USER MOD reduce.3.24.130724 H: found=0, std=0, add=773, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 771 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 16 CYS SG : rot 130:sc= -0.403 USER MOD Set 1.2: A 19 GLN : amide:sc= -1.54 K(o=-1.9,f=-3.9!) USER MOD Set 2.1: A 13 LYS NZ :NH3+ 141:sc= -1.1 (180deg=-2.05!) USER MOD Set 2.2: A 86 CYS SG : rot 180:sc= -0.687 USER MOD Set 3.1: A 11 THR OG1 : rot 9:sc= 0.95 USER MOD Set 3.2: A 28 GLN :FLIP amide:sc= 0.702 F(o=-3.4!,f=1.7) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc=-0.00134 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 15 LYS NZ :NH3+ 172:sc= -0.946 (180deg=-1.26) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 18 ASN : amide:sc= -0.0143 X(o=-0.014,f=-0.51) USER MOD Single : A 23 GLN : amide:sc=-0.00305 X(o=-0.0031,f=0) USER MOD Single : A 27 LYS NZ :NH3+ -160:sc= -0.0139 (180deg=-0.507) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 33 MET CE :methyl 162:sc= -0.0287 (180deg=-0.389) USER MOD Single : A 34 THR OG1 : rot 180:sc= 0.00224 USER MOD Single : A 36 GLN : amide:sc= -0.025 X(o=-0.025,f=0) USER MOD Single : A 37 LYS NZ :NH3+ -150:sc= -0.268 (180deg=-1.15) USER MOD Single : A 39 LYS NZ :NH3+ -169:sc= 0.357 (180deg=0.309) USER MOD Single : A 43 SER OG : rot 61:sc= 0.997 USER MOD Single : A 47 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.0564) USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 56 SER OG : rot 180:sc= -0.973 USER MOD Single : A 57 TYR OH : rot -62:sc= 1.14 USER MOD Single : A 59 SER OG : rot 180:sc= -0.0936 USER MOD Single : A 60 SER OG : rot 180:sc= 0.00116 USER MOD Single : A 61 LYS NZ :NH3+ -154:sc= -0.101 (180deg=-0.481) USER MOD Single : A 62 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 71 ASN : amide:sc= 0 X(o=0,f=-0.3) USER MOD Single : A 74 GLN : amide:sc= -0.398 K(o=-0.4,f=-2.3!) USER MOD Single : A 77 GLN : amide:sc= 0 X(o=0,f=-0.47) USER MOD Single : A 79 TYR OH : rot 70:sc= -0.847 USER MOD Single : A 80 SER OG : rot -51:sc= 0.179 USER MOD Single : A 83 ASN : amide:sc= -0.683 X(o=-0.68,f=-0.47!) USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 95 SER OG : rot 180:sc= 0 USER MOD Single : A 96 SER OG : rot 16:sc= 0.42 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -13.079 11.494 -10.737 1.00 0.00 N ATOM 2 CA GLY A 1 -11.664 11.212 -10.894 1.00 0.00 C ATOM 3 C GLY A 1 -10.948 12.274 -11.705 1.00 0.00 C ATOM 4 O GLY A 1 -9.899 12.774 -11.297 1.00 0.00 O ATOM 0 H1 GLY A 1 -13.523 10.739 -10.176 1.00 0.00 H new ATOM 0 H2 GLY A 1 -13.199 12.405 -10.250 1.00 0.00 H new ATOM 0 H3 GLY A 1 -13.530 11.540 -11.673 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -11.200 11.136 -9.910 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -11.541 10.244 -11.380 1.00 0.00 H new ATOM 8 N SER A 2 -11.514 12.619 -12.857 1.00 0.00 N ATOM 9 CA SER A 2 -10.920 13.625 -13.729 1.00 0.00 C ATOM 10 C SER A 2 -9.436 13.346 -13.949 1.00 0.00 C ATOM 11 O SER A 2 -8.612 14.259 -13.929 1.00 0.00 O ATOM 12 CB SER A 2 -11.105 15.022 -13.132 1.00 0.00 C ATOM 13 OG SER A 2 -12.475 15.305 -12.911 1.00 0.00 O ATOM 0 H SER A 2 -12.383 12.217 -13.208 1.00 0.00 H new ATOM 0 HA SER A 2 -11.427 13.579 -14.693 1.00 0.00 H new ATOM 0 HB2 SER A 2 -10.559 15.094 -12.191 1.00 0.00 H new ATOM 0 HB3 SER A 2 -10.680 15.767 -13.805 1.00 0.00 H new ATOM 0 HG SER A 2 -12.566 16.202 -12.528 1.00 0.00 H new ATOM 19 N SER A 3 -9.105 12.076 -14.159 1.00 0.00 N ATOM 20 CA SER A 3 -7.720 11.674 -14.379 1.00 0.00 C ATOM 21 C SER A 3 -7.233 12.131 -15.751 1.00 0.00 C ATOM 22 O SER A 3 -7.906 11.927 -16.760 1.00 0.00 O ATOM 23 CB SER A 3 -7.583 10.155 -14.256 1.00 0.00 C ATOM 24 OG SER A 3 -8.041 9.505 -15.429 1.00 0.00 O ATOM 0 H SER A 3 -9.776 11.308 -14.181 1.00 0.00 H new ATOM 0 HA SER A 3 -7.103 12.150 -13.617 1.00 0.00 H new ATOM 0 HB2 SER A 3 -6.540 9.894 -14.076 1.00 0.00 H new ATOM 0 HB3 SER A 3 -8.153 9.804 -13.396 1.00 0.00 H new ATOM 0 HG SER A 3 -7.941 8.536 -15.326 1.00 0.00 H new ATOM 30 N GLY A 4 -6.058 12.752 -15.778 1.00 0.00 N ATOM 31 CA GLY A 4 -5.499 13.229 -17.030 1.00 0.00 C ATOM 32 C GLY A 4 -4.307 12.410 -17.482 1.00 0.00 C ATOM 33 O GLY A 4 -4.319 11.829 -18.567 1.00 0.00 O ATOM 0 H GLY A 4 -5.483 12.933 -14.955 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -6.268 13.202 -17.802 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -5.198 14.271 -16.917 1.00 0.00 H new ATOM 37 N SER A 5 -3.271 12.366 -16.649 1.00 0.00 N ATOM 38 CA SER A 5 -2.063 11.617 -16.972 1.00 0.00 C ATOM 39 C SER A 5 -2.244 10.133 -16.665 1.00 0.00 C ATOM 40 O SER A 5 -2.652 9.761 -15.565 1.00 0.00 O ATOM 41 CB SER A 5 -0.871 12.169 -16.187 1.00 0.00 C ATOM 42 OG SER A 5 -0.371 13.353 -16.785 1.00 0.00 O ATOM 0 H SER A 5 -3.245 12.840 -15.746 1.00 0.00 H new ATOM 0 HA SER A 5 -1.871 11.729 -18.039 1.00 0.00 H new ATOM 0 HB2 SER A 5 -1.172 12.376 -15.160 1.00 0.00 H new ATOM 0 HB3 SER A 5 -0.082 11.419 -16.143 1.00 0.00 H new ATOM 0 HG SER A 5 0.389 13.687 -16.264 1.00 0.00 H new ATOM 48 N SER A 6 -1.939 9.291 -17.646 1.00 0.00 N ATOM 49 CA SER A 6 -2.072 7.848 -17.484 1.00 0.00 C ATOM 50 C SER A 6 -1.424 7.386 -16.183 1.00 0.00 C ATOM 51 O SER A 6 -0.348 7.852 -15.812 1.00 0.00 O ATOM 52 CB SER A 6 -1.437 7.119 -18.670 1.00 0.00 C ATOM 53 OG SER A 6 -0.033 7.311 -18.694 1.00 0.00 O ATOM 0 H SER A 6 -1.598 9.583 -18.562 1.00 0.00 H new ATOM 0 HA SER A 6 -3.135 7.608 -17.446 1.00 0.00 H new ATOM 0 HB2 SER A 6 -1.661 6.054 -18.608 1.00 0.00 H new ATOM 0 HB3 SER A 6 -1.873 7.483 -19.600 1.00 0.00 H new ATOM 0 HG SER A 6 0.349 6.834 -19.460 1.00 0.00 H new ATOM 59 N GLY A 7 -2.089 6.463 -15.493 1.00 0.00 N ATOM 60 CA GLY A 7 -1.563 5.953 -14.240 1.00 0.00 C ATOM 61 C GLY A 7 -0.791 4.661 -14.419 1.00 0.00 C ATOM 62 O GLY A 7 -1.279 3.721 -15.046 1.00 0.00 O ATOM 0 H GLY A 7 -2.981 6.060 -15.779 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -0.912 6.703 -13.791 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -2.386 5.788 -13.544 1.00 0.00 H new ATOM 66 N GLN A 8 0.418 4.615 -13.869 1.00 0.00 N ATOM 67 CA GLN A 8 1.260 3.429 -13.973 1.00 0.00 C ATOM 68 C GLN A 8 1.176 2.588 -12.704 1.00 0.00 C ATOM 69 O GLN A 8 1.094 3.122 -11.597 1.00 0.00 O ATOM 70 CB GLN A 8 2.712 3.831 -14.238 1.00 0.00 C ATOM 71 CG GLN A 8 3.376 4.526 -13.060 1.00 0.00 C ATOM 72 CD GLN A 8 4.881 4.620 -13.210 1.00 0.00 C ATOM 73 OE1 GLN A 8 5.629 3.891 -12.558 1.00 0.00 O ATOM 74 NE2 GLN A 8 5.335 5.521 -14.074 1.00 0.00 N ATOM 0 H GLN A 8 0.836 5.385 -13.347 1.00 0.00 H new ATOM 0 HA GLN A 8 0.898 2.829 -14.808 1.00 0.00 H new ATOM 0 HB2 GLN A 8 3.286 2.940 -14.494 1.00 0.00 H new ATOM 0 HB3 GLN A 8 2.745 4.492 -15.104 1.00 0.00 H new ATOM 0 HG2 GLN A 8 2.962 5.529 -12.954 1.00 0.00 H new ATOM 0 HG3 GLN A 8 3.139 3.985 -12.144 1.00 0.00 H new ATOM 0 HE21 GLN A 8 4.680 6.105 -14.594 1.00 0.00 H new ATOM 0 HE22 GLN A 8 6.339 5.629 -14.218 1.00 0.00 H new ATOM 83 N LEU A 9 1.198 1.271 -12.871 1.00 0.00 N ATOM 84 CA LEU A 9 1.124 0.354 -11.738 1.00 0.00 C ATOM 85 C LEU A 9 2.443 0.328 -10.972 1.00 0.00 C ATOM 86 O LEU A 9 3.519 0.423 -11.564 1.00 0.00 O ATOM 87 CB LEU A 9 0.771 -1.054 -12.218 1.00 0.00 C ATOM 88 CG LEU A 9 -0.719 -1.393 -12.270 1.00 0.00 C ATOM 89 CD1 LEU A 9 -1.365 -1.168 -10.911 1.00 0.00 C ATOM 90 CD2 LEU A 9 -1.417 -0.563 -13.338 1.00 0.00 C ATOM 0 H LEU A 9 1.266 0.813 -13.780 1.00 0.00 H new ATOM 0 HA LEU A 9 0.342 0.708 -11.066 1.00 0.00 H new ATOM 0 HB2 LEU A 9 1.189 -1.191 -13.215 1.00 0.00 H new ATOM 0 HB3 LEU A 9 1.264 -1.773 -11.564 1.00 0.00 H new ATOM 0 HG LEU A 9 -0.824 -2.446 -12.530 1.00 0.00 H new ATOM 0 HD11 LEU A 9 -2.425 -1.414 -10.967 1.00 0.00 H new ATOM 0 HD12 LEU A 9 -0.883 -1.805 -10.169 1.00 0.00 H new ATOM 0 HD13 LEU A 9 -1.250 -0.123 -10.622 1.00 0.00 H new ATOM 0 HD21 LEU A 9 -2.477 -0.817 -13.361 1.00 0.00 H new ATOM 0 HD22 LEU A 9 -1.303 0.496 -13.108 1.00 0.00 H new ATOM 0 HD23 LEU A 9 -0.972 -0.773 -14.311 1.00 0.00 H new ATOM 102 N LEU A 10 2.352 0.196 -9.653 1.00 0.00 N ATOM 103 CA LEU A 10 3.539 0.154 -8.805 1.00 0.00 C ATOM 104 C LEU A 10 3.652 -1.190 -8.094 1.00 0.00 C ATOM 105 O LEU A 10 2.750 -1.595 -7.360 1.00 0.00 O ATOM 106 CB LEU A 10 3.495 1.286 -7.778 1.00 0.00 C ATOM 107 CG LEU A 10 2.747 2.550 -8.202 1.00 0.00 C ATOM 108 CD1 LEU A 10 2.839 3.614 -7.120 1.00 0.00 C ATOM 109 CD2 LEU A 10 3.297 3.078 -9.520 1.00 0.00 C ATOM 0 H LEU A 10 1.470 0.116 -9.148 1.00 0.00 H new ATOM 0 HA LEU A 10 4.415 0.282 -9.440 1.00 0.00 H new ATOM 0 HB2 LEU A 10 3.035 0.905 -6.866 1.00 0.00 H new ATOM 0 HB3 LEU A 10 4.519 1.561 -7.527 1.00 0.00 H new ATOM 0 HG LEU A 10 1.696 2.297 -8.344 1.00 0.00 H new ATOM 0 HD11 LEU A 10 2.301 4.506 -7.440 1.00 0.00 H new ATOM 0 HD12 LEU A 10 2.397 3.235 -6.198 1.00 0.00 H new ATOM 0 HD13 LEU A 10 3.885 3.865 -6.945 1.00 0.00 H new ATOM 0 HD21 LEU A 10 2.753 3.978 -9.807 1.00 0.00 H new ATOM 0 HD22 LEU A 10 4.355 3.315 -9.404 1.00 0.00 H new ATOM 0 HD23 LEU A 10 3.178 2.320 -10.294 1.00 0.00 H new ATOM 121 N THR A 11 4.769 -1.878 -8.314 1.00 0.00 N ATOM 122 CA THR A 11 5.001 -3.176 -7.693 1.00 0.00 C ATOM 123 C THR A 11 5.508 -3.019 -6.264 1.00 0.00 C ATOM 124 O THR A 11 6.681 -2.720 -6.040 1.00 0.00 O ATOM 125 CB THR A 11 6.017 -4.009 -8.497 1.00 0.00 C ATOM 126 OG1 THR A 11 5.636 -4.048 -9.877 1.00 0.00 O ATOM 127 CG2 THR A 11 6.108 -5.426 -7.951 1.00 0.00 C ATOM 0 H THR A 11 5.526 -1.558 -8.917 1.00 0.00 H new ATOM 0 HA THR A 11 4.043 -3.696 -7.681 1.00 0.00 H new ATOM 0 HB THR A 11 6.995 -3.537 -8.404 1.00 0.00 H new ATOM 0 HG1 THR A 11 4.899 -3.421 -10.031 1.00 0.00 H new ATOM 0 HG21 THR A 11 6.832 -5.995 -8.535 1.00 0.00 H new ATOM 0 HG22 THR A 11 6.427 -5.395 -6.909 1.00 0.00 H new ATOM 0 HG23 THR A 11 5.131 -5.905 -8.017 1.00 0.00 H new ATOM 135 N LEU A 12 4.617 -3.223 -5.300 1.00 0.00 N ATOM 136 CA LEU A 12 4.974 -3.105 -3.891 1.00 0.00 C ATOM 137 C LEU A 12 4.700 -4.410 -3.148 1.00 0.00 C ATOM 138 O LEU A 12 3.863 -5.210 -3.565 1.00 0.00 O ATOM 139 CB LEU A 12 4.194 -1.962 -3.240 1.00 0.00 C ATOM 140 CG LEU A 12 4.258 -0.613 -3.957 1.00 0.00 C ATOM 141 CD1 LEU A 12 3.176 0.321 -3.436 1.00 0.00 C ATOM 142 CD2 LEU A 12 5.634 0.016 -3.788 1.00 0.00 C ATOM 0 H LEU A 12 3.642 -3.471 -5.469 1.00 0.00 H new ATOM 0 HA LEU A 12 6.041 -2.890 -3.830 1.00 0.00 H new ATOM 0 HB2 LEU A 12 3.149 -2.260 -3.162 1.00 0.00 H new ATOM 0 HB3 LEU A 12 4.564 -1.829 -2.223 1.00 0.00 H new ATOM 0 HG LEU A 12 4.084 -0.780 -5.020 1.00 0.00 H new ATOM 0 HD11 LEU A 12 3.237 1.276 -3.958 1.00 0.00 H new ATOM 0 HD12 LEU A 12 2.196 -0.125 -3.609 1.00 0.00 H new ATOM 0 HD13 LEU A 12 3.318 0.482 -2.367 1.00 0.00 H new ATOM 0 HD21 LEU A 12 5.661 0.975 -4.305 1.00 0.00 H new ATOM 0 HD22 LEU A 12 5.836 0.169 -2.728 1.00 0.00 H new ATOM 0 HD23 LEU A 12 6.391 -0.645 -4.210 1.00 0.00 H new ATOM 154 N LYS A 13 5.410 -4.616 -2.044 1.00 0.00 N ATOM 155 CA LYS A 13 5.242 -5.821 -1.240 1.00 0.00 C ATOM 156 C LYS A 13 4.431 -5.527 0.017 1.00 0.00 C ATOM 157 O LYS A 13 4.794 -4.659 0.812 1.00 0.00 O ATOM 158 CB LYS A 13 6.607 -6.397 -0.857 1.00 0.00 C ATOM 159 CG LYS A 13 7.152 -7.393 -1.866 1.00 0.00 C ATOM 160 CD LYS A 13 8.329 -8.171 -1.302 1.00 0.00 C ATOM 161 CE LYS A 13 9.640 -7.432 -1.516 1.00 0.00 C ATOM 162 NZ LYS A 13 9.747 -6.229 -0.645 1.00 0.00 N ATOM 0 H LYS A 13 6.108 -3.964 -1.685 1.00 0.00 H new ATOM 0 HA LYS A 13 4.700 -6.554 -1.837 1.00 0.00 H new ATOM 0 HB2 LYS A 13 7.319 -5.579 -0.746 1.00 0.00 H new ATOM 0 HB3 LYS A 13 6.527 -6.884 0.115 1.00 0.00 H new ATOM 0 HG2 LYS A 13 6.363 -8.086 -2.157 1.00 0.00 H new ATOM 0 HG3 LYS A 13 7.462 -6.866 -2.768 1.00 0.00 H new ATOM 0 HD2 LYS A 13 8.176 -8.342 -0.236 1.00 0.00 H new ATOM 0 HD3 LYS A 13 8.380 -9.150 -1.778 1.00 0.00 H new ATOM 0 HE2 LYS A 13 10.473 -8.104 -1.311 1.00 0.00 H new ATOM 0 HE3 LYS A 13 9.722 -7.132 -2.561 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 10.723 -6.138 -0.296 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 9.495 -5.381 -1.192 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 9.099 -6.326 0.162 1.00 0.00 H new ATOM 176 N ILE A 14 3.334 -6.256 0.192 1.00 0.00 N ATOM 177 CA ILE A 14 2.474 -6.074 1.355 1.00 0.00 C ATOM 178 C ILE A 14 2.966 -6.902 2.537 1.00 0.00 C ATOM 179 O ILE A 14 2.986 -8.132 2.484 1.00 0.00 O ATOM 180 CB ILE A 14 1.016 -6.462 1.043 1.00 0.00 C ATOM 181 CG1 ILE A 14 0.434 -5.530 -0.022 1.00 0.00 C ATOM 182 CG2 ILE A 14 0.174 -6.419 2.309 1.00 0.00 C ATOM 183 CD1 ILE A 14 0.848 -5.890 -1.431 1.00 0.00 C ATOM 0 H ILE A 14 3.020 -6.978 -0.456 1.00 0.00 H new ATOM 0 HA ILE A 14 2.513 -5.016 1.614 1.00 0.00 H new ATOM 0 HB ILE A 14 1.002 -7.480 0.655 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -0.654 -5.550 0.045 1.00 0.00 H new ATOM 0 HG13 ILE A 14 0.748 -4.508 0.190 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -0.853 -6.696 2.072 1.00 0.00 H new ATOM 0 HG22 ILE A 14 0.579 -7.119 3.039 1.00 0.00 H new ATOM 0 HG23 ILE A 14 0.192 -5.411 2.724 1.00 0.00 H new ATOM 0 HD11 ILE A 14 0.399 -5.187 -2.133 1.00 0.00 H new ATOM 0 HD12 ILE A 14 1.934 -5.842 -1.515 1.00 0.00 H new ATOM 0 HD13 ILE A 14 0.510 -6.900 -1.663 1.00 0.00 H new ATOM 195 N LYS A 15 3.362 -6.219 3.606 1.00 0.00 N ATOM 196 CA LYS A 15 3.852 -6.890 4.805 1.00 0.00 C ATOM 197 C LYS A 15 3.086 -6.425 6.039 1.00 0.00 C ATOM 198 O LYS A 15 2.991 -5.227 6.308 1.00 0.00 O ATOM 199 CB LYS A 15 5.348 -6.622 4.988 1.00 0.00 C ATOM 200 CG LYS A 15 5.963 -7.383 6.150 1.00 0.00 C ATOM 201 CD LYS A 15 7.477 -7.253 6.162 1.00 0.00 C ATOM 202 CE LYS A 15 8.099 -8.088 7.270 1.00 0.00 C ATOM 203 NZ LYS A 15 8.398 -9.475 6.818 1.00 0.00 N ATOM 0 H LYS A 15 3.353 -5.201 3.667 1.00 0.00 H new ATOM 0 HA LYS A 15 3.693 -7.962 4.683 1.00 0.00 H new ATOM 0 HB2 LYS A 15 5.872 -6.890 4.071 1.00 0.00 H new ATOM 0 HB3 LYS A 15 5.501 -5.554 5.142 1.00 0.00 H new ATOM 0 HG2 LYS A 15 5.557 -7.006 7.089 1.00 0.00 H new ATOM 0 HG3 LYS A 15 5.688 -8.436 6.083 1.00 0.00 H new ATOM 0 HD2 LYS A 15 7.878 -7.568 5.199 1.00 0.00 H new ATOM 0 HD3 LYS A 15 7.752 -6.207 6.295 1.00 0.00 H new ATOM 0 HE2 LYS A 15 9.018 -7.611 7.612 1.00 0.00 H new ATOM 0 HE3 LYS A 15 7.421 -8.122 8.123 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 8.942 -9.970 7.553 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 7.507 -9.983 6.645 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 8.954 -9.442 5.940 1.00 0.00 H new ATOM 217 N CYS A 16 2.544 -7.379 6.787 1.00 0.00 N ATOM 218 CA CYS A 16 1.787 -7.067 7.995 1.00 0.00 C ATOM 219 C CYS A 16 2.697 -7.053 9.219 1.00 0.00 C ATOM 220 O CYS A 16 3.235 -8.087 9.616 1.00 0.00 O ATOM 221 CB CYS A 16 0.661 -8.083 8.193 1.00 0.00 C ATOM 222 SG CYS A 16 -0.756 -7.837 7.097 1.00 0.00 S ATOM 0 H CYS A 16 2.614 -8.375 6.579 1.00 0.00 H new ATOM 0 HA CYS A 16 1.354 -6.074 7.876 1.00 0.00 H new ATOM 0 HB2 CYS A 16 1.059 -9.086 8.036 1.00 0.00 H new ATOM 0 HB3 CYS A 16 0.320 -8.034 9.227 1.00 0.00 H new ATOM 0 HG CYS A 16 -1.058 -8.962 6.519 1.00 0.00 H new ATOM 228 N SER A 17 2.867 -5.875 9.811 1.00 0.00 N ATOM 229 CA SER A 17 3.716 -5.726 10.986 1.00 0.00 C ATOM 230 C SER A 17 3.139 -6.489 12.175 1.00 0.00 C ATOM 231 O SER A 17 3.869 -7.132 12.927 1.00 0.00 O ATOM 232 CB SER A 17 3.873 -4.246 11.343 1.00 0.00 C ATOM 233 OG SER A 17 5.041 -4.030 12.116 1.00 0.00 O ATOM 0 H SER A 17 2.428 -5.010 9.496 1.00 0.00 H new ATOM 0 HA SER A 17 4.695 -6.142 10.751 1.00 0.00 H new ATOM 0 HB2 SER A 17 3.922 -3.652 10.431 1.00 0.00 H new ATOM 0 HB3 SER A 17 2.998 -3.907 11.898 1.00 0.00 H new ATOM 0 HG SER A 17 5.120 -3.077 12.330 1.00 0.00 H new ATOM 239 N ASN A 18 1.822 -6.411 12.336 1.00 0.00 N ATOM 240 CA ASN A 18 1.145 -7.094 13.433 1.00 0.00 C ATOM 241 C ASN A 18 1.151 -8.605 13.220 1.00 0.00 C ATOM 242 O ASN A 18 0.762 -9.367 14.104 1.00 0.00 O ATOM 243 CB ASN A 18 -0.294 -6.592 13.563 1.00 0.00 C ATOM 244 CG ASN A 18 -0.803 -6.656 14.990 1.00 0.00 C ATOM 245 OD1 ASN A 18 -0.102 -6.275 15.928 1.00 0.00 O ATOM 246 ND2 ASN A 18 -2.027 -7.140 15.161 1.00 0.00 N ATOM 0 H ASN A 18 1.203 -5.882 11.722 1.00 0.00 H new ATOM 0 HA ASN A 18 1.685 -6.873 14.354 1.00 0.00 H new ATOM 0 HB2 ASN A 18 -0.351 -5.564 13.206 1.00 0.00 H new ATOM 0 HB3 ASN A 18 -0.943 -7.188 12.922 1.00 0.00 H new ATOM 0 HD21 ASN A 18 -2.422 -7.208 16.099 1.00 0.00 H new ATOM 0 HD22 ASN A 18 -2.572 -7.444 14.355 1.00 0.00 H new ATOM 253 N GLN A 19 1.597 -9.029 12.042 1.00 0.00 N ATOM 254 CA GLN A 19 1.653 -10.448 11.713 1.00 0.00 C ATOM 255 C GLN A 19 3.027 -10.827 11.170 1.00 0.00 C ATOM 256 O GLN A 19 3.300 -10.717 9.974 1.00 0.00 O ATOM 257 CB GLN A 19 0.572 -10.800 10.690 1.00 0.00 C ATOM 258 CG GLN A 19 -0.750 -10.092 10.934 1.00 0.00 C ATOM 259 CD GLN A 19 -1.890 -10.691 10.133 1.00 0.00 C ATOM 260 OE1 GLN A 19 -2.312 -10.133 9.120 1.00 0.00 O ATOM 261 NE2 GLN A 19 -2.394 -11.833 10.584 1.00 0.00 N ATOM 0 H GLN A 19 1.925 -8.410 11.300 1.00 0.00 H new ATOM 0 HA GLN A 19 1.475 -11.014 12.627 1.00 0.00 H new ATOM 0 HB2 GLN A 19 0.931 -10.547 9.693 1.00 0.00 H new ATOM 0 HB3 GLN A 19 0.406 -11.877 10.705 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -0.993 -10.140 11.996 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -0.646 -9.038 10.678 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -2.013 -12.260 11.428 1.00 0.00 H new ATOM 0 HE22 GLN A 19 -3.162 -12.283 10.086 1.00 0.00 H new ATOM 270 N PRO A 20 3.914 -11.282 12.067 1.00 0.00 N ATOM 271 CA PRO A 20 5.275 -11.686 11.700 1.00 0.00 C ATOM 272 C PRO A 20 5.297 -12.972 10.880 1.00 0.00 C ATOM 273 O PRO A 20 6.209 -13.195 10.086 1.00 0.00 O ATOM 274 CB PRO A 20 5.957 -11.904 13.053 1.00 0.00 C ATOM 275 CG PRO A 20 4.845 -12.224 13.991 1.00 0.00 C ATOM 276 CD PRO A 20 3.657 -11.439 13.508 1.00 0.00 C ATOM 0 HA PRO A 20 5.766 -10.941 11.074 1.00 0.00 H new ATOM 0 HB2 PRO A 20 6.681 -12.718 13.005 1.00 0.00 H new ATOM 0 HB3 PRO A 20 6.499 -11.013 13.371 1.00 0.00 H new ATOM 0 HG2 PRO A 20 4.632 -13.293 13.993 1.00 0.00 H new ATOM 0 HG3 PRO A 20 5.105 -11.949 15.013 1.00 0.00 H new ATOM 0 HD2 PRO A 20 2.723 -11.969 13.694 1.00 0.00 H new ATOM 0 HD3 PRO A 20 3.582 -10.474 14.010 1.00 0.00 H new ATOM 284 N GLU A 21 4.286 -13.812 11.078 1.00 0.00 N ATOM 285 CA GLU A 21 4.191 -15.075 10.356 1.00 0.00 C ATOM 286 C GLU A 21 3.565 -14.869 8.979 1.00 0.00 C ATOM 287 O GLU A 21 3.909 -15.560 8.020 1.00 0.00 O ATOM 288 CB GLU A 21 3.366 -16.085 11.156 1.00 0.00 C ATOM 289 CG GLU A 21 4.114 -16.681 12.337 1.00 0.00 C ATOM 290 CD GLU A 21 5.214 -17.634 11.911 1.00 0.00 C ATOM 291 OE1 GLU A 21 4.892 -18.690 11.327 1.00 0.00 O ATOM 292 OE2 GLU A 21 6.397 -17.322 12.160 1.00 0.00 O ATOM 0 H GLU A 21 3.522 -13.641 11.732 1.00 0.00 H new ATOM 0 HA GLU A 21 5.200 -15.464 10.223 1.00 0.00 H new ATOM 0 HB2 GLU A 21 2.461 -15.597 11.518 1.00 0.00 H new ATOM 0 HB3 GLU A 21 3.050 -16.890 10.493 1.00 0.00 H new ATOM 0 HG2 GLU A 21 4.546 -15.876 12.932 1.00 0.00 H new ATOM 0 HG3 GLU A 21 3.409 -17.209 12.979 1.00 0.00 H new ATOM 299 N ARG A 22 2.645 -13.914 8.891 1.00 0.00 N ATOM 300 CA ARG A 22 1.970 -13.618 7.633 1.00 0.00 C ATOM 301 C ARG A 22 2.978 -13.472 6.496 1.00 0.00 C ATOM 302 O ARG A 22 3.790 -12.548 6.490 1.00 0.00 O ATOM 303 CB ARG A 22 1.143 -12.337 7.763 1.00 0.00 C ATOM 304 CG ARG A 22 0.184 -12.112 6.605 1.00 0.00 C ATOM 305 CD ARG A 22 -1.174 -12.741 6.877 1.00 0.00 C ATOM 306 NE ARG A 22 -1.237 -14.126 6.416 1.00 0.00 N ATOM 307 CZ ARG A 22 -1.202 -14.477 5.136 1.00 0.00 C ATOM 308 NH1 ARG A 22 -1.103 -13.550 4.193 1.00 0.00 N ATOM 309 NH2 ARG A 22 -1.264 -15.758 4.796 1.00 0.00 N ATOM 0 H ARG A 22 2.350 -13.332 9.675 1.00 0.00 H new ATOM 0 HA ARG A 22 1.305 -14.450 7.402 1.00 0.00 H new ATOM 0 HB2 ARG A 22 0.575 -12.374 8.692 1.00 0.00 H new ATOM 0 HB3 ARG A 22 1.818 -11.484 7.836 1.00 0.00 H new ATOM 0 HG2 ARG A 22 0.063 -11.042 6.434 1.00 0.00 H new ATOM 0 HG3 ARG A 22 0.606 -12.535 5.694 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -1.383 -12.705 7.946 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -1.950 -12.158 6.381 1.00 0.00 H new ATOM 0 HE ARG A 22 -1.312 -14.864 7.116 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -1.053 -12.564 4.450 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -1.076 -13.823 3.211 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -1.339 -16.474 5.518 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -1.237 -16.026 3.812 1.00 0.00 H new ATOM 323 N GLN A 23 2.918 -14.391 5.538 1.00 0.00 N ATOM 324 CA GLN A 23 3.826 -14.365 4.397 1.00 0.00 C ATOM 325 C GLN A 23 3.717 -13.043 3.645 1.00 0.00 C ATOM 326 O GLN A 23 2.750 -12.299 3.815 1.00 0.00 O ATOM 327 CB GLN A 23 3.525 -15.530 3.452 1.00 0.00 C ATOM 328 CG GLN A 23 2.075 -15.589 3.001 1.00 0.00 C ATOM 329 CD GLN A 23 1.732 -16.891 2.306 1.00 0.00 C ATOM 330 OE1 GLN A 23 2.272 -17.203 1.244 1.00 0.00 O ATOM 331 NE2 GLN A 23 0.830 -17.662 2.903 1.00 0.00 N ATOM 0 H GLN A 23 2.251 -15.162 5.529 1.00 0.00 H new ATOM 0 HA GLN A 23 4.844 -14.465 4.773 1.00 0.00 H new ATOM 0 HB2 GLN A 23 4.167 -15.450 2.575 1.00 0.00 H new ATOM 0 HB3 GLN A 23 3.780 -16.466 3.949 1.00 0.00 H new ATOM 0 HG2 GLN A 23 1.424 -15.461 3.866 1.00 0.00 H new ATOM 0 HG3 GLN A 23 1.875 -14.757 2.325 1.00 0.00 H new ATOM 0 HE21 GLN A 23 0.407 -17.365 3.782 1.00 0.00 H new ATOM 0 HE22 GLN A 23 0.560 -18.551 2.482 1.00 0.00 H new ATOM 340 N ILE A 24 4.713 -12.757 2.814 1.00 0.00 N ATOM 341 CA ILE A 24 4.728 -11.525 2.035 1.00 0.00 C ATOM 342 C ILE A 24 3.890 -11.665 0.769 1.00 0.00 C ATOM 343 O ILE A 24 3.879 -12.718 0.131 1.00 0.00 O ATOM 344 CB ILE A 24 6.163 -11.123 1.645 1.00 0.00 C ATOM 345 CG1 ILE A 24 7.062 -11.094 2.883 1.00 0.00 C ATOM 346 CG2 ILE A 24 6.163 -9.769 0.951 1.00 0.00 C ATOM 347 CD1 ILE A 24 6.792 -9.920 3.798 1.00 0.00 C ATOM 0 H ILE A 24 5.520 -13.362 2.663 1.00 0.00 H new ATOM 0 HA ILE A 24 4.300 -10.747 2.667 1.00 0.00 H new ATOM 0 HB ILE A 24 6.557 -11.865 0.951 1.00 0.00 H new ATOM 0 HG12 ILE A 24 6.926 -12.019 3.443 1.00 0.00 H new ATOM 0 HG13 ILE A 24 8.104 -11.064 2.565 1.00 0.00 H new ATOM 0 HG21 ILE A 24 7.184 -9.498 0.681 1.00 0.00 H new ATOM 0 HG22 ILE A 24 5.552 -9.822 0.050 1.00 0.00 H new ATOM 0 HG23 ILE A 24 5.753 -9.015 1.624 1.00 0.00 H new ATOM 0 HD11 ILE A 24 7.465 -9.964 4.654 1.00 0.00 H new ATOM 0 HD12 ILE A 24 6.956 -8.990 3.254 1.00 0.00 H new ATOM 0 HD13 ILE A 24 5.760 -9.960 4.146 1.00 0.00 H new ATOM 359 N LEU A 25 3.189 -10.595 0.410 1.00 0.00 N ATOM 