.505 -1.548 1.00 1.22 H new ATOM 0 HG2 PRO A1115 -17.476 -5.659 0.779 1.00 1.59 H new ATOM 0 HG3 PRO A1115 -15.884 -6.387 0.689 1.00 1.59 H new ATOM 0 HD2 PRO A1115 -16.674 -3.705 1.889 1.00 1.04 H new ATOM 0 HD3 PRO A1115 -15.529 -4.878 2.508 1.00 1.04 H new ATOM 1058 N GLY A1116 -13.967 -2.841 -2.482 1.00 1.65 N ATOM 1059 CA GLY A1116 -13.770 -1.781 -3.479 1.00 2.02 C ATOM 1060 C GLY A1116 -13.242 -0.443 -2.941 1.00 1.87 C ATOM 1061 O GLY A1116 -13.529 0.594 -3.540 1.00 2.24 O ATOM 0 H GLY A1116 -13.404 -3.669 -2.675 1.00 1.65 H new ATOM 0 HA2 GLY A1116 -13.075 -2.146 -4.236 1.00 2.02 H new ATOM 0 HA3 GLY A1116 -14.721 -1.599 -3.980 1.00 2.02 H new ATOM 1065 N CYS A1117 -12.514 -0.437 -1.817 1.00 1.61 N ATOM 1066 CA CYS A1117 -12.102 0.790 -1.121 1.00 1.57 C ATOM 1067 C CYS A1117 -10.727 0.695 -0.430 1.00 1.19 C ATOM 1068 O CYS A1117 -9.898 1.588 -0.598 1.00 1.56 O ATOM 1069 CB CYS A1117 -13.212 1.145 -0.119 1.00 1.77 C ATOM 1070 SG CYS A1117 -12.846 2.713 0.720 1.00 1.99 S ATOM 0 H CYS A1117 -12.191 -1.290 -1.361 1.00 1.61 H new ATOM 0 HA CYS A1117 -11.971 1.578 -1.863 1.00 1.57 H new ATOM 0 HB2 CYS A1117 -14.167 1.220 -0.639 1.00 1.77 H new ATOM 0 HB3 CYS A1117 -13.312 0.348 0.618 1.00 1.77 H new ATOM 0 HG CYS A1117 -13.800 2.990 1.559 1.00 1.99 H new ATOM 1076 N GLY A1118 -10.465 -0.369 0.335 1.00 0.72 N ATOM 1077 CA GLY A1118 -9.187 -0.588 1.022 1.00 0.59 C ATOM 1078 C GLY A1118 -9.292 -1.540 2.212 1.00 0.60 C ATOM 1079 O GLY A1118 -10.395 -1.861 2.657 1.00 0.88 O ATOM 0 H GLY A1118 -11.144 -1.113 0.497 1.00 0.72 H new ATOM 0 HA2 GLY A1118 -8.464 -0.987 0.310 1.00 0.59 H new ATOM 0 HA3 GLY A1118 -8.799 0.371 1.367 1.00 0.59 H new ATOM 1083 N ILE A1119 -8.160 -1.975 2.766 1.00 0.49 N ATOM 1084 CA ILE A1119 -8.126 -2.897 3.916 1.00 0.67 C ATOM 1085 C ILE A1119 -7.052 -2.518 4.945 1.00 0.56 C ATOM 1086 O ILE A1119 -6.107 -1.799 4.628 1.00 0.49 O ATOM 1087 CB ILE A1119 -7.994 -4.382 3.473 1.00 0.94 C ATOM 1088 CG1 ILE A1119 -6.542 -4.843 3.209 1.00 1.49 C ATOM 1089 CG2 ILE A1119 -8.897 -4.730 2.270 1.00 2.65 C ATOM 1090 CD1 ILE A1119 -6.443 -6.357 3.030 1.00 1.46 C ATOM 0 H ILE A1119 -7.235 -1.701 2.434 1.00 0.49 H new ATOM 0 HA ILE A1119 -9.089 -2.793 4.415 1.00 0.67 H new ATOM 0 HB ILE A1119 -8.345 -4.943 4.339 1.00 0.94 H new ATOM 0 HG12 ILE A1119 -6.161 -4.347 2.316 1.00 1.49 H new ATOM 0 HG13 ILE A1119 -5.907 -4.534 4.040 1.00 1.49 H new ATOM 0 HG21 ILE A1119 -8.763 -5.779 2.006 1.00 2.65 H new ATOM 0 HG22 ILE A1119 -9.940 -4.553 2.534 1.00 2.65 H new ATOM 0 HG23 ILE A1119 -8.627 -4.104 1.419 1.00 2.65 H new ATOM 0 HD11 ILE A1119 -5.405 -6.635 2.847 1.00 1.46 H new ATOM 0 HD12 ILE A1119 -6.798 -6.854 3.933 1.00 1.46 H new ATOM 0 HD13 ILE A1119 -7.056 -6.664 2.182 1.00 1.46 H new ATOM 1102 N SER A1120 -7.185 -3.061 6.155 1.00 0.55 N ATOM 1103 CA SER A1120 -6.186 -3.065 7.229 1.00 0.41 C ATOM 1104 C SER A1120 -5.875 -4.504 7.640 1.00 0.41 C ATOM 1105 O SER A1120 -6.752 -5.370 7.612 1.00 0.46 O ATOM 1106 CB SER A1120 -6.666 -2.233 8.426 1.00 0.43 C ATOM 1107 OG SER A1120 -5.761 -2.306 9.515 1.00 0.47 O ATOM 0 H SER A1120 -8.043 -3.539 6.430 1.00 0.55 H new ATOM 0 HA SER A1120 -5.269 -2.605 6.862 1.00 0.41 H new ATOM 0 HB2 SER A1120 -6.785 -1.193 8.121 1.00 0.43 H new ATOM 0 HB3 SER A1120 -7.647 -2.586 8.744 1.00 0.43 H new ATOM 0 HG SER A1120 -6.098 -1.763 10.258 1.00 0.47 H new ATOM 1113 N CYS A1121 -4.628 -4.784 8.011 1.00 0.48 N ATOM 1114 CA CYS A1121 -4.203 -6.095 8.491 1.00 0.56 C ATOM 1115 C CYS A1121 -3.039 -6.004 9.493 1.00 0.57 C ATOM 1116 O CYS A1121 -2.361 -4.977 9.574 1.00 0.60 O ATOM 1117 CB CYS A1121 -3.900 -6.999 7.281 1.00 0.67 C ATOM 1118 SG CYS A1121 -2.513 -6.370 6.307 1.00 0.74 S ATOM 0 H CYS A1121 -3.875 -4.097 7.986 1.00 0.48 H new ATOM 0 HA CYS A1121 -5.015 -6.550 9.059 1.00 0.56 H new ATOM 0 HB2 CYS A1121 -3.674 -8.007 7.628 1.00 0.67 H new ATOM 0 HB3 CYS A1121 -4.785 -7.070 6.649 1.00 0.67 H new ATOM 0 HG CYS A1121 -2.553 -6.883 5.113 1.00 0.74 H new ATOM 1124 N LYS A1122 -2.814 -7.060 10.293 1.00 0.53 N ATOM 1125 CA LYS A1122 -1.732 -7.100 11.304 1.00 0.51 C ATOM 1126 C LYS A1122 -0.794 -8.254 10.985 1.00 0.41 C ATOM 1127 O LYS A1122 -1.170 -9.398 11.204 1.00 0.64 O ATOM 1128 CB LYS A1122 -2.256 -7.207 12.754 1.00 0.73 C ATOM 1129 CG LYS A1122 -3.511 -6.392 13.093 1.00 0.89 C ATOM 1130 CD LYS A1122 -3.325 -4.884 12.918 1.00 1.04 C ATOM 1131 CE LYS A1122 -4.406 -4.103 13.663 1.00 1.34 C ATOM 1132 NZ LYS A1122 -5.784 -4.430 13.209 1.00 1.60 N ATOM 0 H LYS A1122 -3.374 -7.912 10.261 1.00 0.53 H new ATOM 0 HA LYS A1122 -1.196 -6.152 11.250 1.00 0.51 H new ATOM 0 HB2 LYS A1122 -2.464 -8.256 12.965 1.00 0.73 H new ATOM 0 HB3 LYS A1122 -1.457 -6.899 13.429 1.00 0.73 H new ATOM 0 HG2 LYS A1122 -4.333 -6.725 12.459 1.00 0.89 H new ATOM 0 HG3 LYS A1122 -3.800 -6.597 14.124 1.00 0.89 H new ATOM 0 HD2 LYS A1122 -2.342 -4.591 13.287 1.00 1.04 H new ATOM 0 HD3 LYS A1122 -3.356 -4.632 11.858 1.00 1.04 H new ATOM 0 HE2 LYS A1122 -4.324 -4.309 14.730 1.00 1.34 H new ATOM 0 HE3 LYS A1122 -4.230 -3.035 13.530 1.00 1.34 H new ATOM 0 HZ1 LYS A1122 -6.466 -3.820 13.703 1.00 1.60 H new ATOM 0 HZ2 LYS A1122 -5.858 -4.273 12.184 1.00 1.60 H new ATOM 0 HZ3 LYS A1122 -5.992 -5.426 13.422 1.00 1.60 H new ATOM 1146 N VAL A1123 0.396 -7.986 10.456 1.00 0.52 N ATOM 1147 CA VAL A1123 1.310 -8.986 9.881 1.00 0.50 C ATOM 1148 C VAL A1123 2.486 -9.295 10.809 1.00 0.54 C ATOM 1149 O VAL A1123 3.051 -8.405 11.444 1.00 0.63 O ATOM 1150 CB VAL A1123 1.753 -8.540 8.472 1.00 0.59 C ATOM 1151 CG1 VAL A1123 2.492 -7.195 8.456 1.00 1.63 C ATOM 1152 CG2 VAL A1123 2.544 -9.650 7.770 1.00 1.92 C ATOM 0 H VAL A1123 0.769 -7.038 10.411 1.00 0.52 H new ATOM 0 HA VAL A1123 0.775 -9.930 9.777 1.00 0.50 H new ATOM 0 HB VAL A1123 0.841 -8.365 7.901 1.00 0.59 H new ATOM 0 HG11 VAL A1123 2.773 -6.946 7.433 1.00 1.63 H new ATOM 0 HG12 VAL A1123 1.840 -6.417 8.853 1.00 1.63 H new ATOM 0 HG13 VAL A1123 3.389 -7.265 9.071 1.00 1.63 H new ATOM 0 HG21 VAL A1123 2.845 -9.311 6.779 1.00 1.92 H new ATOM 0 HG22 VAL A1123 3.431 -9.891 8.356 1.00 1.92 H new ATOM 0 HG23 VAL A1123 1.919 -10.538 7.676 1.00 1.92 H new ATOM 1162 N THR A1124 2.843 -10.573 10.917 1.00 0.62 N ATOM 1163 CA THR A1124 3.968 -11.049 11.752 1.00 0.80 C ATOM 1164 C THR A1124 5.097 -11.739 10.978 1.00 0.81 C ATOM 1165 O THR A1124 4.959 -12.028 9.792 1.00 0.90 O ATOM 1166 CB THR A1124 3.445 -11.992 12.852 1.00 1.03 C ATOM 1167 OG1 THR A1124 4.321 -11.935 13.957 1.00 1.40 O ATOM 1168 CG2 THR A1124 3.271 -13.462 12.474 1.00 0.98 C ATOM 0 H THR A1124 2.360 -11.324 10.425 1.00 0.62 H new ATOM 0 HA THR A1124 4.409 -10.150 12.183 1.00 0.80 H new ATOM 0 HB THR A1124 2.441 -11.625 13.064 1.00 1.03 H new ATOM 0 HG1 THR A1124 3.995 -12.531 14.664 1.00 1.40 H new ATOM 0 HG21 THR A1124 2.898 -14.017 13.335 1.00 0.98 H new ATOM 0 HG22 THR A1124 2.559 -13.545 11.652 1.00 0.98 H new ATOM 0 HG23 THR A1124 4.231 -13.874 12.165 1.00 0.98 H new ATOM 1176 N ASN A1125 6.181 -11.997 11.721 1.00 1.20 N ATOM 1177 CA ASN A1125 7.382 -12.835 11.530 1.00 1.37 C ATOM 1178 C ASN A1125 8.569 -12.165 12.256 1.00 1.49 C ATOM 1179 O ASN A1125 9.563 -11.735 11.660 1.00 1.98 O ATOM 1180 CB ASN A1125 7.653 -13.303 10.088 1.00 1.50 C ATOM 1181 CG ASN A1125 8.573 -14.507 10.057 1.00 1.85 C ATOM 1182 OD1 ASN A1125 9.568 -14.610 10.766 1.00 2.85 O ATOM 1183 ND2 ASN A1125 8.227 -15.490 9.272 1.00 1.35 N ATOM 0 H ASN A1125 6.247 -11.542 12.631 1.00 1.20 H new ATOM 0 HA ASN A1125 7.200 -13.803 11.997 1.00 1.37 H new ATOM 0 HB2 ASN A1125 6.710 -13.552 9.602 1.00 1.50 H new ATOM 0 HB3 ASN A1125 8.099 -12.488 9.518 1.00 1.50 H new ATOM 0 HD21 ASN A1125 8.784 -16.344 9.248 1.00 1.35 H new ATOM 0 HD22 ASN A1125 7.399 -15.404 8.682 1.00 1.35 H new ATOM 1951 N GLN A1177 3.638 -7.840 16.065 1.00 1.68 N ATOM 1952 CA GLN A1177 2.733 -7.783 14.896 1.00 1.48 C ATOM 1953 C GLN A1177 2.449 -6.369 14.358 1.00 1.54 C ATOM 1954 O GLN A1177 1.855 -5.531 15.036 1.00 2.30 O ATOM 1955 CB GLN A1177 1.406 -8.448 15.274 1.00 1.58 C ATOM 1956 CG GLN A1177 1.519 -9.967 15.187 1.00 1.40 C ATOM 1957 CD GLN A1177 0.218 -10.582 14.789 1.00 1.61 C ATOM 1958 OE1 GLN A1177 -0.655 -10.889 15.590 1.00 2.54 O ATOM 1959 NE2 GLN A1177 0.034 -10.759 13.519 1.00 1.36 N ATOM 0 HA GLN A1177 3.248 -8.306 14.090 1.00 1.48 H new ATOM 0 HB2 GLN A1177 1.123 -8.157 16.286 1.00 1.58 H new ATOM 0 HB3 GLN A1177 0.616 -8.099 14.609 1.00 1.58 H new ATOM 0 HG2 GLN A1177 2.288 -10.236 14.463 1.00 1.40 H new ATOM 0 HG3 GLN A1177 1.834 -10.367 16.151 1.00 1.40 H new ATOM 0 HE21 GLN A1177 0.766 -10.501 12.857 1.00 1.36 H new ATOM 0 HE22 GLN A1177 -0.843 -11.156 13.181 1.00 1.36 H new ATOM 1968 N TYR A1178 2.837 -6.134 13.108 1.00 0.91 N ATOM 1969 CA TYR A1178 2.851 -4.831 12.447 1.00 0.77 C ATOM 1970 C TYR A1178 1.478 -4.500 11.853 1.00 0.62 C ATOM 1971 O TYR A1178 0.978 -5.258 11.023 1.00 0.67 O ATOM 1972 CB TYR A1178 3.925 -4.876 11.342 1.00 0.75 C ATOM 1973 CG TYR A1178 4.782 -3.636 11.209 1.00 1.11 C ATOM 1974 CD1 TYR A1178 4.200 -2.362 11.062 1.00 2.75 C ATOM 1975 CD2 TYR A1178 6.183 -3.778 11.199 1.00 1.30 C ATOM 1976 CE1 TYR A1178 5.018 -1.224 10.931 1.00 3.47 C ATOM 1977 CE2 TYR A1178 7.001 -2.643 11.041 1.00 1.68 C ATOM 1978 CZ TYR A1178 6.422 -1.359 10.911 1.00 2.62 C ATOM 1979 OH TYR A1178 7.196 -0.248 10.800 1.00 3.42 O ATOM 0 H TYR A1178 3.166 -6.883 12.498 1.00 0.91 H new ATOM 0 HA TYR A1178 3.083 -4.049 13.170 1.00 0.77 H new ATOM 0 HB2 TYR A1178 4.578 -5.728 11.530 1.00 0.75 H new ATOM 0 HB3 TYR A1178 3.431 -5.058 10.388 1.00 0.75 H new ATOM 0 HD1 TYR A1178 3.125 -2.258 11.050 1.00 2.75 H new ATOM 0 HD2 TYR A1178 6.629 -4.755 11.312 1.00 1.30 H new ATOM 0 HE1 TYR A1178 4.570 -0.245 10.846 1.00 3.47 H new ATOM 0 HE2 TYR A1178 8.075 -2.753 11.019 1.00 1.68 H new ATOM 0 HH TYR A1178 8.141 -0.506 10.802 1.00 3.42 H new ATOM 1989 N LYS A1179 0.873 -3.366 12.216 1.00 0.58 N ATOM 1990 CA LYS A1179 -0.357 -2.878 11.568 1.00 0.55 C ATOM 1991 C LYS A1179 -0.037 -2.244 10.214 1.00 0.52 C ATOM 1992 O LYS A1179 0.731 -1.288 10.177 1.00 0.64 O ATOM 1993 CB LYS A1179 -1.050 -1.887 12.528 1.00 0.70 C ATOM 1994 CG LYS A1179 -2.363 -1.280 11.989 1.00 0.86 C ATOM 1995 CD LYS A1179 -3.000 -0.352 13.038 1.00 1.05 C ATOM 1996 CE LYS A1179 -4.402 0.132 12.632 1.00 1.60 C ATOM 1997 NZ LYS A1179 -4.999 0.989 13.685 1.00 1.55 N ATOM 0 H LYS A1179 1.216 -2.760 12.962 1.00 0.58 H new ATOM 0 HA LYS A1179 -1.037 -3.706 11.367 1.00 0.55 H new ATOM 0 HB2 LYS A1179 -1.261 -2.399 13.467 1.00 0.70 H new ATOM 0 HB3 LYS A1179 -0.357 -1.077 12.755 1.00 0.70 H new ATOM 0 HG2 LYS A1179 -2.163 -0.721 11.074 1.00 0.86 H new ATOM 0 HG3 LYS A1179 -3.059 -2.077 11.730 1.00 0.86 H new ATOM 0 HD2 LYS A1179 -3.064 -0.878 13.991 1.00 1.05 H new ATOM 0 HD3 LYS A1179 -2.353 0.512 13.193 1.00 1.05 H new ATOM 0 HE2 LYS A1179 -4.341 0.689 11.697 1.00 1.60 H new ATOM 0 HE3 LYS A1179 -5.047 -0.727 12.449 1.00 1.60 H new ATOM 0 HZ1 LYS A1179 -5.890 1.397 13.337 1.00 1.55 H new ATOM 0 HZ2 LYS A1179 -5.188 0.417 14.533 1.00 1.55 H new ATOM 0 HZ3 LYS A1179 -4.338 1.755 13.925 1.00 1.55 H new ATOM 2011 N VAL A1180 -0.640 -2.722 9.127 1.00 0.48 N ATOM 2012 CA VAL A1180 -0.491 -2.152 7.772 1.00 0.48 C ATOM 2013 C VAL A1180 -1.853 -2.028 7.071 1.00 0.45 C ATOM 2014 O VAL A1180 -2.660 -2.954 7.117 1.00 0.56 O ATOM 2015 CB VAL A1180 0.562 -2.911 6.922 1.00 0.51 C ATOM 2016 CG1 VAL A1180 1.894 -3.118 7.663 1.00 0.57 C ATOM 2017 CG2 VAL A1180 0.117 -4.294 6.450 1.00 0.55 C ATOM 0 H VAL A1180 -1.260 -3.532 9.155 1.00 0.48 H new ATOM 0 HA VAL A1180 -0.098 -1.141 7.883 1.00 0.48 H new ATOM 0 HB VAL A1180 0.686 -2.253 6.062 1.00 0.51 H new ATOM 0 HG11 VAL A1180 2.590 -3.654 7.018 1.00 0.57 H new ATOM 0 HG12 VAL A1180 2.318 -2.149 7.928 1.00 0.57 H new ATOM 0 HG13 VAL A1180 1.720 -3.698 8.570 1.00 0.57 H new ATOM 0 HG21 VAL A1180 0.914 -4.752 5.864 1.00 0.55 H new ATOM 0 HG22 VAL A1180 -0.103 -4.920 7.315 1.00 0.55 H new ATOM 0 HG23 VAL A1180 -0.777 -4.198 5.834 1.00 0.55 H new ATOM 2027 N LEU A1181 -2.129 -0.876 6.449 1.00 0.33 N ATOM 2028 CA LEU A1181 -3.391 -0.584 5.754 1.00 0.29 C ATOM 2029 C LEU A1181 -3.187 0.171 4.428 1.00 0.33 C ATOM 2030 O LEU A1181 -2.262 0.971 4.292 1.00 0.36 O ATOM 2031 CB LEU A1181 -4.398 0.113 6.700 1.00 0.29 C ATOM 2032 CG LEU A1181 -4.056 1.551 7.137 1.00 0.31 C ATOM 2033 CD1 LEU A1181 -5.321 2.393 7.288 1.00 0.40 C ATOM 2034 CD2 LEU A1181 -3.347 1.620 8.493 1.00 0.35 C ATOM 0 H LEU A1181 -1.466 -0.102 6.413 1.00 0.33 H new ATOM 0 HA LEU A1181 -3.829 -1.540 5.467 1.00 0.29 H new ATOM 0 HB2 LEU A1181 -5.371 0.129 6.209 1.00 0.29 H new ATOM 0 HB3 LEU A1181 -4.503 -0.499 7.596 1.00 0.29 H new ATOM 0 HG LEU A1181 -3.399 1.928 6.353 1.00 0.31 H new ATOM 0 HD11 LEU A1181 -5.051 3.403 7.597 1.00 0.40 H new ATOM 0 HD12 LEU A1181 -5.847 2.434 6.334 1.00 0.40 H new ATOM 0 HD13 LEU A1181 -5.969 1.944 8.041 1.00 0.40 H new ATOM 0 HD21 LEU A1181 -3.135 2.660 8.740 1.00 0.35 H new ATOM 0 HD22 LEU A1181 -3.988 1.188 9.261 1.00 0.35 H new ATOM 0 HD23 LEU A1181 -2.412 1.061 8.444 1.00 0.35 H new ATOM 2046 N ILE A1182 -4.048 -0.070 3.438 1.00 0.35 N ATOM 2047 CA ILE A1182 -3.883 0.388 2.047 1.00 0.34 C ATOM 2048 C ILE A1182 -5.250 0.630 1.387 1.00 0.36 C ATOM 2049 O ILE A1182 -6.183 -0.144 1.604 1.00 0.40 O ATOM 2050 CB ILE A1182 -3.005 -0.617 1.249 1.00 0.38 C ATOM 2051 CG1 ILE A1182 -2.924 -0.270 -0.261 1.00 0.42 C ATOM 2052 CG2 ILE A1182 -3.422 -2.085 1.487 1.00 0.44 C ATOM 2053 CD1 ILE A1182 -1.766 -0.961 -0.990 1.00 0.48 C ATOM 0 H ILE A1182 -4.905 -0.604 3.580 1.00 0.35 H new ATOM 0 HA ILE A1182 -3.361 1.345 2.045 1.00 0.34 H new ATOM 0 HB ILE A1182 -1.994 -0.513 1.644 1.00 0.38 H new ATOM 0 HG12 ILE A1182 -3.862 -0.550 -0.740 1.00 0.42 H new ATOM 0 HG13 ILE A1182 -2.819 0.809 -0.372 1.00 0.42 H new ATOM 0 HG21 ILE A1182 -2.777 -2.745 0.907 1.00 0.44 