USER MOD reduce.3.24.130724 H: found=0, std=0, add=911, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 910 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 83 SER OG : rot -110:sc= -0.162 USER MOD Set 1.2: A 101 ASN : amide:sc= -0.955 K(o=-1.1,f=-3.7) USER MOD Set 2.1: A 1 SER N :NH3+ 170:sc=-0.00459 (180deg=-0.272) USER MOD Set 2.2: A 94 SER OG : rot 128:sc= 1.14 USER MOD Single : A 1 SER OG : rot 56:sc= 0.338 USER MOD Single : A 3 GLN : amide:sc= -0.0278 X(o=-0.028,f=0) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 TYR OH : rot 180:sc= 0 USER MOD Single : A 8 THR OG1 : rot 180:sc= -0.729 USER MOD Single : A 9 ASN : amide:sc= -0.34 K(o=-0.34,f=-3.5!) USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 THR OG1 : rot -45:sc= 0.334 USER MOD Single : A 18 GLN : amide:sc= -4.03! C(o=-4!,f=-7.3!) USER MOD Single : A 27 ASN : amide:sc= -1.65! C(o=-1.6!,f=-7.9!) USER MOD Single : A 28 THR OG1 : rot 180:sc= 0.0791 USER MOD Single : A 31 THR OG1 : rot 180:sc= -0.495 USER MOD Single : A 32 SER OG : rot 59:sc= 0.275 USER MOD Single : A 38 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 GLN : amide:sc= -3.24! C(o=-3.2!,f=-5.6!) USER MOD Single : A 43 GLN : amide:sc= 0 K(o=0,f=-1.7!) USER MOD Single : A 44 THR OG1 : rot 180:sc= -0.0141 USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 50 ASN : amide:sc= -0.0218 X(o=-0.022,f=-0.51) USER MOD Single : A 51 ASN : amide:sc= 0 X(o=0,f=-0.34) USER MOD Single : A 58 SER OG : rot 64:sc= 1.01 USER MOD Single : A 66 HIS :FLIP no HD1:sc= -0.545 F(o=-1.3!,f=-0.55) USER MOD Single : A 67 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 THR OG1 : rot 180:sc=-0.00797 USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 78 TYR OH : rot -120:sc= -1.57! USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 THR OG1 : rot -36:sc= 1.22 USER MOD Single : A 90 LYS NZ :NH3+ -134:sc= -0.157 (180deg=-2.57!) USER MOD Single : A 91 THR OG1 : rot -72:sc= -0.95 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 TYR OH : rot 180:sc= -1.25 USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 GLN : amide:sc= -0.302 K(o=-0.3,f=-3.1!) USER MOD Single : A 108 THR OG1 : rot -12:sc= 0.776 USER MOD Single : A 111 ASN : amide:sc= -0.41 K(o=-0.41,f=-3.6!) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 6.550 8.702 0.071 1.00 0.00 N ATOM 2 CA SER A 1 6.405 8.242 -1.339 1.00 0.00 C ATOM 3 C SER A 1 7.793 8.024 -1.946 1.00 0.00 C ATOM 4 O SER A 1 8.409 8.943 -2.449 1.00 0.00 O ATOM 5 CB SER A 1 5.658 9.304 -2.147 1.00 0.00 C ATOM 6 OG SER A 1 6.212 10.584 -1.866 1.00 0.00 O ATOM 0 H1 SER A 1 5.625 9.012 0.432 1.00 0.00 H new ATOM 0 H2 SER A 1 6.905 7.920 0.657 1.00 0.00 H new ATOM 0 H3 SER A 1 7.221 9.496 0.110 1.00 0.00 H new ATOM 0 HA SER A 1 5.845 7.307 -1.362 1.00 0.00 H new ATOM 0 HB2 SER A 1 5.735 9.088 -3.213 1.00 0.00 H new ATOM 0 HB3 SER A 1 4.598 9.290 -1.895 1.00 0.00 H new ATOM 0 HG SER A 1 7.173 10.574 -2.057 1.00 0.00 H new ATOM 14 N TRP A 2 8.294 6.818 -1.904 1.00 0.00 N ATOM 15 CA TRP A 2 9.642 6.562 -2.483 1.00 0.00 C ATOM 16 C TRP A 2 9.507 6.116 -3.938 1.00 0.00 C ATOM 17 O TRP A 2 9.274 4.961 -4.230 1.00 0.00 O ATOM 18 CB TRP A 2 10.365 5.482 -1.675 1.00 0.00 C ATOM 19 CG TRP A 2 9.472 4.298 -1.462 1.00 0.00 C ATOM 20 CD1 TRP A 2 9.435 3.201 -2.254 1.00 0.00 C ATOM 21 CD2 TRP A 2 8.507 4.067 -0.396 1.00 0.00 C ATOM 22 NE1 TRP A 2 8.507 2.311 -1.740 1.00 0.00 N ATOM 23 CE2 TRP A 2 7.910 2.798 -0.594 1.00 0.00 C ATOM 24 CE3 TRP A 2 8.097 4.826 0.714 1.00 0.00 C ATOM 25 CZ2 TRP A 2 6.939 2.301 0.281 1.00 0.00 C ATOM 26 CZ3 TRP A 2 7.121 4.331 1.595 1.00 0.00 C ATOM 27 CH2 TRP A 2 6.546 3.070 1.378 1.00 0.00 C ATOM 0 H TRP A 2 7.831 6.005 -1.497 1.00 0.00 H new ATOM 0 HA TRP A 2 10.223 7.483 -2.443 1.00 0.00 H new ATOM 0 HB2 TRP A 2 11.270 5.173 -2.198 1.00 0.00 H new ATOM 0 HB3 TRP A 2 10.677 5.887 -0.712 1.00 0.00 H new ATOM 0 HD1 TRP A 2 10.031 3.045 -3.141 1.00 0.00 H new ATOM 0 HE1 TRP A 2 8.291 1.406 -2.157 1.00 0.00 H new ATOM 0 HE3 TRP A 2 8.536 5.797 0.891 1.00 0.00 H new ATOM 0 HZ2 TRP A 2 6.497 1.331 0.110 1.00 0.00 H new ATOM 0 HZ3 TRP A 2 6.812 4.924 2.443 1.00 0.00 H new ATOM 0 HH2 TRP A 2 5.798 2.694 2.060 1.00 0.00 H new ATOM 38 N GLN A 3 9.660 7.033 -4.856 1.00 0.00 N ATOM 39 CA GLN A 3 9.548 6.679 -6.298 1.00 0.00 C ATOM 40 C GLN A 3 10.872 6.076 -6.773 1.00 0.00 C ATOM 41 O GLN A 3 10.917 5.335 -7.734 1.00 0.00 O ATOM 42 CB GLN A 3 9.241 7.943 -7.103 1.00 0.00 C ATOM 43 CG GLN A 3 9.305 7.634 -8.601 1.00 0.00 C ATOM 44 CD GLN A 3 9.471 8.938 -9.381 1.00 0.00 C ATOM 45 OE1 GLN A 3 8.578 9.352 -10.094 1.00 0.00 O ATOM 46 NE2 GLN A 3 10.585 9.611 -9.274 1.00 0.00 N ATOM 0 H GLN A 3 9.858 8.015 -4.667 1.00 0.00 H new ATOM 0 HA GLN A 3 8.747 5.953 -6.441 1.00 0.00 H new ATOM 0 HB2 GLN A 3 8.252 8.320 -6.842 1.00 0.00 H new ATOM 0 HB3 GLN A 3 9.956 8.727 -6.853 1.00 0.00 H new ATOM 0 HG2 GLN A 3 10.139 6.964 -8.810 1.00 0.00 H new ATOM 0 HG3 GLN A 3 8.397 7.121 -8.917 1.00 0.00 H new ATOM 0 HE21 GLN A 3 11.335 9.264 -8.676 1.00 0.00 H new ATOM 0 HE22 GLN A 3 10.705 10.483 -9.789 1.00 0.00 H new ATOM 55 N THR A 4 11.951 6.390 -6.108 1.00 0.00 N ATOM 56 CA THR A 4 13.268 5.833 -6.525 1.00 0.00 C ATOM 57 C THR A 4 13.268 4.318 -6.314 1.00 0.00 C ATOM 58 O THR A 4 13.348 3.552 -7.254 1.00 0.00 O ATOM 59 CB THR A 4 14.381 6.466 -5.687 1.00 0.00 C ATOM 60 OG1 THR A 4 14.357 7.877 -5.859 1.00 0.00 O ATOM 61 CG2 THR A 4 15.735 5.917 -6.139 1.00 0.00 C ATOM 0 H THR A 4 11.977 7.007 -5.296 1.00 0.00 H new ATOM 0 HA THR A 4 13.439 6.054 -7.578 1.00 0.00 H new ATOM 0 HB THR A 4 14.227 6.226 -4.635 1.00 0.00 H new ATOM 0 HG1 THR A 4 15.068 8.284 -5.322 1.00 0.00 H new ATOM 0 HG21 THR A 4 16.528 6.368 -5.542 1.00 0.00 H new ATOM 0 HG22 THR A 4 15.752 4.835 -6.007 1.00 0.00 H new ATOM 0 HG23 THR A 4 15.892 6.156 -7.191 1.00 0.00 H new ATOM 69 N TYR A 5 13.173 3.877 -5.089 1.00 0.00 N ATOM 70 CA TYR A 5 13.165 2.409 -4.833 1.00 0.00 C ATOM 71 C TYR A 5 12.120 1.754 -5.738 1.00 0.00 C ATOM 72 O TYR A 5 12.337 0.697 -6.295 1.00 0.00 O ATOM 73 CB TYR A 5 12.802 2.124 -3.370 1.00 0.00 C ATOM 74 CG TYR A 5 13.399 3.170 -2.461 1.00 0.00 C ATOM 75 CD1 TYR A 5 14.645 3.734 -2.759 1.00 0.00 C ATOM 76 CD2 TYR A 5 12.703 3.574 -1.313 1.00 0.00 C ATOM 77 CE1 TYR A 5 15.197 4.700 -1.910 1.00 0.00 C ATOM 78 CE2 TYR A 5 13.256 4.541 -0.464 1.00 0.00 C ATOM 79 CZ TYR A 5 14.503 5.104 -0.763 1.00 0.00 C ATOM 80 OH TYR A 5 15.048 6.055 0.075 1.00 0.00 O ATOM 0 H TYR A 5 13.101 4.466 -4.259 1.00 0.00 H new ATOM 0 HA TYR A 5 14.157 2.006 -5.039 1.00 0.00 H new ATOM 0 HB2 TYR A 5 11.718 2.110 -3.255 1.00 0.00 H new ATOM 0 HB3 TYR A 5 13.166 1.137 -3.085 1.00 0.00 H new ATOM 0 HD1 TYR A 5 15.180 3.424 -3.644 1.00 0.00 H new ATOM 0 HD2 TYR A 5 11.741 3.140 -1.083 1.00 0.00 H new ATOM 0 HE1 TYR A 5 16.159 5.134 -2.140 1.00 0.00 H new ATOM 0 HE2 TYR A 5 12.721 4.852 0.421 1.00 0.00 H new ATOM 0 HH TYR A 5 14.437 6.221 0.823 1.00 0.00 H new ATOM 90 N VAL A 6 10.982 2.377 -5.875 1.00 0.00 N ATOM 91 CA VAL A 6 9.904 1.801 -6.728 1.00 0.00 C ATOM 92 C VAL A 6 10.477 1.404 -8.098 1.00 0.00 C ATOM 93 O VAL A 6 10.238 0.321 -8.592 1.00 0.00 O ATOM 94 CB VAL A 6 8.779 2.851 -6.878 1.00 0.00 C ATOM 95 CG1 VAL A 6 8.437 3.107 -8.353 1.00 0.00 C ATOM 96 CG2 VAL A 6 7.525 2.353 -6.155 1.00 0.00 C ATOM 0 H VAL A 6 10.751 3.265 -5.430 1.00 0.00 H new ATOM 0 HA VAL A 6 9.494 0.903 -6.265 1.00 0.00 H new ATOM 0 HB VAL A 6 9.130 3.786 -6.441 1.00 0.00 H new ATOM 0 HG11 VAL A 6 7.642 3.850 -8.419 1.00 0.00 H new ATOM 0 HG12 VAL A 6 9.322 3.475 -8.873 1.00 0.00 H new ATOM 0 HG13 VAL A 6 8.104 2.178 -8.816 1.00 0.00 H new ATOM 0 HG21 VAL A 6 6.729 3.090 -6.258 1.00 0.00 H new ATOM 0 HG22 VAL A 6 7.204 1.408 -6.593 1.00 0.00 H new ATOM 0 HG23 VAL A 6 7.749 2.206 -5.098 1.00 0.00 H new ATOM 106 N ASP A 7 11.208 2.284 -8.723 1.00 0.00 N ATOM 107 CA ASP A 7 11.767 1.971 -10.070 1.00 0.00 C ATOM 108 C ASP A 7 13.116 1.262 -9.948 1.00 0.00 C ATOM 109 O ASP A 7 14.102 1.699 -10.510 1.00 0.00 O ATOM 110 CB ASP A 7 11.963 3.271 -10.845 1.00 0.00 C ATOM 111 CG ASP A 7 11.381 3.121 -12.252 1.00 0.00 C ATOM 112 OD1 ASP A 7 11.067 2.004 -12.626 1.00 0.00 O ATOM 113 OD2 ASP A 7 11.261 4.127 -12.930 1.00 0.00 O ATOM 0 H ASP A 7 11.443 3.208 -8.360 1.00 0.00 H new ATOM 0 HA ASP A 7 11.069 1.315 -10.591 1.00 0.00 H new ATOM 0 HB2 ASP A 7 11.474 4.094 -10.324 1.00 0.00 H new ATOM 0 HB3 ASP A 7 13.024 3.515 -10.903 1.00 0.00 H new ATOM 118 N THR A 8 13.182 0.170 -9.240 1.00 0.00 N ATOM 119 CA THR A 8 14.489 -0.537 -9.127 1.00 0.00 C ATOM 120 C THR A 8 14.430 -1.654 -8.079 1.00 0.00 C ATOM 121 O THR A 8 14.208 -2.805 -8.396 1.00 0.00 O ATOM 122 CB THR A 8 15.577 0.467 -8.733 1.00 0.00 C ATOM 123 OG1 THR A 8 16.599 -0.205 -8.010 1.00 0.00 O ATOM 124 CG2 THR A 8 14.972 1.569 -7.861 1.00 0.00 C ATOM 0 H THR A 8 12.402 -0.259 -8.742 1.00 0.00 H new ATOM 0 HA THR A 8 14.718 -0.985 -10.094 1.00 0.00 H new ATOM 0 HB THR A 8 16.000 0.914 -9.633 1.00 0.00 H new ATOM 0 HG1 THR A 8 17.297 0.435 -7.759 1.00 0.00 H new ATOM 0 HG21 THR A 8 15.749 2.281 -7.583 1.00 0.00 H new ATOM 0 HG22 THR A 8 14.190 2.085 -8.418 1.00 0.00 H new ATOM 0 HG23 THR A 8 14.546 1.127 -6.960 1.00 0.00 H new ATOM 132 N ASN A 9 14.664 -1.327 -6.838 1.00 0.00 N ATOM 133 CA ASN A 9 14.665 -2.373 -5.774 1.00 0.00 C ATOM 134 C ASN A 9 13.266 -2.583 -5.194 1.00 0.00 C ATOM 135 O ASN A 9 12.629 -3.584 -5.454 1.00 0.00 O ATOM 136 CB ASN A 9 15.609 -1.940 -4.650 1.00 0.00 C ATOM 137 CG ASN A 9 16.907 -2.744 -4.725 1.00 0.00 C ATOM 138 OD1 ASN A 9 16.976 -3.748 -5.406 1.00 0.00 O ATOM 139 ND2 ASN A 9 17.946 -2.342 -4.045 1.00 0.00 N ATOM 0 H ASN A 9 14.855 -0.379 -6.513 1.00 0.00 H new ATOM 0 HA ASN A 9 14.996 -3.312 -6.218 1.00 0.00 H new ATOM 0 HB2 ASN A 9 15.825 -0.875 -4.734 1.00 0.00 H new ATOM 0 HB3 ASN A 9 15.131 -2.093 -3.682 1.00 0.00 H new ATOM 0 HD21 ASN A 9 18.817 -2.871 -4.085 1.00 0.00 H new ATOM 0 HD22 ASN A 9 17.887 -1.499 -3.474 1.00 0.00 H new ATOM 146 N LEU A 10 12.811 -1.660 -4.385 1.00 0.00 N ATOM 147 CA LEU A 10 11.468 -1.787 -3.736 1.00 0.00 C ATOM 148 C LEU A 10 10.516 -2.629 -4.582 1.00 0.00 C ATOM 149 O LEU A 10 9.838 -3.502 -4.077 1.00 0.00 O ATOM 150 CB LEU A 10 10.857 -0.400 -3.549 1.00 0.00 C ATOM 151 CG LEU A 10 10.714 -0.100 -2.058 1.00 0.00 C ATOM 152 CD1 LEU A 10 9.724 -1.087 -1.434 1.00 0.00 C ATOM 153 CD2 LEU A 10 12.076 -0.245 -1.376 1.00 0.00 C ATOM 0 H LEU A 10 13.320 -0.810 -4.142 1.00 0.00 H new ATOM 0 HA LEU A 10 11.609 -2.278 -2.773 1.00 0.00 H new ATOM 0 HB2 LEU A 10 11.487 0.353 -4.023 1.00 0.00 H new ATOM 0 HB3 LEU A 10 9.883 -0.352 -4.035 1.00 0.00 H new ATOM 0 HG LEU A 10 10.347 0.918 -1.925 1.00 0.00 H new ATOM 0 HD11 LEU A 10 9.620 -0.875 -0.370 1.00 0.00 H new ATOM 0 HD12 LEU A 10 8.754 -0.986 -1.920 1.00 0.00 H new ATOM 0 HD13 LEU A 10 10.092 -2.104 -1.567 1.00 0.00 H new ATOM 0 HD21 LEU A 10 11.975 -0.031 -0.312 1.00 0.00 H new ATOM 0 HD22 LEU A 10 12.443 -1.263 -1.508 1.00 0.00 H new ATOM 0 HD23 LEU A 10 12.782 0.456 -1.821 1.00 0.00 H new ATOM 165 N VAL A 11 10.438 -2.376 -5.858 1.00 0.00 N ATOM 166 CA VAL A 11 9.501 -3.175 -6.694 1.00 0.00 C ATOM 167 C VAL A 11 10.255 -4.245 -7.474 1.00 0.00 C ATOM 168 O VAL A 11 9.707 -5.292 -7.756 1.00 0.00 O ATOM 169 CB VAL A 11 8.749 -2.258 -7.660 1.00 0.00 C ATOM 170 CG1 VAL A 11 7.745 -3.080 -8.471 1.00 0.00 C ATOM 171 CG2 VAL A 11 8.004 -1.180 -6.869 1.00 0.00 C ATOM 0 H VAL A 11 10.973 -1.662 -6.352 1.00 0.00 H new ATOM 0 HA VAL A 11 8.785 -3.666 -6.035 1.00 0.00 H new ATOM 0 HB VAL A 11 9.461 -1.785 -8.336 1.00 0.00 H new ATOM 0 HG11 VAL A 11 7.210 -2.425 -9.159 1.00 0.00 H new ATOM 0 HG12 VAL A 11 8.275 -3.846 -9.037 1.00 0.00 H new ATOM 0 HG13 VAL A 11 7.034 -3.555 -7.795 1.00 0.00 H new ATOM 0 HG21 VAL A 11 7.469 -0.527 -7.559 1.00 0.00 H new ATOM 0 HG22 VAL A 11 7.293 -1.652 -6.191 1.00 0.00 H new ATOM 0 HG23 VAL A 11 8.719 -0.592 -6.294 1.00 0.00 H new ATOM 181 N GLY A 12 11.509 -4.028 -7.807 1.00 0.00 N ATOM 182 CA GLY A 12 12.263 -5.097 -8.535 1.00 0.00 C ATOM 183 C GLY A 12 11.952 -6.406 -7.816 1.00 0.00 C ATOM 184 O GLY A 12 11.914 -7.476 -8.391 1.00 0.00 O ATOM 0 H GLY A 12 12.032 -3.175 -7.610 1.00 0.00 H new ATOM 0 HA2 GLY A 12 11.957 -5.145 -9.580 1.00 0.00 H new ATOM 0 HA3 GLY A 12 13.334 -4.893 -8.525 1.00 0.00 H new ATOM 188 N THR A 13 11.683 -6.282 -6.547 1.00 0.00 N ATOM 189 CA THR A 13 11.308 -7.438 -5.707 1.00 0.00 C ATOM 190 C THR A 13 10.983 -6.895 -4.328 1.00 0.00 C ATOM 191 O THR A 13 10.051 -7.329 -3.723 1.00 0.00 O ATOM 192 CB THR A 13 12.455 -8.453 -5.601 1.00 0.00 C ATOM 193 OG1 THR A 13 12.617 -8.846 -4.245 1.00 0.00 O ATOM 194 CG2 THR A 13 13.760 -7.834 -6.110 1.00 0.00 C ATOM 0 H THR A 13 11.711 -5.393 -6.047 1.00 0.00 H new ATOM 0 HA THR A 13 10.457 -7.956 -6.150 1.00 0.00 H new ATOM 0 HB THR A 13 12.213 -9.323 -6.211 1.00 0.00 H new ATOM 0 HG1 THR A 13 13.348 -9.495 -4.178 1.00 0.00 H new ATOM 0 HG21 THR A 13 14.565 -8.564 -6.029 1.00 0.00 H new ATOM 0 HG22 THR A 13 13.641 -7.539 -7.153 1.00 0.00 H new ATOM 0 HG23 THR A 13 14.005 -6.957 -5.511 1.00 0.00 H new ATOM 202 N GLY A 14 11.760 -5.927 -3.877 1.00 0.00 N ATOM 203 CA GLY A 14 11.573 -5.260 -2.536 1.00 0.00 C ATOM 204 C GLY A 14 10.558 -5.984 -1.649 1.00 0.00 C ATOM 205 O GLY A 14 9.703 -5.362 -1.054 1.00 0.00 O ATOM 0 H GLY A 14 12.549 -5.558 -4.407 1.00 0.00 H new ATOM 0 HA2 GLY A 14 