USER MOD reduce.3.24.130724 H: found=0, std=0, add=1209, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1210 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 146 HIS : no HD1:sc= -0.944 K(o=-0.4,f=-1.6!) USER MOD Set 1.2: A 150 THR OG1 : rot 82:sc= 0.542 USER MOD Set 2.1: A 136 ASN : amide:sc= -1.68 X(o=-0.48,f=-0.78) USER MOD Set 2.2: A 139 THR OG1 : rot -56:sc= 1.2 USER MOD Set 3.1: A 126 ASN : amide:sc= 0.763 K(o=0.39,f=-7.7!) USER MOD Set 3.2: A 156 MET CE :methyl -146:sc= -0.377 (180deg=0) USER MOD Set 4.1: A 25 SER OG : rot -112:sc= 1.19 USER MOD Set 4.2: A 38 THR OG1 : rot -141:sc= 1.8 USER MOD Single : A 11 CYS SG : rot -28:sc= -1.44 USER MOD Single : A 13 SER OG : rot 80:sc= -0.44 USER MOD Single : A 19 GLN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : A 20 THR OG1 : rot 31:sc= 0.14 USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 THR OG1 : rot 54:sc= 0.0728 USER MOD Single : A 27 CYS SG : rot -125:sc= -3.11 USER MOD Single : A 28 GLN : amide:sc= -0.123 X(o=-0.12,f=-0.0024) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 GLN : amide:sc= -0.943 X(o=-0.94,f=-1.1) USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 35 ASN :FLIP amide:sc= -10.1! C(o=-12!,f=-10!) USER MOD Single : A 39 MET CE :methyl -144:sc= -0.0247 (180deg=-0.327) USER MOD Single : A 41 GLN :FLIP amide:sc= -5.33! C(o=-7.2!,f=-5.3!) USER MOD Single : A 44 HIS : no HE2:sc= -1.64 K(o=-1.6,f=-2.8) USER MOD Single : A 45 GLN : amide:sc= -0.355 K(o=-0.36,f=-2.4!) USER MOD Single : A 52 SER OG : rot 180:sc= 0 USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 57 SER OG : rot 87:sc= 1.13 USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 ASN : amide:sc= -0.217 K(o=-0.22,f=-1.8!) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 73 ASN : amide:sc= -2.94! C(o=-2.9!,f=-4.9!) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 LYS NZ :NH3+ 143:sc= 1.22 (180deg=0.122) USER MOD Single : A 79 HIS : no HD1:sc= -0.85 K(o=-0.85,f=-2.4!) USER MOD Single : A 82 THR OG1 : rot -171:sc= -0.967 USER MOD Single : A 83 SER OG : rot -102:sc= 0.843 USER MOD Single : A 84 TYR OH : rot 92:sc= 0.422! USER MOD Single : A 85 TYR OH : rot 60:sc= -0.792 USER MOD Single : A 86 HIS :FLIP no HD1:sc= -5.81! C(o=-7.9!,f=-5.8!) USER MOD Single : A 91 GLN : amide:sc= -0.764 K(o=-0.76,f=-1.8!) USER MOD Single : A 92 GLN : amide:sc= -0.0552 K(o=-0.055,f=-1.7!) USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 102 ASN : amide:sc= 0 X(o=0,f=-0.014) USER MOD Single : A 103 GLN : amide:sc= -0.0876 X(o=-0.088,f=-0.088) USER MOD Single : A 105 THR OG1 : rot 71:sc= 1.03 USER MOD Single : A 107 CYS SG : rot 180:sc= 0 USER MOD Single : A 118 GLN : amide:sc= 0 K(o=0,f=-0.79) USER MOD Single : A 123 CYS SG : rot -7:sc= -2.54! USER MOD Single : A 127 CYS SG : rot -94:sc= 0.851 USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 133 HIS : no HD1:sc= -0.156 X(o=-0.16,f=-0.01) USER MOD Single : A 135 LYS NZ :NH3+ -163:sc= 1.12 (180deg=0.879) USER MOD Single : A 138 MET CE :methyl -128:sc= -0.154 (180deg=-0.483) USER MOD Single : A 143 SER OG : rot 180:sc= 0 USER MOD Single : A 145 GLN : amide:sc= -4.23! C(o=-4.2!,f=-7.9!) USER MOD Single : A 149 MET CE :methyl -118:sc= -0.112 (180deg=-1.73) USER MOD Single : A 153 GLN : amide:sc= -0.0823 X(o=-0.082,f=-0.15) USER MOD Single : A 157 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 66 N LEU A 8 8.616 13.100 -0.882 1.00 0.00 N ATOM 67 CA LEU A 8 7.687 13.496 -1.935 1.00 0.00 C ATOM 68 C LEU A 8 6.245 13.427 -1.444 1.00 0.00 C ATOM 69 O LEU A 8 5.947 12.853 -0.396 1.00 0.00 O ATOM 70 CB LEU A 8 7.864 12.598 -3.161 1.00 0.00 C ATOM 71 CG LEU A 8 6.763 11.563 -3.399 1.00 0.00 C ATOM 72 CD1 LEU A 8 6.772 11.098 -4.847 1.00 0.00 C ATOM 73 CD2 LEU A 8 6.930 10.381 -2.456 1.00 0.00 C ATOM 0 HA LEU A 8 7.907 14.527 -2.212 1.00 0.00 H new ATOM 0 HB2 LEU A 8 7.936 13.233 -4.044 1.00 0.00 H new ATOM 0 HB3 LEU A 8 8.815 12.073 -3.068 1.00 0.00 H new ATOM 0 HG LEU A 8 5.800 12.031 -3.195 1.00 0.00 H new ATOM 0 HD11 LEU A 8 5.982 10.362 -4.998 1.00 0.00 H new ATOM 0 HD12 LEU A 8 6.603 11.951 -5.504 1.00 0.00 H new ATOM 0 HD13 LEU A 8 7.737 10.647 -5.078 1.00 0.00 H new ATOM 0 HD21 LEU A 8 6.138 9.655 -2.639 1.00 0.00 H new ATOM 0 HD22 LEU A 8 7.899 9.913 -2.628 1.00 0.00 H new ATOM 0 HD23 LEU A 8 6.873 10.728 -1.424 1.00 0.00 H new ATOM 85 N PRO A 9 5.326 14.024 -2.218 1.00 0.00 N ATOM 86 CA PRO A 9 3.899 14.041 -1.883 1.00 0.00 C ATOM 87 C PRO A 9 3.256 12.665 -2.012 1.00 0.00 C ATOM 88 O PRO A 9 2.584 12.194 -1.094 1.00 0.00 O ATOM 89 CB PRO A 9 3.306 15.007 -2.911 1.00 0.00 C ATOM 90 CG PRO A 9 4.244 14.955 -4.067 1.00 0.00 C ATOM 91 CD PRO A 9 5.610 14.726 -3.480 1.00 0.00 C ATOM 0 HA PRO A 9 3.727 14.338 -0.849 1.00 0.00 H new ATOM 0 HB2 PRO A 9 2.300 14.705 -3.204 1.00 0.00 H new ATOM 0 HB3 PRO A 9 3.231 16.017 -2.508 1.00 0.00 H new ATOM 0 HG2 PRO A 9 3.974 14.152 -4.753 1.00 0.00 H new ATOM 0 HG3 PRO A 9 4.214 15.884 -4.636 1.00 0.00 H new ATOM 0 HD2 PRO A 9 6.236 14.127 -4.141 1.00 0.00 H new ATOM 0 HD3 PRO A 9 6.136 15.665 -3.308 1.00 0.00 H new ATOM 99 N LEU A 10 3.468 12.023 -3.156 1.00 0.00 N ATOM 100 CA LEU A 10 2.909 10.699 -3.405 1.00 0.00 C ATOM 101 C LEU A 10 3.033 9.814 -2.169 1.00 0.00 C ATOM 102 O LEU A 10 2.199 8.939 -1.934 1.00 0.00 O ATOM 103 CB LEU A 10 3.616 10.040 -4.591 1.00 0.00 C ATOM 104 CG LEU A 10 3.128 8.642 -4.971 1.00 0.00 C ATOM 105 CD1 LEU A 10 1.614 8.624 -5.110 1.00 0.00 C ATOM 106 CD2 LEU A 10 3.789 8.179 -6.261 1.00 0.00 C ATOM 0 H LEU A 10 4.023 12.398 -3.925 1.00 0.00 H new ATOM 0 HA LEU A 10 1.851 10.817 -3.640 1.00 0.00 H new ATOM 0 HB2 LEU A 10 3.507 10.689 -5.460 1.00 0.00 H new ATOM 0 HB3 LEU A 10 4.681 9.983 -4.367 1.00 0.00 H new ATOM 0 HG LEU A 10 3.407 7.952 -4.175 1.00 0.00 H new ATOM 0 HD11 LEU A 10 1.285 7.621 -5.381 1.00 0.00 H new ATOM 0 HD12 LEU A 10 1.158 8.912 -4.163 1.00 0.00 H new ATOM 0 HD13 LEU A 10 1.312 9.327 -5.886 1.00 0.00 H new ATOM 0 HD21 LEU A 10 3.430 7.182 -6.516 1.00 0.00 H new ATOM 0 HD22 LEU A 10 3.541 8.871 -7.066 1.00 0.00 H new ATOM 0 HD23 LEU A 10 4.870 8.152 -6.126 1.00 0.00 H new ATOM 118 N CYS A 11 4.077 10.049 -1.382 1.00 0.00 N ATOM 119 CA CYS A 11 4.310 9.274 -0.169 1.00 0.00 C ATOM 120 C CYS A 11 3.975 10.095 1.073 1.00 0.00 C ATOM 121 O CYS A 11 3.470 9.564 2.062 1.00 0.00 O ATOM 122 CB CYS A 11 5.765 8.806 -0.109 1.00 0.00 C ATOM 123 SG CYS A 11 6.086 7.554 1.155 1.00 0.00 S ATOM 0 H CYS A 11 4.776 10.770 -1.562 1.00 0.00 H new ATOM 0 HA CYS A 11 3.657 8.402 -0.193 1.00 0.00 H new ATOM 0 HB2 CYS A 11 6.047 8.405 -1.082 1.00 0.00 H new ATOM 0 HB3 CYS A 11 6.405 9.668 0.078 1.00 0.00 H new ATOM 0 HG CYS A 11 5.244 7.701 2.135 1.00 0.00 H new ATOM 129 N ASP A 12 4.262 11.390 1.014 1.00 0.00 N ATOM 130 CA ASP A 12 3.992 12.285 2.134 1.00 0.00 C ATOM 131 C ASP A 12 2.491 12.457 2.342 1.00 0.00 C ATOM 132 O ASP A 12 2.057 13.132 3.276 1.00 0.00 O ATOM 133 CB ASP A 12 4.647 13.646 1.896 1.00 0.00 C ATOM 134 CG ASP A 12 4.441 14.599 3.057 1.00 0.00 C ATOM 135 OD1 ASP A 12 5.233 14.539 4.021 1.00 0.00 O ATOM 136 OD2 ASP A 12 3.487 15.404 3.003 1.00 0.00 O ATOM 0 H ASP A 12 4.682 11.844 0.203 1.00 0.00 H new ATOM 0 HA ASP A 12 4.416 11.840 3.034 1.00 0.00 H new ATOM 0 HB2 ASP A 12 5.715 13.508 1.729 1.00 0.00 H new ATOM 0 HB3 ASP A 12 4.237 14.089 0.989 1.00 0.00 H new ATOM 141 N SER A 13 1.703 11.845 1.464 1.00 0.00 N ATOM 142 CA SER A 13 0.250 11.935 1.549 1.00 0.00 C ATOM 143 C SER A 13 -0.364 10.566 1.827 1.00 0.00 C ATOM 144 O SER A 13 -1.205 10.418 2.716 1.00 0.00 O ATOM 145 CB SER A 13 -0.323 12.508 0.251 1.00 0.00 C ATOM 146 OG SER A 13 -0.278 13.925 0.256 1.00 0.00 O ATOM 0 H SER A 13 2.046 11.282 0.686 1.00 0.00 H new ATOM 0 HA SER A 13 -0.000 12.601 2.375 1.00 0.00 H new ATOM 0 HB2 SER A 13 0.242 12.126 -0.599 1.00 0.00 H new ATOM 0 HB3 SER A 13 -1.353 12.174 0.126 1.00 0.00 H new ATOM 0 HG SER A 13 0.627 14.224 0.028 1.00 0.00 H new ATOM 152 N LEU A 14 0.062 9.567 1.062 1.00 0.00 N ATOM 153 CA LEU A 14 -0.445 8.209 1.225 1.00 0.00 C ATOM 154 C LEU A 14 -0.318 7.750 2.674 1.00 0.00 C ATOM 155 O LEU A 14 -1.211 7.092 3.208 1.00 0.00 O ATOM 156 CB LEU A 14 0.311 7.248 0.306 1.00 0.00 C ATOM 157 CG LEU A 14 -0.283 7.046 -1.089 1.00 0.00 C ATOM 158 CD1 LEU A 14 0.703 6.318 -1.989 1.00 0.00 C ATOM 159 CD2 LEU A 14 -1.596 6.282 -1.004 1.00 0.00 C ATOM 0 H LEU A 14 0.757 9.672 0.323 1.00 0.00 H new ATOM 0 HA LEU A 14 -1.501 8.207 0.954 1.00 0.00 H new ATOM 0 HB2 LEU A 14 1.333 7.611 0.195 1.00 0.00 H new ATOM 0 HB3 LEU A 14 0.370 6.277 0.798 1.00 0.00 H new ATOM 0 HG LEU A 14 -0.484 8.026 -1.523 1.00 0.00 H new ATOM 0 HD11 LEU A 14 0.263 6.183 -2.977 1.00 0.00 H new ATOM 0 HD12 LEU A 14 1.618 6.904 -2.076 1.00 0.00 H new ATOM 0 HD13 LEU A 14 0.936 5.344 -1.560 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -2.004 6.148 -2.006 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -1.421 5.307 -0.550 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -2.305 6.844 -0.396 1.00 0.00 H new ATOM 171 N ILE A 15 0.797 8.104 3.305 1.00 0.00 N ATOM 172 CA ILE A 15 1.039 7.731 4.693 1.00 0.00 C ATOM 173 C ILE A 15 -0.174 8.039 5.565 1.00 0.00 C ATOM 174 O ILE A 15 -0.581 7.222 6.391 1.00 0.00 O ATOM 175 CB ILE A 15 2.267 8.463 5.266 1.00 0.00 C ATOM 176 CG1 ILE A 15 3.557 7.839 4.727 1.00 0.00 C ATOM 177 CG2 ILE A 15 2.248 8.420 6.787 1.00 0.00 C ATOM 178 CD1 ILE A 15 4.784 8.690 4.963 1.00 0.00 C ATOM 0 H ILE A 15 1.546 8.648 2.877 1.00 0.00 H new ATOM 0 HA ILE A 15 1.228 6.657 4.703 1.00 0.00 H new ATOM 0 HB ILE A 15 2.229 9.506 4.951 1.00 0.00 H new ATOM 0 HG12 ILE A 15 3.704 6.866 5.196 1.00 0.00 H new ATOM 0 HG13 ILE A 15 3.447 7.664 3.657 1.00 0.00 H new ATOM 0 HG21 ILE A 15 3.122 8.941 7.177 1.00 0.00 H new ATOM 0 HG22 ILE A 15 1.343 8.905 7.153 1.00 0.00 H new ATOM 0 HG23 ILE A 15 2.265 7.383 7.122 1.00 0.00 H new ATOM 0 HD11 ILE A 15 5.660 8.186 4.555 1.00 0.00 H new ATOM 0 HD12 ILE A 15 4.658 9.654 4.471 1.00 0.00 H new ATOM 0 HD13 ILE A 15 4.919 8.844 6.034 1.00 0.00 H new ATOM 190 N ILE A 16 -0.748 9.222 5.374 1.00 0.00 N ATOM 191 CA ILE A 16 -1.916 9.637 6.140 1.00 0.00 C ATOM 192 C ILE A 16 -3.099 8.710 5.884 1.00 0.00 C ATOM 193 O ILE A 16 -3.917 8.471 6.772 1.00 0.00 O ATOM 194 CB ILE A 16 -2.328 11.082 5.802 1.00 0.00 C ATOM 195 CG1 ILE A 16 -1.133 12.025 5.954 1.00 0.00 C ATOM 196 CG2 ILE A 16 -3.478 11.527 6.692 1.00 0.00 C ATOM 197 CD1 ILE A 16 -1.410 13.433 5.475 1.00 0.00 C ATOM 0 H ILE A 16 -0.423 9.910 4.695 1.00 0.00 H new ATOM 0 HA ILE A 16 -1.637 9.585 7.192 1.00 0.00 H new ATOM 0 HB ILE A 16 -2.663 11.115 4.765 1.00 0.00 H new ATOM 0 HG12 ILE A 16 -0.838 12.058 7.003 1.00 0.00 H new ATOM 0 HG13 ILE A 16 -0.288 11.620 5.397 1.00 0.00 H new ATOM 0 HG21 ILE A 16 -3.758 12.550 6.441 1.00 0.00 H new ATOM 0 HG22 ILE A 16 -4.333 10.869 6.538 1.00 0.00 H new ATOM 0 HG23 ILE A 16 -3.169 11.481 7.736 1.00 0.00 H new ATOM 0 HD11 ILE A 16 -0.519 14.046 5.613 1.00 0.00 H new ATOM 0 HD12 ILE A 16 -1.676 13.412 4.418 1.00 0.00 H new ATOM 0 HD13 ILE A 16 -2.234 13.857 6.048 1.00 0.00 H new ATOM 209 N TRP A 17 -3.182 8.189 4.665 1.00 0.00 N ATOM 210 CA TRP A 17 -4.264 7.285 4.292 1.00 0.00 C ATOM 211 C TRP A 17 -4.102 5.931 4.973 1.00 0.00 C ATOM 212 O TRP A 17 -5.033 5.424 5.600 1.00 0.00 O ATOM 213 CB TRP A 17 -4.305 7.105 2.774 1.00 0.00 C ATOM 214 CG TRP A 17 -5.342 6.122 2.320 1.00 0.00 C ATOM 215 CD1 TRP A 17 -6.689 6.331 2.239 1.00 0.00 C ATOM 216 CD2 TRP A 17 -5.115 4.776 1.887 1.00 0.00 C ATOM 217 NE1 TRP A 17 -7.314 5.196 1.782 1.00 0.00 N ATOM 218 CE2 TRP A 17 -6.370 4.228 1.557 1.00 0.00 C ATOM 219 CE3 TRP A 17 -3.975 3.982 1.743 1.00 0.00 C ATOM 220 CZ2 TRP A 17 -6.514 2.922 1.095 1.00 0.00 C ATOM 221 CZ3 TRP A 17 -4.119 2.686 1.285 1.00 0.00 C ATOM 222 CH2 TRP A 17 -5.380 2.167 0.965 1.00 0.00 C ATOM 0 H TRP A 17 -2.513 8.377 3.918 1.00 0.00 H new ATOM 0 HA TRP A 17 -5.204 7.727 4.624 1.00 0.00 H new ATOM 0 HB2 TRP A 17 -4.500 8.070 2.306 1.00 0.00 H new ATOM 0 HB3 TRP A 17 -3.326 6.775 2.428 1.00 0.00 H new ATOM 0 HD1 TRP A 17 -7.189 7.253 2.496 1.00 0.00 H new ATOM 0 HE1 TRP A 17 -8.318 5.091 1.634 1.00 0.00 H new ATOM 0 HE3 TRP A 17 -2.998 4.374 1.985 1.00 0.00 H new ATOM 0 HZ2 TRP A 17 -7.485 2.520 0.848 1.00 0.00 H new ATOM 0 HZ3 TRP A 17 -3.244 2.063 1.172 1.00 0.00 H new ATOM 0 HH2 TRP A 17 -5.459 1.151 0.609 1.00 0.00 H new ATOM 233 N LEU A 18 -2.914 5.348 4.846 1.00 0.00 N ATOM 234 CA LEU A 18 -2.630 4.051 5.450 1.00 0.00 C ATOM 235 C LEU A 18 -2.719 4.127 6.970 1.00 0.00 C ATOM 236 O LEU A 18 -2.883 3.110 7.643 1.00 0.00 O ATOM 237 CB LEU A 18 -1.241 3.566 5.032 1.00 0.00 C ATOM 238 CG LEU A 18 -1.048 2.050 4.977 1.00 0.00 C ATOM 239 CD1 LEU A 18 -1.195 1.443 6.364 1.00 0.00 C ATOM 240 CD2 LEU A 18 -2.039 1.421 4.010 1.00 0.00 C ATOM 0 H LEU A 18 -2.133 5.753 4.330 1.00 0.00 H new ATOM 0 HA LEU A 18 -3.378 3.341 5.097 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -1.016 3.977 4.048 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -0.509 3.980 5.726 1.00 0.00 H new ATOM 0 HG LEU A 18 -0.040 1.844 4.617 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -1.055 0.364 6.306 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -0.446 1.871 7.030 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -2.190 1.659 6.752 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -1.887 0.342 3.984 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -3.055 1.636 4.339 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -1.886 1.833 3.013 1.00 0.00 H new ATOM 252 N GLN A 19 -2.611 5.340 7.504 1.00 0.00 N ATOM 253 CA GLN A 19 -2.680 5.548 8.946 1.00 0.00 C ATOM 254 C GLN A 19 -4.033 5.108 9.495 1.00 0.00 C ATOM 255 O GLN A 19 -4.122 4.566 10.597 1.00 0.00 O ATOM 256 CB GLN A 19 -2.435 7.020 9.282 1.00 0.00 C ATOM 257 CG GLN A 19 -0.972 7.352 9.526 1.00 0.00 C ATOM 258 CD GLN A 19 -0.782 8.711 10.171 1.00 0.00 C ATOM 259 OE1 GLN A 19 -1.742 9.453 10.377 1.00 0.00 O ATOM 260 NE2 GLN A 19 0.463 9.045 10.493 1.00 0.00 N ATOM 0 H GLN A 19 -2.476 6.192 6.960 1.00 0.00 H new ATOM 0 HA GLN A 19 -1.904 4.942 9.413 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -2.808 7.638 8.465 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -3.012 7.283 10.169 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -0.531 6.586 10.164 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -0.434 7.325 8.578 1.00 0.00 H new ATOM 0 HE21 GLN A 19 1.229 8.399 10.304 1.00 0.00 H new ATOM 0 HE22 GLN A 19 0.652 9.947 10.929 1.00 0.00 H new ATOM 269 N THR A 20 -5.087 5.344 8.719 1.00 0.00 N ATOM 270 CA THR A 20 -6.436 4.974 9.128 1.00 0.00 C ATOM 271 C THR A 20 -6.474 3.551 9.673 1.00 0.00 C ATOM 272 O THR A 20 -7.379 3.187 10.423 1.00 0.00 O ATOM 273 CB THR A 20 -7.429 5.090 7.956 1.00 0.00 C ATOM 274 OG1 THR A 20 -7.090 4.149 6.932 1.00 0.00 O ATOM 275 CG2 THR A 20 -7.426 6.498 7.380 1.00 0.00 C ATOM 0 H THR A 20 -5.032 5.790 7.803 1.00 0.00 H new ATOM 0 HA THR A 20 -6.730 5.669 9.914 1.00 0.00 H new ATOM 0 HB THR A 20 -8.428 4.872 8.333 1.00 0.00 H new ATOM 0 HG1 THR A 20 -6.680 3.357 7.338 1.00 0.00 H new ATOM 0 HG21 THR A 20 -8.135 6.555 6.554 1.00 0.00 H new ATOM 0 HG22 THR A 20 -7.714 7.209 8.155 1.00 0.00 H new ATOM 0 HG23 THR A 20 -6.427 6.741 7.018 1.00 0.00 H new ATOM 283 N PHE A 21 -5.484 2.750 9.291 1.00 0.00 N ATOM 284 CA PHE A 21 -5.405 1.365 9.742 1.00 0.00 C ATOM 285 C PHE A 21 -4.523 1.246 10.982 1.00 0.00 C ATOM 286 O PHE A 21 -3.296 1.312 10.894 1.00 0.00 O ATOM 287 CB PHE A 21 -4.858 0.473 8.626 1.00 0.00 C ATOM 288 CG PHE A 21 -5.652 0.552 7.353 1.00 0.00 C ATOM 289 CD1 PHE A 21 -5.630 1.700 6.577 1.00 0.00 C ATOM 290 CD2 PHE A 21 -6.419 -0.522 6.932 1.00 0.00 C ATOM 291 CE1 PHE A 21 -6.359 1.775 5.405 1.00 0.00 C ATOM 292 CE2 PHE A 21 -7.150 -0.453 5.761 1.00 0.00 C ATOM 293 CZ PHE A 21 -7.121 0.698 4.997 1.00 0.00 C ATOM 0 H PHE A 21 -4.726 3.036 8.671 1.00 0.00 H new ATOM 0 HA PHE A 21 -6.411 1.036 10.000 1.00 0.00 H new ATOM 0 HB2 PHE A 21 -3.826 0.755 8.419 1.00 0.00 H new ATOM 0 HB3 PHE A 21 -4.843 -0.560 8.972 1.00 0.00 H new ATOM 0 HD1 PHE A 21 -5.036 2.546 6.892 1.00 0.00 H new ATOM 0 HD2 PHE A 21 -6.446 -1.424 7.526 1.00 0.00 H new ATOM 0 HE1 PHE A 21 -6.333 2.675 4.809 1.00 0.00 H new ATOM 0 HE2 PHE A 21 -7.743 -1.298 5.443 1.00 0.00 H new ATOM 0 HZ PHE A 21 -7.693 0.755 4.083 1.00 0.00 H new ATOM 303 N LYS A 22 -5.156 1.071 12.137 1.00 0.00 N ATOM 304 CA LYS A 22 -4.431 0.942 13.395 1.00 0.00 C ATOM 305 C LYS A 22 -3.955 -0.492 13.605 1.00 0.00 C ATOM 306 O LYS A 22 -3.804 -0.948 14.738 1.00 0.00 O ATOM 307 CB LYS A 22 -5.319 1.372 14.565 1.00 0.00 C ATOM 308 CG LYS A 22 -6.418 0.377 14.892 1.00 0.00 C ATOM 309 CD LYS A 22 -6.699 0.326 16.385 1.00 0.00 C ATOM 310 CE LYS A 22 -7.982 -0.433 16.685 1.00 0.00 C ATOM 311 NZ LYS A 22 -9.168 0.468 16.701 1.00 0.00 N ATOM 0 H LYS A 22 -6.170 1.015 12.228 1.00 0.00 H new ATOM 0 HA LYS A 22 -3.558 1.593 13.350 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -4.697 1.517 15.448 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -5.771 2.336 14.332 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -7.328 0.651 14.359 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -6.129 -0.614 14.541 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -5.864 -0.152 16.897 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -6.775 1.340 16.777 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -8.127 -1.211 15.936 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -7.892 -0.932 17.650 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -10.023 -0.087 16.909 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -9.041 1.196 17.433 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -9.269 0.925 15.772 1.00 0.00 H new ATOM 325 N THR A 23 -3.719 -1.199 12.504 1.00 0.00 N ATOM 326 CA THR A 23 -3.260 -2.581 12.567 1.00 0.00 C ATOM 327 C THR A 23 -2.181 -2.753 13.630 1.00 0.00 C ATOM 328 O THR A 23 -1.637 -1.775 14.140 1.00 0.00 O ATOM 329 CB THR A 23 -2.707 -3.052 11.209 1.00 0.00 C ATOM 330 OG1 THR A 23 -1.786 -2.084 10.693 1.00 0.00 O ATOM 331 CG2 THR A 23 -3.835 -3.268 10.211 1.00 0.00 C ATOM 0 H THR A 23 -3.838 -0.837 11.558 1.00 0.00 H new ATOM 0 HA THR A 23 -4.125 -3.190 12.829 1.00 0.00 H new ATOM 0 HB THR A 23 -2.191 -4.000 11.361 1.00 0.00 H new ATOM 0 HG1 THR A 23 -1.092 -1.904 11.361 1.00 0.00 H new ATOM 0 HG21 THR A 23 -3.420 -3.600 9.259 1.00 0.00 H new ATOM 0 HG22 THR A 23 -4.519 -4.026 10.593 1.00 0.00 H new ATOM 0 HG23 THR A 23 -4.375 -2.333 10.064 1.00 0.00 H new ATOM 339 N ALA A 24 -1.875 -4.004 13.958 1.00 0.00 N ATOM 340 CA ALA A 24 -0.859 -4.305 14.958 1.00 0.00 C ATOM 341 C ALA A 24 0.431 -3.541 14.677 1.00 0.00 C ATOM 342 O ALA A 24 1.256 -3.348 15.570 1.00 0.00 O ATOM 343 CB ALA A 24 -0.589 -5.802 15.004 1.00 0.00 C ATOM 0 H ALA A 24 -2.317 -4.826 13.545 1.00 0.00 H new ATOM 0 HA ALA A 24 -1.236 -3.986 15.930 1.00 0.00 H new ATOM 0 HB1 ALA A 24 0.172 -6.012 15.756 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -1.508 -6.330 15.261 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -0.238 -6.139 14.029 1.00 0.00 H new ATOM 349 N SER A 25 0.598 -3.110 13.431 1.00 0.00 N ATOM 350 CA SER A 25 1.790 -2.372 13.031 1.00 0.00 C ATOM 351 C SER A 25 1.466 -0.898 12.806 1.00 0.00 C ATOM 352 O SER A 25 0.537 -0.544 12.079 1.00 0.00 O ATOM 353 CB SER A 25 2.386 -2.974 11.758 1.00 0.00 C ATOM 354 OG SER A 25 3.676 -2.446 11.499 1.00 0.00 O ATOM 0 H SER A 25 -0.077 -3.259 12.681 1.00 0.00 H new ATOM 0 HA SER A 25 2.521 -2.447 13.836 1.00 0.00 H new ATOM 0 HB2 SER A 25 2.447 -4.058 11.858 1.00 0.00 H new ATOM 0 HB3 SER A 25 1.729 -2.768 10.913 1.00 0.00 H new ATOM 0 HG SER A 25 3.645 -1.885 10.696 1.00 0.00 H new ATOM 360 N PRO A 26 2.249 -0.016 13.445 1.00 0.00 N ATOM 361 CA PRO A 26 2.066 1.434 13.331 1.00 0.00 C ATOM 362 C PRO A 26 2.438 1.958 11.948 1.00 0.00 C ATOM 363 O PRO A 26 2.753 1.182 11.044 1.00 0.00 O ATOM 364 CB PRO A 26 3.019 1.996 14.389 1.00 0.00 C ATOM 365 CG PRO A 26 4.067 0.949 14.550 1.00 0.00 C ATOM 366 CD PRO A 26 3.375 -0.367 14.328 1.00 0.00 C ATOM 0 HA PRO A 26 1.026 1.726 13.476 1.00 0.00 H new ATOM 0 HB2 PRO A 26 3.452 2.943 14.068 1.00 0.00 H new ATOM 0 HB3 PRO A 26 2.500 2.185 15.329 1.00 0.00 H new ATOM 0 HG2 PRO A 26 4.874 1.091 13.832 1.00 0.00 H new ATOM 0 HG3 PRO A 26 4.513 0.993 15.544 1.00 0.00 H new ATOM 0 HD2 PRO A 26 4.038 -1.096 13.863 1.00 0.00 H new ATOM 0 HD3 PRO A 26 3.030 -0.803 15.266 1.00 0.00 H new ATOM 374 N CYS A 27 2.398 3.276 11.790 1.00 0.00 N ATOM 375 CA CYS A 27 2.730 3.903 10.516 1.00 0.00 C ATOM 376 C CYS A 27 2.966 5.400 10.692 1.00 0.00 C ATOM 377 O CYS A 27 2.022 6.170 10.862 1.00 0.00 O ATOM 378 CB CYS A 27 1.612 3.667 9.500 1.00 0.00 C ATOM 379 SG CYS A 27 1.611 4.833 8.118 1.00 0.00 S ATOM 0 H CYS A 27 2.139 3.931 12.528 1.00 0.00 H new ATOM 0 HA CYS A 27 3.649 3.449 10.145 1.00 0.00 H new ATOM 0 HB2 CYS A 27 1.701 2.654 9.107 1.00 0.00 H new ATOM 0 HB3 CYS A 27 0.652 3.727 10.012 1.00 0.00 H new ATOM 0 HG CYS A 27 0.445 5.401 8.030 1.00 0.00 H new ATOM 385 N GLN A 28 4.232 5.803 10.650 1.00 0.00 N ATOM 386 CA GLN A 28 4.592 7.207 10.808 1.00 0.00 C ATOM 387 C GLN A 28 5.489 7.671 9.666 1.00 0.00 C ATOM 388 O GLN A 28 5.053 8.404 8.778 1.00 0.00 O ATOM 389 CB GLN A 28 5.296 7.428 12.148 1.00 0.00 C ATOM 390 CG GLN A 28 4.439 7.071 13.352 1.00 0.00 C ATOM 391 CD GLN A 28 3.344 8.088 13.611 1.00 0.00 C ATOM 392 OE1 GLN A 28 2.164 7.743 13.677 1.00 0.00 O ATOM 393 NE2 GLN A 28 3.731 9.349 13.760 1.00 0.00 N ATOM 0 H GLN A 28 5.025 5.177 10.508 1.00 0.00 H new ATOM 0 HA GLN A 28 3.675 7.795 10.787 1.00 0.00 H new ATOM 0 HB2 GLN A 28 6.208 6.832 12.172 1.00 0.00 H new ATOM 0 HB3 GLN A 28 5.596 8.473 12.223 1.00 0.00 H new ATOM 0 HG2 GLN A 28 3.989 6.091 13.195 1.00 0.00 H new ATOM 0 HG3 GLN A 28 5.074 6.993 14.235 1.00 0.00 H new ATOM 0 HE21 GLN A 28 4.720 9.590 13.697 1.00 0.00 H new ATOM 0 HE22 GLN A 28 3.039 10.077 13.937 1.00 0.00 H new ATOM 402 N ASP A 29 6.745 7.239 9.695 1.00 0.00 N ATOM 403 CA ASP A 29 7.705 7.609 8.661 1.00 0.00 C ATOM 404 C ASP A 29 7.886 6.476 7.656 1.00 0.00 C ATOM 405 O ASP A 29 7.586 5.318 7.949 1.00 0.00 O ATOM 406 CB ASP A 29 9.052 7.969 9.291 1.00 0.00 C ATOM 407 CG ASP A 29 9.801 9.019 8.495 1.00 0.00 C ATOM 408 OD1 ASP A 29 9.213 10.084 8.217 1.00 0.00 O ATOM 409 OD2 ASP A 29 10.976 8.775 8.149 1.00 0.00 O ATOM 0 H ASP A 29 7.122 6.632 10.423 1.00 0.00 H new ATOM 0 HA ASP A 29 7.315 8.479 8.133 1.00 0.00 H new ATOM 0 HB2 ASP A 29 8.890 8.334 10.305 1.00 0.00 H new ATOM 0 HB3 ASP A 29 9.665 7.071 9.369 1.00 0.00 H new ATOM 414 N VAL A 30 8.377 6.817 6.469 1.00 0.00 N ATOM 415 CA VAL A 30 8.597 5.829 5.420 1.00 0.00 C ATOM 416 C VAL A 30 9.493 4.697 5.911 1.00 0.00 C ATOM 417 O VAL A 30 9.342 3.547 5.499 1.00 0.00 O ATOM 418 CB VAL A 30 9.233 6.468 4.171 1.00 0.00 C ATOM 419 CG1 VAL A 30 8.623 7.834 3.901 1.00 0.00 C ATOM 420 CG2 VAL A 30 10.742 6.572 4.336 1.00 0.00 C ATOM 0 H VAL A 30 8.630 7.771 6.210 1.00 0.00 H new ATOM 0 HA VAL A 30 7.620 5.426 5.155 1.00 0.00 H new ATOM 0 HB VAL A 30 9.027 5.829 3.312 1.00 0.00 H new ATOM 0 HG11 VAL A 30 9.085 8.270 3.015 1.00 0.00 H new ATOM 0 HG12 VAL A 30 7.551 7.728 3.736 1.00 0.00 H new ATOM 0 HG13 VAL A 30 8.796 8.485 4.758 1.00 0.00 H new ATOM 0 HG21 VAL A 30 11.175 7.026 3.444 1.00 0.00 H new ATOM 0 HG22 VAL A 30 10.971 7.189 5.205 1.00 0.00 H new ATOM 0 HG23 VAL A 30 11.162 5.576 4.477 1.00 0.00 H new ATOM 430 N LYS A 31 10.428 5.031 6.794 1.00 0.00 N ATOM 431 CA LYS A 31 11.349 4.044 7.344 1.00 0.00 C ATOM 432 C LYS A 31 10.637 3.128 8.336 1.00 0.00 C ATOM 433 O LYS A 31 11.196 2.126 8.779 1.00 0.00 O ATOM 434 CB LYS A 31 12.526 4.740 8.031 1.00 0.00 C ATOM 435 CG LYS A 31 12.946 6.033 7.354 1.00 0.00 C ATOM 436 CD LYS A 31 14.403 6.361 7.635 1.00 0.00 C ATOM 437 CE LYS A 31 14.961 7.340 6.613 1.00 0.00 C ATOM 438 NZ LYS A 31 16.244 7.944 7.067 1.00 0.00 N ATOM 0 H LYS A 31 10.568 5.979 7.144 1.00 0.00 H new ATOM 0 HA LYS A 31 11.725 3.437 6.520 1.00 0.00 H new ATOM 0 HB2 LYS A 31 12.258 4.952 9.066 1.00 0.00 H new ATOM 0 HB3 LYS A 31 13.377 4.059 8.055 1.00 0.00 H new ATOM 0 HG2 LYS A 31 12.792 5.948 6.278 1.00 0.00 H new ATOM 0 HG3 LYS A 31 12.314 6.850 7.703 1.00 0.00 H new ATOM 0 HD2 LYS A 31 14.495 6.785 8.635 1.00 0.00 H new ATOM 0 HD3 LYS A 31 14.993 5.444 7.622 1.00 0.00 H new ATOM 0 HE2 LYS A 31 15.117 6.826 5.665 1.00 0.00 H new ATOM 0 HE3 LYS A 31 14.232 8.130 6.431 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 16.592 8.605 6.343 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 16.090 8.456 7.959 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 16.948 7.193 7.216 1.00 0.00 H new ATOM 452 N GLN A 32 9.402 3.480 8.677 1.00 0.00 N ATOM 453 CA GLN A 32 8.615 2.689 9.615 1.00 0.00 C ATOM 454 C GLN A 32 7.691 1.727 8.875 1.00 0.00 C ATOM 455 O GLN A 32 7.311 0.683 9.405 1.00 0.00 O ATOM 456 CB GLN A 32 7.794 3.605 10.524 1.00 0.00 C ATOM 457 CG GLN A 32 8.518 4.003 11.800 1.00 0.00 C ATOM 458 CD GLN A 32 7.581 4.561 12.853 1.00 0.00 C ATOM 459 OE1 GLN A 32 7.831 5.623 13.424 1.00 0.00 O ATOM 460 NE2 GLN A 32 6.494 3.845 13.117 1.00 0.00 N ATOM 0 H GLN A 32 8.925 4.307 8.318 1.00 0.00 H new ATOM 0 HA GLN A 32 9.304 2.105 10.226 1.00 0.00 H new ATOM 0 HB2 GLN A 32 7.526 4.506 9.972 1.00 0.00 H new ATOM 0 HB3 GLN A 32 6.863 3.103 10.786 1.00 0.00 H new ATOM 0 HG2 GLN A 32 9.037 3.134 12.205 1.00 0.00 H new ATOM 0 HG3 GLN A 32 9.278 4.748 11.565 1.00 0.00 H new ATOM 0 HE21 GLN A 32 6.326 2.970 12.620 1.00 0.00 H new ATOM 0 HE22 GLN A 32 5.827 4.170 13.817 1.00 0.00 H new ATOM 469 N LEU A 33 7.332 2.086 7.647 1.00 0.00 N ATOM 470 CA LEU A 33 6.451 1.255 6.833 1.00 0.00 C ATOM 471 C LEU A 33 7.249 0.203 6.070 1.00 0.00 C ATOM 472 O LEU A 33 6.761 -0.899 5.816 1.00 0.00 O ATOM 473 CB LEU A 33 5.661 2.123 5.853 1.00 0.00 C ATOM 474 CG LEU A 33 4.504 2.926 6.449 1.00 0.00 C ATOM 475 CD1 LEU A 33 3.356 2.004 6.830 1.00 0.00 C ATOM 476 CD2 LEU A 33 4.974 3.722 7.658 1.00 0.00 C ATOM 0 H LEU A 33 7.637 2.947 7.193 1.00 0.00 H new ATOM 0 HA LEU A 33 5.755 0.745 7.499 1.00 0.00 H new ATOM 0 HB2 LEU A 33 6.352 2.818 5.376 1.00 0.00 H new ATOM 0 HB3 LEU A 33 5.264 1.480 5.068 1.00 0.00 H new ATOM 0 HG LEU A 33 4.146 3.627 5.694 1.00 0.00 H new ATOM 0 HD11 LEU A 33 2.542 2.592 7.252 1.00 0.00 H new ATOM 0 HD12 LEU A 33 3.002 1.478 5.943 1.00 0.00 H new ATOM 0 HD13 LEU A 33 3.701 1.279 7.568 1.00 0.00 H new ATOM 0 HD21 LEU A 33 4.138 4.287 8.069 1.00 0.00 H new ATOM 0 HD22 LEU A 33 5.358 3.039 8.416 1.00 0.00 H new ATOM 0 HD23 LEU A 33 5.763 4.410 7.356 1.00 0.00 H new ATOM 488 N THR A 34 8.480 0.549 5.706 1.00 0.00 N ATOM 489 CA THR A 34 9.346 -0.366 4.973 1.00 0.00 C ATOM 490 C THR A 34 9.191 -1.795 5.480 1.00 0.00 C ATOM 491 O THR A 34 9.373 -2.753 4.730 1.00 0.00 O ATOM 492 CB THR A 34 10.825 0.049 5.085 1.00 0.00 C ATOM 493 OG1 THR A 34 11.102 0.525 6.407 1.00 0.00 O ATOM 494 CG2 THR A 34 11.161 1.132 4.070 1.00 0.00 C ATOM 0 H THR A 34 8.900 1.457 5.907 1.00 0.00 H new ATOM 0 HA THR A 34 9.042 -0.320 3.927 1.00 0.00 H new ATOM 0 HB THR A 34 11.442 -0.826 4.878 1.00 0.00 H new ATOM 0 HG1 THR A 34 12.045 0.785 6.470 1.00 0.00 H new ATOM 0 HG21 THR A 34 12.211 1.409 4.168 1.00 0.00 H new ATOM 0 HG22 THR A 34 10.977 0.757 3.063 1.00 0.00 H new ATOM 0 HG23 THR A 34 10.536 2.007 4.251 1.00 0.00 H new ATOM 502 N ASN A 35 8.854 -1.931 6.758 1.00 0.00 N ATOM 503 CA ASN A 35 8.674 -3.245 7.366 1.00 0.00 C ATOM 504 C ASN A 35 8.024 -4.214 6.384 1.00 0.00 C ATOM 505 O ASN A 35 8.492 -5.337 6.202 1.00 0.00 O ATOM 506 CB ASN A 35 7.820 -3.133 8.630 1.00 0.00 C ATOM 507 CG ASN A 35 8.156 -4.202 9.652 1.00 0.00 C ATOM 508 OD1 ASN A 35 8.106 -5.460 9.230 1.00 0.00 O flip ATOM 509 ND2 ASN A 35 8.458 -3.900 10.807 1.00 0.00 N flip ATOM 0 H ASN A 35 8.700 -1.148 7.393 1.00 0.00 H new ATOM 0 HA ASN A 35 9.657 -3.632 7.634 1.00 0.00 H new ATOM 0 HB2 ASN A 35 7.964 -2.149 9.077 1.00 0.00 H new ATOM 0 HB3 ASN A 35 6.766 -3.210 8.361 1.00 0.00 H new ATOM 0 HD21 ASN A 35 8.484 -2.920 11.088 1.00 0.00 H new ATOM 0 HD22 ASN A 35 8.682 -4.630 11.483 1.00 0.00 H new ATOM 516 N GLY A 36 6.941 -3.771 5.752 1.00 0.00 N ATOM 517 CA GLY A 36 6.244 -4.611 4.795 1.00 0.00 C ATOM 518 C GLY A 36 5.034 -5.295 5.399 1.00 0.00 C ATOM 519 O GLY A 36 4.329 -6.041 4.718 1.00 0.00 O ATOM 0 H GLY A 36 6.534 -2.845 5.886 1.00 0.00 H new ATOM 0 HA2 GLY A 36 5.929 -4.005 3.946 1.00 0.00 H new ATOM 0 HA3 GLY A 36 6.930 -5.366 4.411 1.00 0.00 H new ATOM 523 N VAL A 37 4.791 -5.042 6.681 1.00 0.00 N ATOM 524 CA VAL A 37 3.657 -5.640 7.376 1.00 0.00 C ATOM 525 C VAL A 37 2.462 -4.693 7.393 1.00 0.00 C ATOM 526 O VAL A 37 1.384 -5.027 6.900 1.00 0.00 O ATOM 527 CB VAL A 37 4.022 -6.014 8.825 1.00 0.00 C ATOM 528 CG1 VAL A 37 2.901 -6.818 9.467 1.00 0.00 C ATOM 529 CG2 VAL A 37 5.331 -6.787 8.862 1.00 0.00 C ATOM 0 H VAL A 37 5.364 -4.427 7.259 1.00 0.00 H new ATOM 0 HA VAL A 37 3.392 -6.545 6.830 1.00 0.00 H new ATOM 0 HB VAL A 37 4.153 -5.095 9.397 1.00 0.00 H new ATOM 0 HG11 VAL A 37 3.176 -7.073 10.490 1.00 0.00 H new ATOM 0 HG12 VAL A 37 1.986 -6.225 9.475 1.00 0.00 H new ATOM 0 HG13 VAL A 37 2.736 -7.732 8.897 1.00 0.00 H new ATOM 0 HG21 VAL A 37 5.573 -7.043 9.893 1.00 0.00 H new ATOM 0 HG22 VAL A 37 5.231 -7.700 8.275 1.00 0.00 H new ATOM 0 HG23 VAL A 37 6.128 -6.173 8.444 1.00 0.00 H new ATOM 539 N THR A 38 2.660 -3.509 7.964 1.00 0.00 N ATOM 540 CA THR A 38 1.598 -2.513 8.046 1.00 0.00 C ATOM 541 C THR A 38 0.782 -2.473 6.759 1.00 0.00 C ATOM 542 O THR A 38 -0.406 -2.152 6.777 1.00 0.00 O ATOM 543 CB THR A 38 2.166 -1.109 8.325 1.00 0.00 C ATOM 544 OG1 THR A 38 3.105 -1.165 9.405 1.00 0.00 O ATOM 545 CG2 THR A 38 1.051 -0.132 8.666 1.00 0.00 C ATOM 0 H THR A 38 3.546 -3.216 8.377 1.00 0.00 H new ATOM 0 HA THR A 38 0.952 -2.806 8.873 1.00 0.00 H new ATOM 0 HB THR A 38 2.670 -0.760 7.424 1.00 0.00 H new ATOM 0 HG1 THR A 38 2.999 -0.373 9.972 1.00 0.00 H new ATOM 0 HG21 THR A 38 1.477 0.853 8.859 1.00 0.00 H new ATOM 0 HG22 THR A 38 0.354 -0.069 7.830 1.00 0.00 H new ATOM 0 HG23 THR A 38 0.522 -0.479 9.554 1.00 0.00 H new ATOM 553 N MET A 39 1.427 -2.801 5.644 1.00 0.00 N ATOM 554 CA MET A 39 0.759 -2.803 4.348 1.00 0.00 C ATOM 555 C MET A 39 -0.056 -4.079 4.159 1.00 0.00 C ATOM 556 O MET A 39 -1.207 -4.032 3.725 1.00 0.00 O ATOM 557 CB MET A 39 1.784 -2.668 3.221 1.00 0.00 C ATOM 558 CG MET A 39 2.345 -1.262 3.075 1.00 0.00 C ATOM 559 SD MET A 39 3.758 -0.963 4.154 1.00 0.00 S ATOM 560 CE MET A 39 5.116 -1.270 3.028 1.00 0.00 C ATOM 0 H MET A 39 2.411 -3.069 5.612 1.00 0.00 H new ATOM 0 HA MET A 39 0.081 -1.951 4.316 1.00 0.00 H new ATOM 0 HB2 MET A 39 2.605 -3.361 3.403 1.00 0.00 H new ATOM 0 HB3 MET A 39 1.319 -2.964 2.281 1.00 0.00 H new ATOM 0 HG2 MET A 39 2.643 -1.100 2.039 1.00 0.00 H new ATOM 0 HG3 MET A 39 1.562 -0.537 3.299 1.00 0.00 H new ATOM 0 HE1 MET A 39 5.935 -1.747 3.567 1.00 0.00 H new ATOM 0 HE2 MET A 39 4.781 -1.925 2.224 1.00 0.00 H new ATOM 0 HE3 MET A 39 5.460 -0.325 2.607 1.00 0.00 H new ATOM 570 N ALA A 40 0.548 -5.216 4.488 1.00 0.00 N ATOM 571 CA ALA A 40 -0.123 -6.503 4.356 1.00 0.00 C ATOM 572 C ALA A 40 -1.335 -6.588 5.278 1.00 0.00 C ATOM 573 O ALA A 40 -2.370 -7.140 4.906 1.00 0.00 O ATOM 574 CB ALA A 40 0.848 -7.637 4.651 1.00 0.00 C ATOM 0 H ALA A 40 1.501 -5.272 4.848 1.00 0.00 H new ATOM 0 HA ALA A 40 -0.474 -6.598 3.329 1.00 0.00 H new ATOM 0 HB1 ALA A 40 0.333 -8.592 4.549 1.00 0.00 H new ATOM 0 HB2 ALA A 40 1.680 -7.596 3.948 1.00 0.00 H new ATOM 0 HB3 ALA A 40 1.227 -7.536 5.668 1.00 0.00 H new ATOM 580 N GLN A 41 -1.197 -6.039 6.480 1.00 0.00 N ATOM 581 CA GLN A 41 -2.282 -6.054 7.455 1.00 0.00 C ATOM 582 C GLN A 41 -3.467 -5.229 6.964 1.00 0.00 C ATOM 583 O GLN A 41 -4.618 -5.525 7.285 1.00 0.00 O ATOM 584 CB GLN A 41 -1.793 -5.517 8.801 1.00 0.00 C ATOM 585 CG GLN A 41 -1.064 -6.553 9.641 1.00 0.00 C ATOM 586 CD GLN A 41 -1.175 -6.282 11.129 1.00 0.00 C ATOM 587 OE1 GLN A 41 -0.033 -6.160 11.795 1.00 0.00 O flip ATOM 588 NE2 GLN A 41 -2.275 -6.183 11.673 1.00 0.00 N flip ATOM 0 H GLN A 41 -0.346 -5.579 6.802 1.00 0.00 H new ATOM 0 HA GLN A 41 -2.610 -7.086 7.581 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -1.129 -4.671 8.625 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -2.647 -5.140 9.364 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -1.470 -7.541 9.424 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -0.012 -6.571 9.356 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -3.127 -6.284 11.122 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -2.334 -6.000 12.675 1.00 0.00 H new ATOM 597 N VAL A 42 -3.177 -4.192 6.185 1.00 0.00 N ATOM 598 CA VAL A 42 -4.219 -3.323 5.650 1.00 0.00 C ATOM 599 C VAL A 42 -4.996 -4.019 4.537 1.00 0.00 C ATOM 600 O VAL A 42 -6.214 -3.870 4.429 1.00 0.00 O ATOM 601 CB VAL A 42 -3.628 -2.009 5.104 1.00 0.00 C ATOM 602 CG1 VAL A 42 -4.614 -1.330 4.166 1.00 0.00 C ATOM 603 CG2 VAL A 42 -3.244 -1.083 6.248 1.00 0.00 C ATOM 0 H VAL A 42 -2.229 -3.933 5.910 1.00 0.00 H new ATOM 0 HA VAL A 42 -4.895 -3.094 6.474 1.00 0.00 H new ATOM 0 HB VAL A 42 -2.727 -2.243 4.538 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -4.180 -0.404 3.790 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -4.836 -1.993 3.329 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -5.534 -1.106 4.705 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -2.828 -0.160 5.845 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -4.128 -0.854 6.843 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -2.500 -1.571 6.877 1.00 0.00 H new ATOM 613 N LEU A 43 -4.284 -4.779 3.712 1.00 0.00 N ATOM 614 CA LEU A 43 -4.907 -5.499 2.607 1.00 0.00 C ATOM 615 C LEU A 43 -5.954 -6.483 3.120 1.00 0.00 C ATOM 616 O LEU A 43 -6.952 -6.749 2.449 1.00 0.00 O ATOM 617 CB LEU A 43 -3.845 -6.243 1.795 1.00 0.00 C ATOM 618 CG LEU A 43 -3.048 -5.399 0.800 1.00 0.00 C ATOM 619 CD1 LEU A 43 -1.910 -6.211 0.203 1.00 0.00 C ATOM 620 CD2 LEU A 43 -3.958 -4.866 -0.297 1.00 0.00 C ATOM 0 H LEU A 43 -3.276 -4.912 3.787 1.00 0.00 H new ATOM 0 HA LEU A 43 -5.403 -4.772 1.965 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -3.145 -6.708 2.489 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -4.333 -7.049 1.248 1.00 0.00 H new ATOM 0 HG LEU A 43 -2.620 -4.550 1.334 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -1.354 -5.594 -0.503 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -1.243 -6.543 0.999 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -2.316 -7.079 -0.316 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -3.373 -4.268 -0.996 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -4.415 -5.701 -0.828 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -4.738 -4.247 0.146 1.00 0.00 H new ATOM 632 N HIS A 44 -5.719 -7.020 4.313 1.00 0.00 N ATOM 633 CA HIS A 44 -6.644 -7.973 4.917 1.00 0.00 C ATOM 634 C HIS A 44 -7.978 -7.307 5.238 1.00 0.00 C ATOM 635 O HIS A 44 -8.979 -7.984 5.473 1.00 0.00 O ATOM 636 CB HIS A 44 -6.038 -8.567 6.189 1.00 0.00 C ATOM 637 CG HIS A 44 -6.974 -9.469 6.934 1.00 0.00 C ATOM 638 ND1 HIS A 44 -7.040 -10.829 6.716 1.00 0.00 N ATOM 639 CD2 HIS A 44 -7.883 -9.199 7.899 1.00 0.00 C ATOM 640 CE1 HIS A 44 -7.951 -11.356 7.515 1.00 0.00 C ATOM 641 NE2 HIS A 44 -8.477 -10.388 8.243 1.00 0.00 N ATOM 0 H HIS A 44 -4.897 -6.812 4.880 1.00 0.00 H new ATOM 0 HA HIS A 44 -6.822 -8.774 4.199 1.00 0.00 H new ATOM 0 HB2 HIS A 44 -5.140 -9.126 5.927 1.00 0.00 H new ATOM 0 HB3 HIS A 44 -5.728 -7.755 6.847 1.00 0.00 H new ATOM 0 HD1 HIS A 44 -6.474 -11.347 6.044 1.00 0.00 H new ATOM 0 HD2 HIS A 44 -8.101 -8.229 8.320 1.00 0.00 H new ATOM 0 HE1 HIS A 44 -8.220 -12.401 7.564 1.00 0.00 H new ATOM 650 N GLN A 45 -7.984 -5.978 5.246 1.00 0.00 N ATOM 651 CA GLN A 45 -9.196 -5.222 5.539 1.00 0.00 C ATOM 652 C GLN A 45 -9.961 -4.902 4.260 1.00 0.00 C ATOM 653 O GLN A 45 -11.192 -4.892 4.247 1.00 0.00 O ATOM 654 CB GLN A 45 -8.848 -3.928 6.277 1.00 0.00 C ATOM 655 CG GLN A 45 -7.914 -4.133 7.459 1.00 0.00 C ATOM 656 CD GLN A 45 -8.090 -3.078 8.532 1.00 0.00 C ATOM 657 OE1 GLN A 45 -8.997 -2.247 8.460 1.00 0.00 O ATOM 658 NE2 GLN A 45 -7.223 -3.104 9.537 1.00 0.00 N ATOM 0 H GLN A 45 -7.164 -5.403 5.053 1.00 0.00 H new ATOM 0 HA GLN A 45 -9.832 -5.836 6.176 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -8.386 -3.233 5.576 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -9.768 -3.461 6.629 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -8.092 -5.118 7.891 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -6.882 -4.120 7.108 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -6.487 -3.810 9.557 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -7.293 -2.418 10.289 1.00 0.00 H new ATOM 667 N ILE A 46 -9.224 -4.640 3.185 1.00 0.00 N ATOM 668 CA ILE A 46 -9.834 -4.320 1.901 1.00 0.00 C ATOM 669 C ILE A 46 -10.698 -5.473 1.400 1.00 0.00 C ATOM 670 O ILE A 46 -11.913 -5.333 1.253 1.00 0.00 O ATOM 671 CB ILE A 46 -8.769 -3.993 0.837 1.00 0.00 C ATOM 672 CG1 ILE A 46 -7.847 -2.878 1.334 1.00 0.00 C ATOM 673 CG2 ILE A 46 -9.433 -3.595 -0.472 1.00 0.00 C ATOM 674 CD1 ILE A 46 -6.655 -2.634 0.436 1.00 0.00 C ATOM 0 H ILE A 46 -8.204 -4.643 3.178 1.00 0.00 H new ATOM 0 HA ILE A 46 -10.460 -3.442 2.060 1.00 0.00 H new ATOM 0 HB ILE A 46 -8.167 -4.884 0.660 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -8.421 -1.955 1.421 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -7.493 -3.129 2.334 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -8.667 -3.367 -1.214 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -10.052 -4.417 -0.831 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -10.056 -2.715 -0.311 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -6.046 -1.831 0.850 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -6.058 -3.544 0.368 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -7.000 -2.352 -0.559 1.00 0.00 H new ATOM 686 N ASP A 47 -10.065 -6.611 1.142 1.00 0.00 N ATOM 687 CA ASP A 47 -10.776 -7.790 0.661 1.00 0.00 C ATOM 688 C ASP A 47 -10.347 -9.035 1.431 1.00 0.00 C ATOM 689 O ASP A 47 -9.528 -9.821 0.955 1.00 0.00 O ATOM 690 CB ASP A 47 -10.524 -7.989 -0.835 1.00 0.00 C ATOM 691 CG ASP A 47 -11.491 -8.976 -1.458 1.00 0.00 C ATOM 692 OD1 ASP A 47 -11.628 -10.093 -0.919 1.00 0.00 O ATOM 693 OD2 ASP A 47 -12.111 -8.631 -2.486 1.00 0.00 O ATOM 0 H ASP A 47 -9.060 -6.743 1.258 1.00 0.00 H new ATOM 0 HA ASP A 47 -11.842 -7.633 0.824 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -10.609 -7.030 -1.346 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -9.503 -8.341 -0.985 1.00 0.00 H new ATOM 698 N VAL A 48 -10.906 -9.208 2.625 1.00 0.00 N ATOM 699 CA VAL A 48 -10.582 -10.357 3.462 1.00 0.00 C ATOM 700 C VAL A 48 -10.620 -11.651 2.657 1.00 0.00 C ATOM 701 O VAL A 48 -9.960 -12.630 3.004 1.00 0.00 O ATOM 702 CB VAL A 48 -11.553 -10.476 4.652 1.00 0.00 C ATOM 703 CG1 VAL A 48 -12.827 -11.193 4.232 1.00 0.00 C ATOM 704 CG2 VAL A 48 -10.884 -11.196 5.814 1.00 0.00 C ATOM 0 H VAL A 48 -11.586 -8.567 3.034 1.00 0.00 H new ATOM 0 HA VAL A 48 -9.573 -10.198 3.841 1.00 0.00 H new ATOM 0 HB VAL A 48 -11.822 -9.473 4.982 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -13.501 -11.268 5.086 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -13.314 -10.633 3.434 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -12.581 -12.193 3.875 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -11.584 -11.272 6.646 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -10.585 -12.196 5.499 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -10.003 -10.637 6.130 1.00 0.00 H new ATOM 714 N ALA A 49 -11.397 -11.648 1.579 1.00 0.00 N ATOM 715 CA ALA A 49 -11.520 -12.821 0.722 1.00 0.00 C ATOM 716 C ALA A 49 -10.219 -13.092 -0.026 1.00 0.00 C ATOM 717 O ALA A 49 -9.775 -14.236 -0.122 1.00 0.00 O ATOM 718 CB ALA A 49 -12.668 -12.640 -0.260 1.00 0.00 C ATOM 0 H ALA A 49 -11.951 -10.846 1.278 1.00 0.00 H new ATOM 0 HA ALA A 49 -11.731 -13.683 1.355 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -12.748 -13.524 -0.893 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -13.599 -12.502 0.290 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -12.481 -11.764 -0.881 1.00 0.00 H new ATOM 724 N TRP A 50 -9.615 -12.035 -0.555 1.00 0.00 N ATOM 725 CA TRP A 50 -8.365 -12.160 -1.296 1.00 0.00 C ATOM 726 C TRP A 50 -7.165 -12.084 -0.357 1.00 0.00 C ATOM 727 O TRP A 50 -6.080 -12.566 -0.681 1.00 0.00 O ATOM 728 CB TRP A 50 -8.266 -11.066 -2.360 1.00 0.00 C ATOM 729 CG TRP A 50 -7.217 -11.336 -3.395 1.00 0.00 C ATOM 730 CD1 TRP A 50 -6.018 -10.697 -3.533 1.00 0.00 C ATOM 731 CD2 TRP A 50 -7.274 -12.316 -4.437 1.00 0.00 C ATOM 732 NE1 TRP A 50 -5.326 -11.220 -4.599 1.00 0.00 N ATOM 733 CE2 TRP A 50 -6.075 -12.215 -5.170 1.00 0.00 C ATOM 734 CE3 TRP A 50 -8.220 -13.269 -4.822 1.00 0.00 C ATOM 735 CZ2 TRP A 50 -5.800 -13.032 -6.264 1.00 0.00 C ATOM 736 CZ3 TRP A 50 -7.946 -14.079 -5.909 1.00 0.00 C ATOM 737 CH2 TRP A 50 -6.744 -13.956 -6.619 1.00 0.00 C ATOM 0 H TRP A 50 -9.970 -11.081 -0.485 1.00 0.00 H new ATOM 0 HA TRP A 50 -8.358 -13.134 -1.786 1.00 0.00 H new ATOM 0 HB2 TRP A 50 -9.233 -10.960 -2.852 1.00 0.00 H new ATOM 0 HB3 TRP A 50 -8.050 -10.115 -1.874 1.00 0.00 H new ATOM 0 HD1 TRP A 50 -5.665 -9.898 -2.898 1.00 0.00 H new ATOM 0 HE1 TRP A 50 -4.404 -10.917 -4.914 1.00 0.00 H new ATOM 0 HE3 TRP A 50 -9.149 -13.371 -4.280 1.00 0.00 H new ATOM 0 HZ2 TRP A 50 -4.874 -12.939 -6.813 1.00 0.00 H new ATOM 0 HZ3 TRP A 50 -8.671 -14.819 -6.216 1.00 0.00 H new ATOM 0 HH2 TRP A 50 -6.559 -14.604 -7.463 1.00 0.00 H new ATOM 748 N PHE A 51 -7.368 -11.475 0.806 1.00 0.00 N ATOM 749 CA PHE A 51 -6.302 -11.334 1.792 1.00 0.00 C ATOM 750 C PHE A 51 -6.760 -11.827 3.162 1.00 0.00 C ATOM 751 O PHE A 51 -7.151 -11.035 4.019 1.00 0.00 O ATOM 752 CB PHE A 51 -5.854 -9.874 1.885 1.00 0.00 C ATOM 753 CG PHE A 51 -5.150 -9.383 0.653 1.00 0.00 C ATOM 754 CD1 PHE A 51 -3.823 -9.706 0.422 1.00 0.00 C ATOM 755 CD2 PHE A 51 -5.816 -8.597 -0.274 1.00 0.00 C ATOM 756 CE1 PHE A 51 -3.172 -9.256 -0.711 1.00 0.00 C ATOM 757 CE2 PHE A 51 -5.170 -8.144 -1.409 1.00 0.00 C ATOM 758 CZ PHE A 51 -3.847 -8.473 -1.628 1.00 0.00 C ATOM 0 H PHE A 51 -8.261 -11.071 1.089 1.00 0.00 H new ATOM 0 HA PHE A 51 -5.459 -11.945 1.469 1.00 0.00 H new ATOM 0 HB2 PHE A 51 -6.726 -9.246 2.070 1.00 0.00 H new ATOM 0 HB3 PHE A 51 -5.191 -9.760 2.742 1.00 0.00 H new ATOM 0 HD1 PHE A 51 -3.291 -10.317 1.136 1.00 0.00 H new ATOM 0 HD2 PHE A 51 -6.851 -8.336 -0.108 1.00 0.00 H new ATOM 0 HE1 PHE A 51 -2.137 -9.516 -0.879 1.00 0.00 H new ATOM 0 HE2 PHE A 51 -5.700 -7.533 -2.124 1.00 0.00 H new ATOM 0 HZ PHE A 51 -3.341 -8.119 -2.514 1.00 0.00 H new ATOM 768 N SER A 52 -6.708 -13.140 3.359 1.00 0.00 N ATOM 769 CA SER A 52 -7.121 -13.739 4.623 1.00 0.00 C ATOM 770 C SER A 52 -5.911 -14.055 5.496 1.00 0.00 C ATOM 771 O SER A 52 -4.775 -14.055 5.023 1.00 0.00 O ATOM 772 CB SER A 52 -7.926 -15.015 4.367 1.00 0.00 C ATOM 773 OG SER A 52 -8.747 -15.332 5.478 1.00 0.00 O ATOM 0 H SER A 52 -6.384 -13.809 2.660 1.00 0.00 H new ATOM 0 HA SER A 52 -7.749 -13.020 5.149 1.00 0.00 H new ATOM 0 HB2 SER A 52 -8.545 -14.886 3.479 1.00 0.00 H new ATOM 0 HB3 SER A 52 -7.246 -15.843 4.165 1.00 0.00 H new ATOM 0 HG SER A 52 -9.252 -16.150 5.289 1.00 0.00 H new ATOM 779 N GLU A 53 -6.164 -14.324 6.773 1.00 0.00 N ATOM 780 CA GLU A 53 -5.094 -14.641 7.712 1.00 0.00 C ATOM 781 C GLU A 53 -4.095 -15.613 7.092 1.00 0.00 C ATOM 782 O GLU A 53 -2.919 -15.627 7.457 1.00 0.00 O ATOM 783 CB GLU A 53 -5.674 -15.239 8.996 1.00 0.00 C ATOM 784 CG GLU A 53 -6.446 -14.238 9.839 1.00 0.00 C ATOM 785 CD GLU A 53 -7.058 -14.866 11.076 1.00 0.00 C ATOM 786 OE1 GLU A 53 -6.300 -15.174 12.021 1.00 0.00 O ATOM 787 OE2 GLU A 53 -8.292 -15.051 11.100 1.00 0.00 O ATOM 0 H GLU A 53 -7.099 -14.329 7.181 1.00 0.00 H new ATOM 0 HA GLU A 53 -4.571 -13.715 7.953 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -6.333 -16.067 8.736 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -4.862 -15.654 9.593 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -5.779 -13.430 10.139 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -7.235 -13.792 9.234 1.00 0.00 H new ATOM 794 N SER A 54 -4.571 -16.423 6.153 1.00 0.00 N ATOM 795 CA SER A 54 -3.721 -17.401 5.484 1.00 0.00 C ATOM 796 C SER A 54 -2.565 -16.714 4.764 1.00 0.00 C ATOM 797 O SER A 54 -1.426 -17.178 4.813 1.00 0.00 O ATOM 798 CB SER A 54 -4.541 -18.224 4.487 1.00 0.00 C ATOM 799 OG SER A 54 -5.674 -18.802 5.113 1.00 0.00 O ATOM 0 H SER A 54 -5.541 -16.422 5.838 1.00 0.00 H new ATOM 0 HA SER A 54 -3.309 -18.067 6.242 1.00 0.00 H new ATOM 0 HB2 SER A 54 -4.862 -17.587 3.663 1.00 0.00 H new ATOM 0 HB3 SER A 54 -3.918 -19.009 4.059 1.00 0.00 H new ATOM 0 HG SER A 54 -6.182 -19.321 4.455 1.00 0.00 H new ATOM 805 N TRP A 55 -2.867 -15.607 4.096 1.00 0.00 N ATOM 806 CA TRP A 55 -1.853 -14.855 3.366 1.00 0.00 C ATOM 807 C TRP A 55 -1.011 -14.011 4.316 1.00 0.00 C ATOM 808 O TRP A 55 0.218 -14.102 4.319 1.00 0.00 O ATOM 809 CB TRP A 55 -2.512 -13.958 2.316 1.00 0.00 C ATOM 810 CG TRP A 55 -1.544 -13.051 1.619 1.00 0.00 C ATOM 811 CD1 TRP A 55 -0.741 -13.366 0.560 1.00 0.00 C ATOM 812 CD2 TRP A 55 -1.277 -11.679 1.932 1.00 0.00 C ATOM 813 NE1 TRP A 55 0.009 -12.274 0.197 1.00 0.00 N ATOM 814 CE2 TRP A 55 -0.302 -11.226 1.022 1.00 0.00 C ATOM 815 CE3 TRP A 55 -1.768 -10.790 2.891 1.00 0.00 C ATOM 816 CZ2 TRP A 55 0.191 -9.924 1.047 1.00 0.00 C ATOM 817 CZ3 TRP A 55 -1.278 -9.498 2.914 1.00 0.00 C ATOM 818 CH2 TRP A 55 -0.308 -9.075 1.997 1.00 0.00 C ATOM 0 H TRP A 55 -3.805 -15.210 4.045 1.00 0.00 H new ATOM 0 HA TRP A 55 -1.198 -15.568 2.866 1.00 0.00 H new ATOM 0 HB2 TRP A 55 -3.011 -14.583 1.576 1.00 0.00 H new ATOM 0 HB3 TRP A 55 -3.283 -13.355 2.796 1.00 0.00 H new ATOM 0 HD1 TRP A 55 -0.702 -14.332 0.079 1.00 0.00 H new ATOM 0 HE1 TRP A 55 0.688 -12.248 -0.564 1.00 0.00 H new ATOM 0 HE3 TRP A 55 -2.517 -11.107 3.602 1.00 0.00 H new ATOM 0 HZ2 TRP A 55 0.940 -9.596 0.342 1.00 0.00 H new ATOM 0 HZ3 TRP A 55 -1.650 -8.803 3.652 1.00 0.00 H new ATOM 0 HH2 TRP A 55 0.054 -8.058 2.040 1.00 0.00 H new ATOM 829 N LEU A 56 -1.677 -13.192 5.121 1.00 0.00 N ATOM 830 CA LEU A 56 -0.988 -12.332 6.078 1.00 0.00 C ATOM 831 C LEU A 56 -0.190 -13.160 7.079 1.00 0.00 C ATOM 832 O LEU A 56 0.694 -12.644 7.762 1.00 0.00 O ATOM 833 CB LEU A 56 -1.996 -11.449 6.817 1.00 0.00 C ATOM 834 CG LEU A 56 -1.421 -10.545 7.908 1.00 0.00 C ATOM 835 CD1 LEU A 56 -0.705 -9.353 7.292 1.00 0.00 C ATOM 836 CD2 LEU A 56 -2.523 -10.079 8.849 1.00 0.00 C ATOM 0 H LEU A 56 -2.693 -13.105 5.131 1.00 0.00 H new ATOM 0 HA LEU A 56 -0.295 -11.698 5.526 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -2.506 -10.823 6.085 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -2.752 -12.093 7.267 1.00 0.00 H new ATOM 0 HG LEU A 56 -0.696 -11.120 8.484 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -0.303 -8.721 8.084 1.00 0.00 H new ATOM 0 HD12 LEU A 56 0.110 -9.705 6.659 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -1.408 -8.777 6.691 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -2.096 -9.437 9.619 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -3.271 -9.522 8.285 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -2.992 -10.945 9.317 1.00 0.00 H new ATOM 848 N SER A 57 -0.505 -14.449 7.158 1.00 0.00 N ATOM 849 CA SER A 57 0.182 -15.349 8.076 1.00 0.00 C ATOM 850 C SER A 57 1.613 -15.609 7.614 1.00 0.00 C ATOM 851 O SER A 57 2.431 -16.141 8.363 1.00 0.00 O ATOM 852 CB SER A 57 -0.577 -16.673 8.190 1.00 0.00 C ATOM 853 OG SER A 57 -1.534 -16.624 9.234 1.00 0.00 O ATOM 0 H SER A 57 -1.232 -14.893 6.597 1.00 0.00 H new ATOM 0 HA SER A 57 0.216 -14.872 9.055 1.00 0.00 H new ATOM 0 HB2 SER A 57 -1.075 -16.893 7.246 1.00 0.00 H new ATOM 0 HB3 SER A 57 0.127 -17.484 8.375 1.00 0.00 H new ATOM 0 HG SER A 57 -2.376 -16.259 8.889 1.00 0.00 H new ATOM 859 N ARG A 58 1.906 -15.228 6.375 1.00 0.00 N ATOM 860 CA ARG A 58 3.236 -15.420 5.811 1.00 0.00 C ATOM 861 C ARG A 58 4.104 -14.185 6.034 1.00 0.00 C ATOM 862 O ARG A 58 5.314 -14.214 5.803 1.00 0.00 O ATOM 863 CB ARG A 58 3.141 -15.726 4.315 1.00 0.00 C ATOM 864 CG ARG A 58 2.003 -16.669 3.958 1.00 0.00 C ATOM 865 CD ARG A 58 2.107 -17.980 4.720 1.00 0.00 C ATOM 866 NE ARG A 58 1.477 -19.084 3.999 1.00 0.00 N ATOM 867 CZ ARG A 58 1.362 -20.312 4.491 1.00 0.00 C ATOM 868 NH1 ARG A 58 1.831 -20.593 5.699 1.00 0.00 N ATOM 869 NH2 ARG A 58 0.776 -21.263 3.774 1.00 0.00 N ATOM 0 H ARG A 58 1.240 -14.784 5.743 1.00 0.00 H new ATOM 0 HA ARG A 58 3.699 -16.266 6.319 1.00 0.00 H new ATOM 0 HB2 ARG A 58 3.012 -14.791 3.769 1.00 0.00 H new ATOM 0 HB3 ARG A 58 4.082 -16.163 3.981 1.00 0.00 H new ATOM 0 HG2 ARG A 58 1.049 -16.191 4.182 1.00 0.00 H new ATOM 0 HG3 ARG A 58 2.016 -16.868 2.886 1.00 0.00 H new ATOM 0 HD2 ARG A 58 3.157 -18.214 4.896 1.00 0.00 H new ATOM 0 HD3 ARG A 58 1.636 -17.870 5.697 1.00 0.00 H new ATOM 0 HE ARG A 58 1.105 -18.901 3.067 1.00 0.00 H new ATOM 0 HH11 ARG A 58 2.282 -19.865 6.253 1.00 0.00 H new ATOM 0 HH12 ARG A 58 1.741 -21.537 6.074 1.00 0.00 H new ATOM 0 HH21 ARG A 58 0.414 -21.051 2.844 1.00 0.00 H new ATOM 0 HH22 ARG A 58 0.688 -22.206 4.153 1.00 0.00 H new ATOM 883 N ILE A 59 3.479 -13.102 6.484 1.00 0.00 N ATOM 884 CA ILE A 59 4.195 -11.858 6.738 1.00 0.00 C ATOM 885 C ILE A 59 4.732 -11.814 8.164 1.00 0.00 C ATOM 886 O ILE A 59 4.066 -12.248 9.104 1.00 0.00 O ATOM 887 CB ILE A 59 3.293 -10.632 6.504 1.00 0.00 C ATOM 888 CG1 ILE A 59 2.403 -10.852 5.278 1.00 0.00 C ATOM 889 CG2 ILE A 59 4.137 -9.378 6.333 1.00 0.00 C ATOM 890 CD1 ILE A 59 3.115 -10.616 3.965 1.00 0.00 C ATOM 0 H ILE A 59 2.479 -13.061 6.680 1.00 0.00 H new ATOM 0 HA ILE A 59 5.029 -11.825 6.037 1.00 0.00 H new ATOM 0 HB ILE A 59 2.653 -10.500 7.376 1.00 0.00 H new ATOM 0 HG12 ILE A 59 2.019 -11.872 5.296 1.00 0.00 H new ATOM 0 HG13 ILE A 59 1.542 -10.187 5.340 1.00 0.00 H new ATOM 0 HG21 ILE A 59 3.485 -8.520 6.168 1.00 0.00 H new ATOM 0 HG22 ILE A 59 4.732 -9.214 7.232 1.00 0.00 H new ATOM 0 HG23 ILE A 59 4.800 -9.500 5.476 1.00 0.00 H new ATOM 0 HD11 ILE A 59 2.424 -10.790 3.140 1.00 0.00 H new ATOM 0 HD12 ILE A 59 3.475 -9.588 3.926 1.00 0.00 H new ATOM 0 HD13 ILE A 59 3.960 -11.300 3.881 1.00 0.00 H new ATOM 902 N LYS A 60 5.942 -11.286 8.319 1.00 0.00 N ATOM 903 CA LYS A 60 6.569 -11.182 9.631 1.00 0.00 C ATOM 904 C LYS A 60 6.862 -9.726 9.980 1.00 0.00 C ATOM 905 O LYS A 60 6.994 -8.880 9.095 1.00 0.00 O ATOM 906 CB LYS A 60 7.865 -11.996 9.665 1.00 0.00 C ATOM 907 CG LYS A 60 7.668 -13.433 10.117 1.00 0.00 C ATOM 908 CD LYS A 60 8.897 -13.964 10.836 1.00 0.00 C ATOM 909 CE LYS A 60 9.057 -15.463 10.633 1.00 0.00 C ATOM 910 NZ LYS A 60 8.305 -16.245 11.653 1.00 0.00 N ATOM 0 H LYS A 60 6.508 -10.923 7.552 1.00 0.00 H new ATOM 0 HA LYS A 60 5.876 -11.582 10.371 1.00 0.00 H new ATOM 0 HB2 LYS A 60 8.312 -11.995 8.671 1.00 0.00 H new ATOM 0 HB3 LYS A 60 8.574 -11.507 10.333 1.00 0.00 H new ATOM 0 HG2 LYS A 60 6.804 -13.492 10.779 1.00 0.00 H new ATOM 0 HG3 LYS A 60 7.451 -14.061 9.253 1.00 0.00 H new ATOM 0 HD2 LYS A 60 9.785 -13.449 10.469 1.00 0.00 H new ATOM 0 HD3 LYS A 60 8.819 -13.746 11.901 1.00 0.00 H new ATOM 0 HE2 LYS A 60 8.707 -15.734 9.637 1.00 0.00 H new ATOM 0 HE3 LYS A 60 10.114 -15.725 10.681 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 8.440 -17.262 11.480 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 8.656 -16.006 12.602 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 7.293 -16.014 11.590 1.00 0.00 H new ATOM 924 N ASP A 61 6.963 -9.442 11.274 1.00 0.00 N ATOM 925 CA ASP A 61 7.243 -8.089 11.739 1.00 0.00 C ATOM 926 C ASP A 61 8.509 -8.058 12.591 1.00 0.00 C ATOM 927 O ASP A 61 8.751 -7.100 13.326 1.00 0.00 O ATOM 928 CB ASP A 61 6.060 -7.547 12.542 1.00 0.00 C ATOM 929 CG ASP A 61 6.007 -6.032 12.546 1.00 0.00 C ATOM 930 OD1 ASP A 61 6.845 -5.411 13.232 1.00 0.00 O ATOM 931 OD2 ASP A 61 5.127 -5.468 11.862 1.00 0.00 O ATOM 0 H ASP A 61 6.855 -10.130 12.019 1.00 0.00 H new ATOM 0 HA ASP A 61 7.399 -7.456 10.865 1.00 0.00 H new ATOM 0 HB2 ASP A 61 5.132 -7.939 12.125 1.00 0.00 H new ATOM 0 HB3 ASP A 61 6.126 -7.908 13.568 1.00 0.00 H new ATOM 936 N ASP A 62 9.310 -9.112 12.489 1.00 0.00 N ATOM 937 CA ASP A 62 10.551 -9.206 13.250 1.00 0.00 C ATOM 938 C ASP A 62 11.656 -8.386 12.591 1.00 0.00 C ATOM 939 O ASP A 62 12.754 -8.257 13.133 