USER MOD reduce.3.24.130724 H: found=0, std=0, add=1147, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1146 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 92 HIS : no HD1:sc= -0.287 K(o=0.45,f=-0.57) USER MOD Set 1.2: A 115 CYS SG : rot -31:sc= 0.734 USER MOD Set 1.3: A 119 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 99 SER OG : rot -117:sc= 0.406! USER MOD Set 2.2: A 102 ASN : amide:sc= 0.808 K(o=3.3,f=-8.5!) USER MOD Set 2.3: A 108 ASN : amide:sc= 0.813 K(o=3.3,f=0.94) USER MOD Set 2.4: A 125 LYS NZ :NH3+ -152:sc= 1.5 (180deg=-0.153) USER MOD Set 2.5: A 126 HIS : no HE2:sc= -0.213 K(o=3.3,f=1.8) USER MOD Set 3.1: A 35 ASN : amide:sc= 1.74 K(o=3,f=-2.4!) USER MOD Set 3.2: A 77 SER OG : rot 72:sc= 1.3 USER MOD Set 4.1: A 28 LYS NZ :NH3+ -151:sc= 0.512 (180deg=-1.9) USER MOD Set 4.2: A 87 ASN : amide:sc= 0.417 K(o=0.93,f=-11!) USER MOD Set 5.1: A 3 ASN : amide:sc= -4.76! C(o=-4.8!,f=-11!) USER MOD Set 5.2: A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 SER OG : rot -49:sc= 0.227 USER MOD Single : A 31 LYS NZ :NH3+ -179:sc= 0.196 (180deg=0.117) USER MOD Single : A 32 THR OG1 : rot -93:sc= -0.248 USER MOD Single : A 40 SER OG : rot -30:sc= 0.0907 USER MOD Single : A 41 THR OG1 : rot -48:sc= 0.643 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 TYR OH : rot 68:sc= 1.01 USER MOD Single : A 49 LYS NZ :NH3+ -178:sc= 2.13 (180deg=2.05) USER MOD Single : A 51 SER OG : rot -107:sc= 1.13 USER MOD Single : A 52 CYS SG : rot 45:sc= -0.14 USER MOD Single : A 54 HIS : no HE2:sc= -2.43 K(o=-2.4,f=-6.1!) USER MOD Single : A 61 MET CE :methyl 159:sc= -0.443 (180deg=-0.758) USER MOD Single : A 62 CYS SG : rot 162:sc= -1.13 USER MOD Single : A 63 GLN : amide:sc= 0.733 K(o=0.73,f=-0.041) USER MOD Single : A 79 TYR OH : rot -28:sc= 0.952 USER MOD Single : A 82 LYS NZ :NH3+ -155:sc= 1.23 (180deg=0.254) USER MOD Single : A 91 LYS NZ :NH3+ 154:sc= 1.14 (180deg=0.0533) USER MOD Single : A 93 THR OG1 : rot 180:sc= 0.0743 USER MOD Single : A 100 MET CE :methyl 145:sc=-0.00615 (180deg=-1.9) USER MOD Single : A 106 ASN : amide:sc= -0.84 X(o=-0.84,f=-0.56) USER MOD Single : A 107 THR OG1 : rot -88:sc= 1.22 USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD Single : A 111 GLN : amide:sc= 0.33 K(o=0.33,f=-7.3!) USER MOD Single : A 116 THR OG1 : rot 163:sc= 1.03 USER MOD Single : A 118 LYS NZ :NH3+ -117:sc= 0.579 (180deg=-1.28!) USER MOD Single : A 131 LYS NZ :NH3+ 154:sc= 1.18 (180deg=0.992) USER MOD Single : A 133 LYS NZ :NH3+ -104:sc= 0.969 (180deg=-1.19!) USER MOD Single : A 136 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 137 ASN : amide:sc= 0 X(o=0,f=-0.044) USER MOD Single : A 142 MET CE :methyl -131:sc= 0 (180deg=-0.0726) USER MOD Single : A 147 SER OG : rot 19:sc= 0.908 USER MOD Single : A 149 ASN : amide:sc= -0.11 K(o=-0.11,f=-5.9!) USER MOD Single : A 151 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 152 THR OG1 : rot 100:sc= 0.14 USER MOD Single : A 153 SER OG : rot 180:sc= 0 USER MOD Single : A 154 LYS NZ :NH3+ -156:sc= 0.915 (180deg=0.122!) USER MOD Single : A 155 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 157 THR OG1 : rot 180:sc= 0 USER MOD Single : A 161 CYS SG : rot 100:sc= 0.291 USER MOD Single : A 163 GLN : amide:sc= 0.272 K(o=0.27,f=-5.1!) USER MOD ----------------------------------------------------------------- ATOM 34 N ASN A 3 -1.258 -17.812 -6.893 1.00 1.33 N ATOM 35 CA ASN A 3 -0.618 -16.577 -6.474 1.00 1.00 C ATOM 36 C ASN A 3 -0.262 -16.670 -4.989 1.00 0.97 C ATOM 37 O ASN A 3 -0.962 -17.327 -4.220 1.00 1.14 O ATOM 38 CB ASN A 3 -1.553 -15.380 -6.663 1.00 1.17 C ATOM 39 CG ASN A 3 -2.585 -15.308 -5.535 1.00 2.35 C ATOM 40 OD1 ASN A 3 -2.258 -15.294 -4.360 1.00 4.09 O ATOM 41 ND2 ASN A 3 -3.845 -15.263 -5.957 1.00 2.83 N ATOM 0 HA ASN A 3 0.275 -16.436 -7.083 1.00 1.00 H new ATOM 0 HB2 ASN A 3 -0.970 -14.459 -6.687 1.00 1.17 H new ATOM 0 HB3 ASN A 3 -2.063 -15.460 -7.623 1.00 1.17 H new ATOM 0 HD21 ASN A 3 -4.608 -15.213 -5.281 1.00 2.83 H new ATOM 0 HD22 ASN A 3 -4.049 -15.278 -6.956 1.00 2.83 H new ATOM 48 N PRO A 4 0.854 -15.985 -4.621 1.00 0.94 N ATOM 49 CA PRO A 4 1.232 -15.867 -3.224 1.00 0.98 C ATOM 50 C PRO A 4 0.335 -14.864 -2.495 1.00 0.85 C ATOM 51 O PRO A 4 -0.096 -13.872 -3.080 1.00 0.98 O ATOM 52 CB PRO A 4 2.694 -15.449 -3.245 1.00 1.28 C ATOM 53 CG PRO A 4 2.948 -14.899 -4.639 1.00 1.35 C ATOM 54 CD PRO A 4 1.780 -15.308 -5.522 1.00 1.12 C ATOM 0 HA PRO A 4 1.106 -16.800 -2.675 1.00 0.98 H new ATOM 0 HB2 PRO A 4 2.896 -14.695 -2.484 1.00 1.28 H new ATOM 0 HB3 PRO A 4 3.346 -16.297 -3.034 1.00 1.28 H new ATOM 0 HG2 PRO A 4 3.042 -13.813 -4.610 1.00 1.35 H new ATOM 0 HG3 PRO A 4 3.884 -15.290 -5.039 1.00 1.35 H new ATOM 0 HD2 PRO A 4 1.314 -14.440 -5.990 1.00 1.12 H new ATOM 0 HD3 PRO A 4 2.104 -15.968 -6.326 1.00 1.12 H new ATOM 62 N THR A 5 0.080 -15.158 -1.229 1.00 0.89 N ATOM 63 CA THR A 5 -0.643 -14.231 -0.376 1.00 0.82 C ATOM 64 C THR A 5 0.227 -13.805 0.808 1.00 0.74 C ATOM 65 O THR A 5 1.000 -14.605 1.334 1.00 0.83 O ATOM 66 CB THR A 5 -1.955 -14.897 0.043 1.00 1.01 C ATOM 67 OG1 THR A 5 -2.694 -15.003 -1.172 1.00 1.38 O ATOM 68 CG2 THR A 5 -2.817 -13.991 0.925 1.00 1.15 C ATOM 0 H THR A 5 0.361 -16.026 -0.773 1.00 0.89 H new ATOM 0 HA THR A 5 -0.885 -13.311 -0.909 1.00 0.82 H new ATOM 0 HB THR A 5 -1.738 -15.822 0.577 1.00 1.01 H new ATOM 0 HG1 THR A 5 -3.559 -15.426 -0.993 1.00 1.38 H new ATOM 0 HG21 THR A 5 -3.736 -14.512 1.194 1.00 1.15 H new ATOM 0 HG22 THR A 5 -2.267 -13.735 1.831 1.00 1.15 H new ATOM 0 HG23 THR A 5 -3.063 -13.080 0.380 1.00 1.15 H new ATOM 76 N VAL A 6 0.073 -12.547 1.193 1.00 0.71 N ATOM 77 CA VAL A 6 0.853 -11.999 2.290 1.00 0.70 C ATOM 78 C VAL A 6 -0.059 -11.165 3.193 1.00 0.79 C ATOM 79 O VAL A 6 -1.209 -10.901 2.845 1.00 0.94 O ATOM 80 CB VAL A 6 2.040 -11.203 1.742 1.00 0.82 C ATOM 81 CG1 VAL A 6 2.902 -12.070 0.821 1.00 1.46 C ATOM 82 CG2 VAL A 6 1.566 -9.940 1.021 1.00 1.21 C ATOM 0 H VAL A 6 -0.580 -11.891 0.765 1.00 0.71 H new ATOM 0 HA VAL A 6 1.269 -12.801 2.900 1.00 0.70 H new ATOM 0 HB VAL A 6 2.657 -10.895 2.586 1.00 0.82 H new ATOM 0 HG11 VAL A 6 3.739 -11.481 0.445 1.00 1.46 H new ATOM 0 HG12 VAL A 6 3.282 -12.926 1.378 1.00 1.46 H new ATOM 0 HG13 VAL A 6 2.300 -12.421 -0.017 1.00 1.46 H new ATOM 0 HG21 VAL A 6 2.429 -9.392 0.641 1.00 1.21 H new ATOM 0 HG22 VAL A 6 0.917 -10.217 0.190 1.00 1.21 H new ATOM 0 HG23 VAL A 6 1.014 -9.309 1.717 1.00 1.21 H new ATOM 92 N PHE A 7 0.488 -10.776 4.335 1.00 0.85 N ATOM 93 CA PHE A 7 -0.272 -10.005 5.304 1.00 1.05 C ATOM 94 C PHE A 7 0.656 -9.321 6.310 1.00 0.61 C ATOM 95 O PHE A 7 1.831 -9.671 6.414 1.00 0.78 O ATOM 96 CB PHE A 7 -1.175 -10.990 6.049 1.00 1.69 C ATOM 97 CG PHE A 7 -0.430 -11.896 7.031 1.00 1.64 C ATOM 98 CD1 PHE A 7 0.342 -12.914 6.566 1.00 2.63 C ATOM 99 CD2 PHE A 7 -0.541 -11.684 8.370 1.00 2.47 C ATOM 100 CE1 PHE A 7 1.033 -13.756 7.477 1.00 3.07 C ATOM 101 CE2 PHE A 7 0.151 -12.526 9.282 1.00 2.80 C ATOM 102 CZ PHE A 7 0.923 -13.543 8.816 1.00 2.61 C ATOM 0 H PHE A 7 1.448 -10.980 4.611 1.00 0.85 H new ATOM 0 HA PHE A 7 -0.846 -9.231 4.796 1.00 1.05 H new ATOM 0 HB2 PHE A 7 -1.936 -10.430 6.593 1.00 1.69 H new ATOM 0 HB3 PHE A 7 -1.696 -11.611 5.321 1.00 1.69 H new ATOM 0 HD1 PHE A 7 0.430 -13.082 5.503 1.00 2.63 H new ATOM 0 HD2 PHE A 7 -1.155 -10.876 8.740 1.00 2.47 H new ATOM 0 HE1 PHE A 7 1.645 -14.565 7.107 1.00 3.07 H new ATOM 0 HE2 PHE A 7 0.063 -12.358 10.345 1.00 2.80 H new ATOM 0 HZ PHE A 7 1.449 -14.182 9.509 1.00 2.61 H new ATOM 112 N PHE A 8 0.094 -8.358 7.025 1.00 0.63 N ATOM 113 CA PHE A 8 0.844 -7.654 8.051 1.00 0.91 C ATOM 114 C PHE A 8 -0.093 -7.075 9.114 1.00 0.71 C ATOM 115 O PHE A 8 -1.286 -6.905 8.869 1.00 0.78 O ATOM 116 CB PHE A 8 1.581 -6.506 7.360 1.00 1.68 C ATOM 117 CG PHE A 8 0.688 -5.315 7.006 1.00 1.37 C ATOM 118 CD1 PHE A 8 -0.254 -5.437 6.032 1.00 2.39 C ATOM 119 CD2 PHE A 8 0.835 -4.136 7.667 1.00 2.93 C ATOM 120 CE1 PHE A 8 -1.084 -4.331 5.704 1.00 4.05 C ATOM 121 CE2 PHE A 8 0.005 -3.030 7.340 1.00 4.35 C ATOM 122 CZ PHE A 8 -0.936 -3.152 6.365 1.00 4.73 C ATOM 0 H PHE A 8 -0.872 -8.049 6.914 1.00 0.63 H new ATOM 0 HA PHE A 8 1.532 -8.340 8.545 1.00 0.91 H new ATOM 0 HB2 PHE A 8 2.386 -6.162 8.009 1.00 1.68 H new ATOM 0 HB3 PHE A 8 2.045 -6.883 6.448 1.00 1.68 H new ATOM 0 HD1 PHE A 8 -0.371 -6.374 5.508 1.00 2.39 H new ATOM 0 HD2 PHE A 8 1.583 -4.040 8.441 1.00 2.93 H new ATOM 0 HE1 PHE A 8 -1.832 -4.427 4.930 1.00 4.05 H new ATOM 0 HE2 PHE A 8 0.121 -2.093 7.865 1.00 4.35 H new ATOM 0 HZ PHE A 8 -1.566 -2.311 6.116 1.00 4.73 H new ATOM 132 N ASP A 9 0.483 -6.788 10.272 1.00 0.62 N ATOM 133 CA ASP A 9 -0.307 -6.385 11.422 1.00 0.55 C ATOM 134 C ASP A 9 -0.205 -4.869 11.600 1.00 0.56 C ATOM 135 O ASP A 9 0.825 -4.272 11.289 1.00 0.67 O ATOM 136 CB ASP A 9 0.204 -7.047 12.703 1.00 0.60 C ATOM 137 CG ASP A 9 -0.438 -6.538 13.995 1.00 1.24 C ATOM 138 OD1 ASP A 9 0.077 -5.531 14.527 1.00 2.63 O ATOM 139 OD2 ASP A 9 -1.429 -7.168 14.422 1.00 1.99 O ATOM 0 H ASP A 9 1.489 -6.827 10.438 1.00 0.62 H new ATOM 0 HA ASP A 9 -1.338 -6.691 11.245 1.00 0.55 H new ATOM 0 HB2 ASP A 9 0.036 -8.122 12.631 1.00 0.60 H new ATOM 0 HB3 ASP A 9 1.282 -6.896 12.767 1.00 0.60 H new ATOM 144 N ILE A 10 -1.287 -4.288 12.099 1.00 0.60 N ATOM 145 CA ILE A 10 -1.297 -2.871 12.416 1.00 0.68 C ATOM 146 C ILE A 10 -1.459 -2.692 13.928 1.00 0.71 C ATOM 147 O ILE A 10 -2.338 -3.299 14.537 1.00 0.71 O ATOM 148 CB ILE A 10 -2.363 -2.145 11.594 1.00 0.75 C ATOM 149 CG1 ILE A 10 -2.015 -2.166 10.104 1.00 0.95 C ATOM 150 CG2 ILE A 10 -2.581 -0.722 12.112 1.00 0.93 C ATOM 151 CD1 ILE A 10 -2.343 -3.524 9.483 1.00 1.20 C ATOM 0 H ILE A 10 -2.163 -4.774 12.291 1.00 0.60 H new ATOM 0 HA ILE A 10 -0.348 -2.413 12.140 1.00 0.68 H new ATOM 0 HB ILE A 10 -3.306 -2.678 11.712 1.00 0.75 H new ATOM 0 HG12 ILE A 10 -2.569 -1.382 9.587 1.00 0.95 H new ATOM 0 HG13 ILE A 10 -0.955 -1.948 9.971 1.00 0.95 H new ATOM 0 HG21 ILE A 10 -3.344 -0.228 11.510 1.00 0.93 H new ATOM 0 HG22 ILE A 10 -2.907 -0.759 13.151 1.00 0.93 H new ATOM 0 HG23 ILE A 10 -1.648 -0.163 12.044 1.00 0.93 H new ATOM 0 HD11 ILE A 10 -2.086 -3.511 8.424 1.00 1.20 H new ATOM 0 HD12 ILE A 10 -1.769 -4.302 9.986 1.00 1.20 H new ATOM 0 HD13 ILE A 10 -3.408 -3.728 9.596 1.00 1.20 H new ATOM 163 N ALA A 11 -0.597 -1.857 14.488 1.00 0.85 N ATOM 164 CA ALA A 11 -0.608 -1.620 15.921 1.00 0.97 C ATOM 165 C ALA A 11 -0.954 -0.154 16.189 1.00 1.01 C ATOM 166 O ALA A 11 -0.231 0.746 15.767 1.00 1.02 O ATOM 167 CB ALA A 11 0.745 -2.017 16.515 1.00 1.03 C ATOM 0 H ALA A 11 0.114 -1.336 13.975 1.00 0.85 H new ATOM 0 HA ALA A 11 -1.369 -2.232 16.405 1.00 0.97 H new ATOM 0 HB1 ALA A 11 0.737 -1.839 17.590 1.00 1.03 H new ATOM 0 HB2 ALA A 11 0.930 -3.074 16.324 1.00 1.03 H new ATOM 0 HB3 ALA A 11 1.533 -1.421 16.055 1.00 1.03 H new ATOM 173 N VAL A 12 -2.062 0.040 16.891 1.00 1.09 N ATOM 174 CA VAL A 12 -2.490 1.378 17.259 1.00 1.19 C ATOM 175 C VAL A 12 -2.075 1.664 18.703 1.00 1.33 C ATOM 176 O VAL A 12 -2.779 1.288 19.640 1.00 1.41 O ATOM 177 CB VAL A 12 -3.994 1.529 17.027 1.00 1.26 C ATOM 178 CG1 VAL A 12 -4.491 2.892 17.515 1.00 1.51 C ATOM 179 CG2 VAL A 12 -4.348 1.311 15.555 1.00 1.09 C ATOM 0 H VAL A 12 -2.676 -0.708 17.214 1.00 1.09 H new ATOM 0 HA VAL A 12 -2.002 2.121 16.629 1.00 1.19 H new ATOM 0 HB VAL A 12 -4.500 0.760 17.610 1.00 1.26 H new ATOM 0 HG11 VAL A 12 -5.563 2.973 17.338 1.00 1.51 H new ATOM 0 HG12 VAL A 12 -4.291 2.992 18.582 1.00 1.51 H new ATOM 0 HG13 VAL A 12 -3.973 3.683 16.973 1.00 1.51 H new ATOM 0 HG21 VAL A 12 -5.424 1.424 15.419 1.00 1.09 H new ATOM 0 HG22 VAL A 12 -3.825 2.046 14.942 1.00 1.09 H new ATOM 0 HG23 VAL A 12 -4.048 0.308 15.253 1.00 1.09 H new ATOM 189 N ASP A 13 -0.935 2.325 18.839 1.00 1.36 N ATOM 190 CA ASP A 13 -0.430 2.684 20.154 1.00 1.49 C ATOM 191 C ASP A 13 -0.374 1.432 21.032 1.00 1.54 C ATOM 192 O ASP A 13 -1.288 1.178 21.816 1.00 1.65 O ATOM 193 CB ASP A 13 -1.346 3.701 20.837 1.00 1.61 C ATOM 194 CG ASP A 13 -1.781 4.873 19.956 1.00 1.62 C ATOM 195 OD1 ASP A 13 -0.897 5.421 19.261 1.00 2.41 O ATOM 196 OD2 ASP A 13 -2.989 5.196 19.996 1.00 2.22 O ATOM 0 H ASP A 13 -0.346 2.622 18.061 1.00 1.36 H new ATOM 0 HA ASP A 13 0.561 3.120 20.028 1.00 1.49 H new ATOM 0 HB2 ASP A 13 -2.237 3.183 21.193 1.00 1.61 H new ATOM 0 HB3 ASP A 13 -0.835 4.096 21.715 1.00 1.61 H new ATOM 201 N GLY A 14 0.707 0.684 20.873 1.00 1.51 N ATOM 202 CA GLY A 14 0.949 -0.471 21.721 1.00 1.61 C ATOM 203 C GLY A 14 -0.314 -1.321 21.865 1.00 1.64 C ATOM 204 O GLY A 14 -0.627 -1.794 22.956 1.00 1.78 O ATOM 0 H GLY A 14 1.426 0.855 20.170 1.00 1.51 H new ATOM 0 HA2 GLY A 14 1.752 -1.075 21.298 1.00 1.61 H new ATOM 0 HA3 GLY A 14 1.283 -0.141 22.705 1.00 1.61 H new ATOM 208 N GLU A 15 -1.007 -1.488 20.748 1.00 1.52 N ATOM 209 CA GLU A 15 -2.198 -2.319 20.724 1.00 1.55 C ATOM 210 C GLU A 15 -2.444 -2.854 19.313 1.00 1.36 C ATOM 211 O GLU A 15 -2.489 -2.087 18.352 1.00 1.38 O ATOM 212 CB GLU A 15 -3.416 -1.546 21.237 1.00 1.67 C ATOM 213 CG GLU A 15 -4.564 -2.496 21.583 1.00 1.79 C ATOM 214 CD GLU A 15 -5.778 -1.723 22.102 1.00 1.78 C ATOM 215 OE1 GLU A 15 -6.437 -1.071 21.263 1.00 2.43 O ATOM 216 OE2 GLU A 15 -6.020 -1.801 23.325 1.00 2.89 O ATOM 0 H GLU A 15 -0.766 -1.062 19.853 1.00 1.52 H new ATOM 0 HA GLU A 15 -2.039 -3.167 21.390 1.00 1.55 H new ATOM 0 HB2 GLU A 15 -3.139 -0.968 22.119 1.00 1.67 H new ATOM 0 HB3 GLU A 15 -3.744 -0.834 20.480 1.00 1.67 H new ATOM 0 HG2 GLU A 15 -4.844 -3.070 20.700 1.00 1.79 H new ATOM 0 HG3 GLU A 15 -4.234 -3.211 22.337 1.00 1.79 H new ATOM 223 N PRO A 16 -2.601 -4.203 19.229 1.00 1.23 N ATOM 224 CA PRO A 16 -2.852 -4.849 17.951 1.00 1.05 C ATOM 225 C PRO A 16 -4.293 -4.618 17.494 1.00 0.88 C ATOM 226 O PRO A 16 -5.234 -5.089 18.130 1.00 0.83 O ATOM 227 CB PRO A 16 -2.529 -6.316 18.183 1.00 1.09 C ATOM 228 CG PRO A 16 -2.559 -6.517 19.690 1.00 1.23 C ATOM 229 CD PRO A 16 -2.544 -5.144 20.343 1.00 1.30 C ATOM 0 HA PRO A 16 -2.240 -4.443 17.146 1.00 1.05 H new ATOM 0 HB2 PRO A 16 -3.257 -6.959 17.689 1.00 1.09 H new ATOM 0 HB3 PRO A 16 -1.551 -6.570 17.775 1.00 1.09 H new ATOM 0 HG2 PRO A 16 -3.451 -7.070 19.984 1.00 1.23 H new ATOM 0 HG3 PRO A 16 -1.699 -7.104 20.014 1.00 1.23 H new ATOM 0 HD2 PRO A 16 -3.393 -5.015 21.014 1.00 1.30 H new ATOM 0 HD3 PRO A 16 -1.643 -4.999 20.938 1.00 1.30 H new ATOM 237 N LEU A 17 -4.421 -3.894 16.392 1.00 0.89 N ATOM 238 CA LEU A 17 -5.733 -3.568 15.858 1.00 0.88 C ATOM 239 C LEU A 17 -6.264 -4.761 15.061 1.00 0.77 C ATOM 240 O LEU A 17 -7.432 -5.124 15.185 1.00 0.86 O ATOM 241 CB LEU A 17 -5.677 -2.267 15.055 1.00 1.11 C ATOM 242 CG LEU A 17 -7.003 -1.788 14.460 1.00 0.78 C ATOM 243 CD1 LEU A 17 -7.915 -1.214 15.546 1.00 1.14 C ATOM 244 CD2 LEU A 17 -6.766 -0.792 13.324 1.00 1.99 C ATOM 0 H LEU A 17 -3.638 -3.524 15.854 1.00 0.89 H new ATOM 0 HA LEU A 17 -6.440 -3.385 16.668 1.00 0.88 H new ATOM 0 HB2 LEU A 17 -5.287 -1.481 15.701 1.00 1.11 H new ATOM 0 HB3 LEU A 17 -4.962 -2.396 14.242 1.00 1.11 H new ATOM 0 HG LEU A 17 -7.516 -2.649 14.031 1.00 0.78 H new ATOM 0 HD11 LEU A 17 -8.851 -0.881 15.097 1.00 1.14 H new ATOM 0 HD12 LEU A 17 -8.123 -1.983 16.290 1.00 1.14 H new ATOM 0 HD13 LEU A 17 -7.422 -0.369 16.026 1.00 1.14 H new ATOM 0 HD21 LEU A 17 -7.724 -0.467 12.919 1.00 1.99 H new ATOM 0 HD22 LEU A 17 -6.222 0.072 13.705 1.00 1.99 H new ATOM 0 HD23 LEU A 17 -6.182 -1.270 12.537 1.00 1.99 H new ATOM 256 N GLY A 18 -5.381 -5.337 14.259 1.00 0.71 N ATOM 257 CA GLY A 18 -5.756 -6.457 13.413 1.00 0.85 C ATOM 258 C GLY A 18 -4.736 -6.664 12.292 1.00 0.78 C ATOM 259 O GLY A 18 -3.663 -6.062 12.305 1.00 0.74 O ATOM 0 H GLY A 18 -4.406 -5.049 14.177 1.00 0.71 H new ATOM 0 HA2 GLY A 18 -5.829 -7.363 14.015 1.00 0.85 H new ATOM 0 HA3 GLY A 18 -6.742 -6.279 12.984 1.00 0.85 H new ATOM 263 N ARG A 19 -5.107 -7.516 11.348 1.00 1.06 N ATOM 264 CA ARG A 19 -4.209 -7.862 10.258 1.00 1.08 C ATOM 265 C ARG A 19 -4.891 -7.616 8.911 1.00 1.13 C ATOM 266 O ARG A 19 -6.105 -7.770 8.789 1.00 1.31 O ATOM 267 CB ARG A 19 -3.780 -9.328 10.345 1.00 1.18 C ATOM 268 CG ARG A 19 -2.456 -9.467 11.100 1.00 1.28 C ATOM 269 CD ARG A 19 -2.320 -10.862 11.716 1.00 1.71 C ATOM 270 NE ARG A 19 -3.092 -10.936 12.976 1.00 2.77 N ATOM 271 CZ ARG A 19 -2.817 -10.212 14.069 1.00 3.90 C ATOM 272 NH1 ARG A 19 -1.594 -9.689 14.237 1.00 4.43 N ATOM 273 NH2 ARG A 19 -3.764 -10.010 14.995 1.00 5.31 N ATOM 0 H ARG A 19 -6.016 -7.977 11.315 1.00 1.06 H new ATOM 0 HA ARG A 19 -3.325 -7.230 10.342 1.00 1.08 H new ATOM 0 HB2 ARG A 19 -4.553 -9.908 10.849 1.00 1.18 H new ATOM 0 HB3 ARG