USER MOD reduce.3.24.130724 H: found=0, std=0, add=913, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 914 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 Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 ASN : amide:sc= 0 X(o=0,f=-0.37) USER MOD Single : A 13 TYR OH : rot 180:sc=-0.00815 USER MOD Single : A 14 THR OG1 : rot 180:sc= -0.166 USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 ASN : amide:sc=-0.00385 K(o=-0.0038,f=-0.77) USER MOD Single : A 23 GLN : amide:sc= -0.108 K(o=-0.11,f=-6.2!) USER MOD Single : A 30 THR OG1 : rot 180:sc=0.000156 USER MOD Single : A 35 GLN : amide:sc=-0.00181 K(o=-0.0018,f=-0.68) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 40 ASN : amide:sc= -0.0279 K(o=-0.028,f=-0.88) USER MOD Single : A 42 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0121) USER MOD Single : A 46 LYS NZ :NH3+ -169:sc= 0.467 (180deg=0.366) USER MOD Single : A 47 LYS NZ :NH3+ 167:sc= -0.0134 (180deg=-0.179) USER MOD Single : A 50 SER OG : rot 38:sc= 0.0136 USER MOD Single : A 51 THR OG1 : rot 3:sc= 0.851 USER MOD Single : A 53 TYR OH : rot -150:sc= -0.497 USER MOD Single : A 54 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 58 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0493) USER MOD Single : A 63 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0111) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 SER OG : rot 180:sc= 0.0317 USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 ASN : amide:sc= 0.662 K(o=0.66,f=-0.0064) USER MOD Single : A 75 THR OG1 : rot 77:sc= 1.22 USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 87 SER OG : rot 180:sc= 0.0263 USER MOD Single : A 97 ASN : amide:sc= 0.757 K(o=0.76,f=0) USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 103 TYR OH : rot 180:sc= 0 USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 ASN : amide:sc= 0 X(o=0,f=-0.028) USER MOD Single : A 118 SER OG : rot -150:sc= -0.1 USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 59 N GLY A 7 -3.156 8.026 -8.059 1.00 0.00 N ATOM 60 CA GLY A 7 -2.533 9.284 -7.682 1.00 0.00 C ATOM 61 C GLY A 7 -1.028 9.239 -7.927 1.00 0.00 C ATOM 62 O GLY A 7 -0.421 8.167 -7.967 1.00 0.00 O ATOM 0 HA2 GLY A 7 -2.975 10.100 -8.255 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -2.729 9.491 -6.630 1.00 0.00 H new ATOM 66 N SER A 8 -0.414 10.420 -8.024 1.00 0.00 N ATOM 67 CA SER A 8 1.032 10.589 -7.909 1.00 0.00 C ATOM 68 C SER A 8 1.480 10.120 -6.527 1.00 0.00 C ATOM 69 O SER A 8 0.662 10.036 -5.618 1.00 0.00 O ATOM 70 CB SER A 8 1.375 12.067 -8.093 1.00 0.00 C ATOM 71 OG SER A 8 0.847 12.514 -9.329 1.00 0.00 O ATOM 0 H SER A 8 -0.914 11.294 -8.186 1.00 0.00 H new ATOM 0 HA SER A 8 1.542 10.001 -8.672 1.00 0.00 H new ATOM 0 HB2 SER A 8 0.962 12.654 -7.273 1.00 0.00 H new ATOM 0 HB3 SER A 8 2.456 12.208 -8.073 1.00 0.00 H new ATOM 0 HG SER A 8 1.062 13.462 -9.453 1.00 0.00 H new ATOM 77 N ALA A 9 2.766 9.848 -6.328 1.00 0.00 N ATOM 78 CA ALA A 9 3.193 9.113 -5.148 1.00 0.00 C ATOM 79 C ALA A 9 2.798 9.768 -3.823 1.00 0.00 C ATOM 80 O ALA A 9 2.105 9.112 -3.051 1.00 0.00 O ATOM 81 CB ALA A 9 4.667 8.756 -5.239 1.00 0.00 C ATOM 0 H ALA A 9 3.519 10.122 -6.960 1.00 0.00 H new ATOM 0 HA ALA A 9 2.633 8.178 -5.141 1.00 0.00 H new ATOM 0 HB1 ALA A 9 4.964 8.207 -4.346 1.00 0.00 H new ATOM 0 HB2 ALA A 9 4.838 8.136 -6.119 1.00 0.00 H new ATOM 0 HB3 ALA A 9 5.258 9.668 -5.317 1.00 0.00 H new ATOM 87 N LYS A 10 3.131 11.039 -3.554 1.00 0.00 N ATOM 88 CA LYS A 10 2.683 11.705 -2.316 1.00 0.00 C ATOM 89 C LYS A 10 1.169 11.779 -2.193 1.00 0.00 C ATOM 90 O LYS A 10 0.725 11.994 -1.075 1.00 0.00 O ATOM 91 CB LYS A 10 3.220 13.136 -2.195 1.00 0.00 C ATOM 92 CG LYS A 10 4.692 13.212 -1.764 1.00 0.00 C ATOM 93 CD LYS A 10 5.018 14.536 -1.067 1.00 0.00 C ATOM 94 CE LYS A 10 4.338 14.673 0.303 1.00 0.00 C ATOM 95 NZ LYS A 10 4.577 15.993 0.923 1.00 0.00 N ATOM 0 H LYS A 10 3.701 11.622 -4.166 1.00 0.00 H new ATOM 0 HA LYS A 10 3.085 11.081 -1.517 1.00 0.00 H new ATOM 0 HB2 LYS A 10 3.106 13.639 -3.155 1.00 0.00 H new ATOM 0 HB3 LYS A 10 2.612 13.683 -1.474 1.00 0.00 H new ATOM 0 HG2 LYS A 10 4.916 12.384 -1.092 1.00 0.00 H new ATOM 0 HG3 LYS A 10 5.332 13.095 -2.638 1.00 0.00 H new ATOM 0 HD2 LYS A 10 6.098 14.618 -0.941 1.00 0.00 H new ATOM 0 HD3 LYS A 10 4.708 15.363 -1.705 1.00 0.00 H new ATOM 0 HE2 LYS A 10 3.265 14.517 0.190 1.00 0.00 H new ATOM 0 HE3 LYS A 10 4.706 13.891 0.967 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 4.098 16.035 1.845 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 5.599 16.134 1.057 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 4.203 16.740 0.304 1.00 0.00 H new ATOM 109 N ASN A 11 0.381 11.631 -3.265 1.00 0.00 N ATOM 110 CA ASN A 11 -1.075 11.757 -3.197 1.00 0.00 C ATOM 111 C ASN A 11 -1.617 10.965 -2.013 1.00 0.00 C ATOM 112 O ASN A 11 -2.362 11.524 -1.217 1.00 0.00 O ATOM 113 CB ASN A 11 -1.762 11.295 -4.486 1.00 0.00 C ATOM 114 CG ASN A 11 -3.278 11.350 -4.385 1.00 0.00 C ATOM 115 OD1 ASN A 11 -3.929 10.317 -4.396 1.00 0.00 O ATOM 116 ND2 ASN A 11 -3.866 12.530 -4.330 1.00 0.00 N ATOM 0 H ASN A 11 0.735 11.422 -4.198 1.00 0.00 H new ATOM 0 HA ASN A 11 -1.298 12.816 -3.067 1.00 0.00 H new ATOM 0 HB2 ASN A 11 -1.433 11.921 -5.315 1.00 0.00 H new ATOM 0 HB3 ASN A 11 -1.452 10.275 -4.714 1.00 0.00 H new ATOM 0 HD21 ASN A 11 -4.884 12.592 -4.296 1.00 0.00 H new ATOM 0 HD22 ASN A 11 -3.303 13.380 -4.322 1.00 0.00 H new ATOM 123 N ALA A 12 -1.194 9.702 -1.880 1.00 0.00 N ATOM 124 CA ALA A 12 -1.577 8.844 -0.773 1.00 0.00 C ATOM 125 C ALA A 12 -1.020 9.353 0.563 1.00 0.00 C ATOM 126 O ALA A 12 -1.807 9.684 1.440 1.00 0.00 O ATOM 127 CB ALA A 12 -1.182 7.398 -1.085 1.00 0.00 C ATOM 0 H ALA A 12 -0.570 9.251 -2.549 1.00 0.00 H new ATOM 0 HA ALA A 12 -2.660 8.871 -0.656 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -1.470 6.755 -0.253 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -1.691 7.069 -1.991 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -0.104 7.339 -1.233 1.00 0.00 H new ATOM 133 N TYR A 13 0.303 9.450 0.750 1.00 0.00 N ATOM 134 CA TYR A 13 0.918 9.850 2.023 1.00 0.00 C ATOM 135 C TYR A 13 0.375 11.183 2.536 1.00 0.00 C ATOM 136 O TYR A 13 0.080 11.300 3.727 1.00 0.00 O ATOM 137 CB TYR A 13 2.438 9.943 1.879 1.00 0.00 C ATOM 138 CG TYR A 13 3.206 10.219 3.157 1.00 0.00 C ATOM 139 CD1 TYR A 13 3.689 9.137 3.914 1.00 0.00 C ATOM 140 CD2 TYR A 13 3.540 11.536 3.534 1.00 0.00 C ATOM 141 CE1 TYR A 13 4.552 9.361 5.003 1.00 0.00 C ATOM 142 CE2 TYR A 13 4.378 11.770 4.640 1.00 0.00 C ATOM 143 CZ TYR A 13 4.899 10.679 5.372 1.00 0.00 C ATOM 144 OH TYR A 13 5.715 10.883 6.444 1.00 0.00 O ATOM 0 H TYR A 13 0.982 9.251 0.016 1.00 0.00 H new ATOM 0 HA TYR A 13 0.662 9.080 2.751 1.00 0.00 H new ATOM 0 HB2 TYR A 13 2.802 9.008 1.454 1.00 0.00 H new ATOM 0 HB3 TYR A 13 2.669 10.730 1.161 1.00 0.00 H new ATOM 0 HD1 TYR A 13 3.396 8.129 3.659 1.00 0.00 H new ATOM 0 HD2 TYR A 13 3.150 12.371 2.970 1.00 0.00 H new ATOM 0 HE1 TYR A 13 4.949 8.524 5.557 1.00 0.00 H new ATOM 0 HE2 TYR A 13 4.623 12.781 4.929 1.00 0.00 H new ATOM 0 HH TYR A 13 5.860 11.844 6.567 1.00 0.00 H new ATOM 154 N THR A 14 0.217 12.172 1.650 1.00 0.00 N ATOM 155 CA THR A 14 -0.347 13.459 2.000 1.00 0.00 C ATOM 156 C THR A 14 -1.702 13.261 2.683 1.00 0.00 C ATOM 157 O THR A 14 -1.962 13.865 3.727 1.00 0.00 O ATOM 158 CB THR A 14 -0.466 14.370 0.766 1.00 0.00 C ATOM 159 OG1 THR A 14 0.835 14.636 0.275 1.00 0.00 O ATOM 160 CG2 THR A 14 -1.093 15.730 1.087 1.00 0.00 C ATOM 0 H THR A 14 0.481 12.092 0.668 1.00 0.00 H new ATOM 0 HA THR A 14 0.324 13.958 2.699 1.00 0.00 H new ATOM 0 HB THR A 14 -1.099 13.848 0.049 1.00 0.00 H new ATOM 0 HG1 THR A 14 0.775 15.215 -0.514 1.00 0.00 H new ATOM 0 HG21 THR A 14 -1.150 16.328 0.177 1.00 0.00 H new ATOM 0 HG22 THR A 14 -2.096 15.583 1.488 1.00 0.00 H new ATOM 0 HG23 THR A 14 -0.480 16.249 1.824 1.00 0.00 H new ATOM 168 N LYS A 15 -2.566 12.437 2.078 1.00 0.00 N ATOM 169 CA LYS A 15 -3.866 12.089 2.624 1.00 0.00 C ATOM 170 C LYS A 15 -3.684 11.331 3.931 1.00 0.00 C ATOM 171 O LYS A 15 -4.221 11.797 4.922 1.00 0.00 O ATOM 172 CB LYS A 15 -4.712 11.314 1.605 1.00 0.00 C ATOM 173 CG LYS A 15 -4.993 12.096 0.308 1.00 0.00 C ATOM 174 CD LYS A 15 -6.121 13.124 0.384 1.00 0.00 C ATOM 175 CE LYS A 15 -5.664 14.521 0.808 1.00 0.00 C ATOM 176 NZ LYS A 15 -6.805 15.449 0.955 1.00 0.00 N ATOM 0 H LYS A 15 -2.370 11.991 1.182 1.00 0.00 H new ATOM 0 HA LYS A 15 -4.420 13.002 2.841 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -4.201 10.384 1.354 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -5.661 11.041 2.067 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -4.079 12.609 0.010 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -5.230 11.382 -0.481 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -6.603 13.191 -0.591 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -6.874 12.770 1.088 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -5.124 14.456 1.753 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -4.967 14.916 0.069 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -6.456 16.385 1.243 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -7.305 15.530 0.047 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -7.457 15.085 1.678 1.00 0.00 H new ATOM 190 N LEU A 16 -2.911 10.237 3.979 1.00 0.00 N ATOM 191 CA LEU A 16 -2.710 9.420 5.178 1.00 0.00 C ATOM 192 C LEU A 16 -2.447 10.289 6.407 1.00 0.00 C ATOM 193 O LEU A 16 -3.020 10.039 7.466 1.00 0.00 O ATOM 194 CB LEU A 16 -1.520 8.458 5.016 1.00 0.00 C ATOM 195 CG LEU A 16 -1.804 7.027 4.540 1.00 0.00 C ATOM 196 CD1 LEU A 16 -2.258 6.896 3.090 1.00 0.00 C ATOM 197 CD2 LEU A 16 -0.510 6.218 4.697 1.00 0.00 C ATOM 0 H LEU A 16 -2.399 9.891 3.168 1.00 0.00 H new ATOM 0 HA LEU A 16 -3.629 8.850 5.314 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -0.820 8.910 4.313 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -1.010 8.394 5.977 1.00 0.00 H new ATOM 0 HG LEU A 16 -2.632 6.665 5.150 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -2.431 5.845 2.856 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -3.181 7.457 2.946 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -1.486 7.292 2.430 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -0.679 5.193 4.366 1.00 0.00 H new ATOM 0 HD22 LEU A 16 0.277 6.669 4.093 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -0.207 6.216 5.744 1.00 0.00 H new ATOM 209 N GLY A 17 -1.573 11.290 6.279 1.00 0.00 N ATOM 210 CA GLY A 17 -1.142 12.108 7.405 1.00 0.00 C ATOM 211 C GLY A 17 -2.062 13.271 7.725 1.00 0.00 C ATOM 212 O GLY A 17 -1.721 14.106 8.562 1.00 0.00 O ATOM 0 H GLY A 17 -1.147 11.553 5.390 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -1.058 11.474 8.288 1.00 0.00 H new ATOM 0 HA3 GLY A 17 -0.145 12.496 7.195 1.00 0.00 H new ATOM 216 N THR A 18 -3.208 13.357 7.066 1.00 0.00 N ATOM 217 CA THR A 18 -4.223 14.364 7.301 1.00 0.00 C ATOM 218 C THR A 18 -5.598 13.689 7.440 1.00 0.00 C ATOM 219 O THR A 18 -6.597 14.368 7.661 1.00 0.00 O ATOM 220 CB THR A 18 -4.060 15.423 6.186 1.00 0.00 C ATOM 221 OG1 THR A 18 -4.273 16.757 6.593 1.00 0.00 O ATOM 222 CG2 THR A 18 -4.880 15.193 4.921 1.00 0.00 C ATOM 0 H THR A 18 -3.462 12.702 6.327 1.00 0.00 H new ATOM 0 HA THR A 18 -4.118 14.899 8.245 1.00 0.00 H new ATOM 0 HB THR A 18 -3.007 15.277 5.947 1.00 0.00 H new ATOM 0 HG1 THR A 18 -4.148 17.356 5.828 1.00 0.00 H new ATOM 0 HG21 THR A 18 -4.686 15.996 4.210 1.00 0.00 H new ATOM 0 HG22 THR A 18 -4.601 14.239 4.475 1.00 0.00 H new ATOM 0 HG23 THR A 18 -5.941 15.179 5.172 1.00 0.00 H new ATOM 230 N ASP A 19 -5.658 12.359 7.337 1.00 0.00 N ATOM 231 CA ASP A 19 -6.860 11.547 7.322 1.00 0.00 C ATOM 232 C ASP A 19 -6.633 10.363 8.237 1.00 0.00 C ATOM 233 O ASP A 19 -6.113 9.328 7.833 1.00 0.00 O ATOM 234 CB ASP A 19 -7.187 11.033 5.913 1.00 0.00 C ATOM 235 CG ASP A 19 -7.985 12.019 5.080 1.00 0.00 C ATOM 236 OD1 ASP A 19 -8.946 12.604 5.625 1.00 0.00 O ATOM 237 OD2 ASP A 19 -7.743 12.154 3.859 1.00 0.00 O ATOM 0 H ASP A 19 -4.813 11.794 7.257 1.00 0.00 H new ATOM 0 HA ASP A 19 -7.699 12.158 7.654 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -6.257 10.801 5.395 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -7.747 10.102 5.995 1.00 0.00 H new ATOM 242 N ASP A 20 -7.092 10.480 9.472 1.00 0.00 N ATOM 243 CA ASP A 20 -7.019 9.408 10.462 1.00 0.00 C ATOM 244 C ASP A 20 -7.778 8.161 9.976 1.00 0.00 C ATOM 245 O ASP A 20 -7.468 7.038 10.386 1.00 0.00 O ATOM 246 CB ASP A 20 -7.599 9.887 11.805 1.00 0.00 C ATOM 247 CG ASP A 20 -7.282 11.347 12.134 1.00 0.00 C ATOM 248 OD1 ASP A 20 -7.960 12.242 11.573 1.00 0.00 O ATOM 249 OD2 ASP A 20 -6.401 11.642 12.972 1.00 0.00 O ATOM 0 H ASP A 20 -7.532 11.331 9.824 1.00 0.00 H new ATOM 0 HA ASP A 20 -5.971 9.141 10.600 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -8.681 9.755 11.789 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -7.212 9.253 12.603 1.00 0.00 H new ATOM 254 N ASN A 21 -8.777 8.347 9.100 1.00 0.00 N ATOM 255 CA ASN A 21 -9.610 7.275 8.559 1.00 0.00 C ATOM 256 C ASN A 21 -8.914 6.575 7.396 1.00 0.00 C ATOM 257 O ASN A 21 -9.368 5.514 6.968 1.00 0.00 O ATOM 258 CB ASN A 21 -10.969 7.815 8.069 1.00 0.00 C ATOM 259 CG ASN A 21 -11.888 8.259 9.195 1.00 0.00 C ATOM 260 OD1 ASN A 21 -11.860 7.701 10.286 1.00 0.00 O ATOM 261 ND2 ASN A 21 -12.718 9.261 8.968 1.00 0.00 N ATOM 0 H ASN A 21 -9.029 9.269 8.744 