1.00 0.00 O ATOM 940 CB ASP A 62 10.988 -10.667 13.375 1.00 0.00 C ATOM 941 CG ASP A 62 10.492 -11.312 14.654 1.00 0.00 C ATOM 942 OD1 ASP A 62 9.309 -11.710 14.698 1.00 0.00 O ATOM 943 OD2 ASP A 62 11.287 -11.420 15.611 1.00 0.00 O ATOM 0 H ASP A 62 9.123 -9.914 11.887 1.00 0.00 H new ATOM 0 HA ASP A 62 10.369 -8.803 14.246 1.00 0.00 H new ATOM 0 HB2 ASP A 62 10.614 -11.229 12.519 1.00 0.00 H new ATOM 0 HB3 ASP A 62 12.076 -10.722 13.342 1.00 0.00 H new ATOM 948 N VAL A 63 11.358 -7.834 11.420 1.00 0.00 N ATOM 949 CA VAL A 63 12.326 -7.026 10.687 1.00 0.00 C ATOM 950 C VAL A 63 13.111 -6.121 11.629 1.00 0.00 C ATOM 951 O VAL A 63 14.233 -5.717 11.326 1.00 0.00 O ATOM 952 CB VAL A 63 11.637 -6.160 9.615 1.00 0.00 C ATOM 953 CG1 VAL A 63 10.802 -7.026 8.684 1.00 0.00 C ATOM 954 CG2 VAL A 63 10.781 -5.086 10.268 1.00 0.00 C ATOM 0 H VAL A 63 10.454 -7.931 10.958 1.00 0.00 H new ATOM 0 HA VAL A 63 13.011 -7.718 10.198 1.00 0.00 H new ATOM 0 HB VAL A 63 12.407 -5.668 9.021 1.00 0.00 H new ATOM 0 HG11 VAL A 63 10.323 -6.397 7.934 1.00 0.00 H new ATOM 0 HG12 VAL A 63 11.445 -7.754 8.190 1.00 0.00 H new ATOM 0 HG13 VAL A 63 10.038 -7.548 9.260 1.00 0.00 H new ATOM 0 HG21 VAL A 63 10.302 -4.484 9.496 1.00 0.00 H new ATOM 0 HG22 VAL A 63 10.017 -5.556 10.888 1.00 0.00 H new ATOM 0 HG23 VAL A 63 11.409 -4.447 10.889 1.00 0.00 H new ATOM 964 N GLY A 64 12.513 -5.806 12.774 1.00 0.00 N ATOM 965 CA GLY A 64 13.171 -4.950 13.744 1.00 0.00 C ATOM 966 C GLY A 64 14.683 -5.018 13.645 1.00 0.00 C ATOM 967 O GLY A 64 15.344 -4.000 13.440 1.00 0.00 O ATOM 0 H GLY A 64 11.585 -6.128 13.047 1.00 0.00 H new ATOM 0 HA2 GLY A 64 12.846 -3.920 13.595 1.00 0.00 H new ATOM 0 HA3 GLY A 64 12.862 -5.240 14.748 1.00 0.00 H new ATOM 971 N ASP A 65 15.231 -6.219 13.793 1.00 0.00 N ATOM 972 CA ASP A 65 16.674 -6.415 13.720 1.00 0.00 C ATOM 973 C ASP A 65 17.064 -7.098 12.413 1.00 0.00 C ATOM 974 O ASP A 65 18.246 -7.291 12.130 1.00 0.00 O ATOM 975 CB ASP A 65 17.158 -7.247 14.908 1.00 0.00 C ATOM 976 CG ASP A 65 16.392 -6.939 16.180 1.00 0.00 C ATOM 977 OD1 ASP A 65 16.539 -5.815 16.703 1.00 0.00 O ATOM 978 OD2 ASP A 65 15.647 -7.823 16.653 1.00 0.00 O ATOM 0 H ASP A 65 14.698 -7.071 13.964 1.00 0.00 H new ATOM 0 HA ASP A 65 17.151 -5.435 13.754 1.00 0.00 H new ATOM 0 HB2 ASP A 65 17.055 -8.306 14.672 1.00 0.00 H new ATOM 0 HB3 ASP A 65 18.219 -7.059 15.072 1.00 0.00 H new ATOM 983 N ASN A 66 16.062 -7.462 11.619 1.00 0.00 N ATOM 984 CA ASN A 66 16.300 -8.125 10.342 1.00 0.00 C ATOM 985 C ASN A 66 15.796 -7.271 9.183 1.00 0.00 C ATOM 986 O ASN A 66 14.698 -6.718 9.238 1.00 0.00 O ATOM 987 CB ASN A 66 15.614 -9.493 10.319 1.00 0.00 C ATOM 988 CG ASN A 66 16.531 -10.608 10.782 1.00 0.00 C ATOM 989 OD1 ASN A 66 17.753 -10.511 10.665 1.00 0.00 O ATOM 990 ND2 ASN A 66 15.944 -11.675 11.311 1.00 0.00 N ATOM 0 H ASN A 66 15.078 -7.309 11.838 1.00 0.00 H new ATOM 0 HA ASN A 66 17.375 -8.263 10.227 1.00 0.00 H new ATOM 0 HB2 ASN A 66 14.731 -9.464 10.957 1.00 0.00 H new ATOM 0 HB3 ASN A 66 15.269 -9.706 9.307 1.00 0.00 H new ATOM 0 HD21 ASN A 66 16.509 -12.457 11.640 1.00 0.00 H new ATOM 0 HD22 ASN A 66 14.928 -11.712 11.388 1.00 0.00 H new ATOM 997 N TRP A 67 16.606 -7.169 8.135 1.00 0.00 N ATOM 998 CA TRP A 67 16.242 -6.383 6.962 1.00 0.00 C ATOM 999 C TRP A 67 15.663 -7.273 5.868 1.00 0.00 C ATOM 1000 O TRP A 67 14.952 -6.800 4.981 1.00 0.00 O ATOM 1001 CB TRP A 67 17.461 -5.628 6.430 1.00 0.00 C ATOM 1002 CG TRP A 67 18.589 -6.530 6.027 1.00 0.00 C ATOM 1003 CD1 TRP A 67 19.715 -6.807 6.748 1.00 0.00 C ATOM 1004 CD2 TRP A 67 18.699 -7.270 4.806 1.00 0.00 C ATOM 1005 NE1 TRP A 67 20.518 -7.675 6.049 1.00 0.00 N ATOM 1006 CE2 TRP A 67 19.917 -7.975 4.855 1.00 0.00 C ATOM 1007 CE3 TRP A 67 17.886 -7.407 3.678 1.00 0.00 C ATOM 1008 CZ2 TRP A 67 20.340 -8.802 3.819 1.00 0.00 C ATOM 1009 CZ3 TRP A 67 18.308 -8.229 2.649 1.00 0.00 C ATOM 1010 CH2 TRP A 67 19.525 -8.918 2.726 1.00 0.00 C ATOM 0 H TRP A 67 17.519 -7.621 8.074 1.00 0.00 H new ATOM 0 HA TRP A 67 15.479 -5.664 7.260 1.00 0.00 H new ATOM 0 HB2 TRP A 67 17.161 -5.027 5.571 1.00 0.00 H new ATOM 0 HB3 TRP A 67 17.814 -4.937 7.195 1.00 0.00 H new ATOM 0 HD1 TRP A 67 19.941 -6.403 7.724 1.00 0.00 H new ATOM 0 HE1 TRP A 67 21.417 -8.038 6.367 1.00 0.00 H new ATOM 0 HE3 TRP A 67 16.945 -6.881 3.611 1.00 0.00 H new ATOM 0 HZ2 TRP A 67 21.278 -9.334 3.876 1.00 0.00 H new ATOM 0 HZ3 TRP A 67 17.689 -8.342 1.771 1.00 0.00 H new ATOM 0 HH2 TRP A 67 19.826 -9.554 1.906 1.00 0.00 H new ATOM 1021 N ARG A 68 15.972 -8.564 5.936 1.00 0.00 N ATOM 1022 CA ARG A 68 15.482 -9.520 4.950 1.00 0.00 C ATOM 1023 C ARG A 68 13.979 -9.733 5.099 1.00 0.00 C ATOM 1024 O ARG A 68 13.240 -9.726 4.113 1.00 0.00 O ATOM 1025 CB ARG A 68 16.214 -10.856 5.096 1.00 0.00 C ATOM 1026 CG ARG A 68 17.721 -10.712 5.236 1.00 0.00 C ATOM 1027 CD ARG A 68 18.396 -12.065 5.401 1.00 0.00 C ATOM 1028 NE ARG A 68 18.399 -12.509 6.792 1.00 0.00 N ATOM 1029 CZ ARG A 68 18.630 -13.764 7.163 1.00 0.00 C ATOM 1030 NH1 ARG A 68 18.876 -14.693 6.250 1.00 0.00 N ATOM 1031 NH2 ARG A 68 18.615 -14.090 8.449 1.00 0.00 N ATOM 0 H ARG A 68 16.559 -8.972 6.663 1.00 0.00 H new ATOM 0 HA ARG A 68 15.677 -9.113 3.958 1.00 0.00 H new ATOM 0 HB2 ARG A 68 15.825 -11.381 5.969 1.00 0.00 H new ATOM 0 HB3 ARG A 68 15.996 -11.477 4.227 1.00 0.00 H new ATOM 0 HG2 ARG A 68 18.123 -10.208 4.357 1.00 0.00 H new ATOM 0 HG3 ARG A 68 17.949 -10.083 6.096 1.00 0.00 H new ATOM 0 HD2 ARG A 68 17.882 -12.804 4.786 1.00 0.00 H new ATOM 0 HD3 ARG A 68 19.422 -12.005 5.037 1.00 0.00 H new ATOM 0 HE ARG A 68 18.214 -11.818 7.519 1.00 0.00 H new ATOM 0 HH11 ARG A 68 18.888 -14.445 5.261 1.00 0.00 H new ATOM 0 HH12 ARG A 68 19.053 -15.656 6.537 1.00 0.00 H new ATOM 0 HH21 ARG A 68 18.426 -13.377 9.154 1.00 0.00 H new ATOM 0 HH22 ARG A 68 18.792 -15.053 8.733 1.00 0.00 H new ATOM 1045 N ILE A 69 13.533 -9.922 6.336 1.00 0.00 N ATOM 1046 CA ILE A 69 12.118 -10.136 6.613 1.00 0.00 C ATOM 1047 C ILE A 69 11.252 -9.135 5.856 1.00 0.00 C ATOM 1048 O ILE A 69 10.150 -9.460 5.414 1.00 0.00 O ATOM 1049 CB ILE A 69 11.816 -10.023 8.119 1.00 0.00 C ATOM 1050 CG1 ILE A 69 12.639 -11.045 8.905 1.00 0.00 C ATOM 1051 CG2 ILE A 69 10.329 -10.220 8.378 1.00 0.00 C ATOM 1052 CD1 ILE A 69 12.286 -11.104 10.375 1.00 0.00 C ATOM 0 H ILE A 69 14.131 -9.931 7.162 1.00 0.00 H new ATOM 0 HA ILE A 69 11.880 -11.145 6.278 1.00 0.00 H new ATOM 0 HB ILE A 69 12.094 -9.024 8.456 1.00 0.00 H new ATOM 0 HG12 ILE A 69 12.494 -12.032 8.465 1.00 0.00 H new ATOM 0 HG13 ILE A 69 13.697 -10.803 8.803 1.00 0.00 H new ATOM 0 HG21 ILE A 69 10.132 -10.137 9.447 1.00 0.00 H new ATOM 0 HG22 ILE A 69 9.762 -9.457 7.844 1.00 0.00 H new ATOM 0 HG23 ILE A 69 10.026 -11.207 8.029 1.00 0.00 H new ATOM 0 HD11 ILE A 69 12.909 -11.850 10.869 1.00 0.00 H new ATOM 0 HD12 ILE A 69 12.458 -10.129 10.830 1.00 0.00 H new ATOM 0 HD13 ILE A 69 11.236 -11.376 10.487 1.00 0.00 H new ATOM 1064 N LYS A 70 11.758 -7.915 5.708 1.00 0.00 N ATOM 1065 CA LYS A 70 11.034 -6.866 5.002 1.00 0.00 C ATOM 1066 C LYS A 70 10.771 -7.266 3.553 1.00 0.00 C ATOM 1067 O LYS A 70 9.621 -7.393 3.133 1.00 0.00 O ATOM 1068 CB LYS A 70 11.823 -5.555 5.044 1.00 0.00 C ATOM 1069 CG LYS A 70 11.389 -4.620 6.159 1.00 0.00 C ATOM 1070 CD LYS A 70 12.326 -3.430 6.285 1.00 0.00 C ATOM 1071 CE LYS A 70 13.732 -3.866 6.666 1.00 0.00 C ATOM 1072 NZ LYS A 70 14.564 -2.718 7.122 1.00 0.00 N ATOM 0 H LYS A 70 12.668 -7.629 6.069 1.00 0.00 H new ATOM 0 HA LYS A 70 10.076 -6.723 5.501 1.00 0.00 H new ATOM 0 HB2 LYS A 70 12.882 -5.782 5.163 1.00 0.00 H new ATOM 0 HB3 LYS A 70 11.712 -5.043 4.088 1.00 0.00 H new ATOM 0 HG2 LYS A 70 10.376 -4.268 5.966 1.00 0.00 H new ATOM 0 HG3 LYS A 70 11.363 -5.165 7.103 1.00 0.00 H new ATOM 0 HD2 LYS A 70 12.356 -2.887 5.340 1.00 0.00 H new ATOM 0 HD3 LYS A 70 11.941 -2.741 7.037 1.00 0.00 H new ATOM 0 HE2 LYS A 70 13.679 -4.613 7.458 1.00 0.00 H new ATOM 0 HE3 LYS A 70 14.209 -4.343 5.810 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 15.515 -3.056 7.373 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 14.636 -2.016 6.358 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 14.122 -2.278 7.955 1.00 0.00 H new ATOM 1086 N ALA A 71 11.844 -7.467 2.795 1.00 0.00 N ATOM 1087 CA ALA A 71 11.729 -7.857 1.396 1.00 0.00 C ATOM 1088 C ALA A 71 10.710 -8.977 1.220 1.00 0.00 C ATOM 1089 O ALA A 71 9.812 -8.887 0.383 1.00 0.00 O ATOM 1090 CB ALA A 71 13.085 -8.284 0.854 1.00 0.00 C ATOM 0 H ALA A 71 12.803 -7.366 3.127 1.00 0.00 H new ATOM 0 HA ALA A 71 11.380 -6.993 0.831 1.00 0.00 H new ATOM 0 HB1 ALA A 71 12.984 -8.573 -0.192 1.00 0.00 H new ATOM 0 HB2 ALA A 71 13.787 -7.454 0.935 1.00 0.00 H new ATOM 0 HB3 ALA A 71 13.457 -9.131 1.430 1.00 0.00 H new ATOM 1096 N SER A 72 10.855 -10.033 2.014 1.00 0.00 N ATOM 1097 CA SER A 72 9.950 -11.174 1.943 1.00 0.00 C ATOM 1098 C SER A 72 8.495 -10.717 2.001 1.00 0.00 C ATOM 1099 O SER A 72 7.622 -11.310 1.368 1.00 0.00 O ATOM 1100 CB SER A 72 10.235 -12.150 3.086 1.00 0.00 C ATOM 1101 OG SER A 72 11.241 -13.080 2.723 1.00 0.00 O ATOM 0 H SER A 72 11.591 -10.122 2.714 1.00 0.00 H new ATOM 0 HA SER A 72 10.117 -11.680 0.992 1.00 0.00 H new ATOM 0 HB2 SER A 72 10.549 -11.597 3.971 1.00 0.00 H new ATOM 0 HB3 SER A 72 9.321 -12.682 3.350 1.00 0.00 H new ATOM 0 HG SER A 72 11.406 -13.692 3.471 1.00 0.00 H new ATOM 1107 N ASN A 73 8.244 -9.659 2.764 1.00 0.00 N ATOM 1108 CA ASN A 73 6.895 -9.122 2.906 1.00 0.00 C ATOM 1109 C ASN A 73 6.513 -8.284 1.689 1.00 0.00 C ATOM 1110 O ASN A 73 5.532 -8.577 1.004 1.00 0.00 O ATOM 1111 CB ASN A 73 6.792 -8.274 4.175 1.00 0.00 C ATOM 1112 CG ASN A 73 7.566 -8.872 5.334 1.00 0.00 C ATOM 1113 OD1 ASN A 73 7.797 -10.080 5.384 1.00 0.00 O ATOM 1114 ND2 ASN A 73 7.972 -8.025 6.274 1.00 0.00 N ATOM 0 H ASN A 73 8.956 -9.156 3.294 1.00 0.00 H new ATOM 0 HA ASN A 73 6.203 -9.961 2.980 1.00 0.00 H new ATOM 0 HB2 ASN A 73 7.167 -7.271 3.970 1.00 0.00 H new ATOM 0 HB3 ASN A 73 5.744 -8.171 4.456 1.00 0.00 H new ATOM 0 HD21 ASN A 73 8.498 -8.369 7.078 1.00 0.00 H new ATOM 0 HD22 ASN A 73 7.758 -7.031 6.192 1.00 0.00 H new ATOM 1121 N LEU A 74 7.293 -7.242 1.426 1.00 0.00 N ATOM 1122 CA LEU A 74 7.037 -6.361 0.292 1.00 0.00 C ATOM 1123 C LEU A 74 6.686 -7.167 -0.955 1.00 0.00 C ATOM 1124 O LEU A 74 5.828 -6.770 -1.743 1.00 0.00 O ATOM 1125 CB LEU A 74 8.259 -5.483 0.017 1.00 0.00 C ATOM 1126 CG LEU A 74 8.325 -4.165 0.789 1.00 0.00 C ATOM 1127 CD1 LEU A 74 8.294 -4.422 2.288 1.00 0.00 C ATOM 1128 CD2 LEU A 74 9.574 -3.384 0.405 1.00 0.00 C ATOM 0 H LEU A 74 8.108 -6.986 1.983 1.00 0.00 H new ATOM 0 HA LEU A 74 6.188 -5.724 0.542 1.00 0.00 H new ATOM 0 HB2 LEU A 74 9.155 -6.060 0.245 1.00 0.00 H new ATOM 0 HB3 LEU A 74 8.288 -5.258 -1.049 1.00 0.00 H new ATOM 0 HG LEU A 74 7.452 -3.568 0.526 1.00 0.00 H new ATOM 0 HD11 LEU A 74 8.342 -3.472 2.821 1.00 0.00 H new ATOM 0 HD12 LEU A 74 7.371 -4.939 2.550 1.00 0.00 H new ATOM 0 HD13 LEU A 74 9.147 -5.039 2.569 1.00 0.00 H new ATOM 0 HD21 LEU A 74 9.605 -2.449 0.964 1.00 0.00 H new ATOM 0 HD22 LEU A 74 10.459 -3.976 0.639 1.00 0.00 H new ATOM 0 HD23 LEU A 74 9.554 -3.168 -0.663 1.00 0.00 H new ATOM 1140 N LYS A 75 7.353 -8.304 -1.126 1.00 0.00 N ATOM 1141 CA LYS A 75 7.110 -9.169 -2.274 1.00 0.00 C ATOM 1142 C LYS A 75 5.653 -9.620 -2.317 1.00 0.00 C ATOM 1143 O LYS A 75 4.958 -9.414 -3.312 1.00 0.00 O ATOM 1144 CB LYS A 75 8.031 -10.390 -2.222 1.00 0.00 C ATOM 1145 CG LYS A 75 9.497 -10.056 -2.441 1.00 0.00 C ATOM 1146 CD LYS A 75 10.405 -11.025 -1.703 1.00 0.00 C ATOM 1147 CE LYS A 75 11.755 -11.157 -2.392 1.00 0.00 C ATOM 1148 NZ LYS A 75 12.467 -12.400 -1.982 1.00 0.00 N ATOM 0 H LYS A 75 8.067 -8.648 -0.483 1.00 0.00 H new ATOM 0 HA LYS A 75 7.322 -8.599 -3.178 1.00 0.00 H new ATOM 0 HB2 LYS A 75 7.919 -10.878 -1.254 1.00 0.00 H new ATOM 0 HB3 LYS A 75 7.713 -11.107 -2.979 1.00 0.00 H new ATOM 0 HG2 LYS A 75 9.722 -10.085 -3.507 1.00 0.00 H new ATOM 0 HG3 LYS A 75 9.694 -9.040 -2.101 1.00 0.00 H new ATOM 0 HD2 LYS A 75 10.550 -10.682 -0.679 1.00 0.00 H new ATOM 0 HD3 LYS A 75 9.927 -12.003 -1.647 1.00 0.00 H new ATOM 0 HE2 LYS A 75 11.613 -11.159 -3.473 1.00 0.00 H new ATOM 0 HE3 LYS A 75 12.371 -10.290 -2.154 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 13.382 -12.454 -2.473 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 12.625 -12.386 -0.954 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 11.891 -13.229 -2.232 1.00 0.00 H new ATOM 1162 N LYS A 76 5.196 -10.234 -1.231 1.00 0.00 N ATOM 1163 CA LYS A 76 3.822 -10.711 -1.142 1.00 0.00 C ATOM 1164 C LYS A 76 2.835 -9.557 -1.287 1.00 0.00 C ATOM 1165 O LYS A 76 1.932 -9.600 -2.123 1.00 0.00 O ATOM 1166 CB LYS A 76 3.593 -11.428 0.190 1.00 0.00 C ATOM 1167 CG LYS A 76 4.279 -12.780 0.279 1.00 0.00 C ATOM 1168 CD LYS A 76 4.667 -13.115 1.710 1.00 0.00 C ATOM 1169 CE LYS A 76 5.557 -14.348 1.771 1.00 0.00 C ATOM 1170 NZ LYS A 76 6.951 -14.047 1.345 1.00 0.00 N ATOM 0 H LYS A 76 5.759 -10.413 -0.399 1.00 0.00 H new ATOM 0 HA LYS A 76 3.655 -11.414 -1.958 1.00 0.00 H new ATOM 0 HB2 LYS A 76 3.952 -10.794 1.001 1.00 0.00 H new ATOM 0 HB3 LYS A 76 2.522 -11.563 0.341 1.00 0.00 H new ATOM 0 HG2 LYS A 76 3.615 -13.552 -0.109 1.00 0.00 H new ATOM 0 HG3 LYS A 76 5.169 -12.779 -0.350 1.00 0.00 H new ATOM 0 HD2 LYS A 76 5.187 -12.267 2.155 1.00 0.00 H new ATOM 0 HD3 LYS A 76 3.768 -13.284 2.302 1.00 0.00 H new ATOM 0 HE2 LYS A 76 5.565 -14.740 2.788 1.00 0.00 H new ATOM 0 HE3 LYS A 76 5.142 -15.127 1.132 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 7.618 -14.594 1.927 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 7.072 -14.306 0.345 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 7.139 -13.031 1.465 1.00 0.00 H new ATOM 1184 N VAL A 77 3.013 -8.526 -0.467 1.00 0.00 N ATOM 1185 CA VAL A 77 2.140 -7.359 -0.506 1.00 0.00 C ATOM 1186 C VAL A 77 1.958 -6.856 -1.933 1.00 0.00 C ATOM 1187 O VAL A 77 0.843 -6.547 -2.357 1.00 0.00 O ATOM 1188 CB VAL A 77 2.693 -6.215 0.364 1.00 0.00 C ATOM 1189 CG1 VAL A 77 1.817 -4.977 0.239 1.00 0.00 C ATOM 1190 CG2 VAL A 77 2.804 -6.655 1.816 1.00 0.00 C ATOM 0 H VAL A 77 3.754 -8.475 0.232 1.00 0.00 H new ATOM 0 HA VAL A 77 1.175 -7.673 -0.109 1.00 0.00 H new ATOM 0 HB VAL A 77 3.692 -5.962 0.008 1.00 0.00 H new ATOM 0 HG11 VAL A 77 2.224 -4.179 0.861 1.00 0.00 H new ATOM 0 HG12 VAL A 77 1.794 -4.651 -0.801 1.00 0.00 H new ATOM 0 HG13 VAL A 77 0.805 -5.213 0.567 1.00 0.00 H new ATOM 0 HG21 VAL A 77 3.196 -5.834 2.416 1.00 0.00 H new ATOM 0 HG22 VAL A 77 1.819 -6.937 2.187 1.00 0.00 H new ATOM 0 HG23 VAL A 77 3.477 -7.510 1.887 1.00 0.00 H new ATOM 1200 N LEU A 78 3.060 -6.775 -2.671 1.00 0.00 N ATOM 1201 CA LEU A 78 3.023 -6.309 -4.053 1.00 0.00 C ATOM 1202 C LEU A 78 2.277 -7.300 -4.942 1.00 0.00 C ATOM 1203 O LEU A 78 1.290 -6.948 -5.589 1.00 0.00 O ATOM 1204 CB LEU A 78 4.444 -6.103 -4.580 1.00 0.00 C ATOM 1205 CG LEU A 78 4.569 -5.297 -5.874 1.00 0.00 C ATOM 1206 CD1 LEU A 78 6.021 -5.229 -6.321 1.00 0.00 C ATOM 1207 CD2 LEU A 78 3.700 -5.902 -6.966 1.00 0.00 C ATOM 0 H LEU A 78 3.990 -7.026 -2.335 1.00 0.00 H new ATOM 0 HA LEU A 78 2.492 -5.357 -4.076 1.00 0.00 H new ATOM 0 HB2 LEU A 78 5.028 -5.604 -3.807 1.00 0.00 H new ATOM 0 HB3 LEU A 78 4.896 -7.082 -4.740 1.00 0.00 H new ATOM 0 HG LEU A 78 4.221 -4.282 -5.683 1.00 0.00 H new ATOM 0 HD11 LEU A 78 6.091 -4.652 -7.243 1.00 0.00 H new ATOM 0 HD12 LEU A 78 6.618 -4.749 -5.546 1.00 0.00 H new ATOM 0 HD13 LEU A 78 6.396 -6.238 -6.495 1.00 0.00 H new ATOM 0 HD21 LEU A 78 3.802 -5.315 -7.879 1.00 0.00 H new ATOM 0 HD22 LEU A 78 4.016 -6.927 -7.157 1.00 0.00 H new ATOM 0 HD23 LEU A 78 2.658 -5.897 -6.646 1.00 0.00 H new ATOM 1219 N HIS A 79 2.755 -8.540 -4.967 1.00 0.00 N ATOM 1220 CA HIS A 79 2.132 -9.583 -5.775 1.00 0.00 C ATOM 1221 C HIS A 79 0.650 -9.717 -5.439 1.00 0.00 C ATOM 1222 O HIS A 79 -0.157 -10.098 -6.286 1.00 0.00 O ATOM 1223 CB HIS A 79 2.840 -10.920 -5.554 1.00 0.00 C ATOM 1224 CG HIS A 79 2.311 -12.027 -6.413 1.00 0.00 C ATOM 1225 ND1 HIS A 79 1.051 -12.564 -6.257 1.00 0.00 N ATOM 1226 CD2 HIS A 79 2.879 -12.696 -7.444 1.00 0.00 C ATOM 1227 CE1 HIS A 79 0.868 -13.518 -7.153 1.00 0.00 C ATOM 1228 NE2 HIS A 79 1.962 -13.617 -7.886 1.00 0.00 N ATOM 0 H HIS A 79 3.571 -8.847 -4.438 1.00 0.00 H new ATOM 0 HA HIS A 79 2.225 -9.301 -6.824 1.00 0.00 H new ATOM 0 HB2 HIS A 79 3.905 -10.795 -5.752 1.00 0.00 H new ATOM 0 HB3 HIS A 79 2.741 -11.205 -4.507 1.00 0.00 H new ATOM 0 HD2 HIS A 79 3.869 -12.535 -7.844 1.00 0.00 H new ATOM 0 HE1 HIS A 79 -0.025 -14.115 -7.267 1.00 0.00 H new ATOM 0 HE2 HIS A 79 2.103 -14.271 -8.656 1.00 0.00 H new ATOM 1237 N GLY A 80 0.299 -9.402 -4.195 1.00 0.00 N ATOM 1238 CA GLY A 80 -1.086 -9.495 -3.769 1.00 0.00 C ATOM 1239 C GLY A 80 -1.968 -8.457 -4.433 1.00 0.00 C ATOM 1240 O GLY A 80 -3.163 -8.680 -4.628 1.00 0.00 O ATOM 0 H GLY A 80 0.948 -9.084 -3.475 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -1.467 -10.490 -3.997 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -1.139 -9.374 -2.687 1.00 0.00 H new ATOM 1244 N ILE A 81 -1.379 -7.317 -4.779 1.00 0.00 N ATOM 1245 CA ILE A 81 -2.120 -6.240 -5.424 1.00 0.00 C ATOM 1246 C ILE A 81 -2.110 -6.397 -6.941 1.00 0.00 C ATOM 1247 O ILE A 81 -3.150 -6.298 -7.594 1.00 0.00 O ATOM 1248 CB ILE A 81 -1.540 -4.861 -5.058 1.00 0.00 C ATOM 1249 CG1 ILE A 81 -1.789 -4.554 -3.580 1.00 0.00 C ATOM 1250 CG2 ILE A 81 -2.150 -3.780 -5.939 1.00 0.00 C ATOM 1251 CD1 ILE A 81 -0.704 -3.710 -2.947 1.00 