360 CA LEU A 25 2.347 -10.597 -0.782 1.00 0.00 C ATOM 361 C LEU A 25 2.801 -9.526 -1.770 1.00 0.00 C ATOM 362 O LEU A 25 3.414 -8.532 -1.383 1.00 0.00 O ATOM 363 CB LEU A 25 0.885 -10.366 -0.398 1.00 0.00 C ATOM 364 CG LEU A 25 0.469 -10.860 0.988 1.00 0.00 C ATOM 365 CD1 LEU A 25 -0.740 -10.085 1.490 1.00 0.00 C ATOM 366 CD2 LEU A 25 0.172 -12.352 0.956 1.00 0.00 C ATOM 0 H LEU A 25 3.187 -9.716 0.927 1.00 0.00 H new ATOM 0 HA LEU A 25 2.440 -11.571 -1.262 1.00 0.00 H new ATOM 0 HB2 LEU A 25 0.679 -9.297 -0.458 1.00 0.00 H new ATOM 0 HB3 LEU A 25 0.254 -10.854 -1.140 1.00 0.00 H new ATOM 0 HG LEU A 25 1.296 -10.689 1.677 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -1.022 -10.450 2.478 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -0.493 -9.025 1.552 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -1.573 -10.224 0.801 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -0.122 -12.686 1.951 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -0.638 -12.547 0.253 1.00 0.00 H new ATOM 0 HD23 LEU A 25 1.064 -12.894 0.641 1.00 0.00 H new ATOM 378 N GLU A 26 2.492 -9.737 -3.046 1.00 0.00 N ATOM 379 CA GLU A 26 2.867 -8.789 -4.088 1.00 0.00 C ATOM 380 C GLU A 26 1.650 -8.375 -4.910 1.00 0.00 C ATOM 381 O GLU A 26 0.975 -9.214 -5.508 1.00 0.00 O ATOM 382 CB GLU A 26 3.931 -9.398 -5.003 1.00 0.00 C ATOM 383 CG GLU A 26 4.698 -8.367 -5.815 1.00 0.00 C ATOM 384 CD GLU A 26 4.045 -8.073 -7.151 1.00 0.00 C ATOM 385 OE1 GLU A 26 3.182 -7.172 -7.204 1.00 0.00 O ATOM 386 OE2 GLU A 26 4.397 -8.743 -8.144 1.00 0.00 O ATOM 0 H GLU A 26 1.984 -10.555 -3.382 1.00 0.00 H new ATOM 0 HA GLU A 26 3.277 -7.902 -3.606 1.00 0.00 H new ATOM 0 HB2 GLU A 26 4.635 -9.969 -4.398 1.00 0.00 H new ATOM 0 HB3 GLU A 26 3.453 -10.102 -5.684 1.00 0.00 H new ATOM 0 HG2 GLU A 26 4.776 -7.443 -5.242 1.00 0.00 H new ATOM 0 HG3 GLU A 26 5.714 -8.725 -5.982 1.00 0.00 H new ATOM 393 N LYS A 27 1.375 -7.075 -4.936 1.00 0.00 N ATOM 394 CA LYS A 27 0.240 -6.547 -5.684 1.00 0.00 C ATOM 395 C LYS A 27 0.625 -5.271 -6.426 1.00 0.00 C ATOM 396 O LYS A 27 1.470 -4.506 -5.964 1.00 0.00 O ATOM 397 CB LYS A 27 -0.933 -6.269 -4.742 1.00 0.00 C ATOM 398 CG LYS A 27 -2.170 -5.743 -5.450 1.00 0.00 C ATOM 399 CD LYS A 27 -3.097 -6.872 -5.865 1.00 0.00 C ATOM 400 CE LYS A 27 -4.122 -7.178 -4.783 1.00 0.00 C ATOM 401 NZ LYS A 27 -3.636 -8.221 -3.838 1.00 0.00 N ATOM 0 H LYS A 27 1.923 -6.367 -4.447 1.00 0.00 H new ATOM 0 HA LYS A 27 -0.061 -7.296 -6.417 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -1.190 -7.187 -4.214 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -0.620 -5.545 -3.989 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -2.703 -5.057 -4.792 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -1.872 -5.173 -6.330 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -3.610 -6.602 -6.788 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -2.511 -7.767 -6.076 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -4.351 -6.266 -4.231 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -5.050 -7.512 -5.246 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -4.446 -8.643 -3.341 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -3.131 -8.960 -4.367 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -2.992 -7.789 -3.146 1.00 0.00 H new ATOM 415 N GLN A 28 -0.003 -5.049 -7.576 1.00 0.00 N ATOM 416 CA GLN A 28 0.273 -3.864 -8.380 1.00 0.00 C ATOM 417 C GLN A 28 -0.970 -2.991 -8.508 1.00 0.00 C ATOM 418 O GLN A 28 -2.008 -3.437 -9.000 1.00 0.00 O ATOM 419 CB GLN A 28 0.771 -4.270 -9.768 1.00 0.00 C ATOM 420 CG GLN A 28 2.284 -4.382 -9.863 1.00 0.00 C ATOM 421 CD GLN A 28 2.807 -4.066 -11.251 1.00 0.00 C ATOM 422 OE1 GLN A 28 3.783 -3.169 -11.326 1.00 0.00 O flip ATOM 423 NE2 GLN A 28 2.339 -4.623 -12.244 1.00 0.00 N flip ATOM 0 H GLN A 28 -0.706 -5.673 -7.972 1.00 0.00 H new ATOM 0 HA GLN A 28 1.049 -3.287 -7.877 1.00 0.00 H new ATOM 0 HB2 GLN A 28 0.326 -5.228 -10.039 1.00 0.00 H new ATOM 0 HB3 GLN A 28 0.423 -3.539 -10.498 1.00 0.00 H new ATOM 0 HG2 GLN A 28 2.741 -3.702 -9.143 1.00 0.00 H new ATOM 0 HG3 GLN A 28 2.588 -5.391 -9.585 1.00 0.00 H new ATOM 0 HE21 GLN A 28 1.589 -5.306 -12.139 1.00 0.00 H new ATOM 0 HE22 GLN A 28 2.701 -4.401 -13.171 1.00 0.00 H new ATOM 432 N LEU A 29 -0.860 -1.744 -8.062 1.00 0.00 N ATOM 433 CA LEU A 29 -1.976 -0.807 -8.126 1.00 0.00 C ATOM 434 C LEU A 29 -1.533 0.527 -8.719 1.00 0.00 C ATOM 435 O LEU A 29 -0.374 0.926 -8.614 1.00 0.00 O ATOM 436 CB LEU A 29 -2.565 -0.588 -6.731 1.00 0.00 C ATOM 437 CG LEU A 29 -2.750 -1.843 -5.877 1.00 0.00 C ATOM 438 CD1 LEU A 29 -3.648 -2.844 -6.586 1.00 0.00 C ATOM 439 CD2 LEU A 29 -1.402 -2.469 -5.550 1.00 0.00 C ATOM 0 H LEU A 29 -0.009 -1.359 -7.652 1.00 0.00 H new ATOM 0 HA LEU A 29 -2.741 -1.235 -8.773 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -1.919 0.104 -6.190 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -3.534 -0.100 -6.840 1.00 0.00 H new ATOM 0 HG LEU A 29 -3.230 -1.555 -4.942 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -3.768 -3.730 -5.963 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -4.624 -2.393 -6.767 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -3.197 -3.127 -7.537 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -1.553 -3.361 -4.942 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -0.894 -2.742 -6.475 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -0.792 -1.753 -4.999 1.00 0.00 H new ATOM 451 N PRO A 30 -2.479 1.235 -9.355 1.00 0.00 N ATOM 452 CA PRO A 30 -2.210 2.536 -9.974 1.00 0.00 C ATOM 453 C PRO A 30 -1.950 3.627 -8.941 1.00 0.00 C ATOM 454 O PRO A 30 -2.807 3.925 -8.109 1.00 0.00 O ATOM 455 CB PRO A 30 -3.496 2.831 -10.750 1.00 0.00 C ATOM 456 CG PRO A 30 -4.554 2.060 -10.039 1.00 0.00 C ATOM 457 CD PRO A 30 -3.882 0.820 -9.518 1.00 0.00 C ATOM 0 HA PRO A 30 -1.315 2.514 -10.596 1.00 0.00 H new ATOM 0 HB2 PRO A 30 -3.719 3.898 -10.755 1.00 0.00 H new ATOM 0 HB3 PRO A 30 -3.411 2.519 -11.791 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -4.982 2.644 -9.224 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -5.372 1.807 -10.713 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -4.317 0.494 -8.573 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -3.976 -0.012 -10.216 1.00 0.00 H new ATOM 465 N ASP A 31 -0.763 4.220 -9.000 1.00 0.00 N ATOM 466 CA ASP A 31 -0.390 5.280 -8.070 1.00 0.00 C ATOM 467 C ASP A 31 -1.516 6.298 -7.927 1.00 0.00 C ATOM 468 O ASP A 31 -1.578 7.037 -6.944 1.00 0.00 O ATOM 469 CB ASP A 31 0.887 5.976 -8.543 1.00 0.00 C ATOM 470 CG ASP A 31 0.631 6.944 -9.681 1.00 0.00 C ATOM 471 OD1 ASP A 31 -0.286 6.683 -10.488 1.00 0.00 O ATOM 472 OD2 ASP A 31 1.347 7.964 -9.765 1.00 0.00 O ATOM 0 H ASP A 31 -0.042 3.985 -9.682 1.00 0.00 H new ATOM 0 HA ASP A 31 -0.208 4.827 -7.095 1.00 0.00 H new ATOM 0 HB2 ASP A 31 1.336 6.513 -7.707 1.00 0.00 H new ATOM 0 HB3 ASP A 31 1.609 5.225 -8.864 1.00 0.00 H new ATOM 477 N SER A 32 -2.406 6.332 -8.915 1.00 0.00 N ATOM 478 CA SER A 32 -3.528 7.264 -8.901 1.00 0.00 C ATOM 479 C SER A 32 -4.492 6.935 -7.766 1.00 0.00 C ATOM 480 O SER A 32 -4.986 7.829 -7.078 1.00 0.00 O ATOM 481 CB SER A 32 -4.266 7.225 -10.240 1.00 0.00 C ATOM 482 OG SER A 32 -3.758 8.202 -11.132 1.00 0.00 O ATOM 0 H SER A 32 -2.372 5.725 -9.734 1.00 0.00 H new ATOM 0 HA SER A 32 -3.134 8.268 -8.740 1.00 0.00 H new ATOM 0 HB2 SER A 32 -4.166 6.235 -10.685 1.00 0.00 H new ATOM 0 HB3 SER A 32 -5.330 7.395 -10.077 1.00 0.00 H new ATOM 0 HG SER A 32 -4.245 8.155 -11.981 1.00 0.00 H new ATOM 488 N MET A 33 -4.756 5.647 -7.576 1.00 0.00 N ATOM 489 CA MET A 33 -5.661 5.199 -6.523 1.00 0.00 C ATOM 490 C MET A 33 -5.350 5.901 -5.205 1.00 0.00 C ATOM 491 O MET A 33 -4.197 5.957 -4.775 1.00 0.00 O ATOM 492 CB MET A 33 -5.559 3.683 -6.344 1.00 0.00 C ATOM 493 CG MET A 33 -6.833 3.048 -5.810 1.00 0.00 C ATOM 494 SD MET A 33 -7.060 1.355 -6.389 1.00 0.00 S ATOM 495 CE MET A 33 -6.302 0.436 -5.051 1.00 0.00 C ATOM 0 H MET A 33 -4.356 4.895 -8.137 1.00 0.00 H new ATOM 0 HA MET A 33 -6.678 5.454 -6.819 1.00 0.00 H new ATOM 0 HB2 MET A 33 -5.310 3.228 -7.303 1.00 0.00 H new ATOM 0 HB3 MET A 33 -4.738 3.460 -5.662 1.00 0.00 H new ATOM 0 HG2 MET A 33 -6.809 3.055 -4.720 1.00 0.00 H new ATOM 0 HG3 MET A 33 -7.689 3.650 -6.114 1.00 0.00 H new ATOM 0 HE1 MET A 33 -6.633 -0.602 -5.089 1.00 0.00 H new ATOM 0 HE2 MET A 33 -5.217 0.475 -5.151 1.00 0.00 H new ATOM 0 HE3 MET A 33 -6.594 0.875 -4.097 1.00 0.00 H new ATOM 505 N THR A 34 -6.385 6.436 -4.565 1.00 0.00 N ATOM 506 CA THR A 34 -6.222 7.135 -3.297 1.00 0.00 C ATOM 507 C THR A 34 -5.971 6.155 -2.157 1.00 0.00 C ATOM 508 O THR A 34 -6.562 5.076 -2.111 1.00 0.00 O ATOM 509 CB THR A 34 -7.461 7.987 -2.962 1.00 0.00 C ATOM 510 OG1 THR A 34 -8.652 7.211 -3.136 1.00 0.00 O ATOM 511 CG2 THR A 34 -7.522 9.224 -3.845 1.00 0.00 C ATOM 0 H THR A 34 -7.346 6.398 -4.905 1.00 0.00 H new ATOM 0 HA THR A 34 -5.358 7.790 -3.406 1.00 0.00 H new ATOM 0 HB THR A 34 -7.385 8.305 -1.922 1.00 0.00 H new ATOM 0 HG1 THR A 34 -9.435 7.760 -2.919 1.00 0.00 H new ATOM 0 HG21 THR A 34 -8.405 9.810 -3.590 1.00 0.00 H new ATOM 0 HG22 THR A 34 -6.628 9.828 -3.688 1.00 0.00 H new ATOM 0 HG23 THR A 34 -7.576 8.922 -4.891 1.00 0.00 H new ATOM 519 N VAL A 35 -5.090 6.537 -1.238 1.00 0.00 N ATOM 520 CA VAL A 35 -4.762 5.691 -0.096 1.00 0.00 C ATOM 521 C VAL A 35 -6.014 5.055 0.495 1.00 0.00 C ATOM 522 O VAL A 35 -5.979 3.922 0.976 1.00 0.00 O ATOM 523 CB VAL A 35 -4.037 6.490 1.004 1.00 0.00 C ATOM 524 CG1 VAL A 35 -3.820 5.626 2.237 1.00 0.00 C ATOM 525 CG2 VAL A 35 -2.714 7.033 0.484 1.00 0.00 C ATOM 0 H VAL A 35 -4.591 7.426 -1.262 1.00 0.00 H new ATOM 0 HA VAL A 35 -4.099 4.907 -0.463 1.00 0.00 H new ATOM 0 HB VAL A 35 -4.664 7.335 1.288 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -3.307 6.207 3.003 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -4.784 5.291 2.621 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -3.214 4.760 1.972 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -2.215 7.595 1.274 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -2.078 6.205 0.171 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -2.899 7.689 -0.366 1.00 0.00 H new ATOM 535 N GLN A 36 -7.120 5.791 0.456 1.00 0.00 N ATOM 536 CA GLN A 36 -8.385 5.298 0.988 1.00 0.00 C ATOM 537 C GLN A 36 -8.792 3.996 0.306 1.00 0.00 C ATOM 538 O GLN A 36 -9.219 3.046 0.962 1.00 0.00 O ATOM 539 CB GLN A 36 -9.483 6.347 0.806 1.00 0.00 C ATOM 540 CG GLN A 36 -10.708 6.102 1.672 1.00 0.00 C ATOM 541 CD GLN A 36 -11.916 6.894 1.212 1.00 0.00 C ATOM 542 OE1 GLN A 36 -12.424 7.751 1.936 1.00 0.00 O ATOM 543 NE2 GLN A 36 -12.383 6.612 0.002 1.00 0.00 N ATOM 0 H GLN A 36 -7.166 6.731 0.062 1.00 0.00 H new ATOM 0 HA GLN A 36 -8.251 5.103 2.052 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -9.076 7.331 1.037 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -9.786 6.366 -0.241 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -10.949 5.039 1.661 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -10.477 6.366 2.704 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -11.931 5.894 -0.564 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -13.194 