12.532 -5.216 -2.021 1.00 0.00 H new ATOM 0 HA3 GLY A 14 11.246 -4.232 -2.689 1.00 0.00 H new ATOM 209 N ALA A 15 10.626 -7.286 -1.585 1.00 0.00 N ATOM 210 CA ALA A 15 9.651 -8.070 -0.765 1.00 0.00 C ATOM 211 C ALA A 15 8.434 -8.367 -1.638 1.00 0.00 C ATOM 212 O ALA A 15 7.834 -9.421 -1.556 1.00 0.00 O ATOM 213 CB ALA A 15 9.226 -7.276 0.474 1.00 0.00 C ATOM 0 H ALA A 15 11.324 -7.849 -2.071 1.00 0.00 H new ATOM 0 HA ALA A 15 10.113 -8.997 -0.425 1.00 0.00 H new ATOM 0 HB1 ALA A 15 8.517 -7.864 1.057 1.00 0.00 H new ATOM 0 HB2 ALA A 15 10.102 -7.056 1.083 1.00 0.00 H new ATOM 0 HB3 ALA A 15 8.756 -6.343 0.164 1.00 0.00 H new ATOM 219 N VAL A 16 8.095 -7.453 -2.502 1.00 0.00 N ATOM 220 CA VAL A 16 6.957 -7.666 -3.422 1.00 0.00 C ATOM 221 C VAL A 16 7.495 -7.574 -4.855 1.00 0.00 C ATOM 222 O VAL A 16 8.312 -6.729 -5.158 1.00 0.00 O ATOM 223 CB VAL A 16 5.914 -6.568 -3.192 1.00 0.00 C ATOM 224 CG1 VAL A 16 5.377 -6.658 -1.762 1.00 0.00 C ATOM 225 CG2 VAL A 16 6.569 -5.201 -3.396 1.00 0.00 C ATOM 0 H VAL A 16 8.569 -6.556 -2.607 1.00 0.00 H new ATOM 0 HA VAL A 16 6.493 -8.638 -3.251 1.00 0.00 H new ATOM 0 HB VAL A 16 5.093 -6.696 -3.897 1.00 0.00 H new ATOM 0 HG11 VAL A 16 4.635 -5.875 -1.602 1.00 0.00 H new ATOM 0 HG12 VAL A 16 4.915 -7.633 -1.608 1.00 0.00 H new ATOM 0 HG13 VAL A 16 6.198 -6.530 -1.056 1.00 0.00 H new ATOM 0 HG21 VAL A 16 5.831 -4.416 -3.233 1.00 0.00 H new ATOM 0 HG22 VAL A 16 7.388 -5.081 -2.687 1.00 0.00 H new ATOM 0 HG23 VAL A 16 6.955 -5.131 -4.413 1.00 0.00 H new ATOM 235 N THR A 17 7.051 -8.425 -5.742 1.00 0.00 N ATOM 236 CA THR A 17 7.554 -8.356 -7.150 1.00 0.00 C ATOM 237 C THR A 17 6.816 -7.238 -7.901 1.00 0.00 C ATOM 238 O THR A 17 6.877 -7.136 -9.111 1.00 0.00 O ATOM 239 CB THR A 17 7.308 -9.697 -7.847 1.00 0.00 C ATOM 240 OG1 THR A 17 8.037 -9.736 -9.066 1.00 0.00 O ATOM 241 CG2 THR A 17 5.816 -9.861 -8.134 1.00 0.00 C ATOM 0 H THR A 17 6.368 -9.160 -5.557 1.00 0.00 H new ATOM 0 HA THR A 17 8.623 -8.144 -7.146 1.00 0.00 H new ATOM 0 HB THR A 17 7.640 -10.509 -7.200 1.00 0.00 H new ATOM 0 HG1 THR A 17 7.925 -8.886 -9.541 1.00 0.00 H new ATOM 0 HG21 THR A 17 5.644 -10.816 -8.630 1.00 0.00 H new ATOM 0 HG22 THR A 17 5.260 -9.833 -7.197 1.00 0.00 H new ATOM 0 HG23 THR A 17 5.479 -9.051 -8.780 1.00 0.00 H new ATOM 249 N GLN A 18 6.127 -6.401 -7.178 1.00 0.00 N ATOM 250 CA GLN A 18 5.372 -5.268 -7.796 1.00 0.00 C ATOM 251 C GLN A 18 5.145 -4.217 -6.702 1.00 0.00 C ATOM 252 O GLN A 18 5.376 -4.481 -5.540 1.00 0.00 O ATOM 253 CB GLN A 18 4.007 -5.750 -8.315 1.00 0.00 C ATOM 254 CG GLN A 18 4.181 -6.871 -9.346 1.00 0.00 C ATOM 255 CD GLN A 18 4.774 -6.301 -10.636 1.00 0.00 C ATOM 256 OE1 GLN A 18 5.816 -5.677 -10.617 1.00 0.00 O ATOM 257 NE2 GLN A 18 4.146 -6.492 -11.764 1.00 0.00 N ATOM 0 H GLN A 18 6.052 -6.453 -6.162 1.00 0.00 H new ATOM 0 HA GLN A 18 5.936 -4.858 -8.634 1.00 0.00 H new ATOM 0 HB2 GLN A 18 3.402 -6.107 -7.482 1.00 0.00 H new ATOM 0 HB3 GLN A 18 3.469 -4.916 -8.765 1.00 0.00 H new ATOM 0 HG2 GLN A 18 4.834 -7.647 -8.946 1.00 0.00 H new ATOM 0 HG3 GLN A 18 3.219 -7.340 -9.553 1.00 0.00 H new ATOM 0 HE21 GLN A 18 3.271 -7.016 -11.778 1.00 0.00 H new ATOM 0 HE22 GLN A 18 4.530 -6.117 -12.631 1.00 0.00 H new ATOM 266 N ALA A 19 4.694 -3.037 -7.037 1.00 0.00 N ATOM 267 CA ALA A 19 4.470 -2.021 -5.965 1.00 0.00 C ATOM 268 C ALA A 19 4.096 -0.667 -6.569 1.00 0.00 C ATOM 269 O ALA A 19 4.634 -0.253 -7.576 1.00 0.00 O ATOM 270 CB ALA A 19 5.750 -1.873 -5.139 1.00 0.00 C ATOM 0 H ALA A 19 4.474 -2.736 -7.986 1.00 0.00 H new ATOM 0 HA ALA A 19 3.649 -2.355 -5.331 1.00 0.00 H new ATOM 0 HB1 ALA A 19 5.593 -1.133 -4.355 1.00 0.00 H new ATOM 0 HB2 ALA A 19 6.005 -2.832 -4.687 1.00 0.00 H new ATOM 0 HB3 ALA A 19 6.565 -1.549 -5.786 1.00 0.00 H new ATOM 276 N ALA A 20 3.179 0.030 -5.947 1.00 0.00 N ATOM 277 CA ALA A 20 2.771 1.361 -6.468 1.00 0.00 C ATOM 278 C ALA A 20 2.667 2.340 -5.297 1.00 0.00 C ATOM 279 O ALA A 20 2.231 1.986 -4.220 1.00 0.00 O ATOM 280 CB ALA A 20 1.408 1.245 -7.154 1.00 0.00 C ATOM 0 H ALA A 20 2.697 -0.270 -5.100 1.00 0.00 H new ATOM 0 HA ALA A 20 3.508 1.718 -7.187 1.00 0.00 H new ATOM 0 HB1 ALA A 20 1.109 2.221 -7.536 1.00 0.00 H new ATOM 0 HB2 ALA A 20 1.476 0.537 -7.980 1.00 0.00 H new ATOM 0 HB3 ALA A 20 0.668 0.894 -6.435 1.00 0.00 H new ATOM 286 N ILE A 21 3.058 3.567 -5.490 1.00 0.00 N ATOM 287 CA ILE A 21 2.962 4.548 -4.374 1.00 0.00 C ATOM 288 C ILE A 21 1.746 5.442 -4.604 1.00 0.00 C ATOM 289 O ILE A 21 1.702 6.228 -5.530 1.00 0.00 O ATOM 290 CB ILE A 21 4.236 5.392 -4.308 1.00 0.00 C ATOM 291 CG1 ILE A 21 5.444 4.449 -4.157 1.00 0.00 C ATOM 292 CG2 ILE A 21 4.147 6.341 -3.107 1.00 0.00 C ATOM 293 CD1 ILE A 21 6.601 5.160 -3.445 1.00 0.00 C ATOM 0 H ILE A 21 3.437 3.932 -6.364 1.00 0.00 H new ATOM 0 HA ILE A 21 2.851 4.019 -3.427 1.00 0.00 H new ATOM 0 HB ILE A 21 4.351 5.983 -5.217 1.00 0.00 H new ATOM 0 HG12 ILE A 21 5.152 3.564 -3.592 1.00 0.00 H new ATOM 0 HG13 ILE A 21 5.770 4.107 -5.139 1.00 0.00 H new ATOM 0 HG21 ILE A 21 5.052 6.946 -3.054 1.00 0.00 H new ATOM 0 HG22 ILE A 21 3.281 6.993 -3.222 1.00 0.00 H new ATOM 0 HG23 ILE A 21 4.045 5.760 -2.191 1.00 0.00 H new ATOM 0 HD11 ILE A 21 7.444 4.476 -3.349 1.00 0.00 H new ATOM 0 HD12 ILE A 21 6.905 6.031 -4.025 1.00 0.00 H new ATOM 0 HD13 ILE A 21 6.277 5.479 -2.454 1.00 0.00 H new ATOM 305 N LEU A 22 0.751 5.314 -3.770 1.00 0.00 N ATOM 306 CA LEU A 22 -0.477 6.135 -3.934 1.00 0.00 C ATOM 307 C LEU A 22 -0.408 7.335 -2.984 1.00 0.00 C ATOM 308 O LEU A 22 0.341 7.335 -2.028 1.00 0.00 O ATOM 309 CB LEU A 22 -1.699 5.272 -3.598 1.00 0.00 C ATOM 310 CG LEU A 22 -2.103 4.411 -4.810 1.00 0.00 C ATOM 311 CD1 LEU A 22 -0.861 3.898 -5.551 1.00 0.00 C ATOM 312 CD2 LEU A 22 -2.923 3.211 -4.327 1.00 0.00 C ATOM 0 H LEU A 22 0.738 4.672 -2.978 1.00 0.00 H new ATOM 0 HA LEU A 22 -0.557 6.494 -4.960 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -1.474 4.629 -2.747 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -2.532 5.910 -3.304 1.00 0.00 H new ATOM 0 HG LEU A 22 -2.692 5.025 -5.491 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -1.170 3.292 -6.403 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -0.271 4.745 -5.902 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -0.258 3.292 -4.875 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -3.211 2.599 -5.182 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -2.324 2.614 -3.639 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -3.819 3.564 -3.816 1.00 0.00 H new ATOM 324 N GLY A 23 -1.172 8.363 -3.241 1.00 0.00 N ATOM 325 CA GLY A 23 -1.131 9.560 -2.350 1.00 0.00 C ATOM 326 C GLY A 23 -2.470 9.721 -1.625 1.00 0.00 C ATOM 327 O GLY A 23 -3.379 8.931 -1.794 1.00 0.00 O ATOM 0 H GLY A 23 -1.820 8.426 -4.026 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -0.325 9.455 -1.623 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -0.916 10.453 -2.937 1.00 0.00 H new ATOM 331 N LEU A 24 -2.599 10.742 -0.820 1.00 0.00 N ATOM 332 CA LEU A 24 -3.880 10.957 -0.085 1.00 0.00 C ATOM 333 C LEU A 24 -4.643 12.110 -0.735 1.00 0.00 C ATOM 334 O LEU A 24 -5.820 12.009 -1.018 1.00 0.00 O ATOM 335 CB LEU A 24 -3.605 11.301 1.389 1.00 0.00 C ATOM 336 CG LEU A 24 -2.157 10.961 1.762 1.00 0.00 C ATOM 337 CD1 LEU A 24 -1.275 12.197 1.573 1.00 0.00 C ATOM 338 CD2 LEU A 24 -2.098 10.518 3.226 1.00 0.00 C ATOM 0 H LEU A 24 -1.874 11.436 -0.640 1.00 0.00 H new ATOM 0 HA LEU A 24 -4.470 10.042 -0.129 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -3.791 12.361 1.561 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -4.291 10.748 2.031 1.00 0.00 H new ATOM 0 HG LEU A 24 -1.799 10.156 1.121 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -0.246 11.954 1.839 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -1.315 12.517 0.532 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -1.635 13.002 2.214 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -1.069 10.276 3.492 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -2.458 11.324 3.865 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -2.725 9.637 3.365 1.00 0.00 H new ATOM 350 N ASP A 25 -3.981 13.208 -0.976 1.00 0.00 N ATOM 351 CA ASP A 25 -4.669 14.368 -1.611 1.00 0.00 C ATOM 352 C ASP A 25 -3.762 14.967 -2.686 1.00 0.00 C ATOM 353 O ASP A 25 -3.672 16.170 -2.836 1.00 0.00 O ATOM 354 CB ASP A 25 -4.974 15.426 -0.549 1.00 0.00 C ATOM 355 CG ASP A 25 -3.679 15.829 0.161 1.00 0.00 C ATOM 356 OD1 ASP A 25 -3.031 16.749 -0.309 1.00 0.00 O ATOM 357 OD2 ASP A 25 -3.360 15.212 1.164 1.00 0.00 O ATOM 0 H ASP A 25 -2.994 13.352 -0.761 1.00 0.00 H new ATOM 0 HA ASP A 25 -5.602 14.035 -2.066 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -5.433 16.299 -1.012 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -5.690 15.035 0.174 1.00 0.00 H new ATOM 362 N GLY A 26 -3.088 14.139 -3.436 1.00 0.00 N ATOM 363 CA GLY A 26 -2.188 14.664 -4.502 1.00 0.00 C ATOM 364 C GLY A 26 -2.249 13.745 -5.722 1.00 0.00 C ATOM 365 O GLY A 26 -1.325 13.678 -6.508 1.00 0.00 O ATOM 0 H GLY A 26 -3.121 13.123 -3.357 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -2.487 15.675 -4.780 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -1.165 14.725 -4.131 1.00 0.00 H new ATOM 369 N ASN A 27 -3.331 13.034 -5.889 1.00 0.00 N ATOM 370 CA ASN A 27 -3.447 12.120 -7.058 1.00 0.00 C ATOM 371 C ASN A 27 -2.345 11.060 -6.983 1.00 0.00 C ATOM 372 O ASN A 27 -1.954 10.635 -5.915 1.00 0.00 O ATOM 373 CB ASN A 27 -3.297 12.926 -8.350 1.00 0.00 C ATOM 374 CG ASN A 27 -4.254 14.120 -8.320 1.00 0.00 C ATOM 375 OD1 ASN A 27 -4.639 14.576 -7.261 1.00 0.00 O ATOM 376 ND2 ASN A 27 -4.656 14.646 -9.443 1.00 0.00 N ATOM 0 H ASN A 27 -4.139 13.047 -5.266 1.00 0.00 H new ATOM 0 HA ASN A 27 -4.422 11.632 -7.047 1.00 0.00 H new ATOM 0 HB2 ASN A 27 -2.269 13.273 -8.458 1.00 0.00 H new ATOM 0 HB3 ASN A 27 -3.513 12.295 -9.212 1.00 0.00 H new ATOM 0 HD21 ASN A 27 -5.295 15.441 -9.434 1.00 0.00 H new ATOM 0 HD22 ASN A 27 -4.332 14.262 -10.331 1.00 0.00 H new ATOM 383 N THR A 28 -1.841 10.627 -8.107 1.00 0.00 N ATOM 384 CA THR A 28 -0.768 9.594 -8.091 1.00 0.00 C ATOM 385 C THR A 28 0.600 10.271 -7.961 1.00 0.00 C ATOM 386 O THR A 28 0.813 11.362 -8.450 1.00 0.00 O ATOM 387 CB THR A 28 -0.818 8.788 -9.391 1.00 0.00 C ATOM 388 OG1 THR A 28 -1.897 9.250 -10.192 1.00 0.00 O ATOM 389 CG2 THR A 28 -1.014 7.308 -9.068 1.00 0.00 C ATOM 0 H THR A 28 -2.126 10.944 -9.034 1.00 0.00 H new ATOM 0 HA THR A 28 -0.921 8.928 -7.242 1.00 0.00 H new ATOM 0 HB THR A 28 0.118 8.916 -9.935 1.00 0.00 H new ATOM 0 HG1 THR A 28 -1.929 8.736 -11.026 1.00 0.00 H new ATOM 0 HG21 THR A 28 -1.049 6.735 -9.995 1.00 0.00 H new ATOM 0 HG22 THR A 28 -0.184 6.956 -8.455 1.00 0.00 H new ATOM 0 HG23 THR A 28 -1.949 7.175 -8.523 1.00 0.00 H new ATOM 397 N TRP A 29 1.528 9.626 -7.308 1.00 0.00 N ATOM 398 CA TRP A 29 2.882 10.223 -7.147 1.00 0.00 C ATOM 399 C TRP A 29 3.916 9.305 -7.801 1.00 0.00 C ATOM 400 O TRP A 29 4.967 9.741 -8.231 1.00 0.00 O ATOM 401 CB TRP A 29 3.198 10.371 -5.657 1.00 0.00 C ATOM 402 CG TRP A 29 2.334 11.442 -5.073 1.00 0.00 C ATOM 403 CD1 TRP A 29 1.680 12.386 -5.789 1.00 0.00 C ATOM 404 CD2 TRP A 29 2.017 11.697 -3.674 1.00 0.00 C ATOM 405 NE1 TRP A 29 0.981 13.203 -4.918 1.00 0.00 N ATOM 406 CE2 TRP A 29 1.157 12.819 -3.603 1.00 0.00 C ATOM 407 CE3 TRP A 29 2.389 11.069 -2.471 1.00 0.00 C ATOM 408 CZ2 TRP A 29 0.683 13.300 -2.382 1.00 0.00 C ATOM 409 CZ3 TRP A 29 1.913 11.552 -1.240 1.00 0.00 C ATOM 410 CH2 TRP A 29 1.062 12.665 -1.197 1.00 0.00 C ATOM 0 H TRP A 29 1.405 8.709 -6.878 1.00 0.00 H new ATOM 0 HA TRP A 29 2.911 11.204 -7.622 1.00 0.00 H new ATOM 0 HB2 TRP A 29 3.025 9.427 -5.141 1.00 0.00 H new ATOM 0 HB3 TRP A 29 4.250 10.621 -5.520 1.00 0.00 H new ATOM 0 HD1 TRP A 29 1.700 12.485 -6.864 1.00 0.00 H new ATOM 0 HE1 TRP A 29 0.406 13.993 -5.211 1.00 0.00 H new ATOM 0 HE3 TRP A 29 3.044 10.211 -2.494 1.00 0.00 H new ATOM 0 HZ2 TRP A 29 0.027 14.158 -2.353 1.00 0.00 H new ATOM 0 HZ3 TRP A 29 2.204 11.063 -0.322 1.00 0.00 H new ATOM 0 HH2 TRP A 29 0.699 13.031 -0.248 1.00 0.00 H new ATOM 421 N ALA A 30 3.623 8.038 -7.882 1.00 0.00 N ATOM 422 CA ALA A 30 4.581 7.087 -8.510 1.00 0.00 C ATOM 423 C ALA A 30 3.976 5.683 -8.509 1.00 0.00 C ATOM 424 O ALA A 30 3.079 5.384 -7.746 1.00 0.00 O ATOM 425 CB ALA A 30 5.891 7.079 -7.719 1.00 0.00 C ATOM 0 H ALA A 30 2.759 7.619 -7.539 1.00 0.00 H new ATOM 0 HA ALA A 30 4.781 7.398 -9.535 1.00 0.00 H new ATOM 0 HB1 ALA A 30 6.591 6.382 -8.181 1.00 0.00 H new ATOM 0 HB2 ALA A 30 6.322 8.080 -7.719 1.00 0.00 H new ATOM 0 HB3 ALA A 30 5.694 6.769 -6.693 1.00 0.00 H new ATOM 431 N THR A 31 4.458 4.820 -9.360 1.00 0.00 N ATOM 432 CA THR A 31 3.910 3.437 -9.405 1.00 0.00 C ATOM 433 C THR A 31 4.918 2.510 -10.088 1.00 0.00 C ATOM 434 O THR A 31 5.912 2.949 -10.633 1.00 0.00 O ATOM 435 CB THR A 31 2.597 3.435 -10.192 1.00 0.00 C ATOM 436 OG1 THR A 31 2.250 2.099 -10.528 1.00 0.00 O ATOM 437 CG2 THR A 31 2.765 4.257 -11.470 1.00 0.00 C ATOM 0 H THR A 31 5.207 5.013 -10.025 1.00 0.00 H new ATOM 0 HA THR A 31 3.725 3.085 -8.390 1.00 0.00 H new ATOM 0 HB THR A 31 1.807 3.873 -9.582 1.00 0.00 H new ATOM 0 HG1 THR A 31 1.409 2.096 -11.030 1.00 0.00 H new ATOM 0 HG21 THR A 31 1.830 4.255 -12.030 1.00 0.00 H new ATOM 0 HG22 THR A 31 3.031 5.282 -11.211 1.00 0.00 H new ATOM 0 HG23 THR A 31 3.555 3.821 -12.082 1.00 0.00 H new