A 19 -3.676 -9.741 9.341 1.00 1.18 H new ATOM 0 HG2 ARG A 19 -1.624 -9.283 10.420 1.00 1.28 H new ATOM 0 HG3 ARG A 19 -2.399 -8.712 11.884 1.00 1.28 H new ATOM 0 HD2 ARG A 19 -2.680 -11.615 11.015 1.00 1.71 H new ATOM 0 HD3 ARG A 19 -1.270 -11.082 11.910 1.00 1.71 H new ATOM 0 HE ARG A 19 -3.883 -11.579 13.015 1.00 2.77 H new ATOM 0 HH11 ARG A 19 -0.873 -9.842 13.532 1.00 4.43 H new ATOM 0 HH12 ARG A 19 -1.385 -9.138 15.069 1.00 4.43 H new ATOM 0 HH21 ARG A 19 -4.695 -10.408 14.868 1.00 5.31 H new ATOM 0 HH22 ARG A 19 -3.554 -9.459 15.827 1.00 5.31 H new ATOM 287 N VAL A 20 -4.080 -7.238 7.934 1.00 1.10 N ATOM 288 CA VAL A 20 -4.573 -7.060 6.579 1.00 1.17 C ATOM 289 C VAL A 20 -3.743 -7.916 5.621 1.00 1.39 C ATOM 290 O VAL A 20 -2.519 -7.961 5.726 1.00 2.39 O ATOM 291 CB VAL A 20 -4.565 -5.574 6.211 1.00 1.12 C ATOM 292 CG1 VAL A 20 -5.024 -5.365 4.766 1.00 1.31 C ATOM 293 CG2 VAL A 20 -5.426 -4.765 7.182 1.00 1.10 C ATOM 0 H VAL A 20 -3.085 -7.050 8.054 1.00 1.10 H new ATOM 0 HA VAL A 20 -5.607 -7.396 6.502 1.00 1.17 H new ATOM 0 HB VAL A 20 -3.540 -5.214 6.292 1.00 1.12 H new ATOM 0 HG11 VAL A 20 -5.009 -4.301 4.530 1.00 1.31 H new ATOM 0 HG12 VAL A 20 -4.353 -5.896 4.091 1.00 1.31 H new ATOM 0 HG13 VAL A 20 -6.037 -5.749 4.647 1.00 1.31 H new ATOM 0 HG21 VAL A 20 -5.403 -3.713 6.898 1.00 1.10 H new ATOM 0 HG22 VAL A 20 -6.453 -5.128 7.147 1.00 1.10 H new ATOM 0 HG23 VAL A 20 -5.036 -4.877 8.194 1.00 1.10 H new ATOM 303 N SER A 21 -4.443 -8.575 4.710 1.00 1.13 N ATOM 304 CA SER A 21 -3.800 -9.521 3.813 1.00 1.07 C ATOM 305 C SER A 21 -3.949 -9.051 2.364 1.00 1.11 C ATOM 306 O SER A 21 -4.723 -8.138 2.080 1.00 1.48 O ATOM 307 CB SER A 21 -4.389 -10.924 3.978 1.00 1.18 C ATOM 308 OG SER A 21 -5.771 -10.968 3.634 1.00 2.57 O ATOM 0 H SER A 21 -5.449 -8.473 4.573 1.00 1.13 H new ATOM 0 HA SER A 21 -2.741 -9.568 4.067 1.00 1.07 H new ATOM 0 HB2 SER A 21 -3.837 -11.625 3.351 1.00 1.18 H new ATOM 0 HB3 SER A 21 -4.262 -11.251 5.010 1.00 1.18 H new ATOM 0 HG SER A 21 -6.243 -10.235 4.081 1.00 2.57 H new ATOM 314 N PHE A 22 -3.194 -9.696 1.486 1.00 0.93 N ATOM 315 CA PHE A 22 -3.256 -9.377 0.069 1.00 0.96 C ATOM 316 C PHE A 22 -3.041 -10.628 -0.784 1.00 0.87 C ATOM 317 O PHE A 22 -2.133 -11.416 -0.519 1.00 1.00 O ATOM 318 CB PHE A 22 -2.129 -8.381 -0.213 1.00 1.11 C ATOM 319 CG PHE A 22 -2.202 -7.104 0.625 1.00 1.27 C ATOM 320 CD1 PHE A 22 -3.120 -6.146 0.327 1.00 2.39 C ATOM 321 CD2 PHE A 22 -1.350 -6.927 1.670 1.00 2.29 C ATOM 322 CE1 PHE A 22 -3.187 -4.960 1.106 1.00 2.49 C ATOM 323 CE2 PHE A 22 -1.417 -5.741 2.449 1.00 2.44 C ATOM 324 CZ PHE A 22 -2.335 -4.784 2.150 1.00 1.66 C ATOM 0 H PHE A 22 -2.537 -10.437 1.728 1.00 0.93 H new ATOM 0 HA PHE A 22 -4.235 -8.966 -0.179 1.00 0.96 H new ATOM 0 HB2 PHE A 22 -1.172 -8.870 -0.029 1.00 1.11 H new ATOM 0 HB3 PHE A 22 -2.152 -8.112 -1.269 1.00 1.11 H new ATOM 0 HD1 PHE A 22 -3.798 -6.287 -0.502 1.00 2.39 H new ATOM 0 HD2 PHE A 22 -0.622 -7.689 1.908 1.00 2.29 H new ATOM 0 HE1 PHE A 22 -3.915 -4.198 0.869 1.00 2.49 H new ATOM 0 HE2 PHE A 22 -0.739 -5.600 3.278 1.00 2.44 H new ATOM 0 HZ PHE A 22 -2.387 -3.883 2.743 1.00 1.66 H new ATOM 334 N GLU A 23 -3.891 -10.773 -1.790 1.00 0.80 N ATOM 335 CA GLU A 23 -3.814 -11.924 -2.675 1.00 0.86 C ATOM 336 C GLU A 23 -2.522 -11.877 -3.493 1.00 1.08 C ATOM 337 O GLU A 23 -2.151 -12.862 -4.130 1.00 3.04 O ATOM 338 CB GLU A 23 -5.039 -11.995 -3.588 1.00 1.28 C ATOM 339 CG GLU A 23 -6.323 -12.152 -2.772 1.00 1.39 C ATOM 340 CD GLU A 23 -7.494 -12.566 -3.667 1.00 1.77 C ATOM 341 OE1 GLU A 23 -7.548 -13.765 -4.012 1.00 2.16 O ATOM 342 OE2 GLU A 23 -8.309 -11.672 -3.983 1.00 2.64 O ATOM 0 H GLU A 23 -4.636 -10.113 -2.012 1.00 0.80 H new ATOM 0 HA GLU A 23 -3.803 -12.828 -2.066 1.00 0.86 H new ATOM 0 HB2 GLU A 23 -5.098 -11.091 -4.195 1.00 1.28 H new ATOM 0 HB3 GLU A 23 -4.936 -12.834 -4.276 1.00 1.28 H new ATOM 0 HG2 GLU A 23 -6.174 -12.900 -1.993 1.00 1.39 H new ATOM 0 HG3 GLU A 23 -6.557 -11.212 -2.272 1.00 1.39 H new ATOM 349 N LEU A 24 -1.872 -10.724 -3.450 1.00 0.94 N ATOM 350 CA LEU A 24 -0.678 -10.507 -4.249 1.00 0.92 C ATOM 351 C LEU A 24 -0.779 -11.319 -5.541 1.00 0.95 C ATOM 352 O LEU A 24 -0.260 -12.431 -5.621 1.00 1.34 O ATOM 353 CB LEU A 24 0.578 -10.809 -3.429 1.00 1.19 C ATOM 354 CG LEU A 24 1.576 -9.659 -3.281 1.00 1.09 C ATOM 355 CD1 LEU A 24 0.967 -8.503 -2.485 1.00 1.78 C ATOM 356 CD2 LEU A 24 2.889 -10.149 -2.667 1.00 2.75 C ATOM 0 H LEU A 24 -2.150 -9.929 -2.874 1.00 0.94 H new ATOM 0 HA LEU A 24 -0.598 -9.459 -4.537 1.00 0.92 H new ATOM 0 HB2 LEU A 24 0.270 -11.126 -2.433 1.00 1.19 H new ATOM 0 HB3 LEU A 24 1.093 -11.653 -3.888 1.00 1.19 H new ATOM 0 HG LEU A 24 1.808 -9.278 -4.275 1.00 1.09 H new ATOM 0 HD11 LEU A 24 1.697 -7.699 -2.395 1.00 1.78 H new ATOM 0 HD12 LEU A 24 0.081 -8.132 -3.001 1.00 1.78 H new ATOM 0 HD13 LEU A 24 0.688 -8.853 -1.491 1.00 1.78 H new ATOM 0 HD21 LEU A 24 3.581 -9.312 -2.573 1.00 2.75 H new ATOM 0 HD22 LEU A 24 2.694 -10.572 -1.681 1.00 2.75 H new ATOM 0 HD23 LEU A 24 3.328 -10.913 -3.309 1.00 2.75 H new ATOM 368 N PHE A 25 -1.452 -10.732 -6.520 1.00 0.86 N ATOM 369 CA PHE A 25 -1.615 -11.381 -7.810 1.00 0.86 C ATOM 370 C PHE A 25 -0.302 -11.380 -8.594 1.00 0.88 C ATOM 371 O PHE A 25 -0.128 -10.587 -9.519 1.00 1.04 O ATOM 372 CB PHE A 25 -2.661 -10.577 -8.586 1.00 0.90 C ATOM 373 CG PHE A 25 -4.050 -10.585 -7.948 1.00 0.95 C ATOM 374 CD1 PHE A 25 -4.619 -11.761 -7.571 1.00 1.89 C ATOM 375 CD2 PHE A 25 -4.718 -9.415 -7.759 1.00 1.87 C ATOM 376 CE1 PHE A 25 -5.911 -11.767 -6.980 1.00 2.00 C ATOM 377 CE2 PHE A 25 -6.009 -9.421 -7.168 1.00 1.92 C ATOM 378 CZ PHE A 25 -6.578 -10.598 -6.790 1.00 1.24 C ATOM 0 H PHE A 25 -1.891 -9.814 -6.446 1.00 0.86 H new ATOM 0 HA PHE A 25 -1.921 -12.418 -7.669 1.00 0.86 H new ATOM 0 HB2 PHE A 25 -2.319 -9.546 -8.675 1.00 0.90 H new ATOM 0 HB3 PHE A 25 -2.735 -10.977 -9.597 1.00 0.90 H new ATOM 0 HD1 PHE A 25 -4.089 -12.690 -7.721 1.00 1.89 H new ATOM 0 HD2 PHE A 25 -4.266 -8.481 -8.059 1.00 1.87 H new ATOM 0 HE1 PHE A 25 -6.363 -12.701 -6.681 1.00 2.00 H new ATOM 0 HE2 PHE A 25 -6.539 -8.492 -7.019 1.00 1.92 H new ATOM 0 HZ PHE A 25 -7.559 -10.603 -6.339 1.00 1.24 H new ATOM 388 N ALA A 26 0.589 -12.277 -8.196 1.00 0.79 N ATOM 389 CA ALA A 26 1.860 -12.425 -8.883 1.00 0.78 C ATOM 390 C ALA A 26 1.656 -13.255 -10.153 1.00 0.84 C ATOM 391 O ALA A 26 2.578 -13.413 -10.950 1.00 0.97 O ATOM 392 CB ALA A 26 2.883 -13.053 -7.936 1.00 0.94 C ATOM 0 H ALA A 26 0.455 -12.908 -7.406 1.00 0.79 H new ATOM 0 HA ALA A 26 2.248 -11.452 -9.184 1.00 0.78 H new ATOM 0 HB1 ALA A 26 3.837 -13.164 -8.452 1.00 0.94 H new ATOM 0 HB2 ALA A 26 3.014 -12.411 -7.065 1.00 0.94 H new ATOM 0 HB3 ALA A 26 2.528 -14.032 -7.615 1.00 0.94 H new ATOM 398 N ASP A 27 0.440 -13.762 -10.300 1.00 0.94 N ATOM 399 CA ASP A 27 0.123 -14.634 -11.418 1.00 1.07 C ATOM 400 C ASP A 27 0.642 -14.006 -12.713 1.00 1.14 C ATOM 401 O ASP A 27 1.431 -14.619 -13.431 1.00 1.91 O ATOM 402 CB ASP A 27 -1.388 -14.824 -11.558 1.00 1.24 C ATOM 403 CG ASP A 27 -1.827 -15.651 -12.768 1.00 1.41 C ATOM 404 OD1 ASP A 27 -1.836 -16.893 -12.634 1.00 2.26 O ATOM 405 OD2 ASP A 27 -2.144 -15.021 -13.800 1.00 2.19 O ATOM 0 H ASP A 27 -0.337 -13.585 -9.663 1.00 0.94 H new ATOM 0 HA ASP A 27 0.592 -15.600 -11.234 1.00 1.07 H new ATOM 0 HB2 ASP A 27 -1.764 -15.303 -10.654 1.00 1.24 H new ATOM 0 HB3 ASP A 27 -1.858 -13.843 -11.618 1.00 1.24 H new ATOM 410 N LYS A 28 0.179 -12.793 -12.971 1.00 0.94 N ATOM 411 CA LYS A 28 0.373 -12.178 -14.274 1.00 1.38 C ATOM 412 C LYS A 28 1.428 -11.075 -14.161 1.00 1.25 C ATOM 413 O LYS A 28 1.844 -10.504 -15.167 1.00 1.31 O ATOM 414 CB LYS A 28 -0.961 -11.698 -14.845 1.00 1.80 C ATOM 415 CG LYS A 28 -1.485 -10.487 -14.069 1.00 1.84 C ATOM 416 CD LYS A 28 -2.733 -9.906 -14.737 1.00 2.63 C ATOM 417 CE LYS A 28 -2.356 -8.997 -15.908 1.00 4.63 C ATOM 418 NZ LYS A 28 -1.520 -7.869 -15.441 1.00 6.53 N ATOM 0 H LYS A 28 -0.331 -12.218 -12.300 1.00 0.94 H new ATOM 0 HA LYS A 28 0.752 -12.910 -14.987 1.00 1.38 H new ATOM 0 HB2 LYS A 28 -0.838 -11.436 -15.896 1.00 1.80 H new ATOM 0 HB3 LYS A 28 -1.691 -12.506 -14.802 1.00 1.80 H new ATOM 0 HG2 LYS A 28 -1.719 -10.780 -13.045 1.00 1.84 H new ATOM 0 HG3 LYS A 28 -0.709 -9.723 -14.013 1.00 1.84 H new ATOM 0 HD2 LYS A 28 -3.370 -10.716 -15.092 1.00 2.63 H new ATOM 0 HD3 LYS A 28 -3.312 -9.342 -14.006 1.00 2.63 H new ATOM 0 HE2 LYS A 28 -1.816 -9.570 -16.661 1.00 4.63 H new ATOM 0 HE3 LYS A 28 -3.259 -8.615 -16.385 1.00 4.63 H new ATOM 0 HZ1 LYS A 28 -1.671 -7.046 -16.059 1.00 6.53 H new ATOM 0 HZ2 LYS A 28 -1.783 -7.623 -14.465 1.00 6.53 H new ATOM 0 HZ3 LYS A 28 -0.518 -8.144 -15.470 1.00 6.53 H new ATOM 432 N VAL A 29 1.828 -10.808 -12.926 1.00 1.13 N ATOM 433 CA VAL A 29 2.828 -9.786 -12.669 1.00 1.08 C ATOM 434 C VAL A 29 3.760 -10.259 -11.551 1.00 1.00 C ATOM 435 O VAL A 29 3.731 -9.722 -10.445 1.00 0.90 O ATOM 436 CB VAL A 29 2.146 -8.453 -12.353 1.00 1.04 C ATOM 437 CG1 VAL A 29 1.696 -7.751 -13.636 1.00 1.18 C ATOM 438 CG2 VAL A 29 0.969 -8.654 -11.395 1.00 1.08 C ATOM 0 H VAL A 29 1.478 -11.282 -12.093 1.00 1.13 H new ATOM 0 HA VAL A 29 3.440 -9.621 -13.556 1.00 1.08 H new ATOM 0 HB VAL A 29 2.875 -7.811 -11.858 1.00 1.04 H new ATOM 0 HG11 VAL A 29 1.214 -6.806 -13.384 1.00 1.18 H new ATOM 0 HG12 VAL A 29 2.562 -7.559 -14.269 1.00 1.18 H new ATOM 0 HG13 VAL A 29 0.990 -8.387 -14.170 1.00 1.18 H new ATOM 0 HG21 VAL A 29 0.501 -7.692 -11.186 1.00 1.08 H new ATOM 0 HG22 VAL A 29 0.238 -9.321 -11.852 1.00 1.08 H new ATOM 0 HG23 VAL A 29 1.328 -9.092 -10.464 1.00 1.08 H new ATOM 448 N PRO A 30 4.584 -11.289 -11.887 1.00 1.16 N ATOM 449 CA PRO A 30 5.582 -11.783 -10.954 1.00 1.23 C ATOM 450 C PRO A 30 6.766 -10.820 -10.857 1.00 1.38 C ATOM 451 O PRO A 30 7.906 -11.203 -11.115 1.00 2.70 O ATOM 452 CB PRO A 30 5.971 -13.153 -11.485 1.00 1.47 C ATOM 453 CG PRO A 30 5.527 -13.179 -12.938 1.00 1.60 C ATOM 454 CD PRO A 30 4.587 -12.005 -13.159 1.00 1.40 C ATOM 0 HA PRO A 30 5.205 -11.858 -9.934 1.00 1.23 H new ATOM 0 HB2 PRO A 30 7.046 -13.313 -11.402 1.00 1.47 H new ATOM 0 HB3 PRO A 30 5.486 -13.945 -10.914 1.00 1.47 H new ATOM 0 HG2 PRO A 30 6.389 -13.108 -13.602 1.00 1.60 H new ATOM 0 HG3 PRO A 30 5.024 -14.119 -13.167 1.00 1.60 H new ATOM 0 HD2 PRO A 30 4.934 -11.367 -13.972 1.00 1.40 H new ATOM 0 HD3 PRO A 30 3.586 -12.344 -13.425 1.00 1.40 H new ATOM 462 N LYS A 31 6.456 -9.587 -10.484 1.00 1.13 N ATOM 463 CA LYS A 31 7.485 -8.574 -10.319 1.00 1.13 C ATOM 464 C LYS A 31 6.962 -7.468 -9.399 1.00 1.01 C ATOM 465 O LYS A 31 7.606 -7.124 -8.409 1.00 1.16 O ATOM 466 CB LYS A 31 7.962 -8.067 -11.680 1.00 1.19 C ATOM 467 CG LYS A 31 9.196 -7.175 -11.532 1.00 2.06 C ATOM 468 CD LYS A 31 9.691 -6.691 -12.897 1.00 2.11 C ATOM 469 CE LYS A 31 10.609 -7.727 -13.546 1.00 2.81 C ATOM 470 NZ LYS A 31 11.288 -7.151 -14.729 1.00 3.63 N ATOM 0 H LYS A 31 5.507 -9.266 -10.291 1.00 1.13 H new ATOM 0 HA LYS A 31 8.365 -9.000 -9.838 1.00 1.13 H new ATOM 0 HB2 LYS A 31 8.196 -8.913 -12.325 1.00 1.19 H new ATOM 0 HB3 LYS A 31 7.161 -7.508 -12.165 1.00 1.19 H new ATOM 0 HG2 LYS A 31 8.956 -6.317 -10.904 1.00 2.06 H new ATOM 0 HG3 LYS A 31 9.990 -7.727 -11.028 1.00 2.06 H new ATOM 0 HD2 LYS A 31 8.839 -6.496 -13.548 1.00 2.11 H new ATOM 0 HD3 LYS A 31 10.226 -5.748 -12.781 1.00 2.11 H new ATOM 0 HE2 LYS A 31 11.351 -8.067 -12.824 1.00 2.81 H new ATOM 0 HE3 LYS A 31 10.029 -8.601 -13.842 1.00 2.81 H new ATOM 0 HZ1 LYS A 31 11.894 -7.873 -15.167 1.00 3.63 H new ATOM 0 HZ2 LYS A 31 10.576 -6.833 -15.417 1.00 3.63 H new ATOM 0 HZ3 LYS A 31 11.871 -6.342 -14.435 1.00 3.63 H new ATOM 484 N THR A 32 5.802 -6.942 -9.760 1.00 0.83 N ATOM 485 CA THR A 32 5.084 -6.036 -8.879 1.00 0.87 C ATOM 486 C THR A 32 4.849 -6.690 -7.517 1.00 0.79 C ATOM 487 O THR A 32 5.049 -6.062 -6.479 1.00 0.86 O ATOM 488 CB THR A 32 3.792 -5.616 -9.583 1.00 0.96 C ATOM 489 OG1 THR A 32 4.056 -5.855 -10.963 1.00 1.35 O ATOM 490 CG2 THR A 32 3.548 -4.107 -9.507 1.00 0.94 C ATOM 0 H THR A 32 5.340 -7.125 -10.651 1.00 0.83 H new ATOM 0 HA THR A 32 5.667 -5.138 -8.676 1.00 0.87 H new ATOM 0 HB THR A 32 2.948 -6.143 -9.138 1.00 0.96 H new ATOM 0 HG1 THR A 32 4.394 -5.034 -11.378 1.00 1.35 H new ATOM 0 HG21 THR A 32 2.619 -3.862 -10.022 1.00 0.94 H new ATOM 0 HG22 THR A 32 3.476 -3.802 -8.463 1.00 0.94 H new ATOM 0 HG23 THR A 32 4.376 -3.580 -9.982 1.00 0.94 H new ATOM 498 N ALA A 33 4.425 -7.945 -7.564 1.00 0.74 N ATOM 499 CA ALA A 33 4.150 -8.689 -6.347 1.00 0.74 C ATOM 500 C ALA A 33 5.468 -9.004 -5.637 1.00 0.69 C ATOM 501 O ALA A 33 5.530 -9.009 -4.409 1.00 0.73 O ATOM 502 CB ALA A 33 3.356 -9.952 -6.689 1.00 0.83 C ATOM 0 H ALA A 33 4.265 -8.465 -8.427 1.00 0.74 H new ATOM 0 HA ALA A 33 3.542 -8.096 -5.664 1.00 0.74 H new ATOM 0 HB1 ALA A 33 3.150 -10.510 -5.776 1.00 0.83 H new ATOM 0 HB2 ALA A 33 2.416 -9.673 -7.164 1.00 0.83 H new ATOM 0 HB3 ALA A 33 3.937 -10.573 -7.371 1.00 0.83 H new ATOM 508 N GLU A 34 6.490 -9.256 -6.441 1.00 0.70 N ATOM 509 CA GLU A 34 7.790 -9.624 -5.906 1.00 0.74 C ATOM 510 C GLU A 34 8.300 -8.540 -4.955 1.00 0.74 C ATOM 511 O GLU A 34 8.704 -8.833 -3.832 1.00 0.79 O ATOM 512 CB GLU A 34 8.794 -9.884 -7.032 1.00 0.88 C ATOM 513 CG GLU A 34 10.084 -10.498 -6.485 1.00 1.03 C ATOM 514 CD GLU A 34 11.136 -9.418 -6.223 1.00 2.60 C ATOM 515 OE1 GLU A 34 11.525 -8.753 -7.207 1.00 3.85 O ATOM 516 OE2 GLU A 34 11.528 -9.281 -5.044 1.00 3.70 O ATOM 0 H GLU A 34 6.444 -9.213 -7.459 1.00 0.70 H new ATOM 0 HA GLU A 34 7.679 -10.550 -5.342 1.00 0.74 H new ATOM 0 HB2 GLU A 34 8.353 -10.554 -7.770 1.00 0.88 H new ATOM 0 HB3 GLU A 34 9.021 -8.949 -7.545 1.00 0.88 H new ATOM 0 HG2 GLU A 34 9.872 -11.036 -5.561 1.00 1.03 H new ATOM 0 HG3 GLU A 34 10.474 -11.226 -7.196 1.00 1.03 H new ATOM 523 N ASN A 35 8.265 -7.307 -5.442 1.00 0.78 N ATOM 524 CA ASN A 35 8.713 -6.176 -4.648 1.00 0.90 C ATOM 525 C ASN A 35 8.026 -6.214 -3.282 1.00 1.02 C ATOM 526 O ASN A 35 8.692 -6.262 -2.250 1.00 1.72 O ATOM 527 CB ASN A 35 8.349 -4.851 -5.323 1.00 1.11 C ATOM 528 CG ASN A 35 9.411 -4.449 -6.348 1.00 1.73 C ATOM 529 OD1 ASN A 35 10.386 -3.782 -6.042 1.00 2.41 O ATOM 530 ND2 ASN A 35 9.169 -4.892 -7.579 1.00 2.85 N ATOM 0 H ASN A 35 7.933 -7.068 -6.376 1.00 0.78 H new ATOM 0 HA ASN A 35 9.796 -6.244 -4.545 1.00 0.90 H new ATOM 0 HB2 ASN A 35 7.380 -4.943 -5.814 1.00 1.11 H new ATOM 0 HB3 ASN A 35 8.251 -4.069 -4.569 1.00 1.11 H new ATOM 0 HD21 ASN A 35 9.819 -4.678 -8.335 1.00 2.85 H new ATOM 0 HD22 ASN A 35 8.333 -5.446 -7.767 1.00 2.85 H new ATOM 537 N PHE A 36 6.701 -6.190 -3.320 1.00 0.80 N ATOM 538 CA PHE A 36 5.919 -6.151 -2.096 1.00 0.85 C ATOM 539 C PHE A 36 6.193 -7.382 -1.230 1.00 0.74 C ATOM 540 O PHE A 36 6.262 -7.281 -0.006 1.00 0.82 O ATOM 541 CB PHE A 36 4.445 -6.151 -2.508 1.00 0.98 C ATOM 542 CG PHE A 36 3.480 -5.820 -1.367 1.00 1.62 C ATOM 543 CD1 PHE A 36 3.216 -6.749 -0.410 1.00 2.87 C ATOM 544 CD2 PHE A 36 2.888 -4.596 -1.311 1.00 2.26 C ATOM 545 CE1 PHE A 36 2.321 -6.442 0.649 1.00 3.65 C ATOM 546 CE2 PHE A 36 1.992 -4.290 -0.252 1.00 2.94 C ATOM 547 CZ PHE A 36 1.728 -5.219 0.705 1.00 3.33 C ATOM 0 H PHE A 36 6.150 -6.197 -4.178 1.00 0.80 H new ATOM 0 HA PHE A 36 6.181 -5.266 -1.516 1.00 0.85 H new ATOM 0 HB2 PHE A 36 4.303 -5.428 -3.312 1.00 0.98 H new ATOM 0 HB3 PHE A 36 4.191 -7.131 -2.912 1.00 0.98 H new ATOM 0 HD1 PHE A 36 3.687 -7.720 -0.455 1.00 2.87 H new ATOM 0 HD2 PHE A 36 3.099 -3.858 -2.071 1.00 2.26 H new ATOM 0 HE1 PHE A 36 2.111 -7.179 1.410 1.00 3.65 H new ATOM 0 HE2 PHE A 36 1.520 -3.319 -0.207 1.00 2.94 H new ATOM 0 HZ PHE A 36 1.047 -4.986 1.510 1.00 3.33 H new ATOM 557 N ARG A 37 6.343 -8.516 -1.899 1.00 0.67 N ATOM 558 CA ARG A 37 6.575 -9.770 -1.203 1.00 0.73 C ATOM 559 C ARG A 37 7.915 -9.728 -0.466 1.00 0.73 C ATOM 560 O ARG A 37 8.026 -10.221 0.655 1.00 0.81 O ATOM 561 CB ARG A 37 6.573 -10.950 -2.178 1.00 0.82 C ATOM 562 CG ARG A 37 6.561 -12.282 -1.427 1.00 1.27 C ATOM 563 CD ARG A 37 6.737 -13.456 -2.391 1.00 1.80 C ATOM 564 NE ARG A 37 6.551 -14.735 -1.671 1.00 2.60 N ATOM 565 CZ ARG A 37 6.947 -15.927 -2.140 1.00 3.30 C ATOM 566 NH1 ARG A 37 7.271 -16.063 -3.432 1.00 3.59 N ATOM 567 NH2 ARG A 37 7.017 -16.982 -1.316 1.00 4.73 N ATOM 0 H ARG A 37 6.308 -8.592 -2.916 1.00 0.67 H new ATOM 0 HA ARG A 37 5.766 -9.905 -0.485 1.00 0.73 H new ATOM 0 HB2 ARG A 37 5.701 -10.887 -2.828 1.00 0.82 H new ATOM 0 HB3 ARG A 37 7.453 -10.898 -2.819 1.00 0.82 H new ATOM 0 HG2 ARG A 37 7.360 -12.293 -0.686 1.00 1.27 H new ATOM 0 HG3 ARG A 37 5.621 -12.390 -0.885 1.00 1.27 H new ATOM 0 HD2 ARG A 37 6.016 -13.380 -3.205 1.00 1.80 