7.113 -0.361 1.00 0.00 H new ATOM 552 N LYS A 37 -8.657 3.958 -1.015 1.00 0.00 N ATOM 553 CA LYS A 37 -9.009 2.773 -1.788 1.00 0.00 C ATOM 554 C LYS A 37 -8.117 1.594 -1.412 1.00 0.00 C ATOM 555 O LYS A 37 -8.602 0.491 -1.160 1.00 0.00 O ATOM 556 CB LYS A 37 -8.889 3.061 -3.286 1.00 0.00 C ATOM 557 CG LYS A 37 -10.171 3.583 -3.910 1.00 0.00 C ATOM 558 CD LYS A 37 -10.277 3.194 -5.375 1.00 0.00 C ATOM 559 CE LYS A 37 -11.727 3.124 -5.829 1.00 0.00 C ATOM 560 NZ LYS A 37 -12.521 2.171 -5.005 1.00 0.00 N ATOM 0 H LYS A 37 -8.306 4.736 -1.574 1.00 0.00 H new ATOM 0 HA LYS A 37 -10.042 2.513 -1.557 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -8.095 3.790 -3.445 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -8.590 2.147 -3.800 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -11.029 3.189 -3.365 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -10.206 4.668 -3.817 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -9.738 3.919 -5.985 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -9.798 2.227 -5.532 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -12.175 4.116 -5.769 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -11.766 2.819 -6.875 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -13.282 1.762 -5.584 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -11.901 1.410 -4.660 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -12.935 2.674 -4.194 1.00 0.00 H new ATOM 574 N VAL A 38 -6.810 1.835 -1.375 1.00 0.00 N ATOM 575 CA VAL A 38 -5.851 0.793 -1.028 1.00 0.00 C ATOM 576 C VAL A 38 -6.135 0.224 0.357 1.00 0.00 C ATOM 577 O VAL A 38 -5.985 -0.976 0.591 1.00 0.00 O ATOM 578 CB VAL A 38 -4.406 1.326 -1.066 1.00 0.00 C ATOM 579 CG1 VAL A 38 -3.430 0.258 -0.598 1.00 0.00 C ATOM 580 CG2 VAL A 38 -4.052 1.807 -2.465 1.00 0.00 C ATOM 0 H VAL A 38 -6.391 2.742 -1.581 1.00 0.00 H new ATOM 0 HA VAL A 38 -5.959 0.003 -1.771 1.00 0.00 H new ATOM 0 HB VAL A 38 -4.333 2.174 -0.386 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -2.415 0.653 -0.632 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -3.672 -0.033 0.424 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -3.503 -0.612 -1.250 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -3.028 2.180 -2.473 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -4.142 0.979 -3.168 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -4.732 2.607 -2.758 1.00 0.00 H new ATOM 590 N LYS A 39 -6.546 1.093 1.275 1.00 0.00 N ATOM 591 CA LYS A 39 -6.854 0.678 2.638 1.00 0.00 C ATOM 592 C LYS A 39 -8.165 -0.102 2.687 1.00 0.00 C ATOM 593 O LYS A 39 -8.294 -1.071 3.433 1.00 0.00 O ATOM 594 CB LYS A 39 -6.939 1.898 3.558 1.00 0.00 C ATOM 595 CG LYS A 39 -5.603 2.584 3.783 1.00 0.00 C ATOM 596 CD LYS A 39 -5.753 3.827 4.644 1.00 0.00 C ATOM 597 CE LYS A 39 -4.410 4.298 5.182 1.00 0.00 C ATOM 598 NZ LYS A 39 -4.537 5.559 5.963 1.00 0.00 N ATOM 0 H LYS A 39 -6.673 2.090 1.099 1.00 0.00 H new ATOM 0 HA LYS A 39 -6.051 0.026 2.983 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -7.639 2.616 3.132 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -7.346 1.589 4.521 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -4.912 1.890 4.262 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -5.166 2.856 2.822 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -6.211 4.624 4.058 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -6.425 3.616 5.475 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -3.979 3.521 5.814 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -3.720 4.453 4.352 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -3.591 5.946 6.153 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -5.091 6.250 5.418 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -5.018 5.362 6.864 1.00 0.00 H new ATOM 612 N GLY A 40 -9.134 0.329 1.886 1.00 0.00 N ATOM 613 CA GLY A 40 -10.421 -0.341 1.852 1.00 0.00 C ATOM 614 C GLY A 40 -10.350 -1.702 1.188 1.00 0.00 C ATOM 615 O GLY A 40 -11.082 -2.621 1.557 1.00 0.00 O ATOM 0 H GLY A 40 -9.051 1.130 1.260 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -10.794 -0.456 2.870 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -11.138 0.283 1.318 1.00 0.00 H new ATOM 619 N LEU A 41 -9.467 -1.832 0.204 1.00 0.00 N ATOM 620 CA LEU A 41 -9.303 -3.090 -0.516 1.00 0.00 C ATOM 621 C LEU A 41 -8.821 -4.194 0.420 1.00 0.00 C ATOM 622 O LEU A 41 -9.304 -5.326 0.364 1.00 0.00 O ATOM 623 CB LEU A 41 -8.314 -2.916 -1.669 1.00 0.00 C ATOM 624 CG LEU A 41 -7.852 -4.201 -2.357 1.00 0.00 C ATOM 625 CD1 LEU A 41 -8.816 -4.589 -3.468 1.00 0.00 C ATOM 626 CD2 LEU A 41 -6.442 -4.036 -2.905 1.00 0.00 C ATOM 0 H LEU A 41 -8.854 -1.082 -0.114 1.00 0.00 H new ATOM 0 HA LEU A 41 -10.274 -3.378 -0.919 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -8.771 -2.270 -2.419 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -7.435 -2.394 -1.292 1.00 0.00 H new ATOM 0 HG LEU A 41 -7.841 -5.002 -1.618 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -8.470 -5.506 -3.946 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -9.809 -4.751 -3.048 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -8.860 -3.789 -4.207 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -6.130 -4.960 -3.391 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -6.426 -3.222 -3.630 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -5.758 -3.807 -2.087 1.00 0.00 H new ATOM 638 N LEU A 42 -7.869 -3.857 1.282 1.00 0.00 N ATOM 639 CA LEU A 42 -7.322 -4.819 2.234 1.00 0.00 C ATOM 640 C LEU A 42 -8.153 -4.853 3.512 1.00 0.00 C ATOM 641 O LEU A 42 -8.114 -5.826 4.264 1.00 0.00 O ATOM 642 CB LEU A 42 -5.870 -4.470 2.565 1.00 0.00 C ATOM 643 CG LEU A 42 -4.863 -4.638 1.426 1.00 0.00 C ATOM 644 CD1 LEU A 42 -3.519 -4.039 1.810 1.00 0.00 C ATOM 645 CD2 LEU A 42 -4.709 -6.108 1.063 1.00 0.00 C ATOM 0 H LEU A 42 -7.459 -2.925 1.342 1.00 0.00 H new ATOM 0 HA LEU A 42 -7.356 -5.807 1.774 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -5.834 -3.435 2.905 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -5.549 -5.091 3.401 1.00 0.00 H new ATOM 0 HG LEU A 42 -5.239 -4.106 0.552 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -2.815 -4.168 0.988 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -3.641 -2.976 2.020 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -3.136 -4.543 2.698 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -3.989 -6.209 0.251 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -4.355 -6.662 1.932 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -5.672 -6.507 0.745 1.00 0.00 H new ATOM 657 N SER A 43 -8.906 -3.784 3.751 1.00 0.00 N ATOM 658 CA SER A 43 -9.746 -3.690 4.939 1.00 0.00 C ATOM 659 C SER A 43 -10.612 -4.937 5.092 1.00 0.00 C ATOM 660 O SER A 43 -10.951 -5.337 6.206 1.00 0.00 O ATOM 661 CB SER A 43 -10.633 -2.446 4.866 1.00 0.00 C ATOM 662 OG SER A 43 -11.839 -2.636 5.586 1.00 0.00 O ATOM 0 H SER A 43 -8.951 -2.971 3.137 1.00 0.00 H new ATOM 0 HA SER A 43 -9.094 -3.612 5.809 1.00 0.00 H new ATOM 0 HB2 SER A 43 -10.096 -1.588 5.271 1.00 0.00 H new ATOM 0 HB3 SER A 43 -10.860 -2.218 3.825 1.00 0.00 H new ATOM 0 HG SER A 43 -11.634 -2.810 6.528 1.00 0.00 H new ATOM 668 N ARG A 44 -10.965 -5.546 3.966 1.00 0.00 N ATOM 669 CA ARG A 44 -11.792 -6.747 3.973 1.00 0.00 C ATOM 670 C ARG A 44 -10.931 -7.999 4.117 1.00 0.00 C ATOM 671 O ARG A 44 -11.420 -9.061 4.504 1.00 0.00 O ATOM 672 CB ARG A 44 -12.621 -6.830 2.690 1.00 0.00 C ATOM 673 CG ARG A 44 -13.824 -5.901 2.682 1.00 0.00 C ATOM 674 CD ARG A 44 -14.947 -6.436 3.556 1.00 0.00 C ATOM 675 NE ARG A 44 -16.216 -5.764 3.290 1.00 0.00 N ATOM 676 CZ ARG A 44 -17.281 -5.866 4.077 1.00 0.00 C ATOM 677 NH1 ARG A 44 -17.230 -6.609 5.174 1.00 0.00 N ATOM 678 NH2 ARG A 44 -18.400 -5.223 3.768 1.00 0.00 N ATOM 0 H ARG A 44 -10.691 -5.228 3.036 1.00 0.00 H new ATOM 0 HA ARG A 44 -12.465 -6.689 4.828 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -11.983 -6.592 1.839 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -12.964 -7.856 2.554 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -13.525 -4.914 3.035 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -14.184 -5.778 1.660 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -15.061 -7.506 3.385 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -14.682 -6.308 4.605 1.00 0.00 H new ATOM 0 HE ARG A 44 -16.288 -5.184 2.454 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -16.371 -7.104 5.415 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -18.049 -6.686 5.777 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -18.443 -4.650 2.925 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -19.217 -5.302 4.373 1.00 0.00 H new ATOM 692 N LEU A 45 -9.647 -7.867 3.802 1.00 0.00 N ATOM 693 CA LEU A 45 -8.717 -8.987 3.896 1.00 0.00 C ATOM 694 C LEU A 45 -8.337 -9.260 5.347 1.00 0.00 C ATOM 695 O LEU A 45 -8.515 -10.371 5.849 1.00 0.00 O ATOM 696 CB LEU A 45 -7.460 -8.702 3.072 1.00 0.00 C ATOM 697 CG LEU A 45 -7.498 -9.152 1.611 1.00 0.00 C ATOM 698 CD1 LEU A 45 -7.733 -10.652 1.521 1.00 0.00 C ATOM 699 CD2 LEU A 45 -8.575 -8.395 0.848 1.00 0.00 C ATOM 0 H LEU A 45 -9.226 -6.996 3.479 1.00 0.00 H new ATOM 0 HA LEU A 45 -9.212 -9.873 3.498 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -7.270 -7.629 3.096 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -6.613 -9.187 3.559 1.00 0.00 H new ATOM 0 HG LEU A 45 -6.533 -8.928 1.156 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -7.757 -10.954 0.474 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -6.927 -11.178 2.032 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -8.684 -10.900 1.992 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -8.588 -8.728 -0.190 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -9.547 -8.588 1.303 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -8.363 -7.326 0.884 1.00 0.00 H new ATOM 711 N LEU A 46 -7.815 -8.239 6.018 1.00 0.00 N ATOM 712 CA LEU A 46 -7.412 -8.368 7.414 1.00 0.00 C ATOM 713 C LEU A 46 -8.569 -8.031 8.349 1.00 0.00 C ATOM 714 O LEU A 46 -8.392 -7.930 9.563 1.00 0.00 O ATOM 715 CB LEU A 46 -6.221 -7.453 7.708 1.00 0.00 C ATOM 716 CG LEU A 46 -4.963 -7.701 6.877 1.00 0.00 C ATOM 717 CD1 LEU A 46 -4.105 -6.446 6.818 1.00 0.00 C ATOM 718 CD2 LEU A 46 -4.168 -8.866 7.447 1.00 0.00 C ATOM 0 H LEU A 46 -7.661 -7.313 5.618 1.00 0.00 H new ATOM 0 HA LEU A 46 -7.119 -9.404 7.587 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -6.535 -6.421 7.555 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -5.962 -7.555 8.762 1.00 0.00 H new ATOM 0 HG LEU A 46 -5.267 -7.956 5.862 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -3.214 -6.642 6.222 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -4.675 -5.636 6.362 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -3.810 -6.159 7.827 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -3.276 -9.028 6.842 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -3.875 -8.640 8.472 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -4.783 -9.766 7.435 1.00 0.00 H new ATOM 730 N LYS A 47 -9.755 -7.860 7.775 1.00 0.00 N ATOM 731 CA LYS A 47 -10.944 -7.539 8.556 1.00 0.00 C ATOM 732 C LYS A 47 -10.712 -6.300 9.415 1.00 0.00 C ATOM 733 O LYS A 47 -11.172 -6.228 10.555 1.00 0.00 O ATOM 734 CB LYS A 47 -11.332 -8.723 9.444 1.00 0.00 C ATOM 735 CG LYS A 47 -11.628 -9.995 8.667 1.00 0.00 C ATOM 736 CD LYS A 47 -10.375 -10.833 8.472 1.00 0.00 C ATOM 737 CE LYS A 47 -10.717 -12.263 8.082 1.00 0.00 C ATOM 738 NZ LYS A 47 -11.222 -13.048 9.242 1.00 0.00 N ATOM 0 H LYS A 47 -9.919 -7.938 6.771 1.00 0.00 H new ATOM 0 HA LYS A 47 -11.759 -7.332 7.862 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -10.524 -8.918 10.149 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -12.210 -8.454 10.031 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -12.379 -10.580 9.197 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -12.051 -9.739 7.695 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -9.751 -10.383 7.699 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -9.791 -10.835 9.392 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -11.470 -12.254 7.294 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -9.832 -12.749 7.672 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -11.267 -14.055 8.986 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -10.580 -12.924 10.051 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -12.172 -12.714 9.500 1.00 0.00 H new ATOM 752 N VAL A 48 -9.997 -5.326 8.861 1.00 0.00 N ATOM 753 CA VAL A 48 -9.706 -4.089 9.576 1.00 0.00 C ATOM 754 C VAL A 48 -10.263 -2.881 8.832 1.00 0.00 C ATOM 755 O VAL A 48 -10.152 -2.767 7.611 1.00 0.00 O ATOM 756 CB VAL A 48 -8.191 -3.901 9.778 1.00 0.00 C ATOM 757 CG1 VAL A 48 -7.917 -2.713 10.688 1.00 0.00 C ATOM 758 CG2 VAL A 48 -7.567 -5.169 10.341 1.00 0.00 C ATOM 0 H VAL A 48 -9.608 -5.370 7.919 1.00 0.00 H new ATOM 0 HA VAL A 48 -10.188 -4.165 10.551 1.00 0.00 H new ATOM 0 HB VAL A 48 -7.735 -3.699 8.809 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -6.841 -2.596 10.819 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -8.329 -1.809 10.240 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -8.384 -2.882 11.658 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -6.496 -5.018 10.477 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -8.025 -5.405 11.301 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -7.732 -5.994 9.648 1.00 0.00 H new ATOM 768 N PRO A 49 -10.876 -1.954 9.583 1.00 0.00 N ATOM 769 CA PRO A 49 -11.462 -0.736 9.016 1.00 0.00 C ATOM 770 C PRO A 49 -10.401 0.236 8.509 1.00 0.00 C ATOM 771 O PRO A 49 -9.392 0.470 9.174 1.00 0.00 O ATOM 772 CB PRO A 49 -12.225 -0.127 10.195 1.00 0.00 C ATOM 773 CG PRO A 49 -11.530 -0.648 11.405 1.00 0.00 C ATOM 774 CD PRO A 49 -11.045 -2.024 11.044 1.00 0.00 C ATOM 0 HA PRO A 49 -12.089 -0.950 8.150 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -12.200 0.962 10.162 1.00 0.00 H new ATOM 0 HB3 PRO A 49 -13.274 -0.423 10.183 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -10.698 -0.002 11.685 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -12.207 -0.684 12.258 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -10.108 -2.264 11.546 1.00 0.00 H new ATOM 0 HD3 PRO A 49 -11.765 -2.791 11.329 1.00 0.00 H new ATOM 782 N VAL A 50 -10.637 0.799 7.329 1.00 0.00 N ATOM 783 CA VAL A 50 -9.702 1.747 6.734 1.00 0.00 C ATOM 784 C VAL A 50 -9.251 2.787 7.753 1.00 0.00 C ATOM 785 O VAL A 50 -8.189 3.392 7.609 1.00 0.00 O ATOM 786 CB VAL A 50 -10.326 2.466 5.523 1.00 0.00 C ATOM 787 CG1 VAL A 50 -9.514 3.699 5.158 1.00 0.00 C ATOM 788 CG2 VAL A 50 -10.434 1.518 4.338 1.00 0.00 C ATOM 0 H VAL A 50 -11.467 0.615 6.766 1.00 0.00 H new ATOM 0 HA VAL A 50 -8.838 1.172 6.400 1.00 0.00 H new ATOM 0 HB VAL A 50 -11.331 2.789 5.793 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -9.970 4.194 4.300 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -9.494 4.385 6.005 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -8.496 3.403 4.907 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -10.877 2.043 3.491 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -9.441 1.162 4.065 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -11.062 0.669 4.607 1.00 0.00 H new ATOM 798 N SER A 51 -10.067 2.991 8.782 1.00 0.00 N ATOM 799 CA SER A 51 -9.754 3.961 9.825 1.00 0.00 C ATOM 800 C SER A 51 -8.630 3.452 10.722 1.00 0.00 C ATOM 801 O SER A 51 -7.727 4.202 11.089 1.00 0.00 O ATOM 802 CB SER A 51 -10.998 4.258 10.665 1.00 0.00 C ATOM 803 OG SER A 51 -11.767 5.299 10.087 1.00 0.00 O ATOM 0 H SER A 51 -10.950 2.498 8.916 1.00 0.00 H new ATOM 0 HA SER A 51 -9.422 4.880 9.343 1.00 0.00 H new ATOM 0 HB2 SER A 51 -11.606 3.357 10.751 1.00 0.00 H new ATOM 0 HB3 SER A 51 -10.700 4.539 11.675 1.00 0.00 H new ATOM 0 HG SER A 51 -12.557 5.469 10.641 1.00 0.00 H new ATOM 809 N GLU A 52 -8.695 2.170 11.071 1.00 0.00 N ATOM 810 CA GLU A 52 -7.683 1.560 11.926 1.00 0.00 C ATOM 811 C GLU A 52 -6.577 0.923 11.090 1.00 0.00 C ATOM 812 O GLU A 52 -5.781 0.129 11.594 1.00 0.00 O ATOM 813 CB GLU A 52 -8.320 0.508 12.835 1.00 0.00 C ATOM 814 CG GLU A 52 -9.368 1.073 13.780 1.00 0.00 C ATOM 815 CD GLU A 52 -9.767 0.091 14.864 1.00 0.00 C ATOM 816 OE1 GLU A 52 -10.125 -1.056 14.521 1.00 0.00 O ATOM 817 OE2 GLU A 52 -9.722 0.468 16.053 1.00 0.00 O ATOM 0 H GLU A 52 -9.437 1.535 10.775 1.00 0.00 H new ATOM 0 HA GLU A 52 -7.243 2.344 12.542 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -8.779 -0.264 12.217 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -7.538 0.025 13.421 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -8.983 1.982 14.242 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -10.252 1.356 13.209 1.00 0.00 H new ATOM 824 N LEU A 53 -6.532 1.277 9.810 1.00 0.00 N ATOM 825 CA LEU A 53 -5.524 0.740 8.903 1.00 0.00 C ATOM 826 C LEU A 53 -4.461 1.788 8.589 1.00 0.00 C ATOM 827 O LEU A 53 -4.680 2.685 7.773 1.00 0.00 O ATOM 828 CB LEU A 53 -6.180 0.258 7.608 1.00 0.00 C ATOM 829 CG LEU A 53 -6.760 -1.156 7.635 1.00 0.00 C ATOM 830 CD1 LEU A 53 -7.670 -1.383 6.438 1.00 0.00 C ATOM 831 CD2 LEU A 53 -5.643 -2.190 7.662 1.00 0.00 C ATOM 0 H LEU A 53 -7.182 1.933 9.377 1.00 0.00 H new ATOM 0 HA LEU A 53 -5.041 -0.105 9.394 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -6.980 0.952 7.349 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -5.441 0.311 6.809 1.00 0.00 H new ATOM 0 HG LEU A 53 -7.353 -1.267 8.542 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -8.073 -2.395 6.474 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -8.489 -0.665 6.462 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -7.100 -1.252 5.518 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -6.074 -3.191 7.681 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -5.023 -2.079 6.773 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -5.031 -2.042 8.552 1.00 0.00 H new ATOM 843 N LEU A 54 -3.309 1.669 9.239 1.00 0.00 N ATOM 844 CA LEU A 54 -2.210 2.604 9.028 1.00 0.00 C ATOM 845 C LEU A 54 -1.223 2.062 7.999 1.00 0.00 C ATOM 846 O LEU A 54 -0.402 1.197 8.307 1.00 0.00 O ATOM 847 CB LEU A 54 -1.488 2.880 10.348 1.00 0.00 C ATOM 848 CG LEU A 54 -2.374 2.972 11.591 1.00 0.00 C ATOM 849 CD1 LEU A 54 -3.589 3.845 11.318 1.00 0.00 C ATOM 850 CD2 LEU A 54 -2.804 1.584 12.043 1.00 0.00 C ATOM 0 H LEU A 54 -3.112 0.933 9.917 1.00 0.00 H new ATOM 0 HA LEU A 54 -2.627 3.536 8.648 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -0.752 2.092 10.508 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -0.937 3.815 10.249 1.00 0.00 H new ATOM 0 HG LEU A 54 -1.795 3.431 12.392 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -4.207 3.898 12.214 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -3.262 4.848 11.042 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -4.170 3.415 10.502 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -3.434 1.669 12.929 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -3.365 1.099 11.244 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -1.922 0.989 12.281 1.00 0.00 H new ATOM 862 N LEU A 55 -1.308 2.577 6.778 1.00 0.00 N ATOM 863 CA LEU A 55 -0.421 2.146 5.703 1.00 0.00 C ATOM 864 C LEU A 55 0.858 2.978 5.685 1.00 0.00 C ATOM 865 O LEU A 55 0.816 4.193 5.490 1.00 0.00 O ATOM 866 CB LEU A 55 -1.132 2.255 4.353 1.00 0.00 C ATOM 867 CG LEU A 55 -1.803 0.979 3.843 1.00 0.00 C ATOM 868 CD1 LEU A 55 -2.720 0.396 4.907 1.00 0.00 C ATOM 869 CD2 LEU A 55 -2.577 1.258 2.563 1.00 0.00 C ATOM 0 H LEU A 55 -1.982 3.293 6.507 1.00 0.00 H new ATOM 0 HA LEU A 55 -0.153 1.105 5.883 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -1.889 3.036 4.426 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -0.407 2.583 3.608 1.00 0.00 H new ATOM 0 HG LEU A 55 -1.026 0.247 3.622 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -3.189 -0.511 4.526 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -2.139 0.158 5.798 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -3.491 1.123 5.161 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -3.048 0.339 2.215 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -3.344 2.007 2.758 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -1.894 1.628 1.798 1.00 0.00 H new ATOM 881 N SER A 56 1.992 2.316 5.889 1.00 0.00 N ATOM 882 CA SER A 56 3.282 2.995 5.898 1.00 0.00 C ATOM 883 C SER A 56 4.230 2.375 4.876 1.00 0.00 C ATOM 884 O SER A 56 4.552 1.189 4.950 1.00 0.00 O ATOM 885 CB SER A 56 3.907 2.930 7.294 1.00 0.00 C ATOM 886 OG SER A 56 3.817 1.622 7.832 1.00 0.00 O ATOM 0 H SER A 56 2.044 1.310 6.050 1.00 0.00 H new ATOM 0 HA SER A 56 3.117 4.038 5.629 1.00 0.00 H new ATOM 0 HB2 SER A 56 4.952 3.234 7.243 1.00 0.00 H new ATOM 0 HB3 SER A 56 3.402 3.634 7.955 1.00 0.00 H new ATOM 0 HG SER A 56 4.224 1.606 8.723 1.00 0.00 H new ATOM 892 N TYR A 57 4.672 3.186 3.921 1.00 0.00 N ATOM 893 CA TYR A 57 5.581 2.718 2.881 1.00 0.00 C ATOM 894 C TYR A 57 7.029 3.033 3.241 1.00 0.00 C ATOM 895 O TYR A 57 7.322 4.076 3.824 1.00 0.00 O ATOM 896 CB TYR A 57 5.226 3.359 1.539 1.00 0.00 C ATOM 897 CG TYR A 57 5.941 4.667 1.284 1.00 0.00 C ATOM 898 CD1 TYR A 57 5.474 5.855 1.833 1.00 0.00 C ATOM 899 CD2 TYR A 57 7.083 4.715 0.495 1.00 0.00 C ATOM 900 CE1 TYR A 57 6.123 7.052 1.603 1.00 0.00 C ATOM 901 CE2 TYR A 57 7.740 5.907 0.261 1.00 0.00 C ATOM 902 CZ TYR A 57 7.256 7.073 0.816 1.00 0.00 C ATOM 903 OH TYR A 57 7.907 8.263 0.584 1.00 0.00 O ATOM 0 H TYR A 57 4.416 4.170 3.845 1.00 0.00 H new ATOM 0 HA TYR A 57 5.474 1.636 2.799 1.00 0.00 H new ATOM 0 HB2 TYR A 57 5.467 2.661 0.737 1.00 0.00 H new ATOM 0 HB3 TYR A 57 4.150 3.529 1.501 1.00 0.00 H new ATOM 0 HD1 TYR A 57 4.588 5.842 2.450 1.00 0.00 H new ATOM 0 HD2 TYR A 57 7.464 3.804 0.057 1.00 0.00 H new ATOM 0 HE1 TYR A 57 5.746 7.966 2.037 1.00 0.00 H new ATOM 0 HE2 TYR A 57 8.628 5.926 -0.353 1.00 0.00 H new ATOM 0 HH TYR A 57 7.306 8.879 0.115 1.00 0.00 H new ATOM 913 N GLU A 58 7.932 2.123 2.888 1.00 0.00 N ATOM 914 CA GLU A 58 9.350 2.303 3.174 1.00 0.00 C ATOM 915 C GLU A 58 10.103 2.753 1.925 1.00 0.00 C ATOM 916 O GLU A 58 10.013 2.123 0.872 1.00 0.00 O ATOM 917 CB GLU A 58 9.955 1.002 3.706 1.00 0.00 C ATOM 918 CG GLU A 58 11.289 1.194 4.408 1.00 0.00 C ATOM 919 CD GLU A 58 12.137 -0.063 4.404 1.00 0.00 C ATOM 920 OE1 GLU A 58 12.697 -0.397 3.339 1.00 0.00 O