H new ATOM 0 HG22 ILE A1182 -3.326 -2.323 2.546 1.00 0.44 H new ATOM 0 HG23 ILE A1182 -4.457 -2.224 1.176 1.00 0.44 H new ATOM 0 HD11 ILE A1182 -1.773 -0.671 -2.041 1.00 0.48 H new ATOM 0 HD12 ILE A1182 -0.821 -0.662 -0.537 1.00 0.48 H new ATOM 0 HD13 ILE A1182 -1.880 -2.042 -0.911 1.00 0.48 H new ATOM 2065 N GLY A1183 -5.376 1.682 0.567 1.00 0.43 N ATOM 2066 CA GLY A1183 -6.593 1.960 -0.204 1.00 0.63 C ATOM 2067 C GLY A1183 -6.819 3.431 -0.568 1.00 0.67 C ATOM 2068 O GLY A1183 -5.886 4.228 -0.664 1.00 1.41 O ATOM 0 H GLY A1183 -4.634 2.366 0.420 1.00 0.43 H new ATOM 0 HA2 GLY A1183 -6.561 1.376 -1.124 1.00 0.63 H new ATOM 0 HA3 GLY A1183 -7.453 1.608 0.367 1.00 0.63 H new ATOM 2072 N ASN A1184 -8.086 3.775 -0.787 1.00 0.80 N ATOM 2073 CA ASN A1184 -8.563 5.126 -1.086 1.00 0.92 C ATOM 2074 C ASN A1184 -8.485 6.043 0.153 1.00 1.20 C ATOM 2075 O ASN A1184 -8.488 5.575 1.296 1.00 2.43 O ATOM 2076 CB ASN A1184 -10.004 5.015 -1.634 1.00 1.35 C ATOM 2077 CG ASN A1184 -10.102 4.226 -2.932 1.00 1.70 C ATOM 2078 OD1 ASN A1184 -9.149 4.071 -3.682 1.00 3.48 O ATOM 2079 ND2 ASN A1184 -11.261 3.710 -3.261 1.00 1.21 N ATOM 0 H ASN A1184 -8.842 3.091 -0.760 1.00 0.80 H new ATOM 0 HA ASN A1184 -7.923 5.588 -1.838 1.00 0.92 H new ATOM 0 HB2 ASN A1184 -10.635 4.541 -0.882 1.00 1.35 H new ATOM 0 HB3 ASN A1184 -10.400 6.017 -1.797 1.00 1.35 H new ATOM 0 HD21 ASN A1184 -11.358 3.188 -4.132 1.00 1.21 H new ATOM 0 HD22 ASN A1184 -12.066 3.830 -2.646 1.00 1.21 H new ATOM 2086 N ARG A1185 -8.499 7.370 -0.051 1.00 0.86 N ATOM 2087 CA ARG A1185 -8.340 8.388 1.010 1.00 1.10 C ATOM 2088 C ARG A1185 -9.404 8.310 2.119 1.00 1.07 C ATOM 2089 O ARG A1185 -9.159 8.792 3.220 1.00 1.36 O ATOM 2090 CB ARG A1185 -8.292 9.785 0.353 1.00 1.44 C ATOM 2091 CG ARG A1185 -7.924 10.934 1.315 1.00 3.22 C ATOM 2092 CD ARG A1185 -7.793 12.295 0.612 1.00 3.97 C ATOM 2093 NE ARG A1185 -9.054 12.703 -0.033 1.00 4.30 N ATOM 2094 CZ ARG A1185 -9.331 13.857 -0.607 1.00 5.35 C ATOM 2095 NH1 ARG A1185 -8.514 14.869 -0.631 1.00 6.31 N ATOM 2096 NH2 ARG A1185 -10.485 14.000 -1.183 1.00 6.01 N ATOM 0 H ARG A1185 -8.624 7.778 -0.977 1.00 0.86 H new ATOM 0 HA ARG A1185 -7.401 8.186 1.526 1.00 1.10 H new ATOM 0 HB2 ARG A1185 -7.568 9.764 -0.462 1.00 1.44 H new ATOM 0 HB3 ARG A1185 -9.265 9.997 -0.091 1.00 1.44 H new ATOM 0 HG2 ARG A1185 -8.685 11.006 2.092 1.00 3.22 H new ATOM 0 HG3 ARG A1185 -6.983 10.697 1.811 1.00 3.22 H new ATOM 0 HD2 ARG A1185 -7.495 13.052 1.338 1.00 3.97 H new ATOM 0 HD3 ARG A1185 -7.002 12.243 -0.137 1.00 3.97 H new ATOM 0 HE ARG A1185 -9.802 12.009 -0.036 1.00 4.30 H new ATOM 0 HH11 ARG A1185 -7.598 14.796 -0.188 1.00 6.31 H new ATOM 0 HH12 ARG A1185 -8.789 15.736 -1.093 1.00 6.31 H new ATOM 0 HH21 ARG A1185 -11.153 13.229 -1.184 1.00 6.01 H new ATOM 0 HH22 ARG A1185 -10.724 14.883 -1.634 1.00 6.01 H new ATOM 2110 N GLU A1186 -10.525 7.621 1.890 1.00 1.09 N ATOM 2111 CA GLU A1186 -11.543 7.354 2.918 1.00 1.58 C ATOM 2112 C GLU A1186 -10.961 6.604 4.137 1.00 1.39 C ATOM 2113 O GLU A1186 -11.330 6.912 5.274 1.00 1.67 O ATOM 2114 CB GLU A1186 -12.701 6.540 2.306 1.00 2.23 C ATOM 2115 CG GLU A1186 -13.572 7.361 1.340 1.00 2.98 C ATOM 2116 CD GLU A1186 -14.761 6.557 0.784 1.00 3.82 C ATOM 2117 OE1 GLU A1186 -15.583 6.041 1.585 1.00 4.11 O ATOM 2118 OE2 GLU A1186 -14.897 6.451 -0.462 1.00 4.78 O ATOM 0 H GLU A1186 -10.757 7.228 0.978 1.00 1.09 H new ATOM 0 HA GLU A1186 -11.911 8.317 3.273 1.00 1.58 H new ATOM 0 HB2 GLU A1186 -12.292 5.680 1.775 1.00 2.23 H new ATOM 0 HB3 GLU A1186 -13.327 6.151 3.109 1.00 2.23 H new ATOM 0 HG2 GLU A1186 -13.946 8.245 1.856 1.00 2.98 H new ATOM 0 HG3 GLU A1186 -12.957 7.712 0.512 1.00 2.98 H new ATOM 2125 N TRP A1187 -10.006 5.686 3.917 1.00 1.15 N ATOM 2126 CA TRP A1187 -9.276 4.984 4.982 1.00 1.20 C ATOM 2127 C TRP A1187 -8.240 5.887 5.666 1.00 0.83 C ATOM 2128 O TRP A1187 -8.183 5.942 6.892 1.00 0.91 O ATOM 2129 CB TRP A1187 -8.593 3.725 4.429 1.00 1.71 C ATOM 2130 CG TRP A1187 -9.225 2.417 4.779 1.00 1.67 C ATOM 2131 CD1 TRP A1187 -9.863 1.580 3.931 1.00 3.36 C ATOM 2132 CD2 TRP A1187 -9.186 1.734 6.067 1.00 1.11 C ATOM 2133 NE1 TRP A1187 -10.178 0.407 4.593 1.00 3.40 N ATOM 2134 CE2 TRP A1187 -9.754 0.436 5.906 1.00 1.60 C ATOM 2135 CE3 TRP A1187 -8.691 2.072 7.346 1.00 2.67 C ATOM 2136 CZ2 TRP A1187 -9.785 -0.494 6.953 1.00 1.22 C ATOM 2137 CZ3 TRP A1187 -8.748 1.153 8.413 1.00 3.37 C ATOM 2138 CH2 TRP A1187 -9.291 -0.128 8.216 1.00 2.08 C ATOM 0 H TRP A1187 -9.716 5.407 2.980 1.00 1.15 H new ATOM 0 HA TRP A1187 -10.009 4.695 5.735 1.00 1.20 H new ATOM 0 HB2 TRP A1187 -8.555 3.806 3.343 1.00 1.71 H new ATOM 0 HB3 TRP A1187 -7.562 3.712 4.784 1.00 1.71 H new ATOM 0 HD1 TRP A1187 -10.091 1.794 2.897 1.00 3.36 H new ATOM 0 HE1 TRP A1187 -10.663 -0.381 4.164 1.00 3.40 H new ATOM 0 HE3 TRP A1187 -8.262 3.050 7.509 1.00 2.67 H new ATOM 0 HZ2 TRP A1187 -10.185 -1.484 6.791 1.00 1.22 H new ATOM 0 HZ3 TRP A1187 -8.373 1.434 9.386 1.00 3.37 H new ATOM 0 HH2 TRP A1187 -9.328 -0.831 9.035 1.00 2.08 H new ATOM 2149 N MET A1188 -7.422 6.607 4.891 1.00 0.79 N ATOM 2150 CA MET A1188 -6.396 7.524 5.422 1.00 0.93 C ATOM 2151 C MET A1188 -7.008 8.643 6.287 1.00 0.92 C ATOM 2152 O MET A1188 -6.369 9.112 7.232 1.00 1.16 O ATOM 2153 CB MET A1188 -5.543 8.089 4.273 1.00 1.20 C ATOM 2154 CG MET A1188 -4.534 7.072 3.730 1.00 1.51 C ATOM 2155 SD MET A1188 -5.219 5.563 2.997 1.00 2.12 S ATOM 2156 CE MET A1188 -3.860 4.446 3.410 1.00 0.83 C ATOM 0 H MET A1188 -7.450 6.573 3.872 1.00 0.79 H new ATOM 0 HA MET A1188 -5.744 6.953 6.083 1.00 0.93 H new ATOM 0 HB2 MET A1188 -6.198 8.412 3.464 1.00 1.20 H new ATOM 0 HB3 MET A1188 -5.009 8.973 4.623 1.00 1.20 H new ATOM 0 HG2 MET A1188 -3.921 7.568 2.978 1.00 1.51 H new ATOM 0 HG3 MET A1188 -3.869 6.784 4.544 1.00 1.51 H new ATOM 0 HE1 MET A1188 -4.018 3.485 2.921 1.00 0.83 H new ATOM 0 HE2 MET A1188 -2.919 4.877 3.069 1.00 0.83 H new ATOM 0 HE3 MET A1188 -3.823 4.302 4.490 1.00 0.83 H new ATOM 2166 N ILE A1189 -8.251 9.026 5.993 1.00 0.95 N ATOM 2167 CA ILE A1189 -9.143 9.852 6.817 1.00 1.30 C ATOM 2168 C ILE A1189 -9.497 9.055 8.087 1.00 1.20 C ATOM 2169 O ILE A1189 -9.106 9.437 9.188 1.00 1.31 O ATOM 2170 CB ILE A1189 -10.348 10.343 5.978 1.00 1.65 C ATOM 2171 CG1 ILE A1189 -9.875 11.433 4.984 1.00 1.66 C ATOM 2172 CG2 ILE A1189 -11.485 10.899 6.847 1.00 2.42 C ATOM 2173 CD1 ILE A1189 -10.900 11.781 3.895 1.00 1.93 C ATOM 0 H ILE A1189 -8.693 8.751 5.116 1.00 0.95 H new ATOM 0 HA ILE A1189 -8.661 10.770 7.152 1.00 1.30 H new ATOM 0 HB ILE A1189 -10.743 9.481 5.441 1.00 1.65 H new ATOM 0 HG12 ILE A1189 -9.634 12.338 5.542 1.00 1.66 H new ATOM 0 HG13 ILE A1189 -8.954 11.098 4.506 1.00 1.66 H new ATOM 0 HG21 ILE A1189 -12.304 11.229 6.208 1.00 2.42 H new ATOM 0 HG22 ILE A1189 -11.842 10.120 7.521 1.00 2.42 H new ATOM 0 HG23 ILE A1189 -11.118 11.743 7.430 1.00 2.42 H new ATOM 0 HD11 ILE A1189 -10.490 12.551 3.242 