H new ATOM 0 HD3 ARG A 37 7.730 -13.423 -2.840 1.00 1.80 H new ATOM 0 HE ARG A 37 6.093 -14.708 -0.760 1.00 2.60 H new ATOM 0 HH11 ARG A 37 7.216 -15.260 -4.059 1.00 3.59 H new ATOM 0 HH12 ARG A 37 7.572 -16.970 -3.790 1.00 3.59 H new ATOM 0 HH21 ARG A 37 6.769 -16.878 -0.332 1.00 4.73 H new ATOM 0 HH22 ARG A 37 7.318 -17.889 -1.673 1.00 4.73 H new ATOM 581 N ALA A 38 8.899 -9.136 -1.126 1.00 0.69 N ATOM 582 CA ALA A 38 10.239 -9.070 -0.570 1.00 0.76 C ATOM 583 C ALA A 38 10.233 -8.159 0.660 1.00 0.78 C ATOM 584 O ALA A 38 10.937 -8.419 1.633 1.00 0.89 O ATOM 585 CB ALA A 38 11.216 -8.589 -1.646 1.00 0.77 C ATOM 0 H ALA A 38 8.795 -8.698 -2.041 1.00 0.69 H new ATOM 0 HA ALA A 38 10.569 -10.058 -0.247 1.00 0.76 H new ATOM 0 HB1 ALA A 38 12.222 -8.540 -1.228 1.00 0.77 H new ATOM 0 HB2 ALA A 38 11.205 -9.285 -2.485 1.00 0.77 H new ATOM 0 HB3 ALA A 38 10.918 -7.599 -1.992 1.00 0.77 H new ATOM 591 N LEU A 39 9.428 -7.110 0.574 1.00 0.76 N ATOM 592 CA LEU A 39 9.400 -6.101 1.619 1.00 0.85 C ATOM 593 C LEU A 39 8.595 -6.628 2.808 1.00 0.97 C ATOM 594 O LEU A 39 8.506 -5.970 3.844 1.00 1.31 O ATOM 595 CB LEU A 39 8.883 -4.771 1.067 1.00 0.86 C ATOM 596 CG LEU A 39 9.804 -4.051 0.080 1.00 0.86 C ATOM 597 CD1 LEU A 39 9.184 -2.734 -0.389 1.00 1.00 C ATOM 598 CD2 LEU A 39 11.197 -3.847 0.678 1.00 1.07 C ATOM 0 H LEU A 39 8.790 -6.937 -0.203 1.00 0.76 H new ATOM 0 HA LEU A 39 10.408 -5.898 1.980 1.00 0.85 H new ATOM 0 HB2 LEU A 39 7.927 -4.951 0.576 1.00 0.86 H new ATOM 0 HB3 LEU A 39 8.689 -4.103 1.906 1.00 0.86 H new ATOM 0 HG LEU A 39 9.921 -4.683 -0.800 1.00 0.86 H new ATOM 0 HD11 LEU A 39 9.859 -2.243 -1.090 1.00 1.00 H new ATOM 0 HD12 LEU A 39 8.233 -2.935 -0.882 1.00 1.00 H new ATOM 0 HD13 LEU A 39 9.017 -2.084 0.470 1.00 1.00 H new ATOM 0 HD21 LEU A 39 11.831 -3.333 -0.044 1.00 1.07 H new ATOM 0 HD22 LEU A 39 11.119 -3.247 1.585 1.00 1.07 H new ATOM 0 HD23 LEU A 39 11.634 -4.816 0.920 1.00 1.07 H new ATOM 610 N SER A 40 8.026 -7.810 2.619 1.00 0.93 N ATOM 611 CA SER A 40 7.339 -8.492 3.703 1.00 1.09 C ATOM 612 C SER A 40 8.319 -9.388 4.463 1.00 1.23 C ATOM 613 O SER A 40 7.948 -10.023 5.450 1.00 1.72 O ATOM 614 CB SER A 40 6.163 -9.316 3.178 1.00 1.13 C ATOM 615 OG SER A 40 5.803 -8.947 1.849 1.00 2.29 O ATOM 0 H SER A 40 8.027 -8.313 1.731 1.00 0.93 H new ATOM 0 HA SER A 40 6.943 -7.739 4.384 1.00 1.09 H new ATOM 0 HB2 SER A 40 6.422 -10.374 3.203 1.00 1.13 H new ATOM 0 HB3 SER A 40 5.305 -9.183 3.836 1.00 1.13 H new ATOM 0 HG SER A 40 5.999 -7.997 1.709 1.00 2.29 H new ATOM 621 N THR A 41 9.550 -9.411 3.975 1.00 1.35 N ATOM 622 CA THR A 41 10.583 -10.229 4.588 1.00 1.59 C ATOM 623 C THR A 41 11.969 -9.665 4.271 1.00 1.81 C ATOM 624 O THR A 41 12.950 -10.404 4.230 1.00 2.54 O ATOM 625 CB THR A 41 10.390 -11.670 4.111 1.00 1.60 C ATOM 626 OG1 THR A 41 11.253 -12.432 4.951 1.00 2.35 O ATOM 627 CG2 THR A 41 10.942 -11.899 2.702 1.00 1.67 C ATOM 0 H THR A 41 9.856 -8.876 3.162 1.00 1.35 H new ATOM 0 HA THR A 41 10.503 -10.217 5.675 1.00 1.59 H new ATOM 0 HB THR A 41 9.329 -11.920 4.130 1.00 1.60 H new ATOM 0 HG1 THR A 41 12.137 -12.010 4.980 1.00 2.35 H new ATOM 0 HG21 THR A 41 10.780 -12.937 2.412 1.00 1.67 H new ATOM 0 HG22 THR A 41 10.430 -11.241 1.999 1.00 1.67 H new ATOM 0 HG23 THR A 41 12.010 -11.682 2.690 1.00 1.67 H new ATOM 635 N GLY A 42 12.005 -8.358 4.056 1.00 1.56 N ATOM 636 CA GLY A 42 13.174 -7.728 3.466 1.00 1.88 C ATOM 637 C GLY A 42 14.458 -8.434 3.908 1.00 1.84 C ATOM 638 O GLY A 42 15.036 -9.212 3.149 1.00 2.57 O ATOM 0 H GLY A 42 11.243 -7.718 4.280 1.00 1.56 H new ATOM 0 HA2 GLY A 42 13.096 -7.754 2.379 1.00 1.88 H new ATOM 0 HA3 GLY A 42 13.213 -6.679 3.758 1.00 1.88 H new ATOM 642 N GLU A 43 14.867 -8.139 5.132 1.00 2.89 N ATOM 643 CA GLU A 43 16.194 -8.511 5.588 1.00 3.64 C ATOM 644 C GLU A 43 17.243 -8.126 4.542 1.00 3.45 C ATOM 645 O GLU A 43 18.279 -8.779 4.427 1.00 4.06 O ATOM 646 CB GLU A 43 16.265 -10.006 5.911 1.00 4.39 C ATOM 647 CG GLU A 43 15.276 -10.375 7.017 1.00 5.47 C ATOM 648 CD GLU A 43 15.671 -9.727 8.345 1.00 7.25 C ATOM 649 OE1 GLU A 43 16.565 -10.294 9.009 1.00 8.13 O ATOM 650 OE2 GLU A 43 15.069 -8.680 8.667 1.00 8.14 O ATOM 0 H GLU A 43 14.302 -7.646 5.823 1.00 2.89 H new ATOM 0 HA GLU A 43 16.407 -7.964 6.506 1.00 3.64 H new ATOM 0 HB2 GLU A 43 16.047 -10.586 5.014 1.00 4.39 H new ATOM 0 HB3 GLU A 43 17.277 -10.267 6.221 1.00 4.39 H new ATOM 0 HG2 GLU A 43 14.273 -10.053 6.735 1.00 5.47 H new ATOM 0 HG3 GLU A 43 15.242 -11.458 7.133 1.00 5.47 H new ATOM 657 N LYS A 44 16.936 -7.068 3.806 1.00 3.14 N ATOM 658 CA LYS A 44 17.793 -6.644 2.712 1.00 3.00 C ATOM 659 C LYS A 44 17.735 -5.120 2.586 1.00 3.02 C ATOM 660 O LYS A 44 17.882 -4.578 1.492 1.00 3.25 O ATOM 661 CB LYS A 44 17.423 -7.383 1.424 1.00 2.91 C ATOM 662 CG LYS A 44 18.676 -7.812 0.659 1.00 3.44 C ATOM 663 CD LYS A 44 19.195 -6.676 -0.226 1.00 3.92 C ATOM 664 CE LYS A 44 18.159 -6.288 -1.283 1.00 3.25 C ATOM 665 NZ LYS A 44 18.826 -5.751 -2.489 1.00 4.25 N ATOM 0 H LYS A 44 16.106 -6.492 3.946 1.00 3.14 H new ATOM 0 HA LYS A 44 18.831 -6.908 2.916 1.00 3.00 H new ATOM 0 HB2 LYS A 44 16.821 -8.259 1.664 1.00 2.91 H new ATOM 0 HB3 LYS A 44 16.811 -6.738 0.794 1.00 2.91 H new ATOM 0 HG2 LYS A 44 19.452 -8.112 1.364 1.00 3.44 H new ATOM 0 HG3 LYS A 44 18.450 -8.683 0.044 1.00 3.44 H new ATOM 0 HD2 LYS A 44 19.433 -5.809 0.391 1.00 3.92 H new ATOM 0 HD3 LYS A 44 20.120 -6.984 -0.714 1.00 3.92 H new ATOM 0 HE2 LYS A 44 17.559 -7.158 -1.549 1.00 3.25 H new ATOM 0 HE3 LYS A 44 17.476 -5.542 -0.875 1.00 3.25 H new ATOM 0 HZ1 LYS A 44 18.109 -5.493 -3.196 1.00 4.25 H new ATOM 0 HZ2 LYS A 44 19.380 -4.908 -2.233 1.00 4.25 H new ATOM 0 HZ3 LYS A 44 19.459 -6.474 -2.886 1.00 4.25 H new ATOM 679 N GLY A 45 17.519 -4.472 3.721 1.00 3.43 N ATOM 680 CA GLY A 45 17.421 -3.022 3.748 1.00 3.92 C ATOM 681 C GLY A 45 16.287 -2.567 4.669 1.00 3.58 C ATOM 682 O GLY A 45 16.517 -1.822 5.620 1.00 4.45 O ATOM 0 H GLY A 45 17.409 -4.924 4.629 1.00 3.43 H new ATOM 0 HA2 GLY A 45 18.365 -2.596 4.089 1.00 3.92 H new ATOM 0 HA3 GLY A 45 17.248 -2.647 2.739 1.00 3.92 H new ATOM 686 N PHE A 46 15.089 -3.034 4.354 1.00 2.61 N ATOM 687 CA PHE A 46 13.910 -2.642 5.108 1.00 2.37 C ATOM 688 C PHE A 46 12.691 -3.468 4.690 1.00 1.77 C ATOM 689 O PHE A 46 12.819 -4.431 3.936 1.00 1.62 O ATOM 690 CB PHE A 46 13.646 -1.168 4.790 1.00 2.70 C ATOM 691 CG PHE A 46 13.254 -0.906 3.334 1.00 2.76 C ATOM 692 CD1 PHE A 46 14.207 -0.902 2.364 1.00 2.60 C ATOM 693 CD2 PHE A 46 11.953 -0.678 3.012 1.00 3.72 C ATOM 694 CE1 PHE A 46 13.843 -0.658 1.014 1.00 2.86 C ATOM 695 CE2 PHE A 46 11.589 -0.434 1.660 1.00 4.07 C ATOM 696 CZ PHE A 46 12.542 -0.429 0.690 1.00 3.41 C ATOM 0 H PHE A 46 14.908 -3.681 3.586 1.00 2.61 H new ATOM 0 HA PHE A 46 14.078 -2.805 6.173 1.00 2.37 H new ATOM 0 HB2 PHE A 46 12.851 -0.803 5.441 1.00 2.70 H new ATOM 0 HB3 PHE A 46 14.540 -0.591 5.024 1.00 2.70 H new ATOM 0 HD1 PHE A 46 15.240 -1.084 2.621 1.00 2.60 H new ATOM 0 HD2 PHE A 46 11.197 -0.682 3.783 1.00 3.72 H new ATOM 0 HE1 PHE A 46 14.600 -0.654 0.243 1.00 2.86 H new ATOM 0 HE2 PHE A 46 10.556 -0.253 1.403 1.00 4.07 H new ATOM 0 HZ PHE A 46 12.266 -0.243 -0.337 1.00 3.41 H new ATOM 706 N GLY A 47 11.538 -3.060 5.199 1.00 1.74 N ATOM 707 CA GLY A 47 10.291 -3.715 4.843 1.00 1.49 C ATOM 708 C GLY A 47 9.362 -3.820 6.054 1.00 1.70 C ATOM 709 O GLY A 47 9.586 -4.640 6.944 1.00 3.02 O ATOM 0 H GLY A 47 11.441 -2.285 5.855 1.00 1.74 H new ATOM 0 HA2 GLY A 47 9.797 -3.156 4.048 1.00 1.49 H new ATOM 0 HA3 GLY A 47 10.498 -4.711 4.451 1.00 1.49 H new ATOM 713 N TYR A 48 8.339 -2.978 6.051 1.00 1.29 N ATOM 714 CA TYR A 48 7.311 -3.043 7.076 1.00 1.65 C ATOM 715 C TYR A 48 7.930 -3.251 8.460 1.00 1.44 C ATOM 716 O TYR A 48 7.684 -4.268 9.107 1.00 2.57 O ATOM 717 CB TYR A 48 6.447 -4.257 6.730 1.00 2.08 C ATOM 718 CG TYR A 48 5.479 -4.020 5.568 1.00 2.96 C ATOM 719 CD1 TYR A 48 5.968 -3.810 4.294 1.00 3.41 C ATOM 720 CD2 TYR A 48 4.118 -4.017 5.793 1.00 4.35 C ATOM 721 CE1 TYR A 48 5.058 -3.588 3.201 1.00 4.61 C ATOM 722 CE2 TYR A 48 3.207 -3.794 4.700 1.00 5.52 C ATOM 723 CZ TYR A 48 3.723 -3.591 3.458 1.00 5.39 C ATOM 724 OH TYR A 48 2.863 -3.380 2.425 1.00 6.69 O ATOM 0 H TYR A 48 8.200 -2.246 5.354 1.00 1.29 H new ATOM 0 HA TYR A 48 6.738 -2.116 7.104 1.00 1.65 H new ATOM 0 HB2 TYR A 48 7.098 -5.095 6.482 1.00 2.08 H new ATOM 0 HB3 TYR A 48 5.876 -4.547 7.612 1.00 2.08 H new ATOM 0 HD1 TYR A 48 7.033 -3.812 4.117 1.00 3.41 H new ATOM 0 HD2 TYR A 48 3.735 -4.182 6.789 1.00 4.35 H new ATOM 0 HE1 TYR A 48 5.427 -3.423 2.200 1.00 4.61 H new ATOM 0 HE2 TYR A 48 2.139 -3.788 4.863 1.00 5.52 H new ATOM 0 HH TYR A 48 2.898 -4.141 1.809 1.00 6.69 H new ATOM 734 N LYS A 49 8.722 -2.273 8.872 1.00 1.11 N ATOM 735 CA LYS A 49 9.349 -2.319 10.181 1.00 1.20 C ATOM 736 C LYS A 49 9.762 -0.905 10.595 1.00 1.42 C ATOM 737 O LYS A 49 10.856 -0.450 10.262 1.00 1.57 O ATOM 738 CB LYS A 49 10.504 -3.323 10.187 1.00 1.34 C ATOM 739 CG LYS A 49 11.177 -3.378 11.561 1.00 2.04 C ATOM 740 CD LYS A 49 10.198 -3.865 12.630 1.00 2.12 C ATOM 741 CE LYS A 49 9.607 -5.225 12.255 1.00 2.08 C ATOM 742 NZ LYS A 49 9.005 -5.874 13.440 1.00 2.57 N ATOM 0 H LYS A 49 8.944 -1.443 8.322 1.00 1.11 H new ATOM 0 HA LYS A 49 8.642 -2.677 10.929 1.00 1.20 H new ATOM 0 HB2 LYS A 49 10.132 -4.312 9.921 1.00 1.34 H new ATOM 0 HB3 LYS A 49 11.237 -3.044 9.430 1.00 1.34 H new ATOM 0 HG2 LYS A 49 12.039 -4.044 11.522 1.00 2.04 H new ATOM 0 HG3 LYS A 49 11.550 -2.389 11.827 1.00 2.04 H new ATOM 0 HD2 LYS A 49 10.710 -3.939 13.590 1.00 2.12 H new ATOM 0 HD3 LYS A 49 9.396 -3.137 12.752 1.00 2.12 H new ATOM 0 HE2 LYS A 49 8.851 -5.098 11.480 1.00 2.08 H new ATOM 0 HE3 LYS A 49 10.386 -5.864 11.840 1.00 2.08 H new ATOM 0 HZ1 LYS A 49 8.639 -6.811 13.174 1.00 2.57 H new ATOM 0 HZ2 LYS A 49 9.727 -5.982 14.181 1.00 2.57 H new ATOM 0 HZ3 LYS A 49 8.225 -5.287 13.799 1.00 2.57 H new ATOM 756 N GLY A 50 8.865 -0.248 11.316 1.00 1.97 N ATOM 757 CA GLY A 50 9.130 1.097 11.797 1.00 2.32 C ATOM 758 C GLY A 50 8.226 2.116 11.100 1.00 1.88 C ATOM 759 O GLY A 50 8.081 3.245 11.568 1.00 2.71 O ATOM 0 H GLY A 50 7.953 -0.623 11.579 1.00 1.97 H new ATOM 0 HA2 GLY A 50 8.970 1.140 12.874 1.00 2.32 H new ATOM 0 HA3 GLY A 50 10.175 1.351 11.620 1.00 2.32 H new ATOM 763 N SER A 51 7.642 1.682 9.993 1.00 1.44 N ATOM 764 CA SER A 51 6.761 2.545 9.224 1.00 2.05 C ATOM 765 C SER A 51 5.498 2.855 10.030 1.00 1.58 C ATOM 766 O SER A 51 5.102 2.074 10.894 1.00 2.43 O ATOM 767 CB SER A 51 6.392 1.903 7.886 1.00 3.47 C ATOM 768 OG SER A 51 6.426 0.481 7.948 1.00 4.38 O ATOM 0 H SER A 51 7.761 0.744 9.610 1.00 1.44 H new ATOM 0 HA SER A 51 7.289 3.475 9.016 1.00 2.05 H new ATOM 0 HB2 SER A 51 5.395 2.229 7.591 1.00 3.47 H new ATOM 0 HB3 SER A 51 7.082 2.249 7.116 1.00 3.47 H new ATOM 0 HG SER A 51 7.212 0.151 7.464 1.00 4.38 H new ATOM 774 N CYS A 52 4.900 3.995 9.717 1.00 1.48 N ATOM 775 CA CYS A 52 3.719 4.442 10.436 1.00 1.71 C ATOM 776 C CYS A 52 2.787 5.138 9.443 1.00 1.62 C ATOM 777 O CYS A 52 2.959 6.319 9.147 1.00 2.75 O ATOM 778 CB CYS A 52 4.082 5.352 11.612 1.00 2.69 C ATOM 779 SG CYS A 52 5.206 6.682 11.049 1.00 3.75 S ATOM 0 H CYS A 52 5.211 4.622 8.975 1.00 1.48 H new ATOM 0 HA CYS A 52 3.209 3.583 10.871 1.00 1.71 H new ATOM 0 HB2 CYS A 52 3.178 5.785 12.040 1.00 2.69 H new ATOM 0 HB3 CYS A 52 4.560 4.769 12.400 1.00 2.69 H new ATOM 0 HG CYS A 52 4.768 7.176 9.929 1.00 3.75 H new ATOM 785 N PHE A 53 1.819 4.376 8.953 1.00 1.84 N ATOM 786 CA PHE A 53 0.825 4.921 8.045 1.00 1.98 C ATOM 787 C PHE A 53 1.481 5.786 6.967 1.00 1.72 C ATOM 788 O PHE A 53 2.707 5.854 6.882 1.00 2.35 O ATOM 789 CB PHE A 53 -0.115 5.793 8.880 1.00 2.47 C ATOM 790 CG PHE A 53 0.580 6.964 9.578 1.00 3.59 C ATOM 791 CD1 PHE A 53 0.875 8.094 8.879 1.00 4.51 C ATOM 792 CD2 PHE A 53 0.904 6.876 10.895 1.00 4.88 C ATOM 793 CE1 PHE A 53 1.521 9.180 9.526 1.00 6.41 C ATOM 794 CE2 PHE A 53 1.548 7.963 11.543 1.00 6.56 C ATOM 795 CZ PHE A 53 1.842 9.092 10.845 1.00 7.21 C ATOM 0 H PHE A 53 1.703 3.386 9.168 1.00 1.84 H new ATOM 0 HA PHE A 53 0.293 4.110 7.548 1.00 1.98 H new ATOM 0 HB2 PHE A 53 -0.902 6.183 8.234 1.00 2.47 H new ATOM 0 HB3 PHE A 53 -0.599 5.170 9.632 1.00 2.47 H new ATOM 0 HD1 PHE A 53 0.618 8.164 7.832 1.00 4.51 H new ATOM 0 HD2 PHE A 53 0.671 5.979 11.449 1.00 4.88 H new ATOM 0 HE1 PHE A 53 1.758 10.076 8.971 1.00 6.41 H new ATOM 0 HE2 PHE A 53 1.804 7.893 12.590 1.00 6.56 H new ATOM 0 HZ PHE A 53 2.331 9.919 11.338 1.00 7.21 H new ATOM 805 N HIS A 54 0.637 6.425 6.171 1.00 1.74 N ATOM 806 CA HIS A 54 1.120 7.294 5.110 1.00 1.82 C ATOM 807 C HIS A 54 -0.060 8.023 4.466 1.00 2.04 C ATOM 808 O HIS A 54 -0.415 7.747 3.322 1.00 4.01 O ATOM 809 CB HIS A 54 1.954 6.504 4.098 1.00 2.45 C ATOM 810 CG HIS A 54 2.174 7.225 2.790 1.00 2.02 C ATOM 811 ND1 HIS A 54 2.311 6.561 1.583 1.00 2.19 N ATOM 812 CD2 HIS A 54 2.280 8.556 2.512 1.00 2.77 C ATOM 813 CE1 HIS A 54 2.491 7.463 0.628 1.00 2.64 C ATOM 814 NE2 HIS A 54 2.472 8.698 1.207 1.00 3.36 N ATOM 0 H HIS A 54 -0.379 6.359 6.239 1.00 1.74 H new ATOM 0 HA HIS A 54 1.784 8.050 5.529 1.00 1.82 H new ATOM 0 HB2 HIS A 54 2.923 6.273 4.542 1.00 2.45 H new ATOM 0 HB3 HIS A 54 1.460 5.553 3.899 1.00 2.45 H new ATOM 0 HD1 HIS A 54 2.279 5.550 1.451 1.00 2.19 H new ATOM 0 HD2 HIS A 54 2.218 9.358 3.232 1.00 2.77 H new ATOM 0 HE1 HIS A 54 2.628 7.256 -0.423 1.00 2.64 H new ATOM 822 N ARG A 55 -0.635 8.940 5.230 1.00 0.84 N ATOM 823 CA ARG A 55 -1.774 9.705 4.752 1.00 0.91 C ATOM 824 C ARG A 55 -3.040 8.846 4.781 1.00 0.75 C ATOM 825 O ARG A 55 -3.201 7.943 3.962 1.00 0.94 O ATOM 826 CB ARG A 55 -1.540 10.208 3.327 1.00 1.34 C ATOM 827 CG ARG A 55 -2.034 11.647 3.164 1.00 1.28 C ATOM 828 CD ARG A 55 -2.138 12.028 1.686 1.00 1.29 C ATOM 829 NE ARG A 55 -0.927 11.582 0.962 1.00 2.08 N ATOM 830 CZ ARG A 55 0.323 11.910 1.318 1.00 3.34 C ATOM 831 NH1 ARG A 55 0.539 12.964 2.115 1.00 3.74 N ATOM 832 NH2 ARG A 55 1.358 11.181 0.877 1.00 4.95 N ATOM 0 H ARG A 55 -0.333 9.170 6.177 1.00 0.84 H new ATOM 0 HA ARG A 55 -1.898 10.563 5.412 1.00 0.91 H new ATOM 0 HB2 ARG A 55 -0.478 10.156 3.089 1.00 1.34 H new ATOM 0 HB3 ARG A 55 -2.057 9.560 2.620 1.00 1.34 H new ATOM 0 HG2 ARG A 55 -3.008 11.757 3.641 1.00 1.28 H new ATOM 0 HG3 ARG A 55 -1.352 12.329 3.672 1.00 1.28 H new ATOM 0 HD2 ARG A 55 -3.024 11.571 1.246 1.00 1.29 H new ATOM 0 HD3 ARG A 55 -2.254 13.107 1.587 1.00 1.29 H new ATOM 0 HE ARG A 55 -1.051 10.989 0.142 1.00 2.08 H new ATOM 0 HH11 ARG A 55 -0.248 13.518 2.452 1.00 3.74 H new ATOM 0 HH12 ARG A 55 1.491 13.213 2.385 1.00 3.74 H new ATOM 0 HH21 ARG A 55 1.194 10.377 0.271 1.00 4.95 H new ATOM 0 HH22 ARG A 55 2.309 11.430 1.148 1.00 4.95 H new ATOM 846 N ILE A 56 -3.907 9.159 5.733 1.00 0.66 N ATOM 847 CA ILE A 56 -5.167 8.447 5.862 1.00 0.56 C ATOM 848 C ILE A 56 -6.325 9.425 5.649 1.00 0.56 C ATOM 849 O ILE A 56 -6.365 10.487 6.266 1.00 0.73 O ATOM 850 CB ILE A 56 -5.229 7.703 7.197 1.00 0.58 C ATOM 851 CG1 ILE A 56 -4.018 6.782 7.367 1.00 0.70 C ATOM 852 CG2 ILE A 56 -6.550 6.945 7.342 1.00 0.61 C ATOM 853 CD1 ILE A 56 -4.112 5.990 8.673 1.00 0.77 C ATOM 0 H ILE A 56 -3.761 9.896 6.423 1.00 0.66 H new ATOM 0 HA ILE A 56 -5.251 7.680 5.092 1.00 0.56 H new ATOM 0 HB ILE A 56 -5.191 8.439 8.000 1.00 0.58 H new ATOM 0 HG12 ILE A 56 -3.958 6.094 6.524 1.00 0.70 H new ATOM 0 HG13 ILE A 56 -3.103 7.374 7.361 1.00 0.70 H new ATOM 0 HG21 ILE A 56 -6.568 6.425 8.300 1.00 0.61 H new ATOM 0 HG22 ILE A 56 -7.381 7.649 7.296 1.00 0.61 H new ATOM 0 HG23 ILE A 56 -6.644 6.220 6.534 1.00 0.61 H new ATOM 0 HD11 ILE A 56 -3.240 5.343 8.770 1.00 0.77 H new ATOM 0 HD12 ILE A 56 -4.147 6.681 9.516 1.00 0.77 H new ATOM 0 HD13 ILE A 56 -5.016 5.381 8.665 1.00 0.77 H new ATOM 865 N ILE A 57 -7.238 9.030 4.772 1.00 0.53 N ATOM 866 CA ILE A 57 -8.319 9.912 4.370 1.00 0.58 C ATOM 867 C ILE A 57 -9.635 9.132 4.373 1.00 0.67 C ATOM 868 O ILE A 57 -9.687 7.992 3.915 1.00 0.60 O ATOM 869 CB ILE A 57 -8.000 10.574 3.028 1.00 0.64 C ATOM 870 CG1 ILE A 57 -6.871 11.596 3.176 1.00 0.76 C ATOM 871 CG2 ILE A 57 -9.254 11.191 2.409 1.00 0.76 C ATOM 872 CD1 ILE A 57 -6.469 12.169 1.815 1.00 0.87 C ATOM 0 H ILE A 57 -7.250 8.111 4.330 1.00 0.53 H new ATOM 0 HA ILE A 57 -8.430 10.729 5.084 1.00 0.58 H new ATOM 0 HB ILE A 57 -7.649 9.803 2.342 1.00 0.64 H new ATOM 0 HG12 ILE A 57 -7.191 12.404 3.835 1.00 0.76 H new ATOM 0 HG13 ILE A 57 -6.008 11.124 3.646 1.00 0.76 H new ATOM 0 HG21 ILE A 57 -8.999 11.655 1.456 1.00 0.76 H new ATOM 0 HG22 ILE A 57 -10.000 10.413 2.246 1.00 0.76 H new ATOM 0 HG23 ILE A 57 -9.659 11.946 