1.00 0.00 H new ATOM 0 HA ASN A 21 -9.775 6.563 9.368 1.00 0.00 H new ATOM 0 HB2 ASN A 21 -10.796 8.657 7.399 1.00 0.00 H new ATOM 0 HB3 ASN A 21 -11.469 7.042 7.486 1.00 0.00 H new ATOM 0 HD21 ASN A 21 -13.346 9.580 9.705 1.00 0.00 H new ATOM 0 HD22 ASN A 21 -12.730 9.716 8.055 1.00 0.00 H new ATOM 268 N ALA A 22 -7.848 7.155 6.843 1.00 0.00 N ATOM 269 CA ALA A 22 -7.107 6.549 5.754 1.00 0.00 C ATOM 270 C ALA A 22 -6.324 5.337 6.262 1.00 0.00 C ATOM 271 O ALA A 22 -6.109 5.190 7.466 1.00 0.00 O ATOM 272 CB ALA A 22 -6.178 7.593 5.145 1.00 0.00 C ATOM 0 H ALA A 22 -7.480 8.058 7.143 1.00 0.00 H new ATOM 0 HA ALA A 22 -7.794 6.199 4.984 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -5.616 7.146 4.325 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -6.767 8.429 4.768 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -5.485 7.952 5.906 1.00 0.00 H new ATOM 278 N GLN A 23 -5.854 4.481 5.353 1.00 0.00 N ATOM 279 CA GLN A 23 -5.037 3.299 5.644 1.00 0.00 C ATOM 280 C GLN A 23 -4.078 3.017 4.483 1.00 0.00 C ATOM 281 O GLN A 23 -4.210 3.621 3.424 1.00 0.00 O ATOM 282 CB GLN A 23 -5.960 2.086 5.838 1.00 0.00 C ATOM 283 CG GLN A 23 -6.462 1.894 7.280 1.00 0.00 C ATOM 284 CD GLN A 23 -5.484 1.143 8.183 1.00 0.00 C ATOM 285 OE1 GLN A 23 -4.917 1.707 9.111 1.00 0.00 O ATOM 286 NE2 GLN A 23 -5.284 -0.146 7.963 1.00 0.00 N ATOM 0 H GLN A 23 -6.038 4.595 4.356 1.00 0.00 H new ATOM 0 HA GLN A 23 -4.457 3.481 6.549 1.00 0.00 H new ATOM 0 HB2 GLN A 23 -6.821 2.190 5.177 1.00 0.00 H new ATOM 0 HB3 GLN A 23 -5.428 1.187 5.529 1.00 0.00 H new ATOM 0 HG2 GLN A 23 -6.666 2.872 7.716 1.00 0.00 H new ATOM 0 HG3 GLN A 23 -7.408 1.352 7.256 1.00 0.00 H new ATOM 0 HE21 GLN A 23 -5.759 -0.611 7.189 1.00 0.00 H new ATOM 0 HE22 GLN A 23 -4.655 -0.675 8.567 1.00 0.00 H new ATOM 295 N LEU A 24 -3.166 2.047 4.648 1.00 0.00 N ATOM 296 CA LEU A 24 -2.270 1.558 3.599 1.00 0.00 C ATOM 297 C LEU A 24 -2.423 0.037 3.500 1.00 0.00 C ATOM 298 O LEU A 24 -2.366 -0.632 4.536 1.00 0.00 O ATOM 299 CB LEU A 24 -0.819 1.964 3.934 1.00 0.00 C ATOM 300 CG LEU A 24 0.198 2.108 2.793 1.00 0.00 C ATOM 301 CD1 LEU A 24 0.392 0.797 2.031 1.00 0.00 C ATOM 302 CD2 LEU A 24 -0.171 3.219 1.818 1.00 0.00 C ATOM 0 H LEU A 24 -3.031 1.571 5.540 1.00 0.00 H new ATOM 0 HA LEU A 24 -2.523 1.997 2.634 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -0.858 2.917 4.462 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -0.425 1.228 4.634 1.00 0.00 H new ATOM 0 HG LEU A 24 1.140 2.377 3.272 1.00 0.00 H new ATOM 0 HD11 LEU A 24 1.119 0.944 1.233 1.00 0.00 H new ATOM 0 HD12 LEU A 24 0.754 0.029 2.715 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -0.559 0.482 1.602 1.00 0.00 H new ATOM 0 HD21 LEU A 24 0.581 3.277 1.031 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -1.144 3.006 1.375 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -0.215 4.170 2.349 1.00 0.00 H new ATOM 314 N LEU A 25 -2.609 -0.498 2.288 1.00 0.00 N ATOM 315 CA LEU A 25 -2.597 -1.939 1.999 1.00 0.00 C ATOM 316 C LEU A 25 -1.382 -2.221 1.127 1.00 0.00 C ATOM 317 O LEU A 25 -1.391 -1.969 -0.080 1.00 0.00 O ATOM 318 CB LEU A 25 -3.918 -2.428 1.349 1.00 0.00 C ATOM 319 CG LEU A 25 -4.407 -3.841 1.732 1.00 0.00 C ATOM 320 CD1 LEU A 25 -3.647 -4.960 1.029 1.00 0.00 C ATOM 321 CD2 LEU A 25 -4.333 -4.130 3.220 1.00 0.00 C ATOM 0 H LEU A 25 -2.776 0.072 1.459 1.00 0.00 H new ATOM 0 HA LEU A 25 -2.525 -2.501 2.930 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -4.704 -1.717 1.604 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -3.796 -2.394 0.266 1.00 0.00 H new ATOM 0 HG LEU A 25 -5.447 -3.830 1.406 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -4.044 -5.924 1.346 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -3.763 -4.857 -0.050 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -2.590 -4.900 1.288 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -4.693 -5.141 3.413 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -3.300 -4.042 3.557 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -4.953 -3.415 3.761 1.00 0.00 H new ATOM 333 N ASP A 26 -0.290 -2.652 1.747 1.00 0.00 N ATOM 334 CA ASP A 26 0.926 -2.999 1.078 1.00 0.00 C ATOM 335 C ASP A 26 0.686 -4.328 0.343 1.00 0.00 C ATOM 336 O ASP A 26 0.718 -5.396 0.967 1.00 0.00 O ATOM 337 CB ASP A 26 2.077 -3.122 2.101 1.00 0.00 C ATOM 338 CG ASP A 26 2.162 -2.300 3.355 1.00 0.00 C ATOM 339 OD1 ASP A 26 2.603 -1.145 3.211 1.00 0.00 O ATOM 340 OD2 ASP A 26 1.983 -2.878 4.456 1.00 0.00 O ATOM 0 H ASP A 26 -0.240 -2.768 2.759 1.00 0.00 H new ATOM 0 HA ASP A 26 1.213 -2.229 0.362 1.00 0.00 H new ATOM 0 HB2 ASP A 26 2.098 -4.165 2.416 1.00 0.00 H new ATOM 0 HB3 ASP A 26 2.999 -2.937 1.550 1.00 0.00 H new ATOM 345 N ILE A 27 0.415 -4.284 -0.968 1.00 0.00 N ATOM 346 CA ILE A 27 0.221 -5.491 -1.787 1.00 0.00 C ATOM 347 C ILE A 27 1.533 -6.018 -2.376 1.00 0.00 C ATOM 348 O ILE A 27 1.524 -6.987 -3.140 1.00 0.00 O ATOM 349 CB ILE A 27 -0.866 -5.326 -2.870 1.00 0.00 C ATOM 350 CG1 ILE A 27 -0.510 -4.269 -3.932 1.00 0.00 C ATOM 351 CG2 ILE A 27 -2.215 -5.081 -2.181 1.00 0.00 C ATOM 352 CD1 ILE A 27 -1.447 -4.313 -5.145 1.00 0.00 C ATOM 0 H ILE A 27 0.324 -3.413 -1.491 1.00 0.00 H new ATOM 0 HA ILE A 27 -0.149 -6.250 -1.098 1.00 0.00 H new ATOM 0 HB ILE A 27 -0.936 -6.249 -3.446 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -0.552 -3.278 -3.481 1.00 0.00 H new ATOM 0 HG13 ILE A 27 0.516 -4.425 -4.264 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -2.993 -4.963 -2.935 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -2.456 -5.930 -1.541 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -2.156 -4.176 -1.576 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -1.150 -3.547 -5.862 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -1.386 -5.294 -5.616 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -2.471 -4.129 -4.820 1.00 0.00 H new ATOM 364 N ARG A 28 2.659 -5.390 -2.043 1.00 0.00 N ATOM 365 CA ARG A 28 3.967 -5.860 -2.465 1.00 0.00 C ATOM 366 C ARG A 28 4.229 -7.253 -1.899 1.00 0.00 C ATOM 367 O ARG A 28 3.670 -7.647 -0.867 1.00 0.00 O ATOM 368 CB ARG A 28 5.044 -4.860 -2.029 1.00 0.00 C ATOM 369 CG ARG A 28 4.830 -3.506 -2.709 1.00 0.00 C ATOM 370 CD ARG A 28 6.031 -2.568 -2.584 1.00 0.00 C ATOM 371 NE ARG A 28 6.293 -2.264 -1.182 1.00 0.00 N ATOM 372 CZ ARG A 28 7.319 -2.677 -0.446 1.00 0.00 C ATOM 373 NH1 ARG A 28 8.454 -3.104 -0.990 1.00 0.00 N ATOM 374 NH2 ARG A 28 7.172 -2.646 0.870 1.00 0.00 N ATOM 0 H ARG A 28 2.685 -4.544 -1.474 1.00 0.00 H new ATOM 0 HA ARG A 28 3.997 -5.933 -3.552 1.00 0.00 H new ATOM 0 HB2 ARG A 28 5.017 -4.737 -0.946 1.00 0.00 H new ATOM 0 HB3 ARG A 28 6.031 -5.248 -2.281 1.00 0.00 H new ATOM 0 HG2 ARG A 28 4.613 -3.668 -3.765 1.00 0.00 H new ATOM 0 HG3 ARG A 28 3.955 -3.024 -2.274 1.00 0.00 H new ATOM 0 HD2 ARG A 28 6.910 -3.030 -3.033 1.00 0.00 H new ATOM 0 HD3 ARG A 28 5.840 -1.646 -3.133 1.00 0.00 H new ATOM 0 HE ARG A 28 5.612 -1.667 -0.714 1.00 0.00 H new ATOM 0 HH11 ARG A 28 8.558 -3.122 -2.005 1.00 0.00 H new ATOM 0 HH12 ARG A 28 9.221 -3.414 -0.393 1.00 0.00 H new ATOM 0 HH21 ARG A 28 6.298 -2.315 1.278 1.00 0.00 H new ATOM 0 HH22 ARG A 28 7.933 -2.954 1.476 1.00 0.00 H new ATOM 388 N ALA A 29 5.102 -7.990 -2.583 1.00 0.00 N ATOM 389 CA ALA A 29 5.430 -9.364 -2.280 1.00 0.00 C ATOM 390 C ALA A 29 5.882 -9.503 -0.835 1.00 0.00 C ATOM 391 O ALA A 29 6.476 -8.594 -0.252 1.00 0.00 O ATOM 392 CB ALA A 29 6.539 -9.834 -3.220 1.00 0.00 C ATOM 0 H ALA A 29 5.612 -7.627 -3.388 1.00 0.00 H new ATOM 0 HA ALA A 29 4.542 -9.980 -2.420 1.00 0.00 H new ATOM 0 HB1 ALA A 29 6.791 -10.871 -2.996 1.00 0.00 H new ATOM 0 HB2 ALA A 29 6.197 -9.759 -4.252 1.00 0.00 H new ATOM 0 HB3 ALA A 29 7.421 -9.209 -3.083 1.00 0.00 H new ATOM 398 N THR A 30 5.678 -10.686 -0.273 1.00 0.00 N ATOM 399 CA THR A 30 6.192 -11.015 1.043 1.00 0.00 C ATOM 400 C THR A 30 7.723 -10.911 1.055 1.00 0.00 C ATOM 401 O THR A 30 8.294 -10.422 2.032 1.00 0.00 O ATOM 402 CB THR A 30 5.693 -12.404 1.437 1.00 0.00 C ATOM 403 OG1 THR A 30 4.311 -12.500 1.143 1.00 0.00 O ATOM 404 CG2 THR A 30 5.916 -12.666 2.923 1.00 0.00 C ATOM 0 H THR A 30 5.153 -11.440 -0.717 1.00 0.00 H new ATOM 0 HA THR A 30 5.826 -10.305 1.784 1.00 0.00 H new ATOM 0 HB THR A 30 6.252 -13.149 0.871 1.00 0.00 H new ATOM 0 HG1 THR A 30 3.985 -13.390 1.392 1.00 0.00 H new ATOM 0 HG21 THR A 30 5.552 -13.662 3.176 1.00 0.00 H new ATOM 0 HG22 THR A 30 6.981 -12.601 3.148 1.00 0.00 H new ATOM 0 HG23 THR A 30 5.375 -11.922 3.509 1.00 0.00 H new ATOM 412 N ALA A 31 8.377 -11.310 -0.043 1.00 0.00 N ATOM 413 CA ALA A 31 9.815 -11.180 -0.239 1.00 0.00 C ATOM 414 C ALA A 31 10.278 -9.727 -0.158 1.00 0.00 C ATOM 415 O ALA A 31 11.353 -9.439 0.365 1.00 0.00 O ATOM 416 CB ALA A 31 10.180 -11.727 -1.612 1.00 0.00 C ATOM 0 H ALA A 31 7.903 -11.742 -0.836 1.00 0.00 H new ATOM 0 HA ALA A 31 10.309 -11.739 0.556 1.00 0.00 H new ATOM 0 HB1 ALA A 31 11.255 -11.633 -1.767 1.00 0.00 H new ATOM 0 HB2 ALA A 31 9.895 -12.777 -1.673 1.00 0.00 H new ATOM 0 HB3 ALA A 31 9.652 -11.162 -2.381 1.00 0.00 H new ATOM 422 N ASP A 32 9.473 -8.799 -0.670 1.00 0.00 N ATOM 423 CA ASP A 32 9.864 -7.402 -0.766 1.00 0.00 C ATOM 424 C ASP A 32 10.006 -6.782 0.626 1.00 0.00 C ATOM 425 O ASP A 32 10.894 -5.953 0.823 1.00 0.00 O ATOM 426 CB ASP A 32 8.918 -6.633 -1.690 1.00 0.00 C ATOM 427 CG ASP A 32 9.377 -6.725 -3.136 1.00 0.00 C ATOM 428 OD1 ASP A 32 10.181 -5.864 -3.546 1.00 0.00 O ATOM 429 OD2 ASP A 32 8.929 -7.646 -3.850 1.00 0.00 O ATOM 0 H ASP A 32 8.538 -8.996 -1.027 1.00 0.00 H new ATOM 0 HA ASP A 32 10.850 -7.336 -1.227 1.00 0.00 H new ATOM 0 HB2 ASP A 32 7.909 -7.034 -1.599 1.00 0.00 H new ATOM 0 HB3 ASP A 32 8.875 -5.588 -1.384 1.00 0.00 H new ATOM 434 N PHE A 33 9.269 -7.243 1.647 1.00 0.00 N ATOM 435 CA PHE A 33 9.487 -6.750 3.011 1.00 0.00 C ATOM 436 C PHE A 33 10.826 -7.234 3.582 1.00 0.00 C ATOM 437 O PHE A 33 11.298 -6.682 4.580 1.00 0.00 O ATOM 438 CB PHE A 33 8.337 -7.143 3.947 1.00 0.00 C ATOM 439 CG PHE A 33 6.964 -6.761 3.435 1.00 0.00 C ATOM 440 CD1 PHE A 33 6.526 -5.424 3.459 1.00 0.00 C ATOM 441 CD2 PHE A 33 6.141 -7.747 2.873 1.00 0.00 C ATOM 442 CE1 PHE A 33 5.268 -5.078 2.929 1.00 0.00 C ATOM 443 CE2 PHE A 33 4.900 -7.400 2.316 1.00 0.00 C ATOM 444 CZ PHE A 33 4.464 -6.067 2.338 1.00 0.00 C ATOM 0 H PHE A 33 8.532 -7.942 1.557 1.00 0.00 H new ATOM 0 HA PHE A 33 9.518 -5.662 2.948 1.00 0.00 H new ATOM 0 HB2 PHE A 33 8.366 -8.221 4.108 1.00 0.00 H new ATOM 0 HB3 PHE A 33 8.495 -6.672 4.917 1.00 0.00 H new ATOM 0 HD1 PHE A 33 7.158 -4.659 3.886 1.00 0.00 H new ATOM 0 HD2 PHE A 33 6.463 -8.778 2.869 1.00 0.00 H new ATOM 0 HE1 PHE A 33 4.922 -4.056 2.977 1.00 0.00 H new ATOM 0 HE2 PHE A 33 4.279 -8.162 1.869 1.00 0.00 H new ATOM 0 HZ PHE A 33 3.512 -5.802 1.902 1.00 0.00 H new ATOM 454 N ARG A 34 11.432 -8.271 2.992 1.00 0.00 N ATOM 455 CA ARG A 34 12.697 -8.854 3.443 1.00 0.00 C ATOM 456 C ARG A 34 13.880 -8.083 2.873 1.00 0.00 C ATOM 457 O ARG A 34 14.900 -7.975 3.552 1.00 0.00 O ATOM 458 CB ARG A 34 12.831 -10.333 3.023 1.00 0.00 C ATOM 459 CG ARG A 34 11.545 -11.158 3.181 1.00 0.00 C ATOM 460 CD ARG A 34 11.760 -12.635 2.843 1.00 0.00 C ATOM 461 NE ARG A 34 12.339 -13.352 3.985 1.00 0.00 N ATOM 462 CZ ARG A 34 11.717 -14.208 4.804 1.00 0.00 C ATOM 463 NH1 ARG A 34 10.483 -14.651 4.571 1.00 0.00 N ATOM 464 NH2 ARG A 34 12.375 -14.615 5.876 1.00 0.00 N ATOM 0 H ARG A 34 11.047 -8.737 2.170 1.00 0.00 H new ATOM 0 HA ARG A 34 12.697 -8.793 4.531 1.00 0.00 H new ATOM 0 HB2 ARG A 34 13.149 -10.375 1.981 1.00 0.00 H new ATOM 0 HB3 ARG A 34 13.620 -10.796 3.616 1.00 0.00 H new ATOM 0 HG2 ARG A 34 11.183 -11.071 4.205 1.00 0.00 H new ATOM 0 HG3 ARG A 34 10.770 -10.748 2.533 1.00 0.00 H new ATOM 0 HD2 ARG A 34 10.810 -13.091 2.565 1.00 0.00 H new ATOM 0 HD3 ARG A 34 12.420 -12.723 1.980 1.00 0.00 H new ATOM 0 HE ARG A 34 13.326 -13.178 4.176 1.00 0.00 H new ATOM 0 HH11 ARG A 34 9.977 -14.338 3.743 1.00 0.00 H new ATOM 0 HH12 ARG A 34 10.044 -15.303 5.221 1.00 0.00 H new ATOM 0 HH21 ARG A 34 13.321 -14.276 6.053 1.00 0.00 H new ATOM 0 HH22 ARG A 34 11.937 -15.268 6.526 1.00 0.00 H new ATOM 478 N GLN A 35 13.744 -7.582 1.641 1.00 0.00 N ATOM 479 CA GLN A 35 14.846 -7.067 0.830 1.00 0.00 C ATOM 480 C GLN A 35 14.728 -5.558 0.581 1.00 0.00 C ATOM 481 O GLN A 35 15.753 -4.899 0.453 1.00 0.00 O ATOM 482 CB GLN A 35 14.923 -7.875 -0.482 1.00 0.00 C ATOM 483 CG GLN A 35 13.788 -7.531 -1.461 1.00 0.00 C ATOM 484 CD GLN A 35 13.482 -8.596 -2.517 1.00 0.00 C ATOM 485 OE1 GLN A 35 13.611 -9.798 -2.288 1.00 0.00 O ATOM 486 NE2 GLN A 35 13.006 -8.179 -3.678 1.00 0.00 N ATOM 0 H GLN A 35 12.841 -7.523 1.171 1.00 0.00 H new ATOM 0 HA GLN A 35 15.780 -7.196 1.378 1.00 0.00 H new ATOM 0 HB2 GLN A 35 15.882 -7.686 -0.964 1.00 0.00 H new ATOM 0 HB3 GLN A 35 14.887 -8.940 -0.250 1.00 0.00 H new ATOM 0 HG2 GLN A 35 12.881 -7.343 -0.887 1.00 0.00 H new ATOM 0 HG3 GLN A 35 14.041 -6.601 -1.971 1.00 0.00 H new ATOM 0 HE21 GLN A 35 12.903 -7.180 -3.858 1.00 0.00 H new ATOM 0 HE22 GLN A 35 12.742 -8.856 -4.394 1.00 0.00 H new ATOM 495 N VAL A 36 13.514 -5.002 0.567 1.00 0.00 N ATOM 496 CA VAL A 36 13.239 -3.572 0.408 1.00 0.00 C ATOM 497 C VAL A 36 12.825 -2.993 1.766 1.00 0.00 C ATOM 498 O VAL A 36 13.329 -1.953 2.179 1.00 0.00 O ATOM 499 CB VAL A 36 12.160 -3.330 -0.677 1.00 0.00 C ATOM 500 CG1 VAL A 36 11.967 -1.841 -0.993 1.00 0.00 C ATOM 501 CG2 VAL A 36 12.476 -4.056 -1.991 