1.00 1.93 H new ATOM 0 HD12 ILE A1189 -11.124 10.890 3.308 1.00 1.93 H new ATOM 0 HD13 ILE A1189 -11.815 12.149 4.360 1.00 1.93 H new ATOM 2185 N ARG A1190 -10.244 7.950 7.944 1.00 1.12 N ATOM 2186 CA ARG A1190 -10.676 7.032 9.023 1.00 1.19 C ATOM 2187 C ARG A1190 -9.578 6.582 10.005 1.00 0.87 C ATOM 2188 O ARG A1190 -9.921 6.203 11.123 1.00 1.01 O ATOM 2189 CB ARG A1190 -11.359 5.825 8.343 1.00 1.44 C ATOM 2190 CG ARG A1190 -11.972 4.767 9.269 1.00 2.82 C ATOM 2191 CD ARG A1190 -11.010 3.596 9.527 1.00 3.84 C ATOM 2192 NE ARG A1190 -11.559 2.673 10.537 1.00 5.63 N ATOM 2193 CZ ARG A1190 -11.594 2.880 11.842 1.00 6.72 C ATOM 2194 NH1 ARG A1190 -11.093 3.927 12.427 1.00 6.72 N ATOM 2195 NH2 ARG A1190 -12.170 2.021 12.621 1.00 8.31 N ATOM 0 H ARG A1190 -10.583 7.652 7.029 1.00 1.12 H new ATOM 0 HA ARG A1190 -11.359 7.584 9.669 1.00 1.19 H new ATOM 0 HB2 ARG A1190 -12.146 6.203 7.691 1.00 1.44 H new ATOM 0 HB3 ARG A1190 -10.624 5.334 7.705 1.00 1.44 H new ATOM 0 HG2 ARG A1190 -12.242 5.230 10.218 1.00 2.82 H new ATOM 0 HG3 ARG A1190 -12.893 4.388 8.826 1.00 2.82 H new ATOM 0 HD2 ARG A1190 -10.830 3.057 8.597 1.00 3.84 H new ATOM 0 HD3 ARG A1190 -10.047 3.979 9.865 1.00 3.84 H new ATOM 0 HE ARG A1190 -11.948 1.793 10.197 1.00 5.63 H new ATOM 0 HH11 ARG A1190 -10.638 4.652 11.873 1.00 6.72 H new ATOM 0 HH12 ARG A1190 -11.155 4.023 13.441 1.00 6.72 H new ATOM 0 HH21 ARG A1190 -12.598 1.183 12.228 1.00 8.31 H new ATOM 0 HH22 ARG A1190 -12.196 2.183 13.628 1.00 8.31 H new ATOM 2209 N ASN A1191 -8.293 6.605 9.638 1.00 0.58 N ATOM 2210 CA ASN A1191 -7.156 6.283 10.519 1.00 0.49 C ATOM 2211 C ASN A1191 -6.399 7.528 11.062 1.00 0.64 C ATOM 2212 O ASN A1191 -5.273 7.406 11.557 1.00 0.81 O ATOM 2213 CB ASN A1191 -6.245 5.232 9.837 1.00 0.46 C ATOM 2214 CG ASN A1191 -5.651 4.261 10.840 1.00 0.60 C ATOM 2215 OD1 ASN A1191 -6.139 3.159 11.048 1.00 0.83 O ATOM 2216 ND2 ASN A1191 -4.619 4.660 11.530 1.00 0.73 N ATOM 0 H ASN A1191 -8.002 6.855 8.693 1.00 0.58 H new ATOM 0 HA ASN A1191 -7.556 5.834 11.428 1.00 0.49 H new ATOM 0 HB2 ASN A1191 -6.821 4.680 9.095 1.00 0.46 H new ATOM 0 HB3 ASN A1191 -5.441 5.740 9.304 1.00 0.46 H new ATOM 0 HD21 ASN A1191 -4.218 4.053 12.244 1.00 0.73 H new ATOM 0 HD22 ASN A1191 -4.213 5.579 11.355 1.00 0.73 H new ATOM 2223 N GLY A1192 -6.979 8.729 10.955 1.00 0.73 N ATOM 2224 CA GLY A1192 -6.485 9.970 11.576 1.00 0.93 C ATOM 2225 C GLY A1192 -5.153 10.515 11.050 1.00 0.92 C ATOM 2226 O GLY A1192 -4.502 11.309 11.734 1.00 1.19 O ATOM 0 H GLY A1192 -7.834 8.872 10.417 1.00 0.73 H new ATOM 0 HA2 GLY A1192 -7.244 10.742 11.447 1.00 0.93 H new ATOM 0 HA3 GLY A1192 -6.384 9.798 12.648 1.00 0.93 H new ATOM 2230 N LEU A1193 -4.712 10.081 9.867 1.00 0.75 N ATOM 2231 CA LEU A1193 -3.367 10.355 9.340 1.00 0.72 C ATOM 2232 C LEU A1193 -3.269 11.775 8.751 1.00 0.89 C ATOM 2233 O LEU A1193 -4.273 12.305 8.270 1.00 1.25 O ATOM 2234 CB LEU A1193 -3.003 9.307 8.269 1.00 0.69 C ATOM 2235 CG LEU A1193 -3.316 7.846 8.643 1.00 0.57 C ATOM 2236 CD1 LEU A1193 -2.925 6.924 7.503 1.00 0.59 C ATOM 2237 CD2 LEU A1193 -2.548 7.346 9.859 1.00 0.53 C ATOM 0 H LEU A1193 -5.286 9.521 9.237 1.00 0.75 H new ATOM 0 HA LEU A1193 -2.659 10.291 10.167 1.00 0.72 H new ATOM 0 HB2 LEU A1193 -3.535 9.551 7.350 1.00 0.69 H new ATOM 0 HB3 LEU A1193 -1.938 9.389 8.052 1.00 0.69 H new ATOM 0 HG LEU A1193 -4.384 7.832 8.859 1.00 0.57 H new ATOM 0 HD11 LEU A1193 -3.150 5.893 7.776 1.00 0.59 H new ATOM 0 HD12 LEU A1193 -3.486 7.193 6.608 1.00 0.59 H new ATOM 0 HD13 LEU A1193 -1.858 7.023 7.305 1.00 0.59 H new ATOM 0 HD21 LEU A1193 -2.821 6.310 10.061 1.00 0.53 H new ATOM 0 HD22 LEU A1193 -1.477 7.408 9.664 1.00 0.53 H new ATOM 0 HD23 LEU A1193 -2.795 7.962 10.724 1.00 0.53 H new ATOM 2249 N VAL A1194 -2.065 12.352 8.696 1.00 0.84 N ATOM 2250 CA VAL A1194 -1.801 13.624 7.988 1.00 1.08 C ATOM 2251 C VAL A1194 -1.365 13.346 6.547 1.00 1.09 C ATOM 2252 O VAL A1194 -0.405 12.596 6.331 1.00 1.11 O ATOM 2253 CB VAL A1194 -0.746 14.482 8.721 1.00 1.31 C ATOM 2254 CG1 VAL A1194 -0.430 15.783 7.967 1.00 1.60 C ATOM 2255 CG2 VAL A1194 -1.227 14.874 10.122 1.00 1.35 C ATOM 0 H VAL A1194 -1.238 11.954 9.141 1.00 0.84 H new ATOM 0 HA VAL A1194 -2.729 14.195 7.974 1.00 1.08 H new ATOM 0 HB VAL A1194 0.149 13.863 8.779 1.00 1.31 H new ATOM 0 HG11 VAL A1194 0.316 16.352 8.521 1.00 1.60 H new ATOM 0 HG12 VAL A1194 -0.043 15.545 6.976 1.00 1.60 H new ATOM 0 HG13 VAL A1194 -1.339 16.376 7.868 1.00 1.60 H new ATOM 0 HG21 VAL A1194 -0.464 15.477 10.613 1.00 1.35 H new ATOM 0 HG22 VAL A1194 -2.149 15.450 10.042 1.00 1.35 H new ATOM 0 HG23 VAL A1194 -1.411 13.974 10.709 1.00 1.35 H new ATOM 2265 N ILE A1195 -2.022 13.984 5.572 1.00 1.18 N ATOM 2266 CA ILE A1195 -1.629 13.991 4.153 1.00 1.23 C ATOM 2267 C ILE A1195 -1.182 15.387 3.687 1.00 1.35 C ATOM 2268 O ILE A1195 -1.595 16.411 4.241 1.00 1.53 O ATOM 2269 CB ILE A1195 -2.695 13.318 3.258 1.00 1.29 C ATOM 2270 CG1 ILE A1195 -2.101 13.008 1.869 1.00 1.39 C ATOM 2271 CG2 ILE A1195 -3.973 14.154 3.115 1.00 1.41 C ATOM 2272 CD1 ILE A1195 -2.868 11.929 1.097 1.00 1.55 C ATOM 0 H ILE A1195 -2.867 14.527 5.751 1.00 1.18 H new ATOM 0 HA ILE A1195 -0.741 13.368 4.044 1.00 1.23 H new ATOM 0 HB ILE A1195 -2.983 12.390 3.752 1.00 1.29 H new ATOM 0 HG12 ILE A1195 -2.086 13.924 1.278 1.00 1.39 H new ATOM 0 HG13 ILE A1195 -1.066 12.689 1.989 1.00 1.39 H new ATOM 0 HG21 ILE A1195 -4.682 13.628 2.475 1.00 1.41 H new ATOM 0 HG22 ILE A1195 -4.418 14.310 4.098 1.00 1.41 H new ATOM 0 HG23 ILE A1195 -3.729 15.119 2.670 1.00 1.41 H new ATOM 0 HD11 ILE A1195 -2.392 11.765 0.130 1.00 1.55 H new ATOM 0 HD12 ILE A1195 -2.861 11.000 1.667 1.00 1.55 H new ATOM 0 HD13 ILE A1195 -3.897 12.253 0.944 1.00 1.55 H new ATOM 2284 N ASN A1196 -0.307 15.427 2.678 1.00 1.33 N ATOM 2285 CA ASN A1196 0.419 16.623 2.249 1.00 1.52 C ATOM 2286 C ASN A1196 0.004 17.198 0.881 1.00 1.38 C ATOM 2287 O ASN A1196 -0.495 16.496 -0.001 1.00 1.22 O ATOM 2288 CB ASN A1196 1.922 16.314 2.325 1.00 1.78 C ATOM 2289 CG ASN A1196 2.433 16.403 3.744 1.00 2.01 C ATOM 2290 OD1 ASN A1196 2.849 17.457 4.204 1.00 2.91 O ATOM 2291 ND2 ASN A1196 2.386 15.334 4.501 1.00 1.88 N ATOM 0 H ASN A1196 -0.078 14.603 2.122 1.00 1.33 H new ATOM 0 HA ASN A1196 0.153 17.430 2.931 1.00 1.52 H new ATOM 0 HB2 ASN A1196 2.110 15.315 1.931 1.00 1.78 H new ATOM 0 HB3 ASN A1196 2.471 17.014 1.695 1.00 1.78 H new ATOM 0 HD21 ASN A1196 2.696 15.382 5.472 1.00 1.88 H new ATOM 0 HD22 ASN A1196 2.039 14.454 4.120 1.00 1.88 H new ATOM 2298 N ASN A1197 0.272 18.492 0.692 1.00 1.54 N ATOM 2299 CA ASN A1197 -0.135 19.261 -0.487 1.00 1.54 C ATOM 2300 C ASN A1197 0.596 18.849 -1.788 1.00 1.42 C ATOM 2301 O ASN A1197 -0.019 18.800 -2.856 1.00 1.35 O ATOM 2302 CB ASN A1197 0.092 20.746 -0.141 1.00 1.84 C ATOM 2303 CG ASN A1197 -0.597 21.722 -1.066 1.00 2.44 C ATOM 2304 OD1 ASN A1197 -1.514 21.399 -1.814 1.00 3.03 O ATOM 2305 ND2 