USER MOD reduce.3.24.130724 H: found=0, std=0, add=911, rem=0, adj=32 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 91 THR OG1 : rot 143:sc= -0.439 USER MOD Set 1.2: A 92 SER OG : rot 86:sc= 0.985 USER MOD Set 2.1: A 76 SER OG : rot 169:sc= 0.344 USER MOD Set 2.2: A 78 TYR OH : rot 150:sc= -0.655 USER MOD Set 3.1: A 66 HIS : no HE2:sc= -5.06! C(o=-5.2!,f=-9.5!) USER MOD Set 3.2: A 81 LYS NZ :NH3+ -124:sc= -0.191 (180deg=-0.465) USER MOD Set 4.1: A 1 SER OG : rot 180:sc= 0 USER MOD Set 4.2: A 4 THR OG1 : rot 77:sc= 0.145 USER MOD Set 4.3: A 5 TYR OH : rot 180:sc= 0 USER MOD Single : A 1 SER N :NH3+ 144:sc= -0.401 (180deg=-0.498) USER MOD Single : A 3 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 8 THR OG1 : rot -75:sc= -1 USER MOD Single : A 9 ASN :FLIP amide:sc= -0.0525 F(o=-1.1,f=-0.053) USER MOD Single : A 13 THR OG1 : rot -59:sc= 0.876 USER MOD Single : A 17 THR OG1 : rot 180:sc= 0.101 USER MOD Single : A 18 GLN : amide:sc= -1.02 K(o=-1,f=-3.5!) USER MOD Single : A 27 ASN : amide:sc= -0.0561 K(o=-0.056,f=-1.6!) USER MOD Single : A 28 THR OG1 : rot -25:sc= 0.514 USER MOD Single : A 31 THR OG1 : rot 180:sc= 0 USER MOD Single : A 32 SER OG : rot 48:sc= 1.07 USER MOD Single : A 38 THR OG1 : rot 180:sc= 0.106 USER MOD Single : A 41 GLN : amide:sc= -0.202 K(o=-0.2,f=-1.3!) USER MOD Single : A 43 GLN : amide:sc= -0.467 X(o=-0.47,f=0) USER MOD Single : A 44 THR OG1 : rot 74:sc= 0.0433 USER MOD Single : A 47 SER OG : rot -84:sc= 1.13 USER MOD Single : A 50 ASN : amide:sc= -0.0426 X(o=-0.043,f=0) USER MOD Single : A 51 ASN : amide:sc= -0.342 X(o=-0.34,f=-0.15) USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 67 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 SER OG : rot 180:sc= 0.037 USER MOD Single : A 88 THR OG1 : rot -17:sc= 1 USER MOD Single : A 90 LYS NZ :NH3+ 156:sc= -0.0314 (180deg=-0.0804) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 100 TYR OH : rot 30:sc= 0 USER MOD Single : A 101 ASN : amide:sc= -0.198 X(o=-0.2,f=-0.014) USER MOD Single : A 103 LYS NZ :NH3+ -152:sc= -0.125 (180deg=-1.21) USER MOD Single : A 105 GLN : amide:sc= 0 X(o=0,f=-0.017) USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 111 ASN : amide:sc= -0.678 K(o=-0.68,f=-1.6!) USER MOD Single : A 115 LYS NZ :NH3+ -140:sc= -1.06 (180deg=-1.98!) USER MOD Single : A 119 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 GLN : amide:sc= -0.856 K(o=-0.86,f=-1.4) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 11.816 9.686 0.560 1.00 0.00 N ATOM 2 CA SER A 1 12.627 8.458 0.324 1.00 0.00 C ATOM 3 C SER A 1 11.693 7.288 0.010 1.00 0.00 C ATOM 4 O SER A 1 12.004 6.145 0.275 1.00 0.00 O ATOM 5 CB SER A 1 13.445 8.138 1.576 1.00 0.00 C ATOM 6 OG SER A 1 14.767 7.782 1.193 1.00 0.00 O ATOM 0 H1 SER A 1 12.262 10.259 1.305 1.00 0.00 H new ATOM 0 H2 SER A 1 11.762 10.241 -0.318 1.00 0.00 H new ATOM 0 H3 SER A 1 10.857 9.417 0.858 1.00 0.00 H new ATOM 0 HA SER A 1 13.302 8.622 -0.516 1.00 0.00 H new ATOM 0 HB2 SER A 1 13.466 9.001 2.241 1.00 0.00 H new ATOM 0 HB3 SER A 1 12.981 7.321 2.129 1.00 0.00 H new ATOM 0 HG SER A 1 15.295 7.578 1.993 1.00 0.00 H new ATOM 14 N TRP A 2 10.549 7.565 -0.553 1.00 0.00 N ATOM 15 CA TRP A 2 9.592 6.469 -0.883 1.00 0.00 C ATOM 16 C TRP A 2 9.705 6.122 -2.372 1.00 0.00 C ATOM 17 O TRP A 2 9.603 4.976 -2.764 1.00 0.00 O ATOM 18 CB TRP A 2 8.165 6.932 -0.572 1.00 0.00 C ATOM 19 CG TRP A 2 7.533 5.995 0.411 1.00 0.00 C ATOM 20 CD1 TRP A 2 6.679 6.358 1.396 1.00 0.00 C ATOM 21 CD2 TRP A 2 7.690 4.551 0.518 1.00 0.00 C ATOM 22 NE1 TRP A 2 6.302 5.227 2.101 1.00 0.00 N ATOM 23 CE2 TRP A 2 6.899 4.089 1.597 1.00 0.00 C ATOM 24 CE3 TRP A 2 8.434 3.607 -0.211 1.00 0.00 C ATOM 25 CZ2 TRP A 2 6.850 2.736 1.939 1.00 0.00 C ATOM 26 CZ3 TRP A 2 8.388 2.247 0.132 1.00 0.00 C ATOM 27 CH2 TRP A 2 7.596 1.812 1.204 1.00 0.00 C ATOM 0 H TRP A 2 10.235 8.504 -0.799 1.00 0.00 H new ATOM 0 HA TRP A 2 9.827 5.587 -0.288 1.00 0.00 H new ATOM 0 HB2 TRP A 2 8.181 7.944 -0.166 1.00 0.00 H new ATOM 0 HB3 TRP A 2 7.575 6.965 -1.488 1.00 0.00 H new ATOM 0 HD1 TRP A 2 6.346 7.365 1.599 1.00 0.00 H new ATOM 0 HE1 TRP A 2 5.662 5.234 2.895 1.00 0.00 H new ATOM 0 HE3 TRP A 2 9.045 3.931 -1.041 1.00 0.00 H new ATOM 0 HZ2 TRP A 2 6.239 2.406 2.766 1.00 0.00 H new ATOM 0 HZ3 TRP A 2 8.966 1.531 -0.433 1.00 0.00 H new ATOM 0 HH2 TRP A 2 7.563 0.764 1.461 1.00 0.00 H new ATOM 38 N GLN A 3 9.913 7.103 -3.207 1.00 0.00 N ATOM 39 CA GLN A 3 10.026 6.826 -4.668 1.00 0.00 C ATOM 40 C GLN A 3 11.359 6.133 -4.968 1.00 0.00 C ATOM 41 O GLN A 3 11.477 5.377 -5.912 1.00 0.00 O ATOM 42 CB GLN A 3 9.946 8.145 -5.445 1.00 0.00 C ATOM 43 CG GLN A 3 11.278 8.893 -5.340 1.00 0.00 C ATOM 44 CD GLN A 3 11.163 10.244 -6.050 1.00 0.00 C ATOM 45 OE1 GLN A 3 10.534 11.155 -5.549 1.00 0.00 O ATOM 46 NE2 GLN A 3 11.747 10.413 -7.206 1.00 0.00 N ATOM 0 H GLN A 3 10.010 8.083 -2.942 1.00 0.00 H new ATOM 0 HA GLN A 3 9.209 6.172 -4.973 1.00 0.00 H new ATOM 0 HB2 GLN A 3 9.711 7.947 -6.491 1.00 0.00 H new ATOM 0 HB3 GLN A 3 9.140 8.762 -5.049 1.00 0.00 H new ATOM 0 HG2 GLN A 3 11.542 9.042 -4.293 1.00 0.00 H new ATOM 0 HG3 GLN A 3 12.076 8.301 -5.789 1.00 0.00 H new ATOM 0 HE21 GLN A 3 12.275 9.649 -7.627 1.00 0.00 H new ATOM 0 HE22 GLN A 3 11.675 11.309 -7.688 1.00 0.00 H new ATOM 55 N THR A 4 12.364 6.388 -4.176 1.00 0.00 N ATOM 56 CA THR A 4 13.689 5.749 -4.423 1.00 0.00 C ATOM 57 C THR A 4 13.561 4.225 -4.341 1.00 0.00 C ATOM 58 O THR A 4 14.173 3.501 -5.102 1.00 0.00 O ATOM 59 CB THR A 4 14.699 6.231 -3.376 1.00 0.00 C ATOM 60 OG1 THR A 4 14.053 7.085 -2.443 1.00 0.00 O ATOM 61 CG2 THR A 4 15.830 6.992 -4.068 1.00 0.00 C ATOM 0 H THR A 4 12.326 7.011 -3.369 1.00 0.00 H new ATOM 0 HA THR A 4 14.034 6.027 -5.419 1.00 0.00 H new ATOM 0 HB THR A 4 15.110 5.369 -2.850 1.00 0.00 H new ATOM 0 HG1 THR A 4 13.528 6.546 -1.815 1.00 0.00 H new ATOM 0 HG21 THR A 4 16.548 7.334 -3.322 1.00 0.00 H new ATOM 0 HG22 THR A 4 16.330 6.334 -4.778 1.00 0.00 H new ATOM 0 HG23 THR A 4 15.419 7.852 -4.598 1.00 0.00 H new ATOM 69 N TYR A 5 12.779 3.730 -3.421 1.00 0.00 N ATOM 70 CA TYR A 5 12.625 2.251 -3.291 1.00 0.00 C ATOM 71 C TYR A 5 11.742 1.718 -4.424 1.00 0.00 C ATOM 72 O TYR A 5 11.808 0.561 -4.786 1.00 0.00 O ATOM 73 CB TYR A 5 11.976 1.930 -1.943 1.00 0.00 C ATOM 