ATOM 445 N SER A 32 4.669 1.229 -10.060 1.00 0.00 N ATOM 446 CA SER A 32 5.609 0.269 -10.703 1.00 0.00 C ATOM 447 C SER A 32 5.059 -1.148 -10.553 1.00 0.00 C ATOM 448 O SER A 32 5.448 -1.886 -9.668 1.00 0.00 O ATOM 449 CB SER A 32 6.974 0.358 -10.024 1.00 0.00 C ATOM 450 OG SER A 32 7.900 0.978 -10.906 1.00 0.00 O ATOM 0 H SER A 32 3.853 0.806 -9.618 1.00 0.00 H new ATOM 0 HA SER A 32 5.715 0.513 -11.760 1.00 0.00 H new ATOM 0 HB2 SER A 32 6.896 0.930 -9.100 1.00 0.00 H new ATOM 0 HB3 SER A 32 7.324 -0.638 -9.753 1.00 0.00 H new ATOM 0 HG SER A 32 7.576 1.872 -11.145 1.00 0.00 H new ATOM 456 N ALA A 33 4.154 -1.533 -11.407 1.00 0.00 N ATOM 457 CA ALA A 33 3.573 -2.901 -11.312 1.00 0.00 C ATOM 458 C ALA A 33 2.966 -3.295 -12.661 1.00 0.00 C ATOM 459 O ALA A 33 3.473 -4.156 -13.351 1.00 0.00 O ATOM 460 CB ALA A 33 2.482 -2.914 -10.237 1.00 0.00 C ATOM 0 H ALA A 33 3.791 -0.959 -12.168 1.00 0.00 H new ATOM 0 HA ALA A 33 4.356 -3.612 -11.047 1.00 0.00 H new ATOM 0 HB1 ALA A 33 2.054 -3.914 -10.165 1.00 0.00 H new ATOM 0 HB2 ALA A 33 2.914 -2.634 -9.276 1.00 0.00 H new ATOM 0 HB3 ALA A 33 1.700 -2.203 -10.504 1.00 0.00 H new ATOM 466 N GLY A 34 1.885 -2.671 -13.042 1.00 0.00 N ATOM 467 CA GLY A 34 1.249 -3.012 -14.346 1.00 0.00 C ATOM 468 C GLY A 34 -0.141 -2.377 -14.424 1.00 0.00 C ATOM 469 O GLY A 34 -0.562 -1.913 -15.465 1.00 0.00 O ATOM 0 H GLY A 34 1.415 -1.940 -12.507 1.00 0.00 H new ATOM 0 HA2 GLY A 34 1.869 -2.655 -15.168 1.00 0.00 H new ATOM 0 HA3 GLY A 34 1.171 -4.094 -14.452 1.00 0.00 H new ATOM 473 N PHE A 35 -0.855 -2.350 -13.332 1.00 0.00 N ATOM 474 CA PHE A 35 -2.216 -1.742 -13.349 1.00 0.00 C ATOM 475 C PHE A 35 -2.137 -0.300 -12.844 1.00 0.00 C ATOM 476 O PHE A 35 -1.195 0.084 -12.181 1.00 0.00 O ATOM 477 CB PHE A 35 -3.149 -2.550 -12.443 1.00 0.00 C ATOM 478 CG PHE A 35 -2.693 -2.422 -11.010 1.00 0.00 C ATOM 479 CD1 PHE A 35 -2.922 -1.232 -10.308 1.00 0.00 C ATOM 480 CD2 PHE A 35 -2.040 -3.490 -10.385 1.00 0.00 C ATOM 481 CE1 PHE A 35 -2.499 -1.112 -8.978 1.00 0.00 C ATOM 482 CE2 PHE A 35 -1.617 -3.370 -9.055 1.00 0.00 C ATOM 483 CZ PHE A 35 -1.847 -2.182 -8.352 1.00 0.00 C ATOM 0 H PHE A 35 -0.556 -2.722 -12.431 1.00 0.00 H new ATOM 0 HA PHE A 35 -2.604 -1.750 -14.368 1.00 0.00 H new ATOM 0 HB2 PHE A 35 -4.173 -2.190 -12.544 1.00 0.00 H new ATOM 0 HB3 PHE A 35 -3.148 -3.598 -12.744 1.00 0.00 H new ATOM 0 HD1 PHE A 35 -3.424 -0.407 -10.792 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -1.862 -4.407 -10.928 1.00 0.00 H new ATOM 0 HE1 PHE A 35 -2.676 -0.195 -8.436 1.00 0.00 H new ATOM 0 HE2 PHE A 35 -1.113 -4.194 -8.572 1.00 0.00 H new ATOM 0 HZ PHE A 35 -1.522 -2.090 -7.326 1.00 0.00 H new ATOM 493 N ALA A 36 -3.119 0.501 -13.151 1.00 0.00 N ATOM 494 CA ALA A 36 -3.097 1.917 -12.686 1.00 0.00 C ATOM 495 C ALA A 36 -4.190 2.123 -11.635 1.00 0.00 C ATOM 496 O ALA A 36 -4.784 1.179 -11.152 1.00 0.00 O ATOM 497 CB ALA A 36 -3.351 2.848 -13.874 1.00 0.00 C ATOM 0 H ALA A 36 -3.935 0.237 -13.703 1.00 0.00 H new ATOM 0 HA ALA A 36 -2.124 2.142 -12.250 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -3.335 3.884 -13.535 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -2.575 2.700 -14.625 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -4.325 2.624 -14.310 1.00 0.00 H new ATOM 503 N VAL A 37 -4.463 3.349 -11.279 1.00 0.00 N ATOM 504 CA VAL A 37 -5.520 3.612 -10.263 1.00 0.00 C ATOM 505 C VAL A 37 -6.282 4.883 -10.642 1.00 0.00 C ATOM 506 O VAL A 37 -5.847 5.984 -10.367 1.00 0.00 O ATOM 507 CB VAL A 37 -4.875 3.796 -8.887 1.00 0.00 C ATOM 508 CG1 VAL A 37 -5.964 3.816 -7.814 1.00 0.00 C ATOM 509 CG2 VAL A 37 -3.914 2.637 -8.615 1.00 0.00 C ATOM 0 H VAL A 37 -3.999 4.179 -11.648 1.00 0.00 H new ATOM 0 HA VAL A 37 -6.209 2.768 -10.229 1.00 0.00 H new ATOM 0 HB VAL A 37 -4.325 4.737 -8.866 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -5.506 3.947 -6.833 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -6.650 4.641 -8.007 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -6.513 2.875 -7.835 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -3.454 2.768 -7.635 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -4.464 1.696 -8.635 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -3.138 2.620 -9.380 1.00 0.00 H new ATOM 519 N THR A 38 -7.416 4.741 -11.272 1.00 0.00 N ATOM 520 CA THR A 38 -8.203 5.942 -11.670 1.00 0.00 C ATOM 521 C THR A 38 -8.622 6.716 -10.414 1.00 0.00 C ATOM 522 O THR A 38 -8.914 6.123 -9.395 1.00 0.00 O ATOM 523 CB THR A 38 -9.452 5.508 -12.442 1.00 0.00 C ATOM 524 OG1 THR A 38 -10.432 5.034 -11.528 1.00 0.00 O ATOM 525 CG2 THR A 38 -9.087 4.396 -13.427 1.00 0.00 C ATOM 0 H THR A 38 -7.831 3.845 -11.528 1.00 0.00 H new ATOM 0 HA THR A 38 -7.590 6.581 -12.306 1.00 0.00 H new ATOM 0 HB THR A 38 -9.852 6.359 -12.993 1.00 0.00 H new ATOM 0 HG1 THR A 38 -11.233 4.758 -12.021 1.00 0.00 H new ATOM 0 HG21 THR A 38 -9.978 4.089 -13.975 1.00 0.00 H new ATOM 0 HG22 THR A 38 -8.338 4.763 -14.128 1.00 0.00 H new ATOM 0 HG23 THR A 38 -8.685 3.543 -12.880 1.00 0.00 H new ATOM 533 N PRO A 39 -8.636 8.022 -10.526 1.00 0.00 N ATOM 534 CA PRO A 39 -9.015 8.903 -9.405 1.00 0.00 C ATOM 535 C PRO A 39 -10.459 8.629 -8.977 1.00 0.00 C ATOM 536 O PRO A 39 -11.392 8.860 -9.721 1.00 0.00 O ATOM 537 CB PRO A 39 -8.876 10.327 -9.961 1.00 0.00 C ATOM 538 CG PRO A 39 -8.419 10.215 -11.438 1.00 0.00 C ATOM 539 CD PRO A 39 -8.275 8.723 -11.771 1.00 0.00 C ATOM 0 HA PRO A 39 -8.392 8.745 -8.525 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -9.826 10.858 -9.894 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -8.151 10.896 -9.379 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -9.146 10.686 -12.100 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -7.471 10.733 -11.585 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -8.933 8.436 -12.591 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -7.257 8.483 -12.079 1.00 0.00 H new ATOM 547 N ALA A 40 -10.649 8.142 -7.781 1.00 0.00 N ATOM 548 CA ALA A 40 -12.030 7.857 -7.302 1.00 0.00 C ATOM 549 C ALA A 40 -11.963 7.178 -5.934 1.00 0.00 C ATOM 550 O ALA A 40 -12.197 7.792 -4.911 1.00 0.00 O ATOM 551 CB ALA A 40 -12.736 6.930 -8.294 1.00 0.00 C ATOM 0 H ALA A 40 -9.906 7.929 -7.115 1.00 0.00 H new ATOM 0 HA ALA A 40 -12.585 8.792 -7.220 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -13.747 6.722 -7.942 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -12.784 7.411 -9.271 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -12.181 5.995 -8.377 1.00 0.00 H new ATOM 557 N GLN A 41 -11.647 5.913 -5.907 1.00 0.00 N ATOM 558 CA GLN A 41 -11.566 5.194 -4.605 1.00 0.00 C ATOM 559 C GLN A 41 -10.385 5.734 -3.795 1.00 0.00 C ATOM 560 O GLN A 41 -10.246 5.455 -2.621 1.00 0.00 O ATOM 561 CB GLN A 41 -11.373 3.698 -4.860 1.00 0.00 C ATOM 562 CG GLN A 41 -12.670 2.952 -4.539 1.00 0.00 C ATOM 563 CD GLN A 41 -13.028 2.027 -5.704 1.00 0.00 C ATOM 564 OE1 GLN A 41 -12.290 1.926 -6.663 1.00 0.00 O ATOM 565 NE2 GLN A 41 -14.138 1.341 -5.661 1.00 0.00 N ATOM 0 H GLN A 41 -11.441 5.346 -6.730 1.00 0.00 H new ATOM 0 HA GLN A 41 -12.488 5.350 -4.046 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -11.092 3.529 -5.900 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -10.559 3.316 -4.244 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -12.552 2.372 -3.624 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -13.477 3.663 -4.364 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -14.759 1.425 -4.856 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -14.385 0.721 -6.432 1.00 0.00 H new ATOM 574 N GLY A 42 -9.532 6.510 -4.411 1.00 0.00 N ATOM 575 CA GLY A 42 -8.365 7.069 -3.669 1.00 0.00 C ATOM 576 C GLY A 42 -8.875 7.883 -2.480 1.00 0.00 C ATOM 577 O GLY A 42 -8.364 7.785 -1.379 1.00 0.00 O ATOM 0 H GLY A 42 -9.593 6.780 -5.393 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -7.717 6.263 -3.324 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -7.767 7.699 -4.327 1.00 0.00 H new ATOM 581 N GLN A 43 -9.887 8.680 -2.689 1.00 0.00 N ATOM 582 CA GLN A 43 -10.435 9.491 -1.567 1.00 0.00 C ATOM 583 C GLN A 43 -10.921 8.549 -0.465 1.00 0.00 C ATOM 584 O GLN A 43 -10.833 8.854 0.708 1.00 0.00 O ATOM 585 CB GLN A 43 -11.608 10.340 -2.067 1.00 0.00 C ATOM 586 CG GLN A 43 -11.915 11.433 -1.041 1.00 0.00 C ATOM 587 CD GLN A 43 -13.288 11.181 -0.416 1.00 0.00 C ATOM 588 OE1 GLN A 43 -13.503 10.168 0.219 1.00 0.00 O ATOM 589 NE2 GLN A 43 -14.234 12.068 -0.568 1.00 0.00 N ATOM 0 H GLN A 43 -10.356 8.804 -3.586 1.00 0.00 H new ATOM 0 HA GLN A 43 -9.659 10.149 -1.177 1.00 0.00 H new ATOM 0 HB2 GLN A 43 -11.363 10.788 -3.030 1.00 0.00 H new ATOM 0 HB3 GLN A 43 -12.486 9.713 -2.221 1.00 0.00 H new ATOM 0 HG2 GLN A 43 -11.148 11.444 -0.266 1.00 0.00 H new ATOM 0 HG3 GLN A 43 -11.897 12.411 -1.521 1.00 0.00 H new ATOM 0 HE21 GLN A 43 -14.054 12.919 -1.101 1.00 0.00 H new ATOM 0 HE22 GLN A 43 -15.153 11.910 -0.154 1.00 0.00 H new ATOM 598 N THR A 44 -11.429 7.402 -0.832 1.00 0.00 N ATOM 599 CA THR A 44 -11.913 6.441 0.197 1.00 0.00 C ATOM 600 C THR A 44 -10.822 6.258 1.252 1.00 0.00 C ATOM 601 O THR A 44 -11.078 6.294 2.439 1.00 0.00 O ATOM 602 CB THR A 44 -12.222 5.096 -0.464 1.00 0.00 C ATOM 603 OG1 THR A 44 -13.071 5.306 -1.584 1.00 0.00 O ATOM 604 CG2 THR A 44 -12.917 4.178 0.543 1.00 0.00 C ATOM 0 H THR A 44 -11.529 7.091 -1.798 1.00 0.00 H new ATOM 0 HA THR A 44 -12.819 6.824 0.666 1.00 0.00 H new ATOM 0 HB THR A 44 -11.294 4.630 -0.794 1.00 0.00 H new ATOM 0 HG1 THR A 44 -13.269 4.446 -2.010 1.00 0.00 H new ATOM 0 HG21 THR A 44 -13.137 3.220 0.071 1.00 0.00 H new ATOM 0 HG22 THR A 44 -12.264 4.018 1.401 1.00 0.00 H new ATOM 0 HG23 THR A 44 -13.846 4.640 0.876 1.00 0.00 H new ATOM 612 N LEU A 45 -9.601 6.075 0.825 1.00 0.00 N ATOM 613 CA LEU A 45 -8.493 5.905 1.802 1.00 0.00 C ATOM 614 C LEU A 45 -8.494 7.101 2.752 1.00 0.00 C ATOM 615 O LEU A 45 -8.330 6.960 3.948 1.00 0.00 O ATOM 616 CB LEU A 45 -7.157 5.847 1.058 1.00 0.00 C ATOM 617 CG LEU A 45 -6.897 4.418 0.581 1.00 0.00 C ATOM 618 CD1 LEU A 45 -7.269 4.297 -0.898 1.00 0.00 C ATOM 619 CD2 LEU A 45 -5.415 4.084 0.762 1.00 0.00 C ATOM 0 H LEU A 45 -9.326 6.036 -0.156 1.00 0.00 H new ATOM 0 HA LEU A 45 -8.630 4.980 2.363 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -7.173 6.528 0.207 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -6.350 6.175 1.713 1.00 0.00 H new ATOM 0 HG LEU A 45 -7.502 3.724 1.165 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -7.083 3.278 -1.238 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -8.324 4.537 -1.029 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -6.665 4.990 -1.483 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -5.227 3.065 0.422 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -4.812 4.778 0.177 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -5.149 4.170 1.815 1.00 0.00 H new ATOM 631 N ALA A 46 -8.690 8.281 2.226 1.00 0.00 N ATOM 632 CA ALA A 46 -8.715 9.487 3.098 1.00 0.00 C ATOM 633 C ALA A 46 -9.793 9.303 4.165 1.00 0.00 C ATOM 634 O ALA A 46 -9.623 9.680 5.307 1.00 0.00 O ATOM 635 CB ALA A 46 -9.039 10.723 2.256 1.00 0.00 C ATOM 0 H ALA A 46 -8.833 8.460 1.232 1.00 0.00 H new ATOM 0 HA ALA A 46 -7.742 9.620 3.571 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -9.057 11.605 2.896 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -8.278 10.849 1.486 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -10.014 10.597 1.785 1.00 0.00 H new ATOM 641 N SER A 47 -10.899 8.718 3.798 1.00 0.00 N ATOM 642 CA SER A 47 -11.990 8.498 4.787 1.00 0.00 C ATOM 643 C SER A 47 -11.558 7.414 5.775 1.00 0.00 C ATOM 644 O SER A 47 -11.999 7.378 6.905 1.00 0.00 O ATOM 645 CB SER A 47 -13.256 8.053 4.057 1.00 0.00 C ATOM 646 OG SER A 47 -14.096 9.180 3.843 1.00 0.00 O ATOM 0 H SER A 47 -11.094 8.383 2.855 1.00 0.00 H new ATOM 0 HA SER A 47 -12.193 9.424 5.326 1.00 0.00 H new ATOM 0 HB2 SER A 47 -12.997 7.592 3.104 1.00 0.00 H new ATOM 0 HB3 SER A 47 -13.782 7.299 4.643 1.00 0.00 H new ATOM 0 HG SER A 47 -14.908 8.898 3.373 1.00 0.00 H new ATOM 652 N ALA A 48 -10.693 6.530 5.354 1.00 0.00 N ATOM 653 CA ALA A 48 -10.225 5.449 6.268 1.00 0.00 C ATOM 654 C ALA A 48 -9.450 6.070 7.432 1.00 0.00 C ATOM 655 O ALA A 48 -9.284 5.465 8.473 1.00 0.00 O ATOM 656 CB ALA A 48 -9.313 4.491 5.498 1.00 0.00 C ATOM 0 H ALA A 48 -10.291 6.510 4.417 1.00 0.00 H new ATOM 0 HA ALA A 48 -11.083 4.899 6.655 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -8.970 3.700 6.165 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -9.865 4.051 4.668 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -8.453 5.038 5.112 1.00 0.00 H new ATOM 662 N PHE A 49 -8.974 7.275 7.264 1.00 0.00 N ATOM 663 CA PHE A 49 -8.212 7.937 8.362 1.00 0.00 C ATOM 664 C PHE A 49 -9.101 8.043 9.605 1.00 0.00 C ATOM 665 O PHE A 49 -8.632 8.306 10.695 1.00 0.00 O ATOM 666 CB PHE A 49 -7.793 9.343 7.921 1.00 0.00 C ATOM 667 CG PHE A 49 -6.487 9.276 7.165 1.00 0.00 C ATOM 668 CD1 PHE A 49 -6.487 9.029 5.788 1.00 0.00 C ATOM 669 CD2 PHE A 49 -5.275 9.469 7.841 1.00 0.00 C ATOM 670 CE1 PHE A 49 -5.278 8.975 5.084 1.00 0.00 C ATOM 671 CE2 PHE A 49 -4.065 9.414 7.138 1.00 0.00 C ATOM 672 CZ PHE A 49 -4.067 9.166 5.760 1.00 0.00 C ATOM 0 H PHE A 49 -9.080 7.829 6.414 1.00 0.00 H new ATOM 0 HA PHE A 49 -7.325 7.348 8.593 1.00 0.00 H new ATOM 0 HB2 PHE A 49 -8.566 9.781 