ASN A1197 -0.192 22.961 -1.020 1.00 2.85 N ATOM 0 H ASN A1197 0.791 19.048 1.371 1.00 1.54 H new ATOM 0 HA ASN A1197 -1.183 19.060 -0.707 1.00 1.54 H new ATOM 0 HB2 ASN A1197 -0.254 20.925 0.877 1.00 1.84 H new ATOM 0 HB3 ASN A1197 1.163 20.948 -0.154 1.00 1.84 H new ATOM 0 HD21 ASN A1197 -0.638 23.666 -1.607 1.00 2.85 H new ATOM 0 HD22 ASN A1197 0.571 23.225 -0.397 1.00 2.85 H new ATOM 2312 N ASP A1198 1.891 18.507 -1.722 1.00 1.45 N ATOM 2313 CA ASP A1198 2.665 18.074 -2.900 1.00 1.37 C ATOM 2314 C ASP A1198 2.250 16.671 -3.390 1.00 1.21 C ATOM 2315 O ASP A1198 2.245 16.419 -4.596 1.00 1.20 O ATOM 2316 CB ASP A1198 4.175 18.119 -2.599 1.00 1.53 C ATOM 2317 CG ASP A1198 4.746 19.542 -2.552 1.00 1.85 C ATOM 2318 OD1 ASP A1198 4.652 20.200 -1.486 1.00 2.21 O ATOM 2319 OD2 ASP A1198 5.306 20.019 -3.571 1.00 2.91 O ATOM 0 H ASP A1198 2.431 18.522 -0.857 1.00 1.45 H new ATOM 0 HA ASP A1198 2.443 18.773 -3.706 1.00 1.37 H new ATOM 0 HB2 ASP A1198 4.362 17.629 -1.643 1.00 1.53 H new ATOM 0 HB3 ASP A1198 4.707 17.547 -3.360 1.00 1.53 H new ATOM 2324 N VAL A1199 1.858 15.760 -2.488 1.00 1.14 N ATOM 2325 CA VAL A1199 1.353 14.424 -2.868 1.00 1.10 C ATOM 2326 C VAL A1199 -0.086 14.477 -3.395 1.00 1.08 C ATOM 2327 O VAL A1199 -0.394 13.801 -4.378 1.00 1.10 O ATOM 2328 CB VAL A1199 1.563 13.384 -1.748 1.00 1.14 C ATOM 2329 CG1 VAL A1199 0.789 13.676 -0.463 1.00 1.15 C ATOM 2330 CG2 VAL A1199 1.202 11.973 -2.215 1.00 1.23 C ATOM 0 H VAL A1199 1.880 15.922 -1.481 1.00 1.14 H new ATOM 0 HA VAL A1199 1.957 14.077 -3.706 1.00 1.10 H new ATOM 0 HB VAL A1199 2.626 13.453 -1.518 1.00 1.14 H new ATOM 0 HG11 VAL A1199 0.994 12.896 0.270 1.00 1.15 H new ATOM 0 HG12 VAL A1199 1.099 14.641 -0.063 1.00 1.15 H new ATOM 0 HG13 VAL A1199 -0.279 13.699 -0.679 1.00 1.15 H new ATOM 0 HG21 VAL A1199 1.363 11.268 -1.400 1.00 1.23 H new ATOM 0 HG22 VAL A1199 0.155 11.946 -2.517 1.00 1.23 H new ATOM 0 HG23 VAL A1199 1.831 11.698 -3.062 1.00 1.23 H new ATOM 2340 N ASN A1200 -0.960 15.320 -2.824 1.00 1.07 N ATOM 2341 CA ASN A1200 -2.332 15.489 -3.323 1.00 1.08 C ATOM 2342 C ASN A1200 -2.361 16.021 -4.773 1.00 1.06 C ATOM 2343 O ASN A1200 -3.179 15.558 -5.565 1.00 1.03 O ATOM 2344 CB ASN A1200 -3.133 16.353 -2.338 1.00 1.13 C ATOM 2345 CG ASN A1200 -4.571 16.599 -2.778 1.00 1.39 C ATOM 2346 OD1 ASN A1200 -4.952 17.710 -3.120 1.00 2.75 O ATOM 2347 ND2 ASN A1200 -5.429 15.605 -2.788 1.00 1.98 N ATOM 0 H ASN A1200 -0.739 15.897 -2.013 1.00 1.07 H new ATOM 0 HA ASN A1200 -2.816 14.514 -3.375 1.00 1.08 H new ATOM 0 HB2 ASN A1200 -3.138 15.868 -1.362 1.00 1.13 H new ATOM 0 HB3 ASN A1200 -2.630 17.312 -2.215 1.00 1.13 H new ATOM 0 HD21 ASN A1200 -6.394 15.767 -3.077 1.00 1.98 H new ATOM 0 HD22 ASN A1200 -5.131 14.671 -2.506 1.00 1.98 H new ATOM 2354 N ASP A1201 -1.419 16.897 -5.153 1.00 1.11 N ATOM 2355 CA ASP A1201 -1.264 17.402 -6.528 1.00 1.11 C ATOM 2356 C ASP A1201 -1.013 16.298 -7.576 1.00 0.98 C ATOM 2357 O ASP A1201 -1.540 16.383 -8.688 1.00 1.09 O ATOM 2358 CB ASP A1201 -0.113 18.423 -6.562 1.00 1.28 C ATOM 2359 CG ASP A1201 0.253 18.823 -7.994 1.00 1.45 C ATOM 2360 OD1 ASP A1201 -0.523 19.573 -8.634 1.00 1.54 O ATOM 2361 OD2 ASP A1201 1.274 18.329 -8.531 1.00 2.72 O ATOM 0 H ASP A1201 -0.732 17.281 -4.504 1.00 1.11 H new ATOM 0 HA ASP A1201 -2.211 17.867 -6.801 1.00 1.11 H new ATOM 0 HB2 ASP A1201 -0.399 19.311 -5.999 1.00 1.28 H new ATOM 0 HB3 ASP A1201 0.762 18.000 -6.068 1.00 1.28 H new ATOM 2366 N PHE A1202 -0.200 15.289 -7.256 1.00 0.93 N ATOM 2367 CA PHE A1202 -0.007 14.091 -8.087 1.00 0.92 C ATOM 2368 C PHE A1202 -1.206 13.130 -8.014 1.00 0.78 C ATOM 2369 O PHE A1202 -1.681 12.653 -9.043 1.00 0.89 O ATOM 2370 CB PHE A1202 1.305 13.412 -7.657 1.00 1.20 C ATOM 2371 CG PHE A1202 1.576 12.041 -8.253 1.00 1.23 C ATOM 2372 CD1 PHE A1202 1.520 11.828 -9.645 1.00 2.73 C ATOM 2373 CD2 PHE A1202 1.910 10.972 -7.402 1.00 1.50 C ATOM 2374 CE1 PHE A1202 1.769 10.548 -10.176 1.00 2.91 C ATOM 2375 CE2 PHE A1202 2.163 9.693 -7.932 1.00 1.69 C ATOM 2376 CZ PHE A1202 2.084 9.479 -9.319 1.00 1.76 C ATOM 0 H PHE A1202 0.353 15.278 -6.399 1.00 0.93 H new ATOM 0 HA PHE A1202 0.061 14.386 -9.134 1.00 0.92 H new ATOM 0 HB2 PHE A1202 2.134 14.070 -7.920 1.00 1.20 H new ATOM 0 HB3 PHE A1202 1.303 13.319 -6.571 1.00 1.20 H new ATOM 0 HD1 PHE A1202 1.285 12.649 -10.306 1.00 2.73 H new ATOM 0 HD2 PHE A1202 1.973 11.134 -6.336 1.00 1.50 H new ATOM 0 HE1 PHE A1202 1.718 10.387 -11.243 1.00 2.91 H new ATOM 0 HE2 PHE A1202 2.418 8.876 -7.273 1.00 1.69 H new ATOM 0 HZ PHE A1202 2.265 8.495 -9.726 1.00 1.76 H new ATOM 2386 N MET A1203 -1.722 12.872 -6.809 1.00 0.72 N ATOM 2387 CA MET A1203 -2.812 11.920 -6.560 1.00 0.66 C ATOM 2388 C MET A1203 -4.087 12.305 -7.324 1.00 0.61 C ATOM 2389 O MET A1203 -4.574 11.533 -8.147 1.00 0.70 O ATOM 2390 CB MET A1203 -3.060 11.864 -5.041 1.00 0.80 C ATOM 2391 CG MET A1203 -4.099 10.832 -4.586 1.00 0.81 C ATOM 2392 SD MET A1203 -3.658 9.082 -4.779 1.00 0.88 S ATOM 2393 CE MET A1203 -2.172 8.970 -3.753 1.00 0.65 C ATOM 0 H MET A1203 -1.388 13.328 -5.960 1.00 0.72 H new ATOM 0 HA MET A1203 -2.527 10.933 -6.925 1.00 0.66 H new ATOM 0 HB2 MET A1203 -2.115 11.648 -4.543 1.00 0.80 H new ATOM 0 HB3 MET A1203 -3.380 12.850 -4.705 1.00 0.80 H new ATOM 0 HG2 MET A1203 -4.318 11.012 -3.534 1.00 0.81 H new ATOM 0 HG3 MET A1203 -5.021 11.012 -5.139 1.00 0.81 H new ATOM 0 HE1 MET A1203 -1.912 7.922 -3.602 1.00 0.65 H new ATOM 0 HE2 MET A1203 -1.347 9.480 -4.250 1.00 0.65 H new ATOM 0 HE3 MET A1203 -2.360 9.440 -2.788 1.00 0.65 H new ATOM 2403 N THR A1204 -4.598 13.524 -7.121 1.00 0.64 N ATOM 2404 CA THR A1204 -5.840 13.997 -7.758 1.00 0.84 C ATOM 2405 C THR A1204 -5.701 14.145 -9.278 1.00 0.92 C ATOM 2406 O THR A1204 -6.646 13.897 -10.020 1.00 1.18 O ATOM 2407 CB THR A1204 -6.291 15.308 -7.091 1.00 1.06 C ATOM 2408 OG1 THR A1204 -7.665 15.519 -7.318 1.00 1.43 O ATOM 2409 CG2 THR A1204 -5.531 16.545 -7.575 1.00 0.92 C ATOM 0 H THR A1204 -4.164 14.215 -6.509 1.00 0.64 H new ATOM 0 HA THR A1204 -6.611 13.241 -7.607 1.00 0.84 H new ATOM 0 HB THR A1204 -6.075 15.185 -6.030 1.00 1.06 H new ATOM 0 HG1 THR A1204 -7.943 16.355 -6.888 1.00 1.43 H new ATOM 0 HG21 THR A1204 -5.907 17.428 -7.058 1.00 0.92 H new ATOM 0 HG22 THR A1204 -4.468 16.425 -7.363 1.00 0.92 H new ATOM 0 HG23 THR A1204 -5.676 16.664 -8.649 1.00 0.92 H new ATOM 2417 N GLU A1205 -4.498 14.463 -9.764 1.00 0.83 N ATOM 2418 CA GLU A1205 -4.159 14.481 -11.191 1.00 1.04 C ATOM 2419 C GLU A1205 -4.299 13.085 -11.818 1.00 1.12 C ATOM 2420 O GLU A1205 -4.927 12.948 -12.870 1.00 1.30 O ATOM 2421 CB GLU A1205 -2.743 15.038 -11.328 1.00 1.11 C ATOM 2422 CG GLU A1205 -2.228 15.220 -12.754 1.00 1.56 C ATOM 2423 CD GLU A1205 -2.736 16.517 -13.394 1.00 2.34 C ATOM 2424 OE1 GLU A1205 -3.968 16.674 -13.561 1.00 3.52 O ATOM 2425 OE2 GLU A1205 -1.918 17.424 -13.685 1.00 2.77 O ATOM 0 H GLU A1205 -3.715 14.721 -9.164 1.00 0.83 H new