USER MOD reduce.3.24.130724 H: found=0, std=0, add=973, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 973 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 106 TYR OH : rot 180:sc= -1.04 USER MOD Set 1.2: A 124 GLN : amide:sc= -2.99 K(o=-4,f=-3) USER MOD Set 2.1: A 92 SER OG : rot -65:sc= 0.335 USER MOD Set 2.2: A 94 ASN : amide:sc= -0.918 K(o=-0.58,f=-1.1) USER MOD Set 3.1: A 71 TYR OH : rot -81:sc= -0.188 USER MOD Set 3.2: A 109 SER OG : rot -132:sc= 0.674 USER MOD Set 4.1: A 20 CYS SG : rot 180:sc= -1.42 USER MOD Set 4.2: A 37 MET CE :methyl -114:sc= -0.448 (180deg=-1.28!) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot 73:sc= 0.131 USER MOD Single : A 25 ASN : amide:sc= 0 X(o=0,f=-0.12) USER MOD Single : A 29 HIS : no HD1:sc= 0 X(o=0,f=-0.0034) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 SER OG : rot 180:sc= -0.76 USER MOD Single : A 34 TYR OH : rot -15:sc= -2.74! USER MOD Single : A 38 HIS : no HD1:sc= -3.35! X(o=-3.4!,f=-3) USER MOD Single : A 42 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 THR OG1 : rot -10:sc= -0.998! USER MOD Single : A 56 ASN : amide:sc= 0 X(o=0,f=-0.081) USER MOD Single : A 59 GLN : amide:sc=-0.00983 X(o=-0.0098,f=0) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 ASN : amide:sc= -0.0182 X(o=-0.018,f=0.45) USER MOD Single : A 70 CYS SG : rot -60:sc= 0.806 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 102 THR OG1 : rot 100:sc= -2.69! USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 117 THR OG1 : rot -76:sc= 1.06 USER MOD Single : A 118 GLN : amide:sc= -0.504 X(o=-0.5,f=-0.5) USER MOD Single : A 121 GLN : amide:sc= 0 K(o=0,f=-0.91) USER MOD Single : A 126 ASN : amide:sc= -1.51 K(o=-1.5,f=-2.7!) USER MOD Single : A 129 SER OG : rot 180:sc= 0 USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD Single : A 139 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 141 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 SER OG : rot 180:sc= 0 USER MOD Single : A 143 ASN : amide:sc= -3.24 K(o=-3.2,f=-3.9!) USER MOD ----------------------------------------------------------------- ATOM 63 N VAL A 14 -6.288 6.837 -3.686 1.00 1.14 N ATOM 64 CA VAL A 14 -6.504 7.548 -2.431 1.00 24.31 C ATOM 65 C VAL A 14 -5.335 8.476 -2.117 1.00 75.23 C ATOM 66 O VAL A 14 -4.194 8.033 -1.991 1.00 61.02 O ATOM 67 CB VAL A 14 -6.697 6.569 -1.257 1.00 63.15 C ATOM 68 CG1 VAL A 14 -5.533 5.592 -1.180 1.00 33.01 C ATOM 69 CG2 VAL A 14 -6.853 7.330 0.050 1.00 23.14 C ATOM 0 HA VAL A 14 -7.411 8.139 -2.554 1.00 24.31 H new ATOM 0 HB VAL A 14 -7.609 5.997 -1.429 1.00 63.15 H new ATOM 0 HG11 VAL A 14 -5.686 4.908 -0.345 1.00 33.01 H new ATOM 0 HG12 VAL A 14 -5.473 5.024 -2.108 1.00 33.01 H new ATOM 0 HG13 VAL A 14 -4.604 6.143 -1.032 1.00 33.01 H new ATOM 0 HG21 VAL A 14 -6.988 6.623 0.869 1.00 23.14 H new ATOM 0 HG22 VAL A 14 -5.960 7.929 0.231 1.00 23.14 H new ATOM 0 HG23 VAL A 14 -7.722 7.985 -0.012 1.00 23.14 H new ATOM 79 N SER A 15 -5.629 9.766 -1.992 1.00 11.11 N ATOM 80 CA SER A 15 -4.602 10.758 -1.696 1.00 15.51 C ATOM 81 C SER A 15 -5.094 11.753 -0.648 1.00 60.33 C ATOM 82 O SER A 15 -6.247 12.182 -0.676 1.00 15.11 O ATOM 83 CB SER A 15 -4.199 11.502 -2.971 1.00 22.51 C ATOM 84 OG SER A 15 -2.796 11.691 -3.028 1.00 64.44 O ATOM 0 H SER A 15 -6.569 10.149 -2.091 1.00 11.11 H new ATOM 0 HA SER A 15 -3.732 10.236 -1.297 1.00 15.51 H new ATOM 0 HB2 SER A 15 -4.529 10.939 -3.844 1.00 22.51 H new ATOM 0 HB3 SER A 15 -4.701 12.469 -3.006 1.00 22.51 H new ATOM 0 HG SER A 15 -2.563 12.167 -3.852 1.00 64.44 H new ATOM 90 N VAL A 16 -4.210 12.115 0.276 1.00 64.23 N ATOM 91 CA VAL A 16 -4.551 13.059 1.333 1.00 54.23 C ATOM 92 C VAL A 16 -4.655 14.479 0.788 1.00 10.43 C ATOM 93 O VAL A 16 -3.728 14.981 0.153 1.00 60.30 O ATOM 94 CB VAL A 16 -3.511 13.031 2.468 1.00 13.03 C ATOM 95 CG1 VAL A 16 -2.125 13.353 1.931 1.00 11.02 C ATOM 96 CG2 VAL A 16 -3.903 14.001 3.573 1.00 43.12 C ATOM 0 H VAL A 16 -3.251 11.768 0.314 1.00 64.23 H new ATOM 0 HA VAL A 16 -5.519 12.753 1.730 1.00 54.23 H new ATOM 0 HB VAL A 16 -3.486 12.026 2.890 1.00 13.03 H new ATOM 0 HG11 VAL A 16 -1.404 13.328 2.748 1.00 11.02 H new ATOM 0 HG12 VAL A 16 -1.846 12.616 1.178 1.00 11.02 H new ATOM 0 HG13 VAL A 16 -2.131 14.346 1.482 1.00 11.02 H new ATOM 0 HG21 VAL A 16 -3.157 13.968 4.367 1.00 43.12 H new ATOM 0 HG22 VAL A 16 -3.958 15.011 3.168 1.00 43.12 H new ATOM 0 HG23 VAL A 16 -4.875 13.719 3.977 1.00 43.12 H new ATOM 106 N ALA A 17 -5.790 15.123 1.042 1.00 4.23 N ATOM 107 CA ALA A 17 -6.014 16.487 0.580 1.00 41.20 C ATOM 108 C ALA A 17 -5.417 17.501 1.550 1.00 32.14 C ATOM 109 O ALA A 17 -5.156 17.184 2.711 1.00 11.11 O ATOM 110 CB ALA A 17 -7.502 16.744 0.395 1.00 71.32 C ATOM 0 H ALA A 17 -6.568 14.722 1.565 1.00 4.23 H new ATOM 0 HA ALA A 17 -5.514 16.605 -0.381 1.00 41.20 H new ATOM 0 HB1 ALA A 17 -7.654 17.767 0.050 1.00 71.32 H new ATOM 0 HB2 ALA A 17 -7.902 16.048 -0.343 1.00 71.32 H new ATOM 0 HB3 ALA A 17 -8.017 16.601 1.345 1.00 71.32 H new ATOM 116 N ASP A 18 -5.203 18.720 1.068 1.00 72.12 N ATOM 117 CA ASP A 18 -4.637 19.781 1.893 1.00 33.41 C ATOM 118 C ASP A 18 -5.489 20.014 3.137 1.00 2.02 C ATOM 119 O ASP A 18 -4.984 20.440 4.175 1.00 43.40 O ATOM 120 CB ASP A 18 -4.522 21.076 1.088 1.00 13.02 C ATOM 121 CG ASP A 18 -3.082 21.477 0.839 1.00 64.10 C ATOM 122 OD1 ASP A 18 -2.344 21.686 1.825 1.00 33.44 O ATOM 123 OD2 ASP A 18 -2.691 21.581 -0.342 1.00 51.04 O ATOM 0 H ASP A 18 -5.413 18.998 0.109 1.00 72.12 H new ATOM 0 HA ASP A 18 -3.641 19.470 2.209 1.00 33.41 H new ATOM 0 HB2 ASP A 18 -5.032 20.953 0.133 1.00 13.02 H new ATOM 0 HB3 ASP A 18 -5.032 21.878 1.621 1.00 13.02 H new ATOM 128 N GLU A 19 -6.783 19.733 3.024 1.00 71.53 N ATOM 129 CA GLU A 19 -7.704 19.914 4.139 1.00 13.13 C ATOM 130 C GLU A 19 -7.255 19.105 5.353 1.00 53.31 C ATOM 131 O GLU A 19 -7.259 19.603 6.480 1.00 61.24 O ATOM 132 CB GLU A 19 -9.120 19.501 3.733 1.00 74.22 C ATOM 133 CG GLU A 19 -9.207 18.088 3.180 1.00 31.15 C ATOM 134 CD GLU A 19 -10.452 17.864 2.344 1.00 61.00 C ATOM 135 OE1 GLU A 19 -11.485 18.503 2.634 1.00 60.43 O ATOM 136 OE2 GLU A 19 -10.392 17.050 1.399 1.00 71.41 O ATOM 0 H GLU A 19 -7.217 19.379 2.171 1.00 71.53 H new ATOM 0 HA GLU A 19 -7.705 20.970 4.408 1.00 13.13 H new ATOM 0 HB2 GLU A 19 -9.776 19.584 4.599 1.00 74.22 H new ATOM 0 HB3 GLU A 19 -9.492 20.199 2.983 1.00 74.22 H new ATOM 0 HG2 GLU A 19 -8.325 17.885 2.573 1.00 31.15 H new ATOM 0 HG3 GLU A 19 -9.196 17.377 4.006 1.00 31.15 H new ATOM 143 N CYS A 20 -6.870 17.857 5.114 1.00 20.34 N ATOM 144 CA CYS A 20 -6.419 16.977 6.187 1.00 13.44 C ATOM 145 C CYS A 20 -5.139 17.508 6.824 1.00 41.42 C ATOM 146 O CYS A 20 -4.991 17.501 8.046 1.00 14.30 O ATOM 147 CB CYS A 20 -6.189 15.563 5.653 1.00 0.01 C ATOM 148 SG CYS A 20 -5.467 14.427 6.860 1.00 64.43 S ATOM 0 H CYS A 20 -6.861 17.431 4.187 1.00 20.34 H new ATOM 0 HA CYS A 20 -7.197 16.947 6.950 1.00 13.44 H new ATOM 0 HB2 CYS A 20 -7.141 15.156 5.311 1.00 0.01 H new ATOM 0 HB3 CYS A 20 -5.534 15.617 4.783 1.00 0.01 H new ATOM 0 HG CYS A 20 -5.312 13.257 6.316 1.00 64.43 H new ATOM 154 N VAL A 21 -4.214 17.967 5.986 1.00 12.34 N ATOM 155 CA VAL A 21 -2.945 18.502 6.467 1.00 75.43 C ATOM 156 C VAL A 21 -3.167 19.678 7.411 1.00 42.35 C ATOM 157 O VAL A 21 -2.587 19.736 8.496 1.00 55.32 O ATOM 158 CB VAL A 21 -2.050 18.956 5.299 1.00 24.20 C ATOM 159 CG1 VAL A 21 -0.664 19.331 5.803 1.00 33.30 C ATOM 160 CG2 VAL A 21 -1.964 17.868 4.239 1.00 30.34 C ATOM 0 H VAL A 21 -4.320 17.979 4.972 1.00 12.34 H new ATOM 0 HA VAL A 21 -2.445 17.697 7.006 1.00 75.43 H new ATOM 0 HB VAL A 21 -2.497 19.840 4.844 1.00 24.20 H new ATOM 0 HG11 VAL A 21 -0.045 19.649 4.964 1.00 33.30 H new ATOM 0 HG12 VAL A 21 -0.747 20.146 6.522 1.00 33.30 H new ATOM 0 HG13 VAL A 21 -0.206 18.467 6.284 1.00 33.30 H new ATOM 0 HG21 VAL A 21 -1.328 18.206 3.421 1.00 30.34 H new ATOM 0 HG22 VAL A 21 -1.541 16.965 4.678 1.00 30.34 H new ATOM 0 HG23 VAL A 21 -2.962 17.653 3.857 1.00 30.34 H new ATOM 170 N THR A 22 -4.010 20.616 6.991 1.00 51.45 N ATOM 171 CA THR A 22 -4.308 21.793 7.797 1.00 32.25 C ATOM 172 C THR A 22 -5.009 21.406 9.095 1.00 53.42 C ATOM 173 O THR A 22 -4.701 21.939 10.160 1.00 10.23 O ATOM 174 CB THR A 22 -5.192 22.793 7.028 1.00 63.31 C ATOM 175 OG1 THR A 22 -4.574 23.135 5.782 1.00 23.23 O ATOM 176 CG2 THR A 22 -5.423 24.053 7.848 1.00 72.11 C ATOM 0 H THR A 22 -4.499 20.583 6.096 1.00 51.45 H new ATOM 0 HA THR A 22 -3.354 22.267 8.028 1.00 32.25 H new ATOM 0 HB THR A 22 -6.156 22.321 6.838 1.00 63.31 H new ATOM 0 HG1 THR A 22 -4.641 22.377 5.165 1.00 23.23 H new ATOM 0 HG21 THR A 22 -6.050 24.744 7.284 1.00 72.11 H new ATOM 0 HG22 THR A 22 -5.919 23.793 8.783 1.00 72.11 H new ATOM 0 HG23 THR A 22 -4.465 24.526 8.065 1.00 72.11 H new ATOM 184 N ALA A 23 -5.953 20.476 8.997 1.00 13.14 N ATOM 185 CA ALA A 23 -6.696 20.017 10.164 1.00 32.52 C ATOM 186 C ALA A 23 -5.757 19.461 11.229 1.00 22.41 C ATOM 187 O ALA A 23 -5.882 19.782 12.412 1.00 54.15 O ATOM 188 CB ALA A 23 -7.718 18.965 9.759 1.00 55.14 C ATOM 0 H ALA A 23 -6.221 20.026 8.122 1.00 13.14 H new ATOM 0 HA ALA A 23 -7.220 20.873 10.589 1.00 32.52 H new ATOM 0 HB1 ALA A 23 -8.265 18.631 10.640 1.00 55.14 H new ATOM 0 HB2 ALA A 23 -8.416 19.393 9.039 1.00 55.14 H new ATOM 0 HB3 ALA A 23 -7.206 18.116 9.307 1.00 55.14 H new ATOM 194 N LEU A 24 -4.816 18.625 10.803 1.00 33.43 N ATOM 195 CA LEU A 24 -3.855 18.023 11.721 1.00 31.20 C ATOM 196 C LEU A 24 -2.909 19.077 12.287 1.00 30.10 C ATOM 197 O LEU A 24 -2.567 19.048 13.468 1.00 20.23 O ATOM 198 CB LEU A 24 -3.054 16.932 11.008 1.00 21.14 C ATOM 199 CG LEU A 24 -3.854 15.727 10.512 1.00 53.43 C ATOM 200 CD1 LEU A 24 -2.948 14.750 9.779 1.00 55.24 C ATOM 201 CD2 LEU A 24 -4.557 15.038 11.673 1.00 44.34 C ATOM 0 H LEU A 24 -4.698 18.349 9.828 1.00 33.43 H new ATOM 0 HA LEU A 24 -4.409 17.577 12.547 1.00 31.20 H new ATOM 0 HB2 LEU A 24 -2.546 17.381 10.155 1.00 21.14 H new ATOM 0 HB3 LEU A 24 -2.281 16.574 11.688 1.00 21.14 H new ATOM 0 HG LEU A 24 -4.612 16.081 9.814 1.00 53.43 H new ATOM 0 HD11 LEU A 24 -3.535 13.899 9.433 1.00 55.24 H new ATOM 0 HD12 LEU A 24 -2.492 15.248 8.923 1.00 55.24 H new ATOM 0 HD13 LEU A 24 -2.167 14.402 10.454 1.00 55.24 H new ATOM 0 HD21 LEU A 24 -5.121 14.183 11.301 1.00 44.34 H new ATOM 0 HD22 LEU A 24 -3.816 14.697 12.396 1.00 44.34 H new ATOM 0 HD23 LEU A 24 -5.238 15.740 12.155 1.00 44.34 H new ATOM 213 N ASN A 25 -2.492 20.008 11.436 1.00 45.24 N ATOM 214 CA ASN A 25 -1.586 21.073 11.851 1.00 11.34 C ATOM 215 C ASN A 25 -2.187 21.881 12.998 1.00 41.55 C ATOM 216 O ASN A 25 -1.513 22.173 13.986 1.00 64.54 O ATOM 217 CB ASN A 25 -1.274 21.995 10.671 1.00 1.41 C ATOM 218 CG ASN A 25 0.172 21.895 10.226 1.00 63.24 C ATOM 219 OD1 ASN A 25 1.050 22.563 10.772 1.00 13.43 O ATOM 220 ND2 ASN A 25 0.427 21.056 9.228 1.00 51.42 N ATOM 0 H ASN A 25 -2.767 20.047 10.454 1.00 45.24 H new ATOM 0 HA ASN A 25 -0.660 20.614 12.199 1.00 11.34 H new ATOM 0 HB2 ASN A 25 -1.927 21.744 9.835 1.00 1.41 H new ATOM 0 HB3 ASN A 25 -1.495 23.025 10.950 1.00 1.41 H new ATOM 0 HD21 ASN A 25 1.381 20.946 8.885 1.00 51.42 H new ATOM 0 HD22 ASN A 25 -0.332 20.522 8.804 1.00 51.42 H new ATOM 227 N ASP A 26 -3.458 22.240 12.858 1.00 14.02 N ATOM 228 CA ASP A 26 -4.151 23.013 13.882 1.00 13.23 C ATOM 229 C ASP A 26 -4.424 22.159 15.116 1.00 32.14 C ATOM 230 O ASP A 26 -4.331 22.636 16.248 1.00 13.30 O ATOM 231 CB ASP A 26 -5.465 23.569 13.330 1.00 32.54 C ATOM 232 CG ASP A 26 -5.295 24.212 11.968 1.00 10.35 C ATOM 233 OD1 ASP A 26 -4.174 24.674 11.666 1.00 75.32 O ATOM 234 OD2 ASP A 26 -6.282 24.254 11.205 1.00 50.01 O ATOM 0 H ASP A 26 -4.029 22.008 12.046 1.00 14.02 H new ATOM 0 HA ASP A 26 -3.508 23.844 14.172 1.00 13.23 H new ATOM 0 HB2 ASP A 26 -6.196 22.763 13.259 1.00 32.54 H new ATOM 0 HB3 ASP A 26 -5.867 24.304 14.028 1.00 32.54 H new ATOM 239 N LEU A 27 -4.762 20.894 14.891 1.00 53.20 N ATOM 240 CA LEU A 27 -5.050 19.973 15.985 1.00 71.44 C ATOM 241 C LEU A 27 -3.864 19.873 16.939 1.00 74.20 C ATOM 242 O LEU A 27 -4.032 19.902 18.158 1.00 32.32 O ATOM 243 CB LEU A 27 -5.394 18.588 15.434 1.00 62.45 C ATOM 244 CG LEU A 27 -6.247 17.698 16.338 1.00 22.14 C ATOM 245 CD1 LEU A 27 -7.575 18.370 16.649 1.00 11.12 C ATOM 246 CD2 LEU A 27 -6.473 16.340 15.691 1.00 70.51 C ATOM 0 H LEU A 27 -4.843 20.483 13.961 1.00 53.20 H new ATOM 0 HA LEU A 27 -5.906 20.360 16.538 1.00 71.44 H new ATOM 0 HB2 LEU A 27 -5.917 18.716 14.486 1.00 62.45 H new ATOM 0 HB3 LEU A 27 -4.463 18.064 15.216 1.00 62.45 H new ATOM 0 HG LEU A 27 -5.712 17.546 17.275 1.00 22.14 H new ATOM 0 HD11 LEU A 27 -8.169 17.722 17.294 1.00 11.12 H new ATOM 0 HD12 LEU A 27 -7.393 19.318 17.156 1.00 11.12 H new ATOM 0 HD13 LEU A 27 -8.116 18.553 15.721 1.00 11.12 H new ATOM 0 HD21 LEU A 27 -7.082 15.720 16.349 1.00 70.51 H new ATOM 0 HD22 LEU A 27 -6.987 16.472 14.739 1.00 70.51 H new ATOM 0 HD23 LEU A 27 -5.512 15.854 15.521 1.00 70.51 H new ATOM 258 N ARG A 28 -2.666 19.758 16.376 1.00 72.42 N ATOM 259 CA ARG A 28 -1.452 19.655 17.177 1.00 73.24 C ATOM 260 C ARG A 28 -1.229 20.926 17.990 1.00 3.05 C ATOM 261 O ARG A 28 -0.558 20.905 19.023 1.00 33.33 O ATOM 262 CB ARG A 28 -0.243 19.393 16.277 1.00 0.10 C ATOM 263 CG ARG A 28 0.446 20.661 15.799 1.00 61.31 C ATOM 264 CD ARG A 28 1.075 20.469 14.428 1.00 40.54 C ATOM 265 NE ARG A 28 2.496 20.145 14.518 1.00 61.04 N ATOM 266 CZ ARG A 28 3.324 20.175 13.479 1.00 31.31 C ATOM 267 NH1 ARG A 28 2.875 20.513 12.278 1.00 34.24 N ATOM 268 NH2 ARG A 28 4.604 19.866 13.641 1.00 43.23 N ATOM 0 H ARG A 28 -2.510 19.734 15.368 1.00 72.42 H new ATOM 0 HA ARG A 28 -1.571 18.819 17.867 1.00 73.24 H new ATOM 0 HB2 ARG A 28 0.477 18.781 16.819 1.00 0.10 H new ATOM 0 HB3 ARG A 28 -0.564 18.815 15.410 1.00 0.10 H new ATOM 0 HG2 ARG A 28 -0.277 21.476 15.758 1.00 61.31 H new ATOM 0 HG3 ARG A 28 1.214 20.952 16.516 1.00 61.31 H new ATOM 0 HD2 ARG A 28 0.554 19.671 13.899 1.00 40.54 H new ATOM 0 HD3 ARG A 28 0.947 21.378 13.840 1.00 40.54 H new ATOM 0 HE ARG A 28 2.874 19.881 15.428 1.00 61.04 H new ATOM 