1.00 0.00 C ATOM 0 H VAL A 36 12.664 -5.556 0.670 1.00 0.00 H new ATOM 0 HA VAL A 36 14.140 -3.060 0.068 1.00 0.00 H new ATOM 0 HB VAL A 36 11.242 -3.733 -0.249 1.00 0.00 H new ATOM 0 HG11 VAL A 36 11.200 -1.728 -1.759 1.00 0.00 H new ATOM 0 HG12 VAL A 36 11.658 -1.314 -0.090 1.00 0.00 H new ATOM 0 HG13 VAL A 36 12.906 -1.421 -1.355 1.00 0.00 H new ATOM 0 HG21 VAL A 36 11.689 -3.853 -2.717 1.00 0.00 H new ATOM 0 HG22 VAL A 36 13.430 -3.702 -2.382 1.00 0.00 H new ATOM 0 HG23 VAL A 36 12.534 -5.129 -1.809 1.00 0.00 H new ATOM 511 N GLY A 37 11.936 -3.662 2.507 1.00 0.00 N ATOM 512 CA GLY A 37 11.356 -3.131 3.741 1.00 0.00 C ATOM 513 C GLY A 37 9.885 -2.776 3.511 1.00 0.00 C ATOM 514 O GLY A 37 9.287 -3.257 2.546 1.00 0.00 O ATOM 0 H GLY A 37 11.598 -4.593 2.264 1.00 0.00 H new ATOM 0 HA2 GLY A 37 11.441 -3.867 4.540 1.00 0.00 H new ATOM 0 HA3 GLY A 37 11.907 -2.247 4.062 1.00 0.00 H new ATOM 518 N SER A 38 9.298 -1.947 4.377 1.00 0.00 N ATOM 519 CA SER A 38 7.904 -1.499 4.289 1.00 0.00 C ATOM 520 C SER A 38 7.821 0.027 4.461 1.00 0.00 C ATOM 521 O SER A 38 8.758 0.611 5.002 1.00 0.00 O ATOM 522 CB SER A 38 7.029 -2.222 5.335 1.00 0.00 C ATOM 523 OG SER A 38 7.637 -3.359 5.932 1.00 0.00 O ATOM 0 H SER A 38 9.791 -1.558 5.181 1.00 0.00 H new ATOM 0 HA SER A 38 7.521 -1.753 3.301 1.00 0.00 H new ATOM 0 HB2 SER A 38 6.765 -1.514 6.120 1.00 0.00 H new ATOM 0 HB3 SER A 38 6.099 -2.532 4.859 1.00 0.00 H new ATOM 0 HG SER A 38 7.020 -3.757 6.581 1.00 0.00 H new ATOM 529 N PRO A 39 6.703 0.676 4.099 1.00 0.00 N ATOM 530 CA PRO A 39 6.487 2.104 4.321 1.00 0.00 C ATOM 531 C PRO A 39 6.296 2.455 5.813 1.00 0.00 C ATOM 532 O PRO A 39 5.422 1.909 6.493 1.00 0.00 O ATOM 533 CB PRO A 39 5.265 2.439 3.460 1.00 0.00 C ATOM 534 CG PRO A 39 4.474 1.135 3.410 1.00 0.00 C ATOM 535 CD PRO A 39 5.555 0.069 3.437 1.00 0.00 C ATOM 0 HA PRO A 39 7.355 2.700 4.038 1.00 0.00 H new ATOM 0 HB2 PRO A 39 4.677 3.245 3.899 1.00 0.00 H new ATOM 0 HB3 PRO A 39 5.558 2.766 2.462 1.00 0.00 H new ATOM 0 HG2 PRO A 39 3.797 1.043 4.259 1.00 0.00 H new ATOM 0 HG3 PRO A 39 3.866 1.068 2.508 1.00 0.00 H new ATOM 0 HD2 PRO A 39 5.217 -0.816 3.976 1.00 0.00 H new ATOM 0 HD3 PRO A 39 5.812 -0.252 2.427 1.00 0.00 H new ATOM 543 N ASN A 40 7.140 3.347 6.351 1.00 0.00 N ATOM 544 CA ASN A 40 7.087 3.814 7.736 1.00 0.00 C ATOM 545 C ASN A 40 6.066 4.941 7.887 1.00 0.00 C ATOM 546 O ASN A 40 6.406 6.123 7.961 1.00 0.00 O ATOM 547 CB ASN A 40 8.465 4.246 8.271 1.00 0.00 C ATOM 548 CG ASN A 40 8.417 4.424 9.784 1.00 0.00 C ATOM 549 OD1 ASN A 40 7.770 3.649 10.490 1.00 0.00 O ATOM 550 ND2 ASN A 40 9.037 5.457 10.324 1.00 0.00 N ATOM 0 H ASN A 40 7.898 3.773 5.817 1.00 0.00 H new ATOM 0 HA ASN A 40 6.768 2.967 8.343 1.00 0.00 H new ATOM 0 HB2 ASN A 40 9.214 3.498 8.010 1.00 0.00 H new ATOM 0 HB3 ASN A 40 8.769 5.180 7.798 1.00 0.00 H new ATOM 0 HD21 ASN A 40 8.982 5.616 11.330 1.00 0.00 H new ATOM 0 HD22 ASN A 40 9.571 6.096 9.735 1.00 0.00 H new ATOM 557 N ILE A 41 4.795 4.554 7.967 1.00 0.00 N ATOM 558 CA ILE A 41 3.665 5.471 8.114 1.00 0.00 C ATOM 559 C ILE A 41 3.123 5.532 9.547 1.00 0.00 C ATOM 560 O ILE A 41 2.065 6.111 9.771 1.00 0.00 O ATOM 561 CB ILE A 41 2.559 5.094 7.115 1.00 0.00 C ATOM 562 CG1 ILE A 41 2.000 3.668 7.330 1.00 0.00 C ATOM 563 CG2 ILE A 41 3.083 5.299 5.688 1.00 0.00 C ATOM 564 CD1 ILE A 41 0.476 3.638 7.164 1.00 0.00 C ATOM 0 H ILE A 41 4.515 3.574 7.931 1.00 0.00 H new ATOM 0 HA ILE A 41 4.027 6.475 7.892 1.00 0.00 H new ATOM 0 HB ILE A 41 1.709 5.754 7.287 1.00 0.00 H new ATOM 0 HG12 ILE A 41 2.459 2.983 6.617 1.00 0.00 H new ATOM 0 HG13 ILE A 41 2.267 3.317 8.327 1.00 0.00 H new ATOM 0 HG21 ILE A 41 2.304 5.034 4.973 1.00 0.00 H new ATOM 0 HG22 ILE A 41 3.362 6.343 5.550 1.00 0.00 H new ATOM 0 HG23 ILE A 41 3.955 4.666 5.526 1.00 0.00 H new ATOM 0 HD11 ILE A 41 0.113 2.622 7.321 1.00 0.00 H new ATOM 0 HD12 ILE A 41 0.017 4.304 7.894 1.00 0.00 H new ATOM 0 HD13 ILE A 41 0.213 3.966 6.158 1.00 0.00 H new ATOM 576 N LYS A 42 3.785 4.883 10.508 1.00 0.00 N ATOM 577 CA LYS A 42 3.312 4.775 11.884 1.00 0.00 C ATOM 578 C LYS A 42 3.010 6.157 12.457 1.00 0.00 C ATOM 579 O LYS A 42 1.951 6.342 13.043 1.00 0.00 O ATOM 580 CB LYS A 42 4.340 3.995 12.720 1.00 0.00 C ATOM 581 CG LYS A 42 3.747 3.159 13.865 1.00 0.00 C ATOM 582 CD LYS A 42 3.227 3.950 15.075 1.00 0.00 C ATOM 583 CE LYS A 42 2.695 2.998 16.156 1.00 0.00 C ATOM 584 NZ LYS A 42 3.758 2.248 16.861 1.00 0.00 N ATOM 0 H LYS A 42 4.676 4.413 10.347 1.00 0.00 H new ATOM 0 HA LYS A 42 2.375 4.219 11.912 1.00 0.00 H new ATOM 0 HB2 LYS A 42 4.897 3.333 12.057 1.00 0.00 H new ATOM 0 HB3 LYS A 42 5.056 4.702 13.139 1.00 0.00 H new ATOM 0 HG2 LYS A 42 2.927 2.562 13.466 1.00 0.00 H new ATOM 0 HG3 LYS A 42 4.509 2.461 14.212 1.00 0.00 H new ATOM 0 HD2 LYS A 42 4.028 4.564 15.486 1.00 0.00 H new ATOM 0 HD3 LYS A 42 2.435 4.629 14.759 1.00 0.00 H new ATOM 0 HE2 LYS A 42 2.123 3.573 16.885 1.00 0.00 H new ATOM 0 HE3 LYS A 42 2.006 2.289 15.697 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 3.335 1.677 17.620 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 4.246 1.622 16.188 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 4.441 2.917 17.270 1.00 0.00 H new ATOM 598 N GLY A 43 3.881 7.134 12.217 1.00 0.00 N ATOM 599 CA GLY A 43 3.715 8.506 12.668 1.00 0.00 C ATOM 600 C GLY A 43 2.533 9.240 12.039 1.00 0.00 C ATOM 601 O GLY A 43 2.165 10.304 12.527 1.00 0.00 O ATOM 0 H GLY A 43 4.742 6.986 11.690 1.00 0.00 H new ATOM 0 HA2 GLY A 43 3.592 8.507 13.751 1.00 0.00 H new ATOM 0 HA3 GLY A 43 4.628 9.060 12.450 1.00 0.00 H new ATOM 605 N LEU A 44 1.938 8.712 10.965 1.00 0.00 N ATOM 606 CA LEU A 44 0.702 9.236 10.388 1.00 0.00 C ATOM 607 C LEU A 44 -0.515 8.691 11.134 1.00 0.00 C ATOM 608 O LEU A 44 -1.625 9.153 10.887 1.00 0.00 O ATOM 609 CB LEU A 44 0.572 8.854 8.902 1.00 0.00 C ATOM 610 CG LEU A 44 1.821 9.117 8.044 1.00 0.00 C ATOM 611 CD1 LEU A 44 1.565 8.637 6.618 1.00 0.00 C ATOM 612 CD2 LEU A 44 2.236 10.589 8.007 1.00 0.00 C ATOM 0 H LEU A 44 2.307 7.901 10.469 1.00 0.00 H new ATOM 0 HA LEU A 44 0.741 10.321 10.480 1.00 0.00 H new ATOM 0 HB2 LEU A 44 0.323 7.795 8.837 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -0.265 9.405 8.474 1.00 0.00 H new ATOM 0 HG LEU A 44 2.640 8.566 8.507 1.00 0.00 H new ATOM 0 HD11 LEU A 44 2.449 8.822 6.008 1.00 0.00 H new ATOM 0 HD12 LEU A 44 1.348 7.569 6.627 1.00 0.00 H new ATOM 0 HD13 LEU A 44 0.715 9.177 6.199 1.00 0.00 H new ATOM 0 HD21 LEU A 44 3.123 10.701 7.384 1.00 0.00 H new ATOM 0 HD22 LEU A 44 1.424 11.186 7.592 1.00 0.00 H new ATOM 0 HD23 LEU A 44 2.457 10.930 9.018 1.00 0.00 H new ATOM 624 N GLY A 45 -0.343 7.687 11.999 1.00 0.00 N ATOM 625 CA GLY A 45 -1.378 7.221 12.899 1.00 0.00 C ATOM 626 C GLY A 45 -1.328 5.730 13.208 1.00 0.00 C ATOM 627 O GLY A 45 -1.939 5.307 14.190 1.00 0.00 O ATOM 0 H GLY A 45 0.534 7.174 12.087 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -1.303 7.775 13.835 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -2.350 7.456 12.466 1.00 0.00 H new ATOM 631 N LYS A 46 -0.706 4.914 12.350 1.00 0.00 N ATOM 632 CA LYS A 46 -0.714 3.449 12.408 1.00 0.00 C ATOM 633 C LYS A 46 0.143 2.897 11.280 1.00 0.00 C ATOM 634 O LYS A 46 0.522 3.623 10.366 1.00 0.00 O ATOM 635 CB LYS A 46 -2.133 2.838 12.332 1.00 0.00 C ATOM 636 CG LYS A 46 -3.256 3.614 11.633 1.00 0.00 C ATOM 637 CD LYS A 46 -2.975 4.143 10.218 1.00 0.00 C ATOM 638 CE LYS A 46 -4.255 4.680 9.560 1.00 0.00 C ATOM 639 NZ LYS A 46 -4.882 5.832 10.245 1.00 0.00 N ATOM 0 H LYS A 46 -0.162 5.271 11.565 1.00 0.00 H new ATOM 0 HA LYS A 46 -0.307 3.167 13.379 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -2.046 1.872 11.835 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -2.459 2.642 13.354 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -4.132 2.967 11.583 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -3.522 4.463 12.263 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -2.228 4.935 10.265 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -2.556 3.345 9.605 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -4.023 4.970 8.535 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -4.983 3.871 9.505 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -5.826 6.003 9.843 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -4.970 5.626 11.261 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -4.291 6.678 10.113 1.00 0.00 H new ATOM 653 N LYS A 47 0.501 1.620 11.367 1.00 0.00 N ATOM 654 CA LYS A 47 1.339 0.946 10.384 1.00 0.00 C ATOM 655 C LYS A 47 0.483 0.466 9.215 1.00 0.00 C ATOM 656 O LYS A 47 -0.741 0.365 9.325 1.00 0.00 O ATOM 657 CB LYS A 47 2.100 -0.211 11.067 1.00 0.00 C ATOM 658 CG LYS A 47 3.496 -0.455 10.474 1.00 0.00 C ATOM 659 CD LYS A 47 4.497 0.663 10.807 1.00 0.00 C ATOM 660 CE LYS A 47 5.100 0.562 12.213 1.00 0.00 C ATOM 661 NZ LYS A 47 5.879 -0.670 12.434 1.00 0.00 N ATOM 0 H LYS A 47 0.212 1.015 12.136 1.00 0.00 H new ATOM 0 HA LYS A 47 2.079 1.637 9.980 1.00 0.00 H new ATOM 0 HB2 LYS A 47 2.198 0.006 12.131 1.00 0.00 H new ATOM 0 HB3 LYS A 47 1.512 -1.124 10.981 1.00 0.00 H new ATOM 0 HG2 LYS A 47 3.882 -1.403 10.848 1.00 0.00 H new ATOM 0 HG3 LYS A 47 3.413 -0.549 9.391 1.00 0.00 H new ATOM 0 HD2 LYS A 47 5.304 0.644 10.075 1.00 0.00 H new ATOM 0 HD3 LYS A 47 3.997 1.626 10.706 1.00 0.00 H new ATOM 0 HE2 LYS A 47 5.743 1.425 12.386 1.00 0.00 H new ATOM 0 HE3 LYS A 47 4.297 0.611 12.948 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 6.434 -0.578 13.309 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 5.232 -1.480 12.519 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 6.522 -0.823 11.631 1.00 0.00 H new ATOM 675 N ALA A 48 1.130 0.155 8.096 1.00 0.00 N ATOM 676 CA ALA A 48 0.471 -0.393 6.925 1.00 0.00 C ATOM 677 C ALA A 48 0.153 -1.879 7.119 1.00 0.00 C ATOM 678 O ALA A 48 0.791 -2.560 7.932 1.00 0.00 O ATOM 679 CB ALA A 48 1.394 -0.211 5.730 1.00 0.00 C ATOM 0 H ALA A 48 2.136 0.279 7.980 1.00 0.00 H new ATOM 0 HA ALA A 48 -0.472 0.129 6.762 1.00 0.00 H new ATOM 0 HB1 ALA A 48 0.918 -0.617 4.837 1.00 0.00 H new ATOM 0 HB2 ALA A 48 1.595 0.850 5.584 1.00 0.00 H new ATOM 0 HB3 ALA A 48 2.332 -0.736 5.911 1.00 0.00 H new ATOM 685 N VAL A 49 -0.815 -2.395 6.365 1.00 0.00 N ATOM 686 CA VAL A 49 -1.225 -3.793 6.375 1.00 0.00 C ATOM 687 C VAL A 49 -0.566 -4.483 5.181 1.00 0.00 C ATOM 688 O VAL A 49 -0.916 -4.194 4.040 1.00 0.00 O ATOM 689 CB VAL A 49 -2.762 -3.870 6.288 1.00 0.00 C ATOM 690 CG1 VAL A 49 -3.249 -5.322 6.168 1.00 0.00 C ATOM 691 CG2 VAL A 49 -3.469 -3.213 7.483 1.00 0.00 C ATOM 0 H VAL A 49 -1.353 -1.830 5.708 1.00 0.00 H new ATOM 0 HA VAL A 49 -0.915 -4.291 7.294 1.00 0.00 H new ATOM 0 HB VAL A 49 -3.024 -3.314 5.388 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -4.337 -5.337 6.109 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -2.831 -5.773 5.268 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -2.925 -5.888 7.042 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -4.548 -3.301 7.361 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -3.166 -3.711 8.404 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -3.195 -2.159 7.534 1.00 0.00 H new ATOM 701 N SER A 50 0.346 -5.420 5.431 1.00 0.00 N ATOM 702 CA SER A 50 0.972 -6.194 4.375 1.00 0.00 C ATOM 703 C SER A 50 0.077 -7.377 3.994 1.00 0.00 C ATOM 704 O SER A 50 -0.204 -8.240 4.832 1.00 0.00 O ATOM 705 CB SER A 50 2.381 -6.603 4.823 1.00 0.00 C ATOM 706 OG SER A 50 2.420 -7.195 6.113 1.00 0.00 O ATOM 0 H SER A 50 0.667 -5.659 6.369 1.00 0.00 H new ATOM 0 HA SER A 50 1.086 -5.599 3.469 1.00 0.00 H new ATOM 0 HB2 SER A 50 2.794 -7.305 4.098 1.00 0.00 H new ATOM 0 HB3 SER A 50 3.024 -5.723 4.817 1.00 0.00 H new ATOM 0 HG SER A 50 1.634 -7.768 6.234 1.00 0.00 H new ATOM 712 N THR A 51 -0.393 -7.466 2.750 1.00 0.00 N ATOM 713 CA THR A 51 -0.988 -8.677 2.187 1.00 0.00 C ATOM 714 C THR A 51 -0.758 -8.618 0.678 1.00 0.00 C ATOM 715 O THR A 51 -1.441 -7.854 0.002 1.00 0.00 O ATOM 716 CB THR A 51 -2.495 -8.783 2.526 1.00 0.00 C ATOM 717 OG1 THR A 51 -2.697 -8.830 3.928 1.00 0.00 O ATOM 718 CG2 THR A 51 -3.136 -10.057 1.959 1.00 0.00 C ATOM 0 H THR A 51 -0.370 -6.685 2.094 1.00 0.00 H new ATOM 0 HA THR A 51 -0.525 -9.566 2.614 1.00 0.00 H new ATOM 0 HB THR A 51 -2.954 -7.900 2.081 1.00 0.00 H new ATOM 0 HG1 THR A 51 -1.835 -8.743 4.386 1.00 0.00 H new ATOM 0 HG21 THR A 51 -4.193 -10.082 2.225 1.00 0.00 H new ATOM 0 HG22 THR A 51 -3.035 -10.063 0.874 1.00 0.00 H new ATOM 0 HG23 THR A 51 -2.636 -10.932 2.375 1.00 0.00 H new ATOM 726 N VAL A 52 0.176 -9.410 0.144 1.00 0.00 N ATOM 727 CA VAL A 52 0.372 -9.508 -1.300 1.00 0.00 C ATOM 728 C VAL A 52 -0.928 -9.944 -1.989 1.00 0.00 C ATOM 729 O VAL A 52 -1.566 -10.915 -1.568 1.00 0.00 O ATOM 730 CB VAL A 52 1.603 -10.370 -1.651 1.00 0.00 C ATOM 731 CG1 VAL A 52 1.613 -11.771 -1.034 1.00 0.00 C ATOM 732 CG2 VAL A 52 1.802 -10.523 -3.162 1.00 0.00 C ATOM 0 H VAL A 52 0.808 -9.992 0.693 1.00 0.00 H new ATOM 0 HA VAL A 52 0.606 -8.520 -1.698 1.00 0.00 H new ATOM 0 HB VAL A 52 2.423 -9.804 -1.209 1.00 0.00 H new ATOM 0 HG11 VAL A 52 2.518 -12.297 -1.340 1.00 0.00 H new ATOM 0 HG12 VAL A 52 1.590 -11.690 0.053 1.00 0.00 H new ATOM 0 HG13 VAL A 52 0.738 -12.325 -1.375 1.00 0.00 H new ATOM 0 HG21 VAL A 52 2.681 -11.138 -3.353 1.00 0.00 H new ATOM 0 HG22 VAL A 52 0.924 -11.000 -3.598 1.00 0.00 H new ATOM 0 HG23 VAL A 52 1.942 -9.540 -3.612 1.00 0.00 H new ATOM 742 N TYR