3.083 1.00 0.76 H new ATOM 0 HD11 ILE A 57 -5.665 12.893 1.948 1.00 0.87 H new ATOM 0 HD12 ILE A 57 -6.127 11.362 1.167 1.00 0.87 H new ATOM 0 HD13 ILE A 57 -7.328 12.661 1.359 1.00 0.87 H new ATOM 884 N PRO A 58 -10.695 9.795 4.908 1.00 0.97 N ATOM 885 CA PRO A 58 -11.934 9.101 5.218 1.00 1.04 C ATOM 886 C PRO A 58 -12.724 8.797 3.944 1.00 0.80 C ATOM 887 O PRO A 58 -13.133 9.710 3.229 1.00 1.01 O ATOM 888 CB PRO A 58 -12.675 10.026 6.170 1.00 1.51 C ATOM 889 CG PRO A 58 -12.045 11.398 5.995 1.00 1.70 C ATOM 890 CD PRO A 58 -10.742 11.218 5.233 1.00 1.37 C ATOM 0 HA PRO A 58 -11.768 8.127 5.679 1.00 1.04 H new ATOM 0 HB2 PRO A 58 -13.740 10.053 5.938 1.00 1.51 H new ATOM 0 HB3 PRO A 58 -12.582 9.682 7.200 1.00 1.51 H new ATOM 0 HG2 PRO A 58 -12.718 12.060 5.450 1.00 1.70 H new ATOM 0 HG3 PRO A 58 -11.860 11.860 6.965 1.00 1.70 H new ATOM 0 HD2 PRO A 58 -10.723 11.831 4.332 1.00 1.37 H new ATOM 0 HD3 PRO A 58 -9.885 11.514 5.838 1.00 1.37 H new ATOM 898 N GLY A 59 -12.915 7.508 3.699 1.00 0.64 N ATOM 899 CA GLY A 59 -13.713 7.073 2.565 1.00 0.64 C ATOM 900 C GLY A 59 -12.952 7.264 1.252 1.00 0.65 C ATOM 901 O GLY A 59 -13.539 7.643 0.239 1.00 0.87 O ATOM 0 H GLY A 59 -12.531 6.752 4.266 1.00 0.64 H new ATOM 0 HA2 GLY A 59 -13.980 6.023 2.685 1.00 0.64 H new ATOM 0 HA3 GLY A 59 -14.645 7.637 2.534 1.00 0.64 H new ATOM 905 N PHE A 60 -11.656 6.995 1.311 1.00 0.58 N ATOM 906 CA PHE A 60 -10.820 7.070 0.125 1.00 0.61 C ATOM 907 C PHE A 60 -9.743 5.984 0.143 1.00 0.67 C ATOM 908 O PHE A 60 -9.745 5.089 -0.700 1.00 0.77 O ATOM 909 CB PHE A 60 -10.145 8.443 0.141 1.00 0.59 C ATOM 910 CG PHE A 60 -9.164 8.668 -1.010 1.00 0.64 C ATOM 911 CD1 PHE A 60 -9.424 8.143 -2.238 1.00 1.62 C ATOM 912 CD2 PHE A 60 -8.031 9.392 -0.808 1.00 1.88 C ATOM 913 CE1 PHE A 60 -8.514 8.350 -3.308 1.00 1.65 C ATOM 914 CE2 PHE A 60 -7.120 9.600 -1.878 1.00 1.93 C ATOM 915 CZ PHE A 60 -7.381 9.075 -3.104 1.00 0.81 C ATOM 0 H PHE A 60 -11.164 6.725 2.163 1.00 0.58 H new ATOM 0 HA PHE A 60 -11.427 6.925 -0.769 1.00 0.61 H new ATOM 0 HB2 PHE A 60 -10.914 9.215 0.105 1.00 0.59 H new ATOM 0 HB3 PHE A 60 -9.615 8.565 1.086 1.00 0.59 H new ATOM 0 HD1 PHE A 60 -10.324 7.568 -2.399 1.00 1.62 H new ATOM 0 HD2 PHE A 60 -7.824 9.809 0.166 1.00 1.88 H new ATOM 0 HE1 PHE A 60 -8.721 7.933 -4.282 1.00 1.65 H new ATOM 0 HE2 PHE A 60 -6.220 10.175 -1.717 1.00 1.93 H new ATOM 0 HZ PHE A 60 -6.688 9.233 -3.917 1.00 0.81 H new ATOM 925 N MET A 61 -8.847 6.101 1.113 1.00 0.65 N ATOM 926 CA MET A 61 -7.642 5.290 1.120 1.00 0.76 C ATOM 927 C MET A 61 -6.897 5.424 2.449 1.00 0.78 C ATOM 928 O MET A 61 -6.909 6.488 3.066 1.00 0.82 O ATOM 929 CB MET A 61 -6.726 5.728 -0.025 1.00 0.87 C ATOM 930 CG MET A 61 -5.255 5.511 0.335 1.00 1.72 C ATOM 931 SD MET A 61 -4.648 6.898 1.280 1.00 1.87 S ATOM 932 CE MET A 61 -4.308 8.049 -0.042 1.00 1.63 C ATOM 0 H MET A 61 -8.932 6.745 1.899 1.00 0.65 H new ATOM 0 HA MET A 61 -7.929 4.246 0.990 1.00 0.76 H new ATOM 0 HB2 MET A 61 -6.970 5.165 -0.926 1.00 0.87 H new ATOM 0 HB3 MET A 61 -6.897 6.781 -0.250 1.00 0.87 H new ATOM 0 HG2 MET A 61 -5.144 4.592 0.910 1.00 1.72 H new ATOM 0 HG3 MET A 61 -4.663 5.392 -0.573 1.00 1.72 H new ATOM 0 HE1 MET A 61 -4.282 9.063 0.356 1.00 1.63 H new ATOM 0 HE2 MET A 61 -3.344 7.812 -0.492 1.00 1.63 H new ATOM 0 HE3 MET A 61 -5.090 7.976 -0.798 1.00 1.63 H new ATOM 942 N CYS A 62 -6.268 4.329 2.851 1.00 0.94 N ATOM 943 CA CYS A 62 -5.179 4.403 3.810 1.00 0.98 C ATOM 944 C CYS A 62 -3.910 3.874 3.137 1.00 1.03 C ATOM 945 O CYS A 62 -3.885 2.744 2.652 1.00 1.23 O ATOM 946 CB CYS A 62 -5.503 3.639 5.095 1.00 1.30 C ATOM 947 SG CYS A 62 -5.354 1.837 4.807 1.00 2.64 S ATOM 0 H CYS A 62 -6.492 3.387 2.530 1.00 0.94 H new ATOM 0 HA CYS A 62 -5.026 5.440 4.110 1.00 0.98 H new ATOM 0 HB2 CYS A 62 -4.824 3.946 5.891 1.00 1.30 H new ATOM 0 HB3 CYS A 62 -6.513 3.880 5.426 1.00 1.30 H new ATOM 0 HG CYS A 62 -5.250 1.222 5.948 1.00 2.64 H new ATOM 953 N GLN A 63 -2.887 4.717 3.129 1.00 1.26 N ATOM 954 CA GLN A 63 -1.671 4.409 2.397 1.00 1.59 C ATOM 955 C GLN A 63 -0.561 3.989 3.363 1.00 1.47 C ATOM 956 O GLN A 63 -0.662 4.219 4.568 1.00 1.91 O ATOM 957 CB GLN A 63 -1.231 5.599 1.541 1.00 2.25 C ATOM 958 CG GLN A 63 -1.238 5.238 0.055 1.00 3.25 C ATOM 959 CD GLN A 63 -0.402 6.231 -0.755 1.00 4.59 C ATOM 960 OE1 GLN A 63 -0.471 7.435 -0.573 1.00 5.34 O ATOM 961 NE2 GLN A 63 0.392 5.661 -1.657 1.00 5.53 N ATOM 0 H GLN A 63 -2.876 5.612 3.618 1.00 1.26 H new ATOM 0 HA GLN A 63 -1.876 3.575 1.725 1.00 1.59 H new ATOM 0 HB2 GLN A 63 -1.897 6.444 1.717 1.00 2.25 H new ATOM 0 HB3 GLN A 63 -0.231 5.915 1.837 1.00 2.25 H new ATOM 0 HG2 GLN A 63 -0.844 4.231 -0.080 1.00 3.25 H new ATOM 0 HG3 GLN A 63 -2.263 5.232 -0.317 1.00 3.25 H new ATOM 0 HE21 GLN A 63 0.402 4.646 -1.759 1.00 5.53 H new ATOM 0 HE22 GLN A 63 0.991 6.239 -2.247 1.00 5.53 H new ATOM 970 N GLY A 64 0.471 3.380 2.799 1.00 1.35 N ATOM 971 CA GLY A 64 1.629 2.987 3.585 1.00 1.70 C ATOM 972 C GLY A 64 2.927 3.435 2.911 1.00 1.76 C ATOM 973 O GLY A 64 3.036 3.411 1.686 1.00 2.73 O ATOM 0 H GLY A 64 0.530 3.149 1.807 1.00 1.35 H new ATOM 0 HA2 GLY A 64 1.562 3.425 4.581 1.00 1.70 H new ATOM 0 HA3 GLY A 64 1.636 1.904 3.712 1.00 1.70 H new ATOM 977 N GLY A 65 3.880 3.834 3.742 1.00 1.75 N ATOM 978 CA GLY A 65 5.172 4.274 3.243 1.00 2.34 C ATOM 979 C GLY A 65 6.283 3.959 4.247 1.00 1.97 C ATOM 980 O GLY A 65 6.053 3.971 5.456 1.00 3.21 O ATOM 0 H GLY A 65 3.783 3.862 4.757 1.00 1.75 H new ATOM 0 HA2 GLY A 65 5.385 3.784 2.293 1.00 2.34 H new ATOM 0 HA3 GLY A 65 5.145 5.346 3.049 1.00 2.34 H new ATOM 984 N ASP A 66 7.463 3.687 3.709 1.00 2.13 N ATOM 985 CA ASP A 66 8.565 3.211 4.527 1.00 2.76 C ATOM 986 C ASP A 66 9.887 3.687 3.919 1.00 2.20 C ATOM 987 O ASP A 66 9.998 3.834 2.704 1.00 3.42 O ATOM 988 CB ASP A 66 8.593 1.683 4.581 1.00 4.91 C ATOM 989 CG ASP A 66 9.351 1.091 5.770 1.00 6.68 C ATOM 990 OD1 ASP A 66 10.530 1.470 5.937 1.00 7.36 O ATOM 991 OD2 ASP A 66 8.735 0.271 6.485 1.00 7.88 O ATOM 0 H ASP A 66 7.680 3.787 2.717 1.00 2.13 H new ATOM 0 HA ASP A 66 8.431 3.604 5.535 1.00 2.76 H new ATOM 0 HB2 ASP A 66 7.567 1.317 4.605 1.00 4.91 H new ATOM 0 HB3 ASP A 66 9.043 1.310 3.661 1.00 4.91 H new ATOM 1142 N SER A 77 11.971 1.163 -4.025 1.00 1.53 N ATOM 1143 CA SER A 77 11.876 -0.215 -4.476 1.00 1.33 C ATOM 1144 C SER A 77 13.215 -0.925 -4.274 1.00 1.25 C ATOM 1145 O SER A 77 14.236 -0.280 -4.044 1.00 1.65 O ATOM 1146 CB SER A 77 11.453 -0.285 -5.945 1.00 1.42 C ATOM 1147 OG SER A 77 11.835 -1.517 -6.551 1.00 2.06 O ATOM 0 HA SER A 77 11.113 -0.718 -3.882 1.00 1.33 H new ATOM 0 HB2 SER A 77 10.372 -0.165 -6.017 1.00 1.42 H new ATOM 0 HB3 SER A 77 11.903 0.543 -6.492 1.00 1.42 H new ATOM 0 HG SER A 77 11.270 -2.240 -6.206 1.00 2.06 H new ATOM 1153 N ILE A 78 13.168 -2.246 -4.368 1.00 1.01 N ATOM 1154 CA ILE A 78 14.352 -3.056 -4.135 1.00 1.16 C ATOM 1155 C ILE A 78 15.248 -3.010 -5.374 1.00 1.19 C ATOM 1156 O ILE A 78 16.418 -3.384 -5.314 1.00 1.44 O ATOM 1157 CB ILE A 78 13.958 -4.472 -3.714 1.00 1.28 C ATOM 1158 CG1 ILE A 78 13.485 -5.291 -4.917 1.00 1.52 C ATOM 1159 CG2 ILE A 78 12.915 -4.441 -2.595 1.00 1.67 C ATOM 1160 CD1 ILE A 78 13.407 -6.780 -4.571 1.00 1.70 C ATOM 0 H ILE A 78 12.328 -2.776 -4.602 1.00 1.01 H new ATOM 0 HA ILE A 78 14.933 -2.652 -3.306 1.00 1.16 H new ATOM 0 HB ILE A 78 14.843 -4.968 -3.316 1.00 1.28 H new ATOM 0 HG12 ILE A 78 12.506 -4.937 -5.240 1.00 1.52 H new ATOM 0 HG13 ILE A 78 14.169 -5.144 -5.753 1.00 1.52 H new ATOM 0 HG21 ILE A 78 12.652 -5.461 -2.314 1.00 1.67 H new ATOM 0 HG22 ILE A 78 13.325 -3.921 -1.730 1.00 1.67 H new ATOM 0 HG23 ILE A 78 12.023 -3.919 -2.943 1.00 1.67 H new ATOM 0 HD11 ILE A 78 13.068 -7.339 -5.443 1.00 1.70 H new ATOM 0 HD12 ILE A 78 14.393 -7.136 -4.272 1.00 1.70 H new ATOM 0 HD13 ILE A 78 12.704 -6.927 -3.751 1.00 1.70 H new ATOM 1172 N TYR A 79 14.664 -2.546 -6.470 1.00 1.07 N ATOM 1173 CA TYR A 79 15.382 -2.488 -7.733 1.00 1.16 C ATOM 1174 C TYR A 79 16.153 -1.173 -7.864 1.00 1.23 C ATOM 1175 O TYR A 79 16.920 -0.991 -8.809 1.00 1.43 O ATOM 1176 CB TYR A 79 14.315 -2.552 -8.828 1.00 1.23 C ATOM 1177 CG TYR A 79 13.764 -3.957 -9.078 1.00 1.29 C ATOM 1178 CD1 TYR A 79 12.818 -4.489 -8.225 1.00 2.42 C ATOM 1179 CD2 TYR A 79 14.211 -4.691 -10.156 1.00 2.28 C ATOM 1180 CE1 TYR A 79 12.298 -5.811 -8.461 1.00 2.61 C ATOM 1181 CE2 TYR A 79 13.691 -6.014 -10.392 1.00 2.44 C ATOM 1182 CZ TYR A 79 12.761 -6.508 -9.533 1.00 1.81 C ATOM 1183 OH TYR A 79 12.270 -7.757 -9.756 1.00 2.16 O ATOM 0 H TYR A 79 13.703 -2.207 -6.510 1.00 1.07 H new ATOM 0 HA TYR A 79 16.102 -3.303 -7.804 1.00 1.16 H new ATOM 0 HB2 TYR A 79 13.491 -1.892 -8.557 1.00 1.23 H new ATOM 0 HB3 TYR A 79 14.738 -2.168 -9.756 1.00 1.23 H new ATOM 0 HD1 TYR A 79 12.468 -3.914 -7.381 1.00 2.42 H new ATOM 0 HD2 TYR A 79 14.951 -4.274 -10.824 1.00 2.28 H new ATOM 0 HE1 TYR A 79 11.557 -6.239 -7.802 1.00 2.61 H new ATOM 0 HE2 TYR A 79 14.033 -6.600 -11.233 1.00 2.44 H new ATOM 0 HH TYR A 79 11.994 -8.157 -8.905 1.00 2.16 H new ATOM 1193 N GLY A 80 15.923 -0.291 -6.903 1.00 1.18 N ATOM 1194 CA GLY A 80 16.657 0.962 -6.848 1.00 1.30 C ATOM 1195 C GLY A 80 15.710 2.157 -6.972 1.00 1.51 C ATOM 1196 O GLY A 80 15.716 2.856 -7.984 1.00 3.06 O ATOM 0 H GLY A 80 15.239 -0.419 -6.157 1.00 1.18 H new ATOM 0 HA2 GLY A 80 17.207 1.025 -5.909 1.00 1.30 H new ATOM 0 HA3 GLY A 80 17.393 0.992 -7.651 1.00 1.30 H new ATOM 1200 N GLU A 81 14.918 2.356 -5.927 1.00 1.43 N ATOM 1201 CA GLU A 81 14.121 3.565 -5.813 1.00 1.33 C ATOM 1202 C GLU A 81 12.819 3.419 -6.603 1.00 1.20 C ATOM 1203 O GLU A 81 11.762 3.859 -6.152 1.00 1.30 O ATOM 1204 CB GLU A 81 14.911 4.790 -6.278 1.00 1.42 C ATOM 1205 CG GLU A 81 14.335 6.074 -5.677 1.00 2.33 C ATOM 1206 CD GLU A 81 15.385 7.188 -5.658 1.00 2.39 C ATOM 1207 OE1 GLU A 81 15.644 7.742 -6.747 1.00 3.18 O ATOM 1208 OE2 GLU A 81 15.904 7.460 -4.553 1.00 2.81 O ATOM 0 H GLU A 81 14.812 1.700 -5.153 1.00 1.43 H new ATOM 0 HA GLU A 81 13.871 3.714 -4.763 1.00 1.33 H new ATOM 0 HB2 GLU A 81 15.956 4.685 -5.987 1.00 1.42 H new ATOM 0 HB3 GLU A 81 14.887 4.851 -7.366 1.00 1.42 H new ATOM 0 HG2 GLU A 81 13.469 6.395 -6.256 1.00 2.33 H new ATOM 0 HG3 GLU A 81 13.986 5.881 -4.663 1.00 2.33 H new ATOM 1215 N LYS A 82 12.938 2.800 -7.769 1.00 1.14 N ATOM 1216 CA LYS A 82 11.780 2.569 -8.614 1.00 1.11 C ATOM 1217 C LYS A 82 12.033 1.341 -9.493 1.00 1.13 C ATOM 1218 O LYS A 82 13.129 0.782 -9.484 1.00 1.22 O ATOM 1219 CB LYS A 82 11.433 3.831 -9.407 1.00 1.16 C ATOM 1220 CG LYS A 82 12.683 4.432 -10.053 1.00 2.02 C ATOM 1221 CD LYS A 82 12.500 5.929 -10.311 1.00 2.13 C ATOM 1222 CE LYS A 82 13.192 6.351 -11.609 1.00 3.47 C ATOM 1223 NZ LYS A 82 12.338 6.039 -12.777 1.00 4.87 N ATOM 0 H LYS A 82 13.819 2.452 -8.148 1.00 1.14 H new ATOM 0 HA LYS A 82 10.902 2.352 -8.005 1.00 1.11 H new ATOM 0 HB2 LYS A 82 10.700 3.591 -10.178 1.00 1.16 H new ATOM 0 HB3 LYS A 82 10.972 4.565 -8.746 1.00 1.16 H new ATOM 0 HG2 LYS A 82 13.544 4.274 -9.404 1.00 2.02 H new ATOM 0 HG3 LYS A 82 12.893 3.920 -10.992 1.00 2.02 H new ATOM 0 HD2 LYS A 82 11.437 6.164 -10.368 1.00 2.13 H new ATOM 0 HD3 LYS A 82 12.908 6.498 -9.476 1.00 2.13 H new ATOM 0 HE2 LYS A 82 13.406 7.419 -11.583 1.00 3.47 H new ATOM 0 HE3 LYS A 82 14.148 5.836 -11.702 1.00 3.47 H new ATOM 0 HZ1 LYS A 82 12.934 5.923 -13.622 1.00 4.87 H new ATOM 0 HZ2 LYS A 82 11.815 5.158 -12.599 1.00 4.87 H new ATOM 0 HZ3 LYS A 82 11.665 6.816 -12.932 1.00 4.87 H new ATOM 1237 N PHE A 83 11.000 0.957 -10.229 1.00 1.16 N ATOM 1238 CA PHE A 83 11.100 -0.186 -11.119 1.00 1.35 C ATOM 1239 C PHE A 83 10.109 -0.067 -12.278 1.00 1.25 C ATOM 1240 O PHE A 83 9.279 0.842 -12.300 1.00 1.10 O ATOM 1241 CB PHE A 83 10.754 -1.427 -10.294 1.00 1.60 C ATOM 1242 CG PHE A 83 9.358 -1.991 -10.572 1.00 1.28 C ATOM 1243 CD1 PHE A 83 8.261 -1.371 -10.061 1.00 1.72 C ATOM 1244 CD2 PHE A 83 9.216 -3.110 -11.331 1.00 2.28 C ATOM 1245 CE1 PHE A 83 6.967 -1.894 -10.319 1.00 2.02 C ATOM 1246 CE2 PHE A 83 7.921 -3.633 -11.589 1.00 2.53 C ATOM 1247 CZ PHE A 83 6.823 -3.014 -11.078 1.00 1.97 C ATOM 0 H PHE A 83 10.090 1.418 -10.227 1.00 1.16 H new ATOM 0 HA PHE A 83 12.104 -0.243 -11.539 1.00 1.35 H new ATOM 0 HB2 PHE A 83 11.494 -2.202 -10.494 1.00 1.60 H new ATOM 0 HB3 PHE A 83 10.830 -1.180 -9.235 1.00 1.60 H new ATOM 0 HD1 PHE A 83 8.374 -0.481 -9.459 1.00 1.72 H new ATOM 0 HD2 PHE A 83 10.088 -3.601 -11.738 1.00 2.28 H new ATOM 0 HE1 PHE A 83 6.096 -1.402 -9.912 1.00 2.02 H new ATOM 0 HE2 PHE A 83 7.808 -4.522 -12.191 1.00 2.53 H new ATOM 0 HZ PHE A 83 5.838 -3.411 -11.274 1.00 1.97 H new ATOM 1257 N GLU A 84 10.228 -0.997 -13.215 1.00 1.52 N ATOM 1258 CA GLU A 84 9.490 -0.900 -14.463 1.00 1.56 C ATOM 1259 C GLU A 84 7.986 -1.014 -14.201 1.00 1.18 C ATOM 1260 O GLU A 84 7.562 -1.172 -13.058 1.00 0.96 O ATOM 1261 CB GLU A 84 9.956 -1.965 -15.458 1.00 1.96 C ATOM 1262 CG GLU A 84 9.476 -3.356 -15.038 1.00 3.30 C ATOM 1263 CD GLU A 84 10.538 -4.416 -15.339 1.00 3.97 C ATOM 1264 OE1 GLU A 84 11.570 -4.402 -14.635 1.00 4.47 O ATOM 1265 OE2 GLU A 84 10.291 -5.217 -16.267 1.00 4.67 O ATOM 0 H GLU A 84 10.824 -1.821 -13.135 1.00 1.52 H new ATOM 0 HA GLU A 84 9.688 0.076 -14.906 1.00 1.56 H new ATOM 0 HB2 GLU A 84 9.576 -1.730 -16.452 1.00 1.96 H new ATOM 0 HB3 GLU A 84 11.044 -1.956 -15.523 1.00 1.96 H new ATOM 0 HG2 GLU A 84 9.246 -3.359 -13.973 1.00 3.30 H new ATOM 0 HG3 GLU A 84 8.553 -3.601 -15.564 1.00 3.30 H new ATOM 1272 N ASP A 85 7.223 -0.927 -15.282 1.00 1.46 N ATOM 1273 CA ASP A 85 5.781 -1.082 -15.192 1.00 1.31 C ATOM 1274 C ASP A 85 5.373 -2.405 -15.846 1.00 1.28 C ATOM 1275 O ASP A 85 6.205 -3.290 -16.033 1.00 2.14 O ATOM 1276 CB ASP A 85 5.058 0.050 -15.924 1.00 1.61 C ATOM 1277 CG ASP A 85 3.732 0.484 -15.297 1.00 1.85 C ATOM 1278 OD1 ASP A 85 3.788 1.336 -14.384 1.00 2.23 O ATOM 1279 OD2 ASP A 85 2.692 -0.047 -15.744 1.00 3.33 O ATOM 0 H ASP A 85 7.576 -0.751 -16.223 1.00 1.46 H new ATOM 0 HA ASP A 85 5.505 -1.063 -14.138 1.00 1.31 H new ATOM 0 HB2 ASP A 85 5.721 0.914 -15.970 1.00 1.61 H new ATOM 0 HB3 ASP A 85 4.871 -0.263 -16.951 1.00 1.61 H new ATOM 1284 N GLU A 86 4.093 -2.495 -16.175 1.00 1.15 N ATOM 1285 CA GLU A 86 3.563 -3.699 -16.791 1.00 1.16 C ATOM 1286 C GLU A 86 2.402 -3.350 -17.727 1.00 1.11 C ATOM 1287 O GLU A 86 2.546 -3.407 -18.946 1.00 1.29 O ATOM 1288 CB GLU A 86 3.125 -4.710 -15.730 1.00 1.16 C ATOM 1289 CG GLU A 86 2.439 -4.011 -14.555 1.00 2.71 C ATOM 1290 CD GLU A 86 2.998 -4.506 -13.220 1.00 3.41 C ATOM 1291 OE1 GLU A 86 4.231 -4.394 -13.044 1.00 3.79 O ATOM 1292 OE2 GLU A 86 2.181 -4.984 -12.404 1.00 4.65 O ATOM 0 H GLU A 86 3.408 -1.754 -16.027 1.00 1.15 H new ATOM 0 HA GLU A 86 4.355 -4.160 -17.381 1.00 1.16 H new ATOM 0 HB2 GLU A 86 2.444 -5.436 -16.174 1.00 1.16 H new ATOM 0 HB3 GLU A 86 3.992 -5.265 -15.372 1.00 1.16 H new ATOM 0 HG2 GLU A 86 2.581 -2.933 -14.635 1.00 2.71 H new ATOM 0 HG3 GLU A 86 1.365 -4.195 -14.594 1.00 2.71 H new ATOM 1299 N ASN A 87 1.280 -2.995 -17.118 1.00 0.96 N ATOM 1300 CA ASN A 87 0.065 -2.748 -17.876 1.00 0.93 C ATOM 1301 C ASN A 87 -1.064 -2.375 -16.912 1.00 0.80 C ATOM 1302 O ASN A 87 -0.902 -2.464 -15.696 1.00 0.83 O ATOM 1303 CB ASN A 87 -0.366 -3.997 -18.648 1.00 1.03 C ATOM 1304 CG ASN A 87 -0.234 -5.251 -17.781 1.00 1.15 C ATOM 1305 OD1 ASN A 87 -1.023 -5.502 -16.885 1.00 2.19 O ATOM 1306 ND2 ASN A 87 0.804 -6.020 -18.098 1.00 1.61 N ATOM 0 H ASN A 87 1.187 -2.873 -16.110 1.00 0.96 H new ATOM 0 HA ASN A 87 0.264 -1.940 -18.580 1.00 0.93 H new ATOM 0 HB2 ASN A 87 -1.399 -3.886 -18.978 1.00 1.03 H new ATOM 0 HB3 ASN A 87 0.246 -4.104 -19.544 1.00 1.03 H new ATOM 0 HD21 ASN A 87 0.979 -6.880 -17.579 1.00 1.61 H new ATOM 0 HD22 ASN A 87 1.425 -5.749 -18.861 1.00 1.61 H new ATOM 1313 N PHE A 88 -2.182 -1.965 -17.492 1.00 0.80 N ATOM 1314 CA PHE A 88 -3.355 -1.629 -16.703 1.00 0.73 C ATOM 1315 C PHE A 88 -4.527 -2.552 -17.041 1.00 0.79 C ATOM 1316 O PHE A 88 -5.663 -2.097 -17.173 1.00 0.84 O ATOM 1317 CB PHE A 88 -3.735 -0.190 -17.057 1.00 0.77 C ATOM 1318 CG PHE A 88 -2.607 0.822 -16.848 1.00 0.75 C ATOM 1319 CD1 PHE A 88 -2.202 1.137 -15.589 1.00 1.60 C ATOM 1320 CD2 PHE A 88 -2.008 1.405 -17.922 1.00 1.84 C ATOM 1321 CE1 PHE A 88 -1.155 2.077 -15.394 1.00 1.61 C ATOM 1322 CE2 PHE A 88 -0.962 2.344 -17.727 1.00 1.88 C ATOM 1323 CZ PHE A 88 -0.556 2.660 -16.468 1.00 0.85 C ATOM 0 H PHE A 88 -2.301 -1.858 -18.499 1.00 0.80 H new ATOM 0 HA PHE A 88 -3.134 -1.742 -15.642 1.00 0.73 H new ATOM 0 HB2 PHE A 88 -4.052 -0.155 -18.099 1.00 0.77 H new ATOM 0 HB3 PHE A 88 -4.592 0.107 -16.453 1.00 0.77 H new ATOM 0 HD1 