0.00 C ATOM 0 H ILE A 81 -0.391 -7.116 -4.623 1.00 0.00 H new ATOM 0 HA ILE A 81 -3.146 -6.302 -5.062 1.00 0.00 H new ATOM 0 HB ILE A 81 -0.464 -4.879 -5.229 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -2.744 -4.038 -3.480 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -1.875 -5.492 -3.032 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -1.731 -2.811 -5.669 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -1.927 -3.993 -6.984 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -3.230 -3.760 -5.796 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -0.946 -3.532 -1.899 1.00 0.00 H new ATOM 0 HD12 ILE A 81 0.250 -4.233 -3.015 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -0.633 -2.756 -3.470 1.00 0.00 H new ATOM 1263 N THR A 82 -0.928 -6.645 -7.497 1.00 0.00 N ATOM 1264 CA THR A 82 -0.783 -6.817 -8.937 1.00 0.00 C ATOM 1265 C THR A 82 -1.675 -7.942 -9.449 1.00 0.00 C ATOM 1266 O THR A 82 -2.209 -7.869 -10.556 1.00 0.00 O ATOM 1267 CB THR A 82 0.678 -7.120 -9.321 1.00 0.00 C ATOM 1268 OG1 THR A 82 1.232 -8.086 -8.421 1.00 0.00 O ATOM 1269 CG2 THR A 82 1.519 -5.853 -9.294 1.00 0.00 C ATOM 0 H THR A 82 -0.058 -6.731 -6.972 1.00 0.00 H new ATOM 0 HA THR A 82 -1.086 -5.878 -9.400 1.00 0.00 H new ATOM 0 HB THR A 82 0.688 -7.522 -10.334 1.00 0.00 H new ATOM 0 HG1 THR A 82 2.195 -8.168 -8.581 1.00 0.00 H new ATOM 0 HG21 THR A 82 2.546 -6.092 -9.569 1.00 0.00 H new ATOM 0 HG22 THR A 82 1.113 -5.131 -10.003 1.00 0.00 H new ATOM 0 HG23 THR A 82 1.501 -5.426 -8.291 1.00 0.00 H new ATOM 1277 N SER A 83 -1.832 -8.983 -8.637 1.00 0.00 N ATOM 1278 CA SER A 83 -2.658 -10.125 -9.011 1.00 0.00 C ATOM 1279 C SER A 83 -4.140 -9.765 -8.957 1.00 0.00 C ATOM 1280 O SER A 83 -4.931 -10.223 -9.782 1.00 0.00 O ATOM 1281 CB SER A 83 -2.376 -11.310 -8.084 1.00 0.00 C ATOM 1282 OG SER A 83 -2.640 -12.540 -8.735 1.00 0.00 O ATOM 0 H SER A 83 -1.398 -9.059 -7.717 1.00 0.00 H new ATOM 0 HA SER A 83 -2.407 -10.404 -10.034 1.00 0.00 H new ATOM 0 HB2 SER A 83 -1.336 -11.283 -7.760 1.00 0.00 H new ATOM 0 HB3 SER A 83 -2.992 -11.230 -7.188 1.00 0.00 H new ATOM 0 HG SER A 83 -3.504 -12.891 -8.434 1.00 0.00 H new ATOM 1288 N TYR A 84 -4.507 -8.942 -7.982 1.00 0.00 N ATOM 1289 CA TYR A 84 -5.894 -8.521 -7.818 1.00 0.00 C ATOM 1290 C TYR A 84 -6.339 -7.646 -8.986 1.00 0.00 C ATOM 1291 O TYR A 84 -7.526 -7.365 -9.148 1.00 0.00 O ATOM 1292 CB TYR A 84 -6.066 -7.762 -6.502 1.00 0.00 C ATOM 1293 CG TYR A 84 -7.509 -7.593 -6.085 1.00 0.00 C ATOM 1294 CD1 TYR A 84 -8.250 -6.494 -6.502 1.00 0.00 C ATOM 1295 CD2 TYR A 84 -8.133 -8.533 -5.272 1.00 0.00 C ATOM 1296 CE1 TYR A 84 -9.569 -6.336 -6.123 1.00 0.00 C ATOM 1297 CE2 TYR A 84 -9.451 -8.383 -4.889 1.00 0.00 C ATOM 1298 CZ TYR A 84 -10.165 -7.283 -5.317 1.00 0.00 C ATOM 1299 OH TYR A 84 -11.479 -7.130 -4.936 1.00 0.00 O ATOM 0 H TYR A 84 -3.864 -8.553 -7.293 1.00 0.00 H new ATOM 0 HA TYR A 84 -6.519 -9.414 -7.798 1.00 0.00 H new ATOM 0 HB2 TYR A 84 -5.529 -8.290 -5.715 1.00 0.00 H new ATOM 0 HB3 TYR A 84 -5.606 -6.778 -6.597 1.00 0.00 H new ATOM 0 HD1 TYR A 84 -7.787 -5.750 -7.133 1.00 0.00 H new ATOM 0 HD2 TYR A 84 -7.577 -9.395 -4.934 1.00 0.00 H new ATOM 0 HE1 TYR A 84 -10.130 -5.476 -6.456 1.00 0.00 H new ATOM 0 HE2 TYR A 84 -9.920 -9.123 -4.258 1.00 0.00 H new ATOM 0 HH TYR A 84 -12.061 -7.583 -5.581 1.00 0.00 H new ATOM 1309 N TYR A 85 -5.377 -7.219 -9.797 1.00 0.00 N ATOM 1310 CA TYR A 85 -5.668 -6.375 -10.949 1.00 0.00 C ATOM 1311 C TYR A 85 -5.815 -7.212 -12.215 1.00 0.00 C ATOM 1312 O TYR A 85 -6.625 -6.901 -13.089 1.00 0.00 O ATOM 1313 CB TYR A 85 -4.562 -5.335 -11.137 1.00 0.00 C ATOM 1314 CG TYR A 85 -4.837 -4.024 -10.435 1.00 0.00 C ATOM 1315 CD1 TYR A 85 -5.660 -3.064 -11.010 1.00 0.00 C ATOM 1316 CD2 TYR A 85 -4.274 -3.747 -9.195 1.00 0.00 C ATOM 1317 CE1 TYR A 85 -5.913 -1.866 -10.371 1.00 0.00 C ATOM 1318 CE2 TYR A 85 -4.523 -2.552 -8.549 1.00 0.00 C ATOM 1319 CZ TYR A 85 -5.342 -1.614 -9.141 1.00 0.00 C ATOM 1320 OH TYR A 85 -5.593 -0.422 -8.502 1.00 0.00 O ATOM 0 H TYR A 85 -4.389 -7.444 -9.677 1.00 0.00 H new ATOM 0 HA TYR A 85 -6.612 -5.863 -10.763 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -3.622 -5.745 -10.767 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -4.430 -5.146 -12.202 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -6.110 -3.258 -11.973 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -3.631 -4.479 -8.729 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -6.555 -1.130 -10.832 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -4.078 -2.353 -7.585 1.00 0.00 H new ATOM 0 HH TYR A 85 -6.556 -0.333 -8.341 1.00 0.00 H new ATOM 1330 N HIS A 86 -5.025 -8.278 -12.307 1.00 0.00 N ATOM 1331 CA HIS A 86 -5.067 -9.163 -13.466 1.00 0.00 C ATOM 1332 C HIS A 86 -6.084 -10.281 -13.259 1.00 0.00 C ATOM 1333 O HIS A 86 -6.605 -10.844 -14.221 1.00 0.00 O ATOM 1334 CB HIS A 86 -3.684 -9.758 -13.730 1.00 0.00 C ATOM 1335 CG HIS A 86 -2.587 -8.738 -13.749 1.00 0.00 C ATOM 1336 ND1 HIS A 86 -2.451 -7.572 -13.076 1.00 0.00 N flip ATOM 1337 CD2 HIS A 86 -1.458 -8.862 -14.531 1.00 0.00 C flip ATOM 1338 CE1 HIS A 86 -1.254 -7.018 -13.460 1.00 0.00 C flip ATOM 1339 NE2 HIS A 86 -0.675 -7.816 -14.338 1.00 0.00 N flip ATOM 0 H HIS A 86 -4.349 -8.549 -11.593 1.00 0.00 H new ATOM 0 HA HIS A 86 -5.372 -8.574 -14.331 1.00 0.00 H new ATOM 0 HB2 HIS A 86 -3.465 -10.501 -12.963 1.00 0.00 H new ATOM 0 HB3 HIS A 86 -3.699 -10.281 -14.686 1.00 0.00 H new ATOM 0 HD2 HIS A 86 -1.247 -9.686 -15.197 1.00 0.00 H new ATOM 0 HE1 HIS A 86 -0.852 -6.082 -13.102 1.00 0.00 H new ATOM 0 HE2 HIS A 86 0.224 -7.652 -14.791 1.00 0.00 H new ATOM 1348 N GLU A 87 -6.360 -10.598 -11.998 1.00 0.00 N ATOM 1349 CA GLU A 87 -7.313 -11.650 -11.666 1.00 0.00 C ATOM 1350 C GLU A 87 -8.699 -11.066 -11.405 1.00 0.00 C ATOM 1351 O GLU A 87 -9.623 -11.255 -12.196 1.00 0.00 O ATOM 1352 CB GLU A 87 -6.838 -12.431 -10.439 1.00 0.00 C ATOM 1353 CG GLU A 87 -5.459 -13.047 -10.606 1.00 0.00 C ATOM 1354 CD GLU A 87 -5.271 -14.294 -9.764 1.00 0.00 C ATOM 1355 OE1 GLU A 87 -6.160 -15.170 -9.793 1.00 0.00 O ATOM 1356 OE2 GLU A 87 -4.233 -14.393 -9.076 1.00 0.00 O ATOM 0 H GLU A 87 -5.937 -10.141 -11.190 1.00 0.00 H new ATOM 0 HA GLU A 87 -7.377 -12.328 -12.517 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -6.827 -11.765 -9.576 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -7.556 -13.222 -10.222 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -5.301 -13.295 -11.656 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -4.701 -12.312 -10.334 1.00 0.00 H new ATOM 1363 N PHE A 88 -8.836 -10.357 -10.290 1.00 0.00 N ATOM 1364 CA PHE A 88 -10.108 -9.746 -9.923 1.00 0.00 C ATOM 1365 C PHE A 88 -10.573 -8.770 -11.000 1.00 0.00 C ATOM 1366 O PHE A 88 -11.542 -9.031 -11.714 1.00 0.00 O ATOM 1367 CB PHE A 88 -9.983 -9.022 -8.581 1.00 0.00 C ATOM 1368 CG PHE A 88 -11.292 -8.860 -7.863 1.00 0.00 C ATOM 1369 CD1 PHE A 88 -11.984 -9.967 -7.399 1.00 0.00 C ATOM 1370 CD2 PHE A 88 -11.830 -7.601 -7.651 1.00 0.00 C ATOM 1371 CE1 PHE A 88 -13.189 -9.822 -6.737 1.00 0.00 C ATOM 1372 CE2 PHE A 88 -13.034 -7.450 -6.989 1.00 0.00 C ATOM 1373 CZ PHE A 88 -13.715 -8.562 -6.533 1.00 0.00 C ATOM 0 H PHE A 88 -8.081 -10.191 -9.624 1.00 0.00 H new ATOM 0 HA PHE A 88 -10.850 -10.539 -9.831 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -9.293 -9.574 -7.942 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -9.545 -8.038 -8.748 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -11.577 -10.955 -7.556 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -11.303 -6.728 -8.007 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -13.718 -10.693 -6.380 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -13.442 -6.463 -6.828 1.00 0.00 H new ATOM 0 HZ PHE A 88 -14.657 -8.446 -6.018 1.00 0.00 H new ATOM 1383 N LEU A 89 -9.877 -7.644 -11.109 1.00 0.00 N ATOM 1384 CA LEU A 89 -10.218 -6.626 -12.097 1.00 0.00 C ATOM 1385 C LEU A 89 -9.992 -7.146 -13.513 1.00 0.00 C ATOM 1386 O LEU A 89 -10.855 -7.010 -14.380 1.00 0.00 O ATOM 1387 CB LEU A 89 -9.385 -5.364 -11.866 1.00 0.00 C ATOM 1388 CG LEU A 89 -9.756 -4.531 -10.638 1.00 0.00 C ATOM 1389 CD1 LEU A 89 -8.827 -3.334 -10.505 1.00 0.00 C ATOM 1390 CD2 LEU A 89 -11.206 -4.077 -10.720 1.00 0.00 C ATOM 0 H LEU A 89 -9.073 -7.413 -10.526 1.00 0.00 H new ATOM 0 HA LEU A 89 -11.274 -6.382 -11.983 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -8.338 -5.654 -11.781 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -9.469 -4.731 -12.749 1.00 0.00 H new ATOM 0 HG LEU A 89 -9.641 -5.154 -9.751 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -9.106 -2.753 -9.626 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -7.799 -3.681 -10.399 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -8.909 -2.709 -11.394 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -11.453 -3.486 -9.838 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -11.347 -3.471 -11.615 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -11.858 -4.949 -10.766 1.00 0.00 H new ATOM 1402 N GLY A 90 -8.826 -7.744 -13.740 1.00 0.00 N ATOM 1403 CA GLY A 90 -8.509 -8.277 -15.052 1.00 0.00 C ATOM 1404 C GLY A 90 -7.441 -7.470 -15.763 1.00 0.00 C ATOM 1405 O GLY A 90 -6.699 -8.002 -16.589 1.00 0.00 O ATOM 0 H GLY A 90 -8.096 -7.869 -13.039 1.00 0.00 H new ATOM 0 HA2 GLY A 90 -8.173 -9.309 -14.950 1.00 0.00 H new ATOM 0 HA3 GLY A 90 -9.412 -8.295 -15.661 1.00 0.00 H new ATOM 1409 N GLN A 91 -7.363 -6.182 -15.443 1.00 0.00 N ATOM 1410 CA GLN A 91 -6.379 -5.301 -16.060 1.00 0.00 C ATOM 1411 C GLN A 91 -4.984 -5.570 -15.505 1.00 0.00 C ATOM 1412 O GLN A 91 -4.820 -6.343 -14.562 1.00 0.00 O ATOM 1413 CB GLN A 91 -6.758 -3.837 -15.829 1.00 0.00 C ATOM 1414 CG GLN A 91 -6.929 -3.477 -14.361 1.00 0.00 C ATOM 1415 CD GLN A 91 -7.981 -2.408 -14.141 1.00 0.00 C ATOM 1416 OE1 GLN A 91 -8.967 -2.331 -14.874 1.00 0.00 O ATOM 1417 NE2 GLN A 91 -7.776 -1.575 -13.128 1.00 0.00 N ATOM 0 H GLN A 91 -7.969 -5.726 -14.761 1.00 0.00 H new ATOM 0 HA GLN A 91 -6.370 -5.502 -17.131 1.00 0.00 H new ATOM 0 HB2 GLN A 91 -5.989 -3.198 -16.264 1.00 0.00 H new ATOM 0 HB3 GLN A 91 -7.687 -3.623 -16.358 1.00 0.00 H new ATOM 0 HG2 GLN A 91 -7.203 -4.371 -13.801 1.00 0.00 H new ATOM 0 HG3 GLN A 91 -5.976 -3.131 -13.962 1.00 0.00 H new ATOM 0 HE21 GLN A 91 -6.945 -1.675 -12.546 1.00 0.00 H new ATOM 0 HE22 GLN A 91 -8.450 -0.835 -12.932 1.00 0.00 H new ATOM 1426 N GLN A 92 -3.982 -4.928 -16.098 1.00 0.00 N ATOM 1427 CA GLN A 92 -2.601 -5.100 -15.663 1.00 0.00 C ATOM 1428 C GLN A 92 -2.074 -3.828 -15.009 1.00 0.00 C ATOM 1429 O GLN A 92 -2.817 -2.865 -14.813 1.00 0.00 O ATOM 1430 CB GLN A 92 -1.715 -5.483 -16.850 1.00 0.00 C ATOM 1431 CG GLN A 92 -1.653 -4.416 -17.931 1.00 0.00 C ATOM 1432 CD GLN A 92 -1.144 -4.955 -19.254 1.00 0.00 C ATOM 1433 OE1 GLN A 92 -1.090 -6.168 -19.464 1.00 0.00 O ATOM 1434 NE2 GLN A 92 -0.768 -4.056 -20.155 1.00 0.00 N ATOM 0 H GLN A 92 -4.101 -4.285 -16.880 1.00 0.00 H new ATOM 0 HA GLN A 92 -2.576 -5.902 -14.926 1.00 0.00 H new ATOM 0 HB2 GLN A 92 -0.706 -5.683 -16.490 1.00 0.00 H new ATOM 0 HB3 GLN A 92 -2.087 -6.410 -17.287 1.00 0.00 H new ATOM 0 HG2 GLN A 92 -2.646 -3.991 -18.074 1.00 0.00 H new ATOM 0 HG3 GLN A 92 -1.004 -3.605 -17.599 1.00 0.00 H new ATOM 0 HE21 GLN A 92 -0.830 -3.061 -19.939 1.00 0.00 H new ATOM 0 HE22 GLN A 92 -0.418 -4.360 -21.063 1.00 0.00 H new ATOM 1443 N ILE A 93 -0.789 -3.830 -14.672 1.00 0.00 N ATOM 1444 CA ILE A 93 -0.162 -2.676 -14.040 1.00 0.00 C ATOM 1445 C ILE A 93 1.110 -2.270 -14.775 1.00 0.00 C ATOM 1446 O ILE A 93 1.942 -3.113 -15.110 1.00 0.00 O ATOM 1447 CB ILE A 93 0.178 -2.957 -12.565 1.00 0.00 C ATOM 1448 CG1 ILE A 93 -1.104 -3.097 -11.741 1.00 0.00 C ATOM 1449 CG2 ILE A 93 1.057 -1.849 -12.003 1.00 0.00 C ATOM 1450 CD1 ILE A 93 -0.860 -3.151 -10.249 1.00 0.00 C ATOM 0 H ILE A 93 -0.161 -4.619 -14.826 1.00 0.00 H new ATOM 0 HA ILE A 93 -0.883 -1.860 -14.089 1.00 0.00 H new ATOM 0 HB ILE A 93 0.729 -3.896 -12.507 1.00 0.00 H new ATOM 0 HG12 ILE A 93 -1.763 -2.257 -11.963 1.00 0.00 H new ATOM 0 HG13 ILE A 93 -1.627 -4.003 -12.049 1.00 0.00 H new ATOM 0 HG21 ILE A 93 1.289 -2.062 -10.959 1.00 0.00 H new ATOM 0 HG22 ILE A 93 1.983 -1.793 -12.576 1.00 0.00 H new ATOM 0 HG23 ILE A 93 0.530 -0.897 -12.071 1.00 0.00 H new ATOM 0 HD11 ILE A 93 -1.812 -3.251 -9.728 1.00 0.00 H new ATOM 0 HD12 ILE A 93 -0.227 -4.007 -10.015 1.00 0.00 H new ATOM 0 HD13 ILE A 93 -0.365 -2.235 -9.928 1.00 0.00 H new ATOM 1462 N SER A 94 1.256 -0.972 -15.023 1.00 0.00 N ATOM 1463 CA SER A 94 2.426 -0.453 -15.720 1.00 0.00 C ATOM 1464 C SER A 94 3.623 -0.361 -14.779 1.00 0.00 C ATOM 1465 O SER A 94 3.470 -0.094 -13.587 1.00 0.00 O ATOM 1466 CB SER A 94 2.124 0.924 -16.314 1.00 0.00 C ATOM 1467 OG SER A 94 1.630 0.811 -17.638 1.00 0.00 O ATOM 0 H SER A 94 0.578 -0.261 -14.751 1.00 0.00 H new ATOM 0 HA SER A 94 2.672 -1.143 -16.527 1.00 0.00 H new ATOM 0 HB2 SER A 94 1.392 1.439 -15.692 1.00 0.00 H new ATOM 0 HB3 SER A 94 3.029 1.531 -16.311 1.00 0.00 H new ATOM 0 HG SER A 94 1.443 1.704 -17.995 1.00 0.00 H new ATOM 1473 N GLU A 95 4.815 -0.585 -15.323 1.00 0.00 N ATOM 1474 CA GLU A 95 6.039 -0.528 -14.532 1.00 0.00 C ATOM 1475 C GLU A 95 6.128 0.786 -13.761 1.00 0.00 C ATOM 1476 O GLU A 95 6.909 0.913 -12.819 1.00 0.00 O ATOM 1477 CB GLU A 95 7.264 -0.687 -15.434 1.00 0.00 C ATOM 1478 CG GLU A 95 7.683 -2.132 -15.643 1.00 0.00 C ATOM 1479 CD GLU A 95 9.170 -2.277 -15.901 1.00 0.00 C ATOM 1480 OE1 GLU A 95 9.934 -2.393 -14.920 1.00 0.00 O ATOM 1481 OE2 GLU A 95 9.569 -2.276 -17.085 1.00 0.00 O ATOM 0 H GLU A 95 4.959 -0.808 -16.308 1.00 0.00 H new ATOM 0 HA GLU A 95 6.016 -1.349 -13.815 1.00 0.00 H new ATOM 0 HB2 GLU A 95 7.052 -0.235 -16.403 1.00 0.00 H new ATOM 0 HB3 GLU A 95 8.098 -0.135 -15.001 1.00 0.00 H new ATOM 0 HG2 GLU A 95 7.412 -2.716 -14.763 1.00 0.00 H new ATOM 0 HG3 GLU A 95 7.130 -2.549 -16.485 1.00 0.00 H new ATOM 1488 N GLU A 96 5.321 1.761 -14.169 1.00 0.00 N ATOM 1489 CA GLU A 96 5.310 3.065 -13.518 1.00 0.00 C ATOM 1490 C GLU A 96 4.738 2.964 -12.107 1.00 0.00 C ATOM 1491 O GLU A 96 5.101 3.739 -11.221 1.00 0.00 O ATOM 1492 CB GLU A 96 4.494 4.064 -14.341 1.00 0.00 C ATOM 1493 CG GLU A 96 5.025 4.270 -15.750 1.00 0.00 C ATOM 1494 CD GLU A 96 6.335 5.034 -15.773 1.00 0.00 C ATOM 1495 OE1 GLU A 96 7.360 4.469 -15.337 1.00 0.00 O ATOM 1496 OE2 GLU A 96 6.335 6.196 -16.229 1.00 0.00 O ATOM 0 H GLU A 96 4.667 1.672 -14.947 1.00 0.00 H new ATOM 0 HA GLU A 96 6.339 3.417 -13.450 1.00 0.00 H new ATOM 0 HB2 GLU A 96 3.462 3.718 -14.398 1.00 0.00 H new ATOM 0 HB3 GLU A 96 4.480 5.023 -13.823 1.00 0.00 H new ATOM 0 HG2 GLU A 96 5.166 3.300 -16.227 1.00 0.00 H new ATOM 0 HG3 GLU A 96 4.283 4.810 -16.339 1.00 0.00 H new ATOM 1503 N LEU A 97 3.841 2.005 -11.906 1.00 0.00 N ATOM 1504 CA LEU A 97 3.217 1.802 -10.604 1.00 0.00 C ATOM 1505 C LEU A 97 3.972 0.752 -9.796 1.00 0.00 C ATOM 1506 O LEU A 97 3.992 0.797 -8.565 1.00 0.00 O ATOM 1507 CB LEU A 97 1.758 1.377 -10.776 1.00 0.00 C ATOM 1508 CG LEU A 97 0.941 2.175 -11.793 1.00 0.00 C ATOM 1509 CD1 LEU A 97 -0.457 1.593 -11.930 1.00 0.00 C ATOM 1510 CD2 LEU A 97 0.874 3.641 -11.390 1.00 0.00 C ATOM 0 H LEU A 97 3.530 1.356 -12.628 1.00 0.00 H new ATOM 0 HA LEU A 97 3.252 2.746 -10.061 1.00 0.00 H new ATOM 0 HB2 LEU A 97 1.739 0.327 -11.068 1.00 0.00 H new ATOM 0 HB3 LEU A 97 1.263 1.448 -9.807 1.00 0.00 H new ATOM 0 HG LEU A 97 1.436 2.107 -12.762 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -1.023 2.174 -12.658 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -0.389 0.558 -12.266 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -0.962 1.629 -10.965 1.00 0.00 H new ATOM 0 HD21 LEU A 97 0.289 4.194 -12.125 1.00 0.00 H new ATOM 0 HD22 LEU A 97 0.403 3.728 -10.411 1.00 0.00 H new ATOM 0 HD23 LEU A 97 1.882 4.052 -11.345 1.00 0.00 H new ATOM 1522 N ILE A 98 4.595 -0.191 -10.495 1.00 0.00 N ATOM 1523 CA ILE A 98 5.355 -1.249 -9.843 1.00 0.00 C ATOM 1524 C ILE A 98 6.338 -0.675 -8.829 1.00 0.00 C ATOM 1525 O ILE A 98 7.366 -0.097 -9.182 1.00 0.00 O ATOM 1526 CB ILE A 98 6.128 -2.100 -10.867 1.00 0.00 C ATOM 1527 CG1 ILE A 98 5.166 -2.706 -11.891 1.00 0.00 C ATOM 1528 CG2 ILE A 98 6.916 -3.194 -10.161 1.00 0.00 C ATOM 1529 CD1 ILE A 98 4.248 -3.758 -11.309 1.00 0.00 C ATOM 0 H ILE A 98 4.588 -0.243 -11.514 1.00 0.00 H new ATOM 0 HA ILE A 98 4.634 -1.883 -9.327 1.00 0.00 H new ATOM 0 HB ILE A 98 6.831 -1.455 -11.394 1.00 0.00 H new ATOM 0 HG12 ILE A 98 4.563 -1.909 -12.326 1.00 0.00 H new ATOM 0 HG13 ILE A 98 5.744 -3.148 -12.703 1.00 0.00 H new ATOM 0 HG21 ILE A 98 7.457 -3.787 -10.899 1.00 0.00 H new ATOM 0 HG22 ILE A 98 7.626 -2.742 -9.468 1.00 0.00 H new ATOM 0 HG23 ILE A 98 6.231 -3.838 -9.610 1.00 0.00 H new ATOM 0 HD11 ILE A 98 3.594 -4.144 -12.091 1.00 0.00 H new ATOM 0 HD12 ILE A 98 4.843 -4.574 -10.899 1.00 0.00 H new ATOM 0 HD13 ILE A 98 3.644 -3.316 -10.517 1.00 0.00 H new ATOM 1541 N PRO A 99 6.019 -0.839 -7.536 1.00 0.00 N ATOM 1542 CA PRO A 99 6.863 -0.347 -6.444 1.00 0.00 C ATOM 1543 C PRO A 99 8.167 -1.127 -6.322 1.00 0.00 C ATOM 1544 O PRO A 99 8.160 -2.353 -6.213 1.00 0.00 O ATOM 1545 CB PRO A 99 5.994 -0.559 -5.201 1.00 0.00 C ATOM 1546 CG PRO A 99 5.072 -1.670 -5.569 1.00 0.00 C ATOM 1547 CD PRO A 99 4.810 -1.519 -7.042 1.00 0.00 C ATOM 0 HA PRO A 99 7.166 0.689 -6.598 1.00 0.00 H new ATOM 0 HB2 PRO A 99 6.601 -0.819 -4.333 1.00 0.00 H new ATOM 0 HB3 PRO A 99 5.442 0.345 -4.945 1.00 0.00 H new ATOM 0 HG2 PRO