7.290 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -7.687 9.990 8.792 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -7.421 8.880 5.267 1.00 0.00 H new ATOM 0 HD2 PHE A 49 -5.274 9.660 8.904 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -5.280 8.786 4.021 1.00 0.00 H new ATOM 0 HE2 PHE A 49 -3.131 9.563 7.659 1.00 0.00 H new ATOM 0 HZ PHE A 49 -3.134 9.122 5.218 1.00 0.00 H new ATOM 682 N ASN A 50 -10.383 7.844 9.450 1.00 0.00 N ATOM 683 CA ASN A 50 -11.301 7.938 10.621 1.00 0.00 C ATOM 684 C ASN A 50 -11.232 6.644 11.435 1.00 0.00 C ATOM 685 O ASN A 50 -10.749 6.629 12.550 1.00 0.00 O ATOM 686 CB ASN A 50 -12.733 8.158 10.128 1.00 0.00 C ATOM 687 CG ASN A 50 -12.800 9.451 9.313 1.00 0.00 C ATOM 688 OD1 ASN A 50 -12.199 10.444 9.676 1.00 0.00 O ATOM 689 ND2 ASN A 50 -13.509 9.482 8.218 1.00 0.00 N ATOM 0 H ASN A 50 -10.834 7.620 8.563 1.00 0.00 H new ATOM 0 HA ASN A 50 -11.000 8.775 11.251 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -13.052 7.314 9.517 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -13.416 8.214 10.976 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -13.559 10.339 7.667 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -14.013 8.649 7.913 1.00 0.00 H new ATOM 696 N ASN A 51 -11.709 5.558 10.892 1.00 0.00 N ATOM 697 CA ASN A 51 -11.664 4.275 11.648 1.00 0.00 C ATOM 698 C ASN A 51 -11.507 3.105 10.677 1.00 0.00 C ATOM 699 O ASN A 51 -11.756 1.968 11.021 1.00 0.00 O ATOM 700 CB ASN A 51 -12.952 4.098 12.464 1.00 0.00 C ATOM 701 CG ASN A 51 -14.078 4.940 11.856 1.00 0.00 C ATOM 702 OD1 ASN A 51 -14.513 4.687 10.750 1.00 0.00 O ATOM 703 ND2 ASN A 51 -14.571 5.937 12.539 1.00 0.00 N ATOM 0 H ASN A 51 -12.126 5.503 9.963 1.00 0.00 H new ATOM 0 HA ASN A 51 -10.812 4.297 12.327 1.00 0.00 H new ATOM 0 HB2 ASN A 51 -13.241 3.047 12.480 1.00 0.00 H new ATOM 0 HB3 ASN A 51 -12.781 4.397 13.498 1.00 0.00 H new ATOM 0 HD21 ASN A 51 -15.322 6.504 12.144 1.00 0.00 H new ATOM 0 HD22 ASN A 51 -14.206 6.149 13.467 1.00 0.00 H new ATOM 710 N ALA A 52 -11.083 3.384 9.473 1.00 0.00 N ATOM 711 CA ALA A 52 -10.891 2.302 8.459 1.00 0.00 C ATOM 712 C ALA A 52 -11.975 1.233 8.623 1.00 0.00 C ATOM 713 O ALA A 52 -11.749 0.063 8.383 1.00 0.00 O ATOM 714 CB ALA A 52 -9.516 1.661 8.655 1.00 0.00 C ATOM 0 H ALA A 52 -10.859 4.323 9.144 1.00 0.00 H new ATOM 0 HA ALA A 52 -10.959 2.732 7.460 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -9.374 0.872 7.917 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -8.741 2.417 8.531 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -9.452 1.236 9.657 1.00 0.00 H new ATOM 720 N ASP A 53 -13.146 1.625 9.037 1.00 0.00 N ATOM 721 CA ASP A 53 -14.242 0.635 9.226 1.00 0.00 C ATOM 722 C ASP A 53 -14.747 0.106 7.872 1.00 0.00 C ATOM 723 O ASP A 53 -14.967 -1.081 7.734 1.00 0.00 O ATOM 724 CB ASP A 53 -15.397 1.286 9.992 1.00 0.00 C ATOM 725 CG ASP A 53 -16.488 0.245 10.249 1.00 0.00 C ATOM 726 OD1 ASP A 53 -16.203 -0.726 10.931 1.00 0.00 O ATOM 727 OD2 ASP A 53 -17.589 0.438 9.760 1.00 0.00 O ATOM 0 H ASP A 53 -13.393 2.591 9.253 1.00 0.00 H new ATOM 0 HA ASP A 53 -13.851 -0.207 9.797 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -15.037 1.693 10.937 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -15.803 2.120 9.420 1.00 0.00 H new ATOM 732 N PRO A 54 -14.935 0.985 6.911 1.00 0.00 N ATOM 733 CA PRO A 54 -15.432 0.577 5.583 1.00 0.00 C ATOM 734 C PRO A 54 -14.456 -0.396 4.912 1.00 0.00 C ATOM 735 O PRO A 54 -14.770 -1.003 3.907 1.00 0.00 O ATOM 736 CB PRO A 54 -15.537 1.881 4.781 1.00 0.00 C ATOM 737 CG PRO A 54 -15.124 3.044 5.717 1.00 0.00 C ATOM 738 CD PRO A 54 -14.675 2.432 7.053 1.00 0.00 C ATOM 0 HA PRO A 54 -16.388 0.058 5.647 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -14.888 1.845 3.906 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -16.554 2.026 4.417 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -14.316 3.625 5.272 1.00 0.00 H new ATOM 0 HG3 PRO A 54 -15.960 3.726 5.871 1.00 0.00 H new ATOM 0 HD2 PRO A 54 -13.620 2.628 7.243 1.00 0.00 H new ATOM 0 HD3 PRO A 54 -15.233 2.854 7.889 1.00 0.00 H new ATOM 746 N ILE A 55 -13.279 -0.554 5.454 1.00 0.00 N ATOM 747 CA ILE A 55 -12.299 -1.495 4.832 1.00 0.00 C ATOM 748 C ILE A 55 -12.183 -2.756 5.691 1.00 0.00 C ATOM 749 O ILE A 55 -11.938 -3.837 5.192 1.00 0.00 O ATOM 750 CB ILE A 55 -10.914 -0.838 4.712 1.00 0.00 C ATOM 751 CG1 ILE A 55 -10.918 0.552 5.359 1.00 0.00 C ATOM 752 CG2 ILE A 55 -10.549 -0.700 3.234 1.00 0.00 C ATOM 753 CD1 ILE A 55 -9.500 1.125 5.336 1.00 0.00 C ATOM 0 H ILE A 55 -12.953 -0.077 6.295 1.00 0.00 H new ATOM 0 HA ILE A 55 -12.655 -1.753 3.835 1.00 0.00 H new ATOM 0 HB ILE A 55 -10.184 -1.464 5.225 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -11.598 1.213 4.823 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -11.280 0.487 6.385 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -9.568 -0.235 3.144 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -10.527 -1.687 2.771 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -11.292 -0.080 2.732 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -9.500 2.113 5.795 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -8.832 0.466 5.891 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -9.156 1.204 4.305 1.00 0.00 H new ATOM 765 N ARG A 56 -12.355 -2.629 6.977 1.00 0.00 N ATOM 766 CA ARG A 56 -12.253 -3.822 7.862 1.00 0.00 C ATOM 767 C ARG A 56 -13.631 -4.472 8.004 1.00 0.00 C ATOM 768 O ARG A 56 -13.884 -5.216 8.932 1.00 0.00 O ATOM 769 CB ARG A 56 -11.754 -3.389 9.241 1.00 0.00 C ATOM 770 CG ARG A 56 -12.714 -2.354 9.826 1.00 0.00 C ATOM 771 CD ARG A 56 -13.177 -2.815 11.209 1.00 0.00 C ATOM 772 NE ARG A 56 -12.094 -2.570 12.202 1.00 0.00 N ATOM 773 CZ ARG A 56 -12.355 -2.611 13.481 1.00 0.00 C ATOM 774 NH1 ARG A 56 -13.565 -2.876 13.897 1.00 0.00 N ATOM 775 NH2 ARG A 56 -11.405 -2.389 14.346 1.00 0.00 N ATOM 0 H ARG A 56 -12.562 -1.751 7.453 1.00 0.00 H new ATOM 0 HA ARG A 56 -11.555 -4.538 7.428 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -11.685 -4.252 9.903 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -10.752 -2.968 9.162 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -12.220 -1.385 9.900 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -13.573 -2.225 9.167 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -14.080 -2.278 11.500 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -13.430 -3.875 11.185 1.00 0.00 H new ATOM 0 HE ARG A 56 -11.146 -2.370 11.882 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -14.309 -3.052 13.222 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -13.765 -2.907 14.897 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -10.459 -2.184 14.023 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -11.607 -2.421 15.345 1.00 0.00 H new ATOM 789 N ALA A 57 -14.523 -4.196 7.094 1.00 0.00 N ATOM 790 CA ALA A 57 -15.884 -4.797 7.180 1.00 0.00 C ATOM 791 C ALA A 57 -16.142 -5.659 5.943 1.00 0.00 C ATOM 792 O ALA A 57 -17.222 -6.182 5.756 1.00 0.00 O ATOM 793 CB ALA A 57 -16.928 -3.680 7.249 1.00 0.00 C ATOM 0 H ALA A 57 -14.369 -3.581 6.295 1.00 0.00 H new ATOM 0 HA ALA A 57 -15.952 -5.417 8.074 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -17.925 -4.117 7.312 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -16.745 -3.065 8.130 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -16.859 -3.062 6.354 1.00 0.00 H new ATOM 799 N SER A 58 -15.161 -5.811 5.095 1.00 0.00 N ATOM 800 CA SER A 58 -15.357 -6.637 3.871 1.00 0.00 C ATOM 801 C SER A 58 -14.134 -6.503 2.963 1.00 0.00 C ATOM 802 O SER A 58 -13.510 -7.478 2.596 1.00 0.00 O ATOM 803 CB SER A 58 -16.600 -6.149 3.124 1.00 0.00 C ATOM 804 OG SER A 58 -17.721 -6.926 3.520 1.00 0.00 O ATOM 0 H SER A 58 -14.234 -5.399 5.197 1.00 0.00 H new ATOM 0 HA SER A 58 -15.486 -7.682 4.154 1.00 0.00 H new ATOM 0 HB2 SER A 58 -16.778 -5.096 3.341 1.00 0.00 H new ATOM 0 HB3 SER A 58 -16.448 -6.232 2.048 1.00 0.00 H new ATOM 0 HG SER A 58 -17.898 -6.782 4.473 1.00 0.00 H new ATOM 810 N GLY A 59 -13.789 -5.299 2.598 1.00 0.00 N ATOM 811 CA GLY A 59 -12.608 -5.096 1.713 1.00 0.00 C ATOM 812 C GLY A 59 -12.771 -3.785 0.943 1.00 0.00 C ATOM 813 O GLY A 59 -13.683 -3.020 1.188 1.00 0.00 O ATOM 0 H GLY A 59 -14.275 -4.446 2.875 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -11.694 -5.071 2.307 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -12.513 -5.930 1.018 1.00 0.00 H new ATOM 817 N PHE A 60 -11.896 -3.518 0.014 1.00 0.00 N ATOM 818 CA PHE A 60 -12.008 -2.258 -0.771 1.00 0.00 C ATOM 819 C PHE A 60 -11.858 -2.572 -2.260 1.00 0.00 C ATOM 820 O PHE A 60 -11.510 -3.672 -2.639 1.00 0.00 O ATOM 821 CB PHE A 60 -10.908 -1.284 -0.337 1.00 0.00 C ATOM 822 CG PHE A 60 -9.572 -1.757 -0.863 1.00 0.00 C ATOM 823 CD1 PHE A 60 -9.147 -1.370 -2.140 1.00 0.00 C ATOM 824 CD2 PHE A 60 -8.760 -2.580 -0.075 1.00 0.00 C ATOM 825 CE1 PHE A 60 -7.909 -1.807 -2.627 1.00 0.00 C ATOM 826 CE2 PHE A 60 -7.522 -3.016 -0.562 1.00 0.00 C ATOM 827 CZ PHE A 60 -7.097 -2.630 -1.838 1.00 0.00 C ATOM 0 H PHE A 60 -11.109 -4.117 -0.235 1.00 0.00 H new ATOM 0 HA PHE A 60 -12.982 -1.803 -0.593 1.00 0.00 H new ATOM 0 HB2 PHE A 60 -11.125 -0.284 -0.714 1.00 0.00 H new ATOM 0 HB3 PHE A 60 -10.878 -1.215 0.750 1.00 0.00 H new ATOM 0 HD1 PHE A 60 -9.774 -0.735 -2.749 1.00 0.00 H new ATOM 0 HD2 PHE A 60 -9.088 -2.879 0.909 1.00 0.00 H new ATOM 0 HE1 PHE A 60 -7.581 -1.509 -3.612 1.00 0.00 H new ATOM 0 HE2 PHE A 60 -6.895 -3.650 0.047 1.00 0.00 H new ATOM 0 HZ PHE A 60 -6.142 -2.967 -2.214 1.00 0.00 H new ATOM 837 N ASP A 61 -12.119 -1.616 -3.108 1.00 0.00 N ATOM 838 CA ASP A 61 -11.991 -1.867 -4.571 1.00 0.00 C ATOM 839 C ASP A 61 -10.998 -0.874 -5.176 1.00 0.00 C ATOM 840 O ASP A 61 -11.013 0.303 -4.870 1.00 0.00 O ATOM 841 CB ASP A 61 -13.357 -1.689 -5.241 1.00 0.00 C ATOM 842 CG ASP A 61 -13.702 -2.940 -6.055 1.00 0.00 C ATOM 843 OD1 ASP A 61 -12.919 -3.875 -6.034 1.00 0.00 O ATOM 844 OD2 ASP A 61 -14.745 -2.939 -6.688 1.00 0.00 O ATOM 0 H ASP A 61 -12.415 -0.674 -2.852 1.00 0.00 H new ATOM 0 HA ASP A 61 -11.634 -2.884 -4.733 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -14.123 -1.513 -4.486 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -13.343 -0.814 -5.890 1.00 0.00 H new ATOM 849 N LEU A 62 -10.136 -1.338 -6.037 1.00 0.00 N ATOM 850 CA LEU A 62 -9.145 -0.425 -6.668 1.00 0.00 C ATOM 851 C LEU A 62 -9.592 -0.120 -8.099 1.00 0.00 C ATOM 852 O LEU A 62 -10.738 -0.310 -8.453 1.00 0.00 O ATOM 853 CB LEU A 62 -7.773 -1.099 -6.690 1.00 0.00 C ATOM 854 CG LEU A 62 -6.804 -0.316 -5.801 1.00 0.00 C ATOM 855 CD1 LEU A 62 -5.592 -1.189 -5.471 1.00 0.00 C ATOM 856 CD2 LEU A 62 -6.340 0.941 -6.538 1.00 0.00 C ATOM 0 H LEU A 62 -10.076 -2.313 -6.331 1.00 0.00 H new ATOM 0 HA LEU A 62 -9.079 0.502 -6.098 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -7.856 -2.127 -6.338 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -7.393 -1.141 -7.711 1.00 0.00 H new ATOM 0 HG LEU A 62 -7.308 -0.032 -4.877 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -4.903 -0.630 -4.838 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -5.922 -2.085 -4.946 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -5.087 -1.474 -6.394 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -5.650 1.500 -5.906 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -5.836 0.656 -7.462 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -7.203 1.565 -6.773 1.00 0.00 H new ATOM 868 N ALA A 63 -8.700 0.347 -8.927 1.00 0.00 N ATOM 869 CA ALA A 63 -9.085 0.657 -10.332 1.00 0.00 C ATOM 870 C ALA A 63 -9.902 -0.506 -10.900 1.00 0.00 C ATOM 871 O ALA A 63 -10.877 -0.313 -11.599 1.00 0.00 O ATOM 872 CB ALA A 63 -7.824 0.856 -11.176 1.00 0.00 C ATOM 0 H ALA A 63 -7.724 0.527 -8.693 1.00 0.00 H new ATOM 0 HA ALA A 63 -9.682 1.569 -10.355 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -8.106 1.083 -12.204 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -7.241 1.682 -10.769 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -7.226 -0.055 -11.157 1.00 0.00 H new ATOM 878 N GLY A 64 -9.510 -1.715 -10.600 1.00 0.00 N ATOM 879 CA GLY A 64 -10.260 -2.895 -11.116 1.00 0.00 C ATOM 880 C GLY A 64 -9.737 -4.160 -10.436 1.00 0.00 C ATOM 881 O GLY A 64 -9.692 -5.222 -11.025 1.00 0.00 O ATOM 0 H GLY A 64 -8.701 -1.936 -10.019 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -11.326 -2.777 -10.921 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -10.140 -2.973 -12.197 1.00 0.00 H new ATOM 885 N VAL A 65 -9.336 -4.053 -9.196 1.00 0.00 N ATOM 886 CA VAL A 65 -8.810 -5.247 -8.475 1.00 0.00 C ATOM 887 C VAL A 65 -9.488 -5.363 -7.108 1.00 0.00 C ATOM 888 O VAL A 65 -9.674 -4.384 -6.412 1.00 0.00 O ATOM 889 CB VAL A 65 -7.300 -5.097 -8.280 1.00 0.00 C ATOM 890 CG1 VAL A 65 -6.671 -6.476 -8.068 1.00 0.00 C ATOM 891 CG2 VAL A 65 -6.689 -4.441 -9.521 1.00 0.00 C ATOM 0 H VAL A 65 -9.351 -3.190 -8.653 1.00 0.00 H new ATOM 0 HA VAL A 65 -9.018 -6.143 -9.060 1.00 0.00 H new ATOM 0 HB VAL A 65 -7.107 -4.474 -7.407 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -5.595 -6.368 -7.929 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -7.106 -6.942 -7.184 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -6.863 -7.102 -8.940 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -5.613 -4.334 -9.383 