0 HH11 ARG A 28 1.891 20.751 12.150 1.00 34.24 H new ATOM 0 HH12 ARG A 28 3.513 20.535 11.483 1.00 34.24 H new ATOM 0 HH21 ARG A 28 4.953 19.605 14.563 1.00 43.23 H new ATOM 0 HH22 ARG A 28 5.239 19.889 12.843 1.00 43.23 H new ATOM 282 N HIS A 29 -1.794 22.032 17.518 1.00 51.32 N ATOM 283 CA HIS A 29 -1.657 23.313 18.202 1.00 44.44 C ATOM 284 C HIS A 29 -2.824 23.548 19.155 1.00 12.32 C ATOM 285 O HIS A 29 -3.092 24.680 19.559 1.00 2.12 O ATOM 286 CB HIS A 29 -1.576 24.452 17.185 1.00 54.23 C ATOM 287 CG HIS A 29 -0.588 25.515 17.553 1.00 42.42 C ATOM 288 ND1 HIS A 29 0.533 25.794 16.799 1.00 0.25 N ATOM 289 CD2 HIS A 29 -0.557 26.371 18.601 1.00 54.42 C ATOM 290 CE1 HIS A 29 1.211 26.775 17.369 1.00 20.52 C ATOM 291 NE2 HIS A 29 0.570 27.143 18.464 1.00 43.02 N ATOM 0 H HIS A 29 -2.351 22.067 16.664 1.00 51.32 H new ATOM 0 HA HIS A 29 -0.736 23.289 18.784 1.00 44.44 H new ATOM 0 HB2 HIS A 29 -1.309 24.041 16.212 1.00 54.23 H new ATOM 0 HB3 HIS A 29 -2.562 24.905 17.080 1.00 54.23 H new ATOM 0 HD2 HIS A 29 -1.284 26.435 19.397 1.00 54.42 H new ATOM 0 HE1 HIS A 29 2.132 27.203 17.002 1.00 20.52 H new ATOM 0 HE2 HIS A 29 0.865 27.881 19.104 1.00 43.02 H new ATOM 299 N LYS A 30 -3.517 22.472 19.511 1.00 70.21 N ATOM 300 CA LYS A 30 -4.656 22.559 20.417 1.00 1.32 C ATOM 301 C LYS A 30 -5.763 23.421 19.818 1.00 31.50 C ATOM 302 O LYS A 30 -6.321 24.289 20.489 1.00 4.04 O ATOM 303 CB LYS A 30 -4.218 23.137 21.765 1.00 53.42 C ATOM 304 CG LYS A 30 -5.213 22.888 22.885 1.00 2.14 C ATOM 305 CD LYS A 30 -4.621 22.002 23.969 1.00 14.31 C ATOM 306 CE LYS A 30 -5.641 20.999 24.487 1.00 44.02 C ATOM 307 NZ LYS A 30 -5.599 20.882 25.971 1.00 73.13 N ATOM 0 H LYS A 30 -3.309 21.528 19.185 1.00 70.21 H new ATOM 0 HA LYS A 30 -5.046 21.552 20.569 1.00 1.32 H new ATOM 0 HB2 LYS A 30 -3.257 22.704 22.041 1.00 53.42 H new ATOM 0 HB3 LYS A 30 -4.065 24.211 21.658 1.00 53.42 H new ATOM 0 HG2 LYS A 30 -5.520 23.840 23.319 1.00 2.14 H new ATOM 0 HG3 LYS A 30 -6.109 22.419 22.479 1.00 2.14 H new ATOM 0 HD2 LYS A 30 -3.755 21.471 23.574 1.00 14.31 H new ATOM 0 HD3 LYS A 30 -4.267 22.621 24.793 1.00 14.31 H new ATOM 0 HE2 LYS A 30 -6.640 21.303 24.175 1.00 44.02 H new ATOM 0 HE3 LYS A 30 -5.450 20.023 24.040 1.00 44.02 H new ATOM 0 HZ1 LYS A 30 -6.308 20.189 26.285 1.00 73.13 H new ATOM 0 HZ2 LYS A 30 -4.653 20.568 26.268 1.00 73.13 H new ATOM 0 HZ3 LYS A 30 -5.806 21.807 26.398 1.00 73.13 H new ATOM 321 N LYS A 31 -6.078 23.174 18.551 1.00 33.31 N ATOM 322 CA LYS A 31 -7.121 23.924 17.861 1.00 0.13 C ATOM 323 C LYS A 31 -8.504 23.521 18.363 1.00 1.55 C ATOM 324 O LYS A 31 -9.361 24.373 18.599 1.00 31.25 O ATOM 325 CB LYS A 31 -7.029 23.695 16.351 1.00 5.20 C ATOM 326 CG LYS A 31 -8.147 24.358 15.566 1.00 73.42 C ATOM 327 CD LYS A 31 -8.902 23.351 14.713 1.00 44.40 C ATOM 328 CE LYS A 31 -9.214 23.912 13.334 1.00 2.41 C ATOM 329 NZ LYS A 31 -9.615 22.843 12.378 1.00 4.30 N ATOM 0 H LYS A 31 -5.625 22.460 17.981 1.00 33.31 H new ATOM 0 HA LYS A 31 -6.971 24.983 18.072 1.00 0.13 H new ATOM 0 HB2 LYS A 31 -6.071 24.072 15.992 1.00 5.20 H new ATOM 0 HB3 LYS A 31 -7.043 22.623 16.153 1.00 5.20 H new ATOM 0 HG2 LYS A 31 -8.838 24.844 16.255 1.00 73.42 H new ATOM 0 HG3 LYS A 31 -7.732 25.138 14.928 1.00 73.42 H new ATOM 0 HD2 LYS A 31 -8.310 22.442 14.612 1.00 44.40 H new ATOM 0 HD3 LYS A 31 -9.830 23.073 15.212 1.00 44.40 H new ATOM 0 HE2 LYS A 31 -10.015 24.647 13.414 1.00 2.41 H new ATOM 0 HE3 LYS A 31 -8.339 24.435 12.948 1.00 2.41 H new ATOM 0 HZ1 LYS A 31 -9.819 23.266 11.450 1.00 4.30 H new ATOM 0 HZ2 LYS A 31 -8.841 22.155 12.282 1.00 4.30 H new ATOM 0 HZ3 LYS A 31 -10.465 22.361 12.733 1.00 4.30 H new ATOM 343 N SER A 32 -8.713 22.219 18.526 1.00 74.00 N ATOM 344 CA SER A 32 -9.993 21.704 18.998 1.00 32.32 C ATOM 345 C SER A 32 -9.788 20.523 19.943 1.00 54.31 C ATOM 346 O SER A 32 -9.918 20.658 21.160 1.00 52.23 O ATOM 347 CB SER A 32 -10.864 21.279 17.814 1.00 31.23 C ATOM 348 OG SER A 32 -10.125 21.296 16.605 1.00 1.13 O ATOM 0 H SER A 32 -8.013 21.501 18.338 1.00 74.00 H new ATOM 0 HA SER A 32 -10.498 22.501 19.544 1.00 32.32 H new ATOM 0 HB2 SER A 32 -11.258 20.278 17.989 1.00 31.23 H new ATOM 0 HB3 SER A 32 -11.720 21.948 17.730 1.00 31.23 H new ATOM 0 HG SER A 32 -10.704 21.019 15.864 1.00 1.13 H new ATOM 354 N ARG A 33 -9.468 19.366 19.373 1.00 4.30 N ATOM 355 CA ARG A 33 -9.246 18.161 20.163 1.00 42.20 C ATOM 356 C ARG A 33 -8.897 16.978 19.264 1.00 12.41 C ATOM 357 O ARG A 33 -7.805 16.417 19.355 1.00 33.15 O ATOM 358 CB ARG A 33 -10.488 17.835 20.994 1.00 22.04 C ATOM 359 CG ARG A 33 -10.173 17.424 22.424 1.00 54.53 C ATOM 360 CD ARG A 33 -11.139 18.060 23.411 1.00 14.22 C ATOM 361 NE ARG A 33 -10.496 18.367 24.686 1.00 40.43 N ATOM 362 CZ ARG A 33 -9.574 19.312 24.835 1.00 52.23 C ATOM 363 NH1 ARG A 33 -9.190 20.038 23.794 1.00 52.40 N ATOM 364 NH2 ARG A 33 -9.035 19.533 26.027 1.00 61.51 N ATOM 0 H ARG A 33 -9.357 19.238 18.367 1.00 4.30 H new ATOM 0 HA ARG A 33 -8.407 18.345 20.833 1.00 42.20 H new ATOM 0 HB2 ARG A 33 -11.143 18.706 21.011 1.00 22.04 H new ATOM 0 HB3 ARG A 33 -11.040 17.031 20.507 1.00 22.04 H new ATOM 0 HG2 ARG A 33 -10.224 16.339 22.511 1.00 54.53 H new ATOM 0 HG3 ARG A 33 -9.153 17.717 22.672 1.00 54.53 H new ATOM 0 HD2 ARG A 33 -11.546 18.975 22.981 1.00 14.22 H new ATOM 0 HD3 ARG A 33 -11.979 17.386 23.581 1.00 14.22 H new ATOM 0 HE ARG A 33 -10.770 17.827 25.507 1.00 40.43 H new ATOM 0 HH11 ARG A 33 -9.603 19.872 22.876 1.00 52.40 H new ATOM 0 HH12 ARG A 33 -8.482 20.763 23.911 1.00 52.40 H new ATOM 0 HH21 ARG A 33 -9.328 18.977 26.830 1.00 61.51 H new ATOM 0 HH22 ARG A 33 -8.327 20.259 26.140 1.00 61.51 H new ATOM 378 N TYR A 34 -9.832 16.605 18.397 1.00 1.42 N ATOM 379 CA TYR A 34 -9.625 15.488 17.484 1.00 70.21 C ATOM 380 C TYR A 34 -10.310 15.745 16.145 1.00 64.51 C ATOM 381 O TYR A 34 -11.271 16.509 16.062 1.00 32.22 O ATOM 382 CB TYR A 34 -10.156 14.193 18.101 1.00 71.22 C ATOM 383 CG TYR A 34 -11.665 14.099 18.106 1.00 72.33 C ATOM 384 CD1 TYR A 34 -12.352 13.589 17.011 1.00 34.30 C ATOM 385 CD2 TYR A 34 -12.404 14.521 19.204 1.00 22.32 C ATOM 386 CE1 TYR A 34 -13.731 13.501 17.011 1.00 52.44 C ATOM 387 CE2 TYR A 34 -13.783 14.436 19.213 1.00 25.21 C ATOM 388 CZ TYR A 34 -14.442 13.926 18.114 1.00 24.20 C ATOM 389 OH TYR A 34 -15.815 13.841 18.118 1.00 31.15 O ATOM 0 H TYR A 34 -10.740 17.060 18.308 1.00 1.42 H new ATOM 0 HA TYR A 34 -8.554 15.387 17.310 1.00 70.21 H new ATOM 0 HB2 TYR A 34 -9.749 13.345 17.550 1.00 71.22 H new ATOM 0 HB3 TYR A 34 -9.792 14.112 19.125 1.00 71.22 H new ATOM 0 HD1 TYR A 34 -11.799 13.256 16.145 1.00 34.30 H new ATOM 0 HD2 TYR A 34 -11.892 14.923 20.066 1.00 22.32 H new ATOM 0 HE1 TYR A 34 -14.249 13.102 16.152 1.00 52.44 H new ATOM 0 HE2 TYR A 34 -14.342 14.767 20.076 1.00 25.21 H new ATOM 0 HH TYR A 34 -16.136 13.693 17.204 1.00 31.15 H new ATOM 399 N VAL A 35 -9.807 15.099 15.097 1.00 4.22 N ATOM 400 CA VAL A 35 -10.369 15.255 13.761 1.00 32.12 C ATOM 401 C VAL A 35 -10.481 13.910 13.052 1.00 44.24 C ATOM 402 O VAL A 35 -9.507 13.162 12.962 1.00 44.03 O ATOM 403 CB VAL A 35 -9.518 16.208 12.901 1.00 21.22 C ATOM 404 CG1 VAL A 35 -10.220 16.512 11.587 1.00 40.14 C ATOM 405 CG2 VAL A 35 -9.218 17.489 13.664 1.00 13.32 C ATOM 0 H VAL A 35 -9.011 14.463 15.148 1.00 4.22 H new ATOM 0 HA VAL A 35 -11.364 15.682 13.884 1.00 32.12 H new ATOM 0 HB VAL A 35 -8.571 15.717 12.674 1.00 21.22 H new ATOM 0 HG11 VAL A 35 -9.604 17.187 10.993 1.00 40.14 H new ATOM 0 HG12 VAL A 35 -10.378 15.585 11.036 1.00 40.14 H new ATOM 0 HG13 VAL A 35 -11.182 16.983 11.789 1.00 40.14 H new ATOM 0 HG21 VAL A 35 -8.616 18.151 13.041 1.00 13.32 H new ATOM 0 HG22 VAL A 35 -10.153 17.986 13.923 1.00 13.32 H new ATOM 0 HG23 VAL A 35 -8.670 17.250 14.575 1.00 13.32 H new ATOM 415 N ILE A 36 -11.673 13.610 12.549 1.00 72.31 N ATOM 416 CA ILE A 36 -11.911 12.355 11.846 1.00 53.44 C ATOM 417 C ILE A 36 -12.014 12.580 10.341 1.00 64.22 C ATOM 418 O ILE A 36 -12.847 13.355 9.874 1.00 13.51 O ATOM 419 CB ILE A 36 -13.198 11.668 12.340 1.00 51.44 C ATOM 420 CG1 ILE A 36 -13.166 11.510 13.861 1.00 22.20 C ATOM 421 CG2 ILE A 36 -13.369 10.316 11.664 1.00 13.01 C ATOM 422 CD1 ILE A 36 -14.400 10.841 14.425 1.00 24.31 C ATOM 0 H ILE A 36 -12.489 14.218 12.615 1.00 72.31 H new ATOM 0 HA ILE A 36 -11.060 11.708 12.058 1.00 53.44 H new ATOM 0 HB ILE A 36 -14.051 12.294 12.077 1.00 51.44 H new ATOM 0 HG12 ILE A 36 -12.288 10.928 14.139 1.00 22.20 H new ATOM 0 HG13 ILE A 36 -13.055 12.493 14.318 1.00 22.20 H new ATOM 0 HG21 ILE A 36 -14.283 9.843 12.023 1.00 13.01 H new ATOM 0 HG22 ILE A 36 -13.432 10.454 10.585 1.00 13.01 H new ATOM 0 HG23 ILE A 36 -12.515 9.681 11.899 1.00 13.01 H new ATOM 0 HD11 ILE A 36 -14.308 10.762 15.508 1.00 24.31 H new ATOM 0 HD12 ILE A 36 -15.281 11.434 14.178 1.00 24.31 H new ATOM 0 HD13 ILE A 36 -14.502 9.844 13.996 1.00 24.31 H new ATOM 434 N MET A 37 -11.161 11.894 9.586 1.00 10.14 N ATOM 435 CA MET A 37 -11.158 12.016 8.133 1.00 2.43 C ATOM 436 C MET A 37 -11.667 10.736 7.479 1.00 40.12 C ATOM 437 O MET A 37 -11.456 9.637 7.994 1.00 43.54 O ATOM 438 CB MET A 37 -9.749 12.335 7.630 1.00 25.40 C ATOM 439 CG MET A 37 -9.232 13.690 8.086 1.00 70.32 C ATOM 440 SD MET A 37 -8.391 13.612 9.679 1.00 44.44 S ATOM 441 CE MET A 37 -7.022 12.526 9.286 1.00 44.21 C ATOM 0 H MET A 37 -10.464 11.248 9.957 1.00 10.14 H new ATOM 0 HA MET A 37 -11.827 12.832 7.860 1.00 2.43 H new ATOM 0 HB2 MET A 37 -9.065 11.560 7.975 1.00 25.40 H new ATOM 0 HB3 MET A 37 -9.745 12.302 6.541 1.00 25.40 H new ATOM 0 HG2 MET A 37 -8.546 14.084 7.336 1.00 70.32 H new ATOM 0 HG3 MET A 37 -10.066 14.389 8.154 1.00 70.32 H new ATOM 0 HE1 MET A 37 -7.128 11.592 9.838 1.00 44.21 H new ATOM 0 HE2 MET A 37 -7.019 12.316 8.216 1.00 44.21 H new ATOM 0 HE3 MET A 37 -6.084 13.007 9.564 1.00 44.21 H new ATOM 451 N HIS A 38 -12.339 10.885 6.341 1.00 22.35 N ATOM 452 CA HIS A 38 -12.878 9.739 5.617 1.00 41.53 C ATOM 453 C HIS A 38 -12.447 9.771 4.153 1.00 20.24 C ATOM 454 O HIS A 38 -12.270 10.841 3.571 1.00 10.45 O ATOM 455 CB HIS A 38 -14.404 9.722 5.711 1.00 61.12 C ATOM 456 CG HIS A 38 -15.055 8.816 4.711 1.00 12.43 C ATOM 457 ND1 HIS A 38 -14.794 7.464 4.639 1.00 55.34 N ATOM 458 CD2 HIS A 38 -15.963 9.076 3.741 1.00 23.30 C ATOM 459 CE1 HIS A 38 -15.512 6.931 3.666 1.00 40.42 C ATOM 460 NE2 HIS A 38 -16.230 7.888 3.106 1.00 41.15 N ATOM 0 H HIS A 38 -12.523 11.787 5.901 1.00 22.35 H new ATOM 0 HA HIS A 38 -12.483 8.832 6.075 1.00 41.53 H new ATOM 0 HB2 HIS A 38 -14.695 9.411 6.714 1.00 61.12 H new ATOM 0 HB3 HIS A 38 -14.780 10.735 5.570 1.00 61.12 H new ATOM 0 HD2 HIS A 38 -16.396 10.038 3.510 1.00 23.30 H new ATOM 0 HE1 HIS A 38 -15.512 5.890 3.378 1.00 40.42 H new ATOM 0 HE2 HIS A 38 -16.878 7.765 2.328 1.00 41.15 H new ATOM 468 N ILE A 39 -12.279 8.591 3.566 1.00 74.12 N ATOM 469 CA ILE A 39 -11.870 8.484 2.171 1.00 5.10 C ATOM 470 C ILE A 39 -13.072 8.567 1.237 1.00 60.11 C ATOM 471 O ILE A 39 -13.984 7.742 1.306 1.00 4.41 O ATOM 472 CB ILE A 39 -11.116 7.167 1.905 1.00 55.32 C ATOM 473 CG1 ILE A 39 -10.043 6.943 2.972 1.00 12.40 C ATOM 474 CG2 ILE A 39 -10.495 7.184 0.516 1.00 11.02 C ATOM 475 CD1 ILE A 39 -9.257 5.666 2.779 1.00 24.22 C ATOM 0 H ILE A 39 -12.420 7.696 4.034 1.00 74.12 H new ATOM 0 HA ILE A 39 -11.202 9.322 1.973 1.00 5.10 H new ATOM 0 HB ILE A 39 -11.827 6.342 1.954 1.00 55.32 H new ATOM 0 HG12 ILE A 39 -9.355 7.788 2.967 1.00 12.40 H new ATOM 0 HG13 ILE A 39 -10.517 6.924 3.954 1.00 12.40 H new ATOM 0 HG21 ILE A 39 -9.966 6.247 0.343 1.00 11.02 H new ATOM 0 HG22 ILE A 39 -11.279 7.302 -0.232 1.00 11.02 H new ATOM 0 HG23 ILE A 39 -9.794 8.016 0.441 1.00 11.02 H new ATOM 0 HD11 ILE A 39 -8.514 5.573 3.571 1.00 24.22 H new ATOM 0 HD12 ILE A 39 -9.935 4.813 2.814 1.00 24.22 H new ATOM 0 HD13 ILE A 39 -8.755 5.691 1.812 1.00 24.22 H new ATOM 487 N VAL A 40 -13.067 9.567 0.361 1.00 3.25 N ATOM 488 CA VAL A 40 -14.155 9.757 -0.590 1.00 34.44 C ATOM 489 C VAL A 40 -13.777 9.231 -1.970 1.00 34.44 C ATOM 490 O VAL A 40 -12.692 9.513 -2.477 1.00 24.42 O ATOM 491 CB VAL A 40 -14.546 11.242 -0.708 1.00 25.04 C ATOM 492 CG1 VAL A 40 -15.703 11.415 -1.680 1.00 25.32 C ATOM 493 CG2 VAL A 40 -14.897 11.810 0.659 1.00 53.21 C ATOM 0 H VAL A 40 -12.320 10.258 0.291 1.00 3.25 H new ATOM 0 HA VAL A 40 -15.008 9.194 -0.211 1.00 34.44 H new ATOM 0 HB VAL A 40 -13.691 11.795 -1.098 1.00 25.04 H new ATOM 0 HG11 VAL A 40 -15.965 12.471 -1.750 1.00 25.32 H new ATOM 0 HG12 VAL A 40 -15.410 11.048 -2.664 1.00 25.32 H new ATOM 0 HG13 VAL A 40 -16.565 10.850 -1.324 1.00 25.32 H new ATOM 0 HG21 VAL A 40 -15.171 12.860 0.557 1.00 53.21 H new ATOM 0 HG22 VAL A 40 -15.736 11.255 1.079 1.00 53.21 H new ATOM 0 HG23 VAL A 40 -14.036 11.722 1.322 1.00 53.21 H new ATOM 503 N ASP A 41 -14.680 8.465 -2.573 1.00 13.15 N ATOM 504 CA ASP A 41 -14.443 7.900 -3.896 1.00 3.12 C ATOM 505 C ASP A 41 -13.147 7.095 -3.918 1.00 51.13 C ATOM 506 O ASP A 41 -12.534 6.918 -4.971 1.00 11.24 O ATOM 507 CB ASP A 41 -14.386 9.011 -4.945 1.00 44.24 C ATOM 508 CG ASP A 41 -15.295 8.738 -6.128 1.00 4.05 C ATOM 509 OD1 ASP A 41 -15.064 7.734 -6.833 1.00 34.22 O ATOM 510 OD2 ASP A 41 -16.236 9.529 -6.348 1.00 2.10 O ATOM 0 H ASP A 41 -15.583 8.221 -2.166 1.00 13.15 H new ATOM 0 HA ASP A 41 -15.270 7.230 -4.132 1.00 3.12 H new ATOM 0 HB2 ASP A 41 -14.669 9.957 -4.484 1.00 44.24 H new ATOM 0 HB3 ASP A 41 -13.360 9.122 -5.297 1.00 44.24 H new ATOM 515 N GLN A 42 -12.737 6.611 -2.750 1.00 43.24 N ATOM 516 CA GLN A 42 -11.513 5.827 -2.637 1.00 22.33 C ATOM 517 C GLN A 42 -10.415 6.398 -3.528 1.00 51.21 C ATOM 518 O GLN A 42 -9.666 5.655 -4.163 1.00 54.32 O ATOM 519 CB GLN A 42 -11.781 4.368 -3.009 1.00 61.44 C ATOM 520 CG GLN A 42 -12.187 4.175 -4.462 1.00 11.34 C ATOM 521 CD GLN A 42 -11.995 2.749 -4.937 1.00 63.15 C ATOM 522 OE1 GLN A 42 -10.884 2.340 -5.277 1.00 21.13 O ATOM 523 NE2 GLN A 42 -13.079 1.982 -4.965 1.00 3.41 N ATOM 0 H GLN A 42 -13.234 6.748 -1.870 1.00 43.24 H new ATOM 0 HA GLN A 42 -11.176 5.875 -1.602 1.00 22.33 H new ATOM 0 HB2 GLN A 42 -10.885 