A 99 5.521 -2.639 -5.350 1.00 0.00 H new ATOM 0 HG3 PRO A 99 4.144 -1.612 -5.000 1.00 0.00 H new ATOM 0 HD2 PRO A 99 4.667 -2.485 -7.526 1.00 0.00 H new ATOM 0 HD3 PRO A 99 3.912 -0.931 -7.232 1.00 0.00 H new ATOM 1555 N ASP A 100 9.285 -0.409 -6.340 1.00 0.00 N ATOM 1556 CA ASP A 100 10.598 -1.034 -6.230 1.00 0.00 C ATOM 1557 C ASP A 100 10.910 -1.389 -4.780 1.00 0.00 C ATOM 1558 O ASP A 100 11.370 -0.547 -4.008 1.00 0.00 O ATOM 1559 CB ASP A 100 11.677 -0.103 -6.784 1.00 0.00 C ATOM 1560 CG ASP A 100 11.896 -0.291 -8.272 1.00 0.00 C ATOM 1561 OD1 ASP A 100 11.054 0.188 -9.060 1.00 0.00 O ATOM 1562 OD2 ASP A 100 12.908 -0.919 -8.649 1.00 0.00 O ATOM 0 H ASP A 100 9.308 0.607 -6.430 1.00 0.00 H new ATOM 0 HA ASP A 100 10.587 -1.953 -6.816 1.00 0.00 H new ATOM 0 HB2 ASP A 100 11.395 0.932 -6.589 1.00 0.00 H new ATOM 0 HB3 ASP A 100 12.614 -0.283 -6.256 1.00 0.00 H new ATOM 1567 N LEU A 101 10.656 -2.641 -4.415 1.00 0.00 N ATOM 1568 CA LEU A 101 10.909 -3.109 -3.056 1.00 0.00 C ATOM 1569 C LEU A 101 12.402 -3.093 -2.744 1.00 0.00 C ATOM 1570 O LEU A 101 12.820 -2.631 -1.683 1.00 0.00 O ATOM 1571 CB LEU A 101 10.353 -4.521 -2.870 1.00 0.00 C ATOM 1572 CG LEU A 101 9.104 -4.863 -3.684 1.00 0.00 C ATOM 1573 CD1 LEU A 101 8.560 -6.225 -3.280 1.00 0.00 C ATOM 1574 CD2 LEU A 101 8.041 -3.789 -3.507 1.00 0.00 C ATOM 0 H LEU A 101 10.275 -3.351 -5.041 1.00 0.00 H new ATOM 0 HA LEU A 101 10.405 -2.433 -2.366 1.00 0.00 H new ATOM 0 HB2 LEU A 101 11.136 -5.235 -3.126 1.00 0.00 H new ATOM 0 HB3 LEU A 101 10.124 -4.664 -1.814 1.00 0.00 H new ATOM 0 HG LEU A 101 9.380 -4.902 -4.738 1.00 0.00 H new ATOM 0 HD11 LEU A 101 7.672 -6.451 -3.870 1.00 0.00 H new ATOM 0 HD12 LEU A 101 9.318 -6.987 -3.459 1.00 0.00 H new ATOM 0 HD13 LEU A 101 8.300 -6.214 -2.222 1.00 0.00 H new ATOM 0 HD21 LEU A 101 7.160 -4.049 -4.093 1.00 0.00 H new ATOM 0 HD22 LEU A 101 7.768 -3.717 -2.454 1.00 0.00 H new ATOM 0 HD23 LEU A 101 8.433 -2.830 -3.847 1.00 0.00 H new ATOM 1586 N ASN A 102 13.202 -3.598 -3.678 1.00 0.00 N ATOM 1587 CA ASN A 102 14.649 -3.641 -3.503 1.00 0.00 C ATOM 1588 C ASN A 102 15.188 -2.274 -3.090 1.00 0.00 C ATOM 1589 O ASN A 102 16.095 -2.178 -2.265 1.00 0.00 O ATOM 1590 CB ASN A 102 15.327 -4.099 -4.796 1.00 0.00 C ATOM 1591 CG ASN A 102 15.510 -5.603 -4.851 1.00 0.00 C ATOM 1592 OD1 ASN A 102 16.267 -6.176 -4.068 1.00 0.00 O ATOM 1593 ND2 ASN A 102 14.817 -6.250 -5.780 1.00 0.00 N ATOM 0 H ASN A 102 12.873 -3.983 -4.563 1.00 0.00 H new ATOM 0 HA ASN A 102 14.873 -4.355 -2.710 1.00 0.00 H new ATOM 0 HB2 ASN A 102 14.731 -3.777 -5.650 1.00 0.00 H new ATOM 0 HB3 ASN A 102 16.299 -3.614 -4.885 1.00 0.00 H new ATOM 0 HD21 ASN A 102 14.901 -7.263 -5.866 1.00 0.00 H new ATOM 0 HD22 ASN A 102 14.201 -5.734 -6.408 1.00 0.00 H new ATOM 1600 N GLN A 103 14.621 -1.221 -3.671 1.00 0.00 N ATOM 1601 CA GLN A 103 15.045 0.140 -3.363 1.00 0.00 C ATOM 1602 C GLN A 103 14.348 0.656 -2.108 1.00 0.00 C ATOM 1603 O GLN A 103 14.711 1.703 -1.571 1.00 0.00 O ATOM 1604 CB GLN A 103 14.750 1.067 -4.543 1.00 0.00 C ATOM 1605 CG GLN A 103 15.917 1.218 -5.505 1.00 0.00 C ATOM 1606 CD GLN A 103 16.529 -0.114 -5.893 1.00 0.00 C ATOM 1607 OE1 GLN A 103 17.662 -0.421 -5.521 1.00 0.00 O ATOM 1608 NE2 GLN A 103 15.781 -0.913 -6.645 1.00 0.00 N ATOM 0 H GLN A 103 13.868 -1.284 -4.356 1.00 0.00 H new ATOM 0 HA GLN A 103 16.119 0.127 -3.180 1.00 0.00 H new ATOM 0 HB2 GLN A 103 13.888 0.684 -5.088 1.00 0.00 H new ATOM 0 HB3 GLN A 103 14.475 2.050 -4.162 1.00 0.00 H new ATOM 0 HG2 GLN A 103 15.578 1.733 -6.404 1.00 0.00 H new ATOM 0 HG3 GLN A 103 16.682 1.845 -5.047 1.00 0.00 H new ATOM 0 HE21 GLN A 103 14.847 -0.618 -6.930 1.00 0.00 H new ATOM 0 HE22 GLN A 103 16.140 -1.822 -6.937 1.00 0.00 H new ATOM 1617 N ILE A 104 13.345 -0.084 -1.647 1.00 0.00 N ATOM 1618 CA ILE A 104 12.598 0.299 -0.456 1.00 0.00 C ATOM 1619 C ILE A 104 13.118 -0.432 0.778 1.00 0.00 C ATOM 1620 O ILE A 104 12.980 0.049 1.903 1.00 0.00 O ATOM 1621 CB ILE A 104 11.094 0.007 -0.616 1.00 0.00 C ATOM 1622 CG1 ILE A 104 10.479 0.945 -1.656 1.00 0.00 C ATOM 1623 CG2 ILE A 104 10.382 0.150 0.721 1.00 0.00 C ATOM 1624 CD1 ILE A 104 9.147 0.465 -2.189 1.00 0.00 C ATOM 0 H ILE A 104 13.031 -0.952 -2.081 1.00 0.00 H new ATOM 0 HA ILE A 104 12.740 1.372 -0.327 1.00 0.00 H new ATOM 0 HB ILE A 104 10.972 -1.019 -0.962 1.00 0.00 H new ATOM 0 HG12 ILE A 104 10.349 1.932 -1.212 1.00 0.00 H new ATOM 0 HG13 ILE A 104 11.174 1.059 -2.488 1.00 0.00 H new ATOM 0 HG21 ILE A 104 9.320 -0.059 0.592 1.00 0.00 H new ATOM 0 HG22 ILE A 104 10.806 -0.554 1.436 1.00 0.00 H new ATOM 0 HG23 ILE A 104 10.509 1.166 1.094 1.00 0.00 H new ATOM 0 HD11 ILE A 104 8.770 1.179 -2.922 1.00 0.00 H new ATOM 0 HD12 ILE A 104 9.274 -0.508 -2.663 1.00 0.00 H new ATOM 0 HD13 ILE A 104 8.436 0.379 -1.367 1.00 0.00 H new ATOM 1636 N THR A 105 13.719 -1.597 0.559 1.00 0.00 N ATOM 1637 CA THR A 105 14.261 -2.395 1.651 1.00 0.00 C ATOM 1638 C THR A 105 15.748 -2.120 1.848 1.00 0.00 C ATOM 1639 O THR A 105 16.257 -2.187 2.966 1.00 0.00 O ATOM 1640 CB THR A 105 14.057 -3.901 1.402 1.00 0.00 C ATOM 1641 OG1 THR A 105 12.941 -4.107 0.529 1.00 0.00 O ATOM 1642 CG2 THR A 105 13.825 -4.640 2.712 1.00 0.00 C ATOM 0 H THR A 105 13.843 -2.009 -0.366 1.00 0.00 H new ATOM 0 HA THR A 105 13.719 -2.107 2.552 1.00 0.00 H new ATOM 0 HB THR A 105 14.960 -4.295 0.936 1.00 0.00 H new ATOM 0 HG1 THR A 105 13.174 -3.809 -0.375 1.00 0.00 H new ATOM 0 HG21 THR A 105 13.684 -5.702 2.511 1.00 0.00 H new ATOM 0 HG22 THR A 105 14.689 -4.506 3.363 1.00 0.00 H new ATOM 0 HG23 THR A 105 12.936 -4.242 3.202 1.00 0.00 H new ATOM 1650 N GLU A 106 16.437 -1.811 0.754 1.00 0.00 N ATOM 1651 CA GLU A 106 17.866 -1.526 0.808 1.00 0.00 C ATOM 1652 C GLU A 106 18.119 -0.024 0.905 1.00 0.00 C ATOM 1653 O GLU A 106 19.054 0.417 1.574 1.00 0.00 O ATOM 1654 CB GLU A 106 18.569 -2.095 -0.426 1.00 0.00 C ATOM 1655 CG GLU A 106 18.456 -3.605 -0.549 1.00 0.00 C ATOM 1656 CD GLU A 106 19.604 -4.214 -1.332 1.00 0.00 C ATOM 1657 OE1 GLU A 106 19.565 -4.160 -2.579 1.00 0.00 O ATOM 1658 OE2 GLU A 106 20.540 -4.744 -0.698 1.00 0.00 O ATOM 0 H GLU A 106 16.029 -1.752 -0.179 1.00 0.00 H new ATOM 0 HA GLU A 106 18.272 -2.003 1.700 1.00 0.00 H new ATOM 0 HB2 GLU A 106 18.147 -1.634 -1.319 1.00 0.00 H new ATOM 0 HB3 GLU A 106 19.623 -1.820 -0.392 1.00 0.00 H new ATOM 0 HG2 GLU A 106 18.426 -4.046 0.447 1.00 0.00 H new ATOM 0 HG3 GLU A 106 17.514 -3.857 -1.037 1.00 0.00 H new ATOM 1665 N CYS A 107 17.280 0.755 0.231 1.00 0.00 N ATOM 1666 CA CYS A 107 17.412 2.207 0.239 1.00 0.00 C ATOM 1667 C CYS A 107 16.304 2.850 1.067 1.00 0.00 C ATOM 1668 O CYS A 107 16.556 3.751 1.866 1.00 0.00 O ATOM 1669 CB CYS A 107 17.378 2.751 -1.190 1.00 0.00 C ATOM 1670 SG CYS A 107 19.011 3.002 -1.923 1.00 0.00 S ATOM 0 H CYS A 107 16.502 0.405 -0.328 1.00 0.00 H new ATOM 0 HA CYS A 107 18.371 2.457 0.693 1.00 0.00 H new ATOM 0 HB2 CYS A 107 16.812 2.061 -1.817 1.00 0.00 H new ATOM 0 HB3 CYS A 107 16.840 3.699 -1.194 1.00 0.00 H new ATOM 0 HG CYS A 107 18.878 3.461 -3.132 1.00 0.00 H new ATOM 1676 N ALA A 108 15.076 2.380 0.869 1.00 0.00 N ATOM 1677 CA ALA A 108 13.930 2.909 1.598 1.00 0.00 C ATOM 1678 C ALA A 108 13.566 4.307 1.109 1.00 0.00 C ATOM 1679 O ALA A 108 12.971 5.096 1.844 1.00 0.00 O ATOM 1680 CB ALA A 108 14.217 2.928 3.092 1.00 0.00 C ATOM 0 H ALA A 108 14.850 1.635 0.210 1.00 0.00 H new ATOM 0 HA ALA A 108 13.079 2.254 1.412 1.00 0.00 H new ATOM 0 HB1 ALA A 108 13.352 3.325 3.624 1.00 0.00 H new ATOM 0 HB2 ALA A 108 14.420 1.914 3.436 1.00 0.00 H new ATOM 0 HB3 ALA A 108 15.085 3.558 3.288 1.00 0.00 H new ATOM 1686 N ASP A 109 13.927 4.607 -0.133 1.00 0.00 N ATOM 1687 CA ASP A 109 13.638 5.910 -0.720 1.00 0.00 C ATOM 1688 C ASP A 109 12.159 6.255 -0.575 1.00 0.00 C ATOM 1689 O ASP A 109 11.282 5.398 -0.686 1.00 0.00 O ATOM 1690 CB ASP A 109 14.036 5.928 -2.196 1.00 0.00 C ATOM 1691 CG ASP A 109 14.486 7.301 -2.658 1.00 0.00 C ATOM 1692 OD1 ASP A 109 15.521 7.786 -2.155 1.00 0.00 O ATOM 1693 OD2 ASP A 109 13.802 7.891 -3.520 1.00 0.00 O ATOM 0 H ASP A 109 14.421 3.965 -0.753 1.00 0.00 H new ATOM 0 HA ASP A 109 14.222 6.659 -0.185 1.00 0.00 H new ATOM 0 HB2 ASP A 109 14.840 5.211 -2.361 1.00 0.00 H new ATOM 0 HB3 ASP A 109 13.190 5.603 -2.801 1.00 0.00 H new ATOM 1698 N PRO A 110 11.873 7.541 -0.321 1.00 0.00 N ATOM 1699 CA PRO A 110 10.500 8.028 -0.155 1.00 0.00 C ATOM 1700 C PRO A 110 9.717 8.012 -1.463 1.00 0.00 C ATOM 1701 O PRO A 110 8.486 8.016 -1.461 1.00 0.00 O ATOM 1702 CB PRO A 110 10.692 9.466 0.335 1.00 0.00 C ATOM 1703 CG PRO A 110 12.031 9.867 -0.180 1.00 0.00 C ATOM 1704 CD PRO A 110 12.867 8.617 -0.176 1.00 0.00 C ATOM 0 HA PRO A 110 9.925 7.403 0.528 1.00 0.00 H new ATOM 0 HB2 PRO A 110 9.909 10.122 -0.046 1.00 0.00 H new ATOM 0 HB3 PRO A 110 10.653 9.522 1.423 1.00 0.00 H new ATOM 0 HG2 PRO A 110 11.954 10.282 -1.185 1.00 0.00 H new ATOM 0 HG3 PRO A 110 12.477 10.637 0.450 1.00 0.00 H new ATOM 0 HD2 PRO A 110 13.587 8.612 -0.995 1.00 0.00 H new ATOM 0 HD3 PRO A 110 13.436 8.517 0.749 1.00 0.00 H new ATOM 1712 N VAL A 111 10.438 7.991 -2.579 1.00 0.00 N ATOM 1713 CA VAL A 111 9.811 7.972 -3.895 1.00 0.00 C ATOM 1714 C VAL A 111 9.298 6.578 -4.239 1.00 0.00 C ATOM 1715 O VAL A 111 8.270 6.430 -4.898 1.00 0.00 O ATOM 1716 CB VAL A 111 10.790 8.432 -4.991 1.00 0.00 C ATOM 1717 CG1 VAL A 111 10.110 8.428 -6.351 1.00 0.00 C ATOM 1718 CG2 VAL A 111 11.343 9.811 -4.666 1.00 0.00 C ATOM 0 H VAL A 111 11.458 7.987 -2.598 1.00 0.00 H new ATOM 0 HA VAL A 111 8.971 8.666 -3.855 1.00 0.00 H new ATOM 0 HB VAL A 111 11.624 7.731 -5.027 1.00 0.00 H new ATOM 0 HG11 VAL A 111 10.818 8.756 -7.113 1.00 0.00 H new ATOM 0 HG12 VAL A 111 9.768 7.420 -6.584 1.00 0.00 H new ATOM 0 HG13 VAL A 111 9.256 9.106 -6.333 1.00 0.00 H new ATOM 0 HG21 VAL A 111 12.033 10.121 -5.451 1.00 0.00 H new ATOM 0 HG22 VAL A 111 10.523 10.526 -4.601 1.00 0.00 H new ATOM 0 HG23 VAL A 111 11.870 9.776 -3.713 1.00 0.00 H new ATOM 1728 N GLU A 112 10.023 5.559 -3.787 1.00 0.00 N ATOM 1729 CA GLU A 112 9.640 4.176 -4.048 1.00 0.00 C ATOM 1730 C GLU A 112 8.626 3.688 -3.017 1.00 0.00 C ATOM 1731 O GLU A 112 7.604 3.098 -3.367 1.00 0.00 O ATOM 1732 CB GLU A 112 10.874 3.271 -4.034 1.00 0.00 C ATOM 1733 CG GLU A 112 11.828 3.525 -5.189 1.00 0.00 C ATOM 1734 CD GLU A 112 12.878 4.568 -4.861 1.00 0.00 C ATOM 1735 OE1 GLU A 112 13.940 4.193 -4.323 1.00 0.00 O ATOM 1736 OE2 GLU A 112 12.636 5.761 -5.144 1.00 0.00 O ATOM 0 H GLU A 112 10.877 5.665 -3.239 1.00 0.00 H new ATOM 0 HA GLU A 112 9.178 4.134 -5.034 1.00 0.00 H new ATOM 0 HB2 GLU A 112 11.408 3.414 -3.095 1.00 0.00 H new ATOM 0 HB3 GLU A 112 10.551 2.230 -4.062 1.00 0.00 H new ATOM 0 HG2 GLU A 112 12.321 2.591 -5.460 1.00 0.00 H new ATOM 0 HG3 GLU A 112 11.259 3.849 -6.060 1.00 0.00 H new ATOM 1743 N LEU A 113 8.917 3.939 -1.746 1.00 0.00 N ATOM 1744 CA LEU A 113 8.032 3.525 -0.662 1.00 0.00 C ATOM 1745 C LEU A 113 6.574 3.803 -1.014 1.00 0.00 C ATOM 1746 O LEU A 113 5.718 2.927 -0.893 1.00 0.00 O ATOM 1747 CB LEU A 113 8.404 4.251 0.632 1.00 0.00 C ATOM 1748 CG LEU A 113 7.838 3.656 1.922 1.00 0.00 C ATOM 1749 CD1 LEU A 113 6.423 4.158 2.166 1.00 0.00 C ATOM 1750 CD2 LEU A 113 7.864 2.136 1.864 1.00 0.00 C ATOM 0 H LEU A 113 9.759 4.427 -1.440 1.00 0.00 H new ATOM 0 HA LEU A 113 8.153 2.452 -0.516 1.00 0.00 H new ATOM 0 HB2 LEU A 113 9.491 4.274 0.712 1.00 0.00 H new ATOM 0 HB3 LEU A 113 8.068 5.285 0.554 1.00 0.00 H new ATOM 0 HG LEU A 113 8.464 3.979 2.754 1.00 0.00 H new ATOM 0 HD11 LEU A 113 6.037 3.724 3.088 1.00 0.00 H new ATOM 0 HD12 LEU A 113 6.432 5.245 2.252 1.00 0.00 H new ATOM 0 HD13 LEU A 113 5.784 3.866 1.332 1.00 0.00 H new ATOM 0 HD21 LEU A 113 7.458 1.730 2.790 1.00 0.00 H new ATOM 0 HD22 LEU A 113 7.262 1.794 1.022 1.00 0.00 H new ATOM 0 HD23 LEU A 113 8.891 1.794 1.738 1.00 0.00 H new ATOM 1762 N GLY A 114 6.300 5.027 -1.454 1.00 0.00 N ATOM 1763 CA GLY A 114 4.945 5.398 -1.819 1.00 0.00 C ATOM 1764 C GLY A 114 4.351 4.471 -2.861 1.00 0.00 C ATOM 1765 O GLY A 114 3.188 4.079 -2.763 1.00 0.00 O ATOM 0 H GLY A 114 6.992 5.768 -1.564 1.00 0.00 H new ATOM 0 HA2 GLY A 114 4.317 5.389 -0.928 1.00 0.00 H new ATOM 0 HA3 GLY A 114 4.941 6.419 -2.201 1.00 0.00 H new ATOM 1769 N ARG A 115 5.151 4.119 -3.863 1.00 0.00 N ATOM 1770 CA ARG A 115 4.697 3.235 -4.929 1.00 0.00 C ATOM 1771 C ARG A 115 3.950 2.033 -4.357 1.00 0.00 C ATOM 1772 O ARG A 115 2.950 1.585 -4.919 1.00 0.00 O ATOM 1773 CB ARG A 115 5.885 2.759 -5.767 1.00 0.00 C ATOM 1774 CG ARG A 115 6.711 3.893 -6.351 1.00 0.00 C ATOM 1775 CD ARG A 115 6.229 4.274 -7.742 1.00 0.00 C ATOM 1776 NE ARG A 115 6.439 5.692 -8.024 1.00 0.00 N ATOM 1777 CZ ARG A 115 7.624 6.215 -8.317 1.00 0.00 C ATOM 1778 NH1 ARG A 115 8.700 5.442 -8.365 1.00 0.00 N ATOM 1779 NH2 ARG A 115 7.735 7.514 -8.562 1.00 0.00 N ATOM 0 H ARG A 115 6.117 4.433 -3.958 1.00 0.00 H new ATOM 0 HA ARG A 115 4.014 3.796 -5.566 1.00 0.00 H new ATOM 0 HB2 ARG A 115 6.528 2.134 -5.148 1.00 0.00 H new ATOM 0 HB3 ARG A 115 5.518 2.132 -6.580 1.00 0.00 H new ATOM 0 HG2 ARG A 115 6.654 4.761 -5.695 1.00 0.00 H new ATOM 0 HG3 ARG A 115 7.759 3.596 -6.397 1.00 0.00 H new ATOM 0 HD2 ARG A 115 6.755 3.675 -8.485 1.00 0.00 H new ATOM 0 HD3 ARG A 115 5.169 4.039 -7.836 1.00 0.00 H new ATOM 0 HE ARG A 115 5.631 6.314 -7.994 1.00 0.00 H new ATOM 0 HH11 ARG A 115 8.619 4.443 -8.177 1.00 0.00 H new ATOM 0 HH12 ARG A 115 9.609 5.846 -8.590 1.00 0.00 H new ATOM 0 HH21 ARG A 115 6.910 8.112 -8.525 1.00 0.00 H new ATOM 0 HH22 ARG A 115 8.646 7.915 -8.787 1.00 0.00 H new ATOM 1793 N LEU A 116 4.442 1.515 -3.237 1.00 0.00 N ATOM 1794 CA LEU A 116 3.822 0.365 -2.589 1.00 0.00 C ATOM 1795 C LEU A 116 2.442 0.723 -2.047 1.00 0.00 C ATOM 1796 O LEU A 116 1.429 0.182 -2.493 1.00 0.00 O ATOM 1797 CB LEU A 116 4.711 -0.145 -1.453 1.00 0.00 C ATOM 1798 CG LEU A 116 4.421 -1.563 -0.959 1.00 0.00 C ATOM 1799 CD1 LEU A 116 2.979 -1.681 -0.491 1.00 0.00 C ATOM 1800 CD2 LEU A 116 4.712 -2.579 -2.054 1.00 0.00 C ATOM 0 H LEU A 116 5.269 1.873 -2.759 1.00 0.00 H new ATOM 0 HA LEU A 116 3.706 -0.422 -3.334 1.00 0.00 H new ATOM 0 HB2 LEU A 116 5.749 -0.102 -1.783 1.00 0.00 H new ATOM 0 HB3 LEU A 116 4.616 0.539 -0.609 1.00 0.00 H new ATOM 0 HG LEU A 116 5.075 -1.773 -0.112 1.00 0.00 H new ATOM 0 HD11 LEU A 116 2.791 -2.697 -0.143 1.00 0.00 H new ATOM 0 HD12 LEU A 116 2.803 -0.980 0.325 1.00 0.00 H new ATOM 0 HD13 LEU A 116 2.308 -1.451 -1.319 1.00 0.00 H new ATOM 0 HD21 LEU A 116 4.500 -3.582 -1.685 1.00 0.00 H new ATOM 0 HD22 LEU A 116 4.084 -2.371 -2.920 1.00 0.00 H new ATOM 0 HD23 LEU A 116 5.761 -2.513 -2.343 1.00 0.00 H new ATOM 1812 N LEU A 117 2.408 1.640 -1.086 1.00 0.00 N ATOM 1813 CA LEU A 117 1.152 2.073 -0.485 1.00 0.00 C ATOM 1814 C LEU A 117 0.104 2.355 -1.558 1.00 0.00 C ATOM 1815 O LEU A 117 -1.060 1.983 -1.413 1.00 0.00 O ATOM 1816 CB LEU A 117 1.375 3.324 0.366 1.00 0.00 C ATOM 1817 CG LEU A 117 2.322 3.165 1.557 1.00 0.00 C ATOM 1818 CD1 LEU A 117 2.599 4.514 2.202 1.00 0.00 C ATOM 1819 CD2 LEU A 117 1.740 2.194 2.574 1.00 0.00 C ATOM 0 H LEU A 117 3.237 2.098 -0.706 1.00 0.00 H new ATOM 0 HA LEU A 117 0.786 1.268 0.152 1.00 0.00 H new ATOM 0 HB2 LEU A 117 1.763 4.113 -0.278 1.00 0.00 H new ATOM 0 HB3 LEU A 117 0.408 3.663 0.739 1.00 0.00 H new ATOM 0 HG LEU A 117 3.266 2.758 1.195 1.00 0.00 H new ATOM 0 HD11 LEU A 117 3.274 4.381 3.047 1.00 0.00 H new ATOM 0 HD12 LEU A 117 3.059 5.179 1.471 1.00 0.00 H new ATOM 0 HD13 LEU A 117 1.663 4.950 2.551 1.00 0.00 H new ATOM 0 HD21 LEU A 117 2.427 2.093 3.415 1.00 0.00 H new ATOM 0 HD22 LEU A 117 0.782 2.572 2.931 1.00 0.00 H new ATOM 0 HD23 LEU A 117 1.594 1.221 2.106 1.00 0.00 H new ATOM 1831 N GLN A 118 0.527 3.012 -2.633 1.00 0.00 N ATOM 1832 CA GLN A 118 -0.375 3.341 -3.730 1.00 0.00 C ATOM 1833 C GLN A 118 -1.152 2.110 -4.185 1.00 0.00 C ATOM 1834 O GLN A 118 -2.383 2.095 -4.160 1.00 0.00 O ATOM 1835 CB GLN A 118 0.409 3.927 -4.905 1.00 0.00 C ATOM 1836 CG GLN A 118 -0.474 4.490 -6.006 1.00 0.00 C ATOM 1837 CD GLN A 118 0.324 5.138 -7.121 1.00 0.00 C ATOM 1838 OE1 GLN A 118 1.551 5.044 -7.156 1.00 0.00 O ATOM 1839 NE2 GLN A 118 -0.371 5.800 -8.039 1.00 0.00 N ATOM 0 H GLN A 118 1.488 3.327 -2.768 1.00 0.00 H new ATOM 0 HA GLN A 118 -1.087 4.084 -3.371 1.00 0.00 H new ATOM 0 HB2 GLN A 118 1.063 4.717 -4.536 1.00 0.00 H new ATOM 0 HB3 GLN A 118 1.050 3.152 -5.326 1.00 0.00 H new ATOM 0 HG2 GLN A 118 -1.086 3.689 -6.421 1.00 0.00 H new ATOM 0 HG3 GLN A 118 -1.157 5.225 -5.579 1.00 0.00 H new ATOM 0 HE21 GLN A 118 -1.387 5.852 -7.970 1.00 0.00 H new ATOM 0 HE22 GLN A 118 0.112 6.256 -8.813 1.00 0.00 H new ATOM 1848 N LEU A 119 -0.425 1.078 -4.600 1.00 0.00 N ATOM 1849 CA LEU A 119 -1.045 -0.159 -5.061 1.00 0.00 C ATOM 1850 C LEU A 119 -2.207 -0.555 -4.156 1.00 0.00 C ATOM 1851 O LEU A 119 -3.320 -0.792 -4.627 1.00 0.00 O ATOM 1852 CB LEU A 119 -0.011 -1.285 -5.106 1.00 0.00 C ATOM 1853 CG LEU A 119 0.787 -1.412 -6.404 1.00 0.00 C ATOM 1854 CD1 LEU A 119 1.831 -2.512 -6.283 1.00 0.00 C ATOM 1855 CD2 LEU A 119 -0.143 -1.684 -7.577 1.00 0.00 C ATOM 0 H LEU A 119 0.595 1.074 -4.627 1.00 0.00 H new ATOM 0 HA LEU A 119 -1.432 0.010 -6.066 1.00 0.00 H new ATOM 0 HB2 LEU A 119 0.691 -1.140 -4.284 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -0.524 -2.230 -4.924 1.00 0.00 H new ATOM 0 HG LEU A 119 1.302 -0.469 -6.585 1.00 0.00 H new ATOM 0 HD11 LEU A 119 2.389 -2.588 -7.216 1.00 0.00 H new ATOM 0 HD12 LEU A 119 2.516 -2.276 -5.469 1.00 0.00 H new ATOM 0 