A 53 -1.336 -9.192 -3.014 1.00 0.00 N ATOM 743 CA TYR A 53 -2.463 -9.534 -3.870 1.00 0.00 C ATOM 744 C TYR A 53 -2.052 -10.642 -4.832 1.00 0.00 C ATOM 745 O TYR A 53 -0.882 -10.744 -5.200 1.00 0.00 O ATOM 746 CB TYR A 53 -2.932 -8.283 -4.630 1.00 0.00 C ATOM 747 CG TYR A 53 -4.085 -8.502 -5.598 1.00 0.00 C ATOM 748 CD1 TYR A 53 -5.242 -9.197 -5.191 1.00 0.00 C ATOM 749 CD2 TYR A 53 -4.007 -7.999 -6.910 1.00 0.00 C ATOM 750 CE1 TYR A 53 -6.308 -9.381 -6.085 1.00 0.00 C ATOM 751 CE2 TYR A 53 -5.086 -8.148 -7.802 1.00 0.00 C ATOM 752 CZ TYR A 53 -6.253 -8.813 -7.378 1.00 0.00 C ATOM 753 OH TYR A 53 -7.340 -8.886 -8.187 1.00 0.00 O ATOM 0 H TYR A 53 -0.882 -8.316 -3.272 1.00 0.00 H new ATOM 0 HA TYR A 53 -3.294 -9.896 -3.265 1.00 0.00 H new ATOM 0 HB2 TYR A 53 -3.229 -7.527 -3.903 1.00 0.00 H new ATOM 0 HB3 TYR A 53 -2.086 -7.877 -5.185 1.00 0.00 H new ATOM 0 HD1 TYR A 53 -5.308 -9.589 -4.187 1.00 0.00 H new ATOM 0 HD2 TYR A 53 -3.110 -7.493 -7.236 1.00 0.00 H new ATOM 0 HE1 TYR A 53 -7.171 -9.957 -5.785 1.00 0.00 H new ATOM 0 HE2 TYR A 53 -5.019 -7.755 -8.806 1.00 0.00 H new ATOM 0 HH TYR A 53 -7.050 -8.910 -9.123 1.00 0.00 H new ATOM 763 N ASN A 54 -3.016 -11.459 -5.259 1.00 0.00 N ATOM 764 CA ASN A 54 -2.738 -12.579 -6.171 1.00 0.00 C ATOM 765 C ASN A 54 -3.668 -12.697 -7.378 1.00 0.00 C ATOM 766 O ASN A 54 -3.399 -13.548 -8.230 1.00 0.00 O ATOM 767 CB ASN A 54 -2.651 -13.919 -5.417 1.00 0.00 C ATOM 768 CG ASN A 54 -1.437 -13.977 -4.506 1.00 0.00 C ATOM 769 OD1 ASN A 54 -0.341 -14.337 -4.936 1.00 0.00 O ATOM 770 ND2 ASN A 54 -1.592 -13.625 -3.243 1.00 0.00 N ATOM 0 H ASN A 54 -3.996 -11.370 -4.991 1.00 0.00 H new ATOM 0 HA ASN A 54 -1.763 -12.334 -6.592 1.00 0.00 H new ATOM 0 HB2 ASN A 54 -3.556 -14.063 -4.826 1.00 0.00 H new ATOM 0 HB3 ASN A 54 -2.606 -14.738 -6.135 1.00 0.00 H new ATOM 0 HD21 ASN A 54 -0.796 -13.649 -2.606 1.00 0.00 H new ATOM 0 HD22 ASN A 54 -2.508 -13.329 -2.905 1.00 0.00 H new ATOM 777 N GLY A 55 -4.705 -11.869 -7.519 1.00 0.00 N ATOM 778 CA GLY A 55 -5.576 -11.858 -8.696 1.00 0.00 C ATOM 779 C GLY A 55 -6.585 -12.992 -8.649 1.00 0.00 C ATOM 780 O GLY A 55 -7.772 -12.757 -8.445 1.00 0.00 O ATOM 0 H GLY A 55 -4.966 -11.181 -6.813 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -6.101 -10.904 -8.753 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -4.971 -11.944 -9.599 1.00 0.00 H new ATOM 784 N GLU A 56 -6.085 -14.215 -8.805 1.00 0.00 N ATOM 785 CA GLU A 56 -6.797 -15.478 -8.725 1.00 0.00 C ATOM 786 C GLU A 56 -7.758 -15.474 -7.534 1.00 0.00 C ATOM 787 O GLU A 56 -8.984 -15.527 -7.668 1.00 0.00 O ATOM 788 CB GLU A 56 -5.721 -16.570 -8.599 1.00 0.00 C ATOM 789 CG GLU A 56 -6.321 -17.961 -8.529 1.00 0.00 C ATOM 790 CD GLU A 56 -6.814 -18.405 -9.899 1.00 0.00 C ATOM 791 OE1 GLU A 56 -5.991 -18.876 -10.717 1.00 0.00 O ATOM 792 OE2 GLU A 56 -8.016 -18.214 -10.181 1.00 0.00 O ATOM 0 H GLU A 56 -5.095 -14.354 -9.006 1.00 0.00 H new ATOM 0 HA GLU A 56 -7.412 -15.656 -9.607 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -5.044 -16.511 -9.451 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -5.124 -16.388 -7.705 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -5.576 -18.665 -8.160 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -7.148 -17.970 -7.819 1.00 0.00 H new ATOM 799 N ASP A 57 -7.164 -15.425 -6.350 1.00 0.00 N ATOM 800 CA ASP A 57 -7.837 -15.495 -5.069 1.00 0.00 C ATOM 801 C ASP A 57 -8.371 -14.105 -4.697 1.00 0.00 C ATOM 802 O ASP A 57 -7.969 -13.527 -3.690 1.00 0.00 O ATOM 803 CB ASP A 57 -6.857 -16.095 -4.035 1.00 0.00 C ATOM 804 CG ASP A 57 -7.291 -17.451 -3.493 1.00 0.00 C ATOM 805 OD1 ASP A 57 -8.501 -17.685 -3.254 1.00 0.00 O ATOM 806 OD2 ASP A 57 -6.390 -18.293 -3.254 1.00 0.00 O ATOM 0 H ASP A 57 -6.153 -15.331 -6.257 1.00 0.00 H new ATOM 0 HA ASP A 57 -8.707 -16.151 -5.100 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -5.874 -16.196 -4.495 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -6.750 -15.399 -3.203 1.00 0.00 H new ATOM 811 N LYS A 58 -9.311 -13.552 -5.470 1.00 0.00 N ATOM 812 CA LYS A 58 -10.157 -12.443 -5.007 1.00 0.00 C ATOM 813 C LYS A 58 -10.710 -12.716 -3.592 1.00 0.00 C ATOM 814 O LYS A 58 -10.428 -11.927 -2.686 1.00 0.00 O ATOM 815 CB LYS A 58 -11.284 -12.125 -6.009 1.00 0.00 C ATOM 816 CG LYS A 58 -10.849 -11.577 -7.373 1.00 0.00 C ATOM 817 CD LYS A 58 -10.346 -10.133 -7.337 1.00 0.00 C ATOM 818 CE LYS A 58 -10.256 -9.585 -8.767 1.00 0.00 C ATOM 819 NZ LYS A 58 -11.576 -9.214 -9.316 1.00 0.00 N ATOM 0 H LYS A 58 -9.507 -13.855 -6.424 1.00 0.00 H new ATOM 0 HA LYS A 58 -9.528 -11.555 -4.948 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -11.861 -13.035 -6.175 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -11.956 -11.401 -5.549 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -10.061 -12.215 -7.774 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -11.691 -11.640 -8.062 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -11.020 -9.517 -6.742 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -9.368 -10.089 -6.858 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -9.604 -8.712 -8.777 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -9.796 -10.334 -9.411 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -11.448 -8.711 -10.217 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -12.140 -10.073 -9.476 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -12.071 -8.596 -8.642 1.00 0.00 H new ATOM 833 N PRO A 59 -11.425 -13.835 -3.347 1.00 0.00 N ATOM 834 CA PRO A 59 -11.878 -14.193 -2.012 1.00 0.00 C ATOM 835 C PRO A 59 -10.695 -14.422 -1.069 1.00 0.00 C ATOM 836 O PRO A 59 -10.650 -13.825 0.011 1.00 0.00 O ATOM 837 CB PRO A 59 -12.749 -15.442 -2.187 1.00 0.00 C ATOM 838 CG PRO A 59 -12.279 -16.056 -3.497 1.00 0.00 C ATOM 839 CD PRO A 59 -11.839 -14.848 -4.305 1.00 0.00 C ATOM 0 HA PRO A 59 -12.454 -13.392 -1.548 1.00 0.00 H new ATOM 0 HB2 PRO A 59 -12.620 -16.135 -1.356 1.00 0.00 H new ATOM 0 HB3 PRO A 59 -13.808 -15.185 -2.227 1.00 0.00 H new ATOM 0 HG2 PRO A 59 -11.459 -16.758 -3.342 1.00 0.00 H new ATOM 0 HG3 PRO A 59 -13.079 -16.605 -3.995 1.00 0.00 H new ATOM 0 HD2 PRO A 59 -11.018 -15.107 -4.974 1.00 0.00 H new ATOM 0 HD3 PRO A 59 -12.654 -14.481 -4.929 1.00 0.00 H new ATOM 847 N GLY A 60 -9.710 -15.231 -1.481 1.00 0.00 N ATOM 848 CA GLY A 60 -8.532 -15.604 -0.700 1.00 0.00 C ATOM 849 C GLY A 60 -7.517 -14.484 -0.577 1.00 0.00 C ATOM 850 O GLY A 60 -6.311 -14.723 -0.578 1.00 0.00 O ATOM 0 H GLY A 60 -9.716 -15.659 -2.407 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -8.848 -15.911 0.297 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -8.056 -16.468 -1.163 1.00 0.00 H new ATOM 854 N PHE A 61 -7.993 -13.258 -0.457 1.00 0.00 N ATOM 855 CA PHE A 61 -7.217 -12.060 -0.297 1.00 0.00 C ATOM 856 C PHE A 61 -7.979 -11.165 0.660 1.00 0.00 C ATOM 857 O PHE A 61 -7.484 -10.851 1.743 1.00 0.00 O ATOM 858 CB PHE A 61 -7.045 -11.416 -1.659 1.00 0.00 C ATOM 859 CG PHE A 61 -6.425 -10.053 -1.624 1.00 0.00 C ATOM 860 CD1 PHE A 61 -5.070 -9.918 -1.283 1.00 0.00 C ATOM 861 CD2 PHE A 61 -7.194 -8.930 -1.974 1.00 0.00 C ATOM 862 CE1 PHE A 61 -4.468 -8.656 -1.352 1.00 0.00 C ATOM 863 CE2 PHE A 61 -6.583 -7.673 -2.042 1.00 0.00 C ATOM 864 CZ PHE A 61 -5.210 -7.548 -1.779 1.00 0.00 C ATOM 0 H PHE A 61 -8.995 -13.070 -0.471 1.00 0.00 H new ATOM 0 HA PHE A 61 -6.223 -12.254 0.107 1.00 0.00 H new ATOM 0 HB2 PHE A 61 -6.429 -12.066 -2.280 1.00 0.00 H new ATOM 0 HB3 PHE A 61 -8.020 -11.346 -2.140 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -4.498 -10.779 -0.971 1.00 0.00 H new ATOM 0 HD2 PHE A 61 -8.247 -9.036 -2.189 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -3.431 -8.537 -1.076 1.00 0.00 H new ATOM 0 HE2 PHE A 61 -7.167 -6.801 -2.296 1.00 0.00 H new ATOM 0 HZ PHE A 61 -4.723 -6.592 -1.907 1.00 0.00 H new ATOM 874 N LEU A 62 -9.235 -10.863 0.314 1.00 0.00 N ATOM 875 CA LEU A 62 -10.161 -10.084 1.131 1.00 0.00 C ATOM 876 C LEU A 62 -10.277 -10.631 2.555 1.00 0.00 C ATOM 877 O LEU A 62 -10.564 -9.847 3.463 1.00 0.00 O ATOM 878 CB LEU A 62 -11.547 -10.035 0.465 1.00 0.00 C ATOM 879 CG LEU A 62 -11.589 -9.221 -0.845 1.00 0.00 C ATOM 880 CD1 LEU A 62 -12.890 -9.515 -1.594 1.00 0.00 C ATOM 881 CD2 LEU A 62 -11.476 -7.710 -0.590 1.00 0.00 C ATOM 0 H LEU A 62 -9.644 -11.165 -0.570 1.00 0.00 H new ATOM 0 HA LEU A 62 -9.758 -9.074 1.203 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -11.875 -11.054 0.258 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -12.261 -9.607 1.169 1.00 0.00 H new ATOM 0 HG LEU A 62 -10.731 -9.523 -1.446 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -12.916 -8.938 -2.519 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -12.943 -10.578 -1.828 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -13.740 -9.238 -0.970 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -11.510 -7.177 -1.540 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -12.305 -7.384 0.039 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -10.533 -7.495 -0.087 1.00 0.00 H new ATOM 893 N LYS A 63 -10.015 -11.929 2.776 1.00 0.00 N ATOM 894 CA LYS A 63 -10.051 -12.564 4.087 1.00 0.00 C ATOM 895 C LYS A 63 -9.058 -11.949 5.061 1.00 0.00 C ATOM 896 O LYS A 63 -9.288 -11.967 6.265 1.00 0.00 O ATOM 897 CB LYS A 63 -9.930 -14.101 3.995 1.00 0.00 C ATOM 898 CG LYS A 63 -8.897 -14.703 3.019 1.00 0.00 C ATOM 899 CD LYS A 63 -7.469 -14.287 3.352 1.00 0.00 C ATOM 900 CE LYS A 63 -6.398 -15.127 2.652 1.00 0.00 C ATOM 901 NZ LYS A 63 -6.327 -16.547 3.048 1.00 0.00 N ATOM 0 H LYS A 63 -9.767 -12.574 2.026 1.00 0.00 H new ATOM 0 HA LYS A 63 -11.038 -12.362 4.503 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -9.700 -14.475 4.993 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -10.910 -14.495 3.725 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -8.970 -15.790 3.042 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -9.136 -14.389 2.003 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -7.333 -13.241 3.078 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -7.323 -14.356 4.430 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -6.572 -15.079 1.577 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -5.426 -14.669 2.839 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -5.527 -17.003 2.564 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -6.193 -16.614 4.077 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -7.211 -17.026 2.782 1.00 0.00 H new ATOM 915 N LYS A 64 -7.947 -11.411 4.559 1.00 0.00 N ATOM 916 CA LYS A 64 -6.927 -10.816 5.399 1.00 0.00 C ATOM 917 C LYS A 64 -7.352 -9.432 5.840 1.00 0.00 C ATOM 918 O LYS A 64 -6.910 -8.973 6.887 1.00 0.00 O ATOM 919 CB LYS A 64 -5.596 -10.751 4.638 1.00 0.00 C ATOM 920 CG LYS A 64 -4.841 -12.091 4.731 1.00 0.00 C ATOM 921 CD LYS A 64 -3.686 -11.993 5.745 1.00 0.00 C ATOM 922 CE LYS A 64 -3.293 -13.323 6.402 1.00 0.00 C ATOM 923 NZ LYS A 64 -2.610 -14.272 5.507 1.00 0.00 N ATOM 0 H LYS A 64 -7.736 -11.379 3.562 1.00 0.00 H new ATOM 0 HA LYS A 64 -6.794 -11.434 6.287 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -5.782 -10.506 3.592 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -4.978 -9.952 5.047 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -5.529 -12.882 5.030 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -4.449 -12.363 3.751 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -2.812 -11.581 5.241 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -3.966 -11.286 6.526 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -2.644 -13.115 7.252 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -4.192 -13.798 6.796 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -2.381 -15.141 6.031 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -3.233 -14.504 4.707 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -1.733 -13.842 5.150 1.00 0.00 H new ATOM 937 N LEU A 65 -8.173 -8.747 5.044 1.00 0.00 N ATOM 938 CA LEU A 65 -8.619 -7.409 5.374 1.00 0.00 C ATOM 939 C LEU A 65 -9.654 -7.481 6.498 1.00 0.00 C ATOM 940 O LEU A 65 -9.590 -6.649 7.395 1.00 0.00 O ATOM 941 CB LEU A 65 -9.128 -6.675 4.121 1.00 0.00 C ATOM 942 CG LEU A 65 -7.986 -6.202 3.187 1.00 0.00 C ATOM 943 CD1 LEU A 65 -7.461 -7.272 2.217 1.00 0.00 C ATOM 944 CD2 LEU A 65 -8.461 -4.995 2.373 1.00 0.00 C ATOM 0 H LEU A 65 -8.540 -9.106 4.163 1.00 0.00 H new ATOM 0 HA LEU A 65 -7.781 -6.817 5.742 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -9.793 -7.336 3.565 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -9.719 -5.812 4.428 1.00 0.00 H new ATOM 0 HG LEU A 65 -7.155 -5.951 3.846 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -6.665 -6.849 1.605 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -7.072 -8.118 2.784 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -8.273 -7.609 1.573 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -7.658 -4.661 1.715 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -9.327 -5.278 1.774 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -8.736 -4.186 3.049 1.00 0.00 H new ATOM 956 N SER A 66 -10.524 -8.498 6.537 1.00 0.00 N ATOM 957 CA SER A 66 -11.670 -8.572 7.445 1.00 0.00 C ATOM 958 C SER A 66 -11.342 -8.632 8.944 1.00 0.00 C ATOM 959 O SER A 66 -12.260 -8.728 9.754 1.00 0.00 O ATOM 960 CB SER A 66 -12.498 -9.814 7.096 1.00 0.00 C ATOM 961 OG SER A 66 -12.552 -10.068 5.705 1.00 0.00 O ATOM 0 H SER A 66 -10.447 -9.309 5.923 1.00 0.00 H new ATOM 0 HA