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -6.883 -5.064 -10.394 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -7.136 -3.458 -9.670 1.00 0.00 H new ATOM 901 N HIS A 66 -9.855 -6.553 -6.715 1.00 0.00 N ATOM 902 CA HIS A 66 -10.515 -6.732 -5.390 1.00 0.00 C ATOM 903 C HIS A 66 -9.467 -7.137 -4.351 1.00 0.00 C ATOM 904 O HIS A 66 -8.556 -7.889 -4.636 1.00 0.00 O ATOM 905 CB HIS A 66 -11.577 -7.830 -5.491 1.00 0.00 C ATOM 906 CG HIS A 66 -12.556 -7.492 -6.582 1.00 0.00 C ATOM 907 ND1 HIS A 66 -12.380 -7.092 -7.884 1.00 0.00 N flip ATOM 908 CD2 HIS A 66 -13.928 -7.553 -6.386 1.00 0.00 C flip ATOM 909 CE1 HIS A 66 -13.621 -6.908 -8.489 1.00 0.00 C flip ATOM 910 NE2 HIS A 66 -14.518 -7.199 -7.543 1.00 0.00 N flip ATOM 0 H HIS A 66 -9.726 -7.409 -7.254 1.00 0.00 H new ATOM 0 HA HIS A 66 -10.986 -5.796 -5.091 1.00 0.00 H new ATOM 0 HB2 HIS A 66 -11.103 -8.789 -5.699 1.00 0.00 H new ATOM 0 HB3 HIS A 66 -12.099 -7.932 -4.540 1.00 0.00 H new ATOM 0 HD2 HIS A 66 -14.431 -7.833 -5.472 1.00 0.00 H new ATOM 0 HE1 HIS A 66 -13.816 -6.597 -9.505 1.00 0.00 H new ATOM 0 HE2 HIS A 66 -15.528 -7.158 -7.681 1.00 0.00 H new ATOM 918 N TYR A 67 -9.587 -6.646 -3.149 1.00 0.00 N ATOM 919 CA TYR A 67 -8.596 -7.006 -2.094 1.00 0.00 C ATOM 920 C TYR A 67 -9.317 -7.177 -0.755 1.00 0.00 C ATOM 921 O TYR A 67 -10.433 -6.730 -0.579 1.00 0.00 O ATOM 922 CB TYR A 67 -7.554 -5.893 -1.971 1.00 0.00 C ATOM 923 CG TYR A 67 -6.483 -6.078 -3.020 1.00 0.00 C ATOM 924 CD1 TYR A 67 -5.742 -7.265 -3.064 1.00 0.00 C ATOM 925 CD2 TYR A 67 -6.231 -5.060 -3.948 1.00 0.00 C ATOM 926 CE1 TYR A 67 -4.747 -7.432 -4.036 1.00 0.00 C ATOM 927 CE2 TYR A 67 -5.237 -5.228 -4.920 1.00 0.00 C ATOM 928 CZ TYR A 67 -4.494 -6.415 -4.964 1.00 0.00 C ATOM 929 OH TYR A 67 -3.513 -6.581 -5.920 1.00 0.00 O ATOM 0 H TYR A 67 -10.328 -6.011 -2.851 1.00 0.00 H new ATOM 0 HA TYR A 67 -8.101 -7.939 -2.364 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -8.031 -4.920 -2.092 1.00 0.00 H new ATOM 0 HB3 TYR A 67 -7.108 -5.908 -0.976 1.00 0.00 H new ATOM 0 HD1 TYR A 67 -5.937 -8.051 -2.349 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -6.804 -4.145 -3.914 1.00 0.00 H new ATOM 0 HE1 TYR A 67 -4.174 -8.347 -4.069 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -5.043 -4.443 -5.636 1.00 0.00 H new ATOM 0 HH TYR A 67 -3.468 -5.781 -6.485 1.00 0.00 H new ATOM 939 N VAL A 68 -8.687 -7.820 0.192 1.00 0.00 N ATOM 940 CA VAL A 68 -9.336 -8.017 1.518 1.00 0.00 C ATOM 941 C VAL A 68 -8.459 -7.395 2.608 1.00 0.00 C ATOM 942 O VAL A 68 -7.251 -7.347 2.493 1.00 0.00 O ATOM 943 CB VAL A 68 -9.506 -9.513 1.788 1.00 0.00 C ATOM 944 CG1 VAL A 68 -10.327 -9.715 3.062 1.00 0.00 C ATOM 945 CG2 VAL A 68 -10.230 -10.165 0.607 1.00 0.00 C ATOM 0 H VAL A 68 -7.751 -8.217 0.103 1.00 0.00 H new ATOM 0 HA VAL A 68 -10.315 -7.538 1.520 1.00 0.00 H new ATOM 0 HB VAL A 68 -8.525 -9.971 1.913 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -10.447 -10.782 3.252 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -9.812 -9.252 3.904 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -11.308 -9.256 2.939 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -10.352 -11.231 0.798 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -11.210 -9.705 0.482 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -9.644 -10.024 -0.301 1.00 0.00 H new ATOM 955 N THR A 69 -9.057 -6.916 3.663 1.00 0.00 N ATOM 956 CA THR A 69 -8.257 -6.294 4.755 1.00 0.00 C ATOM 957 C THR A 69 -8.818 -6.731 6.111 1.00 0.00 C ATOM 958 O THR A 69 -9.837 -6.242 6.555 1.00 0.00 O ATOM 959 CB THR A 69 -8.339 -4.770 4.638 1.00 0.00 C ATOM 960 OG1 THR A 69 -8.457 -4.410 3.269 1.00 0.00 O ATOM 961 CG2 THR A 69 -7.078 -4.138 5.225 1.00 0.00 C ATOM 0 H THR A 69 -10.065 -6.928 3.816 1.00 0.00 H new ATOM 0 HA THR A 69 -7.218 -6.612 4.672 1.00 0.00 H new ATOM 0 HB THR A 69 -9.209 -4.411 5.188 1.00 0.00 H new ATOM 0 HG1 THR A 69 -8.511 -3.435 3.191 1.00 0.00 H new ATOM 0 HG21 THR A 69 -7.141 -3.053 5.139 1.00 0.00 H new ATOM 0 HG22 THR A 69 -6.988 -4.414 6.275 1.00 0.00 H new ATOM 0 HG23 THR A 69 -6.204 -4.495 4.679 1.00 0.00 H new ATOM 969 N LEU A 70 -8.162 -7.644 6.775 1.00 0.00 N ATOM 970 CA LEU A 70 -8.667 -8.102 8.100 1.00 0.00 C ATOM 971 C LEU A 70 -7.835 -7.463 9.216 1.00 0.00 C ATOM 972 O LEU A 70 -7.972 -7.800 10.376 1.00 0.00 O ATOM 973 CB LEU A 70 -8.590 -9.634 8.188 1.00 0.00 C ATOM 974 CG LEU A 70 -7.167 -10.088 8.536 1.00 0.00 C ATOM 975 CD1 LEU A 70 -7.184 -11.576 8.888 1.00 0.00 C ATOM 976 CD2 LEU A 70 -6.249 -9.863 7.334 1.00 0.00 C ATOM 0 H LEU A 70 -7.301 -8.091 6.458 1.00 0.00 H new ATOM 0 HA LEU A 70 -9.707 -7.798 8.215 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -9.287 -9.995 8.944 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -8.895 -10.073 7.238 1.00 0.00 H new ATOM 0 HG LEU A 70 -6.799 -9.513 9.386 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -6.174 -11.903 9.136 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -7.839 -11.740 9.744 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -7.551 -12.147 8.035 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -5.238 -10.186 7.583 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -6.615 -10.439 6.484 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -6.239 -8.804 7.077 1.00 0.00 H new ATOM 988 N ARG A 71 -6.978 -6.542 8.875 1.00 0.00 N ATOM 989 CA ARG A 71 -6.138 -5.878 9.910 1.00 0.00 C ATOM 990 C ARG A 71 -5.852 -4.441 9.473 1.00 0.00 C ATOM 991 O ARG A 71 -4.719 -4.005 9.439 1.00 0.00 O ATOM 992 CB ARG A 71 -4.818 -6.637 10.060 1.00 0.00 C ATOM 993 CG ARG A 71 -4.376 -7.160 8.693 1.00 0.00 C ATOM 994 CD ARG A 71 -2.873 -6.937 8.520 1.00 0.00 C ATOM 995 NE ARG A 71 -2.129 -7.771 9.507 1.00 0.00 N ATOM 996 CZ ARG A 71 -0.847 -7.971 9.360 1.00 0.00 C ATOM 997 NH1 ARG A 71 -0.212 -7.443 8.349 1.00 0.00 N ATOM 998 NH2 ARG A 71 -0.199 -8.701 10.226 1.00 0.00 N ATOM 0 H ARG A 71 -6.823 -6.219 7.920 1.00 0.00 H new ATOM 0 HA ARG A 71 -6.663 -5.876 10.865 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -4.053 -5.981 10.475 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -4.939 -7.466 10.757 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -4.609 -8.221 8.606 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -4.923 -6.647 7.902 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -2.570 -7.198 7.506 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -2.632 -5.884 8.663 1.00 0.00 H new ATOM 0 HE ARG A 71 -2.622 -8.186 10.298 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -0.717 -6.872 7.671 1.00 0.00 H new ATOM 0 HH12 ARG A 71 0.789 -7.601 8.237 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -0.694 -9.114 11.016 1.00 0.00 H new ATOM 0 HH22 ARG A 71 0.802 -8.858 10.113 1.00 0.00 H new ATOM 1012 N ALA A 72 -6.872 -3.704 9.128 1.00 0.00 N ATOM 1013 CA ALA A 72 -6.660 -2.298 8.682 1.00 0.00 C ATOM 1014 C ALA A 72 -6.840 -1.345 9.865 1.00 0.00 C ATOM 1015 O ALA A 72 -7.820 -1.405 10.582 1.00 0.00 O ATOM 1016 CB ALA A 72 -7.677 -1.953 7.592 1.00 0.00 C ATOM 0 H ALA A 72 -7.843 -4.015 9.136 1.00 0.00 H new ATOM 0 HA ALA A 72 -5.649 -2.194 8.288 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -7.524 -0.925 7.264 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -7.546 -2.627 6.746 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -8.686 -2.061 7.989 1.00 0.00 H new ATOM 1022 N ASP A 73 -5.903 -0.461 10.068 1.00 0.00 N ATOM 1023 CA ASP A 73 -6.015 0.506 11.198 1.00 0.00 C ATOM 1024 C ASP A 73 -5.334 1.819 10.801 1.00 0.00 C ATOM 1025 O ASP A 73 -4.939 2.003 9.668 1.00 0.00 O ATOM 1026 CB ASP A 73 -5.339 -0.072 12.445 1.00 0.00 C ATOM 1027 CG ASP A 73 -4.197 -1.003 12.030 1.00 0.00 C ATOM 1028 OD1 ASP A 73 -4.479 -2.143 11.699 1.00 0.00 O ATOM 1029 OD2 ASP A 73 -3.061 -0.561 12.052 1.00 0.00 O ATOM 0 H ASP A 73 -5.062 -0.366 9.499 1.00 0.00 H new ATOM 0 HA ASP A 73 -7.066 0.690 11.420 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -4.954 0.735 13.069 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -6.067 -0.619 13.044 1.00 0.00 H new ATOM 1034 N ASP A 74 -5.196 2.737 11.720 1.00 0.00 N ATOM 1035 CA ASP A 74 -4.543 4.034 11.379 1.00 0.00 C ATOM 1036 C ASP A 74 -3.026 3.909 11.552 1.00 0.00 C ATOM 1037 O ASP A 74 -2.369 4.815 12.026 1.00 0.00 O ATOM 1038 CB ASP A 74 -5.074 5.136 12.299 1.00 0.00 C ATOM 1039 CG ASP A 74 -6.324 5.763 11.675 1.00 0.00 C ATOM 1040 OD1 ASP A 74 -6.199 6.359 10.618 1.00 0.00 O ATOM 1041 OD2 ASP A 74 -7.383 5.637 12.267 1.00 0.00 O ATOM 0 H ASP A 74 -5.506 2.646 12.688 1.00 0.00 H new ATOM 0 HA ASP A 74 -4.769 4.288 10.343 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -5.312 4.723 13.279 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -4.309 5.898 12.451 1.00 0.00 H new ATOM 1046 N ARG A 75 -2.465 2.798 11.162 1.00 0.00 N ATOM 1047 CA ARG A 75 -0.991 2.616 11.293 1.00 0.00 C ATOM 1048 C ARG A 75 -0.486 1.786 10.112 1.00 0.00 C ATOM 1049 O ARG A 75 0.156 2.292 9.212 1.00 0.00 O ATOM 1050 CB ARG A 75 -0.670 1.892 12.602 1.00 0.00 C ATOM 1051 CG ARG A 75 0.845 1.893 12.820 1.00 0.00 C ATOM 1052 CD ARG A 75 1.301 3.297 13.216 1.00 0.00 C ATOM 1053 NE ARG A 75 2.586 3.216 13.982 1.00 0.00 N ATOM 1054 CZ ARG A 75 2.699 2.459 15.040 1.00 0.00 C ATOM 1055 NH1 ARG A 75 1.646 1.897 15.567 1.00 0.00 N ATOM 1056 NH2 ARG A 75 3.865 2.309 15.606 1.00 0.00 N ATOM 0 H ARG A 75 -2.965 2.006 10.757 1.00 0.00 H new ATOM 0 HA ARG A 75 -0.502 3.590 11.298 1.00 0.00 H new ATOM 0 HB2 ARG A 75 -1.170 2.385 13.436 1.00 0.00 H new ATOM 0 HB3 ARG A 75 -1.044 0.869 12.566 1.00 0.00 H new ATOM 0 HG2 ARG A 75 1.112 1.179 13.599 1.00 0.00 H new ATOM 0 HG3 ARG A 75 1.355 1.577 11.910 1.00 0.00 H new ATOM 0 HD2 ARG A 75 1.436 3.910 12.325 1.00 0.00 H new ATOM 0 HD3 ARG A 75 0.535 3.780 13.823 1.00 0.00 H new ATOM 0 HE ARG A 75 3.389 3.763 13.671 1.00 0.00 H new ATOM 0 HH11 ARG A 75 0.726 2.048 15.153 1.00 0.00 H new ATOM 0 HH12 ARG A 75 1.743 1.307 16.393 1.00 0.00 H new ATOM 0 HH21 ARG A 75 4.683 2.782 15.222 1.00 0.00 H new ATOM 0 HH22 ARG A 75 3.958 1.719 16.433 1.00 0.00 H new ATOM 1070 N SER A 76 -0.783 0.515 10.103 1.00 0.00 N ATOM 1071 CA SER A 76 -0.336 -0.353 8.976 1.00 0.00 C ATOM 1072 C SER A 76 -1.567 -0.827 8.203 1.00 0.00 C ATOM 1073 O SER A 76 -2.653 -0.902 8.744 1.00 0.00 O ATOM 1074 CB SER A 76 0.416 -1.563 9.531 1.00 0.00 C ATOM 1075 OG SER A 76 0.571 -1.413 10.935 1.00 0.00 O ATOM 0 H SER A 76 -1.317 0.039 10.830 1.00 0.00 H new ATOM 0 HA SER A 76 0.325 0.207 8.315 1.00 0.00 H new ATOM 0 HB2 SER A 76 -0.131 -2.479 9.309 1.00 0.00 H new ATOM 0 HB3 SER A 76 1.392 -1.651 9.053 1.00 0.00 H new ATOM 0 HG SER A 76 1.051 -2.187 11.296 1.00 0.00 H new ATOM 1081 N ILE A 77 -1.421 -1.142 6.945 1.00 0.00 N ATOM 1082 CA ILE A 77 -2.605 -1.599 6.164 1.00 0.00 C ATOM 1083 C ILE A 77 -2.160 -2.431 4.960 1.00 0.00 C ATOM 1084 O ILE A 77 -2.476 -2.115 3.831 1.00 0.00 O ATOM 1085 CB ILE A 77 -3.388 -0.382 5.672 1.00 0.00 C ATOM 1086 CG1 ILE A 77 -3.915 0.404 6.875 1.00 0.00 C ATOM 1087 CG2 ILE A 77 -4.564 -0.844 4.808 1.00 0.00 C ATOM 1088 CD1 ILE A 77 -4.774 1.570 6.386 1.00 0.00 C ATOM 0 H ILE A 77 -0.542 -1.103 6.428 1.00 0.00 H new ATOM 0 HA ILE A 77 -3.235 -2.214 6.807 1.00 0.00 H new ATOM 0 HB ILE A 77 -2.733 0.256 5.079 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -4.503 -0.249 7.520 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -3.083 0.777 7.472 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -5.122 0.025 4.458 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -4.188 -1.404 3.951 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -5.221 -1.483 5.399 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -5.149 2.130 7.243 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -4.172 2.227 5.759 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -5.614 1.186 5.808 1.00 0.00 H new ATOM 1100 N TYR A 78 -1.446 -3.501 5.183 1.00 0.00 N ATOM 1101 CA TYR A 78 -1.012 -4.344 4.034 1.00 0.00 C ATOM 1102 C TYR A 78 -2.026 -5.475 3.839 1.00 0.00 C ATOM 1103 O TYR A 78 -2.037 -6.445 4.570 1.00 0.00 O ATOM 1104 CB TYR A 78 0.374 -4.948 4.295 1.00 0.00 C ATOM 1105 CG TYR A 78 1.129 -4.143 5.331 1.00 0.00 C ATOM 1106 CD1 TYR A 78 0.953 -4.422 6.692 1.00 0.00 C ATOM 1107 CD2 TYR A 78 2.025 -3.138 4.934 1.00 0.00 C ATOM 1108 CE1 TYR A 78 1.665 -3.697 7.654 1.00 0.00 C ATOM 1109 CE2 TYR A 78 2.739 -2.418 5.897 1.00 0.00 C ATOM 1110 CZ TYR A 78 2.558 -2.696 7.257 1.00 0.00 C ATOM 1111 OH TYR A 78 3.267 -1.987 8.205 1.00 0.00 O ATOM 0 H TYR A 78 -1.147 -3.825 6.103 1.00 0.00 H new ATOM 0 HA TYR A 78 -0.957 -3.722 3.140 1.00 0.00 H new ATOM 0 HB2 TYR A 78 0.268 -5.978 4.636 1.00 0.00 H new ATOM 0 HB3 TYR A 78 0.943 -4.977 3.366 1.00 0.00 H new ATOM 0 HD1 TYR A 78 0.267 -5.197 6.999 1.00 0.00 H new ATOM 0 HD2 TYR A 78 2.163 -2.921 3.885 1.00 0.00 H new ATOM 0 HE1 TYR A 78 1.525 -3.910 8.703 1.00 0.00 H new ATOM 0 HE2 TYR A 78 3.431 -1.647 5.591 1.00 0.00 H new ATOM 0 HH TYR A 78 3.050 -1.034 8.131 1.00 0.00 H new ATOM 1121 N GLY A 79 -2.886 -5.354 2.862 1.00 0.00 N ATOM 1122 CA GLY A 79 -3.907 -6.418 2.627 1.00 0.00 C ATOM 1123 C GLY A 79 -3.253 -7.639 1.977 1.00 0.00 C ATOM 1124 O GLY A 79 -2.083 -7.629 1.647 1.00 0.00 O ATOM 0 H GLY A 79 -2.926 -4.565 2.217 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -4.370 -6.703 3.571 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -4.701 -6.036 1.985 1.00 0.00 