ATOM 0 HA GLU A1205 -4.853 15.120 -11.737 1.00 1.04 H new ATOM 0 HB2 GLU A1205 -2.704 16.003 -10.823 1.00 1.11 H new ATOM 0 HB3 GLU A1205 -2.060 14.373 -10.799 1.00 1.11 H new ATOM 0 HG2 GLU A1205 -1.138 15.224 -12.747 1.00 1.56 H new ATOM 0 HG3 GLU A1205 -2.540 14.371 -13.362 1.00 1.56 H new ATOM 2432 N HIS A1206 -3.777 12.053 -11.144 1.00 1.03 N ATOM 2433 CA HIS A1206 -3.867 10.646 -11.553 1.00 1.09 C ATOM 2434 C HIS A1206 -5.309 10.113 -11.478 1.00 1.15 C ATOM 2435 O HIS A1206 -5.765 9.398 -12.370 1.00 1.31 O ATOM 2436 CB HIS A1206 -2.932 9.822 -10.657 1.00 1.12 C ATOM 2437 CG HIS A1206 -2.511 8.516 -11.276 1.00 1.89 C ATOM 2438 ND1 HIS A1206 -3.253 7.361 -11.389 1.00 3.12 N ATOM 2439 CD2 HIS A1206 -1.278 8.260 -11.806 1.00 2.44 C ATOM 2440 CE1 HIS A1206 -2.468 6.426 -11.950 1.00 3.94 C ATOM 2441 NE2 HIS A1206 -1.262 6.936 -12.262 1.00 3.66 N ATOM 0 H HIS A1206 -3.264 12.178 -10.271 1.00 1.03 H new ATOM 0 HA HIS A1206 -3.562 10.560 -12.596 1.00 1.09 H new ATOM 0 HB2 HIS A1206 -2.044 10.412 -10.431 1.00 1.12 H new ATOM 0 HB3 HIS A1206 -3.432 9.622 -9.709 1.00 1.12 H new ATOM 0 HD1 HIS A1206 -4.223 7.238 -11.099 1.00 3.12 H new ATOM 0 HD2 HIS A1206 -0.457 8.959 -11.863 1.00 2.44 H new ATOM 0 HE1 HIS A1206 -2.765 5.403 -12.127 1.00 3.94 H new ATOM 2449 N GLU A1207 -6.058 10.509 -10.447 1.00 1.07 N ATOM 2450 CA GLU A1207 -7.484 10.205 -10.325 1.00 1.24 C ATOM 2451 C GLU A1207 -8.312 10.842 -11.455 1.00 1.43 C ATOM 2452 O GLU A1207 -9.151 10.174 -12.066 1.00 1.58 O ATOM 2453 CB GLU A1207 -8.002 10.700 -8.968 1.00 1.27 C ATOM 2454 CG GLU A1207 -7.535 9.898 -7.754 1.00 1.44 C ATOM 2455 CD GLU A1207 -8.354 10.323 -6.536 1.00 2.70 C ATOM 2456 OE1 GLU A1207 -8.013 11.333 -5.876 1.00 3.87 O ATOM 2457 OE2 GLU A1207 -9.392 9.677 -6.258 1.00 3.07 O ATOM 0 H GLU A1207 -5.689 11.054 -9.668 1.00 1.07 H new ATOM 0 HA GLU A1207 -7.597 9.124 -10.401 1.00 1.24 H new ATOM 0 HB2 GLU A1207 -7.693 11.737 -8.837 1.00 1.27 H new ATOM 0 HB3 GLU A1207 -9.092 10.692 -8.990 1.00 1.27 H new ATOM 0 HG2 GLU A1207 -7.658 8.831 -7.937 1.00 1.44 H new ATOM 0 HG3 GLU A1207 -6.474 10.070 -7.574 1.00 1.44 H new ATOM 2464 N ARG A1208 -8.075 12.120 -11.785 1.00 1.51 N ATOM 2465 CA ARG A1208 -8.836 12.865 -12.810 1.00 1.85 C ATOM 2466 C ARG A1208 -8.551 12.390 -14.244 1.00 2.05 C ATOM 2467 O ARG A1208 -9.436 12.504 -15.097 1.00 2.35 O ATOM 2468 CB ARG A1208 -8.653 14.381 -12.588 1.00 1.95 C ATOM 2469 CG ARG A1208 -9.450 14.826 -11.342 1.00 2.11 C ATOM 2470 CD ARG A1208 -9.130 16.248 -10.865 1.00 2.32 C ATOM 2471 NE ARG A1208 -9.983 16.610 -9.715 1.00 3.37 N ATOM 2472 CZ ARG A1208 -9.852 17.643 -8.905 1.00 4.00 C ATOM 2473 NH1 ARG A1208 -8.911 18.533 -8.995 1.00 4.01 N ATOM 2474 NH2 ARG A1208 -10.700 17.819 -7.944 1.00 5.18 N ATOM 0 H ARG A1208 -7.342 12.676 -11.345 1.00 1.51 H new ATOM 0 HA ARG A1208 -9.896 12.646 -12.686 1.00 1.85 H new ATOM 0 HB2 ARG A1208 -7.596 14.614 -12.458 1.00 1.95 H new ATOM 0 HB3 ARG A1208 -8.995 14.930 -13.465 1.00 1.95 H new ATOM 0 HG2 ARG A1208 -10.515 14.760 -11.564 1.00 2.11 H new ATOM 0 HG3 ARG A1208 -9.250 14.128 -10.529 1.00 2.11 H new ATOM 0 HD2 ARG A1208 -8.080 16.316 -10.582 1.00 2.32 H new ATOM 0 HD3 ARG A1208 -9.287 16.955 -11.679 1.00 2.32 H new ATOM 0 HE ARG A1208 -10.767 15.987 -9.524 1.00 3.37 H new ATOM 0 HH11 ARG A1208 -8.208 18.459 -9.730 1.00 4.01 H new ATOM 0 HH12 ARG A1208 -8.875 19.306 -8.330 1.00 4.01 H new ATOM 0 HH21 ARG A1208 -11.468 17.160 -7.814 1.00 5.18 H new ATOM 0 HH22 ARG A1208 -10.601 18.617 -7.316 1.00 5.18 H new ATOM 2488 N LYS A1209 -7.409 11.725 -14.474 1.00 1.96 N ATOM 2489 CA LYS A1209 -7.111 10.981 -15.722 1.00 2.22 C ATOM 2490 C LYS A1209 -7.642 9.537 -15.759 1.00 2.12 C ATOM 2491 O LYS A1209 -7.324 8.779 -16.677 1.00 2.20 O ATOM 2492 CB LYS A1209 -5.667 11.123 -16.159 1.00 2.38 C ATOM 2493 CG LYS A1209 -4.740 10.431 -15.193 1.00 2.38 C ATOM 2494 CD LYS A1209 -3.493 9.938 -15.869 1.00 2.46 C ATOM 2495 CE LYS A1209 -2.747 11.034 -16.621 1.00 2.80 C ATOM 2496 NZ LYS A1209 -1.489 10.531 -17.212 1.00 3.26 N ATOM 0 H LYS A1209 -6.651 11.684 -13.793 1.00 1.96 H new ATOM 0 HA LYS A1209 -7.702 11.479 -16.490 1.00 2.22 H new ATOM 0 HB2 LYS A1209 -5.542 10.700 -17.156 1.00 2.38 H new ATOM 0 HB3 LYS A1209 -5.406 12.179 -16.226 1.00 2.38 H new ATOM 0 HG2 LYS A1209 -4.471 11.119 -14.392 1.00 2.38 H new ATOM 0 HG3 LYS A1209 -5.259 9.591 -14.731 1.00 2.38 H new ATOM 0 HD2 LYS A1209 -2.830 9.502 -15.122 1.00 2.46 H new ATOM 0 HD3 LYS A1209 -3.755 9.142 -16.565 1.00 2.46 H new ATOM 0 HE2 LYS A1209 -3.385 11.434 -17.409 1.00 2.80 H new ATOM 0 HE3 LYS A1209 -2.526 11.857 -15.941 1.00 2.80 H new ATOM 0 HZ1 LYS A1209 -1.009 11.304 -17.716 1.00 3.26 H new ATOM 0 HZ2 LYS A1209 -0.870 10.172 -16.457 1.00 3.26 H new ATOM 0 HZ3 LYS A1209 -1.702 9.763 -17.880 1.00 3.26 H new ATOM 2510 N GLY A1210 -8.438 9.142 -14.763 1.00 2.01 N ATOM 2511 CA GLY A1210 -9.168 7.873 -14.750 1.00 2.00 C ATOM 2512 C GLY A1210 -8.318 6.618 -14.536 1.00 1.63 C ATOM 2513 O GLY A1210 -8.746 5.537 -14.938 1.00 1.66 O ATOM 0 H GLY A1210 -8.596 9.706 -13.928 1.00 2.01 H new ATOM 0 HA2 GLY A1210 -9.922 7.917 -13.964 1.00 2.00 H new ATOM 0 HA3 GLY A1210 -9.700 7.772 -15.696 1.00 2.00 H new ATOM 2517 N ARG A1211 -7.110 6.737 -13.962 1.00 1.34 N ATOM 2518 CA ARG A1211 -6.230 5.599 -13.631 1.00 1.13 C ATOM 2519 C ARG A1211 -6.139 5.418 -12.108 1.00 0.74 C ATOM 2520 O ARG A1211 -6.158 6.394 -11.352 1.00 0.99 O ATOM 2521 CB ARG A1211 -4.851 5.754 -14.305 1.00 1.36 C ATOM 2522 CG ARG A1211 -4.765 5.298 -15.775 1.00 1.73 C ATOM 2523 CD ARG A1211 -5.536 6.189 -16.753 1.00 2.64 C ATOM 2524 NE ARG A1211 -5.286 5.816 -18.158 1.00 2.88 N ATOM 2525 CZ ARG A1211 -5.768 6.436 -19.218 1.00 3.73 C ATOM 2526 NH1 ARG A1211 -6.542 7.482 -19.130 1.00 4.77 N ATOM 2527 NH2 ARG A1211 -5.469 6.009 -20.408 1.00 4.02 N ATOM 0 H ARG A1211 -6.709 7.640 -13.710 1.00 1.34 H new ATOM 0 HA ARG A1211 -6.664 4.683 -14.032 1.00 1.13 H new ATOM 0 HB2 ARG A1211 -4.558 6.803 -14.252 1.00 1.36 H new ATOM 0 HB3 ARG A1211 -4.120 5.190 -13.726 1.00 1.36 H new ATOM 0 HG2 ARG A1211 -3.717 5.270 -16.075 1.00 1.73 H new ATOM 0 HG3 ARG A1211 -5.146 4.279 -15.851 1.00 1.73 H new ATOM 0 HD2 ARG A1211 -6.603 6.118 -16.544 1.00 2.64 H new ATOM 0 HD3 ARG A1211 -5.250 7.229 -16.598 1.00 2.64 H new ATOM 0 HE ARG A1211 -4.687 5.007 -18.325 1.00 2.88 H new ATOM 0 HH11 ARG A1211 -6.797 7.852 -18.214 1.00 4.77 H new ATOM 0 HH12 ARG A1211 -6.892 7.930 -19.977 1.00 4.77 H new ATOM 0 HH21 ARG A1211 -4.863 5.196 -20.521 1.00 4.02 H new ATOM 0 HH22 ARG A1211 -5.840 6.486 -21.229 1.00 4.02 H new ATOM 2541 N THR A1212 -6.061 4.172 -11.649 1.00 0.78 N ATOM 2542 CA THR A1212 -6.175 3.787 -10.231 1.00 0.63 C ATOM 2543 C THR A1212 -5.076 4.412 -9.365 1.00 0.59 C ATOM 2544 O THR A1212 -3.886 4.225 -9.615 1.00 0.64 O ATOM 2545 CB THR A1212 -6.160 2.257 -10.094 1.00 0.69 C ATOM 2546 OG1 THR A1212 -7.304 1.728 -10.726 1.00 