74 CG TYR A 5 12.738 2.620 -0.842 1.00 0.00 C ATOM 75 CD1 TYR A 5 14.137 2.623 -0.855 1.00 0.00 C ATOM 76 CD2 TYR A 5 12.047 3.254 0.198 1.00 0.00 C ATOM 77 CE1 TYR A 5 14.846 3.260 0.169 1.00 0.00 C ATOM 78 CE2 TYR A 5 12.756 3.890 1.223 1.00 0.00 C ATOM 79 CZ TYR A 5 14.155 3.895 1.209 1.00 0.00 C ATOM 80 OH TYR A 5 14.854 4.523 2.218 1.00 0.00 O ATOM 0 H TYR A 5 12.241 4.283 -2.754 1.00 0.00 H new ATOM 0 HA TYR A 5 13.605 1.778 -3.350 1.00 0.00 H new ATOM 0 HB2 TYR A 5 10.936 2.257 -1.941 1.00 0.00 H new ATOM 0 HB3 TYR A 5 11.971 0.853 -1.777 1.00 0.00 H new ATOM 0 HD1 TYR A 5 14.670 2.133 -1.656 1.00 0.00 H new ATOM 0 HD2 TYR A 5 10.967 3.252 0.209 1.00 0.00 H new ATOM 0 HE1 TYR A 5 15.926 3.262 0.158 1.00 0.00 H new ATOM 0 HE2 TYR A 5 12.223 4.378 2.026 1.00 0.00 H new ATOM 0 HH TYR A 5 14.224 4.914 2.859 1.00 0.00 H new ATOM 90 N VAL A 6 10.910 2.554 -4.982 1.00 0.00 N ATOM 91 CA VAL A 6 10.011 2.103 -6.086 1.00 0.00 C ATOM 92 C VAL A 6 10.820 1.886 -7.366 1.00 0.00 C ATOM 93 O VAL A 6 10.407 1.175 -8.259 1.00 0.00 O ATOM 94 CB VAL A 6 8.949 3.187 -6.318 1.00 0.00 C ATOM 95 CG1 VAL A 6 8.532 3.246 -7.796 1.00 0.00 C ATOM 96 CG2 VAL A 6 7.720 2.873 -5.468 1.00 0.00 C ATOM 0 H VAL A 6 10.813 3.535 -4.721 1.00 0.00 H new ATOM 0 HA VAL A 6 9.534 1.161 -5.816 1.00 0.00 H new ATOM 0 HB VAL A 6 9.373 4.151 -6.038 1.00 0.00 H new ATOM 0 HG11 VAL A 6 7.779 4.022 -7.931 1.00 0.00 H new ATOM 0 HG12 VAL A 6 9.403 3.474 -8.411 1.00 0.00 H new ATOM 0 HG13 VAL A 6 8.118 2.283 -8.096 1.00 0.00 H new ATOM 0 HG21 VAL A 6 6.962 3.639 -5.628 1.00 0.00 H new ATOM 0 HG22 VAL A 6 7.319 1.900 -5.753 1.00 0.00 H new ATOM 0 HG23 VAL A 6 8.001 2.855 -4.415 1.00 0.00 H new ATOM 106 N ASP A 7 11.946 2.514 -7.480 1.00 0.00 N ATOM 107 CA ASP A 7 12.751 2.359 -8.720 1.00 0.00 C ATOM 108 C ASP A 7 12.856 0.883 -9.105 1.00 0.00 C ATOM 109 O ASP A 7 12.034 0.364 -9.833 1.00 0.00 O ATOM 110 CB ASP A 7 14.153 2.935 -8.504 1.00 0.00 C ATOM 111 CG ASP A 7 15.004 2.682 -9.750 1.00 0.00 C ATOM 112 OD1 ASP A 7 14.536 2.987 -10.835 1.00 0.00 O ATOM 113 OD2 ASP A 7 16.109 2.188 -9.599 1.00 0.00 O ATOM 0 H ASP A 7 12.348 3.128 -6.772 1.00 0.00 H new ATOM 0 HA ASP A 7 12.257 2.900 -9.527 1.00 0.00 H new ATOM 0 HB2 ASP A 7 14.092 4.005 -8.303 1.00 0.00 H new ATOM 0 HB3 ASP A 7 14.618 2.473 -7.633 1.00 0.00 H new ATOM 118 N THR A 8 13.868 0.209 -8.643 1.00 0.00 N ATOM 119 CA THR A 8 14.023 -1.228 -9.007 1.00 0.00 C ATOM 120 C THR A 8 14.322 -2.058 -7.758 1.00 0.00 C ATOM 121 O THR A 8 14.446 -3.265 -7.823 1.00 0.00 O ATOM 122 CB THR A 8 15.177 -1.377 -10.002 1.00 0.00 C ATOM 123 OG1 THR A 8 16.025 -0.240 -9.913 1.00 0.00 O ATOM 124 CG2 THR A 8 14.620 -1.492 -11.423 1.00 0.00 C ATOM 0 H THR A 8 14.593 0.586 -8.032 1.00 0.00 H new ATOM 0 HA THR A 8 13.096 -1.583 -9.458 1.00 0.00 H new ATOM 0 HB THR A 8 15.747 -2.276 -9.766 1.00 0.00 H new ATOM 0 HG1 THR A 8 15.591 0.526 -10.344 1.00 0.00 H new ATOM 0 HG21 THR A 8 15.444 -1.598 -12.129 1.00 0.00 H new ATOM 0 HG22 THR A 8 13.970 -2.365 -11.490 1.00 0.00 H new ATOM 0 HG23 THR A 8 14.049 -0.595 -11.664 1.00 0.00 H new ATOM 132 N ASN A 9 14.440 -1.430 -6.623 1.00 0.00 N ATOM 133 CA ASN A 9 14.729 -2.203 -5.385 1.00 0.00 C ATOM 134 C ASN A 9 13.418 -2.699 -4.784 1.00 0.00 C ATOM 135 O ASN A 9 12.990 -3.790 -5.061 1.00 0.00 O ATOM 136 CB ASN A 9 15.457 -1.313 -4.377 1.00 0.00 C ATOM 137 CG ASN A 9 16.967 -1.434 -4.590 1.00 0.00 C ATOM 138 OD1 ASN A 9 17.421 -1.838 -5.746 1.00 0.00 O flip ATOM 139 ND2 ASN A 9 17.742 -1.156 -3.698 1.00 0.00 N flip ATOM 0 H ASN A 9 14.350 -0.422 -6.499 1.00 0.00 H new ATOM 0 HA ASN A 9 15.363 -3.055 -5.628 1.00 0.00 H new ATOM 0 HB2 ASN A 9 15.144 -0.276 -4.498 1.00 0.00 H new ATOM 0 HB3 ASN A 9 15.197 -1.608 -3.360 1.00 0.00 H new ATOM 0 HD21 ASN A 9 17.388 -0.840 -2.795 1.00 0.00 H new ATOM 0 HD22 ASN A 9 18.747 -1.238 -3.852 1.00 0.00 H new ATOM 146 N LEU A 10 12.775 -1.913 -3.964 1.00 0.00 N ATOM 147 CA LEU A 10 11.490 -2.370 -3.359 1.00 0.00 C ATOM 148 C LEU A 10 10.522 -2.790 -4.464 1.00 0.00 C ATOM 149 O LEU A 10 9.650 -3.611 -4.259 1.00 0.00 O ATOM 150 CB LEU A 10 10.861 -1.230 -2.556 1.00 0.00 C ATOM 151 CG LEU A 10 11.217 -1.373 -1.073 1.00 0.00 C ATOM 152 CD1 LEU A 10 10.340 -2.455 -0.440 1.00 0.00 C ATOM 153 CD2 LEU A 10 12.691 -1.764 -0.927 1.00 0.00 C ATOM 0 H LEU A 10 13.081 -0.980 -3.688 1.00 0.00 H new ATOM 0 HA LEU A 10 11.690 -3.216 -2.701 1.00 0.00 H new ATOM 0 HB2 LEU A 10 11.216 -0.271 -2.932 1.00 0.00 H new ATOM 0 HB3 LEU A 10 9.778 -1.241 -2.681 1.00 0.00 H new ATOM 0 HG LEU A 10 11.046 -0.421 -0.570 1.00 0.00 H new ATOM 0 HD11 LEU A 10 10.593 -2.557 0.615 1.00 0.00 H new ATOM 0 HD12 LEU A 10 9.291 -2.175 -0.536 1.00 0.00 H new ATOM 0 HD13 LEU A 10 10.510 -3.404 -0.947 1.00 0.00 H new ATOM 0 HD21 LEU A 10 12.938 -1.864 0.130 1.00 0.00 H new ATOM 0 HD22 LEU A 10 12.867 -2.714 -1.432 1.00 0.00 H new ATOM 0 HD23 LEU A 10 13.318 -0.993 -1.375 1.00 0.00 H new ATOM 165 N VAL A 11 10.656 -2.225 -5.631 1.00 0.00 N ATOM 166 CA VAL A 11 9.729 -2.590 -6.736 1.00 0.00 C ATOM 167 C VAL A 11 10.311 -3.757 -7.532 1.00 0.00 C ATOM 168 O VAL A 11 9.738 -4.828 -7.567 1.00 0.00 O ATOM 169 CB VAL A 11 9.517 -1.369 -7.655 1.00 0.00 C ATOM 170 CG1 VAL A 11 9.056 -1.823 -9.044 1.00 0.00 C ATOM 171 CG2 VAL A 11 8.449 -0.458 -7.048 1.00 0.00 C ATOM 0 H VAL A 11 11.364 -1.530 -5.866 1.00 0.00 H new ATOM 0 HA VAL A 11 8.768 -2.893 -6.321 1.00 0.00 H new ATOM 0 HB VAL A 11 10.460 -0.831 -7.749 1.00 0.00 H new ATOM 0 HG11 VAL A 11 8.910 -0.951 -9.682 1.00 0.00 H new ATOM 0 HG12 VAL A 11 9.813 -2.472 -9.484 1.00 0.00 H new ATOM 0 HG13 VAL A 11 8.117 -2.369 -8.955 1.00 0.00 H new ATOM 0 HG21 VAL A 11 8.297 0.406 -7.695 1.00 0.00 H new ATOM 0 HG22 VAL A 11 7.513 -1.008 -6.952 1.00 0.00 H new ATOM 0 HG23 VAL A 11 8.775 -0.121 -6.064 1.00 0.00 H new ATOM 181 N GLY A 12 11.437 -3.563 -8.172 1.00 0.00 N ATOM 182 CA GLY A 12 12.047 -4.673 -8.963 1.00 0.00 C ATOM 183 C GLY A 12 11.876 -5.976 -8.185 1.00 0.00 C ATOM 184 O GLY A 12 11.586 -7.016 -8.743 1.00 0.00 O ATOM 0 H GLY A 12 11.958 -2.686 -8.181 1.00 0.00 H new ATOM 0 HA2 GLY A 12 11.568 -4.750 -9.939 1.00 0.00 H new ATOM 0 HA3 GLY A 12 13.104 -4.474 -9.141 1.00 0.00 H new ATOM 188 N THR A 13 12.028 -5.905 -6.889 1.00 0.00 N ATOM 189 CA THR A 13 11.855 -7.109 -6.030 1.00 0.00 C ATOM 190 C THR A 13 12.610 -6.922 -4.719 1.00 0.00 C ATOM 191 O THR A 13 13.390 -7.760 -4.312 1.00 0.00 O ATOM 192 CB THR A 13 12.396 -8.344 -6.732 1.00 0.00 C ATOM 193 OG1 THR A 13 12.666 -9.362 -5.776 1.00 0.00 O ATOM 194 CG2 THR A 13 13.682 -7.982 -7.480 1.00 0.00 C ATOM 0 H THR A 13 12.268 -5.052 -6.384 1.00 0.00 H new ATOM 0 HA THR A 13 10.791 -7.240 -5.833 1.00 0.00 H new ATOM 0 HB THR A 13 11.655 -8.711 -7.442 1.00 0.00 H new ATOM 0 HG1 THR A 13 13.323 -9.035 -5.127 1.00 0.00 H new ATOM 0 HG21 THR A 13 14.071 -8.867 -7.984 1.00 0.00 H new ATOM 0 HG22 THR A 13 13.468 -7.209 -8.218 1.00 0.00 H new ATOM 0 HG23 THR A 13 14.423 -7.613 -6.771 1.00 0.00 H new ATOM 202 N GLY A 14 12.357 -5.857 -4.031 1.00 0.00 N ATOM 203 CA GLY A 14 13.025 -5.658 -2.721 1.00 0.00 C ATOM 204 C GLY A 14 12.050 -6.153 -1.664 1.00 0.00 C ATOM 205 O GLY A 14 12.106 -5.766 -0.514 1.00 0.00 O ATOM 0 H GLY A 14 11.718 -5.114 -4.315 1.00 0.00 H new ATOM 0 HA2 GLY A 14 13.963 -6.212 -2.675 1.00 0.00 H new ATOM 0 HA3 GLY A 14 13.268 -4.607 -2.564 1.00 0.00 H new ATOM 209 N ALA A 15 11.138 -6.999 -2.088 1.00 0.00 N ATOM 210 CA ALA A 15 10.088 -7.550 -1.190 1.00 0.00 C ATOM 211 C ALA A 15 8.833 -7.683 -2.041 1.00 0.00 C ATOM 212 O ALA A 15 7.992 -8.529 -1.817 1.00 0.00 O ATOM 213 CB ALA A 15 9.812 -6.601 -0.021 1.00 0.00 C ATOM 0 H ALA A 15 11.083 -7.336 -3.049 1.00 0.00 H new ATOM 0 HA ALA A 15 10.404 -8.504 -0.768 1.00 0.00 H new ATOM 0 HB1 ALA A 15 9.041 -7.028 0.620 1.00 0.00 H new ATOM 0 HB2 ALA A 15 10.726 -6.459 0.556 1.00 0.00 H new ATOM 0 HB3 ALA A 15 9.473 -5.639 -0.405 1.00 0.00 H new ATOM 219 N VAL A 16 8.725 -6.846 -3.041 1.00 0.00 N ATOM 220 CA VAL A 16 7.558 -6.899 -3.946 1.00 0.00 C ATOM 221 C VAL A 16 8.082 -6.873 -5.380 1.00 0.00 C ATOM 222 O VAL A 16 9.011 -6.155 -5.690 1.00 0.00 O ATOM 223 CB VAL A 16 6.678 -5.672 -3.698 1.00 0.00 C ATOM 224 CG1 VAL A 16 5.306 -5.891 -4.326 1.00 0.00 C ATOM 225 CG2 VAL A 16 6.522 -5.452 -2.190 1.00 0.00 C ATOM 0 H VAL A 16 9.409 -6.123 -3.264 1.00 0.00 H new ATOM 0 HA VAL A 16 6.970 -7.800 -3.772 1.00 0.00 H new ATOM 0 HB VAL A 16 7.145 -4.795 -4.147 1.00 0.00 H new ATOM 0 HG11 VAL A 16 4.681 -5.016 -4.148 1.00 0.00 H new ATOM 0 HG12 VAL A 16 5.418 -6.045 -5.399 1.00 0.00 H new ATOM 0 HG13 VAL A 16 4.838 -6.768 -3.880 1.00 0.00 H new ATOM 0 HG21 VAL A 16 5.895 -4.578 -2.013 1.00 0.00 H new ATOM 0 HG22 VAL A 16 6.057 -6.329 -1.741 1.00 0.00 H new ATOM 0 HG23 VAL A 16 7.503 -5.292 -1.742 1.00 0.00 H new ATOM 235 N THR A 17 7.499 -7.629 -6.268 1.00 0.00 N ATOM 236 CA THR A 17 7.987 -7.604 -7.675 1.00 0.00 C ATOM 237 C THR A 17 7.451 -6.340 -8.352 1.00 0.00 C ATOM 238 O THR A 17 7.686 -6.096 -9.519 1.00 0.00 O ATOM 239 CB THR A 17 7.486 -8.842 -8.421 1.00 0.00 C ATOM 240 OG1 THR A 17 6.327 -9.347 -7.773 1.00 0.00 O ATOM 241 CG2 THR A 17 8.579 -9.913 -8.429 1.00 0.00 C ATOM 0 H THR A 17 6.716 -8.256 -6.084 1.00 0.00 H new ATOM 0 HA THR A 17 9.077 -7.604 -7.691 1.00 0.00 H new ATOM 0 HB THR A 17 7.239 -8.573 -9.448 1.00 0.00 H new ATOM 0 HG1 THR A 17 6.004 -10.139 -8.251 1.00 0.00 H new ATOM 0 HG21 THR A 17 8.221 -10.794 -8.961 1.00 0.00 H new ATOM 0 HG22 THR A 17 9.466 -9.524 -8.928 1.00 0.00 H new ATOM 0 HG23 THR A 17 8.830 -10.185 -7.404 1.00 0.00 H new ATOM 249 N GLN A 18 6.744 -5.529 -7.608 1.00 0.00 N ATOM 250 CA GLN A 18 6.187 -4.263 -8.165 1.00 0.00 C ATOM 251 C GLN A 18 5.895 -3.303 -7.006 1.00 0.00 C ATOM 252 O GLN A 18 6.216 -3.576 -5.866 1.00 0.00 O ATOM 253 CB GLN A 18 4.883 -4.539 -8.927 1.00 0.00 C ATOM 254 CG GLN A 18 4.805 -6.011 -9.340 1.00 0.00 C ATOM 255 CD GLN A 18 3.551 -6.237 -10.186 1.00 0.00 C ATOM 256 OE1 GLN A 18 2.445 -6.064 -9.713 1.00 0.00 O ATOM 257 NE2 GLN A 18 3.677 -6.619 -11.428 1.00 0.00 N ATOM 0 H GLN A 18 6.527 -5.694 -6.625 1.00 0.00 H new ATOM 0 HA GLN A 18 6.911 -3.826 -8.853 1.00 0.00 H new ATOM 0 HB2 GLN A 18 4.028 -4.285 -8.300 1.00 0.00 H new ATOM 0 HB3 GLN A 18 4.830 -3.904 -9.811 1.00 0.00 H new ATOM 0 HG2 GLN A 18 5.694 -6.288 -9.907 1.00 0.00 H new ATOM 0 HG3 GLN A 18 4.779 -6.647 -8.455 1.00 0.00 H new ATOM 0 HE21 GLN A 18 4.605 -6.764 -11.825 1.00 0.00 H new ATOM 0 HE22 GLN A 18 2.847 -6.772 -12.001 1.00 0.00 H new ATOM 266 N ALA A 19 5.283 -2.185 -7.286 1.00 0.00 N ATOM 267 CA ALA A 19 4.967 -1.211 -6.202 1.00 0.00 C ATOM 268 C ALA A 19 4.468 0.089 -6.831 1.00 0.00 C ATOM 269 O ALA A 19 4.944 0.503 -7.870 1.00 0.00 O ATOM 270 CB ALA A 19 6.226 -0.928 -5.380 1.00 0.00 C ATOM 0 H ALA A 19 4.987 -1.903 -8.221 1.00 0.00 H new ATOM 0 HA ALA A 19 4.199 -1.626 -5.550 1.00 0.00 H new ATOM 0 HB1 ALA A 19 5.992 -0.216 -4.589 1.00 0.00 H new ATOM 0 HB2 ALA A 19 6.588 -1.856 -4.937 1.00 0.00 H new ATOM 0 HB3 ALA A 19 6.997 -0.510 -6.027 1.00 0.00 H new ATOM 276 N ALA A 20 3.512 0.736 -6.224 1.00 0.00 N ATOM 277 CA ALA A 20 2.999 2.001 -6.815 1.00 0.00 C ATOM 278 C ALA A 20 2.723 3.026 -5.716 1.00 0.00 C ATOM 279 O ALA A 20 1.730 2.954 -5.021 1.00 0.00 O ATOM 280 CB ALA A 20 1.702 1.716 -7.577 1.00 0.00 C ATOM 0 H ALA A 20 3.068 0.446 -5.353 1.00 0.00 H new ATOM 0 HA ALA A 20 3.750 2.403 -7.495 1.00 0.00 H new ATOM 0 HB1 ALA A 20 1.324 2.642 -8.011 1.00 0.00 H new ATOM 0 HB2 ALA A 20 1.898 0.996 -8.372 1.00 0.00 H new ATOM 0 HB3 ALA A 20 0.960 1.307 -6.892 1.00 0.00 H new ATOM 286 N ILE A 21 3.580 4.000 -5.570 1.00 0.00 N ATOM 287 CA ILE A 21 3.342 5.041 -4.536 1.00 0.00 C ATOM 288 C ILE A 21 2.322 6.023 -5.098 1.00 0.00 C ATOM 289 O ILE A 21 2.619 6.808 -5.978 1.00 0.00 O ATOM 290 CB ILE A 21 4.647 5.770 -4.215 1.00 0.00 C ATOM 291 CG1 ILE A 21 5.719 4.743 -3.852 1.00 0.00 C ATOM 292 CG2 ILE A 21 4.427 6.715 -3.033 1.00 0.00 C ATOM 293 CD1 ILE A 21 6.955 5.463 -3.310 1.00 0.00 C ATOM 0 H ILE A 21 4.431 4.118 -6.121 1.00 0.00 H new ATOM 0 HA ILE A 21 2.972 4.588 -3.616 1.00 0.00 H new ATOM 0 HB ILE A 21 4.968 6.346 -5.083 1.00 0.00 H new ATOM 0 HG12 ILE A 21 5.334 4.048 -3.106 1.00 0.00 H new ATOM 0 HG13 ILE A 21 5.984 4.153 -4.730 1.00 0.00 H new ATOM 0 HG21 ILE A 21 5.358 7.235 -2.804 1.00 0.00 H new ATOM 0 HG22 ILE A 21 3.658 7.444 -3.288 1.00 0.00 H new ATOM 0 HG23 ILE A 21 4.109 6.141 -2.163 1.00 0.00 H new ATOM 0 HD11 ILE A 21 7.719 4.730 -3.051 1.00 0.00 H new ATOM 0 HD12 ILE A 21 7.344 6.140 -4.070 1.00 0.00 H new ATOM 0 HD13 ILE A 21 