HD13 LEU A 119 1.337 -3.462 -6.077 1.00 0.00 H new ATOM 0 HD21 LEU A 119 0.442 -1.771 -8.493 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -0.686 -2.613 -7.403 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -0.852 -0.863 -7.677 1.00 0.00 H new ATOM 1867 N ILE A 120 -1.941 -0.624 -2.856 1.00 0.00 N ATOM 1868 CA ILE A 120 -2.966 -0.988 -1.886 1.00 0.00 C ATOM 1869 C ILE A 120 -4.234 -0.167 -2.090 1.00 0.00 C ATOM 1870 O ILE A 120 -5.321 -0.717 -2.272 1.00 0.00 O ATOM 1871 CB ILE A 120 -2.468 -0.793 -0.441 1.00 0.00 C ATOM 1872 CG1 ILE A 120 -1.260 -1.691 -0.169 1.00 0.00 C ATOM 1873 CG2 ILE A 120 -3.586 -1.086 0.548 1.00 0.00 C ATOM 1874 CD1 ILE A 120 -0.417 -1.233 1.000 1.00 0.00 C ATOM 0 H ILE A 120 -1.025 -0.433 -2.450 1.00 0.00 H new ATOM 0 HA ILE A 120 -3.190 -2.043 -2.046 1.00 0.00 H new ATOM 0 HB ILE A 120 -2.161 0.245 -0.315 1.00 0.00 H new ATOM 0 HG12 ILE A 120 -1.608 -2.707 0.020 1.00 0.00 H new ATOM 0 HG13 ILE A 120 -0.637 -1.729 -1.063 1.00 0.00 H new ATOM 0 HG21 ILE A 120 -3.219 -0.944 1.565 1.00 0.00 H new ATOM 0 HG22 ILE A 120 -4.420 -0.409 0.365 1.00 0.00 H new ATOM 0 HG23 ILE A 120 -3.921 -2.116 0.424 1.00 0.00 H new ATOM 0 HD11 ILE A 120 0.421 -1.917 1.134 1.00 0.00 H new ATOM 0 HD12 ILE A 120 -0.039 -0.229 0.805 1.00 0.00 H new ATOM 0 HD13 ILE A 120 -1.025 -1.222 1.905 1.00 0.00 H new ATOM 1886 N LEU A 121 -4.088 1.153 -2.059 1.00 0.00 N ATOM 1887 CA LEU A 121 -5.221 2.053 -2.243 1.00 0.00 C ATOM 1888 C LEU A 121 -6.000 1.697 -3.506 1.00 0.00 C ATOM 1889 O LEU A 121 -7.223 1.817 -3.548 1.00 0.00 O ATOM 1890 CB LEU A 121 -4.740 3.503 -2.319 1.00 0.00 C ATOM 1891 CG LEU A 121 -5.640 4.470 -3.089 1.00 0.00 C ATOM 1892 CD1 LEU A 121 -6.923 4.734 -2.317 1.00 0.00 C ATOM 1893 CD2 LEU A 121 -4.906 5.773 -3.370 1.00 0.00 C ATOM 0 H LEU A 121 -3.196 1.624 -1.908 1.00 0.00 H new ATOM 0 HA LEU A 121 -5.884 1.941 -1.385 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -4.622 3.879 -1.303 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -3.752 3.513 -2.779 1.00 0.00 H new ATOM 0 HG LEU A 121 -5.902 4.011 -4.043 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -7.551 5.424 -2.880 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -7.458 3.796 -2.168 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -6.681 5.171 -1.348 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -5.562 6.449 -3.919 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -4.614 6.236 -2.428 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -4.016 5.568 -3.965 1.00 0.00 H new ATOM 1905 N GLY A 122 -5.281 1.257 -4.534 1.00 0.00 N ATOM 1906 CA GLY A 122 -5.921 0.888 -5.783 1.00 0.00 C ATOM 1907 C GLY A 122 -7.030 -0.126 -5.589 1.00 0.00 C ATOM 1908 O GLY A 122 -8.174 0.112 -5.980 1.00 0.00 O ATOM 0 H GLY A 122 -4.267 1.150 -4.524 1.00 0.00 H new ATOM 0 HA2 GLY A 122 -6.328 1.781 -6.257 1.00 0.00 H new ATOM 0 HA3 GLY A 122 -5.174 0.479 -6.463 1.00 0.00 H new ATOM 1912 N CYS A 123 -6.694 -1.260 -4.985 1.00 0.00 N ATOM 1913 CA CYS A 123 -7.670 -2.316 -4.742 1.00 0.00 C ATOM 1914 C CYS A 123 -8.740 -1.851 -3.759 1.00 0.00 C ATOM 1915 O CYS A 123 -9.828 -2.424 -3.694 1.00 0.00 O ATOM 1916 CB CYS A 123 -6.976 -3.568 -4.204 1.00 0.00 C ATOM 1917 SG CYS A 123 -5.557 -4.105 -5.187 1.00 0.00 S ATOM 0 H CYS A 123 -5.753 -1.472 -4.654 1.00 0.00 H new ATOM 0 HA CYS A 123 -8.152 -2.556 -5.690 1.00 0.00 H new ATOM 0 HB2 CYS A 123 -6.646 -3.377 -3.183 1.00 0.00 H new ATOM 0 HB3 CYS A 123 -7.701 -4.381 -4.158 1.00 0.00 H new ATOM 0 HG CYS A 123 -5.491 -3.398 -6.276 1.00 0.00 H new ATOM 1923 N ALA A 124 -8.423 -0.811 -2.996 1.00 0.00 N ATOM 1924 CA ALA A 124 -9.357 -0.269 -2.017 1.00 0.00 C ATOM 1925 C ALA A 124 -10.350 0.684 -2.674 1.00 0.00 C ATOM 1926 O ALA A 124 -11.372 1.035 -2.084 1.00 0.00 O ATOM 1927 CB ALA A 124 -8.601 0.439 -0.902 1.00 0.00 C ATOM 0 H ALA A 124 -7.526 -0.327 -3.037 1.00 0.00 H new ATOM 0 HA ALA A 124 -9.919 -1.099 -1.590 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -9.311 0.839 -0.178 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -7.937 -0.269 -0.406 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -8.013 1.255 -1.322 1.00 0.00 H new ATOM 1933 N VAL A 125 -10.042 1.100 -3.898 1.00 0.00 N ATOM 1934 CA VAL A 125 -10.908 2.012 -4.636 1.00 0.00 C ATOM 1935 C VAL A 125 -11.516 1.328 -5.855 1.00 0.00 C ATOM 1936 O VAL A 125 -12.173 1.968 -6.675 1.00 0.00 O ATOM 1937 CB VAL A 125 -10.140 3.266 -5.095 1.00 0.00 C ATOM 1938 CG1 VAL A 125 -9.429 3.005 -6.414 1.00 0.00 C ATOM 1939 CG2 VAL A 125 -11.084 4.454 -5.214 1.00 0.00 C ATOM 0 H VAL A 125 -9.199 0.820 -4.400 1.00 0.00 H new ATOM 0 HA VAL A 125 -11.705 2.311 -3.956 1.00 0.00 H new ATOM 0 HB VAL A 125 -9.386 3.504 -4.345 1.00 0.00 H new ATOM 0 HG11 VAL A 125 -8.892 3.902 -6.722 1.00 0.00 H new ATOM 0 HG12 VAL A 125 -8.723 2.184 -6.290 1.00 0.00 H new ATOM 0 HG13 VAL A 125 -10.162 2.741 -7.176 1.00 0.00 H new ATOM 0 HG21 VAL A 125 -10.525 5.332 -5.539 1.00 0.00 H new ATOM 0 HG22 VAL A 125 -11.862 4.229 -5.943 1.00 0.00 H new ATOM 0 HG23 VAL A 125 -11.541 4.654 -4.245 1.00 0.00 H new ATOM 1949 N ASN A 126 -11.293 0.022 -5.966 1.00 0.00 N ATOM 1950 CA ASN A 126 -11.820 -0.750 -7.085 1.00 0.00 C ATOM 1951 C ASN A 126 -12.503 -2.023 -6.594 1.00 0.00 C ATOM 1952 O ASN A 126 -12.434 -3.067 -7.244 1.00 0.00 O ATOM 1953 CB ASN A 126 -10.696 -1.105 -8.061 1.00 0.00 C ATOM 1954 CG ASN A 126 -10.250 0.086 -8.887 1.00 0.00 C ATOM 1955 OD1 ASN A 126 -10.908 0.465 -9.856 1.00 0.00 O ATOM 1956 ND2 ASN A 126 -9.126 0.682 -8.506 1.00 0.00 N ATOM 0 H ASN A 126 -10.751 -0.523 -5.295 1.00 0.00 H new ATOM 0 HA ASN A 126 -12.560 -0.137 -7.600 1.00 0.00 H new ATOM 0 HB2 ASN A 126 -9.845 -1.496 -7.504 1.00 0.00 H new ATOM 0 HB3 ASN A 126 -11.034 -1.899 -8.727 1.00 0.00 H new ATOM 0 HD21 ASN A 126 -8.776 1.488 -9.023 1.00 0.00 H new ATOM 0 HD22 ASN A 126 -8.613 0.333 -7.696 1.00 0.00 H new ATOM 1963 N CYS A 127 -13.162 -1.928 -5.445 1.00 0.00 N ATOM 1964 CA CYS A 127 -13.858 -3.072 -4.866 1.00 0.00 C ATOM 1965 C CYS A 127 -15.293 -2.707 -4.499 1.00 0.00 C ATOM 1966 O CYS A 127 -15.758 -1.606 -4.794 1.00 0.00 O ATOM 1967 CB CYS A 127 -13.114 -3.576 -3.629 1.00 0.00 C ATOM 1968 SG CYS A 127 -12.573 -2.264 -2.508 1.00 0.00 S ATOM 0 H CYS A 127 -13.229 -1.071 -4.896 1.00 0.00 H new ATOM 0 HA CYS A 127 -13.884 -3.866 -5.613 1.00 0.00 H new ATOM 0 HB2 CYS A 127 -13.762 -4.262 -3.083 1.00 0.00 H new ATOM 0 HB3 CYS A 127 -12.243 -4.147 -3.950 1.00 0.00 H new ATOM 0 HG CYS A 127 -11.347 -1.933 -2.787 1.00 0.00 H new ATOM 1974 N GLU A 128 -15.989 -3.638 -3.854 1.00 0.00 N ATOM 1975 CA GLU A 128 -17.371 -3.414 -3.448 1.00 0.00 C ATOM 1976 C GLU A 128 -17.442 -2.454 -2.264 1.00 0.00 C ATOM 1977 O GLU A 128 -18.209 -1.491 -2.275 1.00 0.00 O ATOM 1978 CB GLU A 128 -18.041 -4.740 -3.085 1.00 0.00 C ATOM 1979 CG GLU A 128 -17.356 -5.476 -1.945 1.00 0.00 C ATOM 1980 CD GLU A 128 -18.013 -6.806 -1.630 1.00 0.00 C ATOM 1981 OE1 GLU A 128 -19.249 -6.831 -1.454 1.00 0.00 O ATOM 1982 OE2 GLU A 128 -17.290 -7.822 -1.561 1.00 0.00 O ATOM 0 H GLU A 128 -15.618 -4.554 -3.602 1.00 0.00 H new ATOM 0 HA GLU A 128 -17.901 -2.966 -4.288 1.00 0.00 H new ATOM 0 HB2 GLU A 128 -19.079 -4.550 -2.812 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -18.055 -5.383 -3.965 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -16.310 -5.644 -2.202 1.00 0.00 H new ATOM 0 HG3 GLU A 128 -17.368 -4.849 -1.054 1.00 0.00 H new ATOM 1989 N LYS A 129 -16.637 -2.725 -1.242 1.00 0.00 N ATOM 1990 CA LYS A 129 -16.606 -1.887 -0.049 1.00 0.00 C ATOM 1991 C LYS A 129 -15.794 -0.619 -0.296 1.00 0.00 C ATOM 1992 O LYS A 129 -15.729 0.265 0.559 1.00 0.00 O ATOM 1993 CB LYS A 129 -16.014 -2.663 1.129 1.00 0.00 C ATOM 1994 CG LYS A 129 -16.820 -3.891 1.516 1.00 0.00 C ATOM 1995 CD LYS A 129 -16.695 -4.197 2.999 1.00 0.00 C ATOM 1996 CE LYS A 129 -15.268 -4.571 3.371 1.00 0.00 C ATOM 1997 NZ LYS A 129 -15.211 -5.331 4.650 1.00 0.00 N ATOM 0 H LYS A 129 -15.997 -3.519 -1.216 1.00 0.00 H new ATOM 0 HA LYS A 129 -17.630 -1.601 0.190 1.00 0.00 H new ATOM 0 HB2 LYS A 129 -14.999 -2.970 0.878 1.00 0.00 H new ATOM 0 HB3 LYS A 129 -15.942 -2.000 1.991 1.00 0.00 H new ATOM 0 HG2 LYS A 129 -17.869 -3.733 1.264 1.00 0.00 H new ATOM 0 HG3 LYS A 129 -16.478 -4.749 0.937 1.00 0.00 H new ATOM 0 HD2 LYS A 129 -17.008 -3.329 3.579 1.00 0.00 H new ATOM 0 HD3 LYS A 129 -17.367 -5.014 3.261 1.00 0.00 H new ATOM 0 HE2 LYS A 129 -14.829 -5.170 2.573 1.00 0.00 H new ATOM 0 HE3 LYS A 129 -14.666 -3.666 3.459 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 -14.222 -5.568 4.869 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 -15.606 -4.750 5.417 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 -15.764 -6.207 4.558 1.00 0.00 H new ATOM 2011 N LYS A 130 -15.178 -0.535 -1.470 1.00 0.00 N ATOM 2012 CA LYS A 130 -14.373 0.625 -1.831 1.00 0.00 C ATOM 2013 C LYS A 130 -14.948 1.898 -1.220 1.00 0.00 C ATOM 2014 O LYS A 130 -14.230 2.675 -0.591 1.00 0.00 O ATOM 2015 CB LYS A 130 -14.298 0.766 -3.353 1.00 0.00 C ATOM 2016 CG LYS A 130 -15.383 1.655 -3.935 1.00 0.00 C ATOM 2017 CD LYS A 130 -15.161 1.908 -5.417 1.00 0.00 C ATOM 2018 CE LYS A 130 -15.849 0.855 -6.272 1.00 0.00 C ATOM 2019 NZ LYS A 130 -16.003 1.301 -7.684 1.00 0.00 N ATOM 0 H LYS A 130 -15.221 -1.258 -2.188 1.00 0.00 H new ATOM 0 HA LYS A 130 -13.368 0.475 -1.436 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -13.323 1.171 -3.624 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -14.369 -0.223 -3.805 1.00 0.00 H new ATOM 0 HG2 LYS A 130 -16.356 1.187 -3.787 1.00 0.00 H new ATOM 0 HG3 LYS A 130 -15.401 2.605 -3.401 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -15.540 2.896 -5.679 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -14.092 1.910 -5.631 1.00 0.00 H new ATOM 0 HE2 LYS A 130 -15.272 -0.069 -6.244 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -16.830 0.631 -5.853 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -16.476 0.556 -8.234 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -16.575 2.169 -7.713 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -15.065 1.490 -8.092 1.00 0.00 H new ATOM 2033 N GLN A 131 -16.248 2.105 -1.408 1.00 0.00 N ATOM 2034 CA GLN A 131 -16.919 3.284 -0.873 1.00 0.00 C ATOM 2035 C GLN A 131 -16.544 3.508 0.588 1.00 0.00 C ATOM 2036 O GLN A 131 -16.215 4.623 0.990 1.00 0.00 O ATOM 2037 CB GLN A 131 -18.435 3.138 -1.007 1.00 0.00 C ATOM 2038 CG GLN A 131 -18.909 2.991 -2.444 1.00 0.00 C ATOM 2039 CD GLN A 131 -20.235 3.679 -2.695 1.00 0.00 C ATOM 2040 OE1 GLN A 131 -21.297 3.142 -2.377 1.00 0.00 O ATOM 2041 NE2 GLN A 131 -20.183 4.876 -3.268 1.00 0.00 N ATOM 0 H GLN A 131 -16.857 1.472 -1.926 1.00 0.00 H new ATOM 0 HA GLN A 131 -16.592 4.150 -1.449 1.00 0.00 H new ATOM 0 HB2 GLN A 131 -18.759 2.268 -0.436 1.00 0.00 H new ATOM 0 HB3 GLN A 131 -18.916 4.009 -0.562 1.00 0.00 H new ATOM 0 HG2 GLN A 131 -18.156 3.406 -3.115 1.00 0.00 H new ATOM 0 HG3 GLN A 131 -19.002 1.932 -2.685 1.00 0.00 H new ATOM 0 HE21 GLN A 131 -19.282 5.284 -3.515 1.00 0.00 H new ATOM 0 HE22 GLN A 131 -21.044 5.387 -3.461 1.00 0.00 H new ATOM 2050 N GLU A 132 -16.597 2.440 1.378 1.00 0.00 N ATOM 2051 CA GLU A 132 -16.264 2.521 2.795 1.00 0.00 C ATOM 2052 C GLU A 132 -14.901 3.176 2.997 1.00 0.00 C ATOM 2053 O GLU A 132 -14.640 3.787 4.034 1.00 0.00 O ATOM 2054 CB GLU A 132 -16.270 1.127 3.425 1.00 0.00 C ATOM 2055 CG GLU A 132 -16.657 1.124 4.894 1.00 0.00 C ATOM 2056 CD GLU A 132 -15.549 1.642 5.790 1.00 0.00 C ATOM 2057 OE1 GLU A 132 -14.381 1.645 5.347 1.00 0.00 O ATOM 2058 OE2 GLU A 132 -15.849 2.044 6.934 1.00 0.00 O ATOM 0 H GLU A 132 -16.867 1.509 1.061 1.00 0.00 H new ATOM 0 HA GLU A 132 -17.020 3.136 3.284 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -16.964 0.492 2.874 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -15.279 0.685 3.318 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -17.548 1.737 5.033 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -16.918 0.109 5.195 1.00 0.00 H new ATOM 2065 N HIS A 133 -14.034 3.044 1.998 1.00 0.00 N ATOM 2066 CA HIS A 133 -12.696 3.623 2.065 1.00 0.00 C ATOM 2067 C HIS A 133 -12.689 5.041 1.503 1.00 0.00 C ATOM 2068 O HIS A 133 -12.073 5.942 2.073 1.00 0.00 O ATOM 2069 CB HIS A 133 -11.702 2.752 1.297 1.00 0.00 C ATOM 2070 CG HIS A 133 -11.660 1.331 1.770 1.00 0.00 C ATOM 2071 ND1 HIS A 133 -10.620 0.817 2.516 1.00 0.00 N ATOM 2072 CD2 HIS A 133 -12.538 0.315 1.600 1.00 0.00 C ATOM 2073 CE1 HIS A 133 -10.860 -0.454 2.783 1.00 0.00 C ATOM 2074 NE2 HIS A 133 -12.018 -0.783 2.239 1.00 0.00 N ATOM 0 H HIS A 133 -14.233 2.542 1.133 1.00 0.00 H new ATOM 0 HA HIS A 133 -12.397 3.665 3.112 1.00 0.00 H new ATOM 0 HB2 HIS A 133 -11.961 2.766 0.238 1.00 0.00 H new ATOM 0 HB3 HIS A 133 -10.706 3.186 1.387 1.00 0.00 H new ATOM 0 HD2 HIS A 133 -13.473 0.360 1.062 1.00 0.00 H new ATOM 0 HE1 HIS A 133 -10.219 -1.113 3.350 1.00 0.00 H new ATOM 0 HE2 HIS A 133 -12.455 -1.704 2.286 1.00 0.00 H new ATOM 2083 N ILE A 134 -13.377 5.231 0.382 1.00 0.00 N ATOM 2084 CA ILE A 134 -13.449 6.539 -0.257 1.00 0.00 C ATOM 2085 C ILE A 134 -13.782 7.628 0.757 1.00 0.00 C ATOM 2086 O ILE A 134 -13.138 8.677 0.793 1.00 0.00 O ATOM 2087 CB ILE A 134 -14.503 6.560 -1.380 1.00 0.00 C ATOM 2088 CG1 ILE A 134 -13.905 6.021 -2.681 1.00 0.00 C ATOM 2089 CG2 ILE A 134 -15.036 7.971 -1.580 1.00 0.00 C ATOM 2090 CD1 ILE A 134 -13.530 4.557 -2.612 1.00 0.00 C ATOM 0 H ILE A 134 -13.892 4.496 -0.102 1.00 0.00 H new ATOM 0 HA ILE A 134 -12.467 6.734 -0.688 1.00 0.00 H new ATOM 0 HB ILE A 134 -15.334 5.917 -1.090 1.00 0.00 H new ATOM 0 HG12 ILE A 134 -14.622 6.166 -3.489 1.00 0.00 H new ATOM 0 HG13 ILE A 134 -13.019 6.603 -2.933 1.00 0.00 H new ATOM 0 HG21 ILE A 134 -15.780 7.969 -2.377 1.00 0.00 H new ATOM 0 HG22 ILE A 134 -15.495 8.321 -0.656 1.00 0.00 H new ATOM 0 HG23 ILE A 134 -14.215 8.635 -1.851 1.00 0.00 H new ATOM 0 HD11 ILE A 134 -13.113 4.243 -3.569 1.00 0.00 H new ATOM 0 HD12 ILE A 134 -12.789 4.408 -1.826 1.00 0.00 H new ATOM 0 HD13 ILE A 134 -14.418 3.964 -2.391 1.00 0.00 H new ATOM 2102 N LYS A 135 -14.792 7.372 1.582 1.00 0.00 N ATOM 2103 CA LYS A 135 -15.209 8.328 2.601 1.00 0.00 C ATOM 2104 C LYS A 135 -14.076 8.608 3.583 1.00 0.00 C ATOM 2105 O LYS A 135 -14.009 9.682 4.178 1.00 0.00 O ATOM 2106 CB LYS A 135 -16.433 7.801 3.354 1.00 0.00 C ATOM 2107 CG LYS A 135 -16.163 6.526 4.135 1.00 0.00 C ATOM 2108 CD LYS A 135 -17.246 6.266 5.168 1.00 0.00 C ATOM 2109 CE LYS A 135 -17.138 4.863 5.747 1.00 0.00 C ATOM 2110 NZ LYS A 135 -16.262 4.826 6.950 1.00 0.00 N ATOM 0 H LYS A 135 -15.337 6.510 1.565 1.00 0.00 H new ATOM 0 HA LYS A 135 -15.471 9.261 2.102 1.00 0.00 H new ATOM 0 HB2 LYS A 135 -16.786 8.570 4.041 1.00 0.00 H new ATOM 0 HB3 LYS A 135 -17.237 7.617 2.641 1.00 0.00 H new ATOM 0 HG2 LYS A 135 -16.105 5.682 3.447 1.00 0.00 H new ATOM 0 HG3 LYS A 135 -15.195 6.600 4.631 1.00 0.00 H new ATOM 0 HD2 LYS A 135 -17.168 6.999 5.971 1.00 0.00 H new ATOM 0 HD3 LYS A 135 -18.226 6.397 4.710 1.00 0.00 H new ATOM 0 HE2 LYS A 135 -18.132 4.501 6.010 1.00 0.00 H new ATOM 0 HE3 LYS A 135 -16.743 4.187 4.989 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 -15.980 3.844 7.144 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 -15.413 5.403 6.779 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 -16.780 5.206 7.768 1.00 0.00 H new ATOM 2124 N ASN A 136 -13.186 7.634 3.745 1.00 0.00 N ATOM 2125 CA ASN A 136 -12.055 7.776 4.654 1.00 0.00 C ATOM 2126 C ASN A 136 -11.098 8.859 4.167 1.00 0.00 C ATOM 2127 O ASN A 136 -10.484 9.564 4.967 1.00 0.00 O ATOM 2128 CB ASN A 136 -11.312 6.445 4.788 1.00 0.00 C ATOM 2129 CG ASN A 136 -10.683 6.269 6.157 1.00 0.00 C ATOM 2130 OD1 ASN A 136 -10.360 7.246 6.834 1.00 0.00 O ATOM 2131 ND2 ASN A 136 -10.506 5.020 6.571 1.00 0.00 N ATOM 0 H ASN A 136 -13.226 6.738 3.259 1.00 0.00 H new ATOM 0 HA ASN A 136 -12.440 8.070 5.631 1.00 0.00 H new ATOM 0 HB2 ASN A 136 -12.005 5.625 4.602 1.00 0.00 H new ATOM 0 HB3 ASN A 136 -10.536 6.387 4.025 1.00 0.00 H new ATOM 0 HD21 ASN A 136 -10.087 4.840 7.483 1.00 0.00 H new ATOM 0 HD22 ASN A 136 -10.789 4.241 5.977 1.00 0.00 H new ATOM 2138 N ILE A 137 -10.977 8.985 2.850 1.00 0.00 N ATOM 2139 CA ILE A 137 -10.097 9.983 2.255 1.00 0.00 C ATOM 2140 C ILE A 137 -10.582 11.396 2.562 1.00 0.00 C ATOM 2141 O ILE A 137 -9.787 12.280 2.881 1.00 0.00 O ATOM 2142 CB ILE A 137 -9.995 9.807 0.729 1.00 0.00 C ATOM 2143 CG1 ILE A 137 -9.278 8.498 0.391 1.00 0.00 C ATOM 2144 CG2 ILE A 137 -9.270 10.991 0.106 1.00 0.00 C ATOM 2145 CD1 ILE A 137 -10.214 7.322 0.223 1.00 0.00 C ATOM 0 H ILE A 137 -11.478 8.408 2.174 1.00 0.00 H new ATOM 0 HA ILE A 137 -9.111 9.836 2.695 1.00 0.00 H new ATOM 0 HB ILE A 137 -11.002 9.765 0.315 1.00 0.00 H new ATOM 0 HG12 ILE A 137 -8.708 8.632 -0.528 1.00 0.00 H new ATOM 0 HG13 ILE A 137 -8.561 8.272 1.180 1.00 0.00 H new ATOM 0 HG21 ILE A 137 -9.206 10.852 -0.973 1.00 0.00 H new ATOM 0 HG22 ILE A 137 -9.819 11.908 0.322 1.00 0.00 H new ATOM 0 HG23 ILE A 137 -8.265 11.063 0.523 1.00 0.00 H new ATOM 0 HD11 ILE A 137 -9.637 6.429 -0.015 1.00 0.00 H new ATOM 0 HD12 ILE A 137 -10.766 7.161 1.149 1.00 0.00 H new ATOM 0 HD13 ILE A 137 -10.915 7.528 -0.586 1.00 0.00 H new ATOM 2157 N MET A 138 -11.891 11.600 2.464 1.00 0.00 N ATOM 2158 CA MET A 138 -12.483 12.906 2.734 1.00 0.00 C ATOM 2159 C MET A 138 -12.213 13.338 4.171 1.00 0.00 C ATOM 2160 O MET A 138 -11.980 14.516 4.443 1.00 0.00 O ATOM 2161 CB MET A 138 -13.990 