0.80 O ATOM 2547 CG2 THR A1212 -6.204 1.759 -8.649 1.00 0.79 C ATOM 0 H THR A1212 -5.912 3.373 -12.266 1.00 0.78 H new ATOM 0 HA THR A1212 -7.127 4.174 -9.867 1.00 0.63 H new ATOM 0 HB THR A1212 -5.222 1.931 -10.544 1.00 0.69 H new ATOM 0 HG1 THR A1212 -7.301 0.751 -10.644 1.00 0.80 H new ATOM 0 HG21 THR A1212 -6.190 0.669 -8.639 1.00 0.79 H new ATOM 0 HG22 THR A1212 -5.337 2.138 -8.107 1.00 0.79 H new ATOM 0 HG23 THR A1212 -7.116 2.115 -8.169 1.00 0.79 H new ATOM 2555 N ALA A1213 -5.481 5.134 -8.319 1.00 0.56 N ATOM 2556 CA ALA A1213 -4.590 5.841 -7.398 1.00 0.55 C ATOM 2557 C ALA A1213 -4.937 5.478 -5.937 1.00 0.56 C ATOM 2558 O ALA A1213 -6.106 5.594 -5.552 1.00 0.68 O ATOM 2559 CB ALA A1213 -4.742 7.339 -7.713 1.00 0.66 C ATOM 0 H ALA A1213 -6.467 5.246 -8.082 1.00 0.56 H new ATOM 0 HA ALA A1213 -3.546 5.555 -7.523 1.00 0.55 H new ATOM 0 HB1 ALA A1213 -4.096 7.917 -7.052 1.00 0.66 H new ATOM 0 HB2 ALA A1213 -4.459 7.523 -8.749 1.00 0.66 H new ATOM 0 HB3 ALA A1213 -5.779 7.639 -7.561 1.00 0.66 H new ATOM 2565 N VAL A1214 -3.967 5.003 -5.138 1.00 0.49 N ATOM 2566 CA VAL A1214 -4.163 4.586 -3.725 1.00 0.46 C ATOM 2567 C VAL A1214 -2.987 4.960 -2.805 1.00 0.45 C ATOM 2568 O VAL A1214 -1.855 5.159 -3.247 1.00 0.47 O ATOM 2569 CB VAL A1214 -4.489 3.079 -3.583 1.00 0.47 C ATOM 2570 CG1 VAL A1214 -5.787 2.678 -4.293 1.00 0.52 C ATOM 2571 CG2 VAL A1214 -3.365 2.162 -4.067 1.00 0.48 C ATOM 0 H VAL A1214 -3.004 4.893 -5.455 1.00 0.49 H new ATOM 0 HA VAL A1214 -5.031 5.156 -3.394 1.00 0.46 H new ATOM 0 HB VAL A1214 -4.611 2.941 -2.509 1.00 0.47 H new ATOM 0 HG11 VAL A1214 -5.961 1.611 -4.157 1.00 0.52 H new ATOM 0 HG12 VAL A1214 -6.621 3.238 -3.870 1.00 0.52 H new ATOM 0 HG13 VAL A1214 -5.703 2.900 -5.357 1.00 0.52 H new ATOM 0 HG21 VAL A1214 -3.663 1.122 -3.937 1.00 0.48 H new ATOM 0 HG22 VAL A1214 -3.167 2.354 -5.122 1.00 0.48 H new ATOM 0 HG23 VAL A1214 -2.462 2.356 -3.487 1.00 0.48 H new ATOM 2581 N LEU A1215 -3.248 5.021 -1.498 1.00 0.46 N ATOM 2582 CA LEU A1215 -2.292 5.337 -0.426 1.00 0.44 C ATOM 2583 C LEU A1215 -2.014 4.112 0.463 1.00 0.44 C ATOM 2584 O LEU A1215 -2.842 3.206 0.540 1.00 0.43 O ATOM 2585 CB LEU A1215 -2.869 6.503 0.385 1.00 0.52 C ATOM 2586 CG LEU A1215 -2.697 7.838 -0.351 1.00 0.50 C ATOM 2587 CD1 LEU A1215 -3.909 8.730 -0.119 1.00 0.70 C ATOM 2588 CD2 LEU A1215 -1.435 8.561 0.123 1.00 1.31 C ATOM 0 H LEU A1215 -4.184 4.842 -1.135 1.00 0.46 H new ATOM 0 HA LEU A1215 -1.331 5.621 -0.855 1.00 0.44 H new ATOM 0 HB2 LEU A1215 -3.927 6.326 0.577 1.00 0.52 H new ATOM 0 HB3 LEU A1215 -2.373 6.554 1.354 1.00 0.52 H new ATOM 0 HG LEU A1215 -2.603 7.625 -1.416 1.00 0.50 H new ATOM 0 HD11 LEU A1215 -3.773 9.674 -0.647 1.00 0.70 H new ATOM 0 HD12 LEU A1215 -4.804 8.232 -0.491 1.00 0.70 H new ATOM 0 HD13 LEU A1215 -4.019 8.924 0.948 1.00 0.70 H new ATOM 0 HD21 LEU A1215 -1.334 9.505 -0.413 1.00 1.31 H new ATOM 0 HD22 LEU A1215 -1.508 8.757 1.193 1.00 1.31 H new ATOM 0 HD23 LEU A1215 -0.563 7.937 -0.073 1.00 1.31 H new ATOM 2600 N VAL A1216 -0.880 4.091 1.178 1.00 0.46 N ATOM 2601 CA VAL A1216 -0.515 3.013 2.119 1.00 0.49 C ATOM 2602 C VAL A1216 0.129 3.545 3.407 1.00 0.52 C ATOM 2603 O VAL A1216 1.074 4.336 3.387 1.00 0.65 O ATOM 2604 CB VAL A1216 0.325 1.926 1.418 1.00 0.83 C ATOM 2605 CG1 VAL A1216 1.596 2.430 0.724 1.00 1.91 C ATOM 2606 CG2 VAL A1216 0.688 0.772 2.354 1.00 1.95 C ATOM 0 H VAL A1216 -0.179 4.830 1.121 1.00 0.46 H new ATOM 0 HA VAL A1216 -1.439 2.534 2.445 1.00 0.49 H new ATOM 0 HB VAL A1216 -0.342 1.569 0.633 1.00 0.83 H new ATOM 0 HG11 VAL A1216 2.116 1.591 0.262 1.00 1.91 H new ATOM 0 HG12 VAL A1216 1.328 3.157 -0.042 1.00 1.91 H new ATOM 0 HG13 VAL A1216 2.249 2.901 1.459 1.00 1.91 H new ATOM 0 HG21 VAL A1216 1.279 0.035 1.811 1.00 1.95 H new ATOM 0 HG22 VAL A1216 1.268 1.154 3.194 1.00 1.95 H new ATOM 0 HG23 VAL A1216 -0.224 0.304 2.725 1.00 1.95 H new ATOM 2616 N ALA A1217 -0.404 3.109 4.547 1.00 0.47 N ATOM 2617 CA ALA A1217 -0.111 3.579 5.902 1.00 0.49 C ATOM 2618 C ALA A1217 0.204 2.396 6.842 1.00 0.44 C ATOM 2619 O ALA A1217 -0.286 1.287 6.622 1.00 0.42 O ATOM 2620 CB ALA A1217 -1.316 4.376 6.388 1.00 0.52 C ATOM 0 H ALA A1217 -1.102 2.365 4.549 1.00 0.47 H new ATOM 0 HA ALA A1217 0.774 4.215 5.900 1.00 0.49 H new ATOM 0 HB1 ALA A1217 -1.128 4.741 7.398 1.00 0.52 H new ATOM 0 HB2 ALA A1217 -1.485 5.222 5.722 1.00 0.52 H new ATOM 0 HB3 ALA A1217 -2.198 3.736 6.392 1.00 0.52 H new ATOM 2626 N VAL A1218 0.991 2.608 7.899 1.00 0.47 N ATOM 2627 CA VAL A1218 1.397 1.546 8.846 1.00 0.49 C ATOM 2628 C VAL A1218 1.489 2.061 10.283 1.00 0.52 C ATOM 2629 O VAL A1218 2.013 3.147 10.530 1.00 0.54 O ATOM 2630 CB VAL A1218 2.707 0.827 8.439 1.00 0.73 C ATOM 2631 CG1 VAL A1218 2.687 0.314 6.993 1.00 0.64 C ATOM 2632 CG2 VAL A1218 3.957 1.692 8.582 1.00 0.98 C ATOM 0 H VAL A1218 1.372 3.525 8.131 1.00 0.47 H new ATOM 0 HA VAL A1218 0.601 0.802 8.800 1.00 0.49 H new ATOM 0 HB VAL A1218 2.755 -0.006 9.140 1.00 0.73 H new ATOM 0 HG11 VAL A1218 3.633 -0.180 6.769 1.00 0.64 H new ATOM 0 HG12 VAL A1218 1.869 -0.396 6.870 1.00 0.64 H new ATOM 0 HG13 VAL A1218 2.545 1.153 6.311 1.00 0.64 H new ATOM 0 HG21 VAL A1218 4.833 1.119 8.278 1.00 0.98 H new ATOM 0 HG22 VAL A1218 3.863 2.574 7.949 1.00 0.98 H new ATOM 0 HG23 VAL A1218 4.068 2.001 9.621 1.00 0.98 H new ATOM 2642 N ASP A1219 0.963 1.280 11.232 1.00 0.55 N ATOM 2643 CA ASP A1219 0.921 1.578 12.673 1.00 0.59 C ATOM 2644 C ASP A1219 0.560 3.049 12.953 1.00 0.58 C ATOM 2645 O ASP A1219 1.233 3.778 13.675 1.00 0.67 O ATOM 2646 CB ASP A1219 2.183 1.020 13.343 1.00 0.69 C ATOM 2647 CG ASP A1219 2.227 1.230 14.859 1.00 1.74 C ATOM 2648 OD1 ASP A1219 1.482 0.514 15.572 1.00 2.68 O ATOM 2649 OD2 ASP A1219 3.018 2.068 15.351 1.00 2.99 O ATOM 0 H ASP A1219 0.535 0.381 11.010 1.00 0.55 H new ATOM 0 HA ASP A1219 0.094 1.057 13.156 1.00 0.59 H new ATOM 0 HB2 ASP A1219 2.253 -0.047 13.132 1.00 0.69 H new ATOM 0 HB3 ASP A1219 3.058 1.491 12.896 1.00 0.69 H new ATOM 2654 N ASP A1220 -0.534 3.474 12.318 1.00 0.56 N ATOM 2655 CA ASP A1220 -1.172 4.783 12.474 1.00 0.57 C ATOM 2656 C ASP A1220 -0.361 6.004 11.988 1.00 0.56 C ATOM 2657 O ASP A1220 -0.676 7.138 12.354 1.00 0.73 O ATOM 2658 CB ASP A1220 -1.775 4.912 13.884 1.00 0.64 C ATOM 2659 CG ASP A1220 -2.487 3.620 14.302 1.00 0.74 C ATOM 2660 OD1 ASP A1220 -3.470 3.245 13.623 1.00 1.39 O ATOM 2661 OD2 ASP A1220 -2.043 2.928 15.254 1.00 1.54 O ATOM 0 H ASP A1220 -1.024 2.884 11.646 1.00 0.56 H new ATOM 0 HA ASP A1220 -1.994 4.811 11.759 1.00 0.57 H new ATOM 0 HB2 ASP A1220 -0.986 5.144 14.600 1.00 0.64 H new ATOM 0 HB3 ASP A1220 -2.480 5.743 13.906 1.00 0.64 H new ATOM 2666 N GLU A1221 0.612 5.790 11.092 1.00 0.47 N ATOM 2667 CA GLU A1221 1.363 6.808 10.339 1.00 0.47 C ATOM 2668 C GLU A1221 1.297 6.506 8.823 1.00 0.42 C ATOM 2669 O GLU A1221 1.183 5.348 8.421 1.00 0.50 O ATOM 2670 CB GLU A1221 2.826 6.826 10.834 1.00 0.58 C ATOM 