H new ATOM 1128 N LYS A 80 -4.002 -8.692 1.791 1.00 0.00 N ATOM 1129 CA LYS A 80 -3.431 -9.918 1.162 1.00 0.00 C ATOM 1130 C LYS A 80 -4.537 -10.660 0.407 1.00 0.00 C ATOM 1131 O LYS A 80 -5.623 -10.855 0.917 1.00 0.00 O ATOM 1132 CB LYS A 80 -2.856 -10.829 2.249 1.00 0.00 C ATOM 1133 CG LYS A 80 -3.756 -10.780 3.486 1.00 0.00 C ATOM 1134 CD LYS A 80 -3.642 -12.096 4.259 1.00 0.00 C ATOM 1135 CE LYS A 80 -2.484 -12.005 5.255 1.00 0.00 C ATOM 1136 NZ LYS A 80 -1.907 -13.362 5.469 1.00 0.00 N ATOM 0 H LYS A 80 -4.987 -8.756 2.048 1.00 0.00 H new ATOM 0 HA LYS A 80 -2.639 -9.638 0.468 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -2.783 -11.852 1.880 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -1.846 -10.511 2.508 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -3.467 -9.946 4.125 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -4.791 -10.610 3.188 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -4.574 -12.302 4.786 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -3.477 -12.923 3.568 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -1.718 -11.327 4.878 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -2.835 -11.594 6.201 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -1.120 -13.302 6.146 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -2.640 -13.995 5.846 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -1.558 -13.737 4.564 1.00 0.00 H new ATOM 1150 N LYS A 81 -4.275 -11.075 -0.803 1.00 0.00 N ATOM 1151 CA LYS A 81 -5.319 -11.803 -1.579 1.00 0.00 C ATOM 1152 C LYS A 81 -4.749 -13.123 -2.101 1.00 0.00 C ATOM 1153 O LYS A 81 -4.535 -13.293 -3.284 1.00 0.00 O ATOM 1154 CB LYS A 81 -5.773 -10.939 -2.758 1.00 0.00 C ATOM 1155 CG LYS A 81 -7.235 -11.249 -3.085 1.00 0.00 C ATOM 1156 CD LYS A 81 -7.489 -11.006 -4.574 1.00 0.00 C ATOM 1157 CE LYS A 81 -7.354 -12.326 -5.336 1.00 0.00 C ATOM 1158 NZ LYS A 81 -6.839 -12.057 -6.709 1.00 0.00 N ATOM 0 H LYS A 81 -3.387 -10.942 -1.286 1.00 0.00 H new ATOM 0 HA LYS A 81 -6.170 -12.011 -0.931 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -5.660 -9.883 -2.513 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -5.146 -11.133 -3.628 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -7.464 -12.284 -2.831 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -7.894 -10.620 -2.486 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -8.485 -10.589 -4.721 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -6.778 -10.276 -4.961 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -6.676 -12.996 -4.807 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -8.320 -12.827 -5.390 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -6.747 -12.954 -7.227 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -7.501 -11.433 -7.212 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -5.909 -11.596 -6.647 1.00 0.00 H new ATOM 1172 N GLY A 82 -4.505 -14.060 -1.227 1.00 0.00 N ATOM 1173 CA GLY A 82 -3.952 -15.370 -1.675 1.00 0.00 C ATOM 1174 C GLY A 82 -2.727 -15.138 -2.558 1.00 0.00 C ATOM 1175 O GLY A 82 -1.733 -14.588 -2.127 1.00 0.00 O ATOM 0 H GLY A 82 -4.664 -13.976 -0.223 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -3.679 -15.975 -0.810 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -4.710 -15.926 -2.227 1.00 0.00 H new ATOM 1179 N SER A 83 -2.785 -15.557 -3.794 1.00 0.00 N ATOM 1180 CA SER A 83 -1.619 -15.362 -4.702 1.00 0.00 C ATOM 1181 C SER A 83 -1.076 -13.941 -4.539 1.00 0.00 C ATOM 1182 O SER A 83 -0.148 -13.703 -3.793 1.00 0.00 O ATOM 1183 CB SER A 83 -2.056 -15.583 -6.150 1.00 0.00 C ATOM 1184 OG SER A 83 -1.131 -14.948 -7.022 1.00 0.00 O ATOM 0 H SER A 83 -3.588 -16.025 -4.213 1.00 0.00 H new ATOM 0 HA SER A 83 -0.837 -16.078 -4.448 1.00 0.00 H new ATOM 0 HB2 SER A 83 -2.106 -16.650 -6.368 1.00 0.00 H new ATOM 0 HB3 SER A 83 -3.056 -15.179 -6.306 1.00 0.00 H new ATOM 0 HG SER A 83 -1.557 -14.172 -7.442 1.00 0.00 H new ATOM 1190 N ALA A 84 -1.647 -12.992 -5.230 1.00 0.00 N ATOM 1191 CA ALA A 84 -1.157 -11.589 -5.109 1.00 0.00 C ATOM 1192 C ALA A 84 -1.915 -10.876 -3.987 1.00 0.00 C ATOM 1193 O ALA A 84 -3.017 -11.249 -3.634 1.00 0.00 O ATOM 1194 CB ALA A 84 -1.389 -10.850 -6.428 1.00 0.00 C ATOM 0 H ALA A 84 -2.429 -13.127 -5.871 1.00 0.00 H new ATOM 0 HA ALA A 84 -0.092 -11.598 -4.879 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -1.030 -9.825 -6.338 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -0.848 -11.355 -7.228 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -2.454 -10.843 -6.659 1.00 0.00 H new ATOM 1200 N GLY A 85 -1.333 -9.853 -3.423 1.00 0.00 N ATOM 1201 CA GLY A 85 -2.019 -9.116 -2.325 1.00 0.00 C ATOM 1202 C GLY A 85 -1.620 -7.641 -2.376 1.00 0.00 C ATOM 1203 O GLY A 85 -0.845 -7.229 -3.217 1.00 0.00 O ATOM 0 H GLY A 85 -0.412 -9.496 -3.676 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -3.100 -9.215 -2.425 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -1.748 -9.544 -1.360 1.00 0.00 H new ATOM 1207 N VAL A 86 -2.141 -6.838 -1.490 1.00 0.00 N ATOM 1208 CA VAL A 86 -1.783 -5.392 -1.504 1.00 0.00 C ATOM 1209 C VAL A 86 -0.961 -5.045 -0.261 1.00 0.00 C ATOM 1210 O VAL A 86 -0.982 -5.746 0.733 1.00 0.00 O ATOM 1211 CB VAL A 86 -3.059 -4.549 -1.534 1.00 0.00 C ATOM 1212 CG1 VAL A 86 -3.910 -4.860 -0.302 1.00 0.00 C ATOM 1213 CG2 VAL A 86 -2.687 -3.066 -1.538 1.00 0.00 C ATOM 0 H VAL A 86 -2.796 -7.119 -0.760 1.00 0.00 H new ATOM 0 HA VAL A 86 -1.188 -5.179 -2.392 1.00 0.00 H new ATOM 0 HB VAL A 86 -3.628 -4.784 -2.433 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -4.818 -4.258 -0.326 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -4.175 -5.917 -0.300 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -3.344 -4.627 0.600 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -3.595 -2.463 -1.559 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -2.117 -2.831 -0.639 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -2.084 -2.845 -2.418 1.00 0.00 H new ATOM 1223 N ILE A 87 -0.232 -3.966 -0.318 1.00 0.00 N ATOM 1224 CA ILE A 87 0.608 -3.549 0.841 1.00 0.00 C ATOM 1225 C ILE A 87 0.554 -2.024 0.952 1.00 0.00 C ATOM 1226 O ILE A 87 1.269 -1.324 0.269 1.00 0.00 O ATOM 1227 CB ILE A 87 2.053 -3.997 0.596 1.00 0.00 C ATOM 1228 CG1 ILE A 87 2.069 -5.485 0.239 1.00 0.00 C ATOM 1229 CG2 ILE A 87 2.893 -3.766 1.851 1.00 0.00 C ATOM 1230 CD1 ILE A 87 1.766 -6.314 1.489 1.00 0.00 C ATOM 0 H ILE A 87 -0.181 -3.348 -1.127 1.00 0.00 H new ATOM 0 HA ILE A 87 0.241 -4.002 1.762 1.00 0.00 H new ATOM 0 HB ILE A 87 2.473 -3.416 -0.225 1.00 0.00 H new ATOM 0 HG12 ILE A 87 1.330 -5.692 -0.535 1.00 0.00 H new ATOM 0 HG13 ILE A 87 3.042 -5.762 -0.167 1.00 0.00 H new ATOM 0 HG21 ILE A 87 3.918 -4.087 1.667 1.00 0.00 H new ATOM 0 HG22 ILE A 87 2.885 -2.706 2.104 1.00 0.00 H new ATOM 0 HG23 ILE A 87 2.476 -4.340 2.679 1.00 0.00 H new ATOM 0 HD11 ILE A 87 1.777 -7.374 1.234 1.00 0.00 H new ATOM 0 HD12 ILE A 87 2.521 -6.115 2.249 1.00 0.00 H new ATOM 0 HD13 ILE A 87 0.783 -6.044 1.875 1.00 0.00 H new ATOM 1242 N THR A 88 -0.298 -1.494 1.787 1.00 0.00 N ATOM 1243 CA THR A 88 -0.382 -0.011 1.888 1.00 0.00 C ATOM 1244 C THR A 88 -0.163 0.449 3.329 1.00 0.00 C ATOM 1245 O THR A 88 -0.422 -0.269 4.275 1.00 0.00 O ATOM 1246 CB THR A 88 -1.759 0.458 1.408 1.00 0.00 C ATOM 1247 OG1 THR A 88 -2.735 0.142 2.391 1.00 0.00 O ATOM 1248 CG2 THR A 88 -2.111 -0.240 0.094 1.00 0.00 C ATOM 0 H THR A 88 -0.930 -2.015 2.395 1.00 0.00 H new ATOM 0 HA THR A 88 0.398 0.423 1.262 1.00 0.00 H new ATOM 0 HB THR A 88 -1.739 1.536 1.248 1.00 0.00 H new ATOM 0 HG1 THR A 88 -2.509 -0.713 2.813 1.00 0.00 H new ATOM 0 HG21 THR A 88 -3.091 0.096 -0.245 1.00 0.00 H new ATOM 0 HG22 THR A 88 -1.363 0.005 -0.660 1.00 0.00 H new ATOM 0 HG23 THR A 88 -2.130 -1.319 0.249 1.00 0.00 H new ATOM 1256 N VAL A 89 0.310 1.656 3.494 1.00 0.00 N ATOM 1257 CA VAL A 89 0.549 2.194 4.861 1.00 0.00 C ATOM 1258 C VAL A 89 0.369 3.714 4.842 1.00 0.00 C ATOM 1259 O VAL A 89 0.843 4.394 3.952 1.00 0.00 O ATOM 1260 CB VAL A 89 1.974 1.864 5.302 1.00 0.00 C ATOM 1261 CG1 VAL A 89 2.210 2.407 6.712 1.00 0.00 C ATOM 1262 CG2 VAL A 89 2.168 0.348 5.306 1.00 0.00 C ATOM 0 H VAL A 89 0.542 2.295 2.734 1.00 0.00 H new ATOM 0 HA VAL A 89 -0.160 1.744 5.556 1.00 0.00 H new ATOM 0 HB VAL A 89 2.682 2.321 4.611 1.00 0.00 H new ATOM 0 HG11 VAL A 89 3.227 2.172 7.027 1.00 0.00 H new ATOM 0 HG12 VAL A 89 2.071 3.488 6.714 1.00 0.00 H new ATOM 0 HG13 VAL A 89 1.501 1.949 7.402 1.00 0.00 H new ATOM 0 HG21 VAL A 89 3.185 0.112 5.621 1.00 0.00 H new ATOM 0 HG22 VAL A 89 1.459 -0.108 5.997 1.00 0.00 H new ATOM 0 HG23 VAL A 89 1.999 -0.043 4.303 1.00 0.00 H new ATOM 1272 N LYS A 90 -0.313 4.253 5.817 1.00 0.00 N ATOM 1273 CA LYS A 90 -0.522 5.728 5.854 1.00 0.00 C ATOM 1274 C LYS A 90 0.599 6.387 6.664 1.00 0.00 C ATOM 1275 O LYS A 90 1.147 5.802 7.576 1.00 0.00 O ATOM 1276 CB LYS A 90 -1.866 6.039 6.515 1.00 0.00 C ATOM 1277 CG LYS A 90 -2.976 5.268 5.800 1.00 0.00 C ATOM 1278 CD LYS A 90 -3.364 6.006 4.518 1.00 0.00 C ATOM 1279 CE LYS A 90 -4.876 6.227 4.493 1.00 0.00 C ATOM 1280 NZ LYS A 90 -5.565 4.926 4.265 1.00 0.00 N ATOM 0 H LYS A 90 -0.734 3.735 6.589 1.00 0.00 H new ATOM 0 HA LYS A 90 -0.515 6.116 4.835 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -1.838 5.763 7.569 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -2.066 7.110 6.471 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -2.639 4.259 5.564 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -3.844 5.169 6.452 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -2.845 6.963 4.466 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -3.056 5.429 3.646 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -5.206 6.665 5.435 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -5.138 6.932 3.704 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -6.301 5.045 3.540 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -4.874 4.219 3.943 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -6.001 4.604 5.152 1.00 0.00 H new ATOM 1294 N THR A 91 0.935 7.605 6.339 1.00 0.00 N ATOM 1295 CA THR A 91 2.010 8.311 7.090 1.00 0.00 C ATOM 1296 C THR A 91 1.630 9.783 7.234 1.00 0.00 C ATOM 1297 O THR A 91 0.511 10.172 6.962 1.00 0.00 O ATOM 1298 CB THR A 91 3.332 8.200 6.328 1.00 0.00 C ATOM 1299 OG1 THR A 91 3.164 8.714 5.015 1.00 0.00 O ATOM 1300 CG2 THR A 91 3.761 6.734 6.254 1.00 0.00 C ATOM 0 H THR A 91 0.510 8.143 5.584 1.00 0.00 H new ATOM 0 HA THR A 91 2.126 7.858 8.075 1.00 0.00 H new ATOM 0 HB THR A 91 4.100 8.773 6.848 1.00 0.00 H new ATOM 0 HG1 THR A 91 2.623 8.091 4.487 1.00 0.00 H new ATOM 0 HG21 THR A 91 4.703 6.657 5.711 1.00 0.00 H new ATOM 0 HG22 THR A 91 3.891 6.342 7.263 1.00 0.00 H new ATOM 0 HG23 THR A 91 2.995 6.157 5.736 1.00 0.00 H new ATOM 1308 N SER A 92 2.548 10.606 7.653 1.00 0.00 N ATOM 1309 CA SER A 92 2.228 12.051 7.804 1.00 0.00 C ATOM 1310 C SER A 92 1.514 12.541 6.541 1.00 0.00 C ATOM 1311 O SER A 92 0.758 13.491 6.573 1.00 0.00 O ATOM 1312 CB SER A 92 3.521 12.840 8.005 1.00 0.00 C ATOM 1313 OG SER A 92 3.828 12.892 9.392 1.00 0.00 O ATOM 0 H SER A 92 3.503 10.342 7.897 1.00 0.00 H new ATOM 0 HA SER A 92 1.581 12.198 8.669 1.00 0.00 H new ATOM 0 HB2 SER A 92 4.337 12.369 7.457 1.00 0.00 H new ATOM 0 HB3 SER A 92 3.411 13.849 7.607 1.00 0.00 H new ATOM 0 HG SER A 92 4.658 13.396 9.525 1.00 0.00 H new ATOM 1319 N LYS A 93 1.746 11.893 5.430 1.00 0.00 N ATOM 1320 CA LYS A 93 1.079 12.313 4.163 1.00 0.00 C ATOM 1321 C LYS A 93 1.555 11.416 3.018 1.00 0.00 C ATOM 1322 O LYS A 93 2.241 11.856 2.117 1.00 0.00 O ATOM 1323 CB LYS A 93 1.434 13.770 3.850 1.00 0.00 C ATOM 1324 CG LYS A 93 0.182 14.639 3.979 1.00 0.00 C ATOM 1325 CD LYS A 93 0.584 16.115 3.983 1.00 0.00 C ATOM 1326 CE LYS A 93 -0.233 16.867 5.035 1.00 0.00 C ATOM 1327 NZ LYS A 93 -0.142 18.332 4.781 1.00 0.00 N ATOM 0 H LYS A 93 2.369 11.090 5.345 1.00 0.00 H new ATOM 0 HA LYS A 93 -0.001 12.222 4.276 1.00 0.00 H new ATOM 0 HB2 LYS A 93 2.206 14.122 4.534 1.00 0.00 H new ATOM 0 HB3 LYS A 93 1.841 13.848 2.842 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -0.499 14.439 3.152 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -0.351 14.394 4.898 1.00 0.00 H new ATOM 0 HD2 LYS A 93 1.648 16.212 4.197 1.00 0.00 H new ATOM 0 HD3 LYS A 93 0.416 16.551 2.998 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -1.274 16.545 5.001 1.00 0.00 H new ATOM 0 HE3 LYS A 93 0.139 16.636 6.033 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -0.697 18.843 5.496 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 0.852 18.633 4.835 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -0.517 18.544 3.835 1.00 0.00 H new ATOM 1341 N SER A 94 1.196 10.162 3.045 1.00 0.00 N ATOM 1342 CA SER A 94 1.628 9.239 1.959 1.00 0.00 C ATOM 1343 C SER A 94 0.955 7.879 2.147 1.00 0.00 C ATOM 1344 O SER A 94 0.726 7.436 3.255 1.00 0.00 O ATOM 1345 CB SER A 94 3.146 9.066 2.014 1.00 0.00 C ATOM 1346 OG SER A 94 3.735 9.724 0.901 1.00 0.00 O ATOM 0 H SER A 94 0.622 9.737 3.773 1.00 0.00 H new ATOM 0 HA SER A 94 1.342 9.655 0.993 1.00 0.00 H new ATOM 0 HB2 SER A 94 3.537 9.479 2.944 1.00 0.00 H new ATOM 0 HB3 SER A 94 3.403 8.007 2.003 1.00 0.00 H new ATOM 0 HG SER A 94 4.442 10.327 1.214 1.00 0.00 H new ATOM 1352 N ILE A 95 0.635 7.211 1.074 1.00 0.00 N ATOM 1353 CA ILE A 95 -0.021 5.880 1.195 1.00 0.00 C ATOM 1354 C