6.684 6.033 -2.421 1.00 0.00 H new ATOM 305 N LEU A 22 1.115 5.963 -4.621 1.00 0.00 N ATOM 306 CA LEU A 22 0.062 6.867 -5.152 1.00 0.00 C ATOM 307 C LEU A 22 -0.014 8.126 -4.285 1.00 0.00 C ATOM 308 O LEU A 22 -0.318 8.068 -3.111 1.00 0.00 O ATOM 309 CB LEU A 22 -1.286 6.132 -5.141 1.00 0.00 C ATOM 310 CG LEU A 22 -1.059 4.615 -5.256 1.00 0.00 C ATOM 311 CD1 LEU A 22 -2.400 3.902 -5.433 1.00 0.00 C ATOM 312 CD2 LEU A 22 -0.166 4.309 -6.466 1.00 0.00 C ATOM 0 H LEU A 22 0.810 5.326 -3.885 1.00 0.00 H new ATOM 0 HA LEU A 22 0.303 7.158 -6.175 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -1.826 6.359 -4.221 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -1.906 6.479 -5.968 1.00 0.00 H new ATOM 0 HG LEU A 22 -0.573 4.263 -4.346 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -2.233 2.828 -5.514 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -3.037 4.106 -4.573 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -2.887 4.263 -6.339 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -0.010 3.233 -6.540 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -0.648 4.669 -7.375 1.00 0.00 H new ATOM 0 HD23 LEU A 22 0.796 4.807 -6.344 1.00 0.00 H new ATOM 324 N GLY A 23 0.272 9.266 -4.859 1.00 0.00 N ATOM 325 CA GLY A 23 0.227 10.534 -4.075 1.00 0.00 C ATOM 326 C GLY A 23 -1.097 10.627 -3.314 1.00 0.00 C ATOM 327 O GLY A 23 -1.920 9.735 -3.365 1.00 0.00 O ATOM 0 H GLY A 23 0.535 9.373 -5.839 1.00 0.00 H new ATOM 0 HA2 GLY A 23 1.062 10.569 -3.375 1.00 0.00 H new ATOM 0 HA3 GLY A 23 0.334 11.389 -4.743 1.00 0.00 H new ATOM 331 N LEU A 24 -1.306 11.701 -2.604 1.00 0.00 N ATOM 332 CA LEU A 24 -2.573 11.854 -1.833 1.00 0.00 C ATOM 333 C LEU A 24 -3.504 12.824 -2.565 1.00 0.00 C ATOM 334 O LEU A 24 -4.531 12.439 -3.087 1.00 0.00 O ATOM 335 CB LEU A 24 -2.261 12.406 -0.438 1.00 0.00 C ATOM 336 CG LEU A 24 -0.856 11.971 -0.014 1.00 0.00 C ATOM 337 CD1 LEU A 24 0.120 13.130 -0.220 1.00 0.00 C ATOM 338 CD2 LEU A 24 -0.870 11.571 1.462 1.00 0.00 C ATOM 0 H LEU A 24 -0.653 12.481 -2.524 1.00 0.00 H new ATOM 0 HA LEU A 24 -3.058 10.882 -1.740 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -2.329 13.494 -0.443 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -2.997 12.044 0.280 1.00 0.00 H new ATOM 0 HG LEU A 24 -0.541 11.120 -0.618 1.00 0.00 H new ATOM 0 HD11 LEU A 24 1.121 12.821 0.082 1.00 0.00 H new ATOM 0 HD12 LEU A 24 0.130 13.415 -1.272 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -0.194 13.982 0.383 1.00 0.00 H new ATOM 0 HD21 LEU A 24 0.130 11.261 1.764 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -1.185 12.422 2.067 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -1.566 10.745 1.608 1.00 0.00 H new ATOM 350 N ASP A 25 -3.153 14.080 -2.606 1.00 0.00 N ATOM 351 CA ASP A 25 -4.019 15.072 -3.300 1.00 0.00 C ATOM 352 C ASP A 25 -3.290 15.615 -4.532 1.00 0.00 C ATOM 353 O ASP A 25 -3.709 16.584 -5.136 1.00 0.00 O ATOM 354 CB ASP A 25 -4.339 16.225 -2.347 1.00 0.00 C ATOM 355 CG ASP A 25 -3.036 16.848 -1.844 1.00 0.00 C ATOM 356 OD1 ASP A 25 -2.505 17.701 -2.535 1.00 0.00 O ATOM 357 OD2 ASP A 25 -2.592 16.461 -0.775 1.00 0.00 O ATOM 0 H ASP A 25 -2.304 14.461 -2.189 1.00 0.00 H new ATOM 0 HA ASP A 25 -4.946 14.589 -3.611 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -4.940 16.977 -2.858 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -4.930 15.862 -1.506 1.00 0.00 H new ATOM 362 N GLY A 26 -2.205 14.997 -4.913 1.00 0.00 N ATOM 363 CA GLY A 26 -1.453 15.477 -6.107 1.00 0.00 C ATOM 364 C GLY A 26 -1.886 14.675 -7.336 1.00 0.00 C ATOM 365 O GLY A 26 -2.734 15.098 -8.096 1.00 0.00 O ATOM 0 H GLY A 26 -1.807 14.181 -4.449 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -1.642 16.539 -6.267 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -0.381 15.365 -5.945 1.00 0.00 H new ATOM 369 N ASN A 27 -1.311 13.520 -7.533 1.00 0.00 N ATOM 370 CA ASN A 27 -1.690 12.688 -8.709 1.00 0.00 C ATOM 371 C ASN A 27 -0.947 11.352 -8.647 1.00 0.00 C ATOM 372 O ASN A 27 -1.545 10.306 -8.496 1.00 0.00 O ATOM 373 CB ASN A 27 -1.318 13.421 -10.000 1.00 0.00 C ATOM 374 CG ASN A 27 -1.958 12.709 -11.193 1.00 0.00 C ATOM 375 OD1 ASN A 27 -2.993 12.086 -11.059 1.00 0.00 O ATOM 376 ND2 ASN A 27 -1.384 12.774 -12.363 1.00 0.00 N ATOM 0 H ASN A 27 -0.594 13.117 -6.929 1.00 0.00 H new ATOM 0 HA ASN A 27 -2.765 12.508 -8.694 1.00 0.00 H new ATOM 0 HB2 ASN A 27 -1.659 14.455 -9.955 1.00 0.00 H new ATOM 0 HB3 ASN A 27 -0.235 13.447 -10.117 1.00 0.00 H new ATOM 0 HD21 ASN A 27 -1.804 12.302 -13.164 1.00 0.00 H new ATOM 0 HD22 ASN A 27 -0.515 13.297 -12.477 1.00 0.00 H new ATOM 383 N THR A 28 0.354 11.377 -8.763 1.00 0.00 N ATOM 384 CA THR A 28 1.129 10.103 -8.708 1.00 0.00 C ATOM 385 C THR A 28 2.583 10.399 -8.334 1.00 0.00 C ATOM 386 O THR A 28 3.077 11.491 -8.535 1.00 0.00 O ATOM 387 CB THR A 28 1.087 9.423 -10.079 1.00 0.00 C ATOM 388 OG1 THR A 28 -0.263 9.293 -10.501 1.00 0.00 O ATOM 389 CG2 THR A 28 1.729 8.039 -9.981 1.00 0.00 C ATOM 0 H THR A 28 0.912 12.221 -8.893 1.00 0.00 H new ATOM 0 HA THR A 28 0.689 9.446 -7.958 1.00 0.00 H new ATOM 0 HB THR A 28 1.636 10.026 -10.802 1.00 0.00 H new ATOM 0 HG1 THR A 28 -0.851 9.276 -9.717 1.00 0.00 H new ATOM 0 HG21 THR A 28 1.699 7.554 -10.957 1.00 0.00 H new ATOM 0 HG22 THR A 28 2.765 8.141 -9.658 1.00 0.00 H new ATOM 0 HG23 THR A 28 1.181 7.434 -9.259 1.00 0.00 H new ATOM 397 N TRP A 29 3.275 9.432 -7.791 1.00 0.00 N ATOM 398 CA TRP A 29 4.699 9.654 -7.406 1.00 0.00 C ATOM 399 C TRP A 29 5.601 8.764 -8.264 1.00 0.00 C ATOM 400 O TRP A 29 6.326 9.233 -9.118 1.00 0.00 O ATOM 401 CB TRP A 29 4.898 9.294 -5.931 1.00 0.00 C ATOM 402 CG TRP A 29 4.595 10.480 -5.073 1.00 0.00 C ATOM 403 CD1 TRP A 29 3.515 11.283 -5.212 1.00 0.00 C ATOM 404 CD2 TRP A 29 5.357 11.006 -3.948 1.00 0.00 C ATOM 405 NE1 TRP A 29 3.566 12.269 -4.243 1.00 0.00 N ATOM 406 CE2 TRP A 29 4.683 12.142 -3.440 1.00 0.00 C ATOM 407 CE3 TRP A 29 6.555 10.614 -3.325 1.00 0.00 C ATOM 408 CZ2 TRP A 29 5.178 12.861 -2.353 1.00 0.00 C ATOM 409 CZ3 TRP A 29 7.058 11.336 -2.229 1.00 0.00 C ATOM 410 CH2 TRP A 29 6.370 12.458 -1.744 1.00 0.00 C ATOM 0 H TRP A 29 2.915 8.498 -7.598 1.00 0.00 H new ATOM 0 HA TRP A 29 4.954 10.702 -7.563 1.00 0.00 H new ATOM 0 HB2 TRP A 29 4.248 8.462 -5.660 1.00 0.00 H new ATOM 