2671 CG GLU A1221 3.524 8.190 10.741 1.00 1.09 C ATOM 2672 CD GLU A1221 3.053 9.133 11.858 1.00 1.28 C ATOM 2673 OE1 GLU A1221 2.017 9.822 11.691 1.00 2.14 O ATOM 2674 OE2 GLU A1221 3.697 9.167 12.934 1.00 2.48 O ATOM 0 H GLU A1221 0.915 4.845 10.858 1.00 0.47 H new ATOM 0 HA GLU A1221 0.920 7.790 10.505 1.00 0.47 H new ATOM 0 HB2 GLU A1221 2.847 6.494 11.872 1.00 0.58 H new ATOM 0 HB3 GLU A1221 3.399 6.101 10.256 1.00 0.58 H new ATOM 0 HG2 GLU A1221 4.603 8.054 10.807 1.00 1.09 H new ATOM 0 HG3 GLU A1221 3.319 8.641 9.770 1.00 1.09 H new ATOM 2681 N LEU A1222 1.371 7.510 7.943 1.00 0.40 N ATOM 2682 CA LEU A1222 1.464 7.278 6.486 1.00 0.44 C ATOM 2683 C LEU A1222 2.878 6.829 6.067 1.00 0.55 C ATOM 2684 O LEU A1222 3.847 7.367 6.602 1.00 0.75 O ATOM 2685 CB LEU A1222 1.019 8.542 5.717 1.00 0.50 C ATOM 2686 CG LEU A1222 -0.258 8.301 4.897 1.00 0.51 C ATOM 2687 CD1 LEU A1222 -0.831 9.606 4.373 1.00 0.68 C ATOM 2688 CD2 LEU A1222 0.006 7.358 3.726 1.00 0.67 C ATOM 0 H LEU A1222 1.369 8.495 8.209 1.00 0.40 H new ATOM 0 HA LEU A1222 0.788 6.462 6.228 1.00 0.44 H new ATOM 0 HB2 LEU A1222 0.847 9.354 6.424 1.00 0.50 H new ATOM 0 HB3 LEU A1222 1.821 8.862 5.052 1.00 0.50 H new ATOM 0 HG LEU A1222 -0.984 7.840 5.567 1.00 0.51 H new ATOM 0 HD11 LEU A1222 -1.734 9.402 3.797 1.00 0.68 H new ATOM 0 HD12 LEU A1222 -1.075 10.259 5.211 1.00 0.68 H new ATOM 0 HD13 LEU A1222 -0.096 10.096 3.734 1.00 0.68 H new ATOM 0 HD21 LEU A1222 -0.916 7.207 3.165 1.00 0.67 H new ATOM 0 HD22 LEU A1222 0.761 7.793 3.072 1.00 0.67 H new ATOM 0 HD23 LEU A1222 0.362 6.399 4.104 1.00 0.67 H new ATOM 2700 N CYS A1223 3.019 5.914 5.089 1.00 0.52 N ATOM 2701 CA CYS A1223 4.342 5.498 4.582 1.00 0.56 C ATOM 2702 C CYS A1223 4.572 5.791 3.090 1.00 0.55 C ATOM 2703 O CYS A1223 5.666 6.225 2.727 1.00 0.60 O ATOM 2704 CB CYS A1223 4.641 4.032 4.946 1.00 0.60 C ATOM 2705 SG CYS A1223 3.669 2.820 4.014 1.00 0.68 S ATOM 0 H CYS A1223 2.234 5.449 4.634 1.00 0.52 H new ATOM 0 HA CYS A1223 5.068 6.129 5.095 1.00 0.56 H new ATOM 0 HB2 CYS A1223 5.700 3.837 4.779 1.00 0.60 H new ATOM 0 HB3 CYS A1223 4.455 3.889 6.010 1.00 0.60 H new ATOM 0 HG CYS A1223 2.603 3.392 3.539 1.00 0.68 H new ATOM 2711 N GLY A1224 3.567 5.619 2.225 1.00 0.52 N ATOM 2712 CA GLY A1224 3.753 5.732 0.775 1.00 0.58 C ATOM 2713 C GLY A1224 2.452 5.724 -0.038 1.00 0.52 C ATOM 2714 O GLY A1224 1.352 5.786 0.517 1.00 0.46 O ATOM 0 H GLY A1224 2.611 5.400 2.506 1.00 0.52 H new ATOM 0 HA2 GLY A1224 4.294 6.654 0.562 1.00 0.58 H new ATOM 0 HA3 GLY A1224 4.382 4.908 0.437 1.00 0.58 H new ATOM 2718 N LEU A1225 2.581 5.678 -1.366 1.00 0.56 N ATOM 2719 CA LEU A1225 1.478 5.642 -2.333 1.00 0.53 C ATOM 2720 C LEU A1225 1.775 4.740 -3.545 1.00 0.60 C ATOM 2721 O LEU A1225 2.930 4.583 -3.943 1.00 0.68 O ATOM 2722 CB LEU A1225 1.091 7.068 -2.772 1.00 0.55 C ATOM 2723 CG LEU A1225 2.203 7.910 -3.437 1.00 0.62 C ATOM 2724 CD1 LEU A1225 1.565 8.953 -4.349 1.00 0.85 C ATOM 2725 CD2 LEU A1225 3.069 8.676 -2.428 1.00 0.54 C ATOM 0 H LEU A1225 3.496 5.664 -1.817 1.00 0.56 H new ATOM 0 HA LEU A1225 0.624 5.194 -1.825 1.00 0.53 H new ATOM 0 HB2 LEU A1225 0.255 6.996 -3.468 1.00 0.55 H new ATOM 0 HB3 LEU A1225 0.731 7.609 -1.897 1.00 0.55 H new ATOM 0 HG LEU A1225 2.836 7.206 -3.978 1.00 0.62 H new ATOM 0 HD11 LEU A1225 2.345 9.550 -4.821 1.00 0.85 H new ATOM 0 HD12 LEU A1225 0.976 8.453 -5.118 1.00 0.85 H new ATOM 0 HD13 LEU A1225 0.917 9.603 -3.761 1.00 0.85 H new ATOM 0 HD21 LEU A1225 3.830 9.246 -2.961 1.00 0.54 H new ATOM 0 HD22 LEU A1225 2.441 9.357 -1.853 1.00 0.54 H new ATOM 0 HD23 LEU A1225 3.552 7.970 -1.753 1.00 0.54 H new ATOM 2737 N ILE A1226 0.718 4.179 -4.142 1.00 0.59 N ATOM 2738 CA ILE A1226 0.761 3.267 -5.297 1.00 0.64 C ATOM 2739 C ILE A1226 -0.134 3.806 -6.425 1.00 0.57 C ATOM 2740 O ILE A1226 -1.268 4.231 -6.193 1.00 0.51 O ATOM 2741 CB ILE A1226 0.324 1.831 -4.901 1.00 0.72 C ATOM 2742 CG1 ILE A1226 0.952 1.280 -3.597 1.00 0.82 C ATOM 2743 CG2 ILE A1226 0.539 0.841 -6.059 1.00 0.81 C ATOM 2744 CD1 ILE A1226 2.466 1.038 -3.638 1.00 0.84 C ATOM 0 H ILE A1226 -0.234 4.354 -3.821 1.00 0.59 H new ATOM 0 HA ILE A1226 1.791 3.215 -5.650 1.00 0.64 H new ATOM 0 HB ILE A1226 -0.741 1.927 -4.688 1.00 0.72 H new ATOM 0 HG12 ILE A1226 0.736 1.978 -2.788 1.00 0.82 H new ATOM 0 HG13 ILE A1226 0.459 0.340 -3.347 1.00 0.82 H new ATOM 0 HG21 ILE A1226 0.223 -0.155 -5.749 1.00 0.81 H new ATOM 0 HG22 ILE A1226 -0.049 1.156 -6.921 1.00 0.81 H new ATOM 0 HG23 ILE A1226 1.595 0.820 -6.328 1.00 0.81 H new ATOM 0 HD11 ILE A1226 2.799 0.653 -2.674 1.00 0.84 H new ATOM 0 HD12 ILE A1226 2.698 0.313 -4.418 1.00 0.84 H new ATOM 0 HD13 ILE A1226 2.979 1.976 -3.851 1.00 0.84 H new ATOM 2756 N ALA A1227 0.363 3.742 -7.659 1.00 0.63 N ATOM 2757 CA ALA A1227 -0.330 4.148 -8.877 1.00 0.57 C ATOM 2758 C ALA A1227 -0.392 2.988 -9.888 1.00 0.62 C ATOM 2759 O ALA A1227 0.590 2.277 -10.123 1.00 0.66 O ATOM 2760 CB ALA A1227 0.373 5.385 -9.433 1.00 0.57 C ATOM 0 H ALA A1227 1.302 3.390 -7.844 1.00 0.63 H new ATOM 0 HA ALA A1227 -1.367 4.405 -8.662 1.00 0.57 H new ATOM 0 HB1 ALA A1227 -0.127 5.709 -10.346 1.00 0.57 H new ATOM 0 HB2 ALA A1227 0.336 6.187 -8.695 1.00 0.57 H new ATOM 0 HB3 ALA A1227 1.412 5.144 -9.655 1.00 0.57 H new ATOM 2766 N ILE A1228 -1.569 2.792 -10.483 1.00 0.70 N ATOM 2767 CA ILE A1228 -1.955 1.628 -11.294 1.00 0.81 C ATOM 2768 C ILE A1228 -2.791 2.074 -12.511 1.00 0.90 C ATOM 2769 O ILE A1228 -3.477 3.090 -12.461 1.00 0.97 O ATOM 2770 CB ILE A1228 -2.717 0.640 -10.367 1.00 0.81 C ATOM 2771 CG1 ILE A1228 -1.732 -0.153 -9.477 1.00 1.10 C ATOM 2772 CG2 ILE A1228 -3.584 -0.362 -11.141 1.00 1.17 C ATOM 2773 CD1 ILE A1228 -2.363 -0.860 -8.271 1.00 1.58 C ATOM 0 H ILE A1228 -2.322 3.476 -10.411 1.00 0.70 H new ATOM 0 HA ILE A1228 -1.080 1.122 -11.702 1.00 0.81 H new ATOM 0 HB ILE A1228 -3.373 1.258 -9.754 1.00 0.81 H new ATOM 0 HG12 ILE A1228 -1.231 -0.899 -10.094 1.00 1.10 H new ATOM 0 HG13 ILE A1228 -0.963 0.530 -9.116 1.00 1.10 H new ATOM 0 HG21 ILE A1228 -4.090 -1.024 -10.438 1.00 1.17 H new ATOM 0 HG22 ILE A1228 -4.326 0.178 -11.730 1.00 1.17 H new ATOM 0 HG23 ILE A1228 -2.953 -0.952 -11.805 1.00 1.17 H new ATOM 0 HD11 ILE A1228 -1.589 -1.387 -7.712 1.00 1.58 H new ATOM 0 HD12 ILE A1228 -2.839 -0.122 -7.625 1.00 1.58 H new ATOM 0 HD13 ILE A1228 -3.110 -1.574 -8.618 1.00 1.58 H new ATOM 2785 N ALA A1229 -2.760 1.294 -13.593 1.00 1.01 N ATOM 2786 CA ALA A1229 -3.657 1.419 -14.747 1.00 1.15 C ATOM 2787 C ALA A1229 -4.295 0.052 -15.067 1.00 1.14 C ATOM 2788 O ALA A1229 -3.903 -0.955 -14.481 1.00 1.39 O ATOM 2789 CB ALA A1229 -2.864 1.968 -15.936 1.00 1.43 C ATOM 0 H ALA A1229 -2.089 0.533 -13.695 1.00 1.01 H new ATOM 0 HA ALA A1229 -4.467 2.113 -14.523 1.00 1.15 H new ATOM 0 HB1 ALA A1229 -3.523 2.064 -16.799 1.00 1.43 H new ATOM 0 HB2 ALA A1229 -2.455 2.946 -15.680 1.00 1.43 H new ATOM 0 HB3 ALA A1229 -2.049 1.285 -16.176 1.00 1.43 H new