SER A 66 -12.205 -7.635 7.294 1.00 0.00 H new ATOM 0 HB2 SER A 66 -12.074 -10.681 7.602 1.00 0.00 H new ATOM 0 HB3 SER A 66 -13.512 -9.687 7.476 1.00 0.00 H new ATOM 0 HG SER A 66 -13.090 -10.870 5.540 1.00 0.00 H new ATOM 967 N LEU A 67 -10.066 -8.648 9.330 1.00 0.00 N ATOM 968 CA LEU A 67 -9.596 -8.631 10.712 1.00 0.00 C ATOM 969 C LEU A 67 -8.362 -7.735 10.888 1.00 0.00 C ATOM 970 O LEU A 67 -7.627 -7.881 11.865 1.00 0.00 O ATOM 971 CB LEU A 67 -9.346 -10.064 11.203 1.00 0.00 C ATOM 972 CG LEU A 67 -8.105 -10.767 10.622 1.00 0.00 C ATOM 973 CD1 LEU A 67 -7.785 -11.979 11.490 1.00 0.00 C ATOM 974 CD2 LEU A 67 -8.260 -11.214 9.165 1.00 0.00 C ATOM 0 H LEU A 67 -9.300 -8.674 8.657 1.00 0.00 H new ATOM 0 HA LEU A 67 -10.378 -8.193 11.333 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -9.254 -10.044 12.289 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -10.224 -10.666 10.969 1.00 0.00 H new ATOM 0 HG LEU A 67 -7.296 -10.036 10.627 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -6.908 -12.490 11.093 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -7.584 -11.653 12.510 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -8.634 -12.662 11.488 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -7.342 -11.700 8.834 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -9.090 -11.916 9.086 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -8.458 -10.345 8.537 1.00 0.00 H new ATOM 986 N LYS A 68 -8.080 -6.868 9.912 1.00 0.00 N ATOM 987 CA LYS A 68 -6.940 -5.961 9.897 1.00 0.00 C ATOM 988 C LYS A 68 -7.358 -4.497 10.035 1.00 0.00 C ATOM 989 O LYS A 68 -6.490 -3.656 10.258 1.00 0.00 O ATOM 990 CB LYS A 68 -6.169 -6.163 8.583 1.00 0.00 C ATOM 991 CG LYS A 68 -4.917 -7.038 8.691 1.00 0.00 C ATOM 992 CD LYS A 68 -5.043 -8.359 9.460 1.00 0.00 C ATOM 993 CE LYS A 68 -3.833 -9.221 9.074 1.00 0.00 C ATOM 994 NZ LYS A 68 -3.680 -10.437 9.896 1.00 0.00 N ATOM 0 H LYS A 68 -8.665 -6.779 9.081 1.00 0.00 H new ATOM 0 HA LYS A 68 -6.309 -6.193 10.755 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -6.842 -6.608 7.850 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -5.878 -5.186 8.197 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -4.578 -7.267 7.681 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -4.133 -6.447 9.164 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -5.061 -8.179 10.535 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -5.974 -8.866 9.206 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -3.925 -9.511 8.027 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -2.928 -8.619 9.160 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -2.844 -10.968 9.578 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -3.561 -10.169 10.894 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -4.527 -11.032 9.796 1.00 0.00 H new ATOM 1008 N PHE A 69 -8.636 -4.160 9.868 1.00 0.00 N ATOM 1009 CA PHE A 69 -9.127 -2.780 9.867 1.00 0.00 C ATOM 1010 C PHE A 69 -10.140 -2.590 10.989 1.00 0.00 C ATOM 1011 O PHE A 69 -10.569 -3.584 11.589 1.00 0.00 O ATOM 1012 CB PHE A 69 -9.734 -2.465 8.496 1.00 0.00 C ATOM 1013 CG PHE A 69 -8.701 -2.445 7.392 1.00 0.00 C ATOM 1014 CD1 PHE A 69 -8.156 -3.635 6.880 1.00 0.00 C ATOM 1015 CD2 PHE A 69 -8.285 -1.215 6.872 1.00 0.00 C ATOM 1016 CE1 PHE A 69 -7.204 -3.599 5.853 1.00 0.00 C ATOM 1017 CE2 PHE A 69 -7.382 -1.177 5.799 1.00 0.00 C ATOM 1018 CZ PHE A 69 -6.838 -2.367 5.297 1.00 0.00 C ATOM 0 H PHE A 69 -9.374 -4.850 9.727 1.00 0.00 H new ATOM 0 HA PHE A 69 -8.305 -2.087 10.046 1.00 0.00 H new ATOM 0 HB2 PHE A 69 -10.496 -3.208 8.261 1.00 0.00 H new ATOM 0 HB3 PHE A 69 -10.234 -1.497 8.538 1.00 0.00 H new ATOM 0 HD1 PHE A 69 -8.474 -4.586 7.282 1.00 0.00 H new ATOM 0 HD2 PHE A 69 -8.659 -0.295 7.296 1.00 0.00 H new ATOM 0 HE1 PHE A 69 -6.756 -4.514 5.493 1.00 0.00 H new ATOM 0 HE2 PHE A 69 -7.106 -0.230 5.359 1.00 0.00 H new ATOM 0 HZ PHE A 69 -6.134 -2.334 4.479 1.00 0.00 H new ATOM 1028 N LYS A 70 -10.515 -1.342 11.292 1.00 0.00 N ATOM 1029 CA LYS A 70 -11.473 -1.055 12.362 1.00 0.00 C ATOM 1030 C LYS A 70 -12.808 -0.570 11.842 1.00 0.00 C ATOM 1031 O LYS A 70 -13.835 -1.030 12.333 1.00 0.00 O ATOM 1032 CB LYS A 70 -10.970 -0.259 13.564 1.00 0.00 C ATOM 1033 CG LYS A 70 -9.875 0.745 13.300 1.00 0.00 C ATOM 1034 CD LYS A 70 -10.349 2.104 12.744 1.00 0.00 C ATOM 1035 CE LYS A 70 -9.234 3.153 12.880 1.00 0.00 C ATOM 1036 NZ LYS A 70 -9.497 4.390 12.116 1.00 0.00 N ATOM 0 H LYS A 70 -10.168 -0.514 10.809 1.00 0.00 H new ATOM 0 HA LYS A 70 -11.627 -2.041 12.800 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -11.817 0.269 14.002 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -10.612 -0.964 14.314 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -9.333 0.920 14.229 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -9.167 0.309 12.595 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -10.632 1.998 11.697 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -11.237 2.435 13.282 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -9.108 3.405 13.933 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -8.293 2.719 12.542 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -8.709 5.055 12.250 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -9.589 4.161 11.106 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -10.379 4.826 12.454 1.00 0.00 H new ATOM 1050 N ASP A 71 -12.785 0.311 10.851 1.00 0.00 N ATOM 1051 CA ASP A 71 -13.966 0.944 10.276 1.00 0.00 C ATOM 1052 C ASP A 71 -13.814 0.914 8.760 1.00 0.00 C ATOM 1053 O ASP A 71 -13.460 1.930 8.160 1.00 0.00 O ATOM 1054 CB ASP A 71 -14.103 2.361 10.856 1.00 0.00 C ATOM 1055 CG ASP A 71 -15.263 3.153 10.249 1.00 0.00 C ATOM 1056 OD1 ASP A 71 -16.086 2.571 9.511 1.00 0.00 O ATOM 1057 OD2 ASP A 71 -15.331 4.375 10.496 1.00 0.00 O ATOM 0 H ASP A 71 -11.917 0.615 10.411 1.00 0.00 H new ATOM 0 HA ASP A 71 -14.887 0.418 10.527 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -14.244 2.293 11.935 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -13.174 2.906 10.690 1.00 0.00 H new ATOM 1062 N PRO A 72 -13.943 -0.262 8.119 1.00 0.00 N ATOM 1063 CA PRO A 72 -13.653 -0.388 6.700 1.00 0.00 C ATOM 1064 C PRO A 72 -14.666 0.411 5.878 1.00 0.00 C ATOM 1065 O PRO A 72 -14.265 1.099 4.938 1.00 0.00 O ATOM 1066 CB PRO A 72 -13.663 -1.885 6.401 1.00 0.00 C ATOM 1067 CG PRO A 72 -14.613 -2.440 7.445 1.00 0.00 C ATOM 1068 CD PRO A 72 -14.355 -1.550 8.670 1.00 0.00 C ATOM 0 HA PRO A 72 -12.683 0.027 6.429 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -14.012 -2.091 5.389 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -12.668 -2.320 6.490 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -15.651 -2.380 7.116 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -14.406 -3.489 7.659 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -15.252 -1.449 9.281 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -13.580 -1.973 9.309 1.00 0.00 H new ATOM 1076 N GLU A 73 -15.948 0.366 6.260 1.00 0.00 N ATOM 1077 CA GLU A 73 -17.075 1.011 5.586 1.00 0.00 C ATOM 1078 C GLU A 73 -16.907 2.525 5.425 1.00 0.00 C ATOM 1079 O GLU A 73 -17.562 3.091 4.556 1.00 0.00 O ATOM 1080 CB GLU A 73 -18.393 0.701 6.323 1.00 0.00 C ATOM 1081 CG GLU A 73 -18.345 1.142 7.794 1.00 0.00 C ATOM 1082 CD GLU A 73 -19.714 1.391 8.422 1.00 0.00 C ATOM 1083 OE1 GLU A 73 -20.320 2.464 8.188 1.00 0.00 O ATOM 1084 OE2 GLU A 73 -20.189 0.529 9.200 1.00 0.00 O ATOM 0 H GLU A 73 -16.239 -0.149 7.091 1.00 0.00 H new ATOM 0 HA GLU A 73 -17.105 0.593 4.580 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -19.218 1.206 5.820 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -18.595 -0.369 6.271 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -17.827 0.378 8.373 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -17.753 2.054 7.868 1.00 0.00 H new ATOM 1091 N ASN A 74 -16.011 3.168 6.189 1.00 0.00 N ATOM 1092 CA ASN A 74 -15.667 4.584 6.043 1.00 0.00 C ATOM 1093 C ASN A 74 -14.188 4.779 5.695 1.00 0.00 C ATOM 1094 O ASN A 74 -13.811 5.844 5.210 1.00 0.00 O ATOM 1095 CB ASN A 74 -15.991 5.363 7.322 1.00 0.00 C ATOM 1096 CG ASN A 74 -17.475 5.346 7.657 1.00 0.00 C ATOM 1097 OD1 ASN A 74 -18.244 6.115 7.093 1.00 0.00 O ATOM 1098 ND2 ASN A 74 -17.911 4.497 8.572 1.00 0.00 N ATOM 0 H ASN A 74 -15.497 2.706 6.939 1.00 0.00 H new ATOM 0 HA ASN A 74 -16.270 4.969 5.221 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -15.430 4.938 8.154 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -15.660 6.395 7.208 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -18.901 4.476 8.818 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -17.258 3.863 9.032 1.00 0.00 H new ATOM 1105 N THR A 75 -13.330 3.786 5.940 1.00 0.00 N ATOM 1106 CA THR A 75 -11.903 3.872 5.672 1.00 0.00 C ATOM 1107 C THR A 75 -11.657 4.111 4.180 1.00 0.00 C ATOM 1108 O THR A 75 -12.146 3.368 3.320 1.00 0.00 O ATOM 1109 CB THR A 75 -11.206 2.608 6.208 1.00 0.00 C ATOM 1110 OG1 THR A 75 -11.066 2.714 7.610 1.00 0.00 O ATOM 1111 CG2 THR A 75 -9.817 2.329 5.621 1.00 0.00 C ATOM 0 H THR A 75 -13.616 2.890 6.335 1.00 0.00 H new ATOM 0 HA THR A 75 -11.469 4.725 6.193 1.00 0.00 H new ATOM 0 HB THR A 75 -11.846 1.780 5.905 1.00 0.00 H new ATOM 0 HG1 THR A 75 -11.927 2.528 8.040 1.00 0.00 H new ATOM 0 HG21 THR A 75 -9.412 1.419 6.062 1.00 0.00 H new ATOM 0 HG22 THR A 75 -9.897 2.204 4.541 1.00 0.00 H new ATOM 0 HG23 THR A 75 -9.154 3.166 5.842 1.00 0.00 H new ATOM 1119 N THR A 76 -10.844 5.125 3.885 1.00 0.00 N ATOM 1120 CA THR A 76 -10.283 5.344 2.562 1.00 0.00 C ATOM 1121 C THR A 76 -8.973 4.555 2.502 1.00 0.00 C ATOM 1122 O THR A 76 -7.962 4.973 3.072 1.00 0.00 O ATOM 1123 CB THR A 76 -10.089 6.844 2.297 1.00 0.00 C ATOM 1124 OG1 THR A 76 -11.236 7.575 2.700 1.00 0.00 O ATOM 1125 CG2 THR A 76 -9.840 7.130 0.814 1.00 0.00 C ATOM 0 H THR A 76 -10.556 5.823 4.570 1.00 0.00 H new ATOM 0 HA THR A 76 -10.954 4.995 1.777 1.00 0.00 H new ATOM 0 HB THR A 76 -9.218 7.154 2.875 1.00 0.00 H new ATOM 0 HG1 THR A 76 -11.094 8.529 2.525 1.00 0.00 H new ATOM 0 HG21 THR A 76 -9.708 8.202 0.667 1.00 0.00 H new ATOM 0 HG22 THR A 76 -8.942 6.606 0.488 1.00 0.00 H new ATOM 0 HG23 THR A 76 -10.693 6.786 0.229 1.00 0.00 H new ATOM 1133 N LEU A 77 -8.986 3.356 1.918 1.00 0.00 N ATOM 1134 CA LEU A 77 -7.755 2.603 1.757 1.00 0.00 C ATOM 1135 C LEU A 77 -6.891 3.290 0.701 1.00 0.00 C ATOM 1136 O LEU A 77 -7.407 3.877 -0.252 1.00 0.00 O ATOM 1137 CB LEU A 77 -8.031 1.131 1.369 1.00 0.00 C ATOM 1138 CG LEU A 77 -7.400 0.122 2.339 1.00 0.00 C ATOM 1139 CD1 LEU A 77 -7.620 -1.304 1.814 1.00 0.00 C ATOM 1140 CD2 LEU A 77 -5.898 0.355 2.556 1.00 0.00 C ATOM 0 H LEU A 77 -9.822 2.897 1.557 1.00 0.00 H new ATOM 0 HA LEU A 77 -7.227 2.584 2.710 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -9.108 0.967 1.334 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -7.648 0.949 0.365 1.00 0.00 H new ATOM 0 HG LEU A 77 -7.891 0.261 3.302 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -7.171 -2.019 2.504 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -8.689 -1.501 1.732 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -7.156 -1.406 0.833 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -5.511 -0.390 3.251 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -5.375 0.269 1.604 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -5.740 1.352 2.968 1.00 0.00 H new ATOM 1152 N TYR A 78 -5.581 3.087 0.779 1.00 0.00 N ATOM 1153 CA TYR A 78 -4.604 3.430 -0.240 1.00 0.00 C ATOM 1154 C TYR A 78 -3.771 2.165 -0.439 1.00 0.00 C ATOM 1155 O TYR A 78 -2.986 1.809 0.436 1.00 0.00 O ATOM 1156 CB TYR A 78 -3.776 4.643 0.227 1.00 0.00 C ATOM 1157 CG TYR A 78 -4.564 5.943 0.283 1.00 0.00 C ATOM 1158 CD1 TYR A 78 -5.376 6.226 1.397 1.00 0.00 C ATOM 1159 CD2 TYR A 78 -4.526 6.850 -0.794 1.00 0.00 C ATOM 1160 CE1 TYR A 78 -6.190 7.370 1.419 1.00 0.00 C ATOM 1161 CE2 TYR A 78 -5.314 8.017 -0.765 1.00 0.00 C ATOM 1162 CZ TYR A 78 -6.181 8.259 0.325 1.00 0.00 C ATOM 1163 OH TYR A 78 -7.024 9.330 0.321 1.00 0.00 O ATOM 0 H TYR A 78 -5.153 2.656 1.598 1.00 0.00 H new ATOM 0 HA TYR A 78 -5.049 3.731 -1.189 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -3.369 4.433 1.216 1.00 0.00 H new ATOM 0 HB3 TYR A 78 -2.928 4.772 -0.446 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -5.373 5.556 2.244 1.00 0.00 H new ATOM 0 HD2 TYR A 78 -3.891 6.650 -1.644 1.00 0.00 H new ATOM 0 HE1 TYR A 78 -6.822 7.568 2.272 1.00 0.00 H new ATOM 0 HE2 TYR A 78 -5.256 8.728 -1.576 1.00 0.00 H new ATOM 0 HH TYR A 78 -6.894 9.845 -0.502 1.00 0.00 H new ATOM 1173 N ILE A 79 -3.947 1.423 -1.535 1.00 0.00 N ATOM 1174 CA ILE A 79 -3.049 0.297 -1.810 1.00 0.00 C ATOM 1175 C ILE A 79 -1.653 0.841 -2.120 1.00 0.00 C ATOM 1176 O ILE A 79 -1.538 2.006 -2.505 1.00 0.00 O ATOM 1177 CB ILE A 79 -3.686 -0.540 -2.934 1.00 0.00 C ATOM 1178 CG1 ILE A 79 -4.957 -1.186 -2.324 1.00 0.00 C ATOM 1179 CG2 ILE A 79 -2.801 -1.644 -3.510 1.00 0.00 C ATOM 1180 CD1 ILE A 79 -6.173 -0.850 -3.160 1.00 0.00 C ATOM 0 H ILE A 79 -4.680 1.573 -2.228 1.00 0.00 H new ATOM 0 HA ILE A 79 -2.919 -0.367 -0.956 1.00 0.00 H new ATOM 0 HB ILE A 79 -3.881 0.129 -3.772 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -4.833 -2.268 -2.270 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -5.100 -0.830 -1.304 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -3.343 -2.173 -4.294 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -1.896 -1.204 -3.929 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -2.532 -2.344 -2.719 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -7.057 -1.311 -2.719 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -6.305 0.231 -3.192 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -6.034 -1.228 -4.173 1.00 0.00 H new ATOM 1192 N LEU A 80 -0.606 0.014 -2.056 1.00 0.00 N ATOM 1193 CA LEU A 80 0.760 0.356 -2.457 1.00 0.00 C ATOM 1194 C LEU A 80 1.403 -0.893 -3.077 1.00 0.00 C ATOM 1195 O LEU A 80 1.742 -1.824 -2.339 1.00 0.00 O ATOM 1196 CB LEU A 80 1.513 0.881 -1.218 1.00 0.00 C ATOM 1197 CG LEU A 80 2.723 1.802 -1.469 1.00 0.00 C ATOM 1198 CD1 LEU A 80 3.494 2.051 -0.168 1.00 0.00 C ATOM 1199 CD2 LEU A 80 3.703 1.303 -2.518 1.00 0.00 C ATOM 0 H LEU A 80 -0.689 -0.943 -1.712 1.00 0.00 H new ATOM 0 HA LEU A 80 0.789 1.145 -3.209 1.00 0.00 H new ATOM 0 HB2 LEU A 80 0.801 1.421 -0.593 1.00 0.00 H new ATOM 0 HB3 LEU A 80 1.856 0.022 -0.641 1.00 0.00 H new ATOM 0 HG LEU A 80 2.286 2.722 -1.856 1.00 0.00 H new ATOM 0 HD11 LEU A 80 4.344 2.703 -0.368 1.00 0.00 H new ATOM 0 HD12 LEU A 80 2.836 2.525 0.560 1.00 0.00 H new ATOM 0 HD13 LEU A 80 3.851 1.102 0.231 1.00 0.00 H new ATOM 0 HD21 LEU A 80 4.519 2.018 -2.623 1.00 0.00 H new ATOM 0 HD22 LEU A 80 4.104 0.337 -2.211 1.00 0.00 H new ATOM 0 HD23 LEU A 80 3.190 1.195 -3.473 1.00 0.00 H new ATOM 1211 N ASP A 81 1.491 -0.943 -4.413 1.00 0.00 N ATOM 1212 CA ASP A 81 2.176 -1.993 -5.197 1.00 0.00 C ATOM 1213 C ASP A 81 3.689 -1.702 -5.278 1.00 0.00 C ATOM 1214 O ASP A 81 4.171 -0.762 -4.657 1.00 0.00 O ATOM 1215 CB ASP A 81 1.543 -2.111 -6.601 1.00 0.00 C ATOM 1216 CG ASP A 81 1.631 -3.512 -7.204 1.00 0.00 C ATOM 1217 OD1 ASP A 81 2.750 -4.017 -7.424 1.00 0.00 O ATOM 1218 OD2 ASP A 81 0.568 -4.101 -7.504 1.00 0.00 O ATOM 0 H ASP A 81 1.072 -0.227 -5.006 1.00 0.00 H new ATOM 0 HA ASP A 81 2.051 -2.952 -4.694 1.00 0.00 H new ATOM 0 HB2 ASP A 81 0.495 -1.817 -6.542 1.00 0.00 H new ATOM 0 HB3 ASP A 81 2.035 -1.406 -7.271 1.00 0.00 H new ATOM 1223 N LYS A 82 4.481 -2.527 -5.965 1.00 0.00 N ATOM 1224 CA LYS A 82 5.939 -2.420 -6.064 1.00 0.00 C ATOM 1225 C LYS A 82 6.308 -1.546 -7.231 1.00 0.00 C ATOM 1226 O LYS A 82 6.753 -0.433 -6.996 1.00 0.00 O ATOM 1227 CB LYS A 82 6.627 -3.797 -6.093 1.00 0.00 C ATOM 1228 CG LYS A 82 5.923 -4.980 -6.779 1.00 0.00 C ATOM 1229 CD LYS A 82 6.470 -6.332 -6.295 1.00 0.00 C ATOM 1230 CE LYS A 82 7.967 -6.517 -6.560 1.00 0.00 C ATOM 1231 NZ LYS A 82 8.260 -6.796 -7.974 1.00 0.00 N ATOM 0 H LYS A 82 4.110 -3.320 -6.489 1.00 0.00 H new ATOM 0 HA LYS A 82 6.315 -1.940 -5.161 1.00 0.00 H new ATOM 0 HB2 LYS A 82 7.596 -3.668 -6.576 1.00 0.00 H new ATOM 0 HB3 LYS A 82 6.822 -4.087 -5.060 1.00 0.00 H new ATOM 0 HG2 LYS A 82 4.852 -4.930 -6.581 1.00 0.00 H new ATOM 0 HG3 LYS A 82 6.051 -4.902 -7.859 1.00 0.00 H new ATOM 0 HD2 LYS A 82 6.284 -6.428 -5.225 1.00 0.00 H new ATOM 0 HD3 LYS A 82 5.920 -7.134 -6.787 1.00 0.00 H new ATOM 0 HE2 LYS A 82 8.501 -5.618 -6.253 1.00 0.00 H new ATOM 0 HE3 LYS A 82 8.343 -7.336 -5.946 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 9.286 -6.913 -8.099 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 7.774 -7.669 -8.264 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 7.927 -6.004 -8.560 1.00 0.00 H new ATOM 1245 N PHE A 83 6.129 -2.036 -8.445 1.00 0.00 N ATOM 1246 CA PHE A 83 6.463 -1.267 -9.641 1.00 0.00 C ATOM 1247 C PHE A 83 5.178 -0.865 -10.355 1.00 0.00 C ATOM 1248 O PHE A 83 4.737 0.277 -10.239 1.00 0.00 O ATOM 1249 CB PHE A 83 7.462 -2.033 -10.522 1.00 0.00 C ATOM 1250 CG PHE A 83 8.622 -1.207 -11.029 1.00 0.00 C ATOM 1251 CD1 PHE A 83 8.474 -0.417 -12.183 1.00 0.00 C ATOM 1252 CD2 PHE A 83 9.868 -1.271 -10.376 1.00 0.00 C ATOM 1253 CE1 PHE A 83 9.574 0.295 -12.690 1.00 0.00 C ATOM 1254 CE2 PHE A 83 10.963 -0.552 -10.880 1.00 0.00 C ATOM 1255 CZ PHE A 83 10.818 0.221 -12.043 1.00 0.00 C ATOM 0 H PHE A 83 5.753 -2.965 -8.634 1.00 0.00 H new ATOM 0 HA PHE A 83 6.975 -0.343 -9.370 1.00 0.00 H new ATOM 0 HB2 PHE A 83 7.855 -2.876 -9.953 1.00 0.00 H new ATOM 0 HB3 PHE A 83 6.928 -2.447 -11.377 1.00 0.00 H new ATOM 0 HD1 PHE A 83 7.516 -0.358 -12.679 1.00 0.00 H new ATOM 0 HD2 PHE A 83 9.981 -1.874 -9.487 1.00 0.00 H new ATOM 0 HE1 PHE A 83 9.463 0.900 -13.578 1.00 0.00 H new ATOM 0 HE2 PHE A 83 11.916 -0.593 -10.374 1.00 0.00 H new ATOM 0 HZ PHE A 83 11.665 0.760 -12.441 1.00 0.00 H new ATOM 1265 N ASP A 84 4.560 -1.786 -11.091 1.00 0.00 N ATOM 1266 CA ASP A 84 3.463 -1.486 -12.001 1.00 0.00 C ATOM 1267 C ASP A 84 2.232 -2.154 -11.425 1.00 0.00 C ATOM 1268 O ASP A 84 1.368 -1.484 -10.852 1.00 0.00 O ATOM 1269 CB ASP A 84 3.760 -2.008 -13.409 1.00 0.00 C ATOM 1270 CG ASP A 84 4.946 -1.330 -14.090 1.00 0.00 C ATOM 1271 OD1 ASP A 84 5.102 -0.088 -14.017 1.00 0.00 O ATOM 1272 OD2 ASP A 84 5.692 -2.022 -14.810 1.00 0.00 O ATOM 0 H ASP A 84 4.812 -2.774 -11.070 1.00 0.00 H new ATOM 0 HA ASP A 84 3.317 -0.410 -12.094 1.00 0.00 H new ATOM 0 HB2 ASP A 84 3.951 -3.080 -13.354 1.00 0.00 H new ATOM 0 HB3 ASP A 84 2.874 -1.873 -14.029 1.00 0.00 H new ATOM 1277 N GLY A 85 2.211 -3.484 -11.493 1.00 0.00 N ATOM 1278 CA GLY A 85 1.381 -4.309 -10.659 1.00 0.00 C ATOM 1279 C GLY A 85 -0.094 -4.190 -10.987 1.00 0.00 C ATOM 1280 O GLY A 85 -0.513 -4.200 -12.146 1.00 0.00 O ATOM 0 H GLY A 85 2.787 -4.015 -12.146 1.00 0.00 H new ATOM 0 HA2 GLY A 85 1.688 -5.349 -10.766 1.00 0.00 H new ATOM 0 HA3 GLY A 85 1.539 -4.036 -9.616 1.00 0.00 H new ATOM 1284 N ASN A 86 -0.884 -4.201 -9.928 1.00 0.00 N ATOM 1285 CA ASN A 86 -2.335 -4.356 -9.936 1.00 0.00 C ATOM 1286 C ASN A 86 -2.996 -3.454 -8.896 1.00 0.00 C ATOM 1287 O ASN A 86 -4.172 -3.640 -8.596 1.00 0.00 O ATOM 1288 CB ASN A 86 -2.712 -5.821 -9.657 1.00 0.00 C ATOM 1289 CG ASN A 86 -2.323 -6.800 -10.750 1.00 0.00 C ATOM 1290 OD1 ASN A 86 -1.597 -7.755 -10.499 1.00 0.00 O ATOM 1291 ND2 ASN A 86 -2.791 -6.621 -11.972 1.00 0.00 N ATOM 0 H ASN A 86 -0.513 -4.096 -8.984 1.00 0.00 H new ATOM 0 HA ASN A 86 -2.695 -4.065 -10.923 1.00 0.00 H new ATOM 0 HB2 ASN A 86 -2.239 -6.132 -8.726 1.00 0.00 H new ATOM 0 HB3 ASN A 86 -3.789 -5.881 -9.502 1.00 0.00 H new ATOM 0 HD21 ASN A 86 -2.549 -7.279 -12.712 1.00 0.00 H new ATOM 0 HD22 ASN A 86 -3.395 -5.824 -12.175 1.00 0.00 H new ATOM 1298 N SER A 87 -2.264 -2.500 -8.326 1.00 0.00 N ATOM 1299 CA SER A 87 -2.731 -1.467 -7.413 1.00 0.00 C ATOM 1300 C SER A 87 -4.134 -0.971 -7.758 1.00 0.00 C ATOM 1301 O SER A 87 -5.026 -1.007 -6.914 1.00 0.00 O ATOM 1302 CB SER A 87 -1.725 -0.306 -7.444 1.00 0.00 C ATOM 1303 OG SER A 87 -1.084 -0.200 -8.708 1.00 0.00 O ATOM 0 H SER A 87 -1.262 -2.426 -8.503 1.00 0.00 H new ATOM 0 HA SER A 87 -2.796 -1.892 -6.411 1.00 0.00 H new ATOM 0 HB2 SER A 87 -2.240 0.628 -7.217 1.00 0.00 H new ATOM 0 HB3 SER A 87 -0.975 -0.453 -6.667 1.00 0.00 H new ATOM 0 HG SER A 87 -0.453 0.549 -8.693 1.00 0.00 H new ATOM 1309 N GLU A 88 -4.322 -0.509 -8.992 1.00 0.00 N ATOM 1310 CA GLU A 88 -5.540 0.137 -9.474 1.00 0.00 C ATOM 1311 C GLU A 88 -6.695 -0.865 -9.608 1.00 0.00 C ATOM 1312 O GLU A 88 -7.858 -0.470 -9.658 1.00 0.00 O ATOM 1313 CB GLU A 88 -5.223 0.801 -10.822 1.00 0.00 C ATOM 1314 CG GLU A 88 -4.221 1.963 -10.664 1.00 0.00 C ATOM 1315 CD GLU A 88 -3.436 2.251 -11.943 1.00 0.00 C ATOM 1316 OE1 GLU A 88 -2.740 1.329 -12.432 1.00 0.00 O ATOM 1317 OE2 GLU A 88 -3.491 3.394 -12.455 1.00 0.00 O ATOM 0 H GLU A 88 -3.602 -0.577 -9.711 1.00 0.00 H new ATOM 0 HA GLU A 88 -5.866 0.888 -8.754 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -4.814 0.058 -11.506 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -6.144 1.173 -11.270 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -4.760 2.862 -10.364 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -3.523 1.727 -9.861 1.00 0.00 H new ATOM 1324 N LEU A 89 -6.388 -2.162 -9.673 1.00 0.00 N ATOM 1325 CA LEU A 89 -7.348 -3.256 -9.740 1.00 0.00 C ATOM 1326 C LEU A 89 -7.878 -3.536 -8.331 1.00 0.00 C ATOM 1327 O LEU A 89 -9.086 -3.611 -8.106 1.00 0.00 O ATOM 1328 CB LEU A 89 -6.638 -4.484 -10.353 1.00 0.00 C ATOM 1329 CG LEU A 89 -7.525 -5.532 -11.038 1.00 0.00 C ATOM 1330 CD1 LEU A 89 -8.537 -6.167 -10.088 1.00 0.00 C ATOM 1331 CD2 LEU A 89 -8.238 -4.947 -12.264 1.00 0.00 C ATOM 0 H LEU A 89 -5.422 -2.488 -9.680 1.00 0.00 H new ATOM 0 HA LEU A 89 -8.202 -3.005 -10.370 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -5.912 -4.126 -11.083 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -6.077 -4.981 -9.562 1.00 0.00 H new ATOM 0 HG LEU A 89 -6.853 -6.324 -11.368 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -9.135 -6.900 -10.630 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -8.010 -6.661 -9.272 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -9.190 -5.394 -9.682 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -8.858 -5.716 -12.726 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -8.866 -4.111 -11.955 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -7.497 -4.598 -12.983 1.00 0.00 H new ATOM 1343 N VAL A 90 -6.979 -3.652 -7.352 1.00 0.00 N ATOM 1344 CA VAL A 90 -7.339 -3.766 -5.941 1.00 0.00 C ATOM 1345 C VAL A 90 -8.111 -2.502 -5.511 1.00 0.00 C ATOM 1346 O VAL A 90 -9.079 -2.603 -4.745 1.00 0.00 O ATOM 1347 CB VAL A 90 -6.053 -3.996 -5.109 1.00 0.00 C ATOM 1348 CG1 VAL A 90 -6.397 -4.295 -3.642 1.00 0.00 C ATOM 1349 CG2 VAL A 90 -5.168 -5.123 -5.667 1.00 0.00 C ATOM 0 H VAL A 90 -5.973 -3.669 -7.519 1.00 0.00 H new ATOM 0 HA VAL A 90 -7.995 -4.619 -5.770 1.00 0.00 H new ATOM 0 HB VAL A 90 -5.483 -3.069 -5.174 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -5.478 -4.453 -3.078 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -6.943 -3.453 -3.217 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -7.014 -5.192 -3.589 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -4.283 -5.235 -5.040 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -5.729 -6.057 -5.673 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -4.863 -4.877 -6.684 1.00 0.00 H new ATOM 1359 N ALA A 91 -7.737 -1.323 -6.032 1.00 0.00 N ATOM 1360 CA ALA A 91 -8.320 -0.030 -5.681 1.00 0.00 C ATOM 1361 C ALA A 91 -9.782 0.096 -6.148 1.00 0.00 C ATOM 1362 O ALA A 91 -10.450 1.054 -5.758 1.00 0.00 O ATOM 1363 CB ALA A 91 -7.486 1.104 -6.280 1.00 0.00 C ATOM 0 H ALA A 91 -6.997 -1.247 -6.730 1.00 0.00 H new ATOM 0 HA ALA A 91 -8.314 0.042 -4.593 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -7.930 2.063 -6.012 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -6.469 1.053 -5.890 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -7.464 1.005 -7.365 1.00 0.00 H new ATOM 1369 N GLU A 92 -10.303 -0.847 -6.944 1.00 0.00 N ATOM 1370 CA GLU A 92 -11.711 -0.924 -7.340 1.00 0.00 C ATOM 1371 C GLU A 92 -12.389 -2.193 -6.809 1.00 0.00 C ATOM 1372 O GLU A 92 -13.493 -2.523 -7.238 1.00 0.00 O ATOM 1373 CB GLU A 92 -11.877 -0.794 -8.863 1.00 0.00 C ATOM 1374 CG GLU A 92 -11.398 -2.024 -9.669 1.00 0.00 C ATOM 1375 CD GLU A 92 -12.278 -2.341 -10.883 1.00 0.00 C ATOM 1376 OE1 GLU A 92 -12.955 -1.433 -11.428 1.00 0.00 O ATOM 1377 OE2 GLU A 92 -12.322 -3.510 -11.323 1.00 0.00 O ATOM 0 H GLU A 92 -9.738 -1.598 -7.340 1.00 0.00 H new ATOM 0 HA GLU A 92 -12.217 -0.075 -6.880 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -12.929 -0.616 -9.087 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -11.326 0.083 -9.202 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -10.376 -1.852 -10.006 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -11.374 -2.893 -9.011 1.00 0.00 H new ATOM 1384 N LEU A 93 -11.746 -2.928 -5.899 1.00 0.00 N ATOM 1385 CA LEU A 93 -12.299 -4.143 -5.314 1.00 0.00 C ATOM 1386 C LEU A 93 -12.738 -3.869 -3.887 1.00 0.00 C ATOM 1387 O LEU A 93 -13.902 -4.094 -3.556 1.00 0.00 O ATOM 1388 CB LEU A 93 -11.264 -5.274 -5.378 1.00 0.00 C ATOM 1389 CG LEU A 93 -11.792 -6.604 -4.802 1.00 0.00 C ATOM 1390 CD1 LEU A 93 -12.798 -7.295 -5.727 1.00 0.00 C ATOM 1391 CD2 LEU A 93 -10.602 -7.530 -4.588 1.00 0.00 C ATOM 0 H LEU A 93 -10.819 -2.691 -5.547 1.00 0.00 H new ATOM 0 HA LEU A 93 -13.173 -4.460 -5.882 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -10.964 -5.427 -6.415 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -10.372 -4.975 -4.828 1.00 0.00 H new ATOM 0 HG LEU A 93 -12.312 -6.384 -3.870 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -13.134 -8.225 -5.269 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -13.654 -6.640 -5.888 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -12.323 -7.513 -6.684 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -10.949 -8.480 -4.180 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -10.101 -7.705 -5.540 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -9.903 -7.069 -3.890 1.00 0.00 H new ATOM 1403 N VAL A 94 -11.827 -3.404 -3.028 1.00 0.00 N ATOM 1404 CA VAL A 94 -12.119 -3.228 -1.605 1.00 0.00 C ATOM 1405 C VAL A 94 -13.339 -2.328 -1.405 1.00 0.00 C ATOM 1406 O VAL A 94 -14.236 -2.673 -0.632 1.00 0.00 O ATOM 1407 CB VAL A 94 -10.883 -2.731 -0.829 1.00 0.00 C ATOM 1408 CG1 VAL A 94 -9.796 -3.818 -0.819 1.00 0.00 C ATOM 1409 CG2 VAL A 94 -10.271 -1.434 -1.374 1.00 0.00 C ATOM 0 H VAL A 94 -10.878 -3.142 -3.296 1.00 0.00 H new ATOM 0 HA VAL A 94 -12.370 -4.203 -1.188 1.00 0.00 H new ATOM 0 HB VAL A 94 -11.242 -2.514 0.177 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -8.927 -3.458 -0.269 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -10.184 -4.716 -0.338 