0 HB3 TRP A 29 5.923 8.965 -5.763 1.00 0.00 H new ATOM 0 HD1 TRP A 29 2.741 11.172 -5.957 1.00 0.00 H new ATOM 0 HE1 TRP A 29 2.864 13.001 -4.135 1.00 0.00 H new ATOM 0 HE3 TRP A 29 7.093 9.752 -3.691 1.00 0.00 H new ATOM 0 HZ2 TRP A 29 4.644 13.724 -1.984 1.00 0.00 H new ATOM 0 HZ3 TRP A 29 7.979 11.025 -1.758 1.00 0.00 H new ATOM 0 HH2 TRP A 29 6.760 13.010 -0.902 1.00 0.00 H new ATOM 421 N ALA A 30 5.556 7.480 -8.043 1.00 0.00 N ATOM 422 CA ALA A 30 6.403 6.552 -8.842 1.00 0.00 C ATOM 423 C ALA A 30 5.832 5.138 -8.736 1.00 0.00 C ATOM 424 O ALA A 30 5.758 4.568 -7.665 1.00 0.00 O ATOM 425 CB ALA A 30 7.834 6.571 -8.300 1.00 0.00 C ATOM 0 H ALA A 30 4.967 7.032 -7.341 1.00 0.00 H new ATOM 0 HA ALA A 30 6.411 6.867 -9.886 1.00 0.00 H new ATOM 0 HB1 ALA A 30 8.454 5.892 -8.885 1.00 0.00 H new ATOM 0 HB2 ALA A 30 8.237 7.581 -8.371 1.00 0.00 H new ATOM 0 HB3 ALA A 30 7.832 6.254 -7.257 1.00 0.00 H new ATOM 431 N THR A 31 5.419 4.569 -9.835 1.00 0.00 N ATOM 432 CA THR A 31 4.845 3.195 -9.787 1.00 0.00 C ATOM 433 C THR A 31 5.537 2.308 -10.822 1.00 0.00 C ATOM 434 O THR A 31 6.270 2.776 -11.670 1.00 0.00 O ATOM 435 CB THR A 31 3.345 3.260 -10.087 1.00 0.00 C ATOM 436 OG1 THR A 31 3.143 3.215 -11.493 1.00 0.00 O ATOM 437 CG2 THR A 31 2.766 4.561 -9.527 1.00 0.00 C ATOM 0 H THR A 31 5.454 4.995 -10.761 1.00 0.00 H new ATOM 0 HA THR A 31 5.000 2.773 -8.794 1.00 0.00 H new ATOM 0 HB THR A 31 2.843 2.412 -9.620 1.00 0.00 H new ATOM 0 HG1 THR A 31 2.183 3.255 -11.687 1.00 0.00 H new ATOM 0 HG21 THR A 31 1.698 4.606 -9.741 1.00 0.00 H new ATOM 0 HG22 THR A 31 2.921 4.594 -8.449 1.00 0.00 H new ATOM 0 HG23 THR A 31 3.265 5.411 -9.992 1.00 0.00 H new ATOM 445 N SER A 32 5.311 1.024 -10.754 1.00 0.00 N ATOM 446 CA SER A 32 5.953 0.097 -11.726 1.00 0.00 C ATOM 447 C SER A 32 5.362 -1.303 -11.553 1.00 0.00 C ATOM 448 O SER A 32 5.754 -2.049 -10.678 1.00 0.00 O ATOM 449 CB SER A 32 7.458 0.051 -11.466 1.00 0.00 C ATOM 450 OG SER A 32 8.118 0.941 -12.356 1.00 0.00 O ATOM 0 H SER A 32 4.707 0.577 -10.064 1.00 0.00 H new ATOM 0 HA SER A 32 5.771 0.447 -12.742 1.00 0.00 H new ATOM 0 HB2 SER A 32 7.669 0.329 -10.433 1.00 0.00 H new ATOM 0 HB3 SER A 32 7.831 -0.964 -11.605 1.00 0.00 H new ATOM 0 HG SER A 32 7.656 1.805 -12.356 1.00 0.00 H new ATOM 456 N ALA A 33 4.418 -1.666 -12.377 1.00 0.00 N ATOM 457 CA ALA A 33 3.801 -3.015 -12.255 1.00 0.00 C ATOM 458 C ALA A 33 2.981 -3.316 -13.511 1.00 0.00 C ATOM 459 O ALA A 33 3.315 -4.188 -14.289 1.00 0.00 O ATOM 460 CB ALA A 33 2.888 -3.046 -11.027 1.00 0.00 C ATOM 0 H ALA A 33 4.048 -1.086 -13.130 1.00 0.00 H new ATOM 0 HA ALA A 33 4.583 -3.766 -12.145 1.00 0.00 H new ATOM 0 HB1 ALA A 33 2.435 -4.033 -10.935 1.00 0.00 H new ATOM 0 HB2 ALA A 33 3.473 -2.831 -10.133 1.00 0.00 H new ATOM 0 HB3 ALA A 33 2.105 -2.296 -11.137 1.00 0.00 H new ATOM 466 N GLY A 34 1.910 -2.599 -13.715 1.00 0.00 N ATOM 467 CA GLY A 34 1.069 -2.842 -14.921 1.00 0.00 C ATOM 468 C GLY A 34 -0.408 -2.756 -14.536 1.00 0.00 C ATOM 469 O GLY A 34 -1.227 -3.523 -15.001 1.00 0.00 O ATOM 0 H GLY A 34 1.581 -1.856 -13.099 1.00 0.00 H new ATOM 0 HA2 GLY A 34 1.299 -2.107 -15.692 1.00 0.00 H new ATOM 0 HA3 GLY A 34 1.290 -3.823 -15.340 1.00 0.00 H new ATOM 473 N PHE A 35 -0.757 -1.826 -13.687 1.00 0.00 N ATOM 474 CA PHE A 35 -2.181 -1.691 -13.271 1.00 0.00 C ATOM 475 C PHE A 35 -2.441 -0.257 -12.806 1.00 0.00 C ATOM 476 O PHE A 35 -1.854 0.211 -11.851 1.00 0.00 O ATOM 477 CB PHE A 35 -2.473 -2.666 -12.127 1.00 0.00 C ATOM 478 CG PHE A 35 -1.814 -2.178 -10.859 1.00 0.00 C ATOM 479 CD1 PHE A 35 -0.433 -1.950 -10.828 1.00 0.00 C ATOM 480 CD2 PHE A 35 -2.584 -1.953 -9.712 1.00 0.00 C ATOM 481 CE1 PHE A 35 0.177 -1.499 -9.652 1.00 0.00 C ATOM 482 CE2 PHE A 35 -1.975 -1.501 -8.536 1.00 0.00 C ATOM 483 CZ PHE A 35 -0.594 -1.274 -8.506 1.00 0.00 C ATOM 0 H PHE A 35 -0.116 -1.154 -13.264 1.00 0.00 H new ATOM 0 HA PHE A 35 -2.832 -1.921 -14.115 1.00 0.00 H new ATOM 0 HB2 PHE A 35 -3.549 -2.754 -11.978 1.00 0.00 H new ATOM 0 HB3 PHE A 35 -2.104 -3.660 -12.381 1.00 0.00 H new ATOM 0 HD1 PHE A 35 0.162 -2.122 -11.713 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -3.649 -2.128 -9.735 1.00 0.00 H new ATOM 0 HE1 PHE A 35 1.243 -1.325 -9.629 1.00 0.00 H new ATOM 0 HE2 PHE A 35 -2.570 -1.327 -7.652 1.00 0.00 H new ATOM 0 HZ PHE A 35 -0.124 -0.925 -7.599 1.00 0.00 H new ATOM 493 N ALA A 36 -3.314 0.445 -13.474 1.00 0.00 N ATOM 494 CA ALA A 36 -3.608 1.848 -13.069 1.00 0.00 C ATOM 495 C ALA A 36 -4.833 1.870 -12.153 1.00 0.00 C ATOM 496 O ALA A 36 -5.858 1.292 -12.457 1.00 0.00 O ATOM 497 CB ALA A 36 -3.888 2.690 -14.316 1.00 0.00 C ATOM 0 H ALA A 36 -3.836 0.108 -14.283 1.00 0.00 H new ATOM 0 HA ALA A 36 -2.750 2.260 -12.537 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -4.103 3.717 -14.021 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -3.015 2.675 -14.968 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -4.745 2.278 -14.848 1.00 0.00 H new ATOM 503 N VAL A 37 -4.734 2.534 -11.035 1.00 0.00 N ATOM 504 CA VAL A 37 -5.892 2.594 -10.100 1.00 0.00 C ATOM 505 C VAL A 37 -6.752 3.813 -10.436 1.00 0.00 C ATOM 506 O VAL A 37 -6.312 4.732 -11.098 1.00 0.00 O ATOM 507 CB VAL A 37 -5.381 2.716 -8.663 1.00 0.00 C ATOM 508 CG1 VAL A 37 -6.492 2.309 -7.693 1.00 0.00 C ATOM 509 CG2 VAL A 37 -4.172 1.797 -8.468 1.00 0.00 C ATOM 0 H VAL A 37 -3.902 3.038 -10.728 1.00 0.00 H new ATOM 0 HA VAL A 37 -6.488 1.687 -10.200 1.00 0.00 H new ATOM 0 HB VAL A 37 -5.086 3.747 -8.469 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -6.130 2.395 -6.668 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -7.353 2.964 -7.830 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -6.786 1.278 -7.888 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -3.809 1.885 -7.444 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -4.464 0.765 -8.662 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -3.380 2.086 -9.159 1.00 0.00 H new ATOM 519 N THR A 38 -7.975 3.830 -9.983 1.00 0.00 N ATOM 520 CA THR A 38 -8.859 4.993 -10.275 1.00 0.00 C ATOM 521 C THR A 38 -8.427 6.186 -9.415 1.00 0.00 C ATOM 522 O THR A 38 -7.949 6.011 -8.313 1.00 0.00 O ATOM 523 CB THR A 38 -10.309 4.624 -9.955 1.00 0.00 C ATOM 524 OG1 THR A 38 -10.330 3.692 -8.881 1.00 0.00 O ATOM 525 CG2 THR A 