3.780 -2.810 1.00 61.44 H new ATOM 0 HB3 GLN A 42 -12.569 3.976 -2.365 1.00 61.44 H new ATOM 0 HG2 GLN A 42 -13.233 4.457 -4.583 1.00 11.34 H new ATOM 0 HG3 GLN A 42 -11.601 4.845 -5.091 1.00 11.34 H new ATOM 0 HE21 GLN A 42 -13.980 2.362 -4.674 1.00 3.41 H new ATOM 0 HE22 GLN A 42 -13.010 1.013 -5.277 1.00 3.41 H new ATOM 532 N LYS A 43 -10.325 7.723 -3.571 1.00 41.13 N ATOM 533 CA LYS A 43 -9.318 8.396 -4.384 1.00 34.21 C ATOM 534 C LYS A 43 -8.903 9.720 -3.750 1.00 30.51 C ATOM 535 O LYS A 43 -7.723 10.071 -3.740 1.00 72.30 O ATOM 536 CB LYS A 43 -9.854 8.641 -5.796 1.00 61.45 C ATOM 537 CG LYS A 43 -8.817 9.207 -6.750 1.00 42.35 C ATOM 538 CD LYS A 43 -9.453 9.691 -8.043 1.00 11.23 C ATOM 539 CE LYS A 43 -8.644 10.813 -8.677 1.00 32.55 C ATOM 540 NZ LYS A 43 -9.443 11.577 -9.674 1.00 0.31 N ATOM 0 H LYS A 43 -10.937 8.353 -3.052 1.00 41.13 H new ATOM 0 HA LYS A 43 -8.442 7.750 -4.441 1.00 34.21 H new ATOM 0 HB2 LYS A 43 -10.233 7.702 -6.200 1.00 61.45 H new ATOM 0 HB3 LYS A 43 -10.698 9.328 -5.741 1.00 61.45 H new ATOM 0 HG2 LYS A 43 -8.293 10.033 -6.270 1.00 42.35 H new ATOM 0 HG3 LYS A 43 -8.072 8.443 -6.974 1.00 42.35 H new ATOM 0 HD2 LYS A 43 -9.534 8.859 -8.743 1.00 11.23 H new ATOM 0 HD3 LYS A 43 -10.466 10.040 -7.843 1.00 11.23 H new ATOM 0 HE2 LYS A 43 -8.290 11.490 -7.899 1.00 32.55 H new ATOM 0 HE3 LYS A 43 -7.762 10.395 -9.162 1.00 32.55 H new ATOM 0 HZ1 LYS A 43 -8.857 12.332 -10.083 1.00 0.31 H new ATOM 0 HZ2 LYS A 43 -9.760 10.936 -10.430 1.00 0.31 H new ATOM 0 HZ3 LYS A 43 -10.272 11.997 -9.206 1.00 0.31 H new ATOM 554 N SER A 44 -9.880 10.449 -3.220 1.00 43.24 N ATOM 555 CA SER A 44 -9.615 11.735 -2.586 1.00 53.43 C ATOM 556 C SER A 44 -10.081 11.730 -1.133 1.00 45.52 C ATOM 557 O SER A 44 -11.232 11.407 -0.840 1.00 50.40 O ATOM 558 CB SER A 44 -10.314 12.859 -3.354 1.00 11.44 C ATOM 559 OG SER A 44 -9.383 13.835 -3.789 1.00 12.23 O ATOM 0 H SER A 44 -10.861 10.171 -3.217 1.00 43.24 H new ATOM 0 HA SER A 44 -8.539 11.907 -2.604 1.00 53.43 H new ATOM 0 HB2 SER A 44 -10.839 12.444 -4.214 1.00 11.44 H new ATOM 0 HB3 SER A 44 -11.065 13.327 -2.717 1.00 11.44 H new ATOM 0 HG SER A 44 -9.854 14.541 -4.278 1.00 12.23 H new ATOM 565 N ILE A 45 -9.177 12.091 -0.228 1.00 61.32 N ATOM 566 CA ILE A 45 -9.494 12.129 1.194 1.00 51.10 C ATOM 567 C ILE A 45 -10.158 13.448 1.574 1.00 42.43 C ATOM 568 O ILE A 45 -9.671 14.523 1.223 1.00 15.12 O ATOM 569 CB ILE A 45 -8.234 11.934 2.057 1.00 3.33 C ATOM 570 CG1 ILE A 45 -7.556 10.606 1.716 1.00 24.21 C ATOM 571 CG2 ILE A 45 -8.590 11.989 3.535 1.00 35.13 C ATOM 572 CD1 ILE A 45 -6.277 10.364 2.488 1.00 14.00 C ATOM 0 H ILE A 45 -8.220 12.361 -0.454 1.00 61.32 H new ATOM 0 HA ILE A 45 -10.186 11.309 1.385 1.00 51.10 H new ATOM 0 HB ILE A 45 -7.536 12.743 1.841 1.00 3.33 H new ATOM 0 HG12 ILE A 45 -8.251 9.791 1.916 1.00 24.21 H new ATOM 0 HG13 ILE A 45 -7.336 10.583 0.649 1.00 24.21 H new ATOM 0 HG21 ILE A 45 -7.689 11.849 4.132 1.00 35.13 H new ATOM 0 HG22 ILE A 45 -9.032 12.958 3.767 1.00 35.13 H new ATOM 0 HG23 ILE A 45 -9.304 11.199 3.767 1.00 35.13 H new ATOM 0 HD11 ILE A 45 -5.851 9.404 2.195 1.00 14.00 H new ATOM 0 HD12 ILE A 45 -5.564 11.159 2.269 1.00 14.00 H new ATOM 0 HD13 ILE A 45 -6.493 10.354 3.556 1.00 14.00 H new ATOM 584 N ALA A 46 -11.271 13.359 2.294 1.00 20.42 N ATOM 585 CA ALA A 46 -12.000 14.545 2.725 1.00 3.14 C ATOM 586 C ALA A 46 -12.506 14.389 4.155 1.00 32.22 C ATOM 587 O ALA A 46 -12.718 13.273 4.631 1.00 53.30 O ATOM 588 CB ALA A 46 -13.159 14.825 1.780 1.00 22.04 C ATOM 0 H ALA A 46 -11.688 12.477 2.591 1.00 20.42 H new ATOM 0 HA ALA A 46 -11.314 15.392 2.701 1.00 3.14 H new ATOM 0 HB1 ALA A 46 -13.695 15.714 2.114 1.00 22.04 H new ATOM 0 HB2 ALA A 46 -12.776 14.990 0.773 1.00 22.04 H new ATOM 0 HB3 ALA A 46 -13.838 13.973 1.775 1.00 22.04 H new ATOM 594 N VAL A 47 -12.698 15.514 4.837 1.00 64.03 N ATOM 595 CA VAL A 47 -13.180 15.502 6.213 1.00 63.24 C ATOM 596 C VAL A 47 -14.633 15.045 6.282 1.00 44.11 C ATOM 597 O VAL A 47 -15.466 15.465 5.479 1.00 72.22 O ATOM 598 CB VAL A 47 -13.059 16.893 6.862 1.00 41.20 C ATOM 599 CG1 VAL A 47 -11.630 17.405 6.766 1.00 40.55 C ATOM 600 CG2 VAL A 47 -14.029 17.869 6.214 1.00 41.35 C ATOM 0 H VAL A 47 -12.527 16.446 4.459 1.00 64.03 H new ATOM 0 HA VAL A 47 -12.554 14.798 6.762 1.00 63.24 H new ATOM 0 HB VAL A 47 -13.318 16.806 7.917 1.00 41.20 H new ATOM 0 HG11 VAL A 47 -11.564 18.389 7.230 1.00 40.55 H new ATOM 0 HG12 VAL A 47 -10.961 16.716 7.281 1.00 40.55 H new ATOM 0 HG13 VAL A 47 -11.339 17.478 5.718 1.00 40.55 H new ATOM 0 HG21 VAL A 47 -13.930 18.847 6.685 1.00 41.35 H new ATOM 0 HG22 VAL A 47 -13.804 17.954 5.151 1.00 41.35 H new ATOM 0 HG23 VAL A 47 -15.049 17.507 6.341 1.00 41.35 H new ATOM 610 N LYS A 48 -14.930 14.182 7.248 1.00 54.44 N ATOM 611 CA LYS A 48 -16.283 13.669 7.425 1.00 73.53 C ATOM 612 C LYS A 48 -16.949 14.297 8.645 1.00 42.23 C ATOM 613 O LYS A 48 -18.093 14.748 8.578 1.00 1.02 O ATOM 614 CB LYS A 48 -16.257 12.146 7.573 1.00 72.41 C ATOM 615 CG LYS A 48 -17.356 11.440 6.797 1.00 11.12 C ATOM 616 CD LYS A 48 -17.922 10.265 7.576 1.00 30.52 C ATOM 617 CE LYS A 48 -18.299 9.115 6.655 1.00 73.15 C ATOM 618 NZ LYS A 48 -19.758 9.099 6.356 1.00 32.03 N ATOM 0 H LYS A 48 -14.252 13.823 7.920 1.00 54.44 H new ATOM 0 HA LYS A 48 -16.863 13.933 6.541 1.00 73.53 H new ATOM 0 HB2 LYS A 48 -15.289 11.773 7.237 1.00 72.41 H new ATOM 0 HB3 LYS A 48 -16.348 11.890 8.629 1.00 72.41 H new ATOM 0 HG2 LYS A 48 -18.155 12.147 6.571 1.00 11.12 H new ATOM 0 HG3 LYS A 48 -16.962 11.089 5.843 1.00 11.12 H new ATOM 0 HD2 LYS A 48 -17.187 9.923 8.305 1.00 30.52 H new ATOM 0 HD3 LYS A 48 -18.800 10.587 8.136 1.00 30.52 H new ATOM 0 HE2 LYS A 48 -17.738 9.197 5.724 1.00 73.15 H new ATOM 0 HE3 LYS A 48 -18.013 8.170 7.118 1.00 73.15 H new ATOM 0 HZ1 LYS A 48 -19.974 8.301 5.726 1.00 32.03 H new ATOM 0 HZ2 LYS A 48 -20.293 8.995 7.242 1.00 32.03 H new ATOM 0 HZ3 LYS A 48 -20.027 9.990 5.891 1.00 32.03 H new ATOM 632 N THR A 49 -16.225 14.326 9.759 1.00 24.24 N ATOM 633 CA THR A 49 -16.745 14.900 10.994 1.00 24.51 C ATOM 634 C THR A 49 -15.616 15.230 11.965 1.00 75.24 C ATOM 635 O THR A 49 -14.982 14.333 12.521 1.00 4.30 O ATOM 636 CB THR A 49 -17.736 13.944 11.684 1.00 74.24 C ATOM 637 OG1 THR A 49 -18.862 13.707 10.831 1.00 60.03 O ATOM 638 CG2 THR A 49 -18.211 14.520 13.009 1.00 4.12 C ATOM 0 H THR A 49 -15.276 13.959 9.832 1.00 24.24 H new ATOM 0 HA THR A 49 -17.266 15.818 10.721 1.00 24.51 H new ATOM 0 HB THR A 49 -17.222 13.003 11.879 1.00 74.24 H new ATOM 0 HG1 THR A 49 -18.837 14.331 10.075 1.00 60.03 H new ATOM 0 HG21 THR A 49 -18.910 13.827 13.477 1.00 4.12 H new ATOM 0 HG22 THR A 49 -17.355 14.673 13.667 1.00 4.12 H new ATOM 0 HG23 THR A 49 -18.709 15.474 12.834 1.00 4.12 H new ATOM 646 N ILE A 50 -15.373 16.521 12.164 1.00 64.41 N ATOM 647 CA ILE A 50 -14.322 16.968 13.069 1.00 4.13 C ATOM 648 C ILE A 50 -14.887 17.304 14.445 1.00 55.41 C ATOM 649 O ILE A 50 -16.023 17.761 14.566 1.00 53.53 O ATOM 650 CB ILE A 50 -13.587 18.202 12.513 1.00 11.21 C ATOM 651 CG1 ILE A 50 -12.410 18.573 13.417 1.00 22.44 C ATOM 652 CG2 ILE A 50 -14.548 19.374 12.378 1.00 3.23 C ATOM 653 CD1 ILE A 50 -11.503 19.629 12.826 1.00 3.03 C ATOM 0 H ILE A 50 -15.889 17.275 11.711 1.00 64.41 H new ATOM 0 HA ILE A 50 -13.614 16.144 13.161 1.00 4.13 H new ATOM 0 HB ILE A 50 -13.198 17.960 11.524 1.00 11.21 H new ATOM 0 HG12 ILE A 50 -12.795 18.930 14.372 1.00 22.44 H new ATOM 0 HG13 ILE A 50 -11.825 17.677 13.623 1.00 22.44 H new ATOM 0 HG21 ILE A 50 -14.014 20.239 11.984 1.00 3.23 H new ATOM 0 HG22 ILE A 50 -15.356 19.105 11.698 1.00 3.23 H new ATOM 0 HG23 ILE A 50 -14.963 19.619 13.356 1.00 3.23 H new ATOM 0 HD11 ILE A 50 -10.691 19.842 13.521 1.00 3.03 H new ATOM 0 HD12 ILE A 50 -11.089 19.268 11.885 1.00 3.03 H new ATOM 0 HD13 ILE A 50 -12.074 20.540 12.645 1.00 3.03 H new ATOM 665 N GLY A 51 -14.086 17.076 15.481 1.00 43.22 N ATOM 666 CA GLY A 51 -14.523 17.362 16.835 1.00 51.24 C ATOM 667 C GLY A 51 -13.982 18.680 17.352 1.00 13.23 C ATOM 668 O GLY A 51 -13.277 19.392 16.638 1.00 24.43 O ATOM 0 H GLY A 51 -13.142 16.698 15.407 1.00 43.22 H new ATOM 0 HA2 GLY A 51 -15.612 17.383 16.865 1.00 51.24 H new ATOM 0 HA3 GLY A 51 -14.201 16.557 17.495 1.00 51.24 H new ATOM 672 N GLU A 52 -14.315 19.007 18.597 1.00 35.12 N ATOM 673 CA GLU A 52 -13.860 20.250 19.208 1.00 42.10 C ATOM 674 C GLU A 52 -14.381 20.378 20.636 1.00 35.34 C ATOM 675 O GLU A 52 -15.589 20.338 20.873 1.00 0.32 O ATOM 676 CB GLU A 52 -14.318 21.450 18.377 1.00 42.41 C ATOM 677 CG GLU A 52 -15.789 21.405 18.001 1.00 34.42 C ATOM 678 CD GLU A 52 -16.420 22.783 17.943 1.00 23.51 C ATOM 679 OE1 GLU A 52 -16.044 23.569 17.048 1.00 31.23 O ATOM 680 OE2 GLU A 52 -17.288 23.075 18.792 1.00 62.23 O ATOM 0 H GLU A 52 -14.898 18.428 19.202 1.00 35.12 H new ATOM 0 HA GLU A 52 -12.771 20.232 19.238 1.00 42.10 H new ATOM 0 HB2 GLU A 52 -14.123 22.365 18.937 1.00 42.41 H new ATOM 0 HB3 GLU A 52 -13.721 21.500 17.467 1.00 42.41 H new ATOM 0 HG2 GLU A 52 -15.897 20.919 17.031 1.00 34.42 H new ATOM 0 HG3 GLU A 52 -16.327 20.794 18.726 1.00 34.42 H new ATOM 687 N ARG A 53 -13.463 20.530 21.584 1.00 25.03 N ATOM 688 CA ARG A 53 -13.829 20.661 22.989 1.00 3.53 C ATOM 689 C ARG A 53 -14.545 19.408 23.484 1.00 1.21 C ATOM 690 O ARG A 53 -15.434 19.482 24.331 1.00 10.51 O ATOM 691 CB ARG A 53 -14.722 21.886 23.193 1.00 12.40 C ATOM 692 CG ARG A 53 -14.127 23.173 22.644 1.00 61.42 C ATOM 693 CD ARG A 53 -14.712 23.521 21.284 1.00 23.00 C ATOM 694 NE ARG A 53 -15.345 24.837 21.282 1.00 72.15 N ATOM 695 CZ ARG A 53 -16.574 25.062 21.733 1.00 20.11 C ATOM 696 NH1 ARG A 53 -17.298 24.064 22.221 1.00 25.22 N ATOM 697 NH2 ARG A 53 -17.081 26.287 21.698 1.00 52.55 N ATOM 0 H ARG A 53 -12.460 20.566 21.405 1.00 25.03 H new ATOM 0 HA ARG A 53 -12.913 20.787 23.567 1.00 3.53 H new ATOM 0 HB2 ARG A 53 -15.684 21.707 22.713 1.00 12.40 H new ATOM 0 HB3 ARG A 53 -14.915 22.011 24.258 1.00 12.40 H new ATOM 0 HG2 ARG A 53 -14.315 23.989 23.342 1.00 61.42 H new ATOM 0 HG3 ARG A 53 -13.045 23.068 22.560 1.00 61.42 H new ATOM 0 HD2 ARG A 53 -13.923 23.497 20.533 1.00 23.00 H new ATOM 0 HD3 ARG A 53 -15.445 22.766 21.000 1.00 23.00 H new ATOM 0 HE ARG A 53 -14.814 25.627 20.914 1.00 72.15 H new ATOM 0 HH11 ARG A 53 -16.911 23.121 22.251 1.00 25.22 H new ATOM 0 HH12 ARG A 53 -18.241 24.240 22.567 1.00 25.22 H new ATOM 0 HH21 ARG A 53 -16.527 27.058 21.324 1.00 52.55 H new ATOM 0 HH22 ARG A 53 -18.025 26.458 22.045 1.00 52.55 H new ATOM 711 N GLY A 54 -14.151 18.257 22.948 1.00 21.11 N ATOM 712 CA GLY A 54 -14.766 17.004 23.347 1.00 42.25 C ATOM 713 C GLY A 54 -16.169 16.846 22.796 1.00 13.42 C ATOM 714 O GLY A 54 -17.149 16.979 23.529 1.00 50.22 O ATOM 0 H GLY A 54 -13.417 18.170 22.245 1.00 21.11 H new ATOM 0 HA2 GLY A 54 -14.148 16.174 23.004 1.00 42.25 H new ATOM 0 HA3 GLY A 54 -14.798 16.949 24.435 1.00 42.25 H new ATOM 718 N ALA A 55 -16.267 16.564 21.501 1.00 31.12 N ATOM 719 CA ALA A 55 -17.561 16.388 20.853 1.00 21.34 C ATOM 720 C ALA A 55 -18.437 15.414 21.634 1.00 75.14 C ATOM 721 O ALA A 55 -17.949 14.665 22.479 1.00 72.04 O ATOM 722 CB ALA A 55 -17.373 15.903 19.423 1.00 35.14 C ATOM 0 H ALA A 55 -15.466 16.453 20.880 1.00 31.12 H new ATOM 0 HA ALA A 55 -18.065 17.354 20.834 1.00 21.34 H new ATOM 0 HB1 ALA A 55 -18.347 15.776 18.951 1.00 35.14 H new ATOM 0 HB2 ALA A 55 -16.792 16.636 18.864 1.00 35.14 H new ATOM 0 HB3 ALA A 55 -16.845 14.949 19.429 1.00 35.14 H new ATOM 728 N ASN A 56 -19.735 15.431 21.345 1.00 63.43 N ATOM 729 CA ASN A 56 -20.680 14.549 22.021 1.00 43.32 C ATOM 730 C ASN A 56 -20.491 13.103 21.572 1.00 15.23 C ATOM 731 O ASN A 56 -20.073 12.841 20.444 1.00 0.24 O ATOM 732 CB ASN A 56 -22.116 14.998 21.743 1.00 1.24 C ATOM 733 CG ASN A 56 -22.562 16.114 22.669 1.00 62.13 C ATOM 734 OD1 ASN A 56 -22.490 15.988 23.891 1.00 23.31 O ATOM 735 ND2 ASN A 56 -23.026 17.214 22.088 1.00 51.13 N ATOM 0 H ASN A 56 -20.156 16.045 20.648 1.00 63.43 H new ATOM 0 HA ASN A 56 -20.490 14.606 23.093 1.00 43.32 H new ATOM 0 HB2 ASN A 56 -22.195 15.334 20.709 1.00 1.24 H new ATOM 0 HB3 ASN A 56 -22.788 14.147 21.854 1.00 1.24 H new ATOM 0 HD21 ASN A 56 -23.341 17.998 22.659 1.00 51.13 H new ATOM 0 HD22 ASN A 56 -23.068 17.275 21.071 1.00 51.13 H new ATOM 742 N PHE A 57 -20.804 12.168 22.463 1.00 71.21 N ATOM 743 CA PHE A 57 -20.669 10.748 22.160 1.00 73.14 C ATOM 744 C PHE A 57 -21.635 10.334 21.053 1.00 44.23 C ATOM 745 O PHE A 57 -21.276 9.573 20.154 1.00 31.21 O ATOM 746 CB PHE A 57 -20.925 9.910 23.414 1.00 0.12 C ATOM 747 CG PHE A 57 -19.675 9.332 24.014 1.00 72.11 C ATOM 748 CD1 PHE A 57 -18.869 8.479 23.278 1.00 25.34 C ATOM 749 CD2 PHE A 57 -19.307 9.641 25.313 1.00 13.35 C ATOM 750 CE1 PHE A 57 -17.718 7.945 23.827 1.00 5.11 C ATOM 751 CE2 PHE A 57 -18.157 9.111 25.867 1.00 13.23 C ATOM 752 CZ PHE A 57 -17.362 8.261 25.124 1.00 51.13 C ATOM 0 H PHE A 57 -21.153 12.368 23.400 1.00 71.21 H new ATOM 0 HA PHE A 57 -19.650 10.571 21.815 1.00 73.14 H new ATOM 0 HB2 PHE A 57 -21.424 10.529 24.160 1.00 0.12 H new ATOM 0 HB3 PHE A 57 -21.608 9.098 23.165 1.00 0.12 H new ATOM 0 HD1 PHE A 57 -19.143 8.228 22.264 1.00 25.34 H new ATOM 0 HD2 PHE A 57 -19.926 10.304 25.900 1.00 13.35 H new ATOM 0 HE1 PHE A 57 -17.098 7.282 23.243 1.00 5.11 H new ATOM 0 HE2 PHE A 57 -17.880 9.362 26.880 1.00 13.23 H new ATOM 0 HZ PHE A 57 -16.464 7.844 25.556 1.00 51.13 H new ATOM 762 N ASP A 58 -22.860 10.841 21.125 1.00 35.24 N ATOM 763 CA ASP A 58 -23.879 10.525 20.130 1.00 5.20 C ATOM 764 C ASP A 58 -23.495 11.085 18.764 1.00 63.12 C ATOM 765 O ASP A 58 -23.746 10.460 17.734 1.00 35.21 O ATOM 766 CB ASP A 58 -25.235 11.085 20.562 1.00 61.25 C ATOM 767 CG ASP A 58 -25.728 10.472 21.857 1.00 13.05 C ATOM 768 OD1 ASP A 58 -25.713 9.229 21.969 1.00 25.50 O ATOM 769 OD2 ASP A 58 -26.131 11.236 22.760 1.00 71.11 O ATOM 0 H ASP A 58 -23.172 11.473 21.862 1.00 35.24 H new ATOM 0 HA ASP A 58 -23.952 9.440 20.051 1.00 5.20 H new ATOM 0 HB2 ASP A 58 -25.157 12.166 20.681 1.00 61.25 H new ATOM 0 HB3 ASP A 58 -25.967 10.903 19.775 1.00 61.25 H new ATOM 774 N GLN A 59 -22.885 12.266 18.764 1.00 55.22 N ATOM 775 CA GLN A 59 -22.469 12.910 17.524 1.00 50.32 C ATOM 776 C GLN A 59 -21.254 12.208 16.927 1.00 4.32 C ATOM 777 O GLN A 59 -21.212 11.926 15.729 1.00 14.44 O ATOM 778 CB GLN A 59 -22.150 14.385 17.773 1.00 44.41 C ATOM 779 CG GLN A 59 -23.385 15.254 17.947 1.00 4.40 C ATOM 780 CD GLN A 59 -23.710 16.061 16.705 1.00 35.15 C ATOM 781 OE1 GLN A 59 -24.727 15.829 16.050 1.00 44.43 O ATOM 782 NE2 GLN A 59 -22.848 17.015 16.376 1.00 43.03 N ATOM 0 H GLN A 59 -22.668 12.796 19.608 1.00 55.22 H new ATOM 0 HA GLN A 59 -23.292 12.839 16.813 1.00 50.32 H new ATOM 0 HB2 GLN A 59 -21.529 14.468 18.665 1.00 44.41 H new ATOM 0 HB3 GLN A 59 -21.562 14.767 16.938 1.00 44.41 H new ATOM 0 HG2 GLN A 59 -24.237 14.622 18.198 1.00 4.40 H new ATOM 0 HG3 GLN A 59 -23.232 15.932 18.787 1.00 4.40 H new ATOM 0 HE21 GLN A 59 -22.018 17.172 16.948 1.00 43.03 H new ATOM 0 HE22 GLN A 59 -23.015 17.591 15.551 1.00 43.03 H new ATOM 791 N PHE A 60 -20.265 11.929 17.770 1.00 20.12 N ATOM 792 CA PHE A 60 -19.047 11.261 17.326 1.00 73.21 C ATOM 793 C PHE A 60 -19.365 9.896 16.721 1.00 12.33 C ATOM 794 O PHE A 60 -18.891 9.561 15.636 1.00 45.04 O ATOM 795 CB PHE A 60 -18.074 11.099 18.495 1.00 65.21 C ATOM 796 CG PHE A 60 -16.948 10.147 18.210 1.00 65.43 C ATOM 797 CD1 PHE A 60 -17.077 8.796 18.490 1.00 71.13 C ATOM 798 CD2 PHE A 60 -15.759 10.602 17.662 1.00 52.41 C ATOM 799 CE1 PHE A 60 -16.043 7.917 18.228 1.00 30.21 C ATOM 800 CE2 PHE A 60 -14.722 9.728 17.398 1.00 40.13 C ATOM 801 CZ PHE A 60 -14.864 8.384 17.682 1.00 25.13 C ATOM 0 H PHE A 60 -20.283 12.155 18.764 1.00 20.12 H new ATOM 0 HA PHE A 60 -18.582 11.880 16.558 1.00 73.21 H new ATOM 0 HB2 PHE A 60 -17.659 12.074 18.750 1.00 65.21 H new ATOM 0 HB3 PHE A 60 -18.623 10.748 19.369 1.00 65.21 H new ATOM 0 HD1 PHE A 60 -17.997 8.425 18.918 1.00 71.13 H new ATOM 0 HD2 PHE A 60 -15.642 11.652 17.439 1.00 52.41 H new ATOM 0 HE1 PHE A 60 -16.157 6.866 18.450 1.00 30.21 H new ATOM 0 HE2 PHE A 60 -13.801 10.096 16.970 1.00 40.13 H new ATOM 0 HZ PHE A 60 -14.054 7.699 17.477 1.00 25.13 H new ATOM 811 N ILE A 61 -20.170 9.114 17.432 1.00 14.10 N ATOM 812 CA ILE A 61 -20.552 7.787 16.966 1.00 72.10 C ATOM 813 C ILE A 61 -21.435 7.873 15.726 1.00 61.45 C ATOM 814 O ILE A 61 -21.270 7.103 14.780 1.00 24.42 O ATOM 815 CB ILE A 61 -21.298 6.999 18.059 1.00 2.14 C ATOM 816 CG1 ILE A 61 -20.390 6.783 19.272 1.00 64.44 C ATOM 817 CG2 ILE A 61 -21.786 5.666 17.512 1.00 14.40 C ATOM 818 CD1 ILE A 61 -19.196 5.900 18.982 1.00 30.44 C ATOM 0 H ILE A 61 -20.570 9.376 18.333 1.00 14.10 H new ATOM 0 HA ILE A 61 -19.629 7.263 16.717 1.00 72.10 H new ATOM 0 HB ILE A 61 -22.165 7.578 18.376 1.00 2.14 H new ATOM 0 HG12 ILE A 61 -20.038 7.751 19.629 1.00 64.44 H new ATOM 0 HG13 ILE A 61 -20.974 6.338 20.078 1.00 64.44 H new ATOM 0 HG21 ILE A 61 -22.311 5.121 18.296 1.00 14.40 H new ATOM 0 HG22 ILE A 61 -22.463 5.842 16.676 1.00 14.40 H new ATOM 0 HG23 ILE A 61 -20.934 5.079 17.171 1.00 14.40 H new ATOM 0 HD11 ILE A 61 -18.597 5.790 19.886 1.00 30.44 H new ATOM 0 HD12 ILE A 61 -19.540 4.919 18.653 1.00 30.44 H new ATOM 0 HD13 ILE A 61 -18.590 6.354 18.198 1.00 30.44 H new ATOM 830 N GLU A 62 -22.372 8.816 15.736 1.00 5.04 N ATOM 831 CA GLU A 62 -23.280 9.003 14.611 1.00 63.20 C ATOM 832 C GLU A 62 -22.505 9.305 13.331 1.00 14.54 C ATOM 833 O GLU A 62 -22.863 8.837 12.251 1.00 20.53 O ATOM 834 CB GLU A 62 -24.265 10.136 14.904 1.00 4.54 C ATOM 835 CG GLU A 62 -25.131 10.513 13.715 1.00 73.04 C ATOM 836 CD GLU A 62 -26.343 11.333 14.112 1.00 52.20 C ATOM 837 OE1 GLU A 62 -26.179 12.292 14.896 1.00 60.42 O ATOM 838 OE2 GLU A 62 -27.455 11.017 13.640 1.00 51.11 O ATOM 0 H GLU A 62 -22.522 9.462 16.511 1.00 5.04 H new ATOM 0 HA GLU A 62 -23.836 8.077 14.468 1.00 63.20 H new ATOM 0 HB2 GLU A 62 -24.909 9.841 15.732 1.00 4.54 H new ATOM 0 HB3 GLU A 62 -23.708 11.015 15.230 1.00 4.54 H new ATOM 0 HG2 GLU A 62 -24.533 11.078 13.000 1.00 73.04 H new ATOM 0 HG3 GLU A 62 -25.461 9.606 13.209 1.00 73.04 H new ATOM 845 N ALA A 63 -21.443 10.093 13.462 1.00 0.10 N ATOM 846 CA ALA A 63 -20.617 10.458 12.318 1.00 60.33 C ATOM 847 C ALA A 63 -19.769 9.278 11.854 1.00 33.14 C ATOM 848 O ALA A 63 -19.821 8.884 10.689 1.00 53.22 O ATOM 849 CB ALA A 63 -19.729 11.644 12.664 1.00 14.00 C ATOM 0 H ALA A 63 -21.134 10.491 14.349 1.00 0.10 H new ATOM 0 HA ALA A 63 -21.279 10.741 11.500 1.00 60.33 H new ATOM 0 HB1 ALA A 63 -19.118 11.905 11.800 1.00 14.00 H new ATOM 0 HB2 ALA A 63 -20.351 12.496 12.940 1.00 14.00 H new ATOM 0 HB3 ALA A 63 -19.081 11.382 13.501 1.00 14.00 H new ATOM 855 N ILE A 64 -18.989 8.719 12.773 1.00 34.34 N ATOM 856 CA ILE A 64 -18.131 7.584 12.458 1.00 31.40 C ATOM 857 C ILE A 64 -18.957 6.344 12.133 1.00 61.43 C ATOM 858 O ILE A 64 -19.993 6.096 12.750 1.00 61.31 O ATOM 859 CB ILE A 64 -17.176 7.260 13.622 1.00 61.41 C ATOM 860 CG1 ILE A 64 -16.106 6.263 13.170 1.00 13.03 C ATOM 861 CG2 ILE A 64 -17.954 6.709 14.808 1.00 63.02 C ATOM 862 CD1 ILE A 64 -15.117 5.904 14.257 1.00 15.12 C ATOM 0 H ILE A 64 -18.934 9.034 13.742 1.00 34.34 H new ATOM 0 HA ILE A 64 -17.543 7.866 11.584 1.00 31.40 H new ATOM 0 HB ILE A 64 -16.681 8.180 13.933 1.00 61.41 H new ATOM 0 HG12 ILE A 64 -16.594 5.354 12.819 1.00 13.03 H new ATOM 0 HG13 ILE A 64 -15.565 6.683 12.322 1.00 13.03 H new ATOM 0 HG21 ILE A 64 -17.265 6.485 15.623 1.00 63.02 H new ATOM 0 HG22 ILE A 64 -18.682 7.449 15.141 1.00 63.02 H new ATOM 0 HG23 ILE A 64 -18.473 5.798 14.511 1.00 63.02 H new ATOM 0 HD11 ILE A 64 -14.388 5.194 13.866 1.00 15.12 H new ATOM 0 HD12 ILE A 64 -14.602 6.804 14.592 1.00 15.12 H new ATOM 0 HD13 ILE A 64 -15.647 5.455 15.097 1.00 15.12 H new ATOM 874 N ASP A 65 -18.490 5.567 11.161 1.00 13.11 N ATOM 875 CA ASP A 65 -19.184 4.350 10.755 1.00 1.21 C ATOM 876 C ASP A 65 -18.266 3.138 10.869 1.00 25.53 C ATOM 877 O ASP A 65 -17.059 3.275 11.074 1.00 53.43 O ATOM 878 CB ASP A 65 -19.696 4.484 9.320 1.00 12.32 C ATOM 879 CG ASP A 65 -20.806 3.500 9.007 1.00 22.23 C ATOM 880 OD1 ASP A 65 -21.956 3.751 9.424 1.00 62.40 O ATOM 881 OD2 ASP A 65 -20.524 2.478 8.346 1.00 11.05 O ATOM 0 H ASP A 65 -17.634 5.758 10.640 1.00 13.11 H new ATOM 0 HA ASP A 65 -20.033 4.205 11.423 1.00 1.21 H new ATOM 0 HB2 ASP A 65 -20.059 5.499 9.160 1.00 12.32 H new ATOM 0 HB3 ASP A 65 -18.870 4.328 8.626 1.00 12.32 H new ATOM 886 N LYS A 66 -18.844 1.949 10.737 1.00 74.10 N ATOM 887 CA LYS A 66 -18.079 0.711 10.825 1.00 75.31 C ATOM 888 C LYS A 66 -18.104 -0.040 9.497 1.00 13.41 C ATOM 889 O LYS A 66 -18.903 -0.956 9.306 1.00 4.03 O ATOM 890 CB LYS A 66 -18.638 -0.180 11.937 1.00 71.22 C ATOM 891 CG LYS A 66 -17.609 -1.124 12.534 1.00 33.52 C ATOM 892 CD LYS A 66 -18.261 -2.380 13.090 1.00 43.24 C ATOM 893 CE LYS A 66 -18.266 -3.505 12.066 1.00 53.43 C ATOM 894 NZ LYS A 66 -19.258 -4.561 12.408 1.00 30.41 N ATOM 0 H LYS A 66 -19.841 1.817 10.568 1.00 74.10 H new ATOM 0 HA LYS A 66 -17.046 0.968 11.058 1.00 75.31 H new ATOM 0 HB2 LYS A 66 -19.042 0.451 12.728 1.00 71.22 H new ATOM 0 HB3 LYS A 66 -19.468 -0.764 11.540 1.00 71.22 H new ATOM 0 HG2 LYS A 66 -16.880 -1.398 11.772 1.00 33.52 H new ATOM 0 HG3 LYS A 66 -17.063 -0.614 13.328 1.00 33.52 H new ATOM 0 HD2 LYS A 66 -17.728 -2.703 13.984 1.00 43.24 H new ATOM 0 HD3 LYS A 66 -19.284 -2.157 13.392 1.00 43.24 H new ATOM 0 HE2 LYS A 66 -18.494 -3.098 11.081 1.00 53.43 H new ATOM 0 HE3 LYS A 66 -17.271 -3.947 12.007 1.00 53.43 H new ATOM 0 HZ1 LYS A 66 -19.231 -5.310 11.686 1.00 30.41 H new ATOM 0 HZ2 LYS A 66 -19.026 -4.967 13.337 1.00 30.41 H new ATOM 0 HZ3 LYS A 66 -20.211 -4.145 12.440 1.00 30.41 H new ATOM 908 N ASN A 67 -17.224 0.355 8.583 1.00 41.00 N ATOM 909 CA ASN A 67 -17.145 -0.281 7.273 1.00 23.41 C ATOM 910 C ASN A 67 -16.045 0.352 6.426 1.00 12.01 C ATOM 911 O ASN A 67 -15.102 -0.321 6.009 1.00 13.12 O ATOM 912 CB ASN A 67 -18.488 -0.174 6.549 1.00 50.43 C ATOM 913 CG ASN A 67 -19.046 -1.529 6.161 1.00 70.25 C ATOM 914 OD1 ASN A 67 -19.080 -2.454 6.972 1.00 31.40 O ATOM 915 ND2 ASN A 67 -19.487 -1.653 4.914 1.00 44.41 N ATOM 0 H ASN A 67 -16.556 1.112 8.725 1.00 41.00 H new ATOM 0 HA ASN A 67 -16.903 -1.333 7.422 1.00 23.41 H new ATOM 0 HB2 ASN A 67 -19.203 0.340 7.191 1.00 50.43 H new ATOM 0 HB3 ASN A 67 -18.367 0.436 5.654 1.00 50.43 H new ATOM 0 HD21 ASN A 67 -19.873 -2.542 4.596 1.00 44.41 H new ATOM 0 HD22 ASN A 67 -19.440 -0.859 4.275 1.00 44.41 H new ATOM 922 N VAL A 68 -16.173 1.651 6.176 1.00 42.31 N ATOM 923 CA VAL A 68 -15.190 2.377 5.380 1.00 23.23 C ATOM 924 C VAL A 68 -13.966 2.738 6.215 1.00 61.12 C ATOM 925 O VAL A 68 -14.038 2.888 7.435 1.00 42.04 O ATOM 926 CB VAL A 68 -15.789 3.664 4.785 1.00 54.33 C ATOM 927 CG1 VAL A 68 -17.071 3.355 4.026 1.00 42.25 C ATOM 928 CG2 VAL A 68 -16.043 4.690 5.880 1.00 62.45 C ATOM 0 H VAL A 68 -16.948 2.222 6.513 1.00 42.31 H new ATOM 0 HA VAL A 68 -14.890 1.716 4.567 1.00 23.23 H new ATOM 0 HB VAL A 68 -15.071 4.087 4.082 1.00 54.33 H new ATOM 0 HG11 VAL A 68 -17.480 4.277 3.612 1.00 42.25 H new ATOM 0 HG12 VAL A 68 -16.855 2.658 3.216 1.00 42.25 H new ATOM 0 HG13 VAL A 68 -17.797 2.908 4.705 1.00 42.25 H new ATOM 0 HG21 VAL A 68 -16.466 5.593 5.441 1.00 62.45 H new ATOM 0 HG22 VAL A 68 -16.741 4.279 6.609 1.00 62.45 H new ATOM 0 HG23 VAL A 68 -15.103 4.934 6.375 1.00 62.45 H new ATOM 938 N PRO A 69 -12.814 2.882 5.544 1.00 64.15 N ATOM 939 CA PRO A 69 -11.551 3.229 6.203 1.00 32.52 C ATOM 940 C PRO A 69 -11.542 4.663 6.721 1.00 74.21 C ATOM 941 O PRO A 69 -11.337 5.607 5.957 1.00 2.03 O ATOM 942 CB PRO A 69 -10.512 3.054 5.093 1.00 4.23 C ATOM 943 CG PRO A 69 -11.272 3.249 3.827 1.00 14.55 C ATOM 944 CD PRO A 69 -12.654 2.718 4.089 1.00 75.12 C ATOM 0 HA PRO A 69 -11.365 2.610 7.080 1.00 32.52 H new ATOM 0 HB2 PRO A 69 -9.706 3.782 5.187 1.00 4.23 H new ATOM 0 HB3 PRO A 69 -10.054 2.065 5.132 1.00 4.23 H new ATOM 0 HG2 PRO A 69 -11.305 4.303 3.550 1.00 14.55 H new ATOM 0 HG3 PRO A 69 -10.799 2.717 3.002 1.00 14.55 H new ATOM 0 HD2 PRO A 69 -13.410 3.276 3.536 1.00 75.12 H new ATOM 0 HD3 PRO A 69 -12.746 1.674 3.790 1.00 75.12 H new ATOM 952 N CYS A 70 -11.766 4.819 8.021 1.00 70.21 N ATOM 953 CA CYS A 70 -11.784 6.139 8.641 1.00 51.24 C ATOM 954 C CYS A 70 -10.613 6.304 9.603 1.00 5.01 C ATOM 955 O CYS A 70 -10.251 5.373 10.323 1.00 73.42 O ATOM 956 CB CYS A 70 -13.104 6.360 9.382 1.00 64.44 C ATOM 957 SG CYS A 70 -13.296 5.344 10.865 1.00 2.01 S ATOM 0 H CYS A 70 -11.938 4.048 8.666 1.00 70.21 H new ATOM 0 HA CYS A 70 -11.690 6.885 7.852 1.00 51.24 H new ATOM 0 HB2 CYS A 70 -13.180 7.411 9.662 1.00 64.44 H new ATOM 0 HB3 CYS A 70 -13.930 6.151 8.702 1.00 64.44 H new ATOM 0 HG CYS A 70 -13.251 4.087 10.538 1.00 2.01 H new ATOM 963 N TYR A 71 -10.022 7.494 9.609 1.00 20.24 N ATOM 964 CA TYR A 71 -8.888 7.780 10.480 1.00 32.35 C ATOM 965 C TYR A 71 -9.249 8.844 11.512 1.00 5.41 C ATOM 966 O TYR A 71 -9.771 9.905 11.170 1.00 62.33 O ATOM 967 CB TYR A 71 -7.687 8.241 9.654 1.00 64.33 C ATOM 968 CG TYR A 71 -7.437 7.395 8.425 1.00 3.43 C ATOM 969 CD1 TYR A 71 -8.075 7.676 7.223 1.00 3.42 C ATOM 970 CD2 TYR A 71 -6.564 6.315 8.467 1.00 43.55 C ATOM 971 CE1 TYR A 71 -7.850 6.907 6.098 1.00 31.43 C ATOM 972 CE2 TYR A 71 -6.332 5.541 7.346 1.00 1.13 C ATOM 973 CZ TYR A 71 -6.978 5.840 6.165 1.00 45.53 C ATOM 974 OH TYR A 71 -6.750 5.071 5.047 1.00 74.40 O ATOM 0 H TYR A 71 -10.309 8.276 9.021 1.00 20.24 H new ATOM 0 HA TYR A 71 -8.627 6.862 11.007 1.00 32.35 H new ATOM 0 HB2 TYR A 71 -7.843 9.275 9.347 1.00 64.33 H new ATOM 0 HB3 TYR A 71 -6.797 8.226 10.283 1.00 64.33 H new ATOM 0 HD1 TYR A 71 -8.759 8.510 7.167 1.00 3.42 H new ATOM 0 HD2 TYR A 71 -6.058 6.076 9.391 1.00 43.55 H new ATOM 0 HE1 TYR A 71 -8.354 7.140 5.171 1.00 31.43 H new ATOM 0 HE2 TYR A 71 -5.648 4.706 7.395 1.00 1.13 H new ATOM 0 HH TYR A 71 -7.476 4.421 4.943 1.00 74.40 H new ATOM 984 N ALA A 72 -8.965 8.553 12.777 1.00 4.03 N ATOM 985 CA ALA A 72 -9.255 9.485 13.860 1.00 55.04 C ATOM 986 C ALA A 72 -7.973 9.967 14.529 1.00 62.40 C ATOM 987 O ALA A 72 -7.231 9.176 15.112 1.00 51.23 O ATOM 988 CB ALA A 72 -10.175 8.835 14.883 1.00 52.13 C ATOM 0 H ALA A 72 -8.534 7.679 13.077 1.00 4.03 H new ATOM 0 HA ALA A 72 -9.759 10.353 13.434 1.00 55.04 H new ATOM 0 HB1 ALA A 72 -10.383 9.542 15.686 1.00 52.13 H new ATOM 0 HB2 ALA A 72 -11.109 8.548 14.401 1.00 52.13 H new ATOM 0 HB3 ALA A 72 -9.692 7.949 15.296 1.00 52.13 H new ATOM 994 N ALA A 73 -7.717 11.268 14.441 1.00 74.22 N ATOM 995 CA ALA A 73 -6.525 11.854 15.039 1.00 3.53 C ATOM 996 C ALA A 73 -6.871 12.632 16.304 1.00 11.05 C ATOM 997 O ALA A 73 -7.503 13.687 16.243 1.00 30.04 O ATOM 998 CB ALA A 73 -5.822 12.759 14.038 1.00 62.34 C ATOM 0 H ALA A 73 -8.320 11.936 13.961 1.00 74.22 H new ATOM 0 HA ALA A 73 -5.852 11.043 15.315 1.00 3.53 H new ATOM 0 HB1 ALA A 73 -4.933 13.190 14.499 1.00 62.34 H new ATOM 0 HB2 ALA A 73 -5.532 12.177 13.163 1.00 62.34 H new ATOM 0 HB3 ALA A 73 -6.497 13.559 13.734 1.00 62.34 H new ATOM 1004 N PHE A 74 -6.454 12.104 17.451 1.00 52.24 N ATOM 1005 CA PHE A 74 -6.722 12.748 18.731 1.00 11.41 C ATOM 1006 C PHE A 74 -5.434 13.281 19.352 1.00 10.01 C ATOM 1007 O PHE A 74 -4.437 12.566 19.449 1.00 62.42 O ATOM 1008 CB PHE A 74 -7.395 11.764 19.690 1.00 0.23 C ATOM 1009 CG PHE A 74 -8.116 12.432 20.826 1.00 53.12 C ATOM 1010 CD1 PHE A 74 -7.420 13.177 21.764 1.00 62.11 C ATOM 1011 CD2 PHE A 74 -9.491 12.316 20.955 1.00 61.31 C ATOM 1012 CE1 PHE A 74 -8.081 13.792 22.810 1.00 32.32 C ATOM 1013 CE2 PHE A 74 -10.158 12.929 21.999 1.00 62.31 C ATOM 1014 CZ PHE A 74 -9.452 13.669 22.927 1.00 20.42 C ATOM 0 H PHE A 74 -5.929 11.232 17.519 1.00 52.24 H new ATOM 0 HA PHE A 74 -7.393 13.588 18.553 1.00 11.41 H new ATOM 0 HB2 PHE A 74 -8.102 11.151 19.132 1.00 0.23 H new ATOM 0 HB3 PHE A 74 -6.640 11.090 20.095 1.00 0.23 H new ATOM 0 HD1 PHE A 74 -6.348 13.278 21.677 1.00 62.11 H new ATOM 0 HD2 PHE A 74 -10.048 11.740 20.231 1.00 61.31 H new ATOM 0 HE1 PHE A 74 -7.526 14.368 23.536 1.00 32.32 H new ATOM 0 HE2 PHE A 74 -11.230 12.829 22.089 