ILE A 95 0.624 4.909 0.206 1.00 0.00 C ATOM 1355 O ILE A 95 0.148 4.720 -0.894 1.00 0.00 O ATOM 1356 CB ILE A 95 -1.510 6.023 0.882 1.00 0.00 C ATOM 1357 CG1 ILE A 95 -2.015 7.352 1.446 1.00 0.00 C ATOM 1358 CG2 ILE A 95 -2.283 4.870 1.526 1.00 0.00 C ATOM 1359 CD1 ILE A 95 -3.512 7.495 1.167 1.00 0.00 C ATOM 0 H ILE A 95 0.799 7.529 0.119 1.00 0.00 H new ATOM 0 HA ILE A 95 0.100 5.497 2.208 1.00 0.00 H new ATOM 0 HB ILE A 95 -1.661 5.999 -0.197 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -1.829 7.397 2.519 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -1.470 8.181 0.994 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -3.345 4.974 1.302 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -1.919 3.922 1.130 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -2.136 4.892 2.606 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -3.868 8.443 1.570 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -3.686 7.470 0.091 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -4.050 6.674 1.641 1.00 0.00 H new ATOM 1371 N LEU A 96 1.707 4.293 0.595 1.00 0.00 N ATOM 1372 CA LEU A 96 2.387 3.331 -0.320 1.00 0.00 C ATOM 1373 C LEU A 96 1.427 2.187 -0.647 1.00 0.00 C ATOM 1374 O LEU A 96 0.419 2.017 0.006 1.00 0.00 O ATOM 1375 CB LEU A 96 3.638 2.774 0.367 1.00 0.00 C ATOM 1376 CG LEU A 96 3.295 2.350 1.796 1.00 0.00 C ATOM 1377 CD1 LEU A 96 4.034 1.055 2.137 1.00 0.00 C ATOM 1378 CD2 LEU A 96 3.723 3.452 2.769 1.00 0.00 C ATOM 0 H LEU A 96 2.150 4.414 1.506 1.00 0.00 H new ATOM 0 HA LEU A 96 2.677 3.838 -1.240 1.00 0.00 H new ATOM 0 HB2 LEU A 96 4.023 1.922 -0.193 1.00 0.00 H new ATOM 0 HB3 LEU A 96 4.424 3.529 0.380 1.00 0.00 H new ATOM 0 HG LEU A 96 2.221 2.186 1.879 1.00 0.00 H new ATOM 0 HD11 LEU A 96 3.789 0.754 3.155 1.00 0.00 H new ATOM 0 HD12 LEU A 96 3.732 0.270 1.444 1.00 0.00 H new ATOM 0 HD13 LEU A 96 5.109 1.217 2.055 1.00 0.00 H new ATOM 0 HD21 LEU A 96 3.480 3.152 3.788 1.00 0.00 H new ATOM 0 HD22 LEU A 96 4.798 3.614 2.685 1.00 0.00 H new ATOM 0 HD23 LEU A 96 3.197 4.375 2.527 1.00 0.00 H new ATOM 1390 N VAL A 97 1.723 1.404 -1.653 1.00 0.00 N ATOM 1391 CA VAL A 97 0.814 0.273 -2.008 1.00 0.00 C ATOM 1392 C VAL A 97 1.630 -0.933 -2.468 1.00 0.00 C ATOM 1393 O VAL A 97 1.323 -1.535 -3.472 1.00 0.00 O ATOM 1394 CB VAL A 97 -0.120 0.685 -3.148 1.00 0.00 C ATOM 1395 CG1 VAL A 97 -1.055 -0.479 -3.483 1.00 0.00 C ATOM 1396 CG2 VAL A 97 -0.956 1.895 -2.723 1.00 0.00 C ATOM 0 H VAL A 97 2.551 1.498 -2.241 1.00 0.00 H new ATOM 0 HA VAL A 97 0.232 0.014 -1.124 1.00 0.00 H new ATOM 0 HB VAL A 97 0.475 0.946 -4.023 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -1.722 -0.188 -4.295 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -0.465 -1.343 -3.789 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -1.645 -0.736 -2.604 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -1.619 2.184 -3.539 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -1.550 1.637 -1.846 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -0.295 2.727 -2.481 1.00 0.00 H new ATOM 1406 N GLY A 98 2.659 -1.295 -1.747 1.00 0.00 N ATOM 1407 CA GLY A 98 3.479 -2.474 -2.159 1.00 0.00 C ATOM 1408 C GLY A 98 2.552 -3.589 -2.651 1.00 0.00 C ATOM 1409 O GLY A 98 1.586 -3.934 -2.005 1.00 0.00 O ATOM 0 H GLY A 98 2.967 -0.828 -0.894 1.00 0.00 H new ATOM 0 HA2 GLY A 98 4.175 -2.189 -2.948 1.00 0.00 H new ATOM 0 HA3 GLY A 98 4.077 -2.827 -1.319 1.00 0.00 H new ATOM 1413 N VAL A 99 2.826 -4.152 -3.792 1.00 0.00 N ATOM 1414 CA VAL A 99 1.945 -5.232 -4.308 1.00 0.00 C ATOM 1415 C VAL A 99 2.806 -6.458 -4.622 1.00 0.00 C ATOM 1416 O VAL A 99 3.699 -6.406 -5.443 1.00 0.00 O ATOM 1417 CB VAL A 99 1.220 -4.760 -5.583 1.00 0.00 C ATOM 1418 CG1 VAL A 99 -0.293 -4.776 -5.342 1.00 0.00 C ATOM 1419 CG2 VAL A 99 1.648 -3.335 -5.963 1.00 0.00 C ATOM 0 H VAL A 99 3.619 -3.912 -4.387 1.00 0.00 H new ATOM 0 HA VAL A 99 1.196 -5.486 -3.558 1.00 0.00 H new ATOM 0 HB VAL A 99 1.483 -5.435 -6.397 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -0.808 -4.442 -6.243 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -0.612 -5.789 -5.096 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -0.537 -4.108 -4.516 1.00 0.00 H new ATOM 0 HG21 VAL A 99 1.122 -3.026 -6.866 1.00 0.00 H new ATOM 0 HG22 VAL A 99 1.404 -2.652 -5.149 1.00 0.00 H new ATOM 0 HG23 VAL A 99 2.723 -3.314 -6.144 1.00 0.00 H new ATOM 1429 N TYR A 100 2.558 -7.559 -3.964 1.00 0.00 N ATOM 1430 CA TYR A 100 3.379 -8.780 -4.221 1.00 0.00 C ATOM 1431 C TYR A 100 2.560 -9.798 -5.016 1.00 0.00 C ATOM 1432 O TYR A 100 1.422 -9.557 -5.367 1.00 0.00 O ATOM 1433 CB TYR A 100 3.815 -9.400 -2.891 1.00 0.00 C ATOM 1434 CG TYR A 100 2.600 -9.804 -2.092 1.00 0.00 C ATOM 1435 CD1 TYR A 100 1.898 -8.846 -1.352 1.00 0.00 C ATOM 1436 CD2 TYR A 100 2.180 -11.138 -2.089 1.00 0.00 C ATOM 1437 CE1 TYR A 100 0.773 -9.222 -0.609 1.00 0.00 C ATOM 1438 CE2 TYR A 100 1.055 -11.515 -1.347 1.00 0.00 C ATOM 1439 CZ TYR A 100 0.351 -10.556 -0.607 1.00 0.00 C ATOM 1440 OH TYR A 100 -0.758 -10.926 0.126 1.00 0.00 O ATOM 0 H TYR A 100 1.826 -7.667 -3.262 1.00 0.00 H new ATOM 0 HA TYR A 100 4.262 -8.501 -4.796 1.00 0.00 H new ATOM 0 HB2 TYR A 100 4.446 -10.269 -3.074 1.00 0.00 H new ATOM 0 HB3 TYR A 100 4.413 -8.686 -2.325 1.00 0.00 H new ATOM 0 HD1 TYR A 100 2.224 -7.816 -1.354 1.00 0.00 H new ATOM 0 HD2 TYR A 100 2.724 -11.877 -2.659 1.00 0.00 H new ATOM 0 HE1 TYR A 100 0.231 -8.483 -0.038 1.00 0.00 H new ATOM 0 HE2 TYR A 100 0.730 -12.545 -1.345 1.00 0.00 H new ATOM 0 HH TYR A 100 -0.916 -11.887 0.018 1.00 0.00 H new ATOM 1450 N ASN A 101 3.133 -10.935 -5.308 1.00 0.00 N ATOM 1451 CA ASN A 101 2.387 -11.963 -6.088 1.00 0.00 C ATOM 1452 C ASN A 101 2.579 -13.344 -5.454 1.00 0.00 C ATOM 1453 O ASN A 101 2.845 -13.469 -4.275 1.00 0.00 O ATOM 1454 CB ASN A 101 2.911 -11.987 -7.525 1.00 0.00 C ATOM 1455 CG ASN A 101 1.747 -12.231 -8.488 1.00 0.00 C ATOM 1456 OD1 ASN A 101 0.740 -12.796 -8.110 1.00 0.00 O ATOM 1457 ND2 ASN A 101 1.843 -11.826 -9.724 1.00 0.00 N ATOM 0 H ASN A 101 4.082 -11.195 -5.041 1.00 0.00 H new ATOM 0 HA ASN A 101 1.326 -11.714 -6.086 1.00 0.00 H new ATOM 0 HB2 ASN A 101 3.400 -11.042 -7.761 1.00 0.00 H new ATOM 0 HB3 ASN A 101 3.660 -12.771 -7.637 1.00 0.00 H new ATOM 0 HD21 ASN A 101 1.073 -11.984 -10.374 1.00 0.00 H new ATOM 0 HD22 ASN A 101 2.689 -11.352 -10.041 1.00 0.00 H new ATOM 1464 N GLU A 102 2.438 -14.381 -6.235 1.00 0.00 N ATOM 1465 CA GLU A 102 2.601 -15.761 -5.695 1.00 0.00 C ATOM 1466 C GLU A 102 4.062 -16.005 -5.311 1.00 0.00 C ATOM 1467 O GLU A 102 4.353 -16.671 -4.337 1.00 0.00 O ATOM 1468 CB GLU A 102 2.186 -16.774 -6.766 1.00 0.00 C ATOM 1469 CG GLU A 102 1.577 -18.007 -6.100 1.00 0.00 C ATOM 1470 CD GLU A 102 2.190 -19.270 -6.709 1.00 0.00 C ATOM 1471 OE1 GLU A 102 3.343 -19.545 -6.415 1.00 0.00 O ATOM 1472 OE2 GLU A 102 1.499 -19.940 -7.458 1.00 0.00 O ATOM 0 H GLU A 102 2.216 -14.331 -7.229 1.00 0.00 H new ATOM 0 HA GLU A 102 1.974 -15.875 -4.811 1.00 0.00 H new ATOM 0 HB2 GLU A 102 1.464 -16.323 -7.447 1.00 0.00 H new ATOM 0 HB3 GLU A 102 3.051 -17.061 -7.363 1.00 0.00 H new ATOM 0 HG2 GLU A 102 1.761 -17.982 -5.026 1.00 0.00 H new ATOM 0 HG3 GLU A 102 0.496 -18.012 -6.238 1.00 0.00 H new ATOM 1479 N LYS A 103 4.984 -15.481 -6.071 1.00 0.00 N ATOM 1480 CA LYS A 103 6.423 -15.695 -5.751 1.00 0.00 C ATOM 1481 C LYS A 103 6.687 -15.350 -4.282 1.00 0.00 C ATOM 1482 O LYS A 103 7.284 -16.116 -3.553 1.00 0.00 O ATOM 1483 CB LYS A 103 7.285 -14.802 -6.648 1.00 0.00 C ATOM 1484 CG LYS A 103 8.184 -15.675 -7.527 1.00 0.00 C ATOM 1485 CD LYS A 103 7.646 -15.684 -8.960 1.00 0.00 C ATOM 1486 CE LYS A 103 6.596 -16.786 -9.106 1.00 0.00 C ATOM 1487 NZ LYS A 103 5.965 -16.695 -10.452 1.00 0.00 N ATOM 0 H LYS A 103 4.803 -14.914 -6.899 1.00 0.00 H new ATOM 0 HA LYS A 103 6.677 -16.741 -5.925 1.00 0.00 H new ATOM 0 HB2 LYS A 103 6.649 -14.173 -7.271 1.00 0.00 H new ATOM 0 HB3 LYS A 103 7.893 -14.135 -6.038 1.00 0.00 H new ATOM 0 HG2 LYS A 103 9.205 -15.293 -7.513 1.00 0.00 H new ATOM 0 HG3 LYS A 103 8.218 -16.691 -7.134 1.00 0.00 H new ATOM 0 HD2 LYS A 103 7.208 -14.716 -9.201 1.00 0.00 H new ATOM 0 HD3 LYS A 103 8.461 -15.849 -9.664 1.00 0.00 H new ATOM 0 HE2 LYS A 103 7.059 -17.764 -8.975 1.00 0.00 H new ATOM 0 HE3 LYS A 103 5.838 -16.686 -8.329 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 5.251 -17.444 -10.552 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 5.510 -15.766 -10.560 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 6.693 -16.811 -11.185 1.00 0.00 H new ATOM 1501 N ILE A 104 6.249 -14.201 -3.841 1.00 0.00 N ATOM 1502 CA ILE A 104 6.483 -13.811 -2.420 1.00 0.00 C ATOM 1503 C ILE A 104 5.219 -14.072 -1.597 1.00 0.00 C ATOM 1504 O ILE A 104 4.114 -14.008 -2.097 1.00 0.00 O ATOM 1505 CB ILE A 104 6.833 -12.324 -2.351 1.00 0.00 C ATOM 1506 CG1 ILE A 104 8.022 -12.040 -3.272 1.00 0.00 C ATOM 1507 CG2 ILE A 104 7.204 -11.950 -0.914 1.00 0.00 C ATOM 1508 CD1 ILE A 104 7.515 -11.512 -4.616 1.00 0.00 C ATOM 0 H ILE A 104 5.741 -13.517 -4.402 1.00 0.00 H new ATOM 0 HA ILE A 104 7.306 -14.401 -2.016 1.00 0.00 H new ATOM 0 HB ILE A 104 5.973 -11.734 -2.669 1.00 0.00 H new ATOM 0 HG12 ILE A 104 8.687 -11.310 -2.810 1.00 0.00 H new ATOM 0 HG13 ILE A 104 8.603 -12.949 -3.423 1.00 0.00 H new ATOM 0 HG21 ILE A 104 7.453 -10.890 -0.867 1.00 0.00 H new ATOM 0 HG22 ILE A 104 6.360 -12.154 -0.255 1.00 0.00 H new ATOM 0 HG23 ILE A 104 8.064 -12.539 -0.595 1.00 0.00 H new ATOM 0 HD11 ILE A 104 8.363 -11.310 -5.271 1.00 0.00 H new ATOM 0 HD12 ILE A 104 6.868 -12.257 -5.079 1.00 0.00 H new ATOM 0 HD13 ILE A 104 6.953 -10.592 -4.457 1.00 0.00 H new ATOM 1520 N GLN A 105 5.375 -14.363 -0.333 1.00 0.00 N ATOM 1521 CA GLN A 105 4.188 -14.626 0.528 1.00 0.00 C ATOM 1522 C GLN A 105 4.121 -13.571 1.639 1.00 0.00 C ATOM 1523 O GLN A 105 5.124 -12.991 1.999 1.00 0.00 O ATOM 1524 CB GLN A 105 4.307 -16.019 1.150 1.00 0.00 C ATOM 1525 CG GLN A 105 3.384 -16.990 0.410 1.00 0.00 C ATOM 1526 CD GLN A 105 2.709 -17.917 1.420 1.00 0.00 C ATOM 1527 OE1 GLN A 105 2.615 -17.598 2.588 1.00 0.00 O ATOM 1528 NE2 GLN A 105 2.228 -19.062 1.016 1.00 0.00 N ATOM 0 H GLN A 105 6.276 -14.430 0.140 1.00 0.00 H new ATOM 0 HA GLN A 105 3.282 -14.576 -0.075 1.00 0.00 H new ATOM 0 HB2 GLN A 105 5.338 -16.367 1.094 1.00 0.00 H new ATOM 0 HB3 GLN A 105 4.041 -15.981 2.206 1.00 0.00 H new ATOM 0 HG2 GLN A 105 2.632 -16.437 -0.152 1.00 0.00 H new ATOM 0 HG3 GLN A 105 3.955 -17.574 -0.311 1.00 0.00 H new ATOM 0 HE21 GLN A 105 2.307 -19.331 0.035 1.00 0.00 H new ATOM 0 HE22 GLN A 105 1.774 -19.688 1.681 1.00 0.00 H new ATOM 1537 N PRO A 106 2.933 -13.354 2.146 1.00 0.00 N ATOM 1538 CA PRO A 106 2.704 -12.370 3.220 1.00 0.00 C ATOM 1539 C PRO A 106 3.465 -12.779 4.485 1.00 0.00 C ATOM 1540 O PRO A 106 4.326 -13.635 4.455 1.00 0.00 O ATOM 1541 CB PRO A 106 1.190 -12.408 3.473 1.00 0.00 C ATOM 1542 CG PRO A 106 0.585 -13.492 2.545 1.00 0.00 C ATOM 1543 CD PRO A 106 1.726 -14.069 1.693 1.00 0.00 C ATOM 0 HA PRO A 106 3.051 -11.373 2.948 1.00 0.00 H new ATOM 0 HB2 PRO A 106 0.982 -12.639 4.518 1.00 0.00 H new ATOM 0 HB3 PRO A 106 0.743 -11.435 3.267 1.00 0.00 H new ATOM 0 HG2 PRO A 106 0.112 -14.278 3.133 1.00 0.00 H new ATOM 0 HG3 PRO A 106 -0.188 -13.062 1.908 1.00 0.00 H new ATOM 0 HD2 PRO A 106 1.825 -15.144 1.840 1.00 0.00 H new ATOM 0 HD3 PRO A 106 1.546 -13.908 0.630 1.00 0.00 H new ATOM 1551 N GLY A 107 3.149 -12.173 5.596 1.00 0.00 N ATOM 1552 CA GLY A 107 3.846 -12.526 6.865 1.00 0.00 C ATOM 1553 C GLY A 107 5.358 -12.405 6.672 1.00 0.00 C ATOM 1554 O GLY A 107 6.135 -12.995 7.397 1.00 0.00 O ATOM 0 H GLY A 107 2.437 -11.447 5.680 1.00 0.00 H new ATOM 0 HA2 GLY A 107 3.518 -11.865 7.668 1.00 0.00 H new ATOM 0 HA3 GLY A 107 3.588 -13.542 7.163 1.00 0.00 H new ATOM 1558 N THR A 108 5.781 -11.645 5.701 1.00 0.00 N ATOM 1559 CA THR A 108 7.242 -11.483 5.460 1.00 0.00 C ATOM 1560 C THR A 108 7.483 -10.169 4.718 1.00 0.00 C ATOM 1561 O THR A 108 8.409 -9.438 5.013 1.00 0.00 O ATOM 1562 CB THR A 108 7.755 -12.652 4.617 1.00 0.00 C ATOM 1563 OG1 THR A 108 7.628 -13.858 5.358 1.00 0.00 O ATOM 1564 CG2 THR A 108 9.225 -12.422 4.264 1.00 0.00 C ATOM 0 H THR A 108 5.177 -11.128 5.062 1.00 0.00 H new ATOM 0 HA THR A 108 7.773 -11.469 6.412 1.00 0.00 H new ATOM 0 HB THR A 108 7.170 -12.724 3.700 1.00 0.00 H new ATOM 0 HG1 THR A 108 7.430 -13.647 6.294 1.00 0.00 H new ATOM 0 HG21 THR A 108 9.590 -13.255 3.663 1.00 0.00 H new ATOM 0 HG22 THR A 108 9.322 -11.496 3.697 1.00 0.00 H new ATOM 0 HG23 THR A 108 9.812 -12.350 5.180 1.00 0.00 H new ATOM 1572 N ALA A 109 6.650 -9.858 3.763 1.00 0.00 N ATOM 1573 CA ALA A 109 6.823 -8.587 3.007 1.00 0.00 C ATOM 1574 C ALA A 109 6.136 -7.452 3.770 1.00 0.00 C ATOM 1575 O ALA A 109 6.332 -6.287 3.484 1.00 0.00 O ATOM 1576 CB ALA A 109 6.191 -8.727 1.619 1.00 0.00 C ATOM 0 H ALA A 109 5.857 -10.430 3.474 1.00 0.00 H new ATOM 0 HA ALA A 109 7.885 -8.366 2.898 1.00 0.00 H new ATOM 0 HB1 ALA A 109 6.318 -7.796 1.066 1.00 0.00 H new ATOM 0 HB2 ALA A 109 6.677 -9.539 1.078 1.00 0.00 H new ATOM 0 HB3 ALA A 109 5.128 -8.945 1.723 1.00 0.00 H new ATOM 1582 N ALA A 110 5.333 -7.788 4.743 1.00 0.00 N ATOM 1583 CA ALA A 110 4.630 -6.737 5.534 1.00 0.00 C ATOM 1584 C ALA A 110 5.568 -6.202 6.617 1.00 0.00 C ATOM 1585 O ALA A 110 5.591 -5.022 6.907 1.00 0.00 O ATOM 1586 CB ALA A 110 3.389 -7.347 6.190 1.00 