ATOM 921 OE2 GLU A 58 12.239 -0.714 5.465 1.00 0.00 O ATOM 0 H GLU A 58 7.706 1.254 2.404 1.00 0.00 H new ATOM 0 HA GLU A 58 9.446 3.078 3.935 1.00 0.00 H new ATOM 0 HB2 GLU A 58 9.252 0.541 4.400 1.00 0.00 H new ATOM 0 HB3 GLU A 58 10.087 0.307 2.877 1.00 0.00 H new ATOM 0 HG2 GLU A 58 11.839 2.000 3.922 1.00 0.00 H new ATOM 0 HG3 GLU A 58 11.112 1.505 5.438 1.00 0.00 H new ATOM 928 N SER A 59 10.846 3.849 2.053 1.00 0.00 N ATOM 929 CA SER A 59 11.611 4.387 0.934 1.00 0.00 C ATOM 930 C SER A 59 12.707 3.415 0.508 1.00 0.00 C ATOM 931 O SER A 59 13.349 2.780 1.344 1.00 0.00 O ATOM 932 CB SER A 59 12.229 5.734 1.314 1.00 0.00 C ATOM 933 OG SER A 59 12.596 6.470 0.160 1.00 0.00 O ATOM 0 H SER A 59 10.934 4.381 2.919 1.00 0.00 H new ATOM 0 HA SER A 59 10.930 4.530 0.095 1.00 0.00 H new ATOM 0 HB2 SER A 59 11.518 6.310 1.906 1.00 0.00 H new ATOM 0 HB3 SER A 59 13.106 5.572 1.940 1.00 0.00 H new ATOM 0 HG SER A 59 12.987 7.327 0.429 1.00 0.00 H new ATOM 939 N SER A 60 12.913 3.303 -0.801 1.00 0.00 N ATOM 940 CA SER A 60 13.928 2.405 -1.340 1.00 0.00 C ATOM 941 C SER A 60 15.320 3.015 -1.205 1.00 0.00 C ATOM 942 O SER A 60 16.280 2.328 -0.855 1.00 0.00 O ATOM 943 CB SER A 60 13.635 2.095 -2.809 1.00 0.00 C ATOM 944 OG SER A 60 13.466 3.286 -3.558 1.00 0.00 O ATOM 0 H SER A 60 12.391 3.822 -1.507 1.00 0.00 H new ATOM 0 HA SER A 60 13.900 1.478 -0.767 1.00 0.00 H new ATOM 0 HB2 SER A 60 14.452 1.510 -3.230 1.00 0.00 H new ATOM 0 HB3 SER A 60 12.735 1.485 -2.883 1.00 0.00 H new ATOM 0 HG SER A 60 13.282 3.061 -4.494 1.00 0.00 H new ATOM 950 N LYS A 61 15.422 4.310 -1.486 1.00 0.00 N ATOM 951 CA LYS A 61 16.695 5.015 -1.395 1.00 0.00 C ATOM 952 C LYS A 61 17.123 5.180 0.059 1.00 0.00 C ATOM 953 O LYS A 61 18.300 5.389 0.349 1.00 0.00 O ATOM 954 CB LYS A 61 16.590 6.386 -2.066 1.00 0.00 C ATOM 955 CG LYS A 61 15.486 7.260 -1.496 1.00 0.00 C ATOM 956 CD LYS A 61 15.958 8.026 -0.272 1.00 0.00 C ATOM 957 CE LYS A 61 15.220 9.348 -0.122 1.00 0.00 C ATOM 958 NZ LYS A 61 15.556 10.297 -1.220 1.00 0.00 N ATOM 0 H LYS A 61 14.638 4.893 -1.779 1.00 0.00 H new ATOM 0 HA LYS A 61 17.449 4.421 -1.911 1.00 0.00 H new ATOM 0 HB2 LYS A 61 17.543 6.905 -1.963 1.00 0.00 H new ATOM 0 HB3 LYS A 61 16.417 6.246 -3.133 1.00 0.00 H new ATOM 0 HG2 LYS A 61 15.147 7.962 -2.257 1.00 0.00 H new ATOM 0 HG3 LYS A 61 14.630 6.640 -1.231 1.00 0.00 H new ATOM 0 HD2 LYS A 61 15.804 7.419 0.620 1.00 0.00 H new ATOM 0 HD3 LYS A 61 17.029 8.213 -0.349 1.00 0.00 H new ATOM 0 HE2 LYS A 61 14.145 9.166 -0.115 1.00 0.00 H new ATOM 0 HE3 LYS A 61 15.473 9.798 0.838 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 15.420 11.273 -0.889 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 16.547 10.163 -1.504 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 14.935 10.118 -2.035 1.00 0.00 H new ATOM 972 N MET A 62 16.159 5.084 0.970 1.00 0.00 N ATOM 973 CA MET A 62 16.438 5.221 2.395 1.00 0.00 C ATOM 974 C MET A 62 15.754 4.114 3.191 1.00 0.00 C ATOM 975 O MET A 62 14.644 4.276 3.697 1.00 0.00 O ATOM 976 CB MET A 62 15.975 6.589 2.898 1.00 0.00 C ATOM 977 CG MET A 62 16.014 6.725 4.412 1.00 0.00 C ATOM 978 SD MET A 62 16.231 8.432 4.950 1.00 0.00 S ATOM 979 CE MET A 62 17.686 8.278 5.984 1.00 0.00 C ATOM 0 H MET A 62 15.179 4.912 0.747 1.00 0.00 H new ATOM 0 HA MET A 62 17.515 5.135 2.539 1.00 0.00 H new ATOM 0 HB2 MET A 62 16.604 7.362 2.456 1.00 0.00 H new ATOM 0 HB3 MET A 62 14.957 6.769 2.551 1.00 0.00 H new ATOM 0 HG2 MET A 62 15.089 6.330 4.832 1.00 0.00 H new ATOM 0 HG3 MET A 62 16.828 6.117 4.807 1.00 0.00 H new ATOM 0 HE1 MET A 62 17.947 9.254 6.392 1.00 0.00 H new ATOM 0 HE2 MET A 62 17.480 7.586 6.801 1.00 0.00 H new ATOM 0 HE3 MET A 62 18.517 7.900 5.389 1.00 0.00 H new ATOM 989 N PRO A 63 16.431 2.961 3.306 1.00 0.00 N ATOM 990 CA PRO A 63 15.907 1.806 4.040 1.00 0.00 C ATOM 991 C PRO A 63 15.865 2.045 5.545 1.00 0.00 C ATOM 992 O PRO A 63 16.846 2.490 6.140 1.00 0.00 O ATOM 993 CB PRO A 63 16.900 0.691 3.703 1.00 0.00 C ATOM 994 CG PRO A 63 18.167 1.401 3.371 1.00 0.00 C ATOM 995 CD PRO A 63 17.759 2.698 2.728 1.00 0.00 C ATOM 0 HA PRO A 63 14.878 1.578 3.760 1.00 0.00 H new ATOM 0 HB2 PRO A 63 17.035 0.013 4.546 1.00 0.00 H new ATOM 0 HB3 PRO A 63 16.551 0.090 2.863 1.00 0.00 H new ATOM 0 HG2 PRO A 63 18.761 1.580 4.268 1.00 0.00 H new ATOM 0 HG3 PRO A 63 18.782 0.807 2.695 1.00 0.00 H new ATOM 0 HD2 PRO A 63 18.463 3.499 2.956 1.00 0.00 H new ATOM 0 HD3 PRO A 63 17.715 2.612 1.642 1.00 0.00 H new ATOM 1003 N GLY A 64 14.723 1.746 6.157 1.00 0.00 N ATOM 1004 CA GLY A 64 14.576 1.936 7.588 1.00 0.00 C ATOM 1005 C GLY A 64 13.632 3.072 7.929 1.00 0.00 C ATOM 1006 O GLY A 64 13.098 3.133 9.036 1.00 0.00 O ATOM 0 H GLY A 64 13.897 1.376 5.687 1.00 0.00 H new ATOM 0 HA2 GLY A 64 14.207 1.014 8.038 1.00 0.00 H new ATOM 0 HA3 GLY A 64 15.553 2.136 8.027 1.00 0.00 H new ATOM 1010 N ARG A 65 13.428 3.975 6.975 1.00 0.00 N ATOM 1011 CA ARG A 65 12.544 5.117 7.181 1.00 0.00 C ATOM 1012 C ARG A 65 11.177 4.866 6.553 1.00 0.00 C ATOM 1013 O ARG A 65 11.067 4.664 5.344 1.00 0.00 O ATOM 1014 CB ARG A 65 13.166 6.383 6.589 1.00 0.00 C ATOM 1015 CG ARG A 65 12.388 7.649 6.907 1.00 0.00 C ATOM 1016 CD ARG A 65 13.148 8.893 6.476 1.00 0.00 C ATOM 1017 NE ARG A 65 14.092 9.340 7.497 1.00 0.00 N ATOM 1018 CZ ARG A 65 13.722 9.879 8.653 1.00 0.00 C ATOM 1019 NH1 ARG A 65 12.436 10.038 8.934 1.00 0.00 N ATOM 1020 NH2 ARG A 65 14.640 10.261 9.532 1.00 0.00 N ATOM 0 H ARG A 65 13.862 3.938 6.053 1.00 0.00 H new ATOM 0 HA ARG A 65 12.411 5.254 8.254 1.00 0.00 H new ATOM 0 HB2 ARG A 65 14.184 6.488 6.965 1.00 0.00 H new ATOM 0 HB3 ARG A 65 13.236 6.272 5.507 1.00 0.00 H new ATOM 0 HG2 ARG A 65 11.421 7.619 6.404 1.00 0.00 H new ATOM 0 HG3 ARG A 65 12.189 7.696 7.978 1.00 0.00 H new ATOM 0 HD2 ARG A 65 13.686 8.687 5.551 1.00 0.00 H new ATOM 0 HD3 ARG A 65 12.440 9.694 6.261 1.00 0.00 H new ATOM 0 HE ARG A 65 15.089 9.232 7.312 1.00 0.00 H new ATOM 0 HH11 ARG A 65 11.727 9.746 8.261 1.00 0.00 H new ATOM 0 HH12 ARG A 65 12.156 10.452 9.823 1.00 0.00 H new ATOM 0 HH21 ARG A 65 15.630 10.141 9.320 1.00 0.00 H new ATOM 0 HH22 ARG A 65 14.355 10.675 10.420 1.00 0.00 H new ATOM 1034 N GLU A 66 10.138 4.880 7.382 1.00 0.00 N ATOM 1035 CA GLU A 66 8.779 4.652 6.907 1.00 0.00 C ATOM 1036 C GLU A 66 7.922 5.901 7.091 1.00 0.00 C ATOM 1037 O GLU A 66 8.195 6.731 7.959 1.00 0.00 O ATOM 1038 CB GLU A 66 8.146 3.472 7.647 1.00 0.00 C ATOM 1039 CG GLU A 66 8.008 3.696 9.144 1.00 0.00 C ATOM 1040 CD GLU A 66 7.147 4.899 9.477 1.00 0.00 C ATOM 1041 OE1 GLU A 66 6.123 5.104 8.793 1.00 0.00 O ATOM 1042 OE2 GLU A 66 7.498 5.636 10.422 1.00 0.00 O ATOM 0 H GLU A 66 10.212 5.047 8.386 1.00 0.00 H new ATOM 0 HA GLU A 66 8.828 4.419 5.843 1.00 0.00 H new ATOM 0 HB2 GLU A 66 7.160 3.276 7.225 1.00 0.00 H new ATOM 0 HB3 GLU A 66 8.749 2.581 7.476 1.00 0.00 H new ATOM 0 HG2 GLU A 66 7.576 2.807 9.602 1.00 0.00 H new ATOM 0 HG3 GLU A 66 8.998 3.830 9.580 1.00 0.00 H new ATOM 1049 N ILE A 67 6.886 6.028 6.269 1.00 0.00 N ATOM 1050 CA ILE A 67 5.989 7.174 6.342 1.00 0.00 C ATOM 1051 C ILE A 67 4.551 6.733 6.593 1.00 0.00 C ATOM 1052 O ILE A 67 3.942 6.065 5.757 1.00 0.00 O ATOM 1053 CB ILE A 67 6.039 8.011 5.050 1.00 0.00 C ATOM 1054 CG1 ILE A 67 7.425 8.634 4.873 1.00 0.00 C ATOM 1055 CG2 ILE A 67 4.967 9.090 5.076 1.00 0.00 C ATOM 1056 CD1 ILE A 67 8.448 7.678 4.299 1.00 0.00 C ATOM 0 H ILE A 67 6.647 5.351 5.544 1.00 0.00 H new ATOM 0 HA ILE A 67 6.329 7.787 7.177 1.00 0.00 H new ATOM 0 HB ILE A 67 5.846 7.354 4.202 1.00 0.00 H new ATOM 0 HG12 ILE A 67 7.344 9.502 4.219 1.00 0.00 H new ATOM 0 HG13 ILE A 67 7.778 8.995 5.839 1.00 0.00 H new ATOM 0 HG21 ILE A 67 5.015 9.673 4.156 1.00 0.00 H new ATOM 0 HG22 ILE A 67 3.985 8.625 5.160 1.00 0.00 H new ATOM 0 HG23 ILE A 67 5.132 9.746 5.931 1.00 0.00 H new ATOM 0 HD11 ILE A 67 9.407 8.187 4.201 1.00 0.00 H new ATOM 0 HD12 ILE A 67 8.558 6.821 4.964 1.00 0.00 H new ATOM 0 HD13 ILE A 67 8.117 7.336 3.318 1.00 0.00 H new ATOM 1068 N GLU A 68 4.014 7.112 7.748 1.00 0.00 N ATOM 1069 CA GLU A 68 2.647 6.755 8.108 1.00 0.00 C ATOM 1070 C GLU A 68 1.641 7.598 7.329 1.00 0.00 C ATOM 1071 O GLU A 68 1.467 8.786 7.602 1.00 0.00 O ATOM 1072 CB GLU A 68 2.426 6.939 9.611 1.00 0.00 C ATOM 1073 CG GLU A 68 3.159 8.137 10.191 1.00 0.00 C ATOM 1074 CD GLU A 68 2.517 8.653 11.464 1.00 0.00 C ATOM 1075 OE1 GLU A 68 2.466 7.892 12.453 1.00 0.00 O ATOM 1076 OE2 GLU A 68 2.066 9.817 11.472 1.00 0.00 O ATOM 0 H GLU A 68 4.504 7.666 8.450 1.00 0.00 H new ATOM 0 HA GLU A 68 2.494 5.707 7.851 1.00 0.00 H new ATOM 0 HB2 GLU A 68 1.359 7.049 9.802 1.00 0.00 H new ATOM 0 HB3 GLU A 68 2.751 6.038 10.131 1.00 0.00 H new ATOM 0 HG2 GLU A 68 4.193 7.861 10.396 1.00 0.00 H new ATOM 0 HG3 GLU A 68 3.183 8.937 9.451 1.00 0.00 H new ATOM 1083 N LEU A 69 0.984 6.975 6.357 1.00 0.00 N ATOM 1084 CA LEU A 69 -0.004 7.667 5.537 1.00 0.00 C ATOM 1085 C LEU A 69 -1.268 7.964 6.339 1.00 0.00 C ATOM 1086 O LEU A 69 -1.955 7.049 6.792 1.00 0.00 O ATOM 1087 CB LEU A 69 -0.353 6.828 4.306 1.00 0.00 C ATOM 1088 CG LEU A 69 0.831 6.254 3.528 1.00 0.00 C ATOM 1089 CD1 LEU A 69 0.377 5.115 2.628 1.00 0.00 C ATOM 1090 CD2 LEU A 69 1.510 7.344 2.711 1.00 0.00 C ATOM 0 H LEU A 69 1.117 5.993 6.118 1.00 0.00 H new ATOM 0 HA LEU A 69 0.429 8.613 5.213 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -0.989 6.001 4.623 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -0.944 7.443 3.627 1.00 0.00 H new ATOM 0 HG LEU A 69 1.554 5.859 4.242 1.00 0.00 H new ATOM 0 HD11 LEU A 69 1.233 4.719 2.082 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -0.063 4.324 3.236 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -0.365 5.484 1.920 1.00 0.00 H new ATOM 0 HD21 LEU A 69 2.351 6.918 2.163 1.00 0.00 H new ATOM 0 HD22 LEU A 69 0.795 7.769 2.006 1.00 0.00 H new ATOM 0 HD23 LEU A 69 1.871 8.127 3.378 1.00 0.00 H new ATOM 1102 N GLU A 70 -1.567 9.247 6.509 1.00 0.00 N ATOM 1103 CA GLU A 70 -2.749 9.663 7.255 1.00 0.00 C ATOM 1104 C GLU A 70 -3.729 10.407 6.353 1.00 0.00 C ATOM 1105 O GLU A 70 -4.788 10.847 6.798 1.00 0.00 O ATOM 1106 CB GLU A 70 -2.348 10.552 8.434 1.00 0.00 C ATOM 1107 CG GLU A 70 -1.433 11.702 8.046 1.00 0.00 C ATOM 1108 CD GLU A 70 -1.301 12.739 9.144 1.00 0.00 C ATOM 1109 OE1 GLU A 70 -0.589 12.468 10.134 1.00 0.00 O ATOM 1110 OE2 GLU A 70 -1.910 13.822 9.014 1.00 0.00 O ATOM 0 H GLU A 70 -1.008 10.016 6.141 1.00 0.00 H new ATOM 0 HA GLU A 70 -3.241 8.767 7.635 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -3.249 10.956 8.897 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -1.850 9.940 9.186 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -0.446 11.309 7.802 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -1.818 12.179 7.145 1.00 0.00 H new ATOM 1117 N ASN A 71 -3.366 10.545 5.082 1.00 0.00 N ATOM 1118 CA ASN A 71 -4.212 11.237 4.116 1.00 0.00 C ATOM 1119 C ASN A 71 -4.870 10.246 3.161 1.00 0.00 C ATOM 1120 O ASN A 71 -4.264 9.820 2.178 1.00 0.00 O ATOM 1121 CB ASN A 71 -3.389 12.256 3.324 1.00 0.00 C ATOM 1122 CG ASN A 71 -3.225 13.568 4.067 1.00 0.00 C ATOM 1123 OD1 ASN A 71 -2.436 13.667 5.008 1.00 0.00 O ATOM 1124 ND2 ASN A 71 -3.971 14.583 3.647 1.00 