1.00 62.31 H new ATOM 0 HZ PHE A 74 -9.971 14.151 23.743 1.00 20.42 H new ATOM 1024 N ASP A 75 -5.463 14.541 19.771 1.00 54.45 N ATOM 1025 CA ASP A 75 -4.299 15.171 20.383 1.00 52.23 C ATOM 1026 C ASP A 75 -4.375 15.091 21.904 1.00 31.22 C ATOM 1027 O ASP A 75 -5.333 15.566 22.514 1.00 1.24 O ATOM 1028 CB ASP A 75 -4.192 16.632 19.941 1.00 22.34 C ATOM 1029 CG ASP A 75 -2.872 17.262 20.342 1.00 34.10 C ATOM 1030 OD1 ASP A 75 -1.873 17.057 19.621 1.00 54.01 O ATOM 1031 OD2 ASP A 75 -2.839 17.961 21.376 1.00 30.22 O ATOM 0 H ASP A 75 -6.280 15.147 19.698 1.00 54.45 H new ATOM 0 HA ASP A 75 -3.410 14.634 20.053 1.00 52.23 H new ATOM 0 HB2 ASP A 75 -4.305 16.691 18.858 1.00 22.34 H new ATOM 0 HB3 ASP A 75 -5.011 17.202 20.379 1.00 22.34 H new ATOM 1036 N PHE A 76 -3.360 14.485 22.511 1.00 43.11 N ATOM 1037 CA PHE A 76 -3.312 14.340 23.961 1.00 12.32 C ATOM 1038 C PHE A 76 -2.088 15.045 24.538 1.00 0.03 C ATOM 1039 O PHE A 76 -0.955 14.617 24.323 1.00 5.22 O ATOM 1040 CB PHE A 76 -3.291 12.860 24.347 1.00 73.33 C ATOM 1041 CG PHE A 76 -4.099 12.548 25.574 1.00 55.41 C ATOM 1042 CD1 PHE A 76 -5.463 12.793 25.602 1.00 71.22 C ATOM 1043 CD2 PHE A 76 -3.496 12.011 26.699 1.00 22.12 C ATOM 1044 CE1 PHE A 76 -6.209 12.508 26.730 1.00 22.11 C ATOM 1045 CE2 PHE A 76 -4.237 11.724 27.830 1.00 25.43 C ATOM 1046 CZ PHE A 76 -5.595 11.972 27.845 1.00 31.42 C ATOM 0 H PHE A 76 -2.559 14.086 22.021 1.00 43.11 H new ATOM 0 HA PHE A 76 -4.206 14.804 24.377 1.00 12.32 H new ATOM 0 HB2 PHE A 76 -3.670 12.270 23.513 1.00 73.33 H new ATOM 0 HB3 PHE A 76 -2.259 12.551 24.513 1.00 73.33 H new ATOM 0 HD1 PHE A 76 -5.948 13.211 24.733 1.00 71.22 H new ATOM 0 HD2 PHE A 76 -2.434 11.814 26.693 1.00 22.12 H new ATOM 0 HE1 PHE A 76 -7.271 12.704 26.740 1.00 22.11 H new ATOM 0 HE2 PHE A 76 -3.754 11.306 28.701 1.00 25.43 H new ATOM 0 HZ PHE A 76 -6.176 11.747 28.727 1.00 31.42 H new ATOM 1056 N GLU A 77 -2.327 16.128 25.272 1.00 63.15 N ATOM 1057 CA GLU A 77 -1.244 16.893 25.878 1.00 23.23 C ATOM 1058 C GLU A 77 -1.385 16.925 27.397 1.00 22.14 C ATOM 1059 O GLU A 77 -2.388 17.403 27.929 1.00 65.24 O ATOM 1060 CB GLU A 77 -1.226 18.320 25.327 1.00 61.15 C ATOM 1061 CG GLU A 77 -0.270 19.245 26.061 1.00 31.33 C ATOM 1062 CD GLU A 77 -0.989 20.343 26.820 1.00 41.30 C ATOM 1063 OE1 GLU A 77 -1.671 20.028 27.817 1.00 4.15 O ATOM 1064 OE2 GLU A 77 -0.869 21.519 26.416 1.00 70.14 O ATOM 0 H GLU A 77 -3.260 16.495 25.461 1.00 63.15 H new ATOM 0 HA GLU A 77 -0.303 16.403 25.627 1.00 23.23 H new ATOM 0 HB2 GLU A 77 -0.951 18.290 24.273 1.00 61.15 H new ATOM 0 HB3 GLU A 77 -2.233 18.734 25.382 1.00 61.15 H new ATOM 0 HG2 GLU A 77 0.332 18.661 26.757 1.00 31.33 H new ATOM 0 HG3 GLU A 77 0.418 19.694 25.344 1.00 31.33 H new ATOM 1167 N ARG A 85 3.993 18.345 27.374 1.00 4.11 N ATOM 1168 CA ARG A 85 4.215 17.663 26.105 1.00 41.44 C ATOM 1169 C ARG A 85 2.889 17.302 25.443 1.00 54.04 C ATOM 1170 O ARG A 85 1.876 17.117 26.118 1.00 3.04 O ATOM 1171 CB ARG A 85 5.051 16.400 26.319 1.00 42.32 C ATOM 1172 CG ARG A 85 6.534 16.598 26.047 1.00 34.22 C ATOM 1173 CD ARG A 85 6.860 16.408 24.574 1.00 1.31 C ATOM 1174 NE ARG A 85 8.101 15.663 24.380 1.00 73.30 N ATOM 1175 CZ ARG A 85 9.309 16.192 24.539 1.00 33.32 C ATOM 1176 NH1 ARG A 85 9.438 17.463 24.894 1.00 71.22 N ATOM 1177 NH2 ARG A 85 10.391 15.449 24.344 1.00 33.23 N ATOM 0 HA ARG A 85 4.757 18.342 25.447 1.00 41.44 H new ATOM 0 HB2 ARG A 85 4.921 16.058 27.346 1.00 42.32 H new ATOM 0 HB3 ARG A 85 4.673 15.610 25.670 1.00 42.32 H new ATOM 0 HG2 ARG A 85 6.832 17.598 26.361 1.00 34.22 H new ATOM 0 HG3 ARG A 85 7.112 15.892 26.643 1.00 34.22 H new ATOM 0 HD2 ARG A 85 6.040 15.880 24.086 1.00 1.31 H new ATOM 0 HD3 ARG A 85 6.943 17.382 24.092 1.00 1.31 H new ATOM 0 HE ARG A 85 8.037 14.682 24.107 1.00 73.30 H new ATOM 0 HH11 ARG A 85 8.608 18.037 25.046 1.00 71.22 H new ATOM 0 HH12 ARG A 85 10.367 17.867 25.015 1.00 71.22 H new ATOM 0 HH21 ARG A 85 10.296 14.471 24.072 1.00 33.23 H new ATOM 0 HH22 ARG A 85 11.318 15.856 24.466 1.00 33.23 H new ATOM 1191 N ASP A 86 2.902 17.204 24.118 1.00 60.11 N ATOM 1192 CA ASP A 86 1.701 16.864 23.364 1.00 13.32 C ATOM 1193 C ASP A 86 2.004 15.811 22.303 1.00 23.25 C ATOM 1194 O ASP A 86 2.998 15.908 21.583 1.00 30.30 O ATOM 1195 CB ASP A 86 1.115 18.115 22.706 1.00 22.31 C ATOM 1196 CG ASP A 86 1.821 18.473 21.413 1.00 22.11 C ATOM 1197 OD1 ASP A 86 3.052 18.686 21.448 1.00 75.12 O ATOM 1198 OD2 ASP A 86 1.144 18.539 20.366 1.00 12.34 O ATOM 0 H ASP A 86 3.731 17.355 23.544 1.00 60.11 H new ATOM 0 HA ASP A 86 0.970 16.452 24.060 1.00 13.32 H new ATOM 0 HB2 ASP A 86 0.056 17.954 22.506 1.00 22.31 H new ATOM 0 HB3 ASP A 86 1.185 18.953 23.399 1.00 22.31 H new ATOM 1203 N LYS A 87 1.142 14.804 22.214 1.00 64.44 N ATOM 1204 CA LYS A 87 1.317 13.731 21.241 1.00 11.14 C ATOM 1205 C LYS A 87 -0.011 13.373 20.582 1.00 51.11 C ATOM 1206 O LYS A 87 -1.010 13.135 21.263 1.00 64.44 O ATOM 1207 CB LYS A 87 1.913 12.494 21.917 1.00 14.04 C ATOM 1208 CG LYS A 87 2.187 11.349 20.958 1.00 53.13 C ATOM 1209 CD LYS A 87 3.448 10.593 21.338 1.00 24.30 C ATOM 1210 CE LYS A 87 4.664 11.129 20.598 1.00 62.11 C ATOM 1211 NZ LYS A 87 5.938 10.704 21.242 1.00 13.34 N ATOM 0 H LYS A 87 0.315 14.708 22.804 1.00 64.44 H new ATOM 0 HA LYS A 87 2.003 14.082 20.470 1.00 11.14 H new ATOM 0 HB2 LYS A 87 2.843 12.773 22.411 1.00 14.04 H new ATOM 0 HB3 LYS A 87 1.230 12.150 22.694 1.00 14.04 H new ATOM 0 HG2 LYS A 87 1.339 10.665 20.955 1.00 53.13 H new ATOM 0 HG3 LYS A 87 2.286 11.738 19.945 1.00 53.13 H new ATOM 0 HD2 LYS A 87 3.611 10.672 22.413 1.00 24.30 H new ATOM 0 HD3 LYS A 87 3.321 9.534 21.112 1.00 24.30 H new ATOM 0 HE2 LYS A 87 4.644 10.779 19.566 1.00 62.11 H new ATOM 0 HE3 LYS A 87 4.619 12.218 20.566 1.00 62.11 H new ATOM 0 HZ1 LYS A 87 6.743 11.090 20.708 1.00 13.34 H new ATOM 0 HZ2 LYS A 87 5.969 11.060 22.219 1.00 13.34 H new ATOM 0 HZ3 LYS A 87 5.994 9.666 21.250 1.00 13.34 H new ATOM 1225 N LEU A 88 -0.016 13.336 19.254 1.00 22.10 N ATOM 1226 CA LEU A 88 -1.221 13.005 18.502 1.00 14.12 C ATOM 1227 C LEU A 88 -1.198 11.549 18.049 1.00 31.21 C ATOM 1228 O LEU A 88 -0.201 11.074 17.505 1.00 70.14 O ATOM 1229 CB LEU A 88 -1.358 13.926 17.289 1.00 53.42 C ATOM 1230 CG LEU A 88 -2.709 14.624 17.124 1.00 33.55 C ATOM 1231 CD1 LEU A 88 -2.570 15.858 16.247 1.00 61.20 C ATOM 1232 CD2 LEU A 88 -3.737 13.665 16.540 1.00 24.22 C ATOM 0 H LEU A 88 0.801 13.531 18.676 1.00 22.10 H new ATOM 0 HA LEU A 88 -2.079 13.148 19.158 1.00 14.12 H new ATOM 0 HB2 LEU A 88 -0.582 14.689 17.348 1.00 53.42 H new ATOM 0 HB3 LEU A 88 -1.162 13.341 16.390 1.00 53.42 H new ATOM 0 HG LEU A 88 -3.055 14.941 18.108 1.00 33.55 H new ATOM 0 HD11 LEU A 88 -3.542 16.341 16.141 1.00 61.20 H new ATOM 0 HD12 LEU A 88 -1.867 16.553 16.706 1.00 61.20 H new ATOM 0 HD13 LEU A 88 -2.201 15.566 15.264 1.00 61.20 H new ATOM 0 HD21 LEU A 88 -4.692 14.179 16.430 1.00 24.22 H new ATOM 0 HD22 LEU A 88 -3.397 13.317 15.565 1.00 24.22 H new ATOM 0 HD23 LEU A 88 -3.859 12.812 17.207 1.00 24.22 H new ATOM 1244 N ILE A 89 -2.303 10.846 18.276 1.00 40.42 N ATOM 1245 CA ILE A 89 -2.410 9.445 17.888 1.00 50.52 C ATOM 1246 C ILE A 89 -3.471 9.253 16.809 1.00 3.32 C ATOM 1247 O ILE A 89 -4.465 9.979 16.764 1.00 31.14 O ATOM 1248 CB ILE A 89 -2.753 8.552 19.094 1.00 31.23 C ATOM 1249 CG1 ILE A 89 -1.834 8.876 20.274 1.00 34.32 C ATOM 1250 CG2 ILE A 89 -2.639 7.083 18.715 1.00 70.12 C ATOM 1251 CD1 ILE A 89 -2.460 9.806 21.290 1.00 72.14 C ATOM 0 H ILE A 89 -3.136 11.224 18.727 1.00 40.42 H new ATOM 0 HA ILE A 89 -1.437 9.151 17.494 1.00 50.52 H new ATOM 0 HB ILE A 89 -3.782 8.751 19.394 1.00 31.23 H new ATOM 0 HG12 ILE A 89 -1.551 7.947 20.769 1.00 34.32 H new ATOM 0 HG13 ILE A 89 -0.917 9.328 19.896 1.00 34.32 H new ATOM 0 HG21 ILE A 89 -2.885 6.464 19.578 1.00 70.12 H new ATOM 0 HG22 ILE A 89 -3.331 6.862 17.902 1.00 70.12 H new ATOM 0 HG23 ILE A 89 -1.620 6.868 18.393 1.00 70.12 H new ATOM 0 HD11 ILE A 89 -1.752 9.992 22.098 1.00 72.14 H new ATOM 0 HD12 ILE A 89 -2.718 10.750 20.809 1.00 72.14 H new ATOM 0 HD13 ILE A 89 -3.362 9.348 21.696 1.00 72.14 H new ATOM 1263 N LEU A 90 -3.254 8.270 15.942 1.00 5.53 N ATOM 1264 CA LEU A 90 -4.192 7.980 14.864 1.00 41.43 C ATOM 1265 C LEU A 90 -4.759 6.571 14.999 1.00 22.24 C ATOM 1266 O LEU A 90 -4.019 5.587 14.961 1.00 42.45 O ATOM 1267 CB LEU A 90 -3.504 8.137 13.507 1.00 42.15 C ATOM 1268 CG LEU A 90 -4.376 7.876 12.278 1.00 44.12 C ATOM 1269 CD1 LEU A 90 -4.142 8.944 11.221 1.00 41.42 C ATOM 1270 CD2 LEU A 90 -4.097 6.492 11.710 1.00 31.14 C ATOM 0 H LEU A 90 -2.436 7.660 15.965 1.00 5.53 H new ATOM 0 HA LEU A 90 -5.016 8.691 14.932 1.00 41.43 H new ATOM 0 HB2 LEU A 90 -3.108 9.150 13.438 1.00 42.15 H new ATOM 0 HB3 LEU A 90 -2.652 7.458 13.474 1.00 42.15 H new ATOM 0 HG LEU A 90 -5.422 7.918 12.583 1.00 44.12 H new ATOM 0 HD11 LEU A 90 -4.771 8.742 10.354 1.00 41.42 H new ATOM 0 HD12 LEU A 90 -4.393 9.922 11.631 1.00 41.42 H new ATOM 0 HD13 LEU A 90 -3.095 8.934 10.920 1.00 41.42 H new ATOM 0 HD21 LEU A 90 -4.726 6.324 10.836 1.00 31.14 H new ATOM 0 HD22 LEU A 90 -3.048 6.422 11.421 1.00 31.14 H new ATOM 0 HD23 LEU A 90 -4.316 5.738 12.466 1.00 31.14 H new ATOM 1282 N ILE A 91 -6.075 6.481 15.157 1.00 71.23 N ATOM 1283 CA ILE A 91 -6.741 5.191 15.295 1.00 40.55 C ATOM 1284 C ILE A 91 -7.731 4.960 14.158 1.00 63.42 C ATOM 1285 O ILE A 91 -8.558 5.820 13.856 1.00 45.13 O ATOM 1286 CB ILE A 91 -7.485 5.083 16.638 1.00 14.24 C ATOM 1287 CG1 ILE A 91 -6.514 5.289 17.802 1.00 1.05 C ATOM 1288 CG2 ILE A 91 -8.179 3.734 16.752 1.00 20.15 C ATOM 1289 CD1 ILE A 91 -6.487 6.709 18.323 1.00 45.13 C ATOM 0 H ILE A 91 -6.701 7.285 15.193 1.00 71.23 H new ATOM 0 HA ILE A 91 -5.963 4.428 15.258 1.00 40.55 H new ATOM 0 HB ILE A 91 -8.244 5.865 16.680 1.00 14.24 H new ATOM 0 HG12 ILE A 91 -6.787 4.617 18.616 1.00 1.05 H new ATOM 0 HG13 ILE A 91 -5.511 5.009 17.481 1.00 1.05 H new ATOM 0 HG21 ILE A 91 -8.701 3.673 17.707 1.00 20.15 H new ATOM 0 HG22 ILE A 91 -8.897 3.624 15.939 1.00 20.15 H new ATOM 0 HG23 ILE A 91 -7.438 2.937 16.692 1.00 20.15 H new ATOM 0 HD11 ILE A 91 -5.777 6.781 19.147 1.00 45.13 H new ATOM 0 HD12 ILE A 91 -6.184 7.384 17.523 1.00 45.13 H new ATOM 0 HD13 ILE A 91 -7.481 6.986 18.675 1.00 45.13 H new ATOM 1301 N SER A 92 -7.641 3.790 13.532 1.00 14.31 N ATOM 1302 CA SER A 92 -8.528 3.445 12.427 1.00 41.21 C ATOM 1303 C SER A 92 -9.642 2.514 12.895 1.00 53.23 C ATOM 1304 O SER A 92 -9.385 1.484 13.518 1.00 43.40 O ATOM 1305 CB SER A 92 -7.736 2.784 11.297 1.00 22.24 C ATOM 1306 OG SER A 92 -8.467 2.800 10.084 1.00 54.21 O ATOM 0 H SER A 92 -6.963 3.066 13.771 1.00 14.31 H new ATOM 0 HA SER A 92 -8.979 4.365 12.055 1.00 41.21 H new ATOM 0 HB2 SER A 92 -6.788 3.304 11.161 1.00 22.24 H new ATOM 0 HB3 SER A 92 -7.499 1.755 11.569 1.00 22.24 H new ATOM 0 HG SER A 92 -9.272 2.250 10.180 1.00 54.21 H new ATOM 1312 N TRP A 93 -10.881 2.884 12.589 1.00 4.33 N ATOM 1313 CA TRP A 93 -12.036 2.083 12.978 1.00 25.12 C ATOM 1314 C TRP A 93 -12.738 1.509 11.752 1.00 3.45 C ATOM 1315 O TRP A 93 -13.296 2.249 10.943 1.00 32.23 O ATOM 1316 CB TRP A 93 -13.016 2.927 13.795 1.00 61.42 C ATOM 1317 CG TRP A 93 -13.913 2.110 14.674 1.00 34.51 C ATOM 1318 CD1 TRP A 93 -13.530 1.236 15.651 1.00 4.23 C ATOM 1319 CD2 TRP A 93 -15.345 2.089 14.654 1.00 21.32 C ATOM 1320 NE1 TRP A 93 -14.636 0.674 16.240 1.00 33.42 N ATOM 1321 CE2 TRP A 93 -15.762 1.181 15.647 1.00 31.31 C ATOM 1322 CE3 TRP A 93 -16.315 2.750 13.896 1.00 23.01 C ATOM 1323 CZ2 TRP A 93 -17.106 0.919 15.898 1.00 32.52 C ATOM 1324 CZ3 TRP A 93 -17.648 2.488 14.146 1.00 13.53 C ATOM 1325 CH2 TRP A 93 -18.034 1.580 15.141 1.00 74.02 C ATOM 0 H TRP A 93 -11.111 3.733 12.073 1.00 4.33 H new ATOM 0 HA TRP A 93 -11.683 1.254 13.592 1.00 25.12 H new ATOM 0 HB2 TRP A 93 -12.454 3.628 14.413 1.00 61.42 H new ATOM 0 HB3 TRP A 93 -13.627 3.521 13.115 1.00 61.42 H new ATOM 0 HD1 TRP A 93 -12.507 1.019 15.921 1.00 4.23 H new ATOM 0 HE1 TRP A 93 -14.621 -0.010 16.996 1.00 33.42 H new ATOM 0 HE3 TRP A 93 -16.028 3.453 13.128 1.00 23.01 H new ATOM 0 HZ2 TRP A 93 -17.405 0.218 16.663 1.00 32.52 H new ATOM 0 HZ3 TRP A 93 -18.406 2.992 13.564 1.00 13.53 H new ATOM 0 HH2 TRP A 93 -19.085 1.399 15.314 1.00 74.02 H new ATOM 1336 N ASN A 94 -12.706 0.187 11.622 1.00 44.10 N ATOM 1337 CA ASN A 94 -13.339 -0.485 10.494 1.00 74.24 C ATOM 1338 C ASN A 94 -13.093 -1.990 10.548 1.00 2.24 C ATOM 1339 O ASN A 94 -12.103 -2.462 11.108 1.00 43.33 O ATOM 1340 CB ASN A 94 -12.812 0.082 9.174 1.00 72.42 C ATOM 1341 CG ASN A 94 -11.337 0.428 9.242 1.00 54.15 C ATOM 1342 OD1 ASN A 94 -10.957 1.595 9.142 1.00 33.13 O ATOM 1343 ND2 ASN A 94 -10.498 -0.587 9.411 1.00 74.20 N ATOM 0 H ASN A 94 -12.248 -0.440 12.284 1.00 44.10 H new ATOM 0 HA ASN A 94 -14.413 -0.308 10.555 1.00 74.24 H new ATOM 0 HB2 ASN A 94 -12.976 -0.645 8.378 1.00 72.42 H new ATOM 0 HB3 ASN A 94 -13.380 0.975 8.912 1.00 72.42 H new ATOM 0 HD21 ASN A 94 -9.494 -0.415 9.463 1.00 74.20 H new ATOM 0 HD22 ASN A 94 -10.858 -1.538 9.489 1.00 74.20 H new ATOM 1350 N PRO A 95 -14.014 -2.762 9.954 1.00 62.45 N ATOM 1351 CA PRO A 95 -13.918 -4.225 9.920 1.00 51.22 C ATOM 1352 C PRO A 95 -12.787 -4.711 9.020 1.00 30.11 C ATOM 1353 O PRO A 95 -12.651 -4.263 7.881 1.00 23.54 O ATOM 1354 CB PRO A 95 -15.274 -4.656 9.355 1.00 62.13 C ATOM 1355 CG PRO A 95 -15.742 -3.487 8.559 1.00 42.21 C ATOM 1356 CD PRO A 95 -15.219 -2.268 9.268 1.00 53.25 C ATOM 0 HA PRO A 95 -13.698 -4.642 10.903 1.00 51.22 H new ATOM 0 HB2 PRO A 95 -15.179 -5.546 8.733 1.00 62.13 H new ATOM 0 HB3 PRO A 95 -15.976 -4.898 10.153 1.00 62.13 H new ATOM 0 HG2 PRO A 95 -15.367 -3.535 7.537 1.00 42.21 H new ATOM 0 HG3 PRO A 95 -16.830 -3.466 8.498 1.00 42.21 H new ATOM 0 HD2 PRO A 95 -14.983 -1.467 8.568 1.00 53.25 H new ATOM 0 HD3 PRO A 95 -15.948 -1.870 9.974 1.00 53.25 H new ATOM 1364 N ASP A 96 -11.979 -5.629 9.538 1.00 62.51 N ATOM 1365 CA ASP A 96 -10.860 -6.178 8.780 1.00 1.14 C ATOM 1366 C ASP A 96 -11.355 -6.947 7.560 1.00 72.14 C ATOM 1367 O ASP A 96 -10.772 -6.858 6.479 1.00 