38 -10.963 4.001 -11.189 1.00 0.00 C ATOM 0 H THR A 38 -8.400 3.090 -9.424 1.00 0.00 H new ATOM 0 HA THR A 38 -8.780 5.259 -11.329 1.00 0.00 H new ATOM 0 HB THR A 38 -10.860 5.520 -9.670 1.00 0.00 H new ATOM 0 HG1 THR A 38 -11.258 3.455 -8.672 1.00 0.00 H new ATOM 0 HG21 THR A 38 -11.996 3.738 -10.960 1.00 0.00 H new ATOM 0 HG22 THR A 38 -10.944 4.716 -12.011 1.00 0.00 H new ATOM 0 HG23 THR A 38 -10.416 3.103 -11.477 1.00 0.00 H new ATOM 533 N PRO A 39 -8.604 7.367 -9.951 1.00 0.00 N ATOM 534 CA PRO A 39 -8.234 8.609 -9.250 1.00 0.00 C ATOM 535 C PRO A 39 -9.059 8.764 -7.970 1.00 0.00 C ATOM 536 O PRO A 39 -8.604 9.317 -6.989 1.00 0.00 O ATOM 537 CB PRO A 39 -8.563 9.733 -10.244 1.00 0.00 C ATOM 538 CG PRO A 39 -9.163 9.080 -11.514 1.00 0.00 C ATOM 539 CD PRO A 39 -9.184 7.560 -11.292 1.00 0.00 C ATOM 0 HA PRO A 39 -7.186 8.619 -8.951 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -9.271 10.436 -9.805 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -7.665 10.298 -10.493 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -10.170 9.454 -11.697 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -8.566 9.330 -12.391 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -10.199 7.167 -11.344 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -8.602 7.041 -12.053 1.00 0.00 H new ATOM 547 N ALA A 40 -10.274 8.282 -7.973 1.00 0.00 N ATOM 548 CA ALA A 40 -11.130 8.409 -6.758 1.00 0.00 C ATOM 549 C ALA A 40 -10.798 7.297 -5.755 1.00 0.00 C ATOM 550 O ALA A 40 -11.528 7.067 -4.813 1.00 0.00 O ATOM 551 CB ALA A 40 -12.601 8.304 -7.163 1.00 0.00 C ATOM 0 H ALA A 40 -10.710 7.807 -8.763 1.00 0.00 H new ATOM 0 HA ALA A 40 -10.941 9.375 -6.290 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -13.230 8.396 -6.277 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -12.843 9.102 -7.865 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -12.780 7.338 -7.636 1.00 0.00 H new ATOM 557 N GLN A 41 -9.705 6.605 -5.942 1.00 0.00 N ATOM 558 CA GLN A 41 -9.345 5.518 -4.988 1.00 0.00 C ATOM 559 C GLN A 41 -8.471 6.090 -3.868 1.00 0.00 C ATOM 560 O GLN A 41 -8.519 5.643 -2.741 1.00 0.00 O ATOM 561 CB GLN A 41 -8.574 4.420 -5.726 1.00 0.00 C ATOM 562 CG GLN A 41 -9.361 3.110 -5.658 1.00 0.00 C ATOM 563 CD GLN A 41 -9.294 2.545 -4.239 1.00 0.00 C ATOM 564 OE1 GLN A 41 -8.291 2.681 -3.565 1.00 0.00 O ATOM 565 NE2 GLN A 41 -10.325 1.910 -3.752 1.00 0.00 N ATOM 0 H GLN A 41 -9.049 6.745 -6.711 1.00 0.00 H new ATOM 0 HA GLN A 41 -10.255 5.096 -4.561 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -8.416 4.708 -6.765 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -7.589 4.289 -5.278 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -10.399 3.282 -5.943 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -8.951 2.390 -6.367 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -11.167 1.795 -4.317 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -10.289 1.528 -2.807 1.00 0.00 H new ATOM 574 N GLY A 42 -7.671 7.077 -4.173 1.00 0.00 N ATOM 575 CA GLY A 42 -6.795 7.676 -3.126 1.00 0.00 C ATOM 576 C GLY A 42 -7.659 8.257 -2.005 1.00 0.00 C ATOM 577 O GLY A 42 -7.403 8.048 -0.837 1.00 0.00 O ATOM 0 H GLY A 42 -7.587 7.493 -5.100 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -6.121 6.919 -2.724 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -6.173 8.458 -3.562 1.00 0.00 H new ATOM 581 N GLN A 43 -8.682 8.987 -2.354 1.00 0.00 N ATOM 582 CA GLN A 43 -9.564 9.582 -1.311 1.00 0.00 C ATOM 583 C GLN A 43 -10.211 8.463 -0.494 1.00 0.00 C ATOM 584 O GLN A 43 -10.654 8.670 0.618 1.00 0.00 O ATOM 585 CB GLN A 43 -10.651 10.421 -1.984 1.00 0.00 C ATOM 586 CG GLN A 43 -11.447 9.546 -2.953 1.00 0.00 C ATOM 587 CD GLN A 43 -12.910 9.498 -2.512 1.00 0.00 C ATOM 588 OE1 GLN A 43 -13.733 10.235 -3.017 1.00 0.00 O ATOM 589 NE2 GLN A 43 -13.272 8.654 -1.584 1.00 0.00 N ATOM 0 H GLN A 43 -8.945 9.197 -3.317 1.00 0.00 H new ATOM 0 HA GLN A 43 -8.973 10.217 -0.651 1.00 0.00 H new ATOM 0 HB2 GLN A 43 -11.315 10.845 -1.231 1.00 0.00 H new ATOM 0 HB3 GLN A 43 -10.200 11.257 -2.519 1.00 0.00 H new ATOM 0 HG2 GLN A 43 -11.374 9.946 -3.964 1.00 0.00 H new ATOM 0 HG3 GLN A 43 -11.030 8.539 -2.977 1.00 0.00 H new ATOM 0 HE21 GLN A 43 -12.581 8.035 -1.160 1.00 0.00 H new ATOM 0 HE22 GLN A 43 -14.246 8.614 -1.283 1.00 0.00 H new ATOM 598 N THR A 44 -10.268 7.277 -1.036 1.00 0.00 N ATOM 599 CA THR A 44 -10.884 6.146 -0.288 1.00 0.00 C ATOM 600 C THR A 44 -10.000 5.789 0.906 1.00 0.00 C ATOM 601 O THR A 44 -10.480 5.411 1.956 1.00 0.00 O ATOM 602 CB THR A 44 -11.010 4.930 -1.211 1.00 0.00 C ATOM 603 OG1 THR A 44 -11.944 5.216 -2.241 1.00 0.00 O ATOM 604 CG2 THR A 44 -11.490 3.723 -0.404 1.00 0.00 C ATOM 0 H THR A 44 -9.915 7.043 -1.964 1.00 0.00 H new ATOM 0 HA THR A 44 -11.874 6.438 0.064 1.00 0.00 H new ATOM 0 HB THR A 44 -10.039 4.705 -1.653 1.00 0.00 H new ATOM 0 HG1 THR A 44 -11.539 5.829 -2.889 1.00 0.00 H new ATOM 0 HG21 THR A 44 -11.579 2.858 -1.061 1.00 0.00 H new ATOM 0 HG22 THR A 44 -10.772 3.505 0.387 1.00 0.00 H new ATOM 0 HG23 THR A 44 -12.461 3.944 0.039 1.00 0.00 H new ATOM 612 N LEU A 45 -8.708 5.909 0.753 1.00 0.00 N ATOM 613 CA LEU A 45 -7.791 5.580 1.879 1.00 0.00 C ATOM 614 C LEU A 45 -7.940 6.631 2.981 1.00 0.00 C ATOM 615 O LEU A 45 -7.973 6.314 4.153 1.00 0.00 O ATOM 616 CB LEU A 45 -6.347 5.568 1.376 1.00 0.00 C ATOM 617 CG LEU A 45 -5.911 4.125 1.117 1.00 0.00 C ATOM 618 CD1 LEU A 45 -5.313 4.013 -0.285 1.00 0.00 C ATOM 619 CD2 LEU A 45 -4.862 3.714 2.152 1.00 0.00 C ATOM 0 H LEU A 45 -8.250 6.221 -0.103 1.00 0.00 H new ATOM 0 HA LEU A 45 -8.043 4.597 2.277 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -6.264 6.154 0.461 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -5.690 6.031 2.112 1.00 0.00 H new ATOM 0 HG LEU A 45 -6.777 3.467 1.195 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -5.003 2.984 -0.467 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -6.060 4.303 -1.024 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -4.448 4.672 -0.366 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -4.552 2.686 1.967 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -3.997 4.373 2.075 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -5.289 3.790 3.152 1.00 0.00 H new ATOM 631 N ALA A 46 -8.036 