0.00 N ATOM 0 H ASN A 71 -2.492 10.187 4.697 1.00 0.00 H new ATOM 0 HA ASN A 71 -4.995 11.760 4.665 1.00 0.00 H new ATOM 0 HB2 ASN A 71 -2.406 11.837 3.110 1.00 0.00 H new ATOM 0 HB3 ASN A 71 -3.872 12.442 2.365 1.00 0.00 H new ATOM 0 HD21 ASN A 71 -3.904 15.490 4.108 1.00 0.00 H new ATOM 0 HD22 ASN A 71 -4.611 14.455 2.863 1.00 0.00 H new ATOM 1131 N ASP A 72 -6.113 9.884 3.457 1.00 0.00 N ATOM 1132 CA ASP A 72 -6.855 8.945 2.624 1.00 0.00 C ATOM 1133 C ASP A 72 -7.379 9.630 1.366 1.00 0.00 C ATOM 1134 O ASP A 72 -7.772 8.969 0.404 1.00 0.00 O ATOM 1135 CB ASP A 72 -8.018 8.340 3.412 1.00 0.00 C ATOM 1136 CG ASP A 72 -7.698 8.181 4.885 1.00 0.00 C ATOM 1137 OD1 ASP A 72 -7.594 9.210 5.584 1.00 0.00 O ATOM 1138 OD2 ASP A 72 -7.551 7.027 5.340 1.00 0.00 O ATOM 0 H ASP A 72 -6.628 10.227 4.268 1.00 0.00 H new ATOM 0 HA ASP A 72 -6.175 8.148 2.325 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -8.897 8.974 3.301 1.00 0.00 H new ATOM 0 HB3 ASP A 72 -8.271 7.367 2.991 1.00 0.00 H new ATOM 1143 N LEU A 73 -7.382 10.959 1.380 1.00 0.00 N ATOM 1144 CA LEU A 73 -7.859 11.735 0.240 1.00 0.00 C ATOM 1145 C LEU A 73 -6.704 12.116 -0.680 1.00 0.00 C ATOM 1146 O LEU A 73 -6.817 13.043 -1.482 1.00 0.00 O ATOM 1147 CB LEU A 73 -8.580 12.995 0.722 1.00 0.00 C ATOM 1148 CG LEU A 73 -9.965 12.783 1.335 1.00 0.00 C ATOM 1149 CD1 LEU A 73 -10.557 14.109 1.787 1.00 0.00 C ATOM 1150 CD2 LEU A 73 -10.888 12.095 0.340 1.00 0.00 C ATOM 0 H LEU A 73 -7.060 11.521 2.168 1.00 0.00 H new ATOM 0 HA LEU A 73 -8.558 11.117 -0.323 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -7.950 13.490 1.461 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -8.679 13.678 -0.122 1.00 0.00 H new ATOM 0 HG LEU A 73 -9.861 12.139 2.208 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -11.542 13.939 2.221 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -9.905 14.563 2.534 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -10.648 14.778 0.931 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -11.869 11.952 0.793 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -10.987 12.713 -0.552 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -10.470 11.126 0.066 1.00 0.00 H new ATOM 1162 N GLN A 74 -5.594 11.394 -0.559 1.00 0.00 N ATOM 1163 CA GLN A 74 -4.419 11.657 -1.382 1.00 0.00 C ATOM 1164 C GLN A 74 -3.906 10.372 -2.024 1.00 0.00 C ATOM 1165 O GLN A 74 -3.930 9.297 -1.425 1.00 0.00 O ATOM 1166 CB GLN A 74 -3.314 12.297 -0.539 1.00 0.00 C ATOM 1167 CG GLN A 74 -3.684 13.664 0.013 1.00 0.00 C ATOM 1168 CD GLN A 74 -3.526 14.769 -1.013 1.00 0.00 C ATOM 1169 OE1 GLN A 74 -2.695 14.679 -1.917 1.00 0.00 O ATOM 1170 NE2 GLN A 74 -4.324 15.821 -0.877 1.00 0.00 N ATOM 0 H GLN A 74 -5.484 10.623 0.100 1.00 0.00 H new ATOM 0 HA GLN A 74 -4.708 12.347 -2.175 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -3.071 11.633 0.291 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -2.414 12.391 -1.146 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -4.716 13.643 0.363 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -3.058 13.884 0.878 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -4.999 15.854 -0.113 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -4.263 16.596 -1.537 1.00 0.00 H new ATOM 1179 N PRO A 75 -3.432 10.484 -3.274 1.00 0.00 N ATOM 1180 CA PRO A 75 -2.904 9.341 -4.025 1.00 0.00 C ATOM 1181 C PRO A 75 -1.579 8.839 -3.462 1.00 0.00 C ATOM 1182 O PRO A 75 -1.057 9.389 -2.491 1.00 0.00 O ATOM 1183 CB PRO A 75 -2.707 9.904 -5.435 1.00 0.00 C ATOM 1184 CG PRO A 75 -2.525 11.369 -5.236 1.00 0.00 C ATOM 1185 CD PRO A 75 -3.374 11.734 -4.049 1.00 0.00 C ATOM 0 HA PRO A 75 -3.574 8.482 -3.984 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -1.838 9.460 -5.921 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -3.569 9.695 -6.069 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -1.478 11.611 -5.056 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -2.833 11.924 -6.122 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -2.930 12.545 -3.471 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -4.367 12.065 -4.352 1.00 0.00 H new ATOM 1193 N LEU A 76 -1.038 7.793 -4.077 1.00 0.00 N ATOM 1194 CA LEU A 76 0.228 7.217 -3.637 1.00 0.00 C ATOM 1195 C LEU A 76 1.406 8.057 -4.121 1.00 0.00 C ATOM 1196 O LEU A 76 2.440 8.132 -3.458 1.00 0.00 O ATOM 1197 CB LEU A 76 0.364 5.783 -4.151 1.00 0.00 C ATOM 1198 CG LEU A 76 -0.443 4.722 -3.402 1.00 0.00 C ATOM 1199 CD1 LEU A 76 -0.217 4.840 -1.903 1.00 0.00 C ATOM 1200 CD2 LEU A 76 -1.923 4.847 -3.732 1.00 0.00 C ATOM 0 H LEU A 76 -1.456 7.326 -4.882 1.00 0.00 H new ATOM 0 HA LEU A 76 0.236 7.208 -2.547 1.00 0.00 H new ATOM 0 HB2 LEU A 76 0.066 5.764 -5.199 1.00 0.00 H new ATOM 0 HB3 LEU A 76 1.417 5.503 -4.114 1.00 0.00 H new ATOM 0 HG LEU A 76 -0.101 3.738 -3.724 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -0.799 4.077 -1.386 1.00 0.00 H new ATOM 0 HD12 LEU A 76 0.841 4.700 -1.682 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -0.531 5.827 -1.564 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -2.482 4.084 -3.190 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -2.279 5.835 -3.439 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -2.070 4.712 -4.804 1.00 0.00 H new ATOM 1212 N GLN A 77 1.239 8.688 -5.279 1.00 0.00 N ATOM 1213 CA GLN A 77 2.289 9.524 -5.850 1.00 0.00 C ATOM 1214 C GLN A 77 2.538 10.754 -4.983 1.00 0.00 C ATOM 1215 O GLN A 77 3.618 11.344 -5.019 1.00 0.00 O ATOM 1216 CB GLN A 77 1.912 9.954 -7.269 1.00 0.00 C ATOM 1217 CG GLN A 77 0.853 11.043 -7.314 1.00 0.00 C ATOM 1218 CD GLN A 77 0.576 11.530 -8.722 1.00 0.00 C ATOM 1219 OE1 GLN A 77 1.491 11.672 -9.534 1.00 0.00 O ATOM 1220 NE2 GLN A 77 -0.692 11.790 -9.021 1.00 0.00 N ATOM 0 H GLN A 77 0.388 8.637 -5.839 1.00 0.00 H new ATOM 0 HA GLN A 77 3.206 8.936 -5.887 1.00 0.00 H new ATOM 0 HB2 GLN A 77 2.806 10.307 -7.782 1.00 0.00 H new ATOM 0 HB3 GLN A 77 1.551 9.085 -7.819 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -0.071 10.664 -6.876 1.00 0.00 H new ATOM 0 HG3 GLN A 77 1.176 11.884 -6.700 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -1.419 11.659 -8.318 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -0.938 12.121 -9.954 1.00 0.00 H new ATOM 1229 N PHE A 78 1.531 11.136 -4.204 1.00 0.00 N ATOM 1230 CA PHE A 78 1.640 12.297 -3.328 1.00 0.00 C ATOM 1231 C PHE A 78 2.605 12.022 -2.178 1.00 0.00 C ATOM 1232 O PHE A 78 2.987 12.933 -1.443 1.00 0.00 O ATOM 1233 CB PHE A 78 0.265 12.677 -2.776 1.00 0.00 C ATOM 1234 CG PHE A 78 0.292 13.877 -1.874 1.00 0.00 C ATOM 1235 CD1 PHE A 78 0.214 15.157 -2.399 1.00 0.00 C ATOM 1236 CD2 PHE A 78 0.395 13.726 -0.500 1.00 0.00 C ATOM 1237 CE1 PHE A 78 0.239 16.263 -1.571 1.00 0.00 C ATOM 1238 CE2 PHE A 78 0.420 14.829 0.333 1.00 0.00 C ATOM 1239 CZ PHE A 78 0.341 16.099 -0.204 1.00 0.00 C ATOM 0 H PHE A 78 0.631 10.659 -4.162 1.00 0.00 H new ATOM 0 HA PHE A 78 2.030 13.129 -3.915 1.00 0.00 H new ATOM 0 HB2 PHE A 78 -0.410 12.874 -3.609 1.00 0.00 H new ATOM 0 HB3 PHE A 78 -0.144 11.829 -2.227 1.00 0.00 H new ATOM 0 HD1 PHE A 78 0.133 15.292 -3.467 1.00 0.00 H new ATOM 0 HD2 PHE A 78 0.456 12.735 -0.075 1.00 0.00 H new ATOM 0 HE1 PHE A 78 0.179 17.255 -1.993 1.00 0.00 H new ATOM 0 HE2 PHE A 78 0.501 14.698 1.402 1.00 0.00 H new ATOM 0 HZ PHE A 78 0.359 16.962 0.444 1.00 0.00 H new ATOM 1249 N TYR A 79 2.994 10.761 -2.029 1.00 0.00 N ATOM 1250 CA TYR A 79 3.911 10.364 -0.968 1.00 0.00 C ATOM 1251 C TYR A 79 5.267 9.965 -1.540 1.00 0.00 C ATOM 1252 O TYR A 79 6.151 9.511 -0.814 1.00 0.00 O ATOM 1253 CB TYR A 79 3.322 9.203 -0.164 1.00 0.00 C ATOM 1254 CG TYR A 79 2.309 9.636 0.871 1.00 0.00 C ATOM 1255 CD1 TYR A 79 2.703 9.976 2.159 1.00 0.00 C ATOM 1256 CD2 TYR A 79 0.956 9.706 0.561 1.00 0.00 C ATOM 1257 CE1 TYR A 79 1.781 10.371 3.108 1.00 0.00 C ATOM 1258 CE2 TYR A 79 0.026 10.101 1.503 1.00 0.00 C ATOM 1259 CZ TYR A 79 0.443 10.432 2.775 1.00 0.00 C ATOM 1260 OH TYR A 79 -0.479 10.827 3.717 1.00 0.00 O ATOM 0 H TYR A 79 2.688 9.996 -2.630 1.00 0.00 H new ATOM 0 HA TYR A 79 4.054 11.219 -0.308 1.00 0.00 H new ATOM 0 HB2 TYR A 79 2.850 8.500 -0.850 1.00 0.00 H new ATOM 0 HB3 TYR A 79 4.132 8.669 0.333 1.00 0.00 H new ATOM 0 HD1 TYR A 79 3.749 9.931 2.423 1.00 0.00 H new ATOM 0 HD2 TYR A 79 0.626 9.447 -0.434 1.00 0.00 H new ATOM 0 HE1 TYR A 79 2.105 10.631 4.105 1.00 0.00 H new ATOM 0 HE2 TYR A 79 -1.022 10.150 1.245 1.00 0.00 H new ATOM 0 HH TYR A 79 -0.366 11.782 3.905 1.00 0.00 H new ATOM 1270 N SER A 80 5.424 10.137 -2.849 1.00 0.00 N ATOM 1271 CA SER A 80 6.671 9.793 -3.522 1.00 0.00 C ATOM 1272 C SER A 80 6.845 8.279 -3.600 1.00 0.00 C ATOM 1273 O SER A 80 7.966 7.774 -3.663 1.00 0.00 O ATOM 1274 CB SER A 80 7.860 10.417 -2.789 1.00 0.00 C ATOM 1275 OG SER A 80 9.010 10.447 -3.617 1.00 0.00 O ATOM 0 H SER A 80 4.703 10.513 -3.465 1.00 0.00 H new ATOM 0 HA SER A 80 6.630 10.190 -4.536 1.00 0.00 H new ATOM 0 HB2 SER A 80 7.607 11.430 -2.475 1.00 0.00 H new ATOM 0 HB3 SER A 80 8.074 9.847 -1.885 1.00 0.00 H new ATOM 0 HG SER A 80 9.164 9.556 -3.996 1.00 0.00 H new ATOM 1281 N VAL A 81 5.727 7.560 -3.596 1.00 0.00 N ATOM 1282 CA VAL A 81 5.754 6.104 -3.668 1.00 0.00 C ATOM 1283 C VAL A 81 5.947 5.628 -5.103 1.00 0.00 C ATOM 1284 O VAL A 81 5.087 5.839 -5.958 1.00 0.00 O ATOM 1285 CB VAL A 81 4.459 5.490 -3.104 1.00 0.00 C ATOM 1286 CG1 VAL A 81 4.471 3.977 -3.266 1.00 0.00 C ATOM 1287 CG2 VAL A 81 4.278 5.876 -1.644 1.00 0.00 C ATOM 0 H VAL A 81 4.791 7.962 -3.544 1.00 0.00 H new ATOM 0 HA VAL A 81 6.598 5.773 -3.062 1.00 0.00 H new ATOM 0 HB VAL A 81 3.614 5.886 -3.668 1.00 0.00 H new ATOM 0 HG11 VAL A 81 3.548 3.560 -2.862 1.00 0.00 H new ATOM 0 HG12 VAL A 81 4.550 3.725 -4.323 1.00 0.00 H new ATOM 0 HG13 VAL A 81 5.323 3.560 -2.729 1.00 0.00 H new ATOM 0 HG21 VAL A 81 3.358 5.433 -1.262 1.00 0.00 H new ATOM 0 HG22 VAL A 81 5.125 5.510 -1.063 1.00 0.00 H new ATOM 0 HG23 VAL A 81 4.221 6.961 -1.559 1.00 0.00 H new ATOM 1297 N GLU A 82 7.081 4.984 -5.361 1.00 0.00 N ATOM 1298 CA GLU A 82 7.386 4.478 -6.694 1.00 0.00 C ATOM 1299 C GLU A 82 7.530 2.959 -6.680 1.00 0.00 C ATOM 1300 O GLU A 82 7.645 2.346 -5.619 1.00 0.00 O ATOM 1301 CB GLU A 82 8.670 5.119 -7.225 1.00 0.00 C ATOM 1302 CG GLU A 82 8.455 6.488 -7.848 1.00 0.00 C ATOM 1303 CD GLU A 82 9.507 6.829 -8.885 1.00 0.00 C ATOM 1304 OE1 GLU A 82 10.708 6.647 -8.594 1.00 0.00 O ATOM 1305 OE2 GLU A 82 9.130 7.277 -9.988 1.00 0.00 O ATOM 0 H GLU A 82 7.803 4.800 -4.665 1.00 0.00 H new ATOM 0 HA GLU A 82 6.558 4.740 -7.353 1.00 0.00 H new ATOM 0 HB2 GLU A 82 9.386 5.210 -6.408 1.00 0.00 H new ATOM 0 HB3 GLU A 82 9.116 4.457 -7.968 1.00 0.00 H new ATOM 0 HG2 GLU A 82 7.469 6.521 -8.312 1.00 0.00 H new ATOM 0 HG3 GLU A 82 8.464 7.245 -7.064 1.00 0.00 H new ATOM 1312 N ASN A 83 7.523 2.359 -7.866 1.00 0.00 N ATOM 1313 CA ASN A 83 7.652 0.912 -7.990 1.00 0.00 C ATOM 1314 C ASN A 83 8.922 0.417 -7.304 1.00 0.00 C ATOM 1315 O ASN A 83 9.987 1.019 -7.438 1.00 0.00 O ATOM 1316 CB ASN A 83 7.665 0.505 -9.465 1.00 0.00 C ATOM 1317 CG ASN A 83 8.525 1.424 -10.311 1.00 0.00 C ATOM 1318 OD1 ASN A 83 9.564 1.908 -9.861 1.00 0.00 O ATOM 1319 ND2 ASN A 83 8.095 1.669 -11.543 1.00 