PHE A 88 -2.676 0.673 -14.737 1.00 1.60 H new ATOM 0 HD2 PHE A 88 -2.329 1.153 -18.922 1.00 1.84 H new ATOM 0 HE1 PHE A 88 -0.834 2.329 -14.394 1.00 1.61 H new ATOM 0 HE2 PHE A 88 -0.488 2.808 -18.579 1.00 1.88 H new ATOM 0 HZ PHE A 88 0.241 3.373 -16.321 1.00 0.85 H new ATOM 1333 N ILE A 89 -4.211 -3.832 -17.174 1.00 0.84 N ATOM 1334 CA ILE A 89 -5.230 -4.829 -17.456 1.00 0.91 C ATOM 1335 C ILE A 89 -6.260 -4.834 -16.325 1.00 0.85 C ATOM 1336 O ILE A 89 -7.461 -4.915 -16.575 1.00 1.01 O ATOM 1337 CB ILE A 89 -4.588 -6.194 -17.710 1.00 1.01 C ATOM 1338 CG1 ILE A 89 -3.950 -6.250 -19.099 1.00 1.19 C ATOM 1339 CG2 ILE A 89 -5.600 -7.323 -17.498 1.00 1.04 C ATOM 1340 CD1 ILE A 89 -2.921 -7.380 -19.185 1.00 1.26 C ATOM 0 H ILE A 89 -3.264 -4.202 -17.092 1.00 0.84 H new ATOM 0 HA ILE A 89 -5.765 -4.579 -18.372 1.00 0.91 H new ATOM 0 HB ILE A 89 -3.789 -6.336 -16.983 1.00 1.01 H new ATOM 0 HG12 ILE A 89 -4.723 -6.399 -19.853 1.00 1.19 H new ATOM 0 HG13 ILE A 89 -3.469 -5.297 -19.321 1.00 1.19 H new ATOM 0 HG21 ILE A 89 -5.119 -8.283 -17.685 1.00 1.04 H new ATOM 0 HG22 ILE A 89 -5.967 -7.295 -16.472 1.00 1.04 H new ATOM 0 HG23 ILE A 89 -6.436 -7.196 -18.186 1.00 1.04 H new ATOM 0 HD11 ILE A 89 -2.483 -7.398 -20.183 1.00 1.26 H new ATOM 0 HD12 ILE A 89 -2.136 -7.215 -18.447 1.00 1.26 H new ATOM 0 HD13 ILE A 89 -3.410 -8.334 -18.987 1.00 1.26 H new ATOM 1352 N LEU A 90 -5.752 -4.747 -15.105 1.00 0.67 N ATOM 1353 CA LEU A 90 -6.615 -4.664 -13.938 1.00 0.63 C ATOM 1354 C LEU A 90 -7.171 -3.243 -13.821 1.00 0.63 C ATOM 1355 O LEU A 90 -6.626 -2.309 -14.405 1.00 0.77 O ATOM 1356 CB LEU A 90 -5.872 -5.139 -12.687 1.00 0.60 C ATOM 1357 CG LEU A 90 -5.467 -6.615 -12.669 1.00 0.86 C ATOM 1358 CD1 LEU A 90 -4.050 -6.800 -13.216 1.00 1.40 C ATOM 1359 CD2 LEU A 90 -5.621 -7.207 -11.266 1.00 2.25 C ATOM 0 H LEU A 90 -4.753 -4.732 -14.899 1.00 0.67 H new ATOM 0 HA LEU A 90 -7.469 -5.333 -14.047 1.00 0.63 H new ATOM 0 HB2 LEU A 90 -4.973 -4.534 -12.571 1.00 0.60 H new ATOM 0 HB3 LEU A 90 -6.501 -4.944 -11.819 1.00 0.60 H new ATOM 0 HG LEU A 90 -6.141 -7.164 -13.327 1.00 0.86 H new ATOM 0 HD11 LEU A 90 -3.786 -7.857 -13.193 1.00 1.40 H new ATOM 0 HD12 LEU A 90 -4.006 -6.438 -14.243 1.00 1.40 H new ATOM 0 HD13 LEU A 90 -3.347 -6.237 -12.602 1.00 1.40 H new ATOM 0 HD21 LEU A 90 -5.327 -8.257 -11.280 1.00 2.25 H new ATOM 0 HD22 LEU A 90 -4.985 -6.661 -10.569 1.00 2.25 H new ATOM 0 HD23 LEU A 90 -6.661 -7.126 -10.949 1.00 2.25 H new ATOM 1371 N LYS A 91 -8.250 -3.126 -13.060 1.00 0.63 N ATOM 1372 CA LYS A 91 -8.941 -1.855 -12.934 1.00 0.69 C ATOM 1373 C LYS A 91 -9.257 -1.594 -11.460 1.00 0.64 C ATOM 1374 O LYS A 91 -8.933 -2.410 -10.599 1.00 0.57 O ATOM 1375 CB LYS A 91 -10.173 -1.823 -13.842 1.00 0.87 C ATOM 1376 CG LYS A 91 -9.797 -1.398 -15.262 1.00 1.44 C ATOM 1377 CD LYS A 91 -11.042 -1.258 -16.141 1.00 1.52 C ATOM 1378 CE LYS A 91 -11.888 -0.060 -15.706 1.00 2.45 C ATOM 1379 NZ LYS A 91 -11.805 1.025 -16.710 1.00 3.71 N ATOM 0 H LYS A 91 -8.662 -3.891 -12.525 1.00 0.63 H new ATOM 0 HA LYS A 91 -8.302 -1.039 -13.272 1.00 0.69 H new ATOM 0 HB2 LYS A 91 -10.638 -2.809 -13.865 1.00 0.87 H new ATOM 0 HB3 LYS A 91 -10.911 -1.132 -13.435 1.00 0.87 H new ATOM 0 HG2 LYS A 91 -9.261 -0.450 -15.231 1.00 1.44 H new ATOM 0 HG3 LYS A 91 -9.120 -2.133 -15.698 1.00 1.44 H new ATOM 0 HD2 LYS A 91 -10.744 -1.139 -17.183 1.00 1.52 H new ATOM 0 HD3 LYS A 91 -11.638 -2.169 -16.082 1.00 1.52 H new ATOM 0 HE2 LYS A 91 -12.926 -0.367 -15.579 1.00 2.45 H new ATOM 0 HE3 LYS A 91 -11.543 0.304 -14.739 1.00 2.45 H new ATOM 0 HZ1 LYS A 91 -12.663 1.610 -16.661 1.00 3.71 H new ATOM 0 HZ2 LYS A 91 -10.972 1.616 -16.515 1.00 3.71 H new ATOM 0 HZ3 LYS A 91 -11.721 0.612 -17.661 1.00 3.71 H new ATOM 1393 N HIS A 92 -9.884 -0.453 -11.216 1.00 0.73 N ATOM 1394 CA HIS A 92 -10.306 -0.105 -9.868 1.00 0.70 C ATOM 1395 C HIS A 92 -11.796 -0.412 -9.703 1.00 0.72 C ATOM 1396 O HIS A 92 -12.641 0.454 -9.924 1.00 0.80 O ATOM 1397 CB HIS A 92 -9.962 1.351 -9.551 1.00 0.72 C ATOM 1398 CG HIS A 92 -8.480 1.636 -9.508 1.00 0.79 C ATOM 1399 ND1 HIS A 92 -7.631 1.355 -10.564 1.00 1.31 N ATOM 1400 CD2 HIS A 92 -7.705 2.182 -8.526 1.00 2.16 C ATOM 1401 CE1 HIS A 92 -6.404 1.717 -10.222 1.00 0.97 C ATOM 1402 NE2 HIS A 92 -6.451 2.229 -8.959 1.00 1.65 N ATOM 0 H HIS A 92 -10.110 0.242 -11.927 1.00 0.73 H new ATOM 0 HA HIS A 92 -9.763 -0.712 -9.144 1.00 0.70 H new ATOM 0 HB2 HIS A 92 -10.424 1.994 -10.300 1.00 0.72 H new ATOM 0 HB3 HIS A 92 -10.401 1.616 -8.589 1.00 0.72 H new ATOM 0 HD2 HIS A 92 -8.053 2.519 -7.561 1.00 2.16 H new ATOM 0 HE1 HIS A 92 -5.521 1.623 -10.836 1.00 0.97 H new ATOM 0 HE2 HIS A 92 -5.654 2.589 -8.434 1.00 1.65 H new ATOM 1410 N THR A 93 -12.073 -1.648 -9.315 1.00 0.67 N ATOM 1411 CA THR A 93 -13.448 -2.103 -9.189 1.00 0.71 C ATOM 1412 C THR A 93 -14.145 -1.377 -8.038 1.00 0.67 C ATOM 1413 O THR A 93 -15.298 -0.966 -8.165 1.00 0.85 O ATOM 1414 CB THR A 93 -13.429 -3.624 -9.026 1.00 0.74 C ATOM 1415 OG1 THR A 93 -12.350 -3.864 -8.127 1.00 0.72 O ATOM 1416 CG2 THR A 93 -13.011 -4.346 -10.309 1.00 0.87 C ATOM 0 H THR A 93 -11.369 -2.349 -9.084 1.00 0.67 H new ATOM 0 HA THR A 93 -14.028 -1.865 -10.081 1.00 0.71 H new ATOM 0 HB THR A 93 -14.417 -3.968 -8.721 1.00 0.74 H new ATOM 0 HG1 THR A 93 -12.268 -4.827 -7.964 1.00 0.72 H new ATOM 0 HG21 THR A 93 -13.014 -5.423 -10.138 1.00 0.87 H new ATOM 0 HG22 THR A 93 -13.712 -4.103 -11.108 1.00 0.87 H new ATOM 0 HG23 THR A 93 -12.009 -4.027 -10.596 1.00 0.87 H new ATOM 1424 N GLY A 94 -13.418 -1.240 -6.938 1.00 0.53 N ATOM 1425 CA GLY A 94 -13.968 -0.607 -5.752 1.00 0.52 C ATOM 1426 C GLY A 94 -12.994 -0.708 -4.576 1.00 0.50 C ATOM 1427 O GLY A 94 -11.780 -0.642 -4.763 1.00 0.47 O ATOM 0 H GLY A 94 -12.453 -1.557 -6.844 1.00 0.53 H new ATOM 0 HA2 GLY A 94 -14.184 0.441 -5.961 1.00 0.52 H new ATOM 0 HA3 GLY A 94 -14.913 -1.081 -5.488 1.00 0.52 H new ATOM 1431 N PRO A 95 -13.578 -0.872 -3.358 1.00 0.56 N ATOM 1432 CA PRO A 95 -12.780 -0.918 -2.145 1.00 0.62 C ATOM 1433 C PRO A 95 -12.054 -2.259 -2.017 1.00 0.67 C ATOM 1434 O PRO A 95 -12.542 -3.283 -2.494 1.00 0.72 O ATOM 1435 CB PRO A 95 -13.764 -0.666 -1.016 1.00 0.69 C ATOM 1436 CG PRO A 95 -15.142 -0.950 -1.593 1.00 0.70 C ATOM 1437 CD PRO A 95 -15.008 -1.019 -3.106 1.00 0.62 C ATOM 0 HA PRO A 95 -11.985 -0.172 -2.136 1.00 0.62 H new ATOM 0 HB2 PRO A 95 -13.556 -1.314 -0.165 1.00 0.69 H new ATOM 0 HB3 PRO A 95 -13.694 0.362 -0.659 1.00 0.69 H new ATOM 0 HG2 PRO A 95 -15.534 -1.889 -1.201 1.00 0.70 H new ATOM 0 HG3 PRO A 95 -15.844 -0.167 -1.307 1.00 0.70 H new ATOM 0 HD2 PRO A 95 -15.383 -1.966 -3.494 1.00 0.62 H new ATOM 0 HD3 PRO A 95 -15.579 -0.227 -3.591 1.00 0.62 H new ATOM 1445 N GLY A 96 -10.899 -2.211 -1.370 1.00 0.72 N ATOM 1446 CA GLY A 96 -10.114 -3.414 -1.149 1.00 0.79 C ATOM 1447 C GLY A 96 -8.969 -3.515 -2.158 1.00 1.05 C ATOM 1448 O GLY A 96 -7.956 -4.159 -1.890 1.00 2.09 O ATOM 0 H GLY A 96 -10.488 -1.358 -0.992 1.00 0.72 H new ATOM 0 HA2 GLY A 96 -9.711 -3.409 -0.136 1.00 0.79 H new ATOM 0 HA3 GLY A 96 -10.755 -4.291 -1.232 1.00 0.79 H new ATOM 1452 N ILE A 97 -9.168 -2.868 -3.297 1.00 0.54 N ATOM 1453 CA ILE A 97 -8.187 -2.920 -4.368 1.00 0.55 C ATOM 1454 C ILE A 97 -6.883 -2.279 -3.891 1.00 0.54 C ATOM 1455 O ILE A 97 -6.904 -1.290 -3.160 1.00 0.54 O ATOM 1456 CB ILE A 97 -8.752 -2.290 -5.642 1.00 0.61 C ATOM 1457 CG1 ILE A 97 -9.843 -3.171 -6.253 1.00 0.87 C ATOM 1458 CG2 ILE A 97 -7.636 -1.983 -6.644 1.00 0.67 C ATOM 1459 CD1 ILE A 97 -9.233 -4.312 -7.070 1.00 0.94 C ATOM 0 H ILE A 97 -9.994 -2.305 -3.502 1.00 0.54 H new ATOM 0 HA ILE A 97 -7.958 -3.954 -4.626 1.00 0.55 H new ATOM 0 HB ILE A 97 -9.216 -1.341 -5.376 1.00 0.61 H new ATOM 0 HG12 ILE A 97 -10.470 -3.581 -5.461 1.00 0.87 H new ATOM 0 HG13 ILE A 97 -10.488 -2.567 -6.891 1.00 0.87 H new ATOM 0 HG21 ILE A 97 -8.065 -1.536 -7.541 1.00 0.67 H new ATOM 0 HG22 ILE A 97 -6.926 -1.288 -6.196 1.00 0.67 H new ATOM 0 HG23 ILE A 97 -7.121 -2.906 -6.910 1.00 0.67 H new ATOM 0 HD11 ILE A 97 -10.030 -4.923 -7.493 1.00 0.94 H new ATOM 0 HD12 ILE A 97 -8.626 -3.899 -7.875 1.00 0.94 H new ATOM 0 HD13 ILE A 97 -8.608 -4.928 -6.424 1.00 0.94 H new ATOM 1471 N LEU A 98 -5.778 -2.869 -4.324 1.00 0.77 N ATOM 1472 CA LEU A 98 -4.468 -2.311 -4.030 1.00 0.89 C ATOM 1473 C LEU A 98 -3.805 -1.864 -5.335 1.00 0.78 C ATOM 1474 O LEU A 98 -3.498 -2.689 -6.194 1.00 0.68 O ATOM 1475 CB LEU A 98 -3.630 -3.306 -3.225 1.00 1.01 C ATOM 1476 CG LEU A 98 -2.257 -2.809 -2.765 1.00 1.29 C ATOM 1477 CD1 LEU A 98 -1.942 -3.301 -1.351 1.00 1.00 C ATOM 1478 CD2 LEU A 98 -1.169 -3.204 -3.766 1.00 2.25 C ATOM 0 H LEU A 98 -5.763 -3.727 -4.876 1.00 0.77 H new ATOM 0 HA LEU A 98 -4.563 -1.427 -3.400 1.00 0.89 H new ATOM 0 HB2 LEU A 98 -4.201 -3.603 -2.345 1.00 1.01 H new ATOM 0 HB3 LEU A 98 -3.486 -4.202 -3.829 1.00 1.01 H new ATOM 0 HG LEU A 98 -2.281 -1.720 -2.728 1.00 1.29 H new ATOM 0 HD11 LEU A 98 -0.961 -2.934 -1.048 1.00 1.00 H new ATOM 0 HD12 LEU A 98 -2.698 -2.929 -0.659 1.00 1.00 H new ATOM 0 HD13 LEU A 98 -1.942 -4.391 -1.337 1.00 1.00 H new ATOM 0 HD21 LEU A 98 -0.203 -2.839 -3.416 1.00 2.25 H new ATOM 0 HD22 LEU A 98 -1.136 -4.290 -3.857 1.00 2.25 H new ATOM 0 HD23 LEU A 98 -1.392 -2.765 -4.738 1.00 2.25 H new ATOM 1490 N SER A 99 -3.606 -0.558 -5.442 1.00 0.95 N ATOM 1491 CA SER A 99 -3.000 0.010 -6.635 1.00 0.95 C ATOM 1492 C SER A 99 -1.589 0.510 -6.317 1.00 0.96 C ATOM 1493 O SER A 99 -1.175 0.514 -5.158 1.00 1.00 O ATOM 1494 CB SER A 99 -3.852 1.151 -7.196 1.00 1.12 C ATOM 1495 OG SER A 99 -3.484 2.413 -6.646 1.00 1.98 O ATOM 0 H SER A 99 -3.853 0.122 -4.723 1.00 0.95 H new ATOM 0 HA SER A 99 -2.941 -0.771 -7.393 1.00 0.95 H new ATOM 0 HB2 SER A 99 -3.746 1.183 -8.280 1.00 1.12 H new ATOM 0 HB3 SER A 99 -4.903 0.956 -6.984 1.00 1.12 H new ATOM 0 HG SER A 99 -4.241 2.786 -6.147 1.00 1.98 H new ATOM 1501 N MET A 100 -0.890 0.918 -7.365 1.00 1.01 N ATOM 1502 CA MET A 100 0.462 1.429 -7.211 1.00 1.05 C ATOM 1503 C MET A 100 0.553 2.884 -7.674 1.00 1.20 C ATOM 1504 O MET A 100 0.145 3.212 -8.787 1.00 1.69 O ATOM 1505 CB MET A 100 1.429 0.571 -8.028 1.00 1.10 C ATOM 1506 CG MET A 100 1.684 -0.773 -7.343 1.00 1.34 C ATOM 1507 SD MET A 100 3.061 -0.632 -6.216 1.00 1.89 S ATOM 1508 CE MET A 100 4.387 -1.181 -7.278 1.00 1.44 C ATOM 0 H MET A 100 -1.234 0.905 -8.325 1.00 1.01 H new ATOM 0 HA MET A 100 0.729 1.386 -6.155 1.00 1.05 H new ATOM 0 HB2 MET A 100 1.019 0.403 -9.024 1.00 1.10 H new ATOM 0 HB3 MET A 100 2.372 1.102 -8.157 1.00 1.10 H new ATOM 0 HG2 MET A 100 0.792 -1.090 -6.803 1.00 1.34 H new ATOM 0 HG3 MET A 100 1.892 -1.538 -8.091 1.00 1.34 H new ATOM 0 HE1 MET A 100 5.295 -0.625 -7.044 1.00 1.44 H new ATOM 0 HE2 MET A 100 4.563 -2.245 -7.120 1.00 1.44 H new ATOM 0 HE3 MET A 100 4.114 -1.009 -8.319 1.00 1.44 H new ATOM 1518 N ALA A 101 1.092 3.719 -6.797 1.00 0.94 N ATOM 1519 CA ALA A 101 1.302 5.118 -7.126 1.00 1.08 C ATOM 1520 C ALA A 101 2.537 5.247 -8.020 1.00 1.23 C ATOM 1521 O ALA A 101 3.484 4.473 -7.890 1.00 1.74 O ATOM 1522 CB ALA A 101 1.427 5.932 -5.838 1.00 1.17 C ATOM 0 H ALA A 101 1.390 3.453 -5.858 1.00 0.94 H new ATOM 0 HA ALA A 101 0.451 5.514 -7.680 1.00 1.08 H new ATOM 0 HB1 ALA A 101 1.585 6.982 -6.085 1.00 1.17 H new ATOM 0 HB2 ALA A 101 0.513 5.830 -5.253 1.00 1.17 H new ATOM 0 HB3 ALA A 101 2.273 5.565 -5.256 1.00 1.17 H new ATOM 1528 N ASN A 102 2.486 6.230 -8.907 1.00 1.44 N ATOM 1529 CA ASN A 102 3.561 6.430 -9.864 1.00 1.59 C ATOM 1530 C ASN A 102 3.531 7.876 -10.361 1.00 1.65 C ATOM 1531 O ASN A 102 2.463 8.474 -10.480 1.00 1.62 O ATOM 1532 CB ASN A 102 3.398 5.510 -11.075 1.00 1.65 C ATOM 1533 CG ASN A 102 1.926 5.380 -11.472 1.00 2.20 C ATOM 1534 OD1 ASN A 102 1.103 6.236 -11.191 1.00 2.95 O ATOM 1535 ND2 ASN A 102 1.642 4.266 -12.138 1.00 2.84 N ATOM 0 H ASN A 102 1.717 6.896 -8.983 1.00 1.44 H new ATOM 0 HA ASN A 102 4.504 6.205 -9.365 1.00 1.59 H new ATOM 0 HB2 ASN A 102 3.971 5.903 -11.915 1.00 1.65 H new ATOM 0 HB3 ASN A 102 3.804 4.525 -10.845 1.00 1.65 H new ATOM 0 HD21 ASN A 102 0.687 4.086 -12.447 1.00 2.84 H new ATOM 0 HD22 ASN A 102 2.379 3.591 -12.340 1.00 2.84 H new ATOM 1542 N ALA A 103 4.717 8.397 -10.641 1.00 1.81 N ATOM 1543 CA ALA A 103 4.841 9.764 -11.116 1.00 1.94 C ATOM 1544 C ALA A 103 5.143 9.753 -12.615 1.00 2.01 C ATOM 1545 O ALA A 103 5.628 10.742 -13.162 1.00 2.22 O ATOM 1546 CB ALA A 103 5.921 10.489 -10.309 1.00 2.15 C ATOM 0 H ALA A 103 5.601 7.896 -10.548 1.00 1.81 H new ATOM 0 HA ALA A 103 3.907 10.306 -10.972 1.00 1.94 H new ATOM 0 HB1 ALA A 103 6.014 11.515 -10.665 1.00 2.15 H new ATOM 0 HB2 ALA A 103 5.645 10.495 -9.255 1.00 2.15 H new ATOM 0 HB3 ALA A 103 6.874 9.974 -10.432 1.00 2.15 H new ATOM 1552 N GLY A 104 4.843 8.623 -13.238 1.00 1.93 N ATOM 1553 CA GLY A 104 5.172 8.432 -14.641 1.00 2.05 C ATOM 1554 C GLY A 104 5.522 6.970 -14.927 1.00 1.93 C ATOM 1555 O GLY A 104 5.254 6.091 -14.108 1.00 1.79 O ATOM 0 H GLY A 104 4.376 7.830 -12.798 1.00 1.93 H new ATOM 0 HA2 GLY A 104 4.328 8.736 -15.261 1.00 2.05 H new ATOM 0 HA3 GLY A 104 6.013 9.071 -14.911 1.00 2.05 H new ATOM 1559 N PRO A 105 6.134 6.748 -16.121 1.00 2.06 N ATOM 1560 CA PRO A 105 6.518 5.407 -16.529 1.00 2.05 C ATOM 1561 C PRO A 105 7.758 4.936 -15.767 1.00 1.81 C ATOM 1562 O PRO A 105 8.795 5.597 -15.793 1.00 1.89 O ATOM 1563 CB PRO A 105 6.742 5.501 -18.029 1.00 2.36 C ATOM 1564 CG PRO A 105 6.931 6.979 -18.330 1.00 2.46 C ATOM 1565 CD PRO A 105 6.477 7.765 -17.111 1.00 2.28 C ATOM 0 HA PRO A 105 5.755 4.663 -16.300 1.00 2.05 H new ATOM 0 HB2 PRO A 105 7.618 4.926 -18.330 1.00 2.36 H new ATOM 0 HB3 PRO A 105 5.891 5.096 -18.577 1.00 2.36 H new ATOM 0 HG2 PRO A 105 7.976 7.192 -18.554 1.00 2.46 H new ATOM 0 HG3 PRO A 105 6.352 7.267 -19.207 1.00 2.46 H new ATOM 0 HD2 PRO A 105 7.267 8.422 -16.747 1.00 2.28 H new ATOM 0 HD3 PRO A 105 5.619 8.396 -17.344 1.00 2.28 H new ATOM 1573 N ASN A 106 7.610 3.797 -15.106 1.00 1.60 N ATOM 1574 CA ASN A 106 8.736 3.168 -14.437 1.00 1.51 C ATOM 1575 C ASN A 106 9.194 4.054 -13.277 1.00 1.31 C ATOM 1576 O ASN A 106 10.391 4.243 -13.071 1.00 1.30 O ATOM 1577 CB ASN A 106 9.918 2.994 -15.394 1.00 1.71 C ATOM 1578 CG ASN A 106 9.436 2.650 -16.805 1.00 2.43 C ATOM 1579 OD1 ASN A 106 9.840 3.245 -17.789 1.00 3.37 O ATOM 1580 ND2 ASN A 106 8.550 1.658 -16.846 1.00 3.54 N ATOM 0 H ASN A 106 6.727 3.294 -15.020 1.00 1.60 H new ATOM 0 HA ASN A 106 8.413 2.190 -14.081 1.00 1.51 H new ATOM 0 HB2 ASN A 106 10.507 3.911 -15.421 1.00 1.71 H new ATOM 0 HB3 ASN A 106 10.574 2.204 -15.027 1.00 1.71 H new ATOM 0 HD21 ASN A 106 8.167 1.353 -17.741 1.00 3.54 H new ATOM 0 HD22 ASN A 106 8.254 1.202 -15.983 1.00 3.54 H new ATOM 1587 N THR A 107 8.215 4.573 -12.550 1.00 1.28 N ATOM 1588 CA THR A 107 8.503 5.369 -11.368 1.00 1.21 C ATOM 1589 C THR A 107 7.912 4.706 -10.122 1.00 1.24 C ATOM 1590 O THR A 107 8.084 5.203 -9.010 1.00 1.64 O ATOM 1591 CB THR A 107 7.974 6.784 -11.613 1.00 1.31 C ATOM 1592 OG1 THR A 107 6.557 6.640 -11.555 1.00 2.66 O ATOM 1593 CG2 THR A 107 8.242 7.271 -13.037 1.00 2.69 C ATOM 0 H THR A 107 7.223 4.458 -12.756 1.00 1.28 H new ATOM 0 HA THR A 107 9.576 5.434 -11.185 1.00 1.21 H new ATOM 0 HB THR A 107 8.434 7.471 -10.903 1.00 1.31 H new ATOM 0 HG1 THR A 107 6.215 6.413 -12.445 1.00 2.66 H new ATOM 0 HG21 THR A 107 7.847 8.280 -13.157 1.00 2.69 H new ATOM 0 HG22 THR A 107 9.316 7.278 -13.223 1.00 2.69 H new ATOM 0 HG23 THR A 107 7.755 6.603 -13.748 1.00 2.69 H new ATOM 1601 N ASN A 108 7.228 3.595 -10.349 1.00 1.31 N ATOM 1602 CA ASN A 108 6.628 2.848 -9.257 1.00 1.41 C ATOM 1603 C ASN A 108 7.704 2.513 -8.223 1.00 1.23 C ATOM 1604 O ASN A 108 8.653 1.789 -8.523 1.00 1.45 O ATOM 1605 CB ASN A 108 6.024 1.534 -9.755 1.00 1.80 C ATOM 1606 CG ASN A 108 4.850 1.794 -10.701 1.00 2.67 C ATOM 1607 OD1 ASN A 108 3.759 2.157 -10.294 1.00 3.39 O ATOM 1608 ND2 ASN A 108 5.135 1.589 -11.984 1.00 3.80 N ATOM 0 H ASN A 108 7.076 3.193 -11.274 1.00 1.31 H new ATOM 0 HA ASN A 108 5.841 3.463 -8.820 1.00 1.41 H new ATOM 0 HB2 ASN A 108 6.788 0.950 -10.269 1.00 1.80 H new ATOM 0 HB3 ASN A 108 5.687 0.940 -8.906 1.00 1.80 H new ATOM 0 HD21 ASN A 108 4.419 1.736 -12.695 1.00 3.80 H new ATOM 0 HD22 ASN A 108 6.070 1.285 -12.257 1.00 3.80 H new ATOM 1615 N GLY A 109 7.522 3.054 -7.028 1.00 1.31 N ATOM 1616 CA GLY A 109 8.495 2.866 -5.965 1.00 1.58 C ATOM 1617 C GLY A 109 7.881 2.103 -4.789 1.00 1.40 C ATOM 1618 O GLY A 109 8.183 2.390 -3.632 1.00 2.66 O ATOM 0 H GLY A 109 6.715 3.623 -6.772 1.00 1.31 H new ATOM 0 HA2 GLY A 109 9.356 2.319 -6.348 1.00 1.58 H new ATOM 0 HA3 GLY A 109 8.859 3.835 -5.624 1.00 