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -9.506 -4.052 -1.843 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -9.407 -1.157 -0.769 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -9.957 -1.586 -2.407 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -11.013 -0.636 -1.333 1.00 0.00 H new ATOM 1419 N ALA A 95 -13.411 -1.232 -2.164 1.00 0.00 N ATOM 1420 CA ALA A 95 -14.474 -0.242 -2.088 1.00 0.00 C ATOM 1421 C ALA A 95 -15.852 -0.795 -2.494 1.00 0.00 C ATOM 1422 O ALA A 95 -16.869 -0.143 -2.277 1.00 0.00 O ATOM 1423 CB ALA A 95 -14.095 0.935 -2.995 1.00 0.00 C ATOM 0 H ALA A 95 -12.707 -1.007 -2.868 1.00 0.00 H new ATOM 0 HA ALA A 95 -14.569 0.070 -1.048 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -14.878 1.692 -2.955 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -13.154 1.368 -2.655 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -13.983 0.583 -4.020 1.00 0.00 H new ATOM 1429 N LEU A 96 -15.901 -1.978 -3.110 1.00 0.00 N ATOM 1430 CA LEU A 96 -17.121 -2.655 -3.532 1.00 0.00 C ATOM 1431 C LEU A 96 -17.418 -3.840 -2.609 1.00 0.00 C ATOM 1432 O LEU A 96 -18.527 -4.373 -2.629 1.00 0.00 O ATOM 1433 CB LEU A 96 -16.953 -3.160 -4.974 1.00 0.00 C ATOM 1434 CG LEU A 96 -16.994 -2.069 -6.059 1.00 0.00 C ATOM 1435 CD1 LEU A 96 -15.903 -0.992 -5.953 1.00 0.00 C ATOM 1436 CD2 LEU A 96 -16.908 -2.757 -7.422 1.00 0.00 C ATOM 0 H LEU A 96 -15.059 -2.507 -3.335 1.00 0.00 H new ATOM 0 HA LEU A 96 -17.951 -1.951 -3.481 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -16.003 -3.689 -5.049 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -17.739 -3.886 -5.182 1.00 0.00 H new ATOM 0 HG LEU A 96 -17.930 -1.528 -5.920 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -16.022 -0.273 -6.764 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -15.991 -0.478 -4.996 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -14.921 -1.460 -6.024 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -16.935 -2.006 -8.211 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -15.976 -3.319 -7.488 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -17.751 -3.437 -7.540 1.00 0.00 H new ATOM 1448 N ASN A 97 -16.434 -4.269 -1.815 1.00 0.00 N ATOM 1449 CA ASN A 97 -16.443 -5.490 -1.014 1.00 0.00 C ATOM 1450 C ASN A 97 -16.501 -5.164 0.477 1.00 0.00 C ATOM 1451 O ASN A 97 -16.159 -6.020 1.299 1.00 0.00 O ATOM 1452 CB ASN A 97 -15.224 -6.361 -1.378 1.00 0.00 C ATOM 1453 CG ASN A 97 -15.492 -7.160 -2.640 1.00 0.00 C ATOM 1454 OD1 ASN A 97 -15.815 -8.338 -2.574 1.00 0.00 O ATOM 1455 ND2 ASN A 97 -15.382 -6.548 -3.803 1.00 0.00 N ATOM 0 H ASN A 97 -15.565 -3.745 -1.710 1.00 0.00 H new ATOM 0 HA ASN A 97 -17.342 -6.064 -1.241 1.00 0.00 H new ATOM 0 HB2 ASN A 97 -14.349 -5.728 -1.522 1.00 0.00 H new ATOM 0 HB3 ASN A 97 -14.996 -7.038 -0.555 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -15.567 -7.057 -4.667 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -15.112 -5.565 -3.839 1.00 0.00 H new ATOM 1462 N GLY A 98 -16.889 -3.939 0.841 1.00 0.00 N ATOM 1463 CA GLY A 98 -17.166 -3.559 2.215 1.00 0.00 C ATOM 1464 C GLY A 98 -16.356 -2.390 2.740 1.00 0.00 C ATOM 1465 O GLY A 98 -16.510 -2.072 3.918 1.00 0.00 O ATOM 0 H GLY A 98 -17.019 -3.178 0.175 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -18.225 -3.314 2.300 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -16.986 -4.422 2.856 1.00 0.00 H new ATOM 1469 N PHE A 99 -15.510 -1.764 1.919 1.00 0.00 N ATOM 1470 CA PHE A 99 -14.848 -0.519 2.284 1.00 0.00 C ATOM 1471 C PHE A 99 -15.523 0.656 1.572 1.00 0.00 C ATOM 1472 O PHE A 99 -16.349 0.426 0.688 1.00 0.00 O ATOM 1473 CB PHE A 99 -13.360 -0.574 1.933 1.00 0.00 C ATOM 1474 CG PHE A 99 -12.503 -1.453 2.822 1.00 0.00 C ATOM 1475 CD1 PHE A 99 -12.698 -2.848 2.899 1.00 0.00 C ATOM 1476 CD2 PHE A 99 -11.512 -0.845 3.608 1.00 0.00 C ATOM 1477 CE1 PHE A 99 -11.939 -3.617 3.801 1.00 0.00 C ATOM 1478 CE2 PHE A 99 -10.737 -1.619 4.480 1.00 0.00 C ATOM 1479 CZ PHE A 99 -10.953 -3.002 4.589 1.00 0.00 C ATOM 0 H PHE A 99 -15.269 -2.107 0.989 1.00 0.00 H new ATOM 0 HA PHE A 99 -14.936 -0.379 3.361 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -13.261 -0.924 0.905 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -12.961 0.440 1.964 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -13.430 -3.326 2.265 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -11.347 0.220 3.540 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -12.115 -4.679 3.887 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -9.967 -1.149 5.073 1.00 0.00 H new ATOM 0 HZ PHE A 99 -10.363 -3.590 5.276 1.00 0.00 H new ATOM 1489 N LYS A 100 -15.169 1.907 1.908 1.00 0.00 N ATOM 1490 CA LYS A 100 -15.843 3.070 1.324 1.00 0.00 C ATOM 1491 C LYS A 100 -15.413 3.343 -0.117 1.00 0.00 C ATOM 1492 O LYS A 100 -16.143 3.046 -1.058 1.00 0.00 O ATOM 1493 CB LYS A 100 -15.707 4.331 2.203 1.00 0.00 C ATOM 1494 CG LYS A 100 -16.640 5.492 1.790 1.00 0.00 C ATOM 1495 CD LYS A 100 -18.165 5.284 1.911 1.00 0.00 C ATOM 1496 CE LYS A 100 -18.740 4.287 0.895 1.00 0.00 C ATOM 1497 NZ LYS A 100 -20.156 4.516 0.565 1.00 0.00 N ATOM 0 H LYS A 100 -14.429 2.134 2.573 1.00 0.00 H new ATOM 0 HA LYS A 100 -16.902 2.812 1.292 1.00 0.00 H new ATOM 0 HB2 LYS A 100 -15.915 4.063 3.239 1.00 0.00 H new ATOM 0 HB3 LYS A 100 -14.674 4.678 2.165 1.00 0.00 H new ATOM 0 HG2 LYS A 100 -16.374 6.362 2.391 1.00 0.00 H new ATOM 0 HG3 LYS A 100 -16.420 5.742 0.752 1.00 0.00 H new ATOM 0 HD2 LYS A 100 -18.395 4.935 2.918 1.00 0.00 H new ATOM 0 HD3 LYS A 100 -18.664 6.245 1.785 1.00 0.00 H new ATOM 0 HE2 LYS A 100 -18.152 4.338 -0.021 1.00 0.00 H new ATOM 0 HE3 LYS A 100 -18.629 3.277 1.290 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 -20.471 3.805 -0.125 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 -20.731 4.439 1.428 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 -20.268 5.467 0.158 1.00 0.00 H new ATOM 1511 N SER A 101 -14.246 3.957 -0.282 1.00 0.00 N ATOM 1512 CA SER A 101 -13.673 4.418 -1.537 1.00 0.00 C ATOM 1513 C SER A 101 -12.182 4.156 -1.449 1.00 0.00 C ATOM 1514 O SER A 101 -11.619 4.236 -0.355 1.00 0.00 O ATOM 1515 CB SER A 101 -13.918 5.919 -1.696 1.00 0.00 C ATOM 1516 OG SER A 101 -15.300 6.239 -1.655 1.00 0.00 O ATOM 0 H SER A 101 -13.637 4.158 0.511 1.00 0.00 H new ATOM 0 HA SER A 101 -14.120 3.905 -2.389 1.00 0.00 H new ATOM 0 HB2 SER A 101 -13.398 6.457 -0.904 1.00 0.00 H new ATOM 0 HB3 SER A 101 -13.495 6.257 -2.642 1.00 0.00 H new ATOM 0 HG SER A 101 -15.415 7.207 -1.758 1.00 0.00 H new ATOM 1522 N ALA A 102 -11.534 3.795 -2.552 1.00 0.00 N ATOM 1523 CA ALA A 102 -10.148 3.357 -2.534 1.00 0.00 C ATOM 1524 C ALA A 102 -9.343 4.055 -3.624 1.00 0.00 C ATOM 1525 O ALA A 102 -9.881 4.767 -4.471 1.00 0.00 O ATOM 1526 CB ALA A 102 -10.104 1.824 -2.592 1.00 0.00 C ATOM 0 H ALA A 102 -11.956 3.799 -3.480 1.00 0.00 H new ATOM 0 HA ALA A 102 -9.665 3.649 -1.602 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -9.067 1.489 -2.579 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -10.629 1.412 -1.730 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -10.585 1.481 -3.508 1.00 0.00 H new ATOM 1532 N TYR A 103 -8.027 3.926 -3.503 1.00 0.00 N ATOM 1533 CA TYR A 103 -6.984 4.669 -4.190 1.00 0.00 C ATOM 1534 C TYR A 103 -5.824 3.746 -4.537 1.00 0.00 C ATOM 1535 O TYR A 103 -5.602 2.731 -3.867 1.00 0.00 O ATOM 1536 CB TYR A 103 -6.452 5.782 -3.270 1.00 0.00 C ATOM 1537 CG TYR A 103 -7.158 7.116 -3.377 1.00 0.00 C ATOM 1538 CD1 TYR A 103 -8.492 7.254 -2.961 1.00 0.00 C ATOM 1539 CD2 TYR A 103 -6.466 8.234 -3.877 1.00 0.00 C ATOM 1540 CE1 TYR A 103 -9.150 8.486 -3.087 1.00 0.00 C ATOM 1541 CE2 TYR A 103 -7.106 9.477 -3.983 1.00 0.00 C ATOM 1542 CZ TYR A 103 -8.462 9.607 -3.603 1.00 0.00 C ATOM 1543 OH TYR A 103 -9.098 10.806 -3.711 1.00 0.00 O ATOM 0 H TYR A 103 -7.630 3.237 -2.864 1.00 0.00 H new ATOM 0 HA TYR A 103 -7.405 5.095 -5.101 1.00 0.00 H new ATOM 0 HB2 TYR A 103 -6.519 5.438 -2.238 1.00 0.00 H new ATOM 0 HB3 TYR A 103 -5.395 5.933 -3.487 1.00 0.00 H new ATOM 0 HD1 TYR A 103 -9.014 6.407 -2.542 1.00 0.00 H new ATOM 0 HD2 TYR A 103 -5.435 8.134 -4.181 1.00 0.00 H new ATOM 0 HE1 TYR A 103 -10.184 8.578 -2.789 1.00 0.00 H new ATOM 0 HE2 TYR A 103 -6.564 10.334 -4.354 1.00 0.00 H new ATOM 0 HH TYR A 103 -8.482 11.471 -4.083 1.00 0.00 H new ATOM 1553 N ALA A 104 -5.044 4.153 -5.534 1.00 0.00 N ATOM 1554 CA ALA A 104 -3.773 3.555 -5.887 1.00 0.00 C ATOM 1555 C ALA A 104 -2.712 4.653 -5.986 1.00 0.00 C ATOM 1556 O ALA A 104 -3.033 5.818 -6.233 1.00 0.00 O ATOM 1557 CB ALA A 104 -3.932 2.777 -7.193 1.00 0.00 C ATOM 0 H ALA A 104 -5.294 4.937 -6.136 1.00 0.00 H new ATOM 0 HA ALA A 104 -3.447 2.851 -5.122 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -2.979 2.324 -7.465 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -4.681 1.996 -7.062 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -4.250 3.456 -7.984 1.00 0.00 H new ATOM 1563 N ILE A 105 -1.448 4.289 -5.770 1.00 0.00 N ATOM 1564 CA ILE A 105 -0.279 5.133 -5.986 1.00 0.00 C ATOM 1565 C ILE A 105 0.395 4.575 -7.232 1.00 0.00 C ATOM 1566 O ILE A 105 0.701 3.382 -7.297 1.00 0.00 O ATOM 1567 CB ILE A 105 0.673 5.212 -4.760 1.00 0.00 C ATOM 1568 CG1 ILE A 105 2.131 5.466 -5.200 1.00 0.00 C ATOM 1569 CG2 ILE A 105 0.635 3.985 -3.847 1.00 0.00 C ATOM 1570 CD1 ILE A 105 3.105 5.796 -4.072 1.00 0.00 C ATOM 0 H ILE A 105 -1.204 3.360 -5.426 1.00 0.00 H new ATOM 0 HA ILE A 105 -0.574 6.173 -6.124 1.00 0.00 H new ATOM 0 HB ILE A 105 0.298 6.053 -4.177 1.00 0.00 H new ATOM 0 HG12 ILE A 105 2.494 4.582 -5.724 1.00 0.00 H new ATOM 0 HG13 ILE A 105 2.139 6.287 -5.917 1.00 0.00 H new ATOM 0 HG21 ILE A 105 1.329 4.126 -3.019 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -0.374 3.853 -3.456 1.00 0.00 H new ATOM 0 HG23 ILE A 105 0.923 3.100 -4.415 1.00 0.00 H new ATOM 0 HD11 ILE A 105 4.100 5.957 -4.486 1.00 0.00 H new ATOM 0 HD12 ILE A 105 2.775 6.700 -3.559 1.00 0.00 H new ATOM 0 HD13 ILE A 105 3.136 4.968 -3.364 1.00 0.00 H new ATOM 1582 N LYS A 106 0.617 5.446 -8.208 1.00 0.00 N ATOM 1583 CA LYS A 106 1.319 5.089 -9.422 1.00 0.00 C ATOM 1584 C LYS A 106 2.805 4.838 -9.134 1.00 0.00 C ATOM 1585 O LYS A 106 3.330 5.344 -8.143 1.00 0.00 O ATOM 1586 CB LYS A 106 1.099 6.220 -10.426 1.00 0.00 C ATOM 1587 CG LYS A 106 1.029 5.596 -11.816 1.00 0.00 C ATOM 1588 CD LYS A 106 0.777 6.621 -12.917 1.00 0.00 C ATOM 1589 CE LYS A 106 1.190 6.046 -14.273 1.00 0.00 C ATOM 1590 NZ LYS A 106 0.465 4.822 -14.674 1.00 0.00 N ATOM 0 H LYS A 106 0.313 6.419 -8.175 1.00 0.00 H new ATOM 0 HA LYS A 106 0.935 4.158 -9.840 1.00 0.00 H new ATOM 0 HB2 LYS A 106 0.178 6.758 -10.201 1.00 0.00 H new ATOM 0 HB3 LYS A 106 1.912 6.944 -10.372 1.00 0.00 H new ATOM 0 HG2 LYS A 106 1.963 5.073 -12.021 1.00 0.00 H new ATOM 0 HG3 LYS A 106 0.235 4.849 -11.834 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -0.278 6.895 -12.935 1.00 0.00 H new ATOM 0 HD3 LYS A 106 1.340 7.532 -12.713 1.00 0.00 H new ATOM 0 HE2 LYS A 106 1.037 6.808 -15.037 1.00 0.00 H new ATOM 0 HE3 LYS A 106 2.258 5.828 -14.249 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 0.808 4.504 -15.603 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 0.629 4.075 -13.969 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -0.553 5.025 -14.733 1.00 0.00 H new ATOM 1604 N ASP A 107 3.477 4.061 -9.990 1.00 0.00 N ATOM 1605 CA ASP A 107 4.841 3.518 -9.769 1.00 0.00 C ATOM 1606 C ASP A 107 5.046 2.795 -8.423 1.00 0.00 C ATOM 1607 O ASP A 107 6.185 2.460 -8.083 1.00 0.00 O ATOM 1608 CB ASP A 107 5.917 4.610 -9.983 1.00 0.00 C ATOM 1609 CG ASP A 107 6.402 4.778 -11.413 1.00 0.00 C ATOM 1610 OD1 ASP A 107 6.153 3.895 -12.259 1.00 0.00 O ATOM 1611 OD2 ASP A 107 6.985 5.843 -11.720 1.00 0.00 O ATOM 0 H ASP A 107 3.083 3.778 -10.887 1.00 0.00 H new ATOM 0 HA ASP A 107 4.958 2.741 -10.525 1.00 0.00 H new ATOM 0 HB2 ASP A 107 5.516 5.563 -9.639 1.00 0.00 H new ATOM 0 HB3 ASP A 107 6.775 4.379 -9.351 1.00 0.00 H new ATOM 1616 N GLY A 108 3.981 2.517 -7.664 1.00 0.00 N ATOM 1617 CA GLY A 108 4.035 1.785 -6.412 1.00 0.00 C ATOM 1618 C GLY A 108 5.096 2.342 -5.464 1.00 0.00 C ATOM 1619 O GLY A 108 5.010 3.494 -5.033 1.00 0.00 O ATOM 0 H GLY A 108 3.036 2.806 -7.918 1.00 0.00 H new ATOM 0 HA2 GLY A 108 3.060 1.825 -5.927 1.00 0.00 H new ATOM 0 HA3 GLY A 108 4.247 0.735 -6.615 1.00 0.00 H new ATOM 1623 N ALA A 109 6.075 1.517 -5.100 1.00 0.00 N ATOM 1624 CA ALA A 109 7.190 1.872 -4.242 1.00 0.00 C ATOM 1625 C ALA A 109 8.459 2.111 -5.051 1.00 0.00 C ATOM 1626 O ALA A 109 9.180 3.070 -4.770 1.00 0.00 O ATOM 1627 CB ALA A 109 7.431 0.774 -3.198 1.00 0.00 C ATOM 0 H ALA A 109 6.110 0.546 -5.410 1.00 0.00 H new ATOM 0 HA ALA A 109 6.934 2.800 -3.732 1.00 0.00 H new ATOM 0 HB1 ALA A 109 8.270 1.055 -2.562 1.00 0.00 H new ATOM 0 HB2 ALA A 109 6.537 0.651 -2.586 1.00 0.00 H new ATOM 0 HB3 ALA A 109 7.657 -0.165 -3.703 1.00 0.00 H new ATOM 1633 N GLU A 110 8.766 1.191 -5.965 1.00 0.00 N ATOM 1634 CA GLU A 110 10.070 1.039 -6.593 1.00 0.00 C ATOM 1635 C GLU A 110 10.195 1.833 -7.895 1.00 0.00 C ATOM 1636 O GLU A 110 11.322 2.044 -8.357 1.00 0.00 O ATOM 1637 CB GLU A 110 10.359 -0.446 -6.881 1.00 0.00 C ATOM 1638 CG GLU A 110 10.812 -1.221 -5.638 1.00 0.00 C ATOM 1639 CD GLU A 110 11.112 -2.680 -5.989 1.00 0.00 C ATOM 1640 OE1 GLU A 110 10.152 -3.469 -6.147 1.00 0.00 O ATOM 1641 OE2 GLU A 110 12.296 -3.073 -6.119 1.00 0.00 O ATOM 0 H GLU A 110 8.086 