7.880 2.615 1.00 0.00 N ATOM 632 CA ALA A 46 -8.190 8.944 3.644 1.00 0.00 C ATOM 633 C ALA A 46 -9.499 8.720 4.400 1.00 0.00 C ATOM 634 O ALA A 46 -9.545 8.774 5.612 1.00 0.00 O ATOM 635 CB ALA A 46 -8.216 10.315 2.965 1.00 0.00 C ATOM 0 H ALA A 46 -8.014 8.208 1.649 1.00 0.00 H new ATOM 0 HA ALA A 46 -7.352 8.907 4.341 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -8.329 11.093 3.720 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -7.284 10.469 2.421 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -9.054 10.361 2.269 1.00 0.00 H new ATOM 641 N SER A 47 -10.563 8.457 3.691 1.00 0.00 N ATOM 642 CA SER A 47 -11.868 8.217 4.367 1.00 0.00 C ATOM 643 C SER A 47 -11.919 6.769 4.858 1.00 0.00 C ATOM 644 O SER A 47 -12.845 6.368 5.536 1.00 0.00 O ATOM 645 CB SER A 47 -13.010 8.462 3.380 1.00 0.00 C ATOM 646 OG SER A 47 -12.644 7.960 2.102 1.00 0.00 O ATOM 0 H SER A 47 -10.584 8.398 2.673 1.00 0.00 H new ATOM 0 HA SER A 47 -11.973 8.896 5.213 1.00 0.00 H new ATOM 0 HB2 SER A 47 -13.919 7.972 3.729 1.00 0.00 H new ATOM 0 HB3 SER A 47 -13.228 9.528 3.316 1.00 0.00 H new ATOM 0 HG SER A 47 -12.119 8.635 1.623 1.00 0.00 H new ATOM 652 N ALA A 48 -10.933 5.981 4.525 1.00 0.00 N ATOM 653 CA ALA A 48 -10.928 4.564 4.978 1.00 0.00 C ATOM 654 C ALA A 48 -10.710 4.520 6.491 1.00 0.00 C ATOM 655 O ALA A 48 -11.290 3.714 7.190 1.00 0.00 O ATOM 656 CB ALA A 48 -9.797 3.807 4.277 1.00 0.00 C ATOM 0 H ALA A 48 -10.131 6.259 3.959 1.00 0.00 H new ATOM 0 HA ALA A 48 -11.882 4.098 4.731 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -9.794 2.769 4.609 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -9.949 3.842 3.198 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -8.842 4.270 4.524 1.00 0.00 H new ATOM 662 N PHE A 49 -9.877 5.387 7.002 1.00 0.00 N ATOM 663 CA PHE A 49 -9.623 5.398 8.470 1.00 0.00 C ATOM 664 C PHE A 49 -10.820 6.019 9.191 1.00 0.00 C ATOM 665 O PHE A 49 -10.813 7.183 9.539 1.00 0.00 O ATOM 666 CB PHE A 49 -8.369 6.223 8.769 1.00 0.00 C ATOM 667 CG PHE A 49 -7.193 5.691 7.978 1.00 0.00 C ATOM 668 CD1 PHE A 49 -7.304 4.496 7.254 1.00 0.00 C ATOM 669 CD2 PHE A 49 -5.986 6.399 7.973 1.00 0.00 C ATOM 670 CE1 PHE A 49 -6.209 4.013 6.527 1.00 0.00 C ATOM 671 CE2 PHE A 49 -4.892 5.916 7.246 1.00 0.00 C ATOM 672 CZ PHE A 49 -5.004 4.724 6.523 1.00 0.00 C ATOM 0 H PHE A 49 -9.363 6.086 6.467 1.00 0.00 H new ATOM 0 HA PHE A 49 -9.477 4.375 8.817 1.00 0.00 H new ATOM 0 HB2 PHE A 49 -8.544 7.269 8.516 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -8.146 6.186 9.835 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -8.234 3.948 7.257 1.00 0.00 H new ATOM 0 HD2 PHE A 49 -5.899 7.320 8.531 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -6.295 3.092 5.970 1.00 0.00 H new ATOM 0 HE2 PHE A 49 -3.961 6.464 7.243 1.00 0.00 H new ATOM 0 HZ PHE A 49 -4.160 4.352 5.961 1.00 0.00 H new ATOM 682 N ASN A 50 -11.845 5.250 9.421 1.00 0.00 N ATOM 683 CA ASN A 50 -13.040 5.790 10.124 1.00 0.00 C ATOM 684 C ASN A 50 -13.413 4.839 11.258 1.00 0.00 C ATOM 685 O ASN A 50 -14.508 4.313 11.309 1.00 0.00 O ATOM 686 CB ASN A 50 -14.202 5.904 9.139 1.00 0.00 C ATOM 687 CG ASN A 50 -15.117 7.055 9.558 1.00 0.00 C ATOM 688 OD1 ASN A 50 -16.238 6.836 9.973 1.00 0.00 O ATOM 689 ND2 ASN A 50 -14.685 8.284 9.465 1.00 0.00 N ATOM 0 H ASN A 50 -11.907 4.268 9.152 1.00 0.00 H new ATOM 0 HA ASN A 50 -12.821 6.778 10.530 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -13.823 6.076 8.132 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -14.764 4.970 9.113 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -15.288 9.059 9.741 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -13.744 8.469 9.117 1.00 0.00 H new ATOM 696 N ASN A 51 -12.496 4.613 12.157 1.00 0.00 N ATOM 697 CA ASN A 51 -12.749 3.691 13.304 1.00 0.00 C ATOM 698 C ASN A 51 -12.464 2.256 12.865 1.00 0.00 C ATOM 699 O ASN A 51 -12.883 1.304 13.492 1.00 0.00 O ATOM 700 CB ASN A 51 -14.204 3.812 13.766 1.00 0.00 C ATOM 701 CG ASN A 51 -14.323 3.352 15.220 1.00 0.00 C ATOM 702 OD1 ASN A 51 -15.140 2.511 15.539 1.00 0.00 O ATOM 703 ND2 ASN A 51 -13.535 3.871 16.121 1.00 0.00 N ATOM 0 H ASN A 51 -11.567 5.034 12.147 1.00 0.00 H new ATOM 0 HA ASN A 51 -12.095 3.959 14.134 1.00 0.00 H new ATOM 0 HB2 ASN A 51 -14.541 4.844 13.672 1.00 0.00 H new ATOM 0 HB3 ASN A 51 -14.849 3.207 13.129 1.00 0.00 H new ATOM 0 HD21 ASN A 51 -13.605 3.571 17.093 1.00 0.00 H new ATOM 0 HD22 ASN A 51 -12.849 4.577 15.853 1.00 0.00 H new ATOM 710 N ALA A 52 -11.745 2.099 11.789 1.00 0.00 N ATOM 711 CA ALA A 52 -11.413 0.732 11.289 1.00 0.00 C ATOM 712 C ALA A 52 -12.654 -0.165 11.340 1.00 0.00 C ATOM 713 O ALA A 52 -12.553 -1.374 11.401 1.00 0.00 O ATOM 714 CB ALA A 52 -10.314 0.127 12.165 1.00 0.00 C ATOM 0 H ALA A 52 -11.369 2.864 11.229 1.00 0.00 H new ATOM 0 HA ALA A 52 -11.069 0.804 10.257 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -10.069 -0.871 11.803 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -9.426 0.757 12.121 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -10.664 0.064 13.195 1.00 0.00 H new ATOM 720 N ASP A 53 -13.824 0.413 11.321 1.00 0.00 N ATOM 721 CA ASP A 53 -15.060 -0.415 11.377 1.00 0.00 C ATOM 722 C ASP A 53 -15.551 -0.752 9.960 1.00 0.00 C ATOM 723 O ASP A 53 -15.771 -1.906 9.650 1.00 0.00 O ATOM 724 CB ASP A 53 -16.152 0.348 12.128 1.00 0.00 C ATOM 725 CG ASP A 53 -16.306 -0.236 13.534 1.00 0.00 C ATOM 726 OD1 ASP A 53 -15.442 0.017 14.358 1.00 0.00 O ATOM 727 OD2 ASP A 53 -17.287 -0.926 13.764 1.00 0.00 O ATOM 0 H ASP A 53 -13.976 1.420 11.269 1.00 0.00 H new ATOM 0 HA ASP A 53 -14.834 -1.345 11.898 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -15.896 1.406 12.188 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -17.096 0.279 11.588 1.00 0.00 H new ATOM 732 N PRO A 54 -15.731 0.260 9.146 1.00 0.00 N ATOM 733 CA PRO A 54 -16.221 0.076 7.766 1.00 0.00 C ATOM 734 C PRO A 54 -15.203 -0.701 6.921 1.00 0.00 C ATOM 735 O PRO A 54 -15.478 -1.071 5.797 1.00 0.00 O ATOM 736 CB PRO A 54 -16.396 1.499 7.218 1.00 0.00 C ATOM 737 CG PRO A 54 -15.969 2.487 8.332 1.00 0.00 C ATOM 738 CD PRO A 54 -15.466 1.660 9.524 1.00 0.00 C ATOM 0 HA PRO A 54 -17.148 -0.497 7.737 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -15.788 1.643 6.325 