1.58 H new ATOM 1622 N SER A 110 7.031 1.143 -5.127 1.00 1.52 N ATOM 1623 CA SER A 110 6.458 0.265 -4.122 1.00 1.68 C ATOM 1624 C SER A 110 5.636 1.079 -3.121 1.00 1.35 C ATOM 1625 O SER A 110 5.491 0.684 -1.966 1.00 1.98 O ATOM 1626 CB SER A 110 7.547 -0.527 -3.395 1.00 2.26 C ATOM 1627 OG SER A 110 8.422 -1.190 -4.305 1.00 3.74 O ATOM 0 H SER A 110 6.726 0.955 -6.082 1.00 1.52 H new ATOM 0 HA SER A 110 5.804 -0.447 -4.625 1.00 1.68 H new ATOM 0 HB2 SER A 110 8.125 0.147 -2.762 1.00 2.26 H new ATOM 0 HB3 SER A 110 7.083 -1.262 -2.737 1.00 2.26 H new ATOM 0 HG SER A 110 9.104 -1.683 -3.803 1.00 3.74 H new ATOM 1633 N GLN A 111 5.120 2.201 -3.601 1.00 1.60 N ATOM 1634 CA GLN A 111 4.207 3.004 -2.808 1.00 1.55 C ATOM 1635 C GLN A 111 2.759 2.588 -3.082 1.00 1.39 C ATOM 1636 O GLN A 111 2.021 3.303 -3.758 1.00 2.08 O ATOM 1637 CB GLN A 111 4.408 4.496 -3.080 1.00 1.80 C ATOM 1638 CG GLN A 111 5.872 4.896 -2.881 1.00 2.44 C ATOM 1639 CD GLN A 111 6.567 5.117 -4.226 1.00 3.74 C ATOM 1640 OE1 GLN A 111 6.163 4.601 -5.256 1.00 4.67 O ATOM 1641 NE2 GLN A 111 7.633 5.910 -4.161 1.00 4.53 N ATOM 0 H GLN A 111 5.318 2.573 -4.530 1.00 1.60 H new ATOM 0 HA GLN A 111 4.423 2.828 -1.754 1.00 1.55 H new ATOM 0 HB2 GLN A 111 4.099 4.729 -4.099 1.00 1.80 H new ATOM 0 HB3 GLN A 111 3.774 5.080 -2.413 1.00 1.80 H new ATOM 0 HG2 GLN A 111 5.926 5.807 -2.285 1.00 2.44 H new ATOM 0 HG3 GLN A 111 6.393 4.118 -2.322 1.00 2.44 H new ATOM 0 HE21 GLN A 111 7.918 6.310 -3.267 1.00 4.53 H new ATOM 0 HE22 GLN A 111 8.166 6.118 -5.005 1.00 4.53 H new ATOM 1650 N PHE A 112 2.398 1.434 -2.543 1.00 1.19 N ATOM 1651 CA PHE A 112 1.079 0.874 -2.789 1.00 1.04 C ATOM 1652 C PHE A 112 -0.017 1.795 -2.251 1.00 1.11 C ATOM 1653 O PHE A 112 0.266 2.737 -1.514 1.00 1.45 O ATOM 1654 CB PHE A 112 1.015 -0.464 -2.047 1.00 0.96 C ATOM 1655 CG PHE A 112 1.405 -0.375 -0.571 1.00 1.24 C ATOM 1656 CD1 PHE A 112 0.491 0.032 0.351 1.00 2.37 C ATOM 1657 CD2 PHE A 112 2.665 -0.703 -0.179 1.00 1.93 C ATOM 1658 CE1 PHE A 112 0.853 0.115 1.721 1.00 3.03 C ATOM 1659 CE2 PHE A 112 3.027 -0.621 1.192 1.00 2.36 C ATOM 1660 CZ PHE A 112 2.113 -0.213 2.113 1.00 2.61 C ATOM 0 H PHE A 112 2.995 0.871 -1.937 1.00 1.19 H new ATOM 0 HA PHE A 112 0.920 0.753 -3.861 1.00 1.04 H new ATOM 0 HB2 PHE A 112 0.003 -0.861 -2.122 1.00 0.96 H new ATOM 0 HB3 PHE A 112 1.674 -1.176 -2.544 1.00 0.96 H new ATOM 0 HD1 PHE A 112 -0.510 0.292 0.040 1.00 2.37 H new ATOM 0 HD2 PHE A 112 3.391 -1.026 -0.910 1.00 1.93 H new ATOM 0 HE1 PHE A 112 0.127 0.439 2.452 1.00 3.03 H new ATOM 0 HE2 PHE A 112 4.028 -0.883 1.503 1.00 2.36 H new ATOM 0 HZ PHE A 112 2.388 -0.150 3.155 1.00 2.61 H new ATOM 1670 N PHE A 113 -1.246 1.489 -2.640 1.00 1.02 N ATOM 1671 CA PHE A 113 -2.368 2.356 -2.323 1.00 1.25 C ATOM 1672 C PHE A 113 -3.663 1.551 -2.192 1.00 1.06 C ATOM 1673 O PHE A 113 -4.160 1.002 -3.173 1.00 1.63 O ATOM 1674 CB PHE A 113 -2.513 3.343 -3.484 1.00 1.76 C ATOM 1675 CG PHE A 113 -3.865 4.058 -3.529 1.00 2.33 C ATOM 1676 CD1 PHE A 113 -4.901 3.509 -4.218 1.00 3.87 C ATOM 1677 CD2 PHE A 113 -4.030 5.242 -2.881 1.00 2.83 C ATOM 1678 CE1 PHE A 113 -6.156 4.172 -4.261 1.00 5.22 C ATOM 1679 CE2 PHE A 113 -5.285 5.905 -2.923 1.00 4.47 C ATOM 1680 CZ PHE A 113 -6.321 5.356 -3.612 1.00 5.40 C ATOM 0 H PHE A 113 -1.489 0.653 -3.172 1.00 1.02 H new ATOM 0 HA PHE A 113 -2.189 2.864 -1.376 1.00 1.25 H new ATOM 0 HB2 PHE A 113 -1.721 4.089 -3.414 1.00 1.76 H new ATOM 0 HB3 PHE A 113 -2.365 2.808 -4.422 1.00 1.76 H new ATOM 0 HD1 PHE A 113 -4.769 2.569 -4.733 1.00 3.87 H new ATOM 0 HD2 PHE A 113 -3.207 5.678 -2.335 1.00 2.83 H new ATOM 0 HE1 PHE A 113 -6.979 3.737 -4.809 1.00 5.22 H new ATOM 0 HE2 PHE A 113 -5.417 6.845 -2.408 1.00 4.47 H new ATOM 0 HZ PHE A 113 -7.275 5.860 -3.644 1.00 5.40 H new ATOM 1690 N ILE A 114 -4.172 1.507 -0.969 1.00 0.86 N ATOM 1691 CA ILE A 114 -5.398 0.776 -0.696 1.00 0.75 C ATOM 1692 C ILE A 114 -6.600 1.649 -1.058 1.00 0.74 C ATOM 1693 O ILE A 114 -6.585 2.858 -0.829 1.00 1.38 O ATOM 1694 CB ILE A 114 -5.413 0.279 0.752 1.00 0.97 C ATOM 1695 CG1 ILE A 114 -4.174 -0.566 1.054 1.00 1.04 C ATOM 1696 CG2 ILE A 114 -6.709 -0.474 1.059 1.00 1.13 C ATOM 1697 CD1 ILE A 114 -3.833 -0.525 2.546 1.00 1.15 C ATOM 0 H ILE A 114 -3.758 1.965 -0.157 1.00 0.86 H new ATOM 0 HA ILE A 114 -5.455 -0.118 -1.318 1.00 0.75 H new ATOM 0 HB ILE A 114 -5.380 1.146 1.412 1.00 0.97 H new ATOM 0 HG12 ILE A 114 -4.348 -1.597 0.745 1.00 1.04 H new ATOM 0 HG13 ILE A 114 -3.328 -0.198 0.474 1.00 1.04 H new ATOM 0 HG21 ILE A 114 -6.694 -0.817 2.094 1.00 1.13 H new ATOM 0 HG22 ILE A 114 -7.560 0.190 0.909 1.00 1.13 H new ATOM 0 HG23 ILE A 114 -6.797 -1.333 0.394 1.00 1.13 H new ATOM 0 HD11 ILE A 114 -2.948 -1.134 2.734 1.00 1.15 H new ATOM 0 HD12 ILE A 114 -3.636 0.504 2.846 1.00 1.15 H new ATOM 0 HD13 ILE A 114 -4.672 -0.916 3.122 1.00 1.15 H new ATOM 1709 N CYS A 115 -7.612 1.005 -1.618 1.00 0.60 N ATOM 1710 CA CYS A 115 -8.851 1.691 -1.941 1.00 0.64 C ATOM 1711 C CYS A 115 -9.875 1.372 -0.851 1.00 0.83 C ATOM 1712 O CYS A 115 -10.007 0.222 -0.435 1.00 1.33 O ATOM 1713 CB CYS A 115 -9.362 1.313 -3.333 1.00 0.95 C ATOM 1714 SG CYS A 115 -7.973 1.280 -4.523 1.00 1.57 S ATOM 0 H CYS A 115 -7.599 0.013 -1.857 1.00 0.60 H new ATOM 0 HA CYS A 115 -8.676 2.767 -1.971 1.00 0.64 H new ATOM 0 HB2 CYS A 115 -9.846 0.337 -3.299 1.00 0.95 H new ATOM 0 HB3 CYS A 115 -10.115 2.030 -3.660 1.00 0.95 H new ATOM 0 HG CYS A 115 -7.073 2.147 -4.164 1.00 1.57 H new ATOM 1720 N THR A 116 -10.574 2.411 -0.417 1.00 0.68 N ATOM 1721 CA THR A 116 -11.707 2.231 0.474 1.00 0.88 C ATOM 1722 C THR A 116 -12.999 2.684 -0.207 1.00 0.75 C ATOM 1723 O THR A 116 -14.017 2.886 0.454 1.00 0.79 O ATOM 1724 CB THR A 116 -11.410 2.983 1.774 1.00 1.14 C ATOM 1725 OG1 THR A 116 -10.044 2.678 2.046 1.00 1.42 O ATOM 1726 CG2 THR A 116 -12.167 2.405 2.972 1.00 1.69 C ATOM 0 H THR A 116 -10.377 3.380 -0.666 1.00 0.68 H new ATOM 0 HA THR A 116 -11.856 1.179 0.716 1.00 0.88 H new ATOM 0 HB THR A 116 -11.672 4.034 1.653 1.00 1.14 H new ATOM 0 HG1 THR A 116 -9.690 3.317 2.699 1.00 1.42 H new ATOM 0 HG21 THR A 116 -11.920 2.975 3.868 1.00 1.69 H new ATOM 0 HG22 THR A 116 -13.240 2.465 2.788 1.00 1.69 H new ATOM 0 HG23 THR A 116 -11.881 1.363 3.115 1.00 1.69 H new ATOM 1734 N ALA A 117 -12.918 2.831 -1.522 1.00 0.67 N ATOM 1735 CA ALA A 117 -14.078 3.223 -2.304 1.00 0.56 C ATOM 1736 C ALA A 117 -13.734 3.140 -3.792 1.00 0.55 C ATOM 1737 O ALA A 117 -12.596 2.847 -4.155 1.00 0.64 O ATOM 1738 CB ALA A 117 -14.526 4.624 -1.885 1.00 0.66 C ATOM 0 H ALA A 117 -12.067 2.686 -2.065 1.00 0.67 H new ATOM 0 HA ALA A 117 -14.913 2.547 -2.120 1.00 0.56 H new ATOM 0 HB1 ALA A 117 -15.396 4.918 -2.472 1.00 0.66 H new ATOM 0 HB2 ALA A 117 -14.786 4.622 -0.826 1.00 0.66 H new ATOM 0 HB3 ALA A 117 -13.716 5.332 -2.058 1.00 0.66 H new ATOM 1744 N LYS A 118 -14.740 3.404 -4.615 1.00 0.56 N ATOM 1745 CA LYS A 118 -14.550 3.397 -6.056 1.00 0.66 C ATOM 1746 C LYS A 118 -13.657 4.573 -6.454 1.00 0.65 C ATOM 1747 O LYS A 118 -13.955 5.722 -6.130 1.00 1.04 O ATOM 1748 CB LYS A 118 -15.901 3.379 -6.773 1.00 0.87 C ATOM 1749 CG LYS A 118 -15.715 3.367 -8.292 1.00 1.19 C ATOM 1750 CD LYS A 118 -16.995 2.920 -8.998 1.00 1.39 C ATOM 1751 CE LYS A 118 -16.971 3.309 -10.477 1.00 2.18 C ATOM 1752 NZ LYS A 118 -17.458 4.695 -10.656 1.00 3.61 N ATOM 0 H LYS A 118 -15.688 3.624 -4.311 1.00 0.56 H new ATOM 0 HA LYS A 118 -14.037 2.488 -6.369 1.00 0.66 H new ATOM 0 HB2 LYS A 118 -16.468 2.501 -6.465 1.00 0.87 H new ATOM 0 HB3 LYS A 118 -16.483 4.253 -6.481 1.00 0.87 H new ATOM 0 HG2 LYS A 118 -15.435 4.363 -8.635 1.00 1.19 H new ATOM 0 HG3 LYS A 118 -14.897 2.697 -8.556 1.00 1.19 H new ATOM 0 HD2 LYS A 118 -17.108 1.840 -8.904 1.00 1.39 H new ATOM 0 HD3 LYS A 118 -17.859 3.374 -8.513 1.00 1.39 H new ATOM 0 HE2 LYS A 118 -15.957 3.221 -10.866 1.00 2.18 H new ATOM 0 HE3 LYS A 118 -17.593 2.622 -11.050 1.00 2.18 H new ATOM 0 HZ1 LYS A 118 -18.326 4.687 -11.229 1.00 3.61 H new ATOM 0 HZ2 LYS A 118 -17.661 5.114 -9.726 1.00 3.61 H new ATOM 0 HZ3 LYS A 118 -16.730 5.259 -11.139 1.00 3.61 H new ATOM 1766 N THR A 119 -12.578 4.247 -7.151 1.00 0.54 N ATOM 1767 CA THR A 119 -11.622 5.258 -7.568 1.00 0.57 C ATOM 1768 C THR A 119 -11.379 5.171 -9.076 1.00 0.59 C ATOM 1769 O THR A 119 -10.363 4.633 -9.515 1.00 0.67 O ATOM 1770 CB THR A 119 -10.351 5.077 -6.737 1.00 0.69 C ATOM 1771 OG1 THR A 119 -10.206 3.665 -6.623 1.00 0.81 O ATOM 1772 CG2 THR A 119 -10.524 5.552 -5.292 1.00 0.73 C ATOM 0 H THR A 119 -12.345 3.296 -7.437 1.00 0.54 H new ATOM 0 HA THR A 119 -12.005 6.263 -7.389 1.00 0.57 H new ATOM 0 HB THR A 119 -9.532 5.624 -7.204 1.00 0.69 H new ATOM 0 HG1 THR A 119 -9.404 3.460 -6.099 1.00 0.81 H new ATOM 0 HG21 THR A 119 -9.593 5.401 -4.746 1.00 0.73 H new ATOM 0 HG22 THR A 119 -10.781 6.611 -5.286 1.00 0.73 H new ATOM 0 HG23 THR A 119 -11.321 4.982 -4.815 1.00 0.73 H new ATOM 1780 N GLU A 120 -12.327 5.710 -9.828 1.00 0.65 N ATOM 1781 CA GLU A 120 -12.305 5.570 -11.274 1.00 0.78 C ATOM 1782 C GLU A 120 -11.339 6.583 -11.891 1.00 0.80 C ATOM 1783 O GLU A 120 -10.902 6.417 -13.028 1.00 0.90 O ATOM 1784 CB GLU A 120 -13.710 5.724 -11.861 1.00 1.07 C ATOM 1785 CG GLU A 120 -14.156 7.188 -11.840 1.00 2.24 C ATOM 1786 CD GLU A 120 -15.596 7.330 -12.336 1.00 2.80 C ATOM 1787 OE1 GLU A 120 -16.462 6.629 -11.772 1.00 2.99 O ATOM 1788 OE2 GLU A 120 -15.797 8.137 -13.269 1.00 3.86 O ATOM 0 H GLU A 120 -13.115 6.245 -9.463 1.00 0.65 H new ATOM 0 HA GLU A 120 -11.953 4.567 -11.517 1.00 0.78 H new ATOM 0 HB2 GLU A 120 -13.723 5.351 -12.885 1.00 1.07 H new ATOM 0 HB3 GLU A 120 -14.414 5.117 -11.292 1.00 1.07 H new ATOM 0 HG2 GLU A 120 -14.076 7.582 -10.827 1.00 2.24 H new ATOM 0 HG3 GLU A 120 -13.492 7.783 -12.466 1.00 2.24 H new ATOM 1795 N TRP A 121 -11.034 7.611 -11.113 1.00 0.79 N ATOM 1796 CA TRP A 121 -10.216 8.707 -11.607 1.00 0.88 C ATOM 1797 C TRP A 121 -8.748 8.317 -11.428 1.00 0.81 C ATOM 1798 O TRP A 121 -7.853 9.038 -11.869 1.00 0.89 O ATOM 1799 CB TRP A 121 -10.577 10.018 -10.906 1.00 0.96 C ATOM 1800 CG TRP A 121 -9.904 10.202 -9.545 1.00 0.91 C ATOM 1801 CD1 TRP A 121 -8.688 10.702 -9.286 1.00 0.88 C ATOM 1802 CD2 TRP A 121 -10.463 9.866 -8.258 1.00 0.98 C ATOM 1803 NE1 TRP A 121 -8.424 10.712 -7.931 1.00 0.93 N ATOM 1804 CE2 TRP A 121 -9.538 10.188 -7.286 1.00 1.00 C ATOM 1805 CE3 TRP A 121 -11.711 9.309 -7.924 1.00 1.10 C ATOM 1806 CZ2 TRP A 121 -9.761 9.990 -5.918 1.00 1.13 C ATOM 1807 CZ3 TRP A 121 -11.918 9.116 -6.554 1.00 1.21 C ATOM 1808 CH2 TRP A 121 -10.997 9.435 -5.563 1.00 1.24 C ATOM 0 H TRP A 121 -11.338 7.709 -10.144 1.00 0.79 H new ATOM 0 HA TRP A 121 -10.403 8.883 -12.666 1.00 0.88 H new ATOM 0 HB2 TRP A 121 -10.301 10.851 -11.552 1.00 0.96 H new ATOM 0 HB3 TRP A 121 -11.658 10.062 -10.774 1.00 0.96 H new ATOM 0 HD1 TRP A 121 -8.001 11.053 -10.042 1.00 0.88 H new ATOM 0 HE1 TRP A 121 -7.568 11.043 -7.485 1.00 0.93 H new ATOM 0 HE3 TRP A 121 -12.451 9.051 -8.667 1.00 1.10 H new ATOM 0 HZ2 TRP A 121 -9.020 10.251 -5.177 1.00 1.13 H new ATOM 0 HZ3 TRP A 121 -12.860 8.689 -6.244 1.00 1.21 H new ATOM 0 HH2 TRP A 121 -11.233 9.256 -4.525 1.00 1.24 H new ATOM 1819 N LEU A 122 -8.544 7.179 -10.781 1.00 0.71 N ATOM 1820 CA LEU A 122 -7.204 6.643 -10.613 1.00 0.69 C ATOM 1821 C LEU A 122 -7.043 5.401 -11.491 1.00 0.72 C ATOM 1822 O LEU A 122 -6.007 4.738 -11.451 1.00 0.82 O ATOM 1823 CB LEU A 122 -6.910 6.392 -9.133 1.00 0.62 C ATOM 1824 CG LEU A 122 -6.938 7.624 -8.225 1.00 0.70 C ATOM 1825 CD1 LEU A 122 -6.682 7.237 -6.768 1.00 0.78 C ATOM 1826 CD2 LEU A 122 -5.958 8.691 -8.716 1.00 0.74 C ATOM 0 H LEU A 122 -9.285 6.613 -10.367 1.00 0.71 H new ATOM 0 HA LEU A 122 -6.459 7.367 -10.944 1.00 0.69 H new ATOM 0 HB2 LEU A 122 -7.635 5.671 -8.756 1.00 0.62 H new ATOM 0 HB3 LEU A 122 -5.927 5.928 -9.052 1.00 0.62 H new ATOM 0 HG LEU A 122 -7.936 8.059 -8.272 1.00 0.70 H new ATOM 0 HD11 LEU A 122 -6.707 8.131 -6.144 1.00 0.78 H new ATOM 0 HD12 LEU A 122 -7.452 6.541 -6.436 1.00 0.78 H new ATOM 0 HD13 LEU A 122 -5.704 6.763 -6.684 1.00 0.78 H new ATOM 0 HD21 LEU A 122 -5.998 9.555 -8.053 1.00 0.74 H new ATOM 0 HD22 LEU A 122 -4.947 8.283 -8.719 1.00 0.74 H new ATOM 0 HD23 LEU A 122 -6.229 8.996 -9.727 1.00 0.74 H new ATOM 1838 N ASP A 123 -8.083 5.122 -12.263 1.00 0.79 N ATOM 1839 CA ASP A 123 -8.086 3.948 -13.119 1.00 0.92 C ATOM 1840 C ASP A 123 -7.291 4.248 -14.392 1.00 1.26 C ATOM 1841 O ASP A 123 -7.573 5.222 -15.088 1.00 2.87 O ATOM 1842 CB ASP A 123 -9.510 3.570 -13.530 1.00 0.87 C ATOM 1843 CG ASP A 123 -9.652 2.190 -14.177 1.00 0.93 C ATOM 1844 OD1 ASP A 123 -9.532 1.197 -13.427 1.00 1.66 O ATOM 1845 OD2 ASP A 123 -9.876 2.159 -15.406 1.00 1.91 O ATOM 0 H ASP A 123 -8.929 5.689 -12.314 1.00 0.79 H new ATOM 0 HA ASP A 123 -7.640 3.124 -12.562 1.00 0.92 H new ATOM 0 HB2 ASP A 123 -10.149 3.608 -12.648 1.00 0.87 H new ATOM 0 HB3 ASP A 123 -9.883 4.321 -14.226 1.00 0.87 H new ATOM 1850 N GLY A 124 -6.314 3.393 -14.657 1.00 1.26 N ATOM 1851 CA GLY A 124 -5.486 3.547 -15.841 1.00 1.33 C ATOM 1852 C GLY A 124 -4.172 4.254 -15.504 1.00 1.41 C ATOM 1853 O GLY A 124 -3.194 4.138 -16.240 1.00 2.19 O ATOM 0 H GLY A 124 -6.077 2.592 -14.072 1.00 1.26 H new ATOM 0 HA2 GLY A 124 -5.276 2.568 -16.272 1.00 1.33 H new ATOM 0 HA3 GLY A 124 -6.027 4.118 -16.596 1.00 1.33 H new ATOM 1857 N LYS A 125 -4.193 4.972 -14.390 1.00 1.09 N ATOM 1858 CA LYS A 125 -3.015 5.698 -13.946 1.00 1.11 C ATOM 1859 C LYS A 125 -2.177 4.794 -13.037 1.00 0.98 C ATOM 1860 O LYS A 125 -0.949 4.798 -13.114 1.00 1.19 O ATOM 1861 CB LYS A 125 -3.415 7.023 -13.295 1.00 1.20 C ATOM 1862 CG LYS A 125 -2.192 7.751 -12.735 1.00 2.57 C ATOM 1863 CD LYS A 125 -1.280 8.238 -13.864 1.00 3.24 C ATOM 1864 CE LYS A 125 -0.187 9.162 -13.324 1.00 4.63 C ATOM 1865 NZ LYS A 125 0.873 8.376 -12.653 1.00 6.05 N ATOM 0 H LYS A 125 -5.007 5.066 -13.782 1.00 1.09 H new ATOM 0 HA LYS A 125 -2.389 5.965 -14.797 1.00 1.11 H new ATOM 0 HB2 LYS A 125 -3.915 7.656 -14.028 1.00 1.20 H new ATOM 0 HB3 LYS A 125 -4.130 6.837 -12.494 1.00 1.20 H new ATOM 0 HG2 LYS A 125 -2.514 8.599 -12.131 1.00 2.57 H new ATOM 0 HG3 LYS A 125 -1.637 7.083 -12.076 1.00 2.57 H new ATOM 0 HD2 LYS A 125 -0.825 7.383 -14.363 1.00 3.24 H new ATOM 0 HD3 LYS A 125 -1.871 8.766 -14.612 1.00 3.24 H new ATOM 0 HE2 LYS A 125 0.244 9.741 -14.141 1.00 4.63 H new ATOM 0 HE3 LYS A 125 -0.619 9.874 -12.621 1.00 4.63 H new ATOM 0 HZ1 LYS A 125 1.323 8.957 -11.917 1.00 6.05 H new ATOM 0 HZ2 LYS A 125 0.454 7.529 -12.218 1.00 6.05 H new ATOM 0 HZ3 LYS A 125 1.587 8.089 -13.352 1.00 6.05 H new ATOM 1879 N HIS A 126 -2.875 4.043 -12.198 1.00 0.80 N ATOM 1880 CA HIS A 126 -2.210 3.203 -11.217 1.00 0.81 C ATOM 1881 C HIS A 126 -2.275 1.742 -11.664 1.00 0.91 C ATOM 1882 O HIS A 126 -3.206 1.343 -12.363 1.00 1.71 O ATOM 1883 CB HIS A 126 -2.802 3.424 -9.823 1.00 0.86 C ATOM 1884 CG HIS A 126 -2.641 4.832 -9.303 1.00 0.91 C ATOM 1885 ND1 HIS A 126 -1.693 5.710 -9.799 1.00 1.06 N ATOM 1886 CD2 HIS A 126 -3.315 5.505 -8.327 1.00 1.93 C ATOM 1887 CE1 HIS A 126 -1.801 6.856 -9.143 1.00 0.83 C ATOM 1888 NE2 HIS A 126 -2.807 6.727 -8.231 1.00 1.62 N ATOM 0 H HIS A 126 -3.894 3.999 -12.177 1.00 0.80 H new ATOM 0 HA HIS A 126 -1.158 3.479 -11.150 1.00 0.81 H new ATOM 0 HB2 HIS A 126 -3.863 3.176 -9.847 1.00 0.86 H new ATOM 0 HB3 HIS A 126 -2.329 2.734 -9.125 1.00 0.86 H new ATOM 0 HD1 HIS A 126 -1.025 5.509 -10.543 1.00 1.06 H new ATOM 0 HD2 HIS A 126 -4.126 5.110 -7.733 1.00 1.93 H new ATOM 0 HE1 HIS A 126 -1.198 7.738 -9.302 1.00 0.83 H new ATOM 1896 N VAL A 127 -1.275 0.982 -11.242 1.00 0.79 N ATOM 1897 CA VAL A 127 -1.231 -0.437 -11.551 1.00 0.73 C ATOM 1898 C VAL A 127 -1.792 -1.230 -10.367 1.00 0.75 C ATOM 1899 O VAL A 127 -1.384 -1.020 -9.227 1.00 1.17 O ATOM 1900 CB VAL A 127 0.195 -0.847 -11.923 1.00 0.95 C ATOM 1901 CG1 VAL A 127 0.293 -2.361 -12.132 1.00 1.13 C ATOM 1902 CG2 VAL A 127 0.678 -0.091 -13.162 1.00 0.98 C ATOM 0 H VAL A 127 -0.489 1.322 -10.688 1.00 0.79 H new ATOM 0 HA VAL A 127 -1.855 -0.659 -12.416 1.00 0.73 H new ATOM 0 HB VAL A 127 0.848 -0.580 -11.092 1.00 0.95 H new ATOM 0 HG11 VAL A 127 1.317 -2.626 -12.396 1.00 1.13 H new ATOM 0 HG12 VAL A 127 0.010 -2.874 -11.213 1.00 1.13 H new ATOM 0 HG13 VAL A 127 -0.378 -2.661 -12.937 1.00 1.13 H new ATOM 0 HG21 VAL A 127 1.694 -0.401 -13.404 1.00 0.98 H new ATOM 0 HG22 VAL A 127 0.021 -0.313 -14.003 1.00 0.98 H new ATOM 0 HG23 VAL A 127 0.664 0.981 -12.963 1.00 0.98 H new ATOM 1912 N VAL A 128 -2.719 -2.123 -10.681 1.00 0.48 N ATOM 1913 CA VAL A 128 -3.330 -2.956 -9.661 1.00 0.45 C ATOM 1914 C VAL