0.508 -6.298 1.00 0.00 H new ATOM 0 HA GLU A 110 10.800 1.436 -5.887 1.00 0.00 H new ATOM 0 HB2 GLU A 110 9.461 -0.913 -7.286 1.00 0.00 H new ATOM 0 HB3 GLU A 110 11.130 -0.518 -7.648 1.00 0.00 H new ATOM 0 HG2 GLU A 110 11.701 -0.753 -5.216 1.00 0.00 H new ATOM 0 HG3 GLU A 110 10.036 -1.178 -4.874 1.00 0.00 H new ATOM 1648 N GLY A 111 9.081 2.246 -8.511 1.00 0.00 N ATOM 1649 CA GLY A 111 9.094 2.890 -9.819 1.00 0.00 C ATOM 1650 C GLY A 111 9.774 4.264 -9.776 1.00 0.00 C ATOM 1651 O GLY A 111 9.978 4.820 -8.692 1.00 0.00 O ATOM 0 H GLY A 111 8.148 2.141 -8.112 1.00 0.00 H new ATOM 0 HA2 GLY A 111 9.613 2.251 -10.533 1.00 0.00 H new ATOM 0 HA3 GLY A 111 8.071 3.003 -10.178 1.00 0.00 H new ATOM 1655 N PRO A 112 10.120 4.853 -10.936 1.00 0.00 N ATOM 1656 CA PRO A 112 10.963 6.047 -10.996 1.00 0.00 C ATOM 1657 C PRO A 112 10.321 7.278 -10.360 1.00 0.00 C ATOM 1658 O PRO A 112 11.026 8.236 -10.033 1.00 0.00 O ATOM 1659 CB PRO A 112 11.297 6.277 -12.473 1.00 0.00 C ATOM 1660 CG PRO A 112 10.247 5.461 -13.219 1.00 0.00 C ATOM 1661 CD PRO A 112 9.915 4.315 -12.267 1.00 0.00 C ATOM 0 HA PRO A 112 11.866 5.885 -10.408 1.00 0.00 H new ATOM 0 HB2 PRO A 112 11.242 7.334 -12.735 1.00 0.00 H new ATOM 0 HB3 PRO A 112 12.306 5.942 -12.711 1.00 0.00 H new ATOM 0 HG2 PRO A 112 9.364 6.059 -13.445 1.00 0.00 H new ATOM 0 HG3 PRO A 112 10.632 5.090 -14.169 1.00 0.00 H new ATOM 0 HD2 PRO A 112 8.887 3.977 -12.401 1.00 0.00 H new ATOM 0 HD3 PRO A 112 10.559 3.454 -12.447 1.00 0.00 H new ATOM 1669 N ARG A 113 9.009 7.252 -10.117 1.00 0.00 N ATOM 1670 CA ARG A 113 8.295 8.255 -9.342 1.00 0.00 C ATOM 1671 C ARG A 113 7.332 7.621 -8.337 1.00 0.00 C ATOM 1672 O ARG A 113 6.354 8.267 -7.962 1.00 0.00 O ATOM 1673 CB ARG A 113 7.644 9.248 -10.326 1.00 0.00 C ATOM 1674 CG ARG A 113 8.649 10.257 -10.905 1.00 0.00 C ATOM 1675 CD ARG A 113 9.287 11.054 -9.758 1.00 0.00 C ATOM 1676 NE ARG A 113 9.875 12.330 -10.179 1.00 0.00 N ATOM 1677 CZ ARG A 113 10.065 13.362 -9.349 1.00 0.00 C ATOM 1678 NH1 ARG A 113 9.774 13.252 -8.055 1.00 0.00 N ATOM 1679 NH2 ARG A 113 10.499 14.526 -9.806 1.00 0.00 N ATOM 0 H ARG A 113 8.402 6.510 -10.466 1.00 0.00 H new ATOM 0 HA ARG A 113 8.983 8.819 -8.712 1.00 0.00 H new ATOM 0 HB2 ARG A 113 7.182 8.693 -11.142 1.00 0.00 H new ATOM 0 HB3 ARG A 113 6.847 9.788 -9.816 1.00 0.00 H new ATOM 0 HG2 ARG A 113 9.419 9.735 -11.473 1.00 0.00 H new ATOM 0 HG3 ARG A 113 8.146 10.933 -11.597 1.00 0.00 H new ATOM 0 HD2 ARG A 113 8.531 11.247 -8.997 1.00 0.00 H new ATOM 0 HD3 ARG A 113 10.061 10.445 -9.291 1.00 0.00 H new ATOM 0 HE ARG A 113 10.153 12.436 -11.155 1.00 0.00 H new ATOM 0 HH11 ARG A 113 9.403 12.375 -7.688 1.00 0.00 H new ATOM 0 HH12 ARG A 113 9.922 14.044 -7.430 1.00 0.00 H new ATOM 0 HH21 ARG A 113 10.692 14.643 -10.801 1.00 0.00 H new ATOM 0 HH22 ARG A 113 10.640 15.306 -9.164 1.00 0.00 H new ATOM 1693 N GLY A 114 7.610 6.392 -7.895 1.00 0.00 N ATOM 1694 CA GLY A 114 6.873 5.707 -6.841 1.00 0.00 C ATOM 1695 C GLY A 114 7.269 6.250 -5.469 1.00 0.00 C ATOM 1696 O GLY A 114 7.995 7.240 -5.368 1.00 0.00 O ATOM 0 H GLY A 114 8.376 5.834 -8.274 1.00 0.00 H new ATOM 0 HA2 GLY A 114 5.802 5.838 -6.995 1.00 0.00 H new ATOM 0 HA3 GLY A 114 7.073 4.637 -6.886 1.00 0.00 H new ATOM 1700 N TRP A 115 6.793 5.603 -4.401 1.00 0.00 N ATOM 1701 CA TRP A 115 6.953 6.005 -3.005 1.00 0.00 C ATOM 1702 C TRP A 115 8.403 6.362 -2.666 1.00 0.00 C ATOM 1703 O TRP A 115 8.645 7.442 -2.126 1.00 0.00 O ATOM 1704 CB TRP A 115 6.462 4.876 -2.087 1.00 0.00 C ATOM 1705 CG TRP A 115 6.274 5.225 -0.645 1.00 0.00 C ATOM 1706 CD1 TRP A 115 7.271 5.418 0.245 1.00 0.00 C ATOM 1707 CD2 TRP A 115 5.035 5.390 0.101 1.00 0.00 C ATOM 1708 NE1 TRP A 115 6.741 5.685 1.487 1.00 0.00 N ATOM 1709 CE2 TRP A 115 5.355 5.672 1.463 1.00 0.00 C ATOM 1710 CE3 TRP A 115 3.668 5.310 -0.241 1.00 0.00 C ATOM 1711 CZ2 TRP A 115 4.350 5.867 2.430 1.00 0.00 C ATOM 1712 CZ3 TRP A 115 2.660 5.500 0.719 1.00 0.00 C ATOM 1713 CH2 TRP A 115 3.002 5.798 2.047 1.00 0.00 C ATOM 0 H TRP A 115 6.258 4.740 -4.495 1.00 0.00 H new ATOM 0 HA TRP A 115 6.355 6.903 -2.848 1.00 0.00 H new ATOM 0 HB2 TRP A 115 5.513 4.508 -2.476 1.00 0.00 H new ATOM 0 HB3 TRP A 115 7.173 4.052 -2.149 1.00 0.00 H new ATOM 0 HD1 TRP A 115 8.326 5.370 0.017 1.00 0.00 H new ATOM 0 HE1 TRP A 115 7.299 5.869 2.321 1.00 0.00 H new ATOM 0 HE3 TRP A 115 3.391 5.098 -1.263 1.00 0.00 H new ATOM 0 HZ2 TRP A 115 4.615 6.068 3.458 1.00 0.00 H new ATOM 0 HZ3 TRP A 115 1.621 5.417 0.435 1.00 0.00 H new ATOM 0 HH2 TRP A 115 2.225 5.975 2.776 1.00 0.00 H new ATOM 1724 N LEU A 116 9.364 5.473 -2.945 1.00 0.00 N ATOM 1725 CA LEU A 116 10.767 5.718 -2.602 1.00 0.00 C ATOM 1726 C LEU A 116 11.273 6.963 -3.331 1.00 0.00 C ATOM 1727 O LEU A 116 11.996 7.774 -2.752 1.00 0.00 O ATOM 1728 CB LEU A 116 11.643 4.499 -2.950 1.00 0.00 C ATOM 1729 CG LEU A 116 11.383 3.253 -2.074 1.00 0.00 C ATOM 1730 CD1 LEU A 116 12.139 2.048 -2.643 1.00 0.00 C ATOM 1731 CD2 LEU A 116 11.808 3.473 -0.616 1.00 0.00 C ATOM 0 H LEU A 116 9.194 4.579 -3.407 1.00 0.00 H new ATOM 0 HA LEU A 116 10.834 5.883 -1.527 1.00 0.00 H new ATOM 0 HB2 LEU A 116 11.477 4.234 -3.994 1.00 0.00 H new ATOM 0 HB3 LEU A 116 12.691 4.782 -2.855 1.00 0.00 H new ATOM 0 HG LEU A 116 10.309 3.066 -2.088 1.00 0.00 H new ATOM 0 HD11 LEU A 116 11.951 1.173 -2.020 1.00 0.00 H new ATOM 0 HD12 LEU A 116 11.797 1.850 -3.659 1.00 0.00 H new ATOM 0 HD13 LEU A 116 13.208 2.262 -2.655 1.00 0.00 H new ATOM 0 HD21 LEU A 116 11.606 2.571 -0.038 1.00 0.00 H new ATOM 0 HD22 LEU A 116 12.874 3.698 -0.578 1.00 0.00 H new ATOM 0 HD23 LEU A 116 11.246 4.307 -0.195 1.00 0.00 H new ATOM 1743 N ASN A 117 10.857 7.152 -4.582 1.00 0.00 N ATOM 1744 CA ASN A 117 11.222 8.300 -5.406 1.00 0.00 C ATOM 1745 C ASN A 117 10.390 9.552 -5.104 1.00 0.00 C ATOM 1746 O ASN A 117 10.568 10.592 -5.745 1.00 0.00 O ATOM 1747 CB ASN A 117 11.149 7.919 -6.890 1.00 0.00 C ATOM 1748 CG ASN A 117 12.372 7.103 -7.279 1.00 0.00 C ATOM 1749 OD1 ASN A 117 12.546 5.967 -6.842 1.00 0.00 O ATOM 1750 ND2 ASN A 117 13.273 7.666 -8.058 1.00 0.00 N ATOM 0 H ASN A 117 10.242 6.494 -5.061 1.00 0.00 H new ATOM 0 HA ASN A 117 12.248 8.567 -5.154 1.00 0.00 H new ATOM 0 HB2 ASN A 117 10.243 7.345 -7.082 1.00 0.00 H new ATOM 0 HB3 ASN A 117 11.092 8.819 -7.502 1.00 0.00 H new ATOM 0 HD21 ASN A 117 14.123 7.159 -8.303 1.00 0.00 H new ATOM 0 HD22 ASN A 117 13.120 8.609 -8.416 1.00 0.00 H new ATOM 1757 N SER A 118 9.479 9.490 -4.134 1.00 0.00 N ATOM 1758 CA SER A 118 8.549 10.552 -3.783 1.00 0.00 C ATOM 1759 C SER A 118 9.067 11.425 -2.637 1.00 0.00 C ATOM 1760 O SER A 118 8.354 12.343 -2.212 1.00 0.00 O ATOM 1761 CB SER A 118 7.228 9.898 -3.398 1.00 0.00 C ATOM 1762 OG SER A 118 6.191 10.850 -3.339 1.00 0.00 O ATOM 0 H SER A 118 9.368 8.662 -3.549 1.00 0.00 H new ATOM 0 HA SER A 118 8.424 11.215 -4.639 1.00 0.00 H new ATOM 0 HB2 SER A 118 6.976 9.125 -4.124 1.00 0.00 H new ATOM 0 HB3 SER A 118 7.330 9.406 -2.431 1.00 0.00 H new ATOM 0 HG SER A 118 5.526 10.569 -2.676 1.00 0.00 H new ATOM 1768 N SER A 119 10.277 11.152 -2.136 1.00 0.00 N ATOM 1769 CA SER A 119 10.824 11.782 -0.944 1.00 0.00 C ATOM 1770 C SER A 119 9.920 11.484 0.261 1.00 0.00 C ATOM 1771 O SER A 119 9.382 12.399 0.894 1.00 0.00 O ATOM 1772 CB SER A 119 11.059 13.282 -1.186 1.00 0.00 C ATOM 1773 OG SER A 119 11.576 13.543 -2.485 1.00 0.00 O ATOM 0 H SER A 119 10.910 10.474 -2.560 1.00 0.00 H new ATOM 0 HA SER A 119 11.803 11.362 -0.713 1.00 0.00 H new ATOM 0 HB2 SER A 119 10.120 13.821 -1.056 1.00 0.00 H new ATOM 0 HB3 SER A 119 11.753 13.665 -0.437 1.00 0.00 H new ATOM 0 HG SER A 119 11.709 14.508 -2.597 1.00 0.00 H new ATOM 1779 N LEU A 120 9.711 10.195 0.543 1.00 0.00 N ATOM 1780 CA LEU A 120 8.860 9.662 1.607 1.00 0.00 C ATOM 1781 C LEU A 120 9.697 8.771 2.532 1.00 0.00 C ATOM 1782 O LEU A 120 10.746 8.284 2.103 1.00 0.00 O ATOM 1783 CB LEU A 120 7.694 8.871 0.973 1.00 0.00 C ATOM 1784 CG LEU A 120 6.625 9.749 0.304 1.00 0.00 C ATOM 1785 CD1 LEU A 120 5.554 8.877 -0.358 1.00 0.00 C ATOM 1786 CD2 LEU A 120 5.937 10.638 1.335 1.00 0.00 C ATOM 0 H LEU A 120 10.158 9.454 0.003 1.00 0.00 H new ATOM 0 HA LEU A 120 8.444 10.475 2.203 1.00 0.00 H new ATOM 0 HB2 LEU A 120 8.098 8.182 0.231 1.00 0.00 H new ATOM 0 HB3 LEU A 120 7.219 8.265 1.745 1.00 0.00 H new ATOM 0 HG LEU A 120 7.126 10.364 -0.444 1.00 0.00 H new ATOM 0 HD11 LEU A 120 4.805 9.515 -0.827 1.00 0.00 H new ATOM 0 HD12 LEU A 120 6.017 8.244 -1.115 1.00 0.00 H new ATOM 0 HD13 LEU A 120 5.077 8.251 0.396 1.00 0.00 H new ATOM 0 HD21 LEU A 120 5.184 11.252 0.841 1.00 0.00 H new ATOM 0 HD22 LEU A 120 5.459 10.015 2.091 1.00 0.00 H new ATOM 0 HD23 LEU A 120 6.676 11.283 1.810 1.00 0.00 H new ATOM 1798 N PRO A 121 9.246 8.532 3.778 1.00 0.00 N ATOM 1799 CA PRO A 121 9.950 7.666 4.717 1.00 0.00 C ATOM 1800 C PRO A 121 9.877 6.199 4.295 1.00 0.00 C ATOM 1801 O PRO A 121 9.003 5.807 3.508 1.00 0.00 O ATOM 1802 CB PRO A 121 9.247 7.851 6.063 1.00 0.00 C ATOM 1803 CG PRO A 121 7.870 8.404 5.732 1.00 0.00 C ATOM 1804 CD PRO A 121 8.030 9.071 4.375 1.00 0.00 C ATOM 0 HA PRO A 121 11.007 7.928 4.760 1.00 0.00 H new ATOM 0 HB2 PRO A 121 9.171 6.905 6.599 1.00 0.00 H new ATOM 0 HB3 PRO A 121 9.801 8.537 6.704 1.00 0.00 H new ATOM 0 HG2 PRO A 121 7.124 7.610 5.696 1.00 0.00 H new ATOM 0 HG3 PRO A 121 7.540 9.118 6.486 1.00 0.00 H new ATOM 0 HD2 PRO A 121 7.166 8.869 3.741 1.00 0.00 H new ATOM 0 HD3 PRO A 121 8.100 10.153 4.483 1.00 0.00 H new ATOM 1812 N TRP A 122 10.704 5.365 4.926 1.00 0.00 N ATOM 1813 CA TRP A 122 10.690 3.913 4.787 1.00 0.00 C ATOM 1814 C TRP A 122 11.074 3.249 6.118 1.00 0.00 C ATOM 1815 O TRP A 122 11.617 3.918 6.997 1.00 0.00 O ATOM 1816 CB TRP A 122 11.655 3.533 3.659 1.00 0.00 C ATOM 1817 CG TRP A 122 11.314 2.243 3.000 1.00 0.00 C ATOM 1818 CD1 TRP A 122 12.107 1.156 2.940 1.00 0.00 C ATOM 1819 CD2 TRP A 122 10.120 1.919 2.228 1.00 0.00 C ATOM 1820 NE1 TRP A 122 11.471 0.166 2.230 1.00 0.00 N ATOM 1821 CE2 TRP A 122 10.235 0.575 1.773 1.00 0.00 C ATOM 1822 CE3 TRP A 122 8.979 2.641 1.821 1.00 0.00 C ATOM 1823 CZ2 TRP A 122 9.238 -0.028 0.992 1.00 0.00 C ATOM 1824 CZ3 TRP A 122 7.985 2.050 1.021 1.00 0.00 C ATOM 1825 CH2 TRP A 122 8.107 0.713 0.615 1.00 0.00 C ATOM 0 H TRP A 122 11.425 5.695 5.568 1.00 0.00 H new ATOM 0 HA TRP A 122 9.691 3.559 4.534 1.00 0.00 H new ATOM 0 HB2 TRP A 122 11.658 4.325 2.911 1.00 0.00 H new ATOM 0 HB3 TRP A 122 12.666 3.471 4.061 1.00 0.00 H new ATOM 0 HD1 TRP A 122 13.089 1.075 3.381 1.00 0.00 H new ATOM 0 HE1 TRP A 122 11.865 -0.760 2.061 1.00 0.00 H new ATOM 0 HE3 TRP A 122 8.866 3.670 2.130 1.00 0.00 H new ATOM 0 HZ2 TRP A 122 9.340 -1.058 0.682 1.00 0.00 H new ATOM 0 HZ3 TRP A 122 7.124 2.628 0.718 1.00 0.00 H new ATOM 0 HH2 TRP A 122 7.334 0.256 0.015 1.00 0.00 H new ATOM 1836 N ILE A 123 10.800 1.953 6.288 1.00 0.00 N ATOM 1837 CA ILE A 123 11.160 1.192 7.491 1.00 0.00 C ATOM 1838 C ILE A 123 12.510 0.506 7.281 1.00 0.00 C ATOM 1839 O ILE A 123 13.297 0.446 8.227 1.00 0.00 O ATOM 1840 CB ILE A 123 10.050 0.175 7.884 1.00 0.00 C ATOM 1841 CG1 ILE A 123 8.744 0.902 8.230 1.00 0.00 C ATOM 1842 CG2 ILE A 123 10.450 -0.673 9.092 1.00 0.00 C ATOM 1843 CD1 ILE A 123 7.551 0.030 8.616 1.00 0.00 C ATOM 0 H ILE A 123 10.316 1.394 5.586 1.00 0.00 H new ATOM 0 HA ILE A 123 11.250 1.886 8.327 1.00 0.00 H new ATOM 0 HB ILE A 123 9.910 -0.474 7.020 1.00 0.00 H new ATOM 0 HG12 ILE A 123 8.945 1.587 9.054 1.00 0.00 H new ATOM 0 HG13 ILE A 123 8.457 1.510 7.372 1.00 0.00 H new ATOM 0 HG21 ILE A 123 9.645 -1.369 9.331 1.00 0.00 H new ATOM 0 HG22 ILE A 123 11.356 -1.232 8.860 1.00 0.00 H new ATOM 0 HG23 ILE A 123 10.634 -0.023 9.948 1.00 0.00 H new ATOM 0 HD11 ILE A 123 6.693 0.665 8.836 1.00 0.00 H new ATOM 0 HD12 ILE A 123 7.306 -0.638 7.790 1.00 0.00 H new ATOM 0 HD13 ILE A 123 7.802 -0.560 9.498 1.00 0.00 H new ATOM 1855 N GLU A 124 12.779 0.013 6.065 1.00 0.00 N ATOM 1856 CA GLU A 124 13.870 -0.900 5.707 1.00 0.00 C ATOM 1857 C GLU A 124 13.805 -2.249 6.448 1.00 0.00 C ATOM 1858 O GLU A 124 13.186 -2.370 7.512 1.00 0.00 O ATOM 1859 CB GLU A 124 15.243 -0.211 5.869 1.00 0.00 C ATOM 1860 CG GLU A 124 15.549 0.650 4.642 1.00 0.00 C ATOM 1861 CD GLU A 124 16.980 1.188 4.656 1.00 0.00 C ATOM 1862 OE1 GLU A 124 17.373 1.885 5.625 1.00 0.00 O ATOM 1863 OE2 GLU A 124 17.738 0.890 3.704 1.00 0.00 O ATOM 0 H GLU A 124 12.206 0.256 5.257 1.00 0.00 H new ATOM 0 HA GLU A 124 13.739 -1.145 4.653 1.00 0.00 H new ATOM 0 HB2 GLU A 124 15.244 0.408 6.766 1.00 0.00 H new ATOM 0 HB3 GLU A 124 16.022 -0.962 5.999 1.00 0.00 H new ATOM 0 HG2 GLU A 124 15.393 0.060 3.739 1.00 0.00 H new ATOM 0 HG3 GLU A 124 14.849 1.485 4.602 1.00 0.00 H new ATOM 1870 N PRO A 125 14.467 -3.298 5.931 1.00 0.00 N ATOM 1871 CA PRO A 125 14.741 -4.501 6.702 1.00 0.00 C ATOM 1872 C PRO A 125 15.793 -4.236 7.796 1.00 0.00 C ATOM 1873 O PRO A 125 16.185 -3.100 8.060 1.00 0.00 O ATOM 1874 CB PRO A 125 15.186 -5.512 5.650 1.00 0.00 C ATOM 1875 CG PRO A 125 15.993 -4.657 4.691 1.00 0.00 C ATOM 1876 CD PRO A 125 15.218 -3.344 4.679 1.00 0.00 C ATOM 0 HA PRO A 125 13.880 -4.869 7.260 1.00 0.00 H new ATOM 0 HB2 PRO A 125 15.787 -6.311 6.084 1.00 0.00 H new ATOM 0 HB3 PRO A 125 14.337 -5.984 5.156 1.00 0.00 H new ATOM 0 HG2 PRO A 125 17.018 -4.519 5.036 1.00 0.00 H new ATOM 0 HG3 PRO A 125 16.048 -5.104 3.698 1.00 0.00 H new ATOM 0 HD2 PRO A 125 15.895 -2.494 4.601 1.00 0.00 H new ATOM 0 HD3 PRO A 125 14.547 -3.297 3.821 1.00 0.00 H new