33.11 O ATOM 1368 CB ASP A 96 -10.016 -7.094 9.668 1.00 44.12 C ATOM 1369 CG ASP A 96 -8.912 -6.345 10.388 1.00 23.13 C ATOM 1370 OD1 ASP A 96 -8.882 -5.100 10.296 1.00 23.31 O ATOM 1371 OD2 ASP A 96 -8.077 -7.004 11.044 1.00 71.04 O ATOM 0 H ASP A 96 -12.078 -6.009 10.479 1.00 62.51 H new ATOM 0 HA ASP A 96 -10.243 -5.347 8.437 1.00 1.14 H new ATOM 0 HB2 ASP A 96 -10.660 -7.579 10.401 1.00 44.12 H new ATOM 0 HB3 ASP A 96 -9.577 -7.884 9.058 1.00 44.12 H new ATOM 1376 N SER A 97 -12.434 -7.703 7.740 1.00 5.12 N ATOM 1377 CA SER A 97 -13.004 -8.492 6.655 1.00 55.22 C ATOM 1378 C SER A 97 -14.136 -7.732 5.968 1.00 65.51 C ATOM 1379 O SER A 97 -14.910 -8.307 5.204 1.00 31.23 O ATOM 1380 CB SER A 97 -13.522 -9.830 7.186 1.00 13.22 C ATOM 1381 OG SER A 97 -12.587 -10.868 6.951 1.00 30.24 O ATOM 0 H SER A 97 -12.931 -7.785 8.627 1.00 5.12 H new ATOM 0 HA SER A 97 -12.218 -8.680 5.923 1.00 55.22 H new ATOM 0 HB2 SER A 97 -13.719 -9.749 8.255 1.00 13.22 H new ATOM 0 HB3 SER A 97 -14.469 -10.074 6.705 1.00 13.22 H new ATOM 0 HG SER A 97 -12.941 -11.712 7.301 1.00 30.24 H new ATOM 1387 N GLY A 98 -14.224 -6.435 6.246 1.00 24.23 N ATOM 1388 CA GLY A 98 -15.262 -5.617 5.648 1.00 33.11 C ATOM 1389 C GLY A 98 -15.298 -5.739 4.138 1.00 54.14 C ATOM 1390 O GLY A 98 -15.990 -6.600 3.594 1.00 4.30 O ATOM 0 H GLY A 98 -13.595 -5.936 6.875 1.00 24.23 H new ATOM 0 HA2 GLY A 98 -16.230 -5.908 6.056 1.00 33.11 H new ATOM 0 HA3 GLY A 98 -15.101 -4.574 5.921 1.00 33.11 H new ATOM 1394 N ALA A 99 -14.553 -4.874 3.458 1.00 52.42 N ATOM 1395 CA ALA A 99 -14.503 -4.888 2.001 1.00 24.41 C ATOM 1396 C ALA A 99 -13.062 -4.908 1.502 1.00 2.21 C ATOM 1397 O ALA A 99 -12.126 -4.552 2.219 1.00 72.00 O ATOM 1398 CB ALA A 99 -15.243 -3.686 1.435 1.00 11.21 C ATOM 0 H ALA A 99 -13.976 -4.154 3.893 1.00 52.42 H new ATOM 0 HA ALA A 99 -14.993 -5.798 1.654 1.00 24.41 H new ATOM 0 HB1 ALA A 99 -15.197 -3.710 0.346 1.00 11.21 H new ATOM 0 HB2 ALA A 99 -16.285 -3.716 1.755 1.00 11.21 H new ATOM 0 HB3 ALA A 99 -14.779 -2.769 1.798 1.00 11.21 H new ATOM 1404 N PRO A 100 -12.876 -5.334 0.244 1.00 52.53 N ATOM 1405 CA PRO A 100 -11.551 -5.410 -0.379 1.00 14.40 C ATOM 1406 C PRO A 100 -10.960 -4.031 -0.654 1.00 72.22 C ATOM 1407 O PRO A 100 -9.797 -3.772 -0.346 1.00 0.54 O ATOM 1408 CB PRO A 100 -11.819 -6.149 -1.693 1.00 3.35 C ATOM 1409 CG PRO A 100 -13.250 -5.873 -1.998 1.00 15.31 C ATOM 1410 CD PRO A 100 -13.946 -5.773 -0.668 1.00 43.12 C ATOM 0 HA PRO A 100 -10.825 -5.907 0.265 1.00 14.40 H new ATOM 0 HB2 PRO A 100 -11.168 -5.789 -2.490 1.00 3.35 H new ATOM 0 HB3 PRO A 100 -11.635 -7.218 -1.590 1.00 3.35 H new ATOM 0 HG2 PRO A 100 -13.357 -4.948 -2.565 1.00 15.31 H new ATOM 0 HG3 PRO A 100 -13.680 -6.670 -2.605 1.00 15.31 H new ATOM 0 HD2 PRO A 100 -14.768 -5.058 -0.697 1.00 43.12 H new ATOM 0 HD3 PRO A 100 -14.367 -6.730 -0.362 1.00 43.12 H new ATOM 1418 N ARG A 101 -11.768 -3.151 -1.236 1.00 35.13 N ATOM 1419 CA ARG A 101 -11.324 -1.799 -1.553 1.00 34.11 C ATOM 1420 C ARG A 101 -11.082 -0.994 -0.280 1.00 13.33 C ATOM 1421 O ARG A 101 -10.127 -0.221 -0.192 1.00 72.14 O ATOM 1422 CB ARG A 101 -12.361 -1.091 -2.428 1.00 24.13 C ATOM 1423 CG ARG A 101 -12.680 -1.834 -3.715 1.00 14.42 C ATOM 1424 CD ARG A 101 -11.560 -1.691 -4.733 1.00 54.55 C ATOM 1425 NE ARG A 101 -11.352 -2.920 -5.495 1.00 14.55 N ATOM 1426 CZ ARG A 101 -10.338 -3.102 -6.333 1.00 32.13 C ATOM 1427 NH1 ARG A 101 -9.444 -2.141 -6.516 1.00 50.51 N ATOM 1428 NH2 ARG A 101 -10.217 -4.249 -6.989 1.00 43.22 N ATOM 0 H ARG A 101 -12.734 -3.350 -1.498 1.00 35.13 H new ATOM 0 HA ARG A 101 -10.384 -1.871 -2.101 1.00 34.11 H new ATOM 0 HB2 ARG A 101 -13.280 -0.962 -1.856 1.00 24.13 H new ATOM 0 HB3 ARG A 101 -11.996 -0.094 -2.675 1.00 24.13 H new ATOM 0 HG2 ARG A 101 -12.842 -2.890 -3.496 1.00 14.42 H new ATOM 0 HG3 ARG A 101 -13.608 -1.450 -4.138 1.00 14.42 H new ATOM 0 HD2 ARG A 101 -11.794 -0.876 -5.417 1.00 54.55 H new ATOM 0 HD3 ARG A 101 -10.637 -1.422 -4.220 1.00 54.55 H new ATOM 0 HE ARG A 101 -12.022 -3.680 -5.377 1.00 14.55 H new ATOM 0 HH11 ARG A 101 -9.534 -1.258 -6.012 1.00 50.51 H new ATOM 0 HH12 ARG A 101 -8.666 -2.284 -7.160 1.00 50.51 H new ATOM 0 HH21 ARG A 101 -10.903 -4.991 -6.850 1.00 43.22 H new ATOM 0 HH22 ARG A 101 -9.438 -4.389 -7.633 1.00 43.22 H new ATOM 1442 N THR A 102 -11.954 -1.179 0.707 1.00 53.14 N ATOM 1443 CA THR A 102 -11.837 -0.469 1.974 1.00 22.10 C ATOM 1444 C THR A 102 -10.584 -0.896 2.729 1.00 24.44 C ATOM 1445 O THR A 102 -9.910 -0.074 3.351 1.00 20.50 O ATOM 1446 CB THR A 102 -13.068 -0.708 2.868 1.00 31.41 C ATOM 1447 OG1 THR A 102 -13.321 -2.113 2.988 1.00 52.33 O ATOM 1448 CG2 THR A 102 -14.295 -0.014 2.297 1.00 41.31 C ATOM 0 H THR A 102 -12.749 -1.815 0.652 1.00 53.14 H new ATOM 0 HA THR A 102 -11.771 0.593 1.737 1.00 22.10 H new ATOM 0 HB THR A 102 -12.860 -0.291 3.853 1.00 31.41 H new ATOM 0 HG1 THR A 102 -12.965 -2.438 3.841 1.00 52.33 H new ATOM 0 HG21 THR A 102 -15.152 -0.197 2.946 1.00 41.31 H new ATOM 0 HG22 THR A 102 -14.110 1.058 2.234 1.00 41.31 H new ATOM 0 HG23 THR A 102 -14.504 -0.405 1.301 1.00 41.31 H new ATOM 1456 N LYS A 103 -10.275 -2.188 2.672 1.00 50.54 N ATOM 1457 CA LYS A 103 -9.101 -2.725 3.349 1.00 62.14 C ATOM 1458 C LYS A 103 -7.818 -2.218 2.698 1.00 42.11 C ATOM 1459 O LYS A 103 -6.906 -1.755 3.382 1.00 45.33 O ATOM 1460 CB LYS A 103 -9.128 -4.255 3.323 1.00 21.01 C ATOM 1461 CG LYS A 103 -7.798 -4.893 3.687 1.00 14.03 C ATOM 1462 CD LYS A 103 -7.347 -4.484 5.079 1.00 25.33 C ATOM 1463 CE LYS A 103 -6.795 -5.670 5.857 1.00 53.33 C ATOM 1464 NZ LYS A 103 -5.809 -5.246 6.889 1.00 52.10 N ATOM 0 H LYS A 103 -10.822 -2.882 2.163 1.00 50.54 H new ATOM 0 HA LYS A 103 -9.122 -2.384 4.384 1.00 62.14 H new ATOM 0 HB2 LYS A 103 -9.892 -4.608 4.015 1.00 21.01 H new ATOM 0 HB3 LYS A 103 -9.421 -4.588 2.327 1.00 21.01 H new ATOM 0 HG2 LYS A 103 -7.888 -5.978 3.637 1.00 14.03 H new ATOM 0 HG3 LYS A 103 -7.042 -4.602 2.958 1.00 14.03 H new ATOM 0 HD2 LYS A 103 -6.583 -3.710 5.002 1.00 25.33 H new ATOM 0 HD3 LYS A 103 -8.187 -4.050 5.622 1.00 25.33 H new ATOM 0 HE2 LYS A 103 -7.616 -6.203 6.336 1.00 53.33 H new ATOM 0 HE3 LYS A 103 -6.321 -6.368 5.167 1.00 53.33 H new ATOM 0 HZ1 LYS A 103 -5.457 -6.082 7.397 1.00 52.10 H new ATOM 0 HZ2 LYS A 103 -5.013 -4.759 6.429 1.00 52.10 H new ATOM 0 HZ3 LYS A 103 -6.268 -4.600 7.563 1.00 52.10 H new ATOM 1478 N MET A 104 -7.756 -2.308 1.373 1.00 1.34 N ATOM 1479 CA MET A 104 -6.585 -1.855 0.631 1.00 12.11 C ATOM 1480 C MET A 104 -6.476 -0.334 0.663 1.00 3.23 C ATOM 1481 O MET A 104 -5.377 0.221 0.615 1.00 20.24 O ATOM 1482 CB MET A 104 -6.653 -2.342 -0.817 1.00 73.45 C ATOM 1483 CG MET A 104 -5.396 -3.063 -1.276 1.00 20.21 C ATOM 1484 SD MET A 104 -5.742 -4.691 -1.970 1.00 14.11 S ATOM 1485 CE MET A 104 -4.113 -5.171 -2.536 1.00 64.43 C ATOM 0 H MET A 104 -8.502 -2.690 0.792 1.00 1.34 H new ATOM 0 HA MET A 104 -5.699 -2.275 1.107 1.00 12.11 H new ATOM 0 HB2 MET A 104 -7.506 -3.011 -0.927 1.00 73.45 H new ATOM 0 HB3 MET A 104 -6.831 -1.488 -1.471 1.00 73.45 H new ATOM 0 HG2 MET A 104 -4.886 -2.455 -2.023 1.00 20.21 H new ATOM 0 HG3 MET A 104 -4.714 -3.170 -0.432 1.00 20.21 H new ATOM 0 HE1 MET A 104 -4.163 -6.160 -2.991 1.00 64.43 H new ATOM 0 HE2 MET A 104 -3.757 -4.450 -3.272 1.00 64.43 H new ATOM 0 HE3 MET A 104 -3.426 -5.195 -1.690 1.00 64.43 H new ATOM 1495 N LEU A 105 -7.620 0.335 0.744 1.00 13.54 N ATOM 1496 CA LEU A 105 -7.653 1.793 0.783 1.00 50.41 C ATOM 1497 C LEU A 105 -6.784 2.328 1.917 1.00 63.15 C ATOM 1498 O LEU A 105 -6.231 3.424 1.824 1.00 5.14 O ATOM 1499 CB LEU A 105 -9.091 2.287 0.952 1.00 71.34 C ATOM 1500 CG LEU A 105 -9.798 2.744 -0.325 1.00 31.32 C ATOM 1501 CD1 LEU A 105 -11.225 3.172 -0.021 1.00 34.54 C ATOM 1502 CD2 LEU A 105 -9.028 3.879 -0.984 1.00 31.03 C ATOM 0 H LEU A 105 -8.538 -0.109 0.784 1.00 13.54 H new ATOM 0 HA LEU A 105 -7.256 2.165 -0.161 1.00 50.41 H new ATOM 0 HB2 LEU A 105 -9.678 1.487 1.402 1.00 71.34 H new ATOM 0 HB3 LEU A 105 -9.088 3.117 1.659 1.00 71.34 H new ATOM 0 HG LEU A 105 -9.832 1.904 -1.019 1.00 31.32 H new ATOM 0 HD11 LEU A 105 -11.712 3.494 -0.941 1.00 34.54 H new ATOM 0 HD12 LEU A 105 -11.774 2.332 0.406 1.00 34.54 H new ATOM 0 HD13 LEU A 105 -11.213 3.997 0.691 1.00 34.54 H new ATOM 0 HD21 LEU A 105 -9.546 4.191 -1.891 1.00 31.03 H new ATOM 0 HD22 LEU A 105 -8.962 4.722 -0.296 1.00 31.03 H new ATOM 0 HD23 LEU A 105 -8.024 3.538 -1.238 1.00 31.03 H new ATOM 1514 N TYR A 106 -6.666 1.546 2.984 1.00 71.02 N ATOM 1515 CA TYR A 106 -5.864 1.941 4.136 1.00 60.53 C ATOM 1516 C TYR A 106 -4.383 1.998 3.774 1.00 22.14 C ATOM 1517 O TYR A 106 -3.692 2.966 4.091 1.00 52.43 O ATOM 1518 CB TYR A 106 -6.081 0.964 5.293 1.00 4.10 C ATOM 1519 CG TYR A 106 -5.128 1.173 6.448 1.00 1.53 C ATOM 1520 CD1 TYR A 106 -3.905 0.516 6.493 1.00 24.13 C ATOM 1521 CD2 TYR A 106 -5.451 2.028 7.495 1.00 31.32 C ATOM 1522 CE1 TYR A 106 -3.031 0.703 7.547 1.00 11.41 C ATOM 1523 CE2 TYR A 106 -4.583 2.223 8.552 1.00 33.51 C ATOM 1524 CZ TYR A 106 -3.375 1.558 8.574 1.00 42.03 C ATOM 1525 OH TYR A 106 -2.508 1.748 9.626 1.00 52.34 O ATOM 0 H TYR A 106 -7.115 0.635 3.075 1.00 71.02 H new ATOM 0 HA TYR A 106 -6.182 2.937 4.445 1.00 60.53 H new ATOM 0 HB2 TYR A 106 -7.104 1.064 5.655 1.00 4.10 H new ATOM 0 HB3 TYR A 106 -5.972 -0.055 4.922 1.00 4.10 H new ATOM 0 HD1 TYR A 106 -3.632 -0.153 5.690 1.00 24.13 H new ATOM 0 HD2 TYR A 106 -6.397 2.549 7.482 1.00 31.32 H new ATOM 0 HE1 TYR A 106 -2.085 0.183 7.567 1.00 11.41 H new ATOM 0 HE2 TYR A 106 -4.849 2.893 9.357 1.00 33.51 H new ATOM 0 HH TYR A 106 -2.901 2.380 10.264 1.00 52.34 H new ATOM 1535 N SER A 107 -3.902 0.953 3.109 1.00 70.33 N ATOM 1536 CA SER A 107 -2.502 0.881 2.706 1.00 74.01 C ATOM 1537 C SER A 107 -2.206 1.879 1.591 1.00 10.51 C ATOM 1538 O SER A 107 -1.199 2.587 1.628 1.00 54.11 O ATOM 1539 CB SER A 107 -2.155 -0.535 2.243 1.00 23.33 C ATOM 1540 OG SER A 107 -1.342 -1.198 3.196 1.00 2.03 O ATOM 0 H SER A 107 -4.461 0.144 2.838 1.00 70.33 H new ATOM 0 HA SER A 107 -1.887 1.134 3.570 1.00 74.01 H new ATOM 0 HB2 SER A 107 -3.071 -1.104 2.083 1.00 23.33 H new ATOM 0 HB3 SER A 107 -1.636 -0.491 1.285 1.00 23.33 H new ATOM 0 HG SER A 107 -1.135 -2.102 2.878 1.00 2.03 H new ATOM 1546 N SER A 108 -3.091 1.930 0.600 1.00 4.33 N ATOM 1547 CA SER A 108 -2.923 2.839 -0.528 1.00 71.30 C ATOM 1548 C SER A 108 -2.789 4.281 -0.049 1.00 23.00 C ATOM 1549 O SER A 108 -2.199 5.120 -0.730 1.00 11.45 O ATOM 1550 CB SER A 108 -4.108 2.717 -1.488 1.00 62.34 C ATOM 1551 OG SER A 108 -4.087 1.474 -2.169 1.00 30.35 O ATOM 0 H SER A 108 -3.931 1.353 0.556 1.00 4.33 H new ATOM 0 HA SER A 108 -2.008 2.563 -1.053 1.00 71.30 H new ATOM 0 HB2 SER A 108 -5.041 2.816 -0.933 1.00 62.34 H new ATOM 0 HB3 SER A 108 -4.080 3.532 -2.211 1.00 62.34 H new ATOM 0 HG SER A 108 -4.855 1.420 -2.775 1.00 30.35 H new ATOM 1557 N SER A 109 -3.340 4.561 1.128 1.00 72.15 N ATOM 1558 CA SER A 109 -3.286 5.902 1.697 1.00 11.14 C ATOM 1559 C SER A 109 -2.204 5.994 2.769 1.00 32.43 C ATOM 1560 O SER A 109 -1.711 7.079 3.078 1.00 71.41 O ATOM 1561 CB SER A 109 -4.643 6.281 2.293 1.00 53.31 C ATOM 1562 OG SER A 109 -4.633 6.158 3.705 1.00 73.04 O ATOM 0 H SER A 109 -3.829 3.877 1.706 1.00 72.15 H new ATOM 0 HA SER A 109 -3.041 6.600 0.896 1.00 11.14 H new ATOM 0 HB2 SER A 109 -4.892 7.305 2.016 1.00 53.31 H new ATOM 0 HB3 SER A 109 -5.419 5.640 1.875 1.00 53.31 H new ATOM 0 HG SER A 109 -5.428 5.664 3.996 1.00 73.04 H new ATOM 1568 N ARG A 110 -1.840 4.847 3.333 1.00 33.52 N ATOM 1569 CA ARG A 110 -0.818 4.796 4.371 1.00 11.15 C ATOM 1570 C ARG A 110 0.485 5.421 3.882 1.00 0.43 C ATOM 1571 O ARG A 110 1.170 6.119 4.631 1.00 73.02 O ATOM 1572 CB ARG A 110 -0.571 3.350 4.804 1.00 33.41 C ATOM 1573 CG ARG A 110 -0.214 3.206 6.274 1.00 2.34 C ATOM 1574 CD ARG A 110 0.537 1.911 6.541 1.00 10.14 C ATOM 1575 NE ARG A 110 0.771 1.698 7.967 1.00 1.12 N ATOM 1576 CZ ARG A 110 1.189 0.546 8.479 1.00 21.12 C ATOM 1577 NH1 ARG A 110 1.418 -0.492 7.686 1.00 1.40 N ATOM 1578 NH2 ARG A 110 1.379 0.430 9.787 1.00 23.13 N ATOM 0 H ARG A 110 -2.238 3.940 3.088 1.00 33.52 H new ATOM 0 HA ARG A 110 -1.177 5.368 5.227 1.00 11.15 H new ATOM 0 HB2 ARG A 110 -1.464 2.760 4.596 1.00 33.41 H new ATOM 0 HB3 ARG A 110 0.235 2.932 4.201 1.00 33.41 H new ATOM 0 HG2 ARG A 110 0.397 4.053 6.586 1.00 2.34 H new ATOM 0 HG3 ARG A 110 -1.123 3.231 6.874 1.00 2.34 H new ATOM 0 HD2 ARG A 110 -0.031 1.073 6.138 1.00 10.14 H new ATOM 0 HD3 ARG A 110 1.492 1.931 6.016 1.00 10.14 H new ATOM 0 HE ARG A 110 0.604 2.477 8.604 1.00 1.12 H new ATOM 0 HH11 ARG A 110 1.273 -0.407 6.680 1.00 1.40 H new ATOM 0 HH12 ARG A 110 1.739 -1.375 8.082 1.00 1.40 H new ATOM 0 HH21 ARG A 110 1.204 1.226 10.400 1.00 23.13 H new ATOM 0 HH22 ARG A 110 1.700 -0.455 10.179 1.00 23.13 H new ATOM 1592 N ASP A 111 0.821 5.166 2.623 1.00 43.12 N ATOM 1593 CA ASP A 111 2.042 5.704 2.033 1.00 12.12 C ATOM 1594 C ASP A 111 2.039 7.229 2.075 1.00 50.02 C ATOM 1595 O ASP A 111 3.047 7.853 2.406 1.00 60.54 O ATOM 1596 CB ASP A 111 2.192 5.221 0.590 1.00 41.22 C ATOM 1597 CG ASP A 111 3.270 4.166 0.442 1.00 64.23 C ATOM 1598 OD1 ASP A 111 4.463 4.536 0.408 1.00 51.14 O ATOM 1599 OD2 ASP A 111 2.922 2.970 0.361 1.00 61.42 O ATOM 0 H ASP A 111 0.265 4.590 1.991 1.00 43.12 H new ATOM 0 HA ASP A 111 2.889 5.344 2.618 1.00 12.12 H new ATOM 0 HB2 ASP A 111 1.241 4.815 0.245 1.00 41.22 H new ATOM 0 HB3 ASP A 111 2.428 6.070 -0.052 1.00 41.22 H new ATOM 1604 N ALA A 112 0.899 7.823 1.736 1.00 44.01 N ATOM 1605 CA ALA A 112 0.765 9.274 1.735 1.00 2.55 C ATOM 1606 C ALA A 112 0.553 9.807 3.149 1.00 64.43 C ATOM 1607 O ALA A 112 0.829 10.973 3.432 1.00 42.33 O ATOM 1608 CB ALA A 112 -0.384 9.698 0.832 1.00 24.02 C ATOM 0 H ALA A 112 0.055 7.321 1.459 1.00 44.01 H new ATOM 0 HA ALA A 112 1.692 9.699 1.349 1.00 2.55 H new ATOM 0 HB1 ALA A 112 -0.472 10.784 0.841 1.00 24.02 H new ATOM 0 HB2 ALA A 112 -0.192 9.358 -0.186 1.00 24.02 H new ATOM 0 HB3 ALA A 112 -1.313 9.256 1.193 1.00 24.02 H new ATOM 1614 N LEU A 113 0.062 8.945 4.033 1.00 53.45 N ATOM 1615 