A 128 -2.774 -4.378 -9.767 1.00 0.48 C ATOM 1915 O VAL A 128 -2.946 -5.041 -10.789 1.00 0.59 O ATOM 1916 CB VAL A 128 -4.854 -2.901 -9.784 1.00 0.44 C ATOM 1917 CG1 VAL A 128 -5.519 -3.890 -8.823 1.00 0.64 C ATOM 1918 CG2 VAL A 128 -5.372 -1.480 -9.552 1.00 0.51 C ATOM 0 H VAL A 128 -3.061 -2.287 -11.628 1.00 0.48 H new ATOM 0 HA VAL A 128 -3.083 -2.583 -8.667 1.00 0.45 H new ATOM 0 HB VAL A 128 -5.118 -3.193 -10.801 1.00 0.44 H new ATOM 0 HG11 VAL A 128 -6.602 -3.830 -8.931 1.00 0.64 H new ATOM 0 HG12 VAL A 128 -5.187 -4.902 -9.055 1.00 0.64 H new ATOM 0 HG13 VAL A 128 -5.243 -3.643 -7.798 1.00 0.64 H new ATOM 0 HG21 VAL A 128 -6.458 -1.469 -9.645 1.00 0.51 H new ATOM 0 HG22 VAL A 128 -5.090 -1.149 -8.553 1.00 0.51 H new ATOM 0 HG23 VAL A 128 -4.937 -0.809 -10.293 1.00 0.51 H new ATOM 1928 N PHE A 129 -2.117 -4.803 -8.698 1.00 0.59 N ATOM 1929 CA PHE A 129 -1.486 -6.112 -8.679 1.00 0.64 C ATOM 1930 C PHE A 129 -1.841 -6.873 -7.399 1.00 0.66 C ATOM 1931 O PHE A 129 -1.291 -7.941 -7.136 1.00 1.00 O ATOM 1932 CB PHE A 129 0.025 -5.881 -8.719 1.00 0.78 C ATOM 1933 CG PHE A 129 0.628 -5.473 -7.372 1.00 1.40 C ATOM 1934 CD1 PHE A 129 0.636 -4.166 -6.999 1.00 2.30 C ATOM 1935 CD2 PHE A 129 1.156 -6.419 -6.549 1.00 2.63 C ATOM 1936 CE1 PHE A 129 1.195 -3.787 -5.750 1.00 3.10 C ATOM 1937 CE2 PHE A 129 1.714 -6.040 -5.299 1.00 3.43 C ATOM 1938 CZ PHE A 129 1.722 -4.732 -4.926 1.00 3.30 C ATOM 0 H PHE A 129 -2.008 -4.264 -7.839 1.00 0.59 H new ATOM 0 HA PHE A 129 -1.829 -6.703 -9.528 1.00 0.64 H new ATOM 0 HB2 PHE A 129 0.513 -6.793 -9.063 1.00 0.78 H new ATOM 0 HB3 PHE A 129 0.245 -5.106 -9.453 1.00 0.78 H new ATOM 0 HD1 PHE A 129 0.217 -3.415 -7.653 1.00 2.30 H new ATOM 0 HD2 PHE A 129 1.151 -7.457 -6.846 1.00 2.63 H new ATOM 0 HE1 PHE A 129 1.202 -2.748 -5.454 1.00 3.10 H new ATOM 0 HE2 PHE A 129 2.132 -6.791 -4.645 1.00 3.43 H new ATOM 0 HZ PHE A 129 2.147 -4.444 -3.976 1.00 3.30 H new ATOM 1948 N GLY A 130 -2.758 -6.292 -6.640 1.00 0.65 N ATOM 1949 CA GLY A 130 -3.118 -6.848 -5.346 1.00 0.79 C ATOM 1950 C GLY A 130 -4.546 -6.457 -4.959 1.00 0.73 C ATOM 1951 O GLY A 130 -5.088 -5.483 -5.476 1.00 0.78 O ATOM 0 H GLY A 130 -3.262 -5.443 -6.895 1.00 0.65 H new ATOM 0 HA2 GLY A 130 -3.030 -7.934 -5.376 1.00 0.79 H new ATOM 0 HA3 GLY A 130 -2.421 -6.492 -4.587 1.00 0.79 H new ATOM 1955 N LYS A 131 -5.114 -7.240 -4.053 1.00 0.68 N ATOM 1956 CA LYS A 131 -6.448 -6.958 -3.552 1.00 0.69 C ATOM 1957 C LYS A 131 -6.597 -7.549 -2.149 1.00 0.57 C ATOM 1958 O LYS A 131 -6.144 -8.663 -1.890 1.00 0.73 O ATOM 1959 CB LYS A 131 -7.507 -7.447 -4.542 1.00 0.91 C ATOM 1960 CG LYS A 131 -8.917 -7.137 -4.035 1.00 1.87 C ATOM 1961 CD LYS A 131 -9.536 -8.358 -3.351 1.00 2.06 C ATOM 1962 CE LYS A 131 -10.218 -9.271 -4.372 1.00 2.06 C ATOM 1963 NZ LYS A 131 -10.650 -10.533 -3.731 1.00 2.60 N ATOM 0 H LYS A 131 -4.675 -8.069 -3.653 1.00 0.68 H new ATOM 0 HA LYS A 131 -6.602 -5.883 -3.463 1.00 0.69 H new ATOM 0 HB2 LYS A 131 -7.352 -6.971 -5.510 1.00 0.91 H new ATOM 0 HB3 LYS A 131 -7.399 -8.521 -4.694 1.00 0.91 H new ATOM 0 HG2 LYS A 131 -8.880 -6.303 -3.334 1.00 1.87 H new ATOM 0 HG3 LYS A 131 -9.546 -6.825 -4.868 1.00 1.87 H new ATOM 0 HD2 LYS A 131 -8.762 -8.913 -2.821 1.00 2.06 H new ATOM 0 HD3 LYS A 131 -10.262 -8.033 -2.606 1.00 2.06 H new ATOM 0 HE2 LYS A 131 -11.079 -8.763 -4.805 1.00 2.06 H new ATOM 0 HE3 LYS A 131 -9.531 -9.488 -5.190 1.00 2.06 H new ATOM 0 HZ1 LYS A 131 -11.454 -10.932 -4.256 1.00 2.60 H new ATOM 0 HZ2 LYS A 131 -9.862 -11.212 -3.736 1.00 2.60 H new ATOM 0 HZ3 LYS A 131 -10.938 -10.343 -2.750 1.00 2.60 H new ATOM 1977 N VAL A 132 -7.235 -6.778 -1.281 1.00 0.64 N ATOM 1978 CA VAL A 132 -7.450 -7.212 0.090 1.00 0.54 C ATOM 1979 C VAL A 132 -8.593 -8.228 0.124 1.00 0.68 C ATOM 1980 O VAL A 132 -9.759 -7.862 -0.013 1.00 1.16 O ATOM 1981 CB VAL A 132 -7.700 -6.000 0.989 1.00 0.79 C ATOM 1982 CG1 VAL A 132 -8.122 -6.438 2.394 1.00 0.65 C ATOM 1983 CG2 VAL A 132 -6.468 -5.094 1.044 1.00 1.21 C ATOM 0 H VAL A 132 -7.610 -5.855 -1.500 1.00 0.64 H new ATOM 0 HA VAL A 132 -6.561 -7.709 0.478 1.00 0.54 H new ATOM 0 HB VAL A 132 -8.519 -5.425 0.557 1.00 0.79 H new ATOM 0 HG11 VAL A 132 -8.294 -5.558 3.013 1.00 0.65 H new ATOM 0 HG12 VAL A 132 -9.040 -7.023 2.332 1.00 0.65 H new ATOM 0 HG13 VAL A 132 -7.333 -7.046 2.838 1.00 0.65 H new ATOM 0 HG21 VAL A 132 -6.673 -4.240 1.690 1.00 1.21 H new ATOM 0 HG22 VAL A 132 -5.622 -5.654 1.441 1.00 1.21 H new ATOM 0 HG23 VAL A 132 -6.231 -4.741 0.040 1.00 1.21 H new ATOM 1993 N LYS A 133 -8.219 -9.487 0.307 1.00 0.90 N ATOM 1994 CA LYS A 133 -9.202 -10.547 0.451 1.00 1.15 C ATOM 1995 C LYS A 133 -9.862 -10.441 1.827 1.00 1.06 C ATOM 1996 O LYS A 133 -11.062 -10.676 1.963 1.00 1.94 O ATOM 1997 CB LYS A 133 -8.563 -11.909 0.178 1.00 1.50 C ATOM 1998 CG LYS A 133 -7.648 -12.327 1.331 1.00 1.65 C ATOM 1999 CD LYS A 133 -7.139 -13.757 1.136 1.00 1.86 C ATOM 2000 CE LYS A 133 -8.128 -14.774 1.708 1.00 2.03 C ATOM 2001 NZ LYS A 133 -7.973 -14.879 3.176 1.00 3.75 N ATOM 0 H LYS A 133 -7.248 -9.796 0.359 1.00 0.90 H new ATOM 0 HA LYS A 133 -9.993 -10.437 -0.291 1.00 1.15 H new ATOM 0 HB2 LYS A 133 -9.342 -12.658 0.037 1.00 1.50 H new ATOM 0 HB3 LYS A 133 -7.990 -11.867 -0.748 1.00 1.50 H new ATOM 0 HG2 LYS A 133 -6.803 -11.642 1.396 1.00 1.65 H new ATOM 0 HG3 LYS A 133 -8.190 -12.255 2.274 1.00 1.65 H new ATOM 0 HD2 LYS A 133 -6.986 -13.951 0.074 1.00 1.86 H new ATOM 0 HD3 LYS A 133 -6.171 -13.872 1.624 1.00 1.86 H new ATOM 0 HE2 LYS A 133 -9.148 -14.475 1.465 1.00 2.03 H new ATOM 0 HE3 LYS A 133 -7.963 -15.749 1.248 1.00 2.03 H new ATOM 0 HZ1 LYS A 133 -7.467 -15.757 3.410 1.00 3.75 H new ATOM 0 HZ2 LYS A 133 -7.432 -14.063 3.527 1.00 3.75 H new ATOM 0 HZ3 LYS A 133 -8.911 -14.891 3.624 1.00 3.75 H new ATOM 2015 N GLU A 134 -9.050 -10.087 2.812 1.00 1.03 N ATOM 2016 CA GLU A 134 -9.540 -9.951 4.174 1.00 1.07 C ATOM 2017 C GLU A 134 -8.772 -8.850 4.906 1.00 1.28 C ATOM 2018 O GLU A 134 -7.570 -8.685 4.702 1.00 2.08 O ATOM 2019 CB GLU A 134 -9.445 -11.280 4.926 1.00 1.28 C ATOM 2020 CG GLU A 134 -10.475 -12.282 4.402 1.00 1.82 C ATOM 2021 CD GLU A 134 -10.466 -13.565 5.236 1.00 1.92 C ATOM 2022 OE1 GLU A 134 -11.041 -13.525 6.344 1.00 2.27 O ATOM 2023 OE2 GLU A 134 -9.884 -14.557 4.745 1.00 3.01 O ATOM 0 H GLU A 134 -8.056 -9.890 2.695 1.00 1.03 H new ATOM 0 HA GLU A 134 -10.592 -9.668 4.135 1.00 1.07 H new ATOM 0 HB2 GLU A 134 -8.442 -11.693 4.816 1.00 1.28 H new ATOM 0 HB3 GLU A 134 -9.606 -11.112 5.991 1.00 1.28 H new ATOM 0 HG2 GLU A 134 -11.469 -11.834 4.428 1.00 1.82 H new ATOM 0 HG3 GLU A 134 -10.259 -12.520 3.360 1.00 1.82 H new ATOM 2030 N GLY A 135 -9.497 -8.124 5.745 1.00 0.89 N ATOM 2031 CA GLY A 135 -8.886 -7.086 6.557 1.00 0.98 C ATOM 2032 C GLY A 135 -9.491 -5.716 6.241 1.00 0.85 C ATOM 2033 O GLY A 135 -9.108 -4.712 6.839 1.00 0.89 O ATOM 0 H GLY A 135 -10.502 -8.235 5.880 1.00 0.89 H new ATOM 0 HA2 GLY A 135 -9.027 -7.315 7.613 1.00 0.98 H new ATOM 0 HA3 GLY A 135 -7.811 -7.063 6.377 1.00 0.98 H new ATOM 2037 N MET A 136 -10.424 -5.720 5.301 1.00 0.84 N ATOM 2038 CA MET A 136 -11.126 -4.501 4.939 1.00 0.84 C ATOM 2039 C MET A 136 -11.755 -3.843 6.169 1.00 0.71 C ATOM 2040 O MET A 136 -11.890 -2.622 6.223 1.00 0.73 O ATOM 2041 CB MET A 136 -12.219 -4.824 3.917 1.00 0.94 C ATOM 2042 CG MET A 136 -11.702 -4.651 2.488 1.00 1.48 C ATOM 2043 SD MET A 136 -12.549 -3.298 1.691 1.00 1.74 S ATOM 2044 CE MET A 136 -11.648 -1.920 2.379 1.00 1.49 C ATOM 0 H MET A 136 -10.710 -6.548 4.779 1.00 0.84 H new ATOM 0 HA MET A 136 -10.406 -3.806 4.507 1.00 0.84 H new ATOM 0 HB2 MET A 136 -12.565 -5.848 4.061 1.00 0.94 H new ATOM 0 HB3 MET A 136 -13.077 -4.172 4.079 1.00 0.94 H new ATOM 0 HG2 MET A 136 -10.629 -4.461 2.501 1.00 1.48 H new ATOM 0 HG3 MET A 136 -11.856 -5.570 1.923 1.00 1.48 H new ATOM 0 HE1 MET A 136 -12.051 -0.988 1.983 1.00 1.49 H new ATOM 0 HE2 MET A 136 -11.747 -1.926 3.465 1.00 1.49 H new ATOM 0 HE3 MET A 136 -10.595 -2.003 2.110 1.00 1.49 H new ATOM 2054 N ASN A 137 -12.123 -4.682 7.126 1.00 0.66 N ATOM 2055 CA ASN A 137 -12.682 -4.195 8.375 1.00 0.62 C ATOM 2056 C ASN A 137 -11.609 -3.418 9.140 1.00 0.59 C ATOM 2057 O ASN A 137 -11.899 -2.392 9.754 1.00 0.60 O ATOM 2058 CB ASN A 137 -13.148 -5.353 9.258 1.00 0.74 C ATOM 2059 CG ASN A 137 -13.450 -4.872 10.679 1.00 1.69 C ATOM 2060 OD1 ASN A 137 -12.843 -5.295 11.649 1.00 2.90 O ATOM 2061 ND2 ASN A 137 -14.420 -3.965 10.748 1.00 2.98 N ATOM 0 H ASN A 137 -12.045 -5.697 7.061 1.00 0.66 H new ATOM 0 HA ASN A 137 -13.534 -3.558 8.138 1.00 0.62 H new ATOM 0 HB2 ASN A 137 -14.040 -5.808 8.827 1.00 0.74 H new ATOM 0 HB3 ASN A 137 -12.379 -6.125 9.287 1.00 0.74 H new ATOM 0 HD21 ASN A 137 -14.696 -3.581 11.652 1.00 2.98 H new ATOM 0 HD22 ASN A 137 -14.888 -3.653 9.897 1.00 2.98 H new ATOM 2068 N ILE A 138 -10.391 -3.937 9.079 1.00 0.59 N ATOM 2069 CA ILE A 138 -9.279 -3.319 9.780 1.00 0.60 C ATOM 2070 C ILE A 138 -8.886 -2.026 9.064 1.00 0.62 C ATOM 2071 O ILE A 138 -8.453 -1.066 9.701 1.00 0.66 O ATOM 2072 CB ILE A 138 -8.125 -4.311 9.933 1.00 0.65 C ATOM 2073 CG1 ILE A 138 -8.604 -5.616 10.575 1.00 0.92 C ATOM 2074 CG2 ILE A 138 -6.963 -3.686 10.707 1.00 0.58 C ATOM 2075 CD1 ILE A 138 -9.381 -5.339 11.864 1.00 0.89 C ATOM 0 H ILE A 138 -10.150 -4.778 8.555 1.00 0.59 H new ATOM 0 HA ILE A 138 -9.572 -3.047 10.794 1.00 0.60 H new ATOM 0 HB ILE A 138 -7.754 -4.558 8.938 1.00 0.65 H new ATOM 0 HG12 ILE A 138 -9.237 -6.160 9.874 1.00 0.92 H new ATOM 0 HG13 ILE A 138 -7.748 -6.255 10.792 1.00 0.92 H new ATOM 0 HG21 ILE A 138 -6.156 -4.413 10.801 1.00 0.58 H new ATOM 0 HG22 ILE A 138 -6.600 -2.808 10.172 1.00 0.58 H new ATOM 0 HG23 ILE A 138 -7.304 -3.391 11.700 1.00 0.58 H new ATOM 0 HD11 ILE A 138 -9.710 -6.282 12.300 1.00 0.89 H new ATOM 0 HD12 ILE A 138 -8.737 -4.817 12.572 1.00 0.89 H new ATOM 0 HD13 ILE A 138 -10.250 -4.720 11.639 1.00 0.89 H new ATOM 2087 N VAL A 139 -9.050 -2.041 7.750 1.00 0.63 N ATOM 2088 CA VAL A 139 -8.824 -0.846 6.953 1.00 0.70 C ATOM 2089 C VAL A 139 -9.839 0.227 7.352 1.00 0.68 C ATOM 2090 O VAL A 139 -9.468 1.373 7.603 1.00 0.74 O ATOM 2091 CB VAL A 139 -8.875 -1.193 5.463 1.00 0.82 C ATOM 2092 CG1 VAL A 139 -8.999 0.070 4.610 1.00 1.03 C ATOM 2093 CG2 VAL A 139 -7.653 -2.017 5.050 1.00 0.96 C ATOM 0 H VAL A 139 -9.337 -2.862 7.216 1.00 0.63 H new ATOM 0 HA VAL A 139 -7.830 -0.441 7.145 1.00 0.70 H new ATOM 0 HB VAL A 139 -9.763 -1.801 5.291 1.00 0.82 H new ATOM 0 HG11 VAL A 139 -9.033 -0.205 3.556 1.00 1.03 H new ATOM 0 HG12 VAL A 139 -9.913 0.601 4.876 1.00 1.03 H new ATOM 0 HG13 VAL A 139 -8.139 0.716 4.789 1.00 1.03 H new ATOM 0 HG21 VAL A 139 -7.714 -2.250 3.987 1.00 0.96 H new ATOM 0 HG22 VAL A 139 -6.746 -1.445 5.245 1.00 0.96 H new ATOM 0 HG23 VAL A 139 -7.628 -2.943 5.624 1.00 0.96 H new ATOM 2103 N GLU A 140 -11.097 -0.182 7.398 1.00 0.68 N ATOM 2104 CA GLU A 140 -12.164 0.723 7.790 1.00 0.72 C ATOM 2105 C GLU A 140 -11.921 1.249 9.206 1.00 0.71 C ATOM 2106 O GLU A 140 -12.262 2.390 9.516 1.00 0.83 O ATOM 2107 CB GLU A 140 -13.529 0.040 7.687 1.00 0.76 C ATOM 2108 CG GLU A 140 -14.648 1.070 7.523 1.00 1.01 C ATOM 2109 CD GLU A 140 -14.485 1.853 6.219 1.00 2.26 C ATOM 2110 OE1 GLU A 140 -14.477 1.192 5.157 1.00 3.21 O ATOM 2111 OE2 GLU A 140 -14.372 3.095 6.311 1.00 3.63 O ATOM 0 H GLU A 140 -11.402 -1.128 7.170 1.00 0.68 H new ATOM 0 HA GLU A 140 -12.165 1.570 7.103 1.00 0.72 H new ATOM 0 HB2 GLU A 140 -13.534 -0.645 6.839 1.00 0.76 H new ATOM 0 HB3 GLU A 140 -13.709 -0.558 8.581 1.00 0.76 H new ATOM 0 HG2 GLU A 140 -15.615 0.566 7.531 1.00 1.01 H new ATOM 0 HG3 GLU A 140 -14.640 1.758 8.368 1.00 1.01 H new ATOM 2118 N ALA A 141 -11.331 0.394 10.028 1.00 0.69 N ATOM 2119 CA ALA A 141 -11.066 0.747 11.412 1.00 0.76 C ATOM 2120 C ALA A 141 -10.005 1.849 11.457 1.00 0.75 C ATOM 2121 O ALA A 141 -10.179 2.854 12.146 1.00 0.82 O ATOM 2122 CB ALA A 141 -10.641 -0.502 12.187 1.00 0.86 C ATOM 0 H ALA A 141 -11.029 -0.543 9.762 1.00 0.69 H new ATOM 0 HA ALA A 141 -11.967 1.134 11.888 1.00 0.76 H new ATOM 0 HB1 ALA A 141 -10.442 -0.236 13.225 1.00 0.86 H new ATOM 0 HB2 ALA A 141 -11.439 -1.243 12.149 1.00 0.86 H new ATOM 0 HB3 ALA A 141 -9.738 -0.918 11.740 1.00 0.86 H new ATOM 2128 N MET A 142 -8.931 1.624 10.716 1.00 0.73 N ATOM 2129 CA MET A 142 -7.824 2.565 10.696 1.00 0.76 C ATOM 2130 C MET A 142 -8.189 3.825 9.909 1.00 0.74 C ATOM 2131 O MET A 142 -7.512 4.846 10.016 1.00 0.89 O ATOM 2132 CB MET A 142 -6.601 1.902 10.060 1.00 0.91 C ATOM 2133 CG MET A 142 -6.496 2.254 8.575 1.00 1.55 C ATOM 2134 SD MET A 142 -5.330 1.170 7.770 1.00 1.71 S ATOM 2135 CE MET A 142 -3.799 1.841 8.397 1.00 1.63 C ATOM 0 H MET A 142 -8.803 0.803 10.124 1.00 0.73 H new ATOM 0 HA MET A 142 -7.599 2.853 11.723 1.00 0.76 H new ATOM 0 HB2 MET A 142 -5.698 2.224 10.578 1.00 0.91 H new ATOM 0 HB3 MET A 142 -6.667 0.820 10.177 1.00 0.91 H new ATOM 0 HG2 MET A 142 -7.474 2.165 8.102 1.00 1.55 H new ATOM 0 HG3 MET A 142 -6.180 3.291 8.460 1.00 1.55 H new ATOM 0 HE1 MET A 142 -3.107 2.003 7.570 1.00 1.63 H new ATOM 0 HE2 MET A 142 -3.995 2.790 8.897 1.00 1.63 H new ATOM 0 HE3 MET A 142 -3.359 1.141 9.107 1.00 1.63 H new ATOM 2145 N GLU A 143 -9.259 3.712 9.136 1.00 0.72 N ATOM 2146 CA GLU A 143 -9.768 4.851 8.390 1.00 0.76 C ATOM 2147 C GLU A 143 -10.694 5.691 9.271 1.00 0.82 C ATOM 2148 O GLU A 143 -11.215 6.714 8.831 1.00 1.19 O ATOM 2149 CB GLU A 143 -10.484 4.397 7.117 1.00 0.83 C ATOM 2150 CG GLU A 143 -9.483 3.899 6.072 1.00 1.85 C ATOM 2151 CD GLU A 143 -9.230 4.964 5.004 1.00 2.60 C ATOM 2152 OE1 GLU A 143 -8.587 5.978 5.353 1.00 3.96 O ATOM 2153 OE2 GLU A 143 -9.686 4.741 3.861 1.00 2.92 O ATOM 0 H GLU A 143 -9.788 2.849 9.010 1.00 0.72 H new ATOM 0 HA GLU A 143 -8.923 5.471 8.090 1.00 0.76 H new ATOM 0 HB2 GLU A 143 -11.190 3.602 7.357 1.00 0.83 H new ATOM 0 HB3 GLU A 143 -11.062 5.224 6.706 1.00 0.83 H new ATOM 0 HG2 GLU A 143 -8.544 3.637 6.559 1.00 1.85 H new ATOM 0 HG3 GLU A 143 -9.863 2.991 5.603 1.00 1.85 H new ATOM 2160 N ARG A 144 -10.871 5.228 10.500 1.00 1.01 N ATOM 2161 CA ARG A 144 -11.662 5.965 11.471 1.00 1.20 C ATOM 2162 C ARG A 144 -10.794 7.001 12.186 1.00 1.10 C ATOM 2163 O ARG A 144 -11.211 8.143 12.374 1.00 1.23 O ATOM 2164 CB ARG A 144 -12.279 5.022 12.506 1.00 1.66 C ATOM 2165 CG ARG A 144 -13.758 5.347 12.730 1.00 1.75 C ATOM 2166 CD ARG A 144 -14.653 4.265 12.125 1.00 2.26 C ATOM 2167 NE ARG A 144 -14.192 3.930 10.759 1.00 3.37 N ATOM 2168 CZ ARG A 144 -14.428 4.688 9.680 1.00 4.60 C ATOM 2169 NH1 ARG A 144 -15.197 5.781 9.783 1.00 4.94 N ATOM 2170 NH2 ARG A 144 -13.894 4.354 8.497 1.00 6.37 N ATOM 0 H ARG A 144 -10.480 4.352 10.846 1.00 1.01 H new ATOM 0 HA ARG A 144 -12.464 6.470 10.932 1.00 1.20 H new ATOM 0 HB2 ARG A 144 -12.176 3.990 12.170 1.00 1.66 H new ATOM 0 HB3 ARG A 144 -11.738 5.106 13.448 1.00 1.66 H new ATOM 0 HG2 ARG A 144 -13.957 5.434 13.798 1.00 1.75 H new ATOM 0 HG3 ARG A 144 -13.994 6.312 12.282 1.00 1.75 H new ATOM 0 HD2 ARG A 144 -14.635 3.374 12.752 1.00 2.26 H new ATOM 0 HD3 ARG A 144 -15.686 4.612 12.094 1.00 2.26 H new ATOM 0 HE ARG A 144 -13.662 3.068 10.631 1.00 3.37 H new ATOM 0 HH11 ARG A 144 -15.603 6.036 10.683 1.00 4.94 H new ATOM 0 HH12 ARG A 144 -15.376 6.358 8.961 1.00 4.94 H new ATOM 0 HH21 ARG A 144 -13.308 3.523 8.418 1.00 6.37 H new ATOM 0 HH22 ARG A 144 -14.074 4.931 7.675 1.00 6.37 H new ATOM 2184 N PHE A 145 -9.601 6.566 12.567 1.00 1.12 N ATOM 2185 CA PHE A 145 -8.690 7.426 13.301 1.00 1.14 C ATOM 2186 C PHE A 145 -8.210 8.588 12.428 1.00 0.96 C ATOM 2187 O PHE A 145 -8.283 9.746 12.835 1.00 1.39 O ATOM 2188 CB PHE A 145 -7.486 6.569 13.696 1.00 1.35 C ATOM 2189 CG PHE A 145 -7.786 5.538 14.786 1.00 1.65 C ATOM 2190 CD1 PHE A 145 -8.259 5.944 15.995 1.00 2.38 C ATOM 2191 CD2 PHE A 145 -7.582 4.215 14.546 1.00 2.54 C ATOM 2192 CE1 PHE A 145 -8.538 4.987 17.005 1.00 2.66 C ATOM 2193 CE2 PHE A 145 -7.860 3.258 15.557 1.00 2.99 C ATOM 2194 CZ PHE A 145 -8.333 3.664 16.766 1.00 2.56 C ATOM 0 H PHE A 145 -9.245 5.628 12.380 1.00 1.12 H new ATOM 0 HA PHE A 145 -9.194 7.845 14.172 1.00 1.14 H new ATOM 0 HB2 PHE A 145 -7.117 6.050 12.811 1.00 1.35 H new ATOM 0 HB3 PHE A 145 -6.685 7.223 14.040 1.00 1.35 H new ATOM 0 HD1 PHE A 145 -8.422 6.994 16.186 1.00 2.38 H new ATOM 0 HD2 PHE A 145 -7.208 3.892 13.586 1.00 2.54 H new ATOM 0 HE1 PHE A 145 -8.914 5.310 17.965 1.00 2.66 H new ATOM 0 HE2 PHE A 145 -7.696 2.208 15.366 1.00 2.99 H new ATOM 0 HZ PHE A 145 -8.546 2.936 17.535 1.00 2.56 H new ATOM 2204 N GLY A 146 -7.730 8.237 11.245 1.00 1.23 N ATOM 2205 CA GLY A 146 -7.442 9.235 10.228 1.00 0.97 C ATOM 2206 C