0.00 C ATOM 0 H ALA A 110 5.133 -8.748 5.025 1.00 0.00 H new ATOM 0 HA ALA A 110 4.333 -5.920 4.876 1.00 0.00 H new ATOM 0 HB1 ALA A 110 2.871 -6.583 6.770 1.00 0.00 H new ATOM 0 HB2 ALA A 110 2.722 -7.732 5.419 1.00 0.00 H new ATOM 0 HB3 ALA A 110 3.689 -8.161 6.849 1.00 0.00 H new ATOM 1592 N ASN A 111 6.339 -7.063 7.223 1.00 0.00 N ATOM 1593 CA ASN A 111 7.273 -6.608 8.291 1.00 0.00 C ATOM 1594 C ASN A 111 8.332 -5.680 7.691 1.00 0.00 C ATOM 1595 O ASN A 111 8.708 -4.687 8.283 1.00 0.00 O ATOM 1596 CB ASN A 111 7.958 -7.823 8.919 1.00 0.00 C ATOM 1597 CG ASN A 111 7.398 -8.053 10.325 1.00 0.00 C ATOM 1598 OD1 ASN A 111 6.731 -7.197 10.872 1.00 0.00 O ATOM 1599 ND2 ASN A 111 7.644 -9.179 10.938 1.00 0.00 N ATOM 0 H ASN A 111 6.362 -8.063 7.024 1.00 0.00 H new ATOM 0 HA ASN A 111 6.712 -6.069 9.054 1.00 0.00 H new ATOM 0 HB2 ASN A 111 7.794 -8.706 8.301 1.00 0.00 H new ATOM 0 HB3 ASN A 111 9.035 -7.663 8.966 1.00 0.00 H new ATOM 0 HD21 ASN A 111 7.276 -9.340 11.876 1.00 0.00 H new ATOM 0 HD22 ASN A 111 8.204 -9.898 10.479 1.00 0.00 H new ATOM 1606 N VAL A 112 8.818 -5.994 6.522 1.00 0.00 N ATOM 1607 CA VAL A 112 9.853 -5.128 5.889 1.00 0.00 C ATOM 1608 C VAL A 112 9.219 -3.801 5.464 1.00 0.00 C ATOM 1609 O VAL A 112 9.887 -2.791 5.353 1.00 0.00 O ATOM 1610 CB VAL A 112 10.429 -5.838 4.662 1.00 0.00 C ATOM 1611 CG1 VAL A 112 9.291 -6.238 3.723 1.00 0.00 C ATOM 1612 CG2 VAL A 112 11.385 -4.894 3.928 1.00 0.00 C ATOM 0 H VAL A 112 8.544 -6.812 5.978 1.00 0.00 H new ATOM 0 HA VAL A 112 10.652 -4.933 6.604 1.00 0.00 H new ATOM 0 HB VAL A 112 10.969 -6.730 4.980 1.00 0.00 H new ATOM 0 HG11 VAL A 112 9.701 -6.744 2.849 1.00 0.00 H new ATOM 0 HG12 VAL A 112 8.609 -6.910 4.244 1.00 0.00 H new ATOM 0 HG13 VAL A 112 8.751 -5.346 3.406 1.00 0.00 H new ATOM 0 HG21 VAL A 112 11.796 -5.399 3.054 1.00 0.00 H new ATOM 0 HG22 VAL A 112 10.844 -4.003 3.611 1.00 0.00 H new ATOM 0 HG23 VAL A 112 12.197 -4.607 4.596 1.00 0.00 H new ATOM 1622 N VAL A 113 7.936 -3.793 5.224 1.00 0.00 N ATOM 1623 CA VAL A 113 7.262 -2.530 4.807 1.00 0.00 C ATOM 1624 C VAL A 113 6.940 -1.691 6.045 1.00 0.00 C ATOM 1625 O VAL A 113 6.816 -0.484 5.973 1.00 0.00 O ATOM 1626 CB VAL A 113 5.963 -2.862 4.067 1.00 0.00 C ATOM 1627 CG1 VAL A 113 5.196 -1.571 3.773 1.00 0.00 C ATOM 1628 CG2 VAL A 113 6.292 -3.566 2.748 1.00 0.00 C ATOM 0 H VAL A 113 7.325 -4.606 5.299 1.00 0.00 H new ATOM 0 HA VAL A 113 7.923 -1.968 4.147 1.00 0.00 H new ATOM 0 HB VAL A 113 5.351 -3.516 4.688 1.00 0.00 H new ATOM 0 HG11 VAL A 113 4.272 -1.809 3.246 1.00 0.00 H new ATOM 0 HG12 VAL A 113 4.960 -1.066 4.710 1.00 0.00 H new ATOM 0 HG13 VAL A 113 5.809 -0.917 3.153 1.00 0.00 H new ATOM 0 HG21 VAL A 113 5.367 -3.802 2.221 1.00 0.00 H new ATOM 0 HG22 VAL A 113 6.905 -2.911 2.129 1.00 0.00 H new ATOM 0 HG23 VAL A 113 6.838 -4.487 2.953 1.00 0.00 H new ATOM 1638 N GLU A 114 6.801 -2.318 7.182 1.00 0.00 N ATOM 1639 CA GLU A 114 6.486 -1.556 8.419 1.00 0.00 C ATOM 1640 C GLU A 114 7.709 -0.735 8.836 1.00 0.00 C ATOM 1641 O GLU A 114 7.589 0.367 9.334 1.00 0.00 O ATOM 1642 CB GLU A 114 6.117 -2.542 9.532 1.00 0.00 C ATOM 1643 CG GLU A 114 6.185 -1.836 10.886 1.00 0.00 C ATOM 1644 CD GLU A 114 5.020 -2.293 11.763 1.00 0.00 C ATOM 1645 OE1 GLU A 114 4.856 -3.493 11.919 1.00 0.00 O ATOM 1646 OE2 GLU A 114 4.309 -1.437 12.264 1.00 0.00 O ATOM 0 H GLU A 114 6.893 -3.326 7.305 1.00 0.00 H new ATOM 0 HA GLU A 114 5.649 -0.882 8.238 1.00 0.00 H new ATOM 0 HB2 GLU A 114 5.114 -2.935 9.366 1.00 0.00 H new ATOM 0 HB3 GLU A 114 6.799 -3.392 9.519 1.00 0.00 H new ATOM 0 HG2 GLU A 114 7.132 -2.060 11.377 1.00 0.00 H new ATOM 0 HG3 GLU A 114 6.146 -0.756 10.746 1.00 0.00 H new ATOM 1653 N LYS A 115 8.885 -1.264 8.640 1.00 0.00 N ATOM 1654 CA LYS A 115 10.114 -0.515 9.029 1.00 0.00 C ATOM 1655 C LYS A 115 10.468 0.496 7.936 1.00 0.00 C ATOM 1656 O LYS A 115 10.880 1.605 8.212 1.00 0.00 O ATOM 1657 CB LYS A 115 11.271 -1.499 9.214 1.00 0.00 C ATOM 1658 CG LYS A 115 11.485 -2.287 7.919 1.00 0.00 C ATOM 1659 CD LYS A 115 12.689 -3.217 8.077 1.00 0.00 C ATOM 1660 CE LYS A 115 12.368 -4.299 9.111 1.00 0.00 C ATOM 1661 NZ LYS A 115 13.538 -4.488 10.014 1.00 0.00 N ATOM 0 H LYS A 115 9.049 -2.182 8.227 1.00 0.00 H new ATOM 0 HA LYS A 115 9.935 0.016 9.964 1.00 0.00 H new ATOM 0 HB2 LYS A 115 12.181 -0.961 9.479 1.00 0.00 H new ATOM 0 HB3 LYS A 115 11.054 -2.182 10.036 1.00 0.00 H new ATOM 0 HG2 LYS A 115 10.593 -2.867 7.683 1.00 0.00 H new ATOM 0 HG3 LYS A 115 11.649 -1.602 7.087 1.00 0.00 H new ATOM 0 HD2 LYS A 115 12.935 -3.676 7.120 1.00 0.00 H new ATOM 0 HD3 LYS A 115 13.563 -2.647 8.391 1.00 0.00 H new ATOM 0 HE2 LYS A 115 11.490 -4.014 9.691 1.00 0.00 H new ATOM 0 HE3 LYS A 115 12.128 -5.236 8.609 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 13.319 -5.223 10.716 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 14.365 -4.779 9.454 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 13.747 -3.594 10.502 1.00 0.00 H new ATOM 1675 N LEU A 116 10.312 0.121 6.695 1.00 0.00 N ATOM 1676 CA LEU A 116 10.642 1.060 5.584 1.00 0.00 C ATOM 1677 C LEU A 116 9.947 2.402 5.828 1.00 0.00 C ATOM 1678 O LEU A 116 10.463 3.449 5.490 1.00 0.00 O ATOM 1679 CB LEU A 116 10.159 0.470 4.258 1.00 0.00 C ATOM 1680 CG LEU A 116 10.490 1.433 3.115 1.00 0.00 C ATOM 1681 CD1 LEU A 116 12.008 1.561 2.975 1.00 0.00 C ATOM 1682 CD2 LEU A 116 9.903 0.891 1.810 1.00 0.00 C ATOM 0 H LEU A 116 9.970 -0.795 6.402 1.00 0.00 H new ATOM 0 HA LEU A 116 11.721 1.211 5.543 1.00 0.00 H new ATOM 0 HB2 LEU A 116 10.635 -0.495 4.083 1.00 0.00 H new ATOM 0 HB3 LEU A 116 9.084 0.293 4.298 1.00 0.00 H new ATOM 0 HG LEU A 116 10.063 2.412 3.330 1.00 0.00 H new ATOM 0 HD11 LEU A 116 12.242 2.247 2.161 1.00 0.00 H new ATOM 0 HD12 LEU A 116 12.428 1.945 3.905 1.00 0.00 H new ATOM 0 HD13 LEU A 116 12.437 0.583 2.760 1.00 0.00 H new ATOM 0 HD21 LEU A 116 10.137 1.575 0.994 1.00 0.00 H new ATOM 0 HD22 LEU A 116 10.332 -0.088 1.597 1.00 0.00 H new ATOM 0 HD23 LEU A 116 8.821 0.800 1.908 1.00 0.00 H new ATOM 1694 N ALA A 117 8.780 2.378 6.410 1.00 0.00 N ATOM 1695 CA ALA A 117 8.053 3.651 6.674 1.00 0.00 C ATOM 1696 C ALA A 117 8.621 4.315 7.928 1.00 0.00 C ATOM 1697 O ALA A 117 8.686 5.520 8.023 1.00 0.00 O ATOM 1698 CB ALA A 117 6.568 3.358 6.891 1.00 0.00 C ATOM 0 H ALA A 117 8.298 1.532 6.714 1.00 0.00 H new ATOM 0 HA ALA A 117 8.174 4.317 5.820 1.00 0.00 H new ATOM 0 HB1 ALA A 117 6.038 4.290 7.084 1.00 0.00 H new ATOM 0 HB2 ALA A 117 6.157 2.884 6.000 1.00 0.00 H new ATOM 0 HB3 ALA A 117 6.450 2.690 7.744 1.00 0.00 H new ATOM 1704 N ASP A 118 9.032 3.542 8.892 1.00 0.00 N ATOM 1705 CA ASP A 118 9.591 4.144 10.136 1.00 0.00 C ATOM 1706 C ASP A 118 10.858 4.934 9.799 1.00 0.00 C ATOM 1707 O ASP A 118 11.367 5.685 10.608 1.00 0.00 O ATOM 1708 CB ASP A 118 9.927 3.034 11.135 1.00 0.00 C ATOM 1709 CG ASP A 118 10.415 3.654 12.446 1.00 0.00 C ATOM 1710 OD1 ASP A 118 10.239 4.850 12.614 1.00 0.00 O ATOM 1711 OD2 ASP A 118 10.954 2.923 13.259 1.00 0.00 O ATOM 0 H ASP A 118 9.006 2.522 8.874 1.00 0.00 H new ATOM 0 HA ASP A 118 8.854 4.816 10.577 1.00 0.00 H new ATOM 0 HB2 ASP A 118 9.047 2.417 11.318 1.00 0.00 H new ATOM 0 HB3 ASP A 118 10.695 2.380 10.722 1.00 0.00 H new ATOM 1716 N TYR A 119 11.375 4.768 8.612 1.00 0.00 N ATOM 1717 CA TYR A 119 12.611 5.508 8.226 1.00 0.00 C ATOM 1718 C TYR A 119 12.237 6.848 7.581 1.00 0.00 C ATOM 1719 O TYR A 119 12.693 7.894 7.994 1.00 0.00 O ATOM 1720 CB TYR A 119 13.413 4.670 7.229 1.00 0.00 C ATOM 1721 CG TYR A 119 14.558 5.491 6.688 1.00 0.00 C ATOM 1722 CD1 TYR A 119 14.352 6.355 5.607 1.00 0.00 C ATOM 1723 CD2 TYR A 119 15.829 5.385 7.267 1.00 0.00 C ATOM 1724 CE1 TYR A 119 15.414 7.115 5.105 1.00 0.00 C ATOM 1725 CE2 TYR A 119 16.892 6.145 6.764 1.00 0.00 C ATOM 1726 CZ TYR A 119 16.684 7.010 5.683 1.00 0.00 C ATOM 1727 OH TYR A 119 17.732 7.757 5.187 1.00 0.00 O ATOM 0 H TYR A 119 10.995 4.152 7.893 1.00 0.00 H new ATOM 0 HA TYR A 119 13.211 5.694 9.117 1.00 0.00 H new ATOM 0 HB2 TYR A 119 13.794 3.772 7.716 1.00 0.00 H new ATOM 0 HB3 TYR A 119 12.769 4.342 6.413 1.00 0.00 H new ATOM 0 HD1 TYR A 119 13.372 6.435 5.160 1.00 0.00 H new ATOM 0 HD2 TYR A 119 15.989 4.718 8.101 1.00 0.00 H new ATOM 0 HE1 TYR A 119 15.254 7.783 4.271 1.00 0.00 H new ATOM 0 HE2 TYR A 119 17.872 6.064 7.210 1.00 0.00 H new ATOM 0 HH TYR A 119 18.543 7.566 5.703 1.00 0.00 H new ATOM 1737 N LEU A 120 11.417 6.819 6.566 1.00 0.00 N ATOM 1738 CA LEU A 120 11.015 8.080 5.884 1.00 0.00 C ATOM 1739 C LEU A 120 10.230 8.974 6.850 1.00 0.00 C ATOM 1740 O LEU A 120 10.316 10.185 6.804 1.00 0.00 O ATOM 1741 CB LEU A 120 10.154 7.716 4.666 1.00 0.00 C ATOM 1742 CG LEU A 120 8.680 7.574 5.064 1.00 0.00 C ATOM 1743 CD1 LEU A 120 8.027 8.957 5.108 1.00 0.00 C ATOM 1744 CD2 LEU A 120 7.956 6.706 4.031 1.00 0.00 C ATOM 0 H LEU A 120 11.006 5.970 6.178 1.00 0.00 H new ATOM 0 HA LEU A 120 11.898 8.631 5.560 1.00 0.00 H new ATOM 0 HB2 LEU A 120 10.256 8.485 3.900 1.00 0.00 H new ATOM 0 HB3 LEU A 120 10.509 6.782 4.230 1.00 0.00 H new ATOM 0 HG LEU A 120 8.613 7.108 6.047 1.00 0.00 H new ATOM 0 HD11 LEU A 120 6.979 8.856 5.391 1.00 0.00 H new ATOM 0 HD12 LEU A 120 8.542 9.579 5.840 1.00 0.00 H new ATOM 0 HD13 LEU A 120 8.094 9.422 4.125 1.00 0.00 H new ATOM 0 HD21 LEU A 120 6.908 6.604 4.312 1.00 0.00 H new ATOM 0 HD22 LEU A 120 8.024 7.175 3.050 1.00 0.00 H new ATOM 0 HD23 LEU A 120 8.420 5.720 3.995 1.00 0.00 H new ATOM 1756 N ILE A 121 9.461 8.384 7.719 1.00 0.00 N ATOM 1757 CA ILE A 121 8.665 9.190 8.685 1.00 0.00 C ATOM 1758 C ILE A 121 9.610 9.973 9.597 1.00 0.00 C ATOM 1759 O ILE A 121 9.205 10.885 10.290 1.00 0.00 O ATOM 1760 CB ILE A 121 7.791 8.253 9.521 1.00 0.00 C ATOM 1761 CG1 ILE A 121 6.639 7.732 8.656 1.00 0.00 C ATOM 1762 CG2 ILE A 121 7.224 9.014 10.722 1.00 0.00 C ATOM 1763 CD1 ILE A 121 6.416 6.243 8.937 1.00 0.00 C ATOM 0 H ILE A 121 9.348 7.374 7.803 1.00 0.00 H new ATOM 0 HA ILE A 121 8.029 9.892 8.145 1.00 0.00 H new ATOM 0 HB ILE A 121 8.391 7.415 9.876 1.00 0.00 H new ATOM 0 HG12 ILE A 121 5.729 8.293 8.869 1.00 0.00 H new ATOM 0 HG13 ILE A 121 6.867 7.883 7.601 1.00 0.00 H new ATOM 0 HG21 ILE A 121 6.602 8.345 11.316 1.00 0.00 H new ATOM 0 HG22 ILE A 121 8.044 9.388 11.336 1.00 0.00 H new ATOM 0 HG23 ILE A 121 6.622 9.852 10.371 1.00 0.00 H new ATOM 0 HD11 ILE A 121 5.596 5.875 8.320 1.00 0.00 H new ATOM 0 HD12 ILE A 121 7.324 5.688 8.701 1.00 0.00 H new ATOM 0 HD13 ILE A 121 6.169 6.104 9.990 1.00 0.00 H new ATOM 1775 N GLY A 122 10.869 9.631 9.596 1.00 0.00 N ATOM 1776 CA GLY A 122 11.837 10.367 10.456 1.00 0.00 C ATOM 1777 C GLY A 122 11.600 11.869 10.300 1.00 0.00 C ATOM 1778 O GLY A 122 11.864 12.646 11.197 1.00 0.00 O ATOM 0 H GLY A 122 11.268 8.876 9.038 1.00 0.00 H new ATOM 0 HA2 GLY A 122 11.714 10.073 11.498 1.00 0.00 H new ATOM 0 HA3 GLY A 122 12.859 10.116 10.173 1.00 0.00 H new ATOM 1782 N GLN A 123 11.099 12.282 9.167 1.00 0.00 N ATOM 1783 CA GLN A 123 10.837 13.733 8.949 1.00 0.00 C ATOM 1784 C GLN A 123 9.337 14.000 9.088 1.00 0.00 C ATOM 1785 O GLN A 123 8.900 14.677 9.998 1.00 0.00 O ATOM 1786 CB GLN A 123 11.296 14.137 7.547 1.00 0.00 C ATOM 1787 CG GLN A 123 12.582 13.389 7.191 1.00 0.00 C ATOM 1788 CD GLN A 123 13.288 14.111 6.044 1.00 0.00 C ATOM 1789 OE1 GLN A 123 14.218 14.864 6.264 1.00 0.00 O ATOM 1790 NE2 GLN A 123 12.885 13.915 4.818 1.00 0.00 N ATOM 0 H GLN A 123 10.860 11.676 8.382 1.00 0.00 H new ATOM 0 HA GLN A 123 11.386 14.315 9.689 1.00 0.00 H new ATOM 0 HB2 GLN A 123 10.518 13.909 6.819 1.00 0.00 H new ATOM 0 HB3 GLN A 123 11.466 15.213 7.505 1.00 0.00 H new ATOM 0 HG2 GLN A 123 13.237 13.336 8.060 1.00 0.00 H new ATOM 0 HG3 GLN A 123 12.351 12.363 6.903 1.00 0.00 H new ATOM 0 HE21 GLN A 123 12.105 13.284 4.632 1.00 0.00 H new ATOM 0 HE22 GLN A 123 13.350 14.393 4.046 1.00 0.00 H new ATOM 1799 N GLY A 124 8.544 13.468 8.197 1.00 0.00 N ATOM 1800 CA GLY A 124 7.071 13.686 8.287 1.00 0.00 C ATOM 1801 C GLY A 124 6.585 14.492 7.079 1.00 0.00 C ATOM 1802 O GLY A 124 6.856 15.671 6.958 1.00 0.00 O ATOM 0 H GLY A 124 8.851 12.893 7.412 1.00 0.00 H new ATOM 0 HA2 GLY A 124 6.555 12.727 8.326 1.00 0.00 H new ATOM 0 HA3 GLY A 124 6.829 14.215 9.209 1.00 0.00 H new ATOM 1806 N PHE A 125 5.866 13.868 6.184 1.00 0.00 N ATOM 1807 CA PHE A 125 5.359 14.601 4.988 1.00 0.00 C ATOM 1808 C PHE A 125 4.484 15.772 5.439 1.00 0.00 C ATOM 1809 O PHE A 125 4.375 16.727 4.689 1.00 0.00 O ATOM 1810 CB PHE A 125 4.531 13.651 4.117 1.00 0.00 C ATOM 1811 CG PHE A 125 5.442 12.631 3.479 1.00 0.00 C ATOM 1812 CD1 PHE A 125 6.622 13.045 2.849 1.00 0.00 C ATOM 1813 CD2 PHE A 125 5.109 11.272 3.520 1.00 0.00 C ATOM 1814 CE1 PHE A 125 7.468 12.099 2.258 1.00 0.00 C ATOM 1815 CE2 PHE A 125 5.955 10.327 2.928 1.00 0.00 C ATOM 1816 CZ PHE A 125 7.136 10.740 2.298 1.00 0.00 C ATOM 1817 OXT PHE A 125 3.939 15.694 6.528 1.00 0.00 O ATOM 0 H PHE A 125 5.608 12.882 6.230 1.00 0.00 H new ATOM 0 HA PHE A 125 6.203 14.979 4.411 1.00 0.00 H new ATOM 0 HB2 PHE A 125 3.775 13.151 4.723 1.00 0.00 H new ATOM 0 HB3 PHE A 125 4.002 14.214 3.348 1.00 0.00 H new ATOM 0 HD1 PHE A 125 6.879 14.093 2.819 1.00 0.00 H new ATOM 0 HD2 PHE A 125 4.200 10.953 4.008 1.00 0.00 H new ATOM 0 HE1 PHE A 125 8.378 12.418 1.771 1.00 0.00 H new ATOM 0 HE2 PHE A 125 5.697 9.279 2.957 1.00 0.00 H new ATOM 0 HZ PHE A 125 7.790 10.010 1.844 1.00 0.00 H new TER 1827 PHE A 125