CA LEU A 113 -0.188 9.329 5.418 1.00 50.24 C ATOM 1616 C LEU A 113 1.086 9.226 6.250 1.00 62.24 C ATOM 1617 O LEU A 113 1.192 9.825 7.320 1.00 41.45 O ATOM 1618 CB LEU A 113 -1.279 8.445 6.024 1.00 55.24 C ATOM 1619 CG LEU A 113 -2.702 9.003 5.970 1.00 51.24 C ATOM 1620 CD1 LEU A 113 -3.714 7.918 6.303 1.00 11.24 C ATOM 1621 CD2 LEU A 113 -2.849 10.183 6.920 1.00 22.41 C ATOM 0 H LEU A 113 -0.171 7.976 3.815 1.00 53.45 H new ATOM 0 HA LEU A 113 -0.523 10.366 5.427 1.00 50.24 H new ATOM 0 HB2 LEU A 113 -1.267 7.484 5.510 1.00 55.24 H new ATOM 0 HB3 LEU A 113 -1.025 8.252 7.066 1.00 55.24 H new ATOM 0 HG LEU A 113 -2.896 9.353 4.956 1.00 51.24 H new ATOM 0 HD11 LEU A 113 -4.721 8.334 6.260 1.00 11.24 H new ATOM 0 HD12 LEU A 113 -3.626 7.105 5.583 1.00 11.24 H new ATOM 0 HD13 LEU A 113 -3.522 7.537 7.306 1.00 11.24 H new ATOM 0 HD21 LEU A 113 -3.868 10.567 6.868 1.00 22.41 H new ATOM 0 HD22 LEU A 113 -2.635 9.859 7.938 1.00 22.41 H new ATOM 0 HD23 LEU A 113 -2.150 10.969 6.635 1.00 22.41 H new ATOM 1633 N VAL A 114 2.053 8.463 5.750 1.00 60.34 N ATOM 1634 CA VAL A 114 3.322 8.283 6.445 1.00 40.33 C ATOM 1635 C VAL A 114 4.024 9.619 6.661 1.00 50.23 C ATOM 1636 O VAL A 114 4.367 9.994 7.782 1.00 1.31 O ATOM 1637 CB VAL A 114 4.261 7.343 5.666 1.00 74.23 C ATOM 1638 CG1 VAL A 114 5.715 7.705 5.924 1.00 1.15 C ATOM 1639 CG2 VAL A 114 3.990 5.893 6.037 1.00 34.32 C ATOM 0 H VAL A 114 1.982 7.959 4.866 1.00 60.34 H new ATOM 0 HA VAL A 114 3.092 7.835 7.412 1.00 40.33 H new ATOM 0 HB VAL A 114 4.066 7.465 4.601 1.00 74.23 H new ATOM 0 HG11 VAL A 114 6.363 7.030 5.365 1.00 1.15 H new ATOM 0 HG12 VAL A 114 5.897 8.731 5.603 1.00 1.15 H new ATOM 0 HG13 VAL A 114 5.929 7.614 6.989 1.00 1.15 H new ATOM 0 HG21 VAL A 114 4.662 5.243 5.477 1.00 34.32 H new ATOM 0 HG22 VAL A 114 4.156 5.754 7.105 1.00 34.32 H new ATOM 0 HG23 VAL A 114 2.957 5.642 5.795 1.00 34.32 H new ATOM 1649 N PRO A 115 4.243 10.357 5.562 1.00 22.11 N ATOM 1650 CA PRO A 115 4.905 11.664 5.605 1.00 24.14 C ATOM 1651 C PRO A 115 4.040 12.731 6.268 1.00 23.51 C ATOM 1652 O PRO A 115 4.547 13.613 6.962 1.00 44.35 O ATOM 1653 CB PRO A 115 5.128 11.998 4.128 1.00 21.22 C ATOM 1654 CG PRO A 115 4.074 11.234 3.404 1.00 14.21 C ATOM 1655 CD PRO A 115 3.861 9.972 4.193 1.00 31.02 C ATOM 0 HA PRO A 115 5.822 11.637 6.193 1.00 24.14 H new ATOM 0 HB2 PRO A 115 5.036 13.069 3.946 1.00 21.22 H new ATOM 0 HB3 PRO A 115 6.125 11.703 3.802 1.00 21.22 H new ATOM 0 HG2 PRO A 115 3.152 11.811 3.335 1.00 14.21 H new ATOM 0 HG3 PRO A 115 4.386 11.009 2.384 1.00 14.21 H new ATOM 0 HD2 PRO A 115 2.825 9.638 4.144 1.00 31.02 H new ATOM 0 HD3 PRO A 115 4.478 9.155 3.818 1.00 31.02 H new ATOM 1663 N LEU A 116 2.733 12.644 6.051 1.00 34.53 N ATOM 1664 CA LEU A 116 1.796 13.602 6.628 1.00 31.54 C ATOM 1665 C LEU A 116 1.729 13.452 8.145 1.00 44.11 C ATOM 1666 O LEU A 116 1.806 14.436 8.881 1.00 4.32 O ATOM 1667 CB LEU A 116 0.404 13.411 6.024 1.00 34.22 C ATOM 1668 CG LEU A 116 -0.751 14.071 6.778 1.00 53.53 C ATOM 1669 CD1 LEU A 116 -0.609 15.585 6.752 1.00 41.43 C ATOM 1670 CD2 LEU A 116 -2.087 13.649 6.183 1.00 41.20 C ATOM 0 H LEU A 116 2.297 11.920 5.480 1.00 34.53 H new ATOM 0 HA LEU A 116 2.152 14.606 6.396 1.00 31.54 H new ATOM 0 HB2 LEU A 116 0.415 13.799 5.005 1.00 34.22 H new ATOM 0 HB3 LEU A 116 0.203 12.342 5.956 1.00 34.22 H new ATOM 0 HG LEU A 116 -0.718 13.741 7.816 1.00 53.53 H new ATOM 0 HD11 LEU A 116 -1.440 16.038 7.293 1.00 41.43 H new ATOM 0 HD12 LEU A 116 0.331 15.870 7.225 1.00 41.43 H new ATOM 0 HD13 LEU A 116 -0.616 15.933 5.719 1.00 41.43 H new ATOM 0 HD21 LEU A 116 -2.897 14.128 6.732 1.00 41.20 H new ATOM 0 HD22 LEU A 116 -2.130 13.950 5.136 1.00 41.20 H new ATOM 0 HD23 LEU A 116 -2.191 12.566 6.254 1.00 41.20 H new ATOM 1682 N THR A 117 1.588 12.213 8.607 1.00 51.51 N ATOM 1683 CA THR A 117 1.512 11.934 10.035 1.00 3.53 C ATOM 1684 C THR A 117 2.841 11.405 10.563 1.00 32.02 C ATOM 1685 O THR A 117 2.885 10.375 11.234 1.00 22.54 O ATOM 1686 CB THR A 117 0.404 10.912 10.350 1.00 12.42 C ATOM 1687 OG1 THR A 117 0.785 9.615 9.879 1.00 5.04 O ATOM 1688 CG2 THR A 117 -0.911 11.325 9.706 1.00 72.41 C ATOM 0 H THR A 117 1.524 11.387 8.012 1.00 51.51 H new ATOM 0 HA THR A 117 1.277 12.877 10.529 1.00 3.53 H new ATOM 0 HB THR A 117 0.267 10.879 11.431 1.00 12.42 H new ATOM 0 HG1 THR A 117 0.684 9.578 8.905 1.00 5.04 H new ATOM 0 HG21 THR A 117 -1.679 10.588 9.942 1.00 72.41 H new ATOM 0 HG22 THR A 117 -1.213 12.300 10.089 1.00 72.41 H new ATOM 0 HG23 THR A 117 -0.784 11.383 8.625 1.00 72.41 H new ATOM 1696 N GLN A 118 3.920 12.117 10.256 1.00 63.32 N ATOM 1697 CA GLN A 118 5.250 11.717 10.700 1.00 3.03 C ATOM 1698 C GLN A 118 5.386 11.863 12.212 1.00 34.24 C ATOM 1699 O GLN A 118 5.191 12.946 12.761 1.00 4.45 O ATOM 1700 CB GLN A 118 6.319 12.555 9.997 1.00 4.45 C ATOM 1701 CG GLN A 118 6.184 14.049 10.248 1.00 34.41 C ATOM 1702 CD GLN A 118 6.220 14.861 8.969 1.00 61.14 C ATOM 1703 OE1 GLN A 118 7.124 14.706 8.147 1.00 72.22 O ATOM 1704 NE2 GLN A 118 5.235 15.734 8.793 1.00 72.41 N ATOM 0 H GLN A 118 3.900 12.973 9.702 1.00 63.32 H new ATOM 0 HA GLN A 118 5.392 10.668 10.440 1.00 3.03 H new ATOM 0 HB2 GLN A 118 7.303 12.227 10.330 1.00 4.45 H new ATOM 0 HB3 GLN A 118 6.267 12.369 8.924 1.00 4.45 H new ATOM 0 HG2 GLN A 118 5.247 14.243 10.770 1.00 34.41 H new ATOM 0 HG3 GLN A 118 6.989 14.377 10.905 1.00 34.41 H new ATOM 0 HE21 GLN A 118 4.506 15.830 9.500 1.00 72.41 H new ATOM 0 HE22 GLN A 118 5.207 16.309 7.951 1.00 72.41 H new ATOM 1713 N GLY A 119 5.720 10.763 12.881 1.00 71.13 N ATOM 1714 CA GLY A 119 5.875 10.790 14.323 1.00 31.23 C ATOM 1715 C GLY A 119 4.728 10.108 15.042 1.00 13.45 C ATOM 1716 O GLY A 119 4.940 9.361 15.997 1.00 24.42 O ATOM 0 H GLY A 119 5.886 9.854 12.449 1.00 71.13 H new ATOM 0 HA2 GLY A 119 6.811 10.302 14.594 1.00 31.23 H new ATOM 0 HA3 GLY A 119 5.946 11.825 14.658 1.00 31.23 H new ATOM 1720 N PHE A 120 3.507 10.368 14.585 1.00 22.21 N ATOM 1721 CA PHE A 120 2.321 9.776 15.193 1.00 2.01 C ATOM 1722 C PHE A 120 2.231 8.287 14.873 1.00 64.21 C ATOM 1723 O PHE A 120 2.820 7.815 13.901 1.00 74.45 O ATOM 1724 CB PHE A 120 1.060 10.491 14.704 1.00 43.44 C ATOM 1725 CG PHE A 120 1.157 11.989 14.769 1.00 30.21 C ATOM 1726 CD1 PHE A 120 1.670 12.615 15.894 1.00 65.45 C ATOM 1727 CD2 PHE A 120 0.734 12.771 13.706 1.00 32.43 C ATOM 1728 CE1 PHE A 120 1.761 13.992 15.957 1.00 42.41 C ATOM 1729 CE2 PHE A 120 0.822 14.149 13.764 1.00 65.32 C ATOM 1730 CZ PHE A 120 1.336 14.760 14.891 1.00 54.41 C ATOM 0 H PHE A 120 3.313 10.985 13.796 1.00 22.21 H new ATOM 0 HA PHE A 120 2.401 9.893 16.274 1.00 2.01 H new ATOM 0 HB2 PHE A 120 0.858 10.192 13.675 1.00 43.44 H new ATOM 0 HB3 PHE A 120 0.211 10.163 15.303 1.00 43.44 H new ATOM 0 HD1 PHE A 120 2.003 12.019 16.731 1.00 65.45 H new ATOM 0 HD2 PHE A 120 0.331 12.298 12.822 1.00 32.43 H new ATOM 0 HE1 PHE A 120 2.164 14.467 16.839 1.00 42.41 H new ATOM 0 HE2 PHE A 120 0.489 14.748 12.929 1.00 65.32 H new ATOM 0 HZ PHE A 120 1.405 15.837 14.938 1.00 54.41 H new ATOM 1740 N GLN A 121 1.492 7.554 15.699 1.00 73.33 N ATOM 1741 CA GLN A 121 1.326 6.118 15.504 1.00 11.14 C ATOM 1742 C GLN A 121 -0.051 5.802 14.930 1.00 70.11 C ATOM 1743 O GLN A 121 -1.050 6.408 15.315 1.00 3.15 O ATOM 1744 CB GLN A 121 1.522 5.377 16.828 1.00 32.01 C ATOM 1745 CG GLN A 121 1.243 3.885 16.737 1.00 15.44 C ATOM 1746 CD GLN A 121 2.324 3.048 17.391 1.00 2.41 C ATOM 1747 OE1 GLN A 121 2.172 2.592 18.524 1.00 31.44 O ATOM 1748 NE2 GLN A 121 3.425 2.842 16.678 1.00 5.24 N ATOM 0 H GLN A 121 0.999 7.930 16.509 1.00 73.33 H new ATOM 0 HA GLN A 121 2.081 5.783 14.793 1.00 11.14 H new ATOM 0 HB2 GLN A 121 2.546 5.527 17.170 1.00 32.01 H new ATOM 0 HB3 GLN A 121 0.867 5.816 17.581 1.00 32.01 H new ATOM 0 HG2 GLN A 121 0.285 3.669 17.210 1.00 15.44 H new ATOM 0 HG3 GLN A 121 1.152 3.600 15.689 1.00 15.44 H new ATOM 0 HE21 GLN A 121 3.508 3.239 15.742 1.00 5.24 H new ATOM 0 HE22 GLN A 121 4.187 2.286 17.066 1.00 5.24 H new ATOM 1757 N GLY A 122 -0.096 4.848 14.004 1.00 12.15 N ATOM 1758 CA GLY A 122 -1.356 4.469 13.391 1.00 25.53 C ATOM 1759 C GLY A 122 -1.755 3.044 13.722 1.00 52.22 C ATOM 1760 O GLY A 122 -1.108 2.093 13.283 1.00 42.22 O ATOM 0 H GLY A 122 0.717 4.332 13.668 1.00 12.15 H new ATOM 0 HA2 GLY A 122 -2.139 5.150 13.726 1.00 25.53 H new ATOM 0 HA3 GLY A 122 -1.278 4.580 12.309 1.00 25.53 H new ATOM 1764 N ILE A 123 -2.823 2.896 14.499 1.00 41.13 N ATOM 1765 CA ILE A 123 -3.307 1.577 14.888 1.00 41.51 C ATOM 1766 C ILE A 123 -4.688 1.304 14.303 1.00 54.21 C ATOM 1767 O ILE A 123 -5.577 2.154 14.362 1.00 23.22 O ATOM 1768 CB ILE A 123 -3.372 1.431 16.420 1.00 53.34 C ATOM 1769 CG1 ILE A 123 -3.997 2.680 17.047 1.00 65.43 C ATOM 1770 CG2 ILE A 123 -1.983 1.185 16.988 1.00 62.30 C ATOM 1771 CD1 ILE A 123 -4.093 2.614 18.555 1.00 42.41 C ATOM 0 H ILE A 123 -3.369 3.673 14.871 1.00 41.13 H new ATOM 0 HA ILE A 123 -2.598 0.851 14.492 1.00 41.51 H new ATOM 0 HB ILE A 123 -3.999 0.573 16.662 1.00 53.34 H new ATOM 0 HG12 ILE A 123 -3.407 3.552 16.766 1.00 65.43 H new ATOM 0 HG13 ILE A 123 -4.995 2.824 16.633 1.00 65.43 H new ATOM 0 HG21 ILE A 123 -2.046 1.084 18.072 1.00 62.30 H new ATOM 0 HG22 ILE A 123 -1.572 0.270 16.561 1.00 62.30 H new ATOM 0 HG23 ILE A 123 -1.334 2.025 16.739 1.00 62.30 H new ATOM 0 HD11 ILE A 123 -4.545 3.532 18.931 1.00 42.41 H new ATOM 0 HD12 ILE A 123 -4.708 1.762 18.843 1.00 42.41 H new ATOM 0 HD13 ILE A 123 -3.095 2.501 18.979 1.00 42.41 H new ATOM 1783 N GLN A 124 -4.862 0.113 13.740 1.00 25.41 N ATOM 1784 CA GLN A 124 -6.136 -0.273 13.145 1.00 2.25 C ATOM 1785 C GLN A 124 -6.835 -1.331 13.993 1.00 5.55 C ATOM 1786 O GLN A 124 -6.286 -2.404 14.239 1.00 33.53 O ATOM 1787 CB GLN A 124 -5.921 -0.800 11.726 1.00 74.42 C ATOM 1788 CG GLN A 124 -4.963 0.044 10.901 1.00 12.02 C ATOM 1789 CD GLN A 124 -3.558 -0.524 10.876 1.00 21.14 C ATOM 1790 OE1 GLN A 124 -3.245 -1.403 10.072 1.00 12.43 O ATOM 1791 NE2 GLN A 124 -2.701 -0.024 11.760 1.00 74.35 N ATOM 0 H GLN A 124 -4.137 -0.602 13.683 1.00 25.41 H new ATOM 0 HA GLN A 124 -6.772 0.611 13.104 1.00 2.25 H new ATOM 0 HB2 GLN A 124 -5.539 -1.819 11.780 1.00 74.42 H new ATOM 0 HB3 GLN A 124 -6.883 -0.847 11.215 1.00 74.42 H new ATOM 0 HG2 GLN A 124 -5.338 0.120 9.880 1.00 12.02 H new ATOM 0 HG3 GLN A 124 -4.935 1.055 11.306 1.00 12.02 H new ATOM 0 HE21 GLN A 124 -3.003 0.704 12.408 1.00 74.35 H new ATOM 0 HE22 GLN A 124 -1.741 -0.368 11.791 1.00 74.35 H new ATOM 1800 N ALA A 125 -8.047 -1.019 14.438 1.00 15.22 N ATOM 1801 CA ALA A 125 -8.822 -1.943 15.257 1.00 24.13 C ATOM 1802 C ALA A 125 -10.315 -1.796 14.988 1.00 34.40 C ATOM 1803 O ALA A 125 -10.841 -0.685 14.943 1.00 71.25 O ATOM 1804 CB ALA A 125 -8.525 -1.717 16.732 1.00 24.03 C ATOM 0 H ALA A 125 -8.514 -0.133 14.245 1.00 15.22 H new ATOM 0 HA ALA A 125 -8.530 -2.959 14.990 1.00 24.13 H new ATOM 0 HB1 ALA A 125 -9.110 -2.414 17.332 1.00 24.03 H new ATOM 0 HB2 ALA A 125 -7.464 -1.881 16.919 1.00 24.03 H new ATOM 0 HB3 ALA A 125 -8.788 -0.695 17.004 1.00 24.03 H new ATOM 1810 N ASN A 126 -10.993 -2.925 14.809 1.00 35.55 N ATOM 1811 CA ASN A 126 -12.427 -2.922 14.543 1.00 14.12 C ATOM 1812 C ASN A 126 -13.219 -3.177 15.822 1.00 1.03 C ATOM 1813 O ASN A 126 -12.709 -3.772 16.772 1.00 61.13 O ATOM 1814 CB ASN A 126 -12.775 -3.981 13.495 1.00 12.01 C ATOM 1815 CG ASN A 126 -12.966 -5.357 14.104 1.00 11.55 C ATOM 1816 OD1 ASN A 126 -12.286 -5.723 15.063 1.00 12.32 O ATOM 1817 ND2 ASN A 126 -13.895 -6.126 13.549 1.00 42.13 N ATOM 0 H ASN A 126 -10.572 -3.854 14.843 1.00 35.55 H new ATOM 0 HA ASN A 126 -12.697 -1.938 14.160 1.00 14.12 H new ATOM 0 HB2 ASN A 126 -13.687 -3.687 12.975 1.00 12.01 H new ATOM 0 HB3 ASN A 126 -11.982 -4.024 12.749 1.00 12.01 H new ATOM 0 HD21 ASN A 126 -14.069 -7.062 13.916 1.00 42.13 H new ATOM 0 HD22 ASN A 126 -14.435 -5.781 12.755 1.00 42.13 H new ATOM 1824 N ASP A 127 -14.467 -2.723 15.839 1.00 33.32 N ATOM 1825 CA ASP A 127 -15.331 -2.903 17.001 1.00 64.54 C ATOM 1826 C ASP A 127 -14.780 -2.153 18.209 1.00 25.10 C ATOM 1827 O ASP A 127 -13.933 -1.270 18.071 1.00 74.32 O ATOM 1828 CB ASP A 127 -15.475 -4.390 17.330 1.00 64.10 C ATOM 1829 CG ASP A 127 -15.513 -5.257 16.087 1.00 23.41 C ATOM 1830 OD1 ASP A 127 -16.141 -4.841 15.091 1.00 14.25 O ATOM 1831 OD2 ASP A 127 -14.913 -6.352 16.110 1.00 71.43 O ATOM 0 H ASP A 127 -14.904 -2.228 15.062 1.00 33.32 H new ATOM 0 HA ASP A 127 -16.313 -2.495 16.760 1.00 64.54 H new ATOM 0 HB2 ASP A 127 -14.643 -4.702 17.961 1.00 64.10 H new ATOM 0 HB3 ASP A 127 -16.388 -4.545 17.906 1.00 64.10 H new ATOM 1836 N ALA A 128 -15.266 -2.510 19.393 1.00 11.01 N ATOM 1837 CA ALA A 128 -14.822 -1.871 20.626 1.00 63.23 C ATOM 1838 C ALA A 128 -13.301 -1.897 20.740 1.00 13.10 C ATOM 1839 O ALA A 128 -12.705 -1.047 21.401 1.00 44.12 O ATOM 1840 CB ALA A 128 -15.455 -2.551 21.831 1.00 71.15 C ATOM 0 H ALA A 128 -15.968 -3.239 19.525 1.00 11.01 H new ATOM 0 HA ALA A 128 -15.141 -0.829 20.602 1.00 63.23 H new ATOM 0 HB1 ALA A 128 -15.114 -2.063 22.744 1.00 71.15 H new ATOM 0 HB2 ALA A 128 -16.540 -2.476 21.763 1.00 71.15 H new ATOM 0 HB3 ALA A 128 -15.164 -3.601 21.850 1.00 71.15 H new ATOM 1846 N SER A 129 -12.680 -2.878 20.093 1.00 52.33 N ATOM 1847 CA SER A 129 -11.229 -3.016 20.126 1.00 70.52 C ATOM 1848 C SER A 129 -10.551 -1.770 19.564 1.00 32.33 C ATOM 1849 O SER A 129 -9.393 -1.489 19.870 1.00 52.23 O ATOM 1850 CB SER A 129 -10.795 -4.249 19.330 1.00 32.12 C ATOM 1851 OG SER A 129 -10.060 -5.148 20.143 1.00 42.44 O ATOM 0 H SER A 129 -13.159 -3.589 19.540 1.00 52.33 H new ATOM 0 HA SER A 129 -10.924 -3.137 21.165 1.00 70.52 H new ATOM 0 HB2 SER A 129 -11.673 -4.753 18.927 1.00 32.12 H new ATOM 0 HB3 SER A 129 -10.186 -3.941 18.480 1.00 32.12 H new ATOM 0 HG SER A 129 -9.796 -5.928 19.612 1.00 42.44 H new ATOM 1857 N GLY A 130 -11.283 -1.026 18.740 1.00 31.51 N ATOM 1858 CA GLY A 130 -10.737 0.181 18.148 1.00 32.22 C ATOM 1859 C GLY A 130 -11.369 1.439 18.710 1.00 21.12 C ATOM 1860 O GLY A 130 -11.395 2.478 18.049 1.00 13.03 O ATOM 0 H GLY A 130 -12.244 -1.238 