GLY A 146 -8.685 9.540 9.390 1.00 1.58 C ATOM 2207 O GLY A 146 -9.419 8.631 9.007 1.00 3.18 O ATOM 0 H GLY A 146 -7.533 7.276 10.967 1.00 1.23 H new ATOM 0 HA2 GLY A 146 -7.085 10.150 10.702 1.00 0.97 H new ATOM 0 HA3 GLY A 146 -6.641 8.878 9.580 1.00 0.97 H new ATOM 2211 N SER A 147 -8.883 10.824 9.130 1.00 1.03 N ATOM 2212 CA SER A 147 -10.189 11.311 8.719 1.00 1.95 C ATOM 2213 C SER A 147 -10.169 12.838 8.615 1.00 1.72 C ATOM 2214 O SER A 147 -10.274 13.390 7.522 1.00 2.40 O ATOM 2215 CB SER A 147 -11.278 10.860 9.696 1.00 3.79 C ATOM 2216 OG SER A 147 -11.729 9.538 9.417 1.00 5.50 O ATOM 0 H SER A 147 -8.161 11.542 9.196 1.00 1.03 H new ATOM 0 HA SER A 147 -10.419 10.889 7.741 1.00 1.95 H new ATOM 0 HB2 SER A 147 -10.893 10.904 10.715 1.00 3.79 H new ATOM 0 HB3 SER A 147 -12.121 11.549 9.644 1.00 3.79 H new ATOM 0 HG SER A 147 -11.066 9.077 8.862 1.00 5.50 H new ATOM 2222 N ARG A 148 -10.033 13.476 9.769 1.00 2.69 N ATOM 2223 CA ARG A 148 -10.295 14.901 9.871 1.00 3.88 C ATOM 2224 C ARG A 148 -9.181 15.696 9.185 1.00 3.63 C ATOM 2225 O ARG A 148 -9.395 16.286 8.127 1.00 4.01 O ATOM 2226 CB ARG A 148 -10.398 15.340 11.333 1.00 5.23 C ATOM 2227 CG ARG A 148 -10.542 16.859 11.441 1.00 5.49 C ATOM 2228 CD ARG A 148 -10.891 17.276 12.871 1.00 6.95 C ATOM 2229 NE ARG A 148 -10.382 18.639 13.139 1.00 7.54 N ATOM 2230 CZ ARG A 148 -9.165 18.903 13.635 1.00 8.76 C ATOM 2231 NH1 ARG A 148 -8.242 17.934 13.694 1.00 9.33 N ATOM 2232 NH2 ARG A 148 -8.872 20.135 14.072 1.00 9.85 N ATOM 0 H ARG A 148 -9.745 13.032 10.641 1.00 2.69 H new ATOM 0 HA ARG A 148 -11.246 15.099 9.376 1.00 3.88 H new ATOM 0 HB2 ARG A 148 -11.254 14.856 11.802 1.00 5.23 H new ATOM 0 HB3 ARG A 148 -9.511 15.016 11.877 1.00 5.23 H new ATOM 0 HG2 ARG A 148 -9.612 17.339 11.135 1.00 5.49 H new ATOM 0 HG3 ARG A 148 -11.318 17.204 10.758 1.00 5.49 H new ATOM 0 HD2 ARG A 148 -11.971 17.248 13.013 1.00 6.95 H new ATOM 0 HD3 ARG A 148 -10.457 16.571 13.580 1.00 6.95 H new ATOM 0 HE ARG A 148 -10.996 19.427 12.933 1.00 7.54 H new ATOM 0 HH11 ARG A 148 -8.465 16.996 13.362 1.00 9.33 H new ATOM 0 HH12 ARG A 148 -7.316 18.134 14.071 1.00 9.33 H new ATOM 0 HH21 ARG A 148 -9.575 20.873 14.027 1.00 9.85 H new ATOM 0 HH22 ARG A 148 -7.946 20.335 14.449 1.00 9.85 H new ATOM 2246 N ASN A 149 -8.016 15.685 9.816 1.00 3.21 N ATOM 2247 CA ASN A 149 -6.985 16.659 9.501 1.00 3.28 C ATOM 2248 C ASN A 149 -5.879 15.981 8.691 1.00 2.85 C ATOM 2249 O ASN A 149 -4.697 16.145 8.988 1.00 3.63 O ATOM 2250 CB ASN A 149 -6.357 17.229 10.774 1.00 3.53 C ATOM 2251 CG ASN A 149 -6.075 16.119 11.790 1.00 3.40 C ATOM 2252 OD1 ASN A 149 -6.864 15.836 12.675 1.00 4.19 O ATOM 2253 ND2 ASN A 149 -4.906 15.509 11.613 1.00 3.13 N ATOM 0 H ASN A 149 -7.763 15.017 10.544 1.00 3.21 H new ATOM 0 HA ASN A 149 -7.448 17.467 8.935 1.00 3.28 H new ATOM 0 HB2 ASN A 149 -5.429 17.745 10.527 1.00 3.53 H new ATOM 0 HB3 ASN A 149 -7.026 17.969 11.214 1.00 3.53 H new ATOM 0 HD21 ASN A 149 -4.624 14.755 12.239 1.00 3.13 H new ATOM 0 HD22 ASN A 149 -4.292 15.795 10.851 1.00 3.13 H new ATOM 2260 N GLY A 150 -6.302 15.233 7.682 1.00 2.05 N ATOM 2261 CA GLY A 150 -5.364 14.499 6.850 1.00 2.08 C ATOM 2262 C GLY A 150 -4.480 13.581 7.698 1.00 1.70 C ATOM 2263 O GLY A 150 -3.368 13.953 8.067 1.00 2.52 O ATOM 0 H GLY A 150 -7.282 15.120 7.422 1.00 2.05 H new ATOM 0 HA2 GLY A 150 -5.910 13.907 6.116 1.00 2.08 H new ATOM 0 HA3 GLY A 150 -4.740 15.199 6.295 1.00 2.08 H new ATOM 2267 N LYS A 151 -5.009 12.400 7.980 1.00 1.66 N ATOM 2268 CA LYS A 151 -4.273 11.417 8.758 1.00 1.86 C ATOM 2269 C LYS A 151 -4.496 11.682 10.248 1.00 1.27 C ATOM 2270 O LYS A 151 -4.863 12.790 10.638 1.00 1.73 O ATOM 2271 CB LYS A 151 -2.799 11.406 8.348 1.00 2.70 C ATOM 2272 CG LYS A 151 -1.926 12.053 9.425 1.00 2.34 C ATOM 2273 CD LYS A 151 -0.577 12.487 8.850 1.00 3.09 C ATOM 2274 CE LYS A 151 0.352 12.997 9.953 1.00 3.12 C ATOM 2275 NZ LYS A 151 1.556 13.627 9.367 1.00 3.75 N ATOM 0 H LYS A 151 -5.938 12.101 7.684 1.00 1.66 H new ATOM 0 HA LYS A 151 -4.644 10.413 8.554 1.00 1.86 H new ATOM 0 HB2 LYS A 151 -2.473 10.380 8.178 1.00 2.70 H new ATOM 0 HB3 LYS A 151 -2.676 11.940 7.406 1.00 2.70 H new ATOM 0 HG2 LYS A 151 -2.441 12.917 9.845 1.00 2.34 H new ATOM 0 HG3 LYS A 151 -1.768 11.348 10.241 1.00 2.34 H new ATOM 0 HD2 LYS A 151 -0.110 11.647 8.336 1.00 3.09 H new ATOM 0 HD3 LYS A 151 -0.729 13.270 8.107 1.00 3.09 H new ATOM 0 HE2 LYS A 151 -0.176 13.718 10.577 1.00 3.12 H new ATOM 0 HE3 LYS A 151 0.645 12.171 10.600 1.00 3.12 H new ATOM 0 HZ1 LYS A 151 2.176 13.968 10.130 1.00 3.75 H new ATOM 0 HZ2 LYS A 151 2.068 12.929 8.791 1.00 3.75 H new ATOM 0 HZ3 LYS A 151 1.272 14.428 8.768 1.00 3.75 H new ATOM 2289 N THR A 152 -4.265 10.646 11.041 1.00 1.24 N ATOM 2290 CA THR A 152 -4.567 10.710 12.461 1.00 1.39 C ATOM 2291 C THR A 152 -3.494 11.514 13.198 1.00 1.77 C ATOM 2292 O THR A 152 -2.626 12.119 12.572 1.00 2.26 O ATOM 2293 CB THR A 152 -4.713 9.277 12.977 1.00 1.89 C ATOM 2294 OG1 THR A 152 -5.117 9.437 14.335 1.00 3.37 O ATOM 2295 CG2 THR A 152 -3.372 8.547 13.070 1.00 2.30 C ATOM 0 H THR A 152 -3.873 9.758 10.728 1.00 1.24 H new ATOM 0 HA THR A 152 -5.505 11.235 12.643 1.00 1.39 H new ATOM 0 HB THR A 152 -5.382 8.722 12.320 1.00 1.89 H new ATOM 0 HG1 THR A 152 -6.086 9.312 14.405 1.00 3.37 H new ATOM 0 HG21 THR A 152 -3.534 7.535 13.441 1.00 2.30 H new ATOM 0 HG22 THR A 152 -2.913 8.502 12.082 1.00 2.30 H new ATOM 0 HG23 THR A 152 -2.713 9.083 13.753 1.00 2.30 H new ATOM 2303 N SER A 153 -3.589 11.495 14.520 1.00 2.23 N ATOM 2304 CA SER A 153 -2.628 12.201 15.349 1.00 3.11 C ATOM 2305 C SER A 153 -2.178 11.306 16.506 1.00 2.54 C ATOM 2306 O SER A 153 -2.400 11.634 17.672 1.00 2.74 O ATOM 2307 CB SER A 153 -3.219 13.507 15.886 1.00 4.37 C ATOM 2308 OG SER A 153 -3.708 14.341 14.841 1.00 5.29 O ATOM 0 H SER A 153 -4.317 11.002 15.037 1.00 2.23 H new ATOM 0 HA SER A 153 -1.763 12.451 14.734 1.00 3.11 H new ATOM 0 HB2 SER A 153 -4.030 13.280 16.578 1.00 4.37 H new ATOM 0 HB3 SER A 153 -2.458 14.044 16.452 1.00 4.37 H new ATOM 0 HG SER A 153 -4.078 15.163 15.225 1.00 5.29 H new ATOM 2314 N LYS A 154 -1.556 10.194 16.146 1.00 2.17 N ATOM 2315 CA LYS A 154 -1.131 9.220 17.135 1.00 1.82 C ATOM 2316 C LYS A 154 -0.030 8.340 16.538 1.00 1.82 C ATOM 2317 O LYS A 154 0.714 8.779 15.663 1.00 2.09 O ATOM 2318 CB LYS A 154 -2.332 8.430 17.660 1.00 1.47 C ATOM 2319 CG LYS A 154 -2.996 7.631 16.537 1.00 2.90 C ATOM 2320 CD LYS A 154 -3.856 6.499 17.103 1.00 3.24 C ATOM 2321 CE LYS A 154 -5.013 7.053 17.936 1.00 3.50 C ATOM 2322 NZ LYS A 154 -4.732 6.898 19.381 1.00 4.07 N ATOM 0 H LYS A 154 -1.336 9.946 15.181 1.00 2.17 H new ATOM 0 HA LYS A 154 -0.704 9.721 18.004 1.00 1.82 H new ATOM 0 HB2 LYS A 154 -2.009 7.753 18.451 1.00 1.47 H new ATOM 0 HB3 LYS A 154 -3.057 9.114 18.102 1.00 1.47 H new ATOM 0 HG2 LYS A 154 -3.614 8.294 15.931 1.00 2.90 H new ATOM 0 HG3 LYS A 154 -2.232 7.218 15.879 1.00 2.90 H new ATOM 0 HD2 LYS A 154 -4.249 5.893 16.287 1.00 3.24 H new ATOM 0 HD3 LYS A 154 -3.241 5.843 17.719 1.00 3.24 H new ATOM 0 HE2 LYS A 154 -5.167 8.106 17.700 1.00 3.50 H new ATOM 0 HE3 LYS A 154 -5.935 6.531 17.681 1.00 3.50 H new ATOM 0 HZ1 LYS A 154 -5.628 6.885 19.909 1.00 4.07 H new ATOM 0 HZ2 LYS A 154 -4.222 6.006 19.542 1.00 4.07 H new ATOM 0 HZ3 LYS A 154 -4.149 7.694 19.709 1.00 4.07 H new ATOM 2336 N LYS A 155 0.038 7.114 17.036 1.00 1.79 N ATOM 2337 CA LYS A 155 1.083 6.194 16.620 1.00 1.94 C ATOM 2338 C LYS A 155 0.444 4.918 16.068 1.00 1.68 C ATOM 2339 O LYS A 155 0.274 3.941 16.795 1.00 1.94 O ATOM 2340 CB LYS A 155 2.065 5.944 17.768 1.00 2.17 C ATOM 2341 CG LYS A 155 2.750 7.244 18.195 1.00 2.49 C ATOM 2342 CD LYS A 155 3.779 6.984 19.297 1.00 3.10 C ATOM 2343 CE LYS A 155 4.453 8.285 19.736 1.00 3.71 C ATOM 2344 NZ LYS A 155 5.448 8.021 20.799 1.00 4.80 N ATOM 0 H LYS A 155 -0.614 6.736 17.724 1.00 1.79 H new ATOM 0 HA LYS A 155 1.674 6.629 15.814 1.00 1.94 H new ATOM 0 HB2 LYS A 155 1.535 5.512 18.617 1.00 2.17 H new ATOM 0 HB3 LYS A 155 2.816 5.218 17.457 1.00 2.17 H new ATOM 0 HG2 LYS A 155 3.240 7.701 17.335 1.00 2.49 H new ATOM 0 HG3 LYS A 155 2.003 7.954 18.550 1.00 2.49 H new ATOM 0 HD2 LYS A 155 3.291 6.517 20.152 1.00 3.10 H new ATOM 0 HD3 LYS A 155 4.533 6.283 18.938 1.00 3.10 H new ATOM 0 HE2 LYS A 155 4.941 8.755 18.882 1.00 3.71 H new ATOM 0 HE3 LYS A 155 3.702 8.986 20.099 1.00 3.71 H new ATOM 0 HZ1 LYS A 155 5.896 8.915 21.085 1.00 4.80 H new ATOM 0 HZ2 LYS A 155 4.974 7.593 21.620 1.00 4.80 H new ATOM 0 HZ3 LYS A 155 6.175 7.369 20.440 1.00 4.80 H new ATOM 2358 N ILE A 156 0.109 4.969 14.788 1.00 1.34 N ATOM 2359 CA ILE A 156 -0.304 3.772 14.075 1.00 1.18 C ATOM 2360 C ILE A 156 0.901 3.181 13.339 1.00 1.06 C ATOM 2361 O ILE A 156 1.251 3.633 12.250 1.00 1.32 O ATOM 2362 CB ILE A 156 -1.494 4.076 13.162 1.00 1.29 C ATOM 2363 CG1 ILE A 156 -2.648 4.693 13.952 1.00 1.77 C ATOM 2364 CG2 ILE A 156 -1.928 2.826 12.393 1.00 1.59 C ATOM 2365 CD1 ILE A 156 -3.901 4.822 13.083 1.00 1.28 C ATOM 0 H ILE A 156 0.115 5.820 14.226 1.00 1.34 H new ATOM 0 HA ILE A 156 -0.654 3.013 14.775 1.00 1.18 H new ATOM 0 HB ILE A 156 -1.179 4.814 12.425 1.00 1.29 H new ATOM 0 HG12 ILE A 156 -2.868 4.076 14.823 1.00 1.77 H new ATOM 0 HG13 ILE A 156 -2.355 5.675 14.322 1.00 1.77 H new ATOM 0 HG21 ILE A 156 -2.775 3.069 11.752 1.00 1.59 H new ATOM 0 HG22 ILE A 156 -1.100 2.470 11.781 1.00 1.59 H new ATOM 0 HG23 ILE A 156 -2.219 2.048 13.098 1.00 1.59 H new ATOM 0 HD11 ILE A 156 -4.707 5.264 13.669 1.00 1.28 H new ATOM 0 HD12 ILE A 156 -3.685 5.459 12.225 1.00 1.28 H new ATOM 0 HD13 ILE A 156 -4.205 3.835 12.734 1.00 1.28 H new ATOM 2377 N THR A 157 1.503 2.180 13.965 1.00 1.04 N ATOM 2378 CA THR A 157 2.747 1.622 13.461 1.00 1.00 C ATOM 2379 C THR A 157 2.568 0.143 13.117 1.00 0.93 C ATOM 2380 O THR A 157 1.698 -0.526 13.674 1.00 0.97 O ATOM 2381 CB THR A 157 3.836 1.876 14.505 1.00 1.19 C ATOM 2382 OG1 THR A 157 3.624 0.860 15.481 1.00 1.76 O ATOM 2383 CG2 THR A 157 3.617 3.181 15.274 1.00 1.51 C ATOM 0 H THR A 157 1.153 1.741 14.816 1.00 1.04 H new ATOM 0 HA THR A 157 3.049 2.105 12.531 1.00 1.00 H new ATOM 0 HB THR A 157 4.809 1.902 14.015 1.00 1.19 H new ATOM 0 HG1 THR A 157 4.289 0.949 16.196 1.00 1.76 H new ATOM 0 HG21 THR A 157 4.417 3.313 16.002 1.00 1.51 H new ATOM 0 HG22 THR A 157 3.619 4.019 14.577 1.00 1.51 H new ATOM 0 HG23 THR A 157 2.659 3.142 15.792 1.00 1.51 H new ATOM 2391 N ILE A 158 3.404 -0.325 12.201 1.00 0.90 N ATOM 2392 CA ILE A 158 3.378 -1.723 11.809 1.00 0.81 C ATOM 2393 C ILE A 158 4.264 -2.532 12.761 1.00 0.86 C ATOM 2394 O ILE A 158 5.482 -2.366 12.771 1.00 1.01 O ATOM 2395 CB ILE A 158 3.761 -1.874 10.336 1.00 0.81 C ATOM 2396 CG1 ILE A 158 2.725 -1.206 9.430 1.00 1.06 C ATOM 2397 CG2 ILE A 158 3.977 -3.344 9.973 1.00 0.82 C ATOM 2398 CD1 ILE A 158 3.225 -1.136 7.985 1.00 1.30 C ATOM 0 H ILE A 158 4.103 0.240 11.719 1.00 0.90 H new ATOM 0 HA ILE A 158 2.368 -2.124 11.894 1.00 0.81 H new ATOM 0 HB ILE A 158 4.709 -1.361 10.175 1.00 0.81 H new ATOM 0 HG12 ILE A 158 1.789 -1.764 9.468 1.00 1.06 H new ATOM 0 HG13 ILE A 158 2.512 -0.201 9.794 1.00 1.06 H new ATOM 0 HG21 ILE A 158 4.248 -3.423 8.920 1.00 0.82 H new ATOM 0 HG22 ILE A 158 4.778 -3.756 10.586 1.00 0.82 H new ATOM 0 HG23 ILE A 158 3.058 -3.902 10.154 1.00 0.82 H new ATOM 0 HD11 ILE A 158 2.470 -0.657 7.362 1.00 1.30 H new ATOM 0 HD12 ILE A 158 4.148 -0.557 7.947 1.00 1.30 H new ATOM 0 HD13 ILE A 158 3.414 -2.144 7.616 1.00 1.30 H new ATOM 2410 N ALA A 159 3.616 -3.388 13.537 1.00 0.94 N ATOM 2411 CA ALA A 159 4.328 -4.213 14.498 1.00 1.05 C ATOM 2412 C ALA A 159 5.266 -5.164 13.752 1.00 0.97 C ATOM 2413 O ALA A 159 6.478 -5.138 13.961 1.00 1.08 O ATOM 2414 CB ALA A 159 3.322 -4.957 15.377 1.00 1.20 C ATOM 0 H ALA A 159 2.606 -3.528 13.520 1.00 0.94 H new ATOM 0 HA ALA A 159 4.940 -3.595 15.155 1.00 1.05 H new ATOM 0 HB1 ALA A 159 3.856 -5.576 16.098 1.00 1.20 H new ATOM 0 HB2 ALA A 159 2.700 -4.236 15.908 1.00 1.20 H new ATOM 0 HB3 ALA A 159 2.691 -5.590 14.753 1.00 1.20 H new ATOM 2420 N ASP A 160 4.669 -5.982 12.897 1.00 0.86 N ATOM 2421 CA ASP A 160 5.428 -6.980 12.163 1.00 0.81 C ATOM 2422 C ASP A 160 4.674 -7.348 10.883 1.00 0.72 C ATOM 2423 O ASP A 160 3.517 -6.968 10.710 1.00 0.72 O ATOM 2424 CB ASP A 160 5.606 -8.255 12.989 1.00 0.87 C ATOM 2425 CG ASP A 160 6.503 -8.107 14.220 1.00 2.14 C ATOM 2426 OD1 ASP A 160 7.734 -8.034 14.020 1.00 3.57 O ATOM 2427 OD2 ASP A 160 5.935 -8.071 15.334 1.00 2.66 O ATOM 0 H ASP A 160 3.669 -5.974 12.696 1.00 0.86 H new ATOM 0 HA ASP A 160 6.407 -6.558 11.935 1.00 0.81 H new ATOM 0 HB2 ASP A 160 4.624 -8.600 13.313 1.00 0.87 H new ATOM 0 HB3 ASP A 160 6.021 -9.031 12.346 1.00 0.87 H new ATOM 2432 N CYS A 161 5.359 -8.083 10.021 1.00 0.75 N ATOM 2433 CA CYS A 161 4.767 -8.511 8.765 1.00 0.72 C ATOM 2434 C CYS A 161 4.981 -10.019 8.623 1.00 0.93 C ATOM 2435 O CYS A 161 5.832 -10.595 9.298 1.00 1.20 O ATOM 2436 CB CYS A 161 5.341 -7.739 7.576 1.00 1.07 C ATOM 2437 SG CYS A 161 7.168 -7.693 7.682 1.00 2.70 S ATOM 0 H CYS A 161 6.319 -8.394 10.167 1.00 0.75 H new ATOM 0 HA CYS A 161 3.699 -8.295 8.772 1.00 0.72 H new ATOM 0 HB2 CYS A 161 5.035 -8.212 6.643 1.00 1.07 H new ATOM 0 HB3 CYS A 161 4.944 -6.724 7.565 1.00 1.07 H new ATOM 0 HG CYS A 161 7.671 -8.593 6.890 1.00 2.70 H new ATOM 2443 N GLY A 162 4.192 -10.616 7.741 1.00 1.09 N ATOM 2444 CA GLY A 162 4.270 -12.049 7.516 1.00 1.66 C ATOM 2445 C GLY A 162 4.187 -12.375 6.024 1.00 1.02 C ATOM 2446 O GLY A 162 3.925 -11.496 5.206 1.00 1.19 O ATOM 0 H GLY A 162 3.496 -10.133 7.174 1.00 1.09 H new ATOM 0 HA2 GLY A 162 5.204 -12.435 7.925 1.00 1.66 H new ATOM 0 HA3 GLY A 162 3.460 -12.549 8.047 1.00 1.66 H new ATOM 2450 N GLN A 163 4.418 -13.643 5.715 1.00 1.22 N ATOM 2451 CA GLN A 163 4.390 -14.093 4.334 1.00 0.83 C ATOM 2452 C GLN A 163 3.882 -15.534 4.254 1.00 0.90 C ATOM 2453 O GLN A 163 4.528 -16.453 4.757 1.00 1.25 O ATOM 2454 CB GLN A 163 5.771 -13.963 3.687 1.00 1.14 C ATOM 2455 CG GLN A 163 5.673 -14.051 2.163 1.00 1.63 C ATOM 2456 CD GLN A 163 6.998 -14.516 1.555 1.00 1.88 C ATOM 2457 OE1 GLN A 163 7.119 -15.607 1.021 1.00 2.15 O ATOM 2458 NE2 GLN A 163 7.985 -13.630 1.665 1.00 3.27 N ATOM 0 H GLN A 163 4.625 -14.372 6.397 1.00 1.22 H new ATOM 0 HA GLN A 163 3.702 -13.455 3.779 1.00 0.83 H new ATOM 0 HB2 GLN A 163 6.222 -13.012 3.972 1.00 1.14 H new ATOM 0 HB3 GLN A 163 6.426 -14.751 4.059 1.00 1.14 H new ATOM 0 HG2 GLN A 163 4.878 -14.743 1.885 1.00 1.63 H new ATOM 0 HG3 GLN A 163 5.404 -13.077 1.755 1.00 1.63 H new ATOM 0 HE21 GLN A 163 7.818 -12.734 2.124 1.00 3.27 H new ATOM 0 HE22 GLN A 163 8.909 -13.847 1.291 1.00 3.27 H new ATOM 2467 N LEU A 164 2.729 -15.687 3.619 1.00 0.86 N ATOM 2468 CA LEU A 164 2.100 -16.993 3.514 1.00 1.14 C ATOM 2469 C LEU A 164 2.637 -17.715 2.276 1.00 1.38 C ATOM 2470 O LEU A 164 1.933 -17.846 1.276 1.00 1.63 O ATOM 2471 CB LEU A 164 0.575 -16.856 3.533 1.00 1.20 C ATOM 2472 CG LEU A 164 -0.009 -16.034 4.684 1.00 1.20 C ATOM 2473 CD1 LEU A 164 -1.263 -15.279 4.236 1.00 1.41 C ATOM 2474 CD2 LEU A 164 -0.276 -16.914 5.906 1.00 1.63 C ATOM 0 H LEU A 164 2.214 -14.928 3.172 1.00 0.86 H new ATOM 0 HA LEU A 164 2.353 -17.608 4.377 1.00 1.14 H new ATOM 0 HB2 LEU A 164 0.259 -16.404 2.593 1.00 1.20 H new ATOM 0 HB3 LEU A 164 0.140 -17.855 3.569 1.00 1.20 H new ATOM 0 HG LEU A 164 0.728 -15.288 4.980 1.00 1.20 H new ATOM 0 HD11 LEU A 164 -1.659 -14.703 5.072 1.00 1.41 H new ATOM 0 HD12 LEU A 164 -1.009 -14.605 3.418 1.00 1.41 H new ATOM 0 HD13 LEU A 164 -2.015 -15.992 3.898 1.00 1.41 H new ATOM 0 HD21 LEU A 164 -0.691 -16.305 6.709 1.00 1.63 H new ATOM 0 HD22 LEU A 164 -0.986 -17.698 5.642 1.00 1.63 H new ATOM 0 HD23 LEU A 164 0.658 -17.367 6.239 1.00 1.63 H new ATOM 2486 N GLU A 165 3.878 -18.164 2.385 1.00 1.76 N ATOM 2487 CA GLU A 165 4.522 -18.858 1.283 1.00 2.20 C ATOM 2488 C GLU A 165 3.865 -20.223 1.062 1.00 2.69 C ATOM 2489 O GLU A 165 3.167 -20.729 1.939 1.00 2.82 O ATOM 2490 CB GLU A 165 6.025 -19.006 1.531 1.00 2.83 C ATOM 2491 CG GLU A 165 6.298 -19.987 2.674 1.00 3.68 C ATOM 2492 CD GLU A 165 6.767 -21.339 2.136 1.00 4.61 C ATOM 2493 OE1 GLU A 165 7.846 -21.355 1.504 1.00 5.45 O ATOM 2494 OE2 GLU A 165 6.037 -22.327 2.368 1.00 5.28 O ATOM 0 H GLU A 165 4.455 -18.061 3.220 1.00 1.76 H new ATOM 0 HA GLU A 165 4.394 -18.263 0.379 1.00 2.20 H new ATOM 0 HB2 GLU A 165 6.515 -19.356 0.622 1.00 2.83 H new ATOM 0 HB3 GLU A 165 6.455 -18.034 1.771 1.00 2.83 H new ATOM 0 HG2 GLU A 165 7.056 -19.574 3.339 1.00 3.68 H new ATOM 0 HG3 GLU A 165 5.393 -20.122 3.266 1.00 3.68 H new