0.00 N ATOM 0 H ASN A 83 7.429 2.852 -8.754 1.00 0.00 H new ATOM 0 HA ASN A 83 6.793 0.453 -7.500 1.00 0.00 H new ATOM 0 HB2 ASN A 83 8.034 -0.517 -9.554 1.00 0.00 H new ATOM 0 HB3 ASN A 83 6.645 0.510 -9.850 1.00 0.00 H new ATOM 0 HD21 ASN A 83 8.632 2.280 -12.158 1.00 0.00 H new ATOM 0 HD22 ASN A 83 7.228 1.246 -11.874 1.00 0.00 H new ATOM 1326 N GLY A 84 8.801 -0.683 -6.568 1.00 0.00 N ATOM 1327 CA GLY A 84 9.946 -1.240 -5.872 1.00 0.00 C ATOM 1328 C GLY A 84 9.864 -1.045 -4.371 1.00 0.00 C ATOM 1329 O GLY A 84 10.393 -1.849 -3.604 1.00 0.00 O ATOM 0 H GLY A 84 7.930 -1.199 -6.441 1.00 0.00 H new ATOM 0 HA2 GLY A 84 10.019 -2.305 -6.093 1.00 0.00 H new ATOM 0 HA3 GLY A 84 10.857 -0.773 -6.247 1.00 0.00 H new ATOM 1333 N ASP A 85 9.200 0.026 -3.951 1.00 0.00 N ATOM 1334 CA ASP A 85 9.050 0.325 -2.532 1.00 0.00 C ATOM 1335 C ASP A 85 8.388 -0.836 -1.798 1.00 0.00 C ATOM 1336 O ASP A 85 8.067 -1.862 -2.401 1.00 0.00 O ATOM 1337 CB ASP A 85 8.228 1.601 -2.342 1.00 0.00 C ATOM 1338 CG ASP A 85 8.924 2.827 -2.899 1.00 0.00 C ATOM 1339 OD1 ASP A 85 9.542 2.720 -3.979 1.00 0.00 O ATOM 1340 OD2 ASP A 85 8.850 3.894 -2.255 1.00 0.00 O ATOM 0 H ASP A 85 8.757 0.702 -4.573 1.00 0.00 H new ATOM 0 HA ASP A 85 10.044 0.476 -2.111 1.00 0.00 H new ATOM 0 HB2 ASP A 85 7.261 1.483 -2.831 1.00 0.00 H new ATOM 0 HB3 ASP A 85 8.033 1.749 -1.280 1.00 0.00 H new ATOM 1345 N CYS A 86 8.186 -0.669 -0.496 1.00 0.00 N ATOM 1346 CA CYS A 86 7.563 -1.705 0.320 1.00 0.00 C ATOM 1347 C CYS A 86 6.372 -1.146 1.091 1.00 0.00 C ATOM 1348 O CYS A 86 6.404 -0.011 1.568 1.00 0.00 O ATOM 1349 CB CYS A 86 8.583 -2.298 1.294 1.00 0.00 C ATOM 1350 SG CYS A 86 9.828 -3.349 0.509 1.00 0.00 S ATOM 0 H CYS A 86 8.444 0.174 0.017 1.00 0.00 H new ATOM 0 HA CYS A 86 7.206 -2.491 -0.345 1.00 0.00 H new ATOM 0 HB2 CYS A 86 9.087 -1.484 1.816 1.00 0.00 H new ATOM 0 HB3 CYS A 86 8.054 -2.881 2.048 1.00 0.00 H new ATOM 0 HG CYS A 86 10.646 -3.801 1.412 1.00 0.00 H new ATOM 1356 N LEU A 87 5.320 -1.949 1.208 1.00 0.00 N ATOM 1357 CA LEU A 87 4.116 -1.535 1.919 1.00 0.00 C ATOM 1358 C LEU A 87 4.032 -2.207 3.285 1.00 0.00 C ATOM 1359 O LEU A 87 4.189 -3.424 3.402 1.00 0.00 O ATOM 1360 CB LEU A 87 2.872 -1.871 1.095 1.00 0.00 C ATOM 1361 CG LEU A 87 2.576 -0.944 -0.084 1.00 0.00 C ATOM 1362 CD1 LEU A 87 1.402 -1.469 -0.895 1.00 0.00 C ATOM 1363 CD2 LEU A 87 2.298 0.470 0.406 1.00 0.00 C ATOM 0 H LEU A 87 5.277 -2.891 0.819 1.00 0.00 H new ATOM 0 HA LEU A 87 4.165 -0.456 2.068 1.00 0.00 H new ATOM 0 HB2 LEU A 87 2.976 -2.887 0.715 1.00 0.00 H new ATOM 0 HB3 LEU A 87 2.008 -1.867 1.760 1.00 0.00 H new ATOM 0 HG LEU A 87 3.454 -0.918 -0.730 1.00 0.00 H new ATOM 0 HD11 LEU A 87 1.206 -0.796 -1.730 1.00 0.00 H new ATOM 0 HD12 LEU A 87 1.639 -2.462 -1.277 1.00 0.00 H new ATOM 0 HD13 LEU A 87 0.518 -1.526 -0.260 1.00 0.00 H new ATOM 0 HD21 LEU A 87 2.089 1.116 -0.447 1.00 0.00 H new ATOM 0 HD22 LEU A 87 1.437 0.461 1.074 1.00 0.00 H new ATOM 0 HD23 LEU A 87 3.169 0.847 0.942 1.00 0.00 H new ATOM 1375 N LEU A 88 3.781 -1.409 4.317 1.00 0.00 N ATOM 1376 CA LEU A 88 3.674 -1.927 5.677 1.00 0.00 C ATOM 1377 C LEU A 88 2.271 -1.709 6.233 1.00 0.00 C ATOM 1378 O LEU A 88 1.880 -0.582 6.536 1.00 0.00 O ATOM 1379 CB LEU A 88 4.705 -1.253 6.584 1.00 0.00 C ATOM 1380 CG LEU A 88 6.159 -1.325 6.116 1.00 0.00 C ATOM 1381 CD1 LEU A 88 6.955 -0.151 6.664 1.00 0.00 C ATOM 1382 CD2 LEU A 88 6.791 -2.643 6.539 1.00 0.00 C ATOM 0 H LEU A 88 3.648 -0.401 4.238 1.00 0.00 H new ATOM 0 HA LEU A 88 3.871 -2.999 5.648 1.00 0.00 H new ATOM 0 HB2 LEU A 88 4.431 -0.204 6.695 1.00 0.00 H new ATOM 0 HB3 LEU A 88 4.640 -1.705 7.574 1.00 0.00 H new ATOM 0 HG LEU A 88 6.173 -1.271 5.027 1.00 0.00 H new ATOM 0 HD11 LEU A 88 7.987 -0.219 6.320 1.00 0.00 H new ATOM 0 HD12 LEU A 88 6.516 0.782 6.311 1.00 0.00 H new ATOM 0 HD13 LEU A 88 6.933 -0.173 7.754 1.00 0.00 H new ATOM 0 HD21 LEU A 88 7.826 -2.677 6.197 1.00 0.00 H new ATOM 0 HD22 LEU A 88 6.765 -2.727 7.625 1.00 0.00 H new ATOM 0 HD23 LEU A 88 6.236 -3.471 6.098 1.00 0.00 H new ATOM 1394 N VAL A 89 1.517 -2.796 6.368 1.00 0.00 N ATOM 1395 CA VAL A 89 0.158 -2.725 6.892 1.00 0.00 C ATOM 1396 C VAL A 89 0.147 -2.854 8.411 1.00 0.00 C ATOM 1397 O VAL A 89 0.802 -3.731 8.974 1.00 0.00 O ATOM 1398 CB VAL A 89 -0.735 -3.824 6.287 1.00 0.00 C ATOM 1399 CG1 VAL A 89 -2.182 -3.632 6.715 1.00 0.00 C ATOM 1400 CG2 VAL A 89 -0.615 -3.834 4.771 1.00 0.00 C ATOM 0 H VAL A 89 1.825 -3.737 6.121 1.00 0.00 H new ATOM 0 HA VAL A 89 -0.239 -1.750 6.611 1.00 0.00 H new ATOM 0 HB VAL A 89 -0.396 -4.790 6.661 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -2.798 -4.418 6.278 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -2.249 -3.680 7.802 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -2.537 -2.660 6.372 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -1.253 -4.617 4.361 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -0.926 -2.867 4.375 1.00 0.00 H new ATOM 0 HG23 VAL A 89 0.421 -4.025 4.489 1.00 0.00 H new ATOM 1410 N ARG A 90 -0.601 -1.975 9.068 1.00 0.00 N ATOM 1411 CA ARG A 90 -0.697 -1.990 10.523 1.00 0.00 C ATOM 1412 C ARG A 90 -2.089 -1.564 10.981 1.00 0.00 C ATOM 1413 O ARG A 90 -2.848 -0.966 10.217 1.00 0.00 O ATOM 1414 CB ARG A 90 0.357 -1.066 11.135 1.00 0.00 C ATOM 1415 CG ARG A 90 1.668 -1.766 11.456 1.00 0.00 C ATOM 1416 CD ARG A 90 2.829 -0.785 11.494 1.00 0.00 C ATOM 1417 NE ARG A 90 3.013 -0.205 12.822 1.00 0.00 N ATOM 1418 CZ ARG A 90 3.986 0.647 13.123 1.00 0.00 C ATOM 1419 NH1 ARG A 90 4.859 1.017 12.196 1.00 0.00 N ATOM 1420 NH2 ARG A 90 4.088 1.131 14.354 1.00 0.00 N ATOM 0 H ARG A 90 -1.150 -1.243 8.616 1.00 0.00 H new ATOM 0 HA ARG A 90 -0.518 -3.010 10.863 1.00 0.00 H new ATOM 0 HB2 ARG A 90 0.553 -0.245 10.445 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -0.044 -0.626 12.048 1.00 0.00 H new ATOM 0 HG2 ARG A 90 1.586 -2.271 12.418 1.00 0.00 H new ATOM 0 HG3 ARG A 90 1.864 -2.534 10.708 1.00 0.00 H new ATOM 0 HD2 ARG A 90 3.744 -1.294 11.191 1.00 0.00 H new ATOM 0 HD3 ARG A 90 2.654 0.012 10.772 1.00 0.00 H new ATOM 0 HE ARG A 90 2.358 -0.469 13.558 1.00 0.00 H new ATOM 0 HH11 ARG A 90 4.784 0.647 11.248 1.00 0.00 H new ATOM 0 HH12 ARG A 90 5.605 1.672 12.431 1.00 0.00 H new ATOM 0 HH21 ARG A 90 3.419 0.849 15.070 1.00 0.00 H new ATOM 0 HH22 ARG A 90 4.836 1.785 14.584 1.00 0.00 H new ATOM 1434 N TRP A 91 -2.417 -1.875 12.229 1.00 0.00 N ATOM 1435 CA TRP A 91 -3.718 -1.525 12.788 1.00 0.00 C ATOM 1436 C TRP A 91 -3.731 -1.718 14.300 1.00 0.00 C ATOM 1437 O TRP A 91 -3.151 -2.672 14.818 1.00 0.00 O ATOM 1438 CB TRP A 91 -4.817 -2.371 12.144 1.00 0.00 C ATOM 1439 CG TRP A 91 -4.725 -3.827 12.489 1.00 0.00 C ATOM 1440 CD1 TRP A 91 -5.250 -4.443 13.589 1.00 0.00 C ATOM 1441 CD2 TRP A 91 -4.066 -4.847 11.731 1.00 0.00 C ATOM 1442 NE1 TRP A 91 -4.957 -5.785 13.560 1.00 0.00 N ATOM 1443 CE2 TRP A 91 -4.233 -6.058 12.430 1.00 0.00 C ATOM 1444 CE3 TRP A 91 -3.354 -4.856 10.528 1.00 0.00 C ATOM 1445 CZ2 TRP A 91 -3.712 -7.263 11.965 1.00 0.00 C ATOM 1446 CZ3 TRP A 91 -2.838 -6.052 10.069 1.00 0.00 C ATOM 1447 CH2 TRP A 91 -3.019 -7.243 10.786 1.00 0.00 C ATOM 0 H TRP A 91 -1.800 -2.369 12.874 1.00 0.00 H new ATOM 0 HA TRP A 91 -3.906 -0.473 12.574 1.00 0.00 H new ATOM 0 HB2 TRP A 91 -5.789 -1.991 12.458 1.00 0.00 H new ATOM 0 HB3 TRP A 91 -4.765 -2.258 11.061 1.00 0.00 H new ATOM 0 HD1 TRP A 91 -5.813 -3.948 14.367 1.00 0.00 H new ATOM 0 HE1 TRP A 91 -5.234 -6.467 14.266 1.00 0.00 H new ATOM 0 HE3 TRP A 91 -3.210 -3.944 9.968 1.00 0.00 H new ATOM 0 HZ2 TRP A 91 -3.850 -8.181 12.516 1.00 0.00 H new ATOM 0 HZ3 TRP A 91 -2.285 -6.070 9.141 1.00 0.00 H new ATOM 0 HH2 TRP A 91 -2.603 -8.162 10.400 1.00 0.00 H new ATOM 1458 N SER A 92 -4.396 -0.807 15.003 1.00 0.00 N ATOM 1459 CA SER A 92 -4.481 -0.875 16.457 1.00 0.00 C ATOM 1460 C SER A 92 -5.923 -0.705 16.926 1.00 0.00 C ATOM 1461 O SER A 92 -6.580 0.282 16.600 1.00 0.00 O ATOM 1462 CB SER A 92 -3.596 0.199 17.093 1.00 0.00 C ATOM 1463 OG SER A 92 -3.562 0.063 18.503 1.00 0.00 O ATOM 0 H SER A 92 -4.884 -0.013 14.589 1.00 0.00 H new ATOM 0 HA SER A 92 -4.129 -1.858 16.770 1.00 0.00 H new ATOM 0 HB2 SER A 92 -2.585 0.125 16.693 1.00 0.00 H new ATOM 0 HB3 SER A 92 -3.972 1.188 16.829 1.00 0.00 H new ATOM 0 HG SER A 92 -2.989 0.760 18.885 1.00 0.00 H new ATOM 1469 N GLY A 93 -6.408 -1.676 17.694 1.00 0.00 N ATOM 1470 CA GLY A 93 -7.768 -1.615 18.196 1.00 0.00 C ATOM 1471 C GLY A 93 -8.467 -2.960 18.140 1.00 0.00 C ATOM 1472 O GLY A 93 -9.230 -3.249 17.218 1.00 0.00 O ATOM 0 H GLY A 93 -5.883 -2.504 17.977 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -7.756 -1.257 19.226 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -8.335 -0.889 17.613 1.00 0.00 H new ATOM 1476 N PRO A 94 -8.205 -3.809 19.145 1.00 0.00 N ATOM 1477 CA PRO A 94 -8.804 -5.144 19.229 1.00 0.00 C ATOM 1478 C PRO A 94 -10.298 -5.092 19.531 1.00 0.00 C ATOM 1479 O PRO A 94 -10.712 -5.217 20.683 1.00 0.00 O ATOM 1480 CB PRO A 94 -8.047 -5.800 20.386 1.00 0.00 C ATOM 1481 CG PRO A 94 -7.581 -4.662 21.228 1.00 0.00 C ATOM 1482 CD PRO A 94 -7.306 -3.530 20.277 1.00 0.00 C ATOM 0 HA PRO A 94 -8.724 -5.686 18.287 1.00 0.00 H new ATOM 0 HB2 PRO A 94 -8.693 -6.472 20.951 1.00 0.00 H new ATOM 0 HB3 PRO A 94 -7.208 -6.394 20.024 1.00 0.00 H new ATOM 0 HG2 PRO A 94 -8.339 -4.382 21.960 1.00 0.00 H new ATOM 0 HG3 PRO A 94 -6.684 -4.931 21.785 1.00 0.00 H new ATOM 0 HD2 PRO A 94 -7.520 -2.563 20.731 1.00 0.00 H new ATOM 0 HD3 PRO A 94 -6.262 -3.512 19.966 1.00 0.00 H new ATOM 1490 N SER A 95 -11.102 -4.906 18.489 1.00 0.00 N ATOM 1491 CA SER A 95 -12.550 -4.834 18.644 1.00 0.00 C ATOM 1492 C SER A 95 -13.121 -6.190 19.045 1.00 0.00 C ATOM 1493 O SER A 95 -12.919 -7.190 18.356 1.00 0.00 O ATOM 1494 CB SER A 95 -13.200 -4.358 17.343 1.00 0.00 C ATOM 1495 OG SER A 95 -12.908 -2.994 17.097 1.00 0.00 O ATOM 0 H SER A 95 -10.775 -4.802 17.528 1.00 0.00 H new ATOM 0 HA SER A 95 -12.771 -4.118 19.435 1.00 0.00 H new ATOM 0 HB2 SER A 95 -12.843 -4.965 16.511 1.00 0.00 H new ATOM 0 HB3 SER A 95 -14.280 -4.498 17.400 1.00 0.00 H new ATOM 0 HG SER A 95 -13.333 -2.714 16.259 1.00 0.00 H new ATOM 1501 N SER A 96 -13.836 -6.216 20.165 1.00 0.00 N ATOM 1502 CA SER A 96 -14.435 -7.450 20.662 1.00 0.00 C ATOM 1503 C SER A 96 -15.608 -7.875 19.785 1.00 0.00 C ATOM 1504 O SER A 96 -16.533 -7.100 19.547 1.00 0.00 O ATOM 1505 CB SER A 96 -14.903 -7.269 22.107 1.00 0.00 C ATOM 1506 OG SER A 96 -16.015 -6.394 22.177 1.00 0.00 O ATOM 0 H SER A 96 -14.015 -5.397 20.746 1.00 0.00 H new ATOM 0 HA SER A 96 -13.677 -8.232 20.629 1.00 0.00 H new ATOM 0 HB2 SER A 96 -15.171 -8.237 22.530 1.00 0.00 H new ATOM 0 HB3 SER A 96 -14.086 -6.873 22.710 1.00 0.00 H new ATOM 0 HG SER A 96 -16.409 -6.294 21.285 1.00 0.00 H new ATOM 1512 N GLY A 97 -15.563 -9.115 19.307 1.00 0.00 N ATOM 1513 CA GLY A 97 -16.627 -9.624 18.462 1.00 0.00 C ATOM 1514 C GLY A 97 -17.770 -10.218 19.262 1.00 0.00 C ATOM 1515 O GLY A 97 -18.640 -9.494 19.746 1.00 0.00 O ATOM 0 H GLY A 97 -14.808 -9.776 19.490 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -17.007 -8.817 17.836 1.00 0.00 H new ATOM 0 HA3 GLY A 97 -16.223 -10.383 17.793 1.00 0.00 H new TER 1519 GLY A 97