18.472 1.00 31.51 H new ATOM 0 HA2 GLY A 130 -9.661 0.211 18.319 1.00 32.22 H new ATOM 0 HA3 GLY A 130 -10.888 0.153 17.069 1.00 32.22 H new ATOM 1864 N LEU A 131 -11.881 1.347 19.933 1.00 62.45 N ATOM 1865 CA LEU A 131 -12.518 2.486 20.583 1.00 4.34 C ATOM 1866 C LEU A 131 -12.231 2.488 22.082 1.00 45.25 C ATOM 1867 O LEU A 131 -12.984 3.063 22.867 1.00 31.24 O ATOM 1868 CB LEU A 131 -14.028 2.458 20.342 1.00 2.30 C ATOM 1869 CG LEU A 131 -14.472 2.276 18.890 1.00 32.14 C ATOM 1870 CD1 LEU A 131 -15.960 1.970 18.822 1.00 14.21 C ATOM 1871 CD2 LEU A 131 -14.142 3.516 18.072 1.00 74.41 C ATOM 0 H LEU A 131 -11.867 0.495 20.494 1.00 62.45 H new ATOM 0 HA LEU A 131 -12.104 3.397 20.151 1.00 4.34 H new ATOM 0 HB2 LEU A 131 -14.456 1.650 20.936 1.00 2.30 H new ATOM 0 HB3 LEU A 131 -14.453 3.389 20.717 1.00 2.30 H new ATOM 0 HG LEU A 131 -13.929 1.431 18.467 1.00 32.14 H new ATOM 0 HD11 LEU A 131 -16.258 1.844 17.781 1.00 14.21 H new ATOM 0 HD12 LEU A 131 -16.168 1.053 19.373 1.00 14.21 H new ATOM 0 HD13 LEU A 131 -16.521 2.794 19.263 1.00 14.21 H new ATOM 0 HD21 LEU A 131 -14.465 3.369 17.041 1.00 74.41 H new ATOM 0 HD22 LEU A 131 -14.658 4.378 18.494 1.00 74.41 H new ATOM 0 HD23 LEU A 131 -13.066 3.690 18.094 1.00 74.41 H new ATOM 1883 N ASP A 132 -11.136 1.844 22.469 1.00 24.35 N ATOM 1884 CA ASP A 132 -10.747 1.774 23.873 1.00 24.42 C ATOM 1885 C ASP A 132 -9.844 2.945 24.246 1.00 1.41 C ATOM 1886 O ASP A 132 -8.670 2.981 23.876 1.00 73.15 O ATOM 1887 CB ASP A 132 -10.033 0.452 24.161 1.00 22.13 C ATOM 1888 CG ASP A 132 -10.949 -0.574 24.800 1.00 4.51 C ATOM 1889 OD1 ASP A 132 -11.165 -0.493 26.027 1.00 5.32 O ATOM 1890 OD2 ASP A 132 -11.449 -1.457 24.073 1.00 22.41 O ATOM 0 H ASP A 132 -10.502 1.363 21.831 1.00 24.35 H new ATOM 0 HA ASP A 132 -11.652 1.829 24.478 1.00 24.42 H new ATOM 0 HB2 ASP A 132 -9.633 0.048 23.231 1.00 22.13 H new ATOM 0 HB3 ASP A 132 -9.184 0.637 24.819 1.00 22.13 H new ATOM 1895 N PHE A 133 -10.400 3.903 24.981 1.00 45.34 N ATOM 1896 CA PHE A 133 -9.645 5.078 25.402 1.00 14.20 C ATOM 1897 C PHE A 133 -8.342 4.672 26.083 1.00 45.12 C ATOM 1898 O PHE A 133 -7.282 5.231 25.800 1.00 32.42 O ATOM 1899 CB PHE A 133 -10.484 5.935 26.352 1.00 14.30 C ATOM 1900 CG PHE A 133 -11.490 6.801 25.648 1.00 3.42 C ATOM 1901 CD1 PHE A 133 -12.730 6.297 25.293 1.00 72.23 C ATOM 1902 CD2 PHE A 133 -11.194 8.120 25.343 1.00 54.14 C ATOM 1903 CE1 PHE A 133 -13.657 7.091 24.644 1.00 4.52 C ATOM 1904 CE2 PHE A 133 -12.117 8.920 24.695 1.00 60.24 C ATOM 1905 CZ PHE A 133 -13.350 8.405 24.346 1.00 71.11 C ATOM 0 H PHE A 133 -11.370 3.889 25.297 1.00 45.34 H new ATOM 0 HA PHE A 133 -9.404 5.662 24.514 1.00 14.20 H new ATOM 0 HB2 PHE A 133 -11.005 5.283 27.053 1.00 14.30 H new ATOM 0 HB3 PHE A 133 -9.820 6.568 26.940 1.00 14.30 H new ATOM 0 HD1 PHE A 133 -12.976 5.271 25.526 1.00 72.23 H new ATOM 0 HD2 PHE A 133 -10.231 8.528 25.615 1.00 54.14 H new ATOM 0 HE1 PHE A 133 -14.620 6.685 24.370 1.00 4.52 H new ATOM 0 HE2 PHE A 133 -11.874 9.946 24.462 1.00 60.24 H new ATOM 0 HZ PHE A 133 -14.073 9.028 23.841 1.00 71.11 H new ATOM 1915 N GLU A 134 -8.429 3.696 26.982 1.00 50.44 N ATOM 1916 CA GLU A 134 -7.257 3.217 27.704 1.00 64.42 C ATOM 1917 C GLU A 134 -6.184 2.726 26.735 1.00 33.44 C ATOM 1918 O GLU A 134 -4.990 2.833 27.010 1.00 2.51 O ATOM 1919 CB GLU A 134 -7.647 2.091 28.664 1.00 62.45 C ATOM 1920 CG GLU A 134 -7.877 2.560 30.090 1.00 34.43 C ATOM 1921 CD GLU A 134 -8.436 1.467 30.980 1.00 34.44 C ATOM 1922 OE1 GLU A 134 -9.658 1.217 30.918 1.00 71.41 O ATOM 1923 OE2 GLU A 134 -7.651 0.861 31.740 1.00 50.13 O ATOM 0 H GLU A 134 -9.298 3.222 27.227 1.00 50.44 H new ATOM 0 HA GLU A 134 -6.850 4.049 28.278 1.00 64.42 H new ATOM 0 HB2 GLU A 134 -8.554 1.611 28.298 1.00 62.45 H new ATOM 0 HB3 GLU A 134 -6.862 1.334 28.661 1.00 62.45 H new ATOM 0 HG2 GLU A 134 -6.936 2.917 30.507 1.00 34.43 H new ATOM 0 HG3 GLU A 134 -8.565 3.406 30.084 1.00 34.43 H new ATOM 1930 N GLU A 135 -6.621 2.186 25.602 1.00 73.31 N ATOM 1931 CA GLU A 135 -5.699 1.677 24.594 1.00 60.24 C ATOM 1932 C GLU A 135 -4.917 2.816 23.947 1.00 51.52 C ATOM 1933 O GLU A 135 -3.716 2.698 23.702 1.00 51.43 O ATOM 1934 CB GLU A 135 -6.461 0.894 23.522 1.00 21.12 C ATOM 1935 CG GLU A 135 -6.092 -0.579 23.467 1.00 33.11 C ATOM 1936 CD GLU A 135 -5.781 -1.050 22.060 1.00 61.41 C ATOM 1937 OE1 GLU A 135 -6.735 -1.342 21.308 1.00 24.21 O ATOM 1938 OE2 GLU A 135 -4.585 -1.128 21.711 1.00 43.35 O ATOM 0 H GLU A 135 -7.607 2.090 25.359 1.00 73.31 H new ATOM 0 HA GLU A 135 -4.993 1.010 25.089 1.00 60.24 H new ATOM 0 HB2 GLU A 135 -7.531 0.985 23.709 1.00 21.12 H new ATOM 0 HB3 GLU A 135 -6.268 1.345 22.549 1.00 21.12 H new ATOM 0 HG2 GLU A 135 -5.227 -0.757 24.105 1.00 33.11 H new ATOM 0 HG3 GLU A 135 -6.913 -1.171 23.871 1.00 33.11 H new ATOM 1945 N ILE A 136 -5.607 3.918 23.673 1.00 50.43 N ATOM 1946 CA ILE A 136 -4.978 5.079 23.055 1.00 1.21 C ATOM 1947 C ILE A 136 -3.994 5.745 24.011 1.00 15.34 C ATOM 1948 O ILE A 136 -2.865 6.060 23.637 1.00 50.23 O ATOM 1949 CB ILE A 136 -6.025 6.116 22.609 1.00 53.40 C ATOM 1950 CG1 ILE A 136 -6.992 5.495 21.599 1.00 52.21 C ATOM 1951 CG2 ILE A 136 -5.341 7.338 22.013 1.00 21.33 C ATOM 1952 CD1 ILE A 136 -8.255 6.303 21.395 1.00 21.15 C ATOM 0 H ILE A 136 -6.602 4.031 23.869 1.00 50.43 H new ATOM 0 HA ILE A 136 -4.441 4.717 22.178 1.00 1.21 H new ATOM 0 HB ILE A 136 -6.595 6.433 23.482 1.00 53.40 H new ATOM 0 HG12 ILE A 136 -6.483 5.384 20.642 1.00 52.21 H new ATOM 0 HG13 ILE A 136 -7.261 4.494 21.935 1.00 52.21 H new ATOM 0 HG21 ILE A 136 -6.095 8.062 21.703 1.00 21.33 H new ATOM 0 HG22 ILE A 136 -4.689 7.791 22.760 1.00 21.33 H new ATOM 0 HG23 ILE A 136 -4.748 7.038 21.149 1.00 21.33 H new ATOM 0 HD11 ILE A 136 -8.893 5.803 20.666 1.00 21.15 H new ATOM 0 HD12 ILE A 136 -8.787 6.392 22.342 1.00 21.15 H new ATOM 0 HD13 ILE A 136 -7.996 7.297 21.029 1.00 21.15 H new ATOM 1964 N SER A 137 -4.431 5.955 25.249 1.00 12.51 N ATOM 1965 CA SER A 137 -3.590 6.586 26.260 1.00 52.03 C ATOM 1966 C SER A 137 -2.348 5.744 26.535 1.00 32.24 C ATOM 1967 O SER A 137 -1.249 6.274 26.698 1.00 61.25 O ATOM 1968 CB SER A 137 -4.379 6.791 27.554 1.00 1.15 C ATOM 1969 OG SER A 137 -3.527 7.197 28.612 1.00 71.03 O ATOM 0 H SER A 137 -5.362 5.697 25.576 1.00 12.51 H new ATOM 0 HA SER A 137 -3.272 7.557 25.880 1.00 52.03 H new ATOM 0 HB2 SER A 137 -5.152 7.543 27.397 1.00 1.15 H new ATOM 0 HB3 SER A 137 -4.885 5.865 27.826 1.00 1.15 H new ATOM 0 HG SER A 137 -4.055 7.323 29.428 1.00 71.03 H new ATOM 1975 N ARG A 138 -2.532 4.429 26.587 1.00 34.31 N ATOM 1976 CA ARG A 138 -1.428 3.512 26.844 1.00 12.13 C ATOM 1977 C ARG A 138 -0.468 3.471 25.659 1.00 74.02 C ATOM 1978 O ARG A 138 0.746 3.367 25.832 1.00 1.14 O ATOM 1979 CB ARG A 138 -1.960 2.107 27.132 1.00 12.14 C ATOM 1980 CG ARG A 138 -0.961 1.212 27.847 1.00 10.23 C ATOM 1981 CD ARG A 138 -0.044 0.504 26.863 1.00 62.33 C ATOM 1982 NE ARG A 138 -0.116 -0.949 26.996 1.00 44.13 N ATOM 1983 CZ ARG A 138 0.525 -1.793 26.194 1.00 0.35 C ATOM 1984 NH1 ARG A 138 1.281 -1.331 25.208 1.00 5.14 N ATOM 1985 NH2 ARG A 138 0.410 -3.102 26.379 1.00 10.32 N ATOM 0 H ARG A 138 -3.435 3.974 26.455 1.00 34.31 H new ATOM 0 HA ARG A 138 -0.885 3.873 27.717 1.00 12.13 H new ATOM 0 HB2 ARG A 138 -2.862 2.187 27.738 1.00 12.14 H new ATOM 0 HB3 ARG A 138 -2.248 1.637 26.192 1.00 12.14 H new ATOM 0 HG2 ARG A 138 -0.365 1.809 28.537 1.00 10.23 H new ATOM 0 HG3 ARG A 138 -1.495 0.473 28.444 1.00 10.23 H new ATOM 0 HD2 ARG A 138 -0.314 0.789 25.846 1.00 62.33 H new ATOM 0 HD3 ARG A 138 0.983 0.832 27.024 1.00 62.33 H new ATOM 0 HE ARG A 138 -0.689 -1.337 27.745 1.00 44.13 H new ATOM 0 HH11 ARG A 138 1.372 -0.325 25.063 1.00 5.14 H new ATOM 0 HH12 ARG A 138 1.772 -1.981 24.594 1.00 5.14 H new ATOM 0 HH21 ARG A 138 -0.171 -3.461 27.137 1.00 10.32 H new ATOM 0 HH22 ARG A 138 0.902 -3.749 25.763 1.00 10.32 H new ATOM 1999 N LYS A 139 -1.021 3.553 24.453 1.00 34.44 N ATOM 2000 CA LYS A 139 -0.216 3.526 23.238 1.00 30.42 C ATOM 2001 C LYS A 139 0.698 4.745 23.164 1.00 71.40 C ATOM 2002 O LYS A 139 1.896 4.620 22.909 1.00 52.23 O ATOM 2003 CB LYS A 139 -1.120 3.476 22.004 1.00 5.40 C ATOM 2004 CG LYS A 139 -0.423 2.949 20.761 1.00 15.03 C ATOM 2005 CD LYS A 139 0.026 1.509 20.942 1.00 34.25 C ATOM 2006 CE LYS A 139 -0.680 0.578 19.968 1.00 42.22 C ATOM 2007 NZ LYS A 139 -0.425 -0.854 20.286 1.00 72.23 N ATOM 0 H LYS A 139 -2.024 3.639 24.292 1.00 34.44 H new ATOM 0 HA LYS A 139 0.404 2.630 23.262 1.00 30.42 H new ATOM 0 HB2 LYS A 139 -1.983 2.846 22.221 1.00 5.40 H new ATOM 0 HB3 LYS A 139 -1.499 4.477 21.801 1.00 5.40 H new ATOM 0 HG2 LYS A 139 -1.098 3.016 19.908 1.00 15.03 H new ATOM 0 HG3 LYS A 139 0.440 3.575 20.534 1.00 15.03 H new ATOM 0 HD2 LYS A 139 1.104 1.442 20.795 1.00 34.25 H new ATOM 0 HD3 LYS A 139 -0.177 1.189 21.964 1.00 34.25 H new ATOM 0 HE2 LYS A 139 -1.753 0.770 19.994 1.00 42.22 H new ATOM 0 HE3 LYS A 139 -0.343 0.790 18.953 1.00 42.22 H new ATOM 0 HZ1 LYS A 139 -0.923 -1.456 19.600 1.00 72.23 H new ATOM 0 HZ2 LYS A 139 0.596 -1.044 20.236 1.00 72.23 H new ATOM 0 HZ3 LYS A 139 -0.770 -1.063 21.245 1.00 72.23 H new ATOM 2021 N VAL A 140 0.125 5.923 23.390 1.00 22.30 N ATOM 2022 CA VAL A 140 0.889 7.164 23.351 1.00 10.03 C ATOM 2023 C VAL A 140 1.879 7.237 24.509 1.00 73.44 C ATOM 2024 O VAL A 140 2.999 7.724 24.353 1.00 14.01 O ATOM 2025 CB VAL A 140 -0.036 8.394 23.404 1.00 53.24 C ATOM 2026 CG1 VAL A 140 -0.885 8.371 24.666 1.00 41.13 C ATOM 2027 CG2 VAL A 140 0.778 9.677 23.322 1.00 31.41 C ATOM 0 H VAL A 140 -0.865 6.044 23.602 1.00 22.30 H new ATOM 0 HA VAL A 140 1.436 7.169 22.408 1.00 10.03 H new ATOM 0 HB VAL A 140 -0.706 8.360 22.545 1.00 53.24 H new ATOM 0 HG11 VAL A 140 -1.532 9.248 24.685 1.00 41.13 H new ATOM 0 HG12 VAL A 140 -1.497 7.469 24.677 1.00 41.13 H new ATOM 0 HG13 VAL A 140 -0.236 8.380 25.542 1.00 41.13 H new ATOM 0 HG21 VAL A 140 0.108 10.536 23.361 1.00 31.41 H new ATOM 0 HG22 VAL A 140 1.473 9.721 24.160 1.00 31.41 H new ATOM 0 HG23 VAL A 140 1.336 9.694 22.386 1.00 31.41 H new ATOM 2037 N LYS A 141 1.459 6.748 25.671 1.00 74.04 N ATOM 2038 CA LYS A 141 2.308 6.755 26.856 1.00 73.11 C ATOM 2039 C LYS A 141 3.525 5.857 26.658 1.00 1.34 C ATOM 2040 O LYS A 141 4.611 6.149 27.160 1.00 72.30 O ATOM 2041 CB LYS A 141 1.514 6.293 28.080 1.00 54.20 C ATOM 2042 CG LYS A 141 2.349 6.193 29.344 1.00 21.54 C ATOM 2043 CD LYS A 141 1.475 6.094 30.584 1.00 44.52 C ATOM 2044 CE LYS A 141 1.841 7.157 31.609 1.00 53.33 C ATOM 2045 NZ LYS A 141 1.104 8.430 31.375 1.00 73.12 N ATOM 0 H LYS A 141 0.535 6.342 25.817 1.00 74.04 H new ATOM 0 HA LYS A 141 2.654 7.776 27.019 1.00 73.11 H new ATOM 0 HB2 LYS A 141 0.691 6.987 28.252 1.00 54.20 H new ATOM 0 HB3 LYS A 141 1.071 5.320 27.869 1.00 54.20 H new ATOM 0 HG2 LYS A 141 2.998 5.319 29.284 1.00 21.54 H new ATOM 0 HG3 LYS A 141 2.997 7.066 29.423 1.00 21.54 H new ATOM 0 HD2 LYS A 141 0.428 6.204 30.302 1.00 44.52 H new ATOM 0 HD3 LYS A 141 1.583 5.105 31.029 1.00 44.52 H new ATOM 0 HE2 LYS A 141 1.619 6.788 32.610 1.00 53.33 H new ATOM 0 HE3 LYS A 141 2.914 7.346 31.569 1.00 53.33 H new ATOM 0 HZ1 LYS A 141 1.381 9.129 32.094 1.00 73.12 H new ATOM 0 HZ2 LYS A 141 1.335 8.796 30.429 1.00 73.12 H new ATOM 0 HZ3 LYS A 141 0.081 8.255 31.438 1.00 73.12 H new ATOM 2059 N SER A 142 3.337 4.766 25.924 1.00 71.24 N ATOM 2060 CA SER A 142 4.420 3.825 25.662 1.00 75.42 C ATOM 2061 C SER A 142 5.266 4.286 24.480 1.00 64.14 C ATOM 2062 O SER A 142 6.467 4.022 24.422 1.00 54.43 O ATOM 2063 CB SER A 142 3.855 2.430 25.386 1.00 23.51 C ATOM 2064 OG SER A 142 4.787 1.635 24.672 1.00 35.35 O ATOM 0 H SER A 142 2.445 4.511 25.500 1.00 71.24 H new ATOM 0 HA SER A 142 5.055 3.784 26.547 1.00 75.42 H new ATOM 0 HB2 SER A 142 3.603 1.943 26.328 1.00 23.51 H new ATOM 0 HB3 SER A 142 2.931 2.515 24.814 1.00 23.51 H new ATOM 0 HG SER A 142 4.403 0.748 24.509 1.00 35.35 H new ATOM 2070 N ASN A 143 4.631 4.976 23.538 1.00 10.43 N ATOM 2071 CA ASN A 143 5.325 5.475 22.356 1.00 32.42 C ATOM 2072 C ASN A 143 6.307 4.436 21.824 1.00 24.10 C ATOM 2073 O ASN A 143 7.420 4.771 21.416 1.00 31.55 O ATOM 2074 CB ASN A 143 6.065 6.773 22.683 1.00 22.02 C ATOM 2075 CG ASN A 143 7.101 6.589 23.775 1.00 21.53 C ATOM 2076 OD1 ASN A 143 6.774 6.584 24.962 1.00 30.12 O ATOM 2077 ND2 ASN A 143 8.359 6.436 23.378 1.00 71.42 N ATOM 0 H ASN A 143 3.637 5.202 23.570 1.00 10.43 H new ATOM 0 HA ASN A 143 4.581 5.674 21.585 1.00 32.42 H new ATOM 0 HB2 ASN A 143 6.553 7.147 21.783 1.00 22.02 H new ATOM 0 HB3 ASN A 143 5.345 7.530 22.993 1.00 22.02 H new ATOM 0 HD21 ASN A 143 9.099 6.308 24.068 1.00 71.42 H new ATOM 0 HD22 ASN A 143 8.585 6.447 22.383 1.00 71.42 H new ATOM 2084 N ARG A 144 5.888 3.175 21.831 1.00 61.25 N ATOM 2085 CA ARG A 144 6.731 2.087 21.349 1.00 30.02 C ATOM 2086 C ARG A 144 5.912 0.817 21.138 1.00 53.24 C ATOM 2087 O ARG A 144 4.730 0.766 21.478 1.00 73.41 O ATOM 2088 CB ARG A 144 7.865 1.816 22.339 1.00 22.23 C ATOM 2089 CG ARG A 144 9.250 2.062 21.762 1.00 75.01 C ATOM 2090 CD ARG A 144 9.792 0.823 21.067 1.00 31.33 C ATOM 2091 NE ARG A 144 10.519 -0.047 21.988 1.00 34.13 N ATOM 2092 CZ ARG A 144 10.849 -1.303 21.707 1.00 0.43 C ATOM 2093 NH1 ARG A 144 10.520 -1.832 20.537 1.00 32.22 N ATOM 2094 NH2 ARG A 144 11.511 -2.031 22.597 1.00 13.04 N ATOM 0 H ARG A 144 4.970 2.881 22.165 1.00 61.25 H new ATOM 0 HA ARG A 144 7.157 2.387 20.392 1.00 30.02 H new ATOM 0 HB2 ARG A 144 7.729 2.448 23.216 1.00 22.23 H new ATOM 0 HB3 ARG A 144 7.800 0.782 22.678 1.00 22.23 H new ATOM 0 HG2 ARG A 144 9.208 2.889 21.053 1.00 75.01 H new ATOM 0 HG3 ARG A 144 9.930 2.360 22.560 1.00 75.01 H new ATOM 0 HD2 ARG A 144 8.967 0.269 20.619 1.00 31.33 H new ATOM 0 HD3 ARG A 144 10.453 1.123 20.254 1.00 31.33 H new ATOM 0 HE ARG A 144 10.788 0.330 22.897 1.00 34.13 H new ATOM 0 HH11 ARG A 144 10.012 -1.275 19.850 1.00 32.22 H new ATOM 0 HH12 ARG A 144 10.775 -2.796 20.324 1.00 32.22 H new ATOM 0 HH21 ARG A 144 11.767 -1.627 23.498 1.00 13.04 H new ATOM 0 HH22 ARG A 144 11.764 -2.995 22.380 1.00 13.04 H new