12.870 2.474 1.00 0.00 C ATOM 2162 CG MET A 138 -14.359 12.300 1.114 1.00 0.00 C ATOM 2163 SD MET A 138 -13.982 13.431 -0.239 1.00 0.00 S ATOM 2164 CE MET A 138 -12.469 12.711 -0.871 1.00 0.00 C ATOM 0 H MET A 138 -12.562 10.879 2.200 1.00 0.00 H new ATOM 0 HA MET A 138 -12.023 13.632 2.063 1.00 0.00 H new ATOM 0 HB2 MET A 138 -14.470 12.275 3.251 1.00 0.00 H new ATOM 0 HB3 MET A 138 -14.389 13.881 2.555 1.00 0.00 H new ATOM 0 HG2 MET A 138 -13.823 11.363 0.959 1.00 0.00 H new ATOM 0 HG3 MET A 138 -15.423 12.065 1.100 1.00 0.00 H new ATOM 0 HE1 MET A 138 -11.699 13.480 -0.933 1.00 0.00 H new ATOM 0 HE2 MET A 138 -12.136 11.917 -0.202 1.00 0.00 H new ATOM 0 HE3 MET A 138 -12.650 12.297 -1.863 1.00 0.00 H new ATOM 2174 N THR A 139 -12.246 12.378 5.090 1.00 0.00 N ATOM 2175 CA THR A 139 -12.007 12.660 6.500 1.00 0.00 C ATOM 2176 C THR A 139 -10.575 13.127 6.731 1.00 0.00 C ATOM 2177 O THR A 139 -10.233 13.602 7.816 1.00 0.00 O ATOM 2178 CB THR A 139 -12.279 11.421 7.374 1.00 0.00 C ATOM 2179 OG1 THR A 139 -11.259 10.438 7.162 1.00 0.00 O ATOM 2180 CG2 THR A 139 -13.640 10.822 7.056 1.00 0.00 C ATOM 0 H THR A 139 -12.436 11.398 4.883 1.00 0.00 H new ATOM 0 HA THR A 139 -12.696 13.455 6.786 1.00 0.00 H new ATOM 0 HB THR A 139 -12.272 11.733 8.418 1.00 0.00 H new ATOM 0 HG1 THR A 139 -11.209 10.219 6.208 1.00 0.00 H new ATOM 0 HG21 THR A 139 -13.809 9.949 7.686 1.00 0.00 H new ATOM 0 HG22 THR A 139 -14.417 11.563 7.246 1.00 0.00 H new ATOM 0 HG23 THR A 139 -13.671 10.525 6.008 1.00 0.00 H new ATOM 2188 N LEU A 140 -9.740 12.991 5.707 1.00 0.00 N ATOM 2189 CA LEU A 140 -8.343 13.401 5.799 1.00 0.00 C ATOM 2190 C LEU A 140 -8.197 14.898 5.547 1.00 0.00 C ATOM 2191 O LEU A 140 -9.188 15.612 5.402 1.00 0.00 O ATOM 2192 CB LEU A 140 -7.494 12.618 4.795 1.00 0.00 C ATOM 2193 CG LEU A 140 -7.653 11.098 4.823 1.00 0.00 C ATOM 2194 CD1 LEU A 140 -6.892 10.460 3.672 1.00 0.00 C ATOM 2195 CD2 LEU A 140 -7.177 10.537 6.155 1.00 0.00 C ATOM 0 H LEU A 140 -10.006 12.600 4.803 1.00 0.00 H new ATOM 0 HA LEU A 140 -7.992 13.185 6.808 1.00 0.00 H new ATOM 0 HB2 LEU A 140 -7.736 12.970 3.792 1.00 0.00 H new ATOM 0 HB3 LEU A 140 -6.445 12.857 4.972 1.00 0.00 H new ATOM 0 HG LEU A 140 -8.711 10.860 4.708 1.00 0.00 H new ATOM 0 HD11 LEU A 140 -7.017 9.378 3.709 1.00 0.00 H new ATOM 0 HD12 LEU A 140 -7.279 10.838 2.726 1.00 0.00 H new ATOM 0 HD13 LEU A 140 -5.833 10.706 3.755 1.00 0.00 H new ATOM 0 HD21 LEU A 140 -7.297 9.454 6.157 1.00 0.00 H new ATOM 0 HD22 LEU A 140 -6.126 10.786 6.300 1.00 0.00 H new ATOM 0 HD23 LEU A 140 -7.767 10.969 6.963 1.00 0.00 H new ATOM 2207 N GLU A 141 -6.953 15.366 5.495 1.00 0.00 N ATOM 2208 CA GLU A 141 -6.678 16.778 5.259 1.00 0.00 C ATOM 2209 C GLU A 141 -6.917 17.142 3.797 1.00 0.00 C ATOM 2210 O GLU A 141 -7.074 16.266 2.947 1.00 0.00 O ATOM 2211 CB GLU A 141 -5.238 17.112 5.651 1.00 0.00 C ATOM 2212 CG GLU A 141 -4.991 18.598 5.853 1.00 0.00 C ATOM 2213 CD GLU A 141 -6.009 19.238 6.778 1.00 0.00 C ATOM 2214 OE1 GLU A 141 -5.878 19.072 8.009 1.00 0.00 O ATOM 2215 OE2 GLU A 141 -6.936 19.903 6.270 1.00 0.00 O ATOM 0 H GLU A 141 -6.121 14.788 5.613 1.00 0.00 H new ATOM 0 HA GLU A 141 -7.360 17.363 5.877 1.00 0.00 H new ATOM 0 HB2 GLU A 141 -4.989 16.583 6.571 1.00 0.00 H new ATOM 0 HB3 GLU A 141 -4.565 16.742 4.878 1.00 0.00 H new ATOM 0 HG2 GLU A 141 -3.991 18.744 6.262 1.00 0.00 H new ATOM 0 HG3 GLU A 141 -5.017 19.102 4.887 1.00 0.00 H new ATOM 2222 N GLU A 142 -6.944 18.441 3.513 1.00 0.00 N ATOM 2223 CA GLU A 142 -7.164 18.920 2.153 1.00 0.00 C ATOM 2224 C GLU A 142 -6.010 18.518 1.240 1.00 0.00 C ATOM 2225 O GLU A 142 -6.208 17.834 0.237 1.00 0.00 O ATOM 2226 CB GLU A 142 -7.329 20.441 2.146 1.00 0.00 C ATOM 2227 CG GLU A 142 -8.778 20.897 2.092 1.00 0.00 C ATOM 2228 CD GLU A 142 -9.380 21.090 3.470 1.00 0.00 C ATOM 2229 OE1 GLU A 142 -8.773 21.815 4.286 1.00 0.00 O ATOM 2230 OE2 GLU A 142 -10.458 20.517 3.733 1.00 0.00 O ATOM 0 H GLU A 142 -6.816 19.179 4.205 1.00 0.00 H new ATOM 0 HA GLU A 142 -8.078 18.460 1.777 1.00 0.00 H new ATOM 0 HB2 GLU A 142 -6.861 20.853 3.040 1.00 0.00 H new ATOM 0 HB3 GLU A 142 -6.796 20.852 1.289 1.00 0.00 H new ATOM 0 HG2 GLU A 142 -8.840 21.834 1.538 1.00 0.00 H new ATOM 0 HG3 GLU A 142 -9.366 20.162 1.542 1.00 0.00 H new ATOM 2237 N SER A 143 -4.804 18.949 1.596 1.00 0.00 N ATOM 2238 CA SER A 143 -3.618 18.639 0.807 1.00 0.00 C ATOM 2239 C SER A 143 -3.528 17.142 0.528 1.00 0.00 C ATOM 2240 O SER A 143 -3.521 16.713 -0.626 1.00 0.00 O ATOM 2241 CB SER A 143 -2.357 19.110 1.536 1.00 0.00 C ATOM 2242 OG SER A 143 -1.217 19.004 0.701 1.00 0.00 O ATOM 0 H SER A 143 -4.623 19.514 2.426 1.00 0.00 H new ATOM 0 HA SER A 143 -3.697 19.165 -0.145 1.00 0.00 H new ATOM 0 HB2 SER A 143 -2.483 20.144 1.856 1.00 0.00 H new ATOM 0 HB3 SER A 143 -2.209 18.514 2.436 1.00 0.00 H new ATOM 0 HG SER A 143 -0.425 19.312 1.188 1.00 0.00 H new ATOM 2248 N VAL A 144 -3.458 16.350 1.593 1.00 0.00 N ATOM 2249 CA VAL A 144 -3.370 14.901 1.465 1.00 0.00 C ATOM 2250 C VAL A 144 -4.467 14.362 0.553 1.00 0.00 C ATOM 2251 O VAL A 144 -4.215 13.515 -0.303 1.00 0.00 O ATOM 2252 CB VAL A 144 -3.471 14.208 2.837 1.00 0.00 C ATOM 2253 CG1 VAL A 144 -4.837 14.453 3.459 1.00 0.00 C ATOM 2254 CG2 VAL A 144 -3.196 12.718 2.702 1.00 0.00 C ATOM 0 H VAL A 144 -3.461 16.688 2.555 1.00 0.00 H new ATOM 0 HA VAL A 144 -2.396 14.681 1.027 1.00 0.00 H new ATOM 0 HB VAL A 144 -2.716 14.635 3.498 1.00 0.00 H new ATOM 0 HG11 VAL A 144 -4.890 13.956 4.428 1.00 0.00 H new ATOM 0 HG12 VAL A 144 -4.989 15.524 3.592 1.00 0.00 H new ATOM 0 HG13 VAL A 144 -5.612 14.055 2.804 1.00 0.00 H new ATOM 0 HG21 VAL A 144 -3.271 12.244 3.681 1.00 0.00 H new ATOM 0 HG22 VAL A 144 -3.926 12.273 2.026 1.00 0.00 H new ATOM 0 HG23 VAL A 144 -2.193 12.568 2.303 1.00 0.00 H new ATOM 2264 N GLN A 145 -5.684 14.860 0.744 1.00 0.00 N ATOM 2265 CA GLN A 145 -6.820 14.428 -0.061 1.00 0.00 C ATOM 2266 C GLN A 145 -6.492 14.498 -1.549 1.00 0.00 C ATOM 2267 O GLN A 145 -6.820 13.589 -2.312 1.00 0.00 O ATOM 2268 CB GLN A 145 -8.046 15.291 0.243 1.00 0.00 C ATOM 2269 CG GLN A 145 -8.895 14.759 1.387 1.00 0.00 C ATOM 2270 CD GLN A 145 -9.748 15.835 2.030 1.00 0.00 C ATOM 2271 OE1 GLN A 145 -9.458 16.296 3.135 1.00 0.00 O ATOM 2272 NE2 GLN A 145 -10.806 16.243 1.340 1.00 0.00 N ATOM 0 H GLN A 145 -5.909 15.562 1.449 1.00 0.00 H new ATOM 0 HA GLN A 145 -7.040 13.392 0.196 1.00 0.00 H new ATOM 0 HB2 GLN A 145 -7.718 16.302 0.485 1.00 0.00 H new ATOM 0 HB3 GLN A 145 -8.662 15.362 -0.654 1.00 0.00 H new ATOM 0 HG2 GLN A 145 -9.540 13.963 1.016 1.00 0.00 H new ATOM 0 HG3 GLN A 145 -8.245 14.317 2.142 1.00 0.00 H new ATOM 0 HE21 GLN A 145 -11.009 15.834 0.428 1.00 0.00 H new ATOM 0 HE22 GLN A 145 -11.416 16.966 1.722 1.00 0.00 H new ATOM 2281 N HIS A 146 -5.841 15.584 -1.955 1.00 0.00 N ATOM 2282 CA HIS A 146 -5.467 15.773 -3.352 1.00 0.00 C ATOM 2283 C HIS A 146 -4.606 14.613 -3.846 1.00 0.00 C ATOM 2284 O HIS A 146 -4.965 13.923 -4.800 1.00 0.00 O ATOM 2285 CB HIS A 146 -4.714 17.092 -3.527 1.00 0.00 C ATOM 2286 CG HIS A 146 -3.691 17.058 -4.621 1.00 0.00 C ATOM 2287 ND1 HIS A 146 -3.945 16.539 -5.873 1.00 0.00 N ATOM 2288 CD2 HIS A 146 -2.407 17.485 -4.645 1.00 0.00 C ATOM 2289 CE1 HIS A 146 -2.861 16.646 -6.619 1.00 0.00 C ATOM 2290 NE2 HIS A 146 -1.913 17.217 -5.898 1.00 0.00 N ATOM 0 H HIS A 146 -5.562 16.346 -1.337 1.00 0.00 H new ATOM 0 HA HIS A 146 -6.381 15.803 -3.946 1.00 0.00 H new ATOM 0 HB2 HIS A 146 -5.432 17.885 -3.736 1.00 0.00 H new ATOM 0 HB3 HIS A 146 -4.222 17.347 -2.588 1.00 0.00 H new ATOM 0 HD2 HIS A 146 -1.871 17.950 -3.831 1.00 0.00 H new ATOM 0 HE1 HIS A 146 -2.766 16.322 -7.645 1.00 0.00 H new ATOM 0 HE2 HIS A 146 -0.968 17.425 -6.220 1.00 0.00 H new ATOM 2299 N VAL A 147 -3.468 14.406 -3.191 1.00 0.00 N ATOM 2300 CA VAL A 147 -2.557 13.331 -3.563 1.00 0.00 C ATOM 2301 C VAL A 147 -3.249 11.974 -3.491 1.00 0.00 C ATOM 2302 O VAL A 147 -3.146 11.163 -4.411 1.00 0.00 O ATOM 2303 CB VAL A 147 -1.313 13.310 -2.654 1.00 0.00 C ATOM 2304 CG1 VAL A 147 -0.398 12.154 -3.029 1.00 0.00 C ATOM 2305 CG2 VAL A 147 -0.572 14.636 -2.735 1.00 0.00 C ATOM 0 H VAL A 147 -3.155 14.969 -2.400 1.00 0.00 H new ATOM 0 HA VAL A 147 -2.245 13.522 -4.590 1.00 0.00 H new ATOM 0 HB VAL A 147 -1.639 13.165 -1.624 1.00 0.00 H new ATOM 0 HG11 VAL A 147 0.475 12.155 -2.377 1.00 0.00 H new ATOM 0 HG12 VAL A 147 -0.935 11.213 -2.915 1.00 0.00 H new ATOM 0 HG13 VAL A 147 -0.077 12.265 -4.065 1.00 0.00 H new ATOM 0 HG21 VAL A 147 0.304 14.604 -2.087 1.00 0.00 H new ATOM 0 HG22 VAL A 147 -0.256 14.814 -3.763 1.00 0.00 H new ATOM 0 HG23 VAL A 147 -1.232 15.442 -2.413 1.00 0.00 H new ATOM 2315 N VAL A 148 -3.956 11.734 -2.391 1.00 0.00 N ATOM 2316 CA VAL A 148 -4.667 10.476 -2.199 1.00 0.00 C ATOM 2317 C VAL A 148 -5.661 10.229 -3.328 1.00 0.00 C ATOM 2318 O VAL A 148 -5.821 9.100 -3.791 1.00 0.00 O ATOM 2319 CB VAL A 148 -5.418 10.456 -0.855 1.00 0.00 C ATOM 2320 CG1 VAL A 148 -6.476 9.363 -0.850 1.00 0.00 C ATOM 2321 CG2 VAL A 148 -4.443 10.271 0.298 1.00 0.00 C ATOM 0 H VAL A 148 -4.051 12.394 -1.620 1.00 0.00 H new ATOM 0 HA VAL A 148 -3.917 9.685 -2.200 1.00 0.00 H new ATOM 0 HB VAL A 148 -5.920 11.415 -0.726 1.00 0.00 H new ATOM 0 HG11 VAL A 148 -6.996 9.364 0.108 1.00 0.00 H new ATOM 0 HG12 VAL A 148 -7.192 9.546 -1.652 1.00 0.00 H new ATOM 0 HG13 VAL A 148 -5.999 8.395 -1.003 1.00 0.00 H new ATOM 0 HG21 VAL A 148 -4.991 10.259 1.240 1.00 0.00 H new ATOM 0 HG22 VAL A 148 -3.910 9.328 0.176 1.00 0.00 H new ATOM 0 HG23 VAL A 148 -3.728 11.093 0.305 1.00 0.00 H new ATOM 2331 N MET A 149 -6.326 11.292 -3.767 1.00 0.00 N ATOM 2332 CA MET A 149 -7.304 11.191 -4.844 1.00 0.00 C ATOM 2333 C MET A 149 -6.611 11.051 -6.196 1.00 0.00 C ATOM 2334 O MET A 149 -7.060 10.299 -7.062 1.00 0.00 O ATOM 2335 CB MET A 149 -8.217 12.418 -4.851 1.00 0.00 C ATOM 2336 CG MET A 149 -9.266 12.400 -3.751 1.00 0.00 C ATOM 2337 SD MET A 149 -10.798 11.599 -4.266 1.00 0.00 S ATOM 2338 CE MET A 149 -10.539 9.941 -3.640 1.00 0.00 C ATOM 0 H MET A 149 -6.206 12.234 -3.394 1.00 0.00 H new ATOM 0 HA MET A 149 -7.907 10.300 -4.670 1.00 0.00 H new ATOM 0 HB2 MET A 149 -7.607 13.315 -4.746 1.00 0.00 H new ATOM 0 HB3 MET A 149 -8.717 12.484 -5.818 1.00 0.00 H new ATOM 0 HG2 MET A 149 -8.865 11.882 -2.880 1.00 0.00 H new ATOM 0 HG3 MET A 149 -9.481 13.423 -3.443 1.00 0.00 H new ATOM 0 HE1 MET A 149 -10.529 9.236 -4.471 1.00 0.00 H new ATOM 0 HE2 MET A 149 -9.585 9.895 -3.114 1.00 0.00 H new ATOM 0 HE3 MET A 149 -11.345 9.681 -2.953 1.00 0.00 H new ATOM 2348 N THR A 150 -5.513 11.780 -6.372 1.00 0.00 N ATOM 2349 CA THR A 150 -4.759 11.739 -7.619 1.00 0.00 C ATOM 2350 C THR A 150 -4.242 10.333 -7.902 1.00 0.00 C ATOM 2351 O THR A 150 -4.213 9.892 -9.050 1.00 0.00 O ATOM 2352 CB THR A 150 -3.568 12.715 -7.588 1.00 0.00 C ATOM 2353 OG1 THR A 150 -4.043 14.065 -7.533 1.00 0.00 O ATOM 2354 CG2 THR A 150 -2.687 12.532 -8.814 1.00 0.00 C ATOM 0 H THR A 150 -5.126 12.406 -5.666 1.00 0.00 H new ATOM 0 HA THR A 150 -5.444 12.039 -8.413 1.00 0.00 H new ATOM 0 HB THR A 150 -2.975 12.502 -6.699 1.00 0.00 H new ATOM 0 HG1 THR A 150 -4.272 14.294 -6.608 1.00 0.00 H new ATOM 0 HG21 THR A 150 -1.853 13.232 -8.770 1.00 0.00 H new ATOM 0 HG22 THR A 150 -2.304 11.512 -8.838 1.00 0.00 H new ATOM 0 HG23 THR A 150 -3.272 12.721 -9.714 1.00 0.00 H new ATOM 2362 N ALA A 151 -3.836 9.633 -6.847 1.00 0.00 N ATOM 2363 CA ALA A 151 -3.322 8.276 -6.983 1.00 0.00 C ATOM 2364 C ALA A 151 -4.320 7.382 -7.712 1.00 0.00 C ATOM 2365 O ALA A 151 -3.954 6.651 -8.633 1.00 0.00 O ATOM 2366 CB ALA A 151 -2.993 7.697 -5.615 1.00 0.00 C ATOM 0 H ALA A 151 -3.853 9.984 -5.889 1.00 0.00 H new ATOM 0 HA ALA A 151 -2.409 8.317 -7.577 1.00 0.00 H new ATOM 0 HB1 ALA A 151 -2.610 6.683 -5.732 1.00 0.00 H new ATOM 0 HB2 ALA A 151 -2.239 8.316 -5.130 1.00 0.00 H new ATOM 0 HB3 ALA A 151 -3.894 7.676 -5.002 1.00 0.00 H new ATOM 2372 N ILE A 152 -5.579 7.445 -7.294 1.00 0.00 N ATOM 2373 CA ILE A 152 -6.629 6.641 -7.908 1.00 0.00 C ATOM 2374 C ILE A 152 -6.704 6.890 -9.410 1.00 0.00 C ATOM 2375 O ILE A 152 -6.664 5.953 -10.207 1.00 0.00 O ATOM 2376 CB ILE A 152 -8.004 6.937 -7.281 1.00 0.00 C ATOM 2377 CG1 ILE A 152 -8.069 6.381 -5.856 1.00 0.00 C ATOM 2378 CG2 ILE A 152 -9.114 6.345 -8.136 1.00 0.00 C ATOM 2379 CD1 ILE A 152 -7.560 7.346 -4.808 1.00 0.00 C ATOM 0 H ILE A 152 -5.897 8.044 -6.533 1.00 0.00 H new ATOM 0 HA ILE A 152 -6.373 5.597 -7.727 1.00 0.00 H new ATOM 0 HB ILE A 152 -8.142 8.017 -7.237 1.00 0.00 H new ATOM 0 HG12 ILE A 152 -9.101 6.116 -5.624 1.00 0.00 H new ATOM 0 HG13 ILE A 152 -7.485 5.462 -5.806 1.00 0.00 H new ATOM 0 HG21 ILE A 152 -10.080 6.562 -7.680 1.00 0.00 H new ATOM 0 HG22 ILE A 152 -9.077 6.782 -9.134 1.00 0.00 H new ATOM 0 HG23 ILE A 152 -8.982 5.265 -8.208 1.00 0.00 H new ATOM 0 HD11 ILE A 152 -7.636 6.886 -3.823 1.00 0.00 H new ATOM 0 HD12 ILE A 152 -6.518 7.592 -5.015 1.00 0.00 H new ATOM 0 HD13 ILE A 152 -8.159 8.256 -4.830 1.00 0.00 H new ATOM 2391 N GLN A 153 -6.811 8.159 -9.790 1.00 0.00 N ATOM 2392 CA GLN A 153 -6.890 8.532 -11.197 1.00 0.00 C ATOM 2393 C GLN A 153 -5.691 7.994 -11.971 1.00 0.00 C ATOM 2394 O GLN A 153 -5.845 7.392 -13.033 1.00 0.00 O ATOM 2395 CB GLN A 153 -6.965 10.053 -11.341 1.00 0.00 C ATOM 2396 CG GLN A 153 -7.950 10.706 -10.386 1.00 0.00 C ATOM 2397 CD GLN A 153 -9.284 9.988 -10.341 1.00 0.00 C ATOM 2398 OE1 GLN A 153 -9.873 9.683 -11.378 1.00 0.00 O ATOM 2399 NE2 GLN A 153 -9.768 9.713 -9.136 1.00 0.00 N ATOM 0 H GLN A 153 -6.845 8.946 -9.143 1.00 0.00 H new ATOM 0 HA GLN A 153 -7.796 8.091 -11.613 1.00 0.00 H new ATOM 0 HB2 GLN A 153 -5.974 10.475 -11.173 1.00 0.00 H new ATOM 0 HB3 GLN A 153 -7.247 10.299 -12.365 1.00 0.00 H new ATOM 0 HG2 GLN A 153 -7.519 10.727 -9.385 1.00 0.00 H new ATOM 0 HG3 GLN A 153 -8.109 11.742 -10.687 1.00 0.00 H new ATOM 0 HE21 GLN A 153 -9.246 9.984 -8.303 1.00 0.00 H new ATOM 0 HE22 GLN A 153 -10.662 9.230 -9.043 1.00 0.00 H new ATOM 2408 N GLU A 154 -4.496 8.217 -11.431 1.00 0.00 N ATOM 2409 CA GLU A 154 -3.271 7.755 -12.072 1.00 0.00 C ATOM 2410 C GLU A 154 -3.270 6.236 -12.215 1.00 0.00 C ATOM 2411 O GLU A 154 -2.710 5.690 -13.166 1.00 0.00 O ATOM 2412 CB GLU A 154 -2.048 8.203 -11.269 1.00 0.00 C ATOM 2413 CG GLU A 154 -0.802 7.379 -11.546 1.00 0.00 C ATOM 2414 CD GLU A 154 0.476 8.170 -11.349 1.00 0.00 C ATOM 2415 OE1 GLU A 154 0.724 9.103 -12.142 1.00 0.00 O ATOM 2416 OE2 GLU A 154 1.229 7.857 -10.403 1.00 0.00 O ATOM 0 H GLU A 154 -4.351 8.714 -10.552 1.00 0.00 H new ATOM 0 HA GLU A 154 -3.225 8.196 -13.068 1.00 0.00 H new ATOM 0 HB2 GLU A 154 -1.839 9.249 -11.494 1.00 0.00 H new ATOM 0 HB3 GLU A 154 -2.282 8.147 -10.206 1.00 0.00 H new ATOM 0 HG2 GLU A 154 -0.792 6.510 -10.888 1.00 0.00 H new ATOM 0 HG3 GLU A 154 -0.839 7.004 -12.569 1.00 0.00 H new ATOM 2423 N LEU A 155 -3.901 5.558 -11.263 1.00 0.00 N ATOM 2424 CA LEU A 155 -3.974 4.101 -11.280 1.00 0.00 C ATOM 2425 C LEU A 155 -4.829 3.613 -12.446 1.00 0.00 C ATOM 2426 O LEU A 155 -4.394 2.780 -13.240 1.00 0.00 O ATOM 2427 CB LEU A 155 -4.548 3.584 -9.960 1.00 0.00 C ATOM 2428 CG LEU A 155 -3.576 3.530 -8.781 1.00 0.00 C ATOM 2429 CD1 LEU A 155 -4.322 3.702 -7.467 1.00 0.00 C ATOM 2430 CD2 LEU A 155 -2.800 2.221 -8.788 1.00 0.00 C ATOM 0 H LEU A 155 -4.370 5.994 -10.469 1.00 0.00 H new ATOM 0 HA LEU A 155 -2.964 3.712 -11.406 1.00 0.00 H new ATOM 0 HB2 LEU A 155 -5.391 4.216 -9.681 1.00 0.00 H new ATOM 0 HB3 LEU A 155 -4.942 2.582 -10.126 1.00 0.00 H new ATOM 0 HG LEU A 155 -2.866 4.350 -8.883 1.00 0.00 H new ATOM 0 HD11 LEU A 155 -3.614 3.661 -6.639 1.00 0.00 H new ATOM 0 HD12 LEU A 155 -4.832 4.665 -7.461 1.00 0.00 H new ATOM 0 HD13 LEU A 155 -5.055 2.903 -7.358 1.00 0.00 H new ATOM 0 HD21 LEU A 155 -2.113 2.201 -7.942 1.00 0.00 H new ATOM 0 HD22 LEU A 155 -3.496 1.385 -8.711 1.00 0.00 H new ATOM 0 HD23 LEU A 155 -2.235 2.138 -9.716 1.00 0.00 H new ATOM 2442 N MET A 156 -6.045 4.139 -12.542 1.00 0.00 N ATOM 2443 CA MET A 156 -6.959 3.758 -13.613 1.00 0.00 C ATOM 2444 C MET A 156 -6.387 4.136 -14.975 1.00 0.00 C ATOM 2445 O MET A 156 -6.668 3.481 -15.980 1.00 0.00 O ATOM 2446 CB MET A 156 -8.320 4.430 -13.414 1.00 0.00 C ATOM 2447 CG MET A 156 -8.791 4.431 -11.969 1.00 0.00 C ATOM 2448 SD MET A 156 -10.589 4.424 -11.825 1.00 0.00 S ATOM 2449 CE MET A 156 -10.808 3.404 -10.369 1.00 0.00 C ATOM 0 H MET A 156 -6.421 4.830 -11.892 1.00 0.00 H new ATOM 0 HA MET A 156 -7.088 2.676 -13.580 1.00 0.00 H new ATOM 0 HB2 MET A 156 -8.264 5.459 -13.770 1.00 0.00 H new ATOM 0 HB3 MET A 156 -9.061 3.920 -14.029 1.00 0.00 H new ATOM 0 HG2 MET A 156 -8.386 3.557 -11.458 1.00 0.00 H new ATOM 0 HG3 MET A 156 -8.393 5.310 -11.462 1.00 0.00 H new ATOM 0 HE1 MET A 156 -11.722 2.818 -10.469 1.00 0.00 H new ATOM 0 HE2 MET A 156 -9.956 2.732 -10.264 1.00 0.00 H new ATOM 0 HE3 MET A 156 -10.880 4.040 -9.487 1.00 0.00 H new ATOM 2459 N SER A 157 -5.584 5.195 -15.003 1.00 0.00 N ATOM 2460 CA SER A 157 -4.976 5.661 -16.243 1.00 0.00 C ATOM 2461 C SER A 157 -3.916 4.679 -16.731 1.00 0.00 C ATOM 2462 O SER A 157 -3.624 4.604 -17.925 1.00 0.00 O ATOM 2463 CB SER A 157 -4.353 7.044 -16.042 1.00 0.00 C ATOM 2464 OG SER A 157 -5.289 8.071 -16.324 1.00 0.00 O ATOM 0 H SER A 157 -5.340 5.746 -14.180 1.00 0.00 H new ATOM 0 HA SER A 157 -5.758 5.729 -16.999 1.00 0.00 H new ATOM 0 HB2 SER A 157 -4.000 7.141 -15.015 1.00 0.00 H new ATOM 0 HB3 SER A 157 -3.483 7.152 -16.690 1.00 0.00 H new ATOM 0 HG SER A 157 -4.867 8.945 -16.186 1.00 0.00 H new