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -17.432 1.673 6.929 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -15.186 3.154 7.972 1.00 0.00 H new ATOM 0 HG3 PRO A 54 -16.809 3.114 8.629 1.00 0.00 H new ATOM 0 HD2 PRO A 54 -14.404 1.828 9.702 1.00 0.00 H new ATOM 0 HD3 PRO A 54 -15.990 1.928 10.441 1.00 0.00 H new ATOM 746 N ILE A 55 -14.032 -0.949 7.442 1.00 0.00 N ATOM 747 CA ILE A 55 -13.014 -1.699 6.645 1.00 0.00 C ATOM 748 C ILE A 55 -12.832 -3.101 7.232 1.00 0.00 C ATOM 749 O ILE A 55 -12.303 -3.987 6.590 1.00 0.00 O ATOM 750 CB ILE A 55 -11.663 -0.966 6.662 1.00 0.00 C ATOM 751 CG1 ILE A 55 -11.755 0.318 7.495 1.00 0.00 C ATOM 752 CG2 ILE A 55 -11.265 -0.607 5.230 1.00 0.00 C ATOM 753 CD1 ILE A 55 -10.499 1.163 7.266 1.00 0.00 C ATOM 0 H ILE A 55 -13.736 -0.668 8.377 1.00 0.00 H new ATOM 0 HA ILE A 55 -13.365 -1.769 5.616 1.00 0.00 H new ATOM 0 HB ILE A 55 -10.915 -1.622 7.108 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -12.644 0.884 7.215 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -11.854 0.072 8.552 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -10.307 -0.087 5.238 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -11.178 -1.518 4.637 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -12.025 0.040 4.792 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -10.562 2.076 7.857 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -9.619 0.596 7.568 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -10.421 1.419 6.209 1.00 0.00 H new ATOM 765 N ARG A 56 -13.264 -3.310 8.443 1.00 0.00 N ATOM 766 CA ARG A 56 -13.114 -4.654 9.068 1.00 0.00 C ATOM 767 C ARG A 56 -14.224 -5.579 8.561 1.00 0.00 C ATOM 768 O ARG A 56 -13.980 -6.706 8.177 1.00 0.00 O ATOM 769 CB ARG A 56 -13.214 -4.522 10.589 1.00 0.00 C ATOM 770 CG ARG A 56 -12.087 -5.322 11.246 1.00 0.00 C ATOM 771 CD ARG A 56 -11.745 -4.705 12.602 1.00 0.00 C ATOM 772 NE ARG A 56 -11.623 -5.786 13.631 1.00 0.00 N ATOM 773 CZ ARG A 56 -12.556 -6.693 13.777 1.00 0.00 C ATOM 774 NH1 ARG A 56 -13.699 -6.580 13.152 1.00 0.00 N ATOM 775 NH2 ARG A 56 -12.365 -7.691 14.596 1.00 0.00 N ATOM 0 H ARG A 56 -13.715 -2.607 9.029 1.00 0.00 H new ATOM 0 HA ARG A 56 -12.143 -5.073 8.803 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -13.147 -3.473 10.879 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -14.182 -4.887 10.933 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -12.391 -6.361 11.374 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -11.206 -5.325 10.604 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -10.811 -4.147 12.534 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -12.519 -3.996 12.895 1.00 0.00 H new ATOM 0 HE ARG A 56 -10.798 -5.816 14.229 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -13.871 -5.780 12.544 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -14.419 -7.292 13.273 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -11.492 -7.762 15.119 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -13.089 -8.400 14.713 1.00 0.00 H new ATOM 789 N ALA A 57 -15.444 -5.111 8.556 1.00 0.00 N ATOM 790 CA ALA A 57 -16.566 -5.964 8.073 1.00 0.00 C ATOM 791 C ALA A 57 -17.039 -5.461 6.708 1.00 0.00 C ATOM 792 O ALA A 57 -18.163 -5.029 6.550 1.00 0.00 O ATOM 793 CB ALA A 57 -17.724 -5.894 9.070 1.00 0.00 C ATOM 0 H ALA A 57 -15.711 -4.176 8.865 1.00 0.00 H new ATOM 0 HA ALA A 57 -16.225 -6.995 7.982 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -18.546 -6.518 8.718 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -17.388 -6.252 10.043 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -18.064 -4.862 9.160 1.00 0.00 H new ATOM 799 N SER A 58 -16.190 -5.518 5.722 1.00 0.00 N ATOM 800 CA SER A 58 -16.587 -5.046 4.366 1.00 0.00 C ATOM 801 C SER A 58 -15.344 -4.932 3.483 1.00 0.00 C ATOM 802 O SER A 58 -15.404 -5.113 2.283 1.00 0.00 O ATOM 803 CB SER A 58 -17.257 -3.676 4.476 1.00 0.00 C ATOM 804 OG SER A 58 -17.217 -3.031 3.208 1.00 0.00 O ATOM 0 H SER A 58 -15.236 -5.872 5.796 1.00 0.00 H new ATOM 0 HA SER A 58 -17.285 -5.758 3.925 1.00 0.00 H new ATOM 0 HB2 SER A 58 -18.289 -3.789 4.807 1.00 0.00 H new ATOM 0 HB3 SER A 58 -16.747 -3.068 5.223 1.00 0.00 H new ATOM 0 HG SER A 58 -17.647 -2.153 3.274 1.00 0.00 H new ATOM 810 N GLY A 59 -14.217 -4.632 4.067 1.00 0.00 N ATOM 811 CA GLY A 59 -12.970 -4.506 3.262 1.00 0.00 C ATOM 812 C GLY A 59 -13.155 -3.417 2.203 1.00 0.00 C ATOM 813 O GLY A 59 -13.933 -2.499 2.371 1.00 0.00 O ATOM 0 H GLY A 59 -14.106 -4.469 5.068 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -12.129 -4.259 3.910 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -12.735 -5.457 2.784 1.00 0.00 H new ATOM 817 N PHE A 60 -12.446 -3.511 1.113 1.00 0.00 N ATOM 818 CA PHE A 60 -12.584 -2.484 0.042 1.00 0.00 C ATOM 819 C PHE A 60 -12.257 -3.120 -1.308 1.00 0.00 C ATOM 820 O PHE A 60 -12.140 -4.323 -1.423 1.00 0.00 O ATOM 821 CB PHE A 60 -11.621 -1.325 0.313 1.00 0.00 C ATOM 822 CG PHE A 60 -10.225 -1.861 0.512 1.00 0.00 C ATOM 823 CD1 PHE A 60 -9.537 -2.434 -0.564 1.00 0.00 C ATOM 824 CD2 PHE A 60 -9.617 -1.782 1.770 1.00 0.00 C ATOM 825 CE1 PHE A 60 -8.241 -2.929 -0.381 1.00 0.00 C ATOM 826 CE2 PHE A 60 -8.321 -2.278 1.953 1.00 0.00 C ATOM 827 CZ PHE A 60 -7.633 -2.852 0.878 1.00 0.00 C ATOM 0 H PHE A 60 -11.776 -4.255 0.917 1.00 0.00 H new ATOM 0 HA PHE A 60 -13.605 -2.104 0.029 1.00 0.00 H new ATOM 0 HB2 PHE A 60 -11.636 -0.624 -0.521 1.00 0.00 H new ATOM 0 HB3 PHE A 60 -11.939 -0.774 1.198 1.00 0.00 H new ATOM 0 HD1 PHE A 60 -10.006 -2.494 -1.535 1.00 0.00 H new ATOM 0 HD2 PHE A 60 -10.148 -1.338 2.599 1.00 0.00 H new ATOM 0 HE1 PHE A 60 -7.710 -3.371 -1.211 1.00 0.00 H new ATOM 0 HE2 PHE A 60 -7.852 -2.218 2.924 1.00 0.00 H new ATOM 0 HZ PHE A 60 -6.633 -3.235 1.019 1.00 0.00 H new ATOM 837 N ASP A 61 -12.116 -2.329 -2.334 1.00 0.00 N ATOM 838 CA ASP A 61 -11.806 -2.911 -3.670 1.00 0.00 C ATOM 839 C ASP A 61 -10.961 -1.942 -4.494 1.00 0.00 C ATOM 840 O ASP A 61 -11.099 -0.738 -4.400 1.00 0.00 O ATOM 841 CB ASP A 61 -13.112 -3.207 -4.410 1.00 0.00 C ATOM 842 CG ASP A 61 -14.155 -2.146 -4.055 1.00 0.00 C ATOM 843 OD1 ASP A 61 -14.152 -1.105 -4.691 1.00 0.00 O ATOM 844 OD2 ASP A 61 -14.937 -2.392 -3.153 1.00 0.00 O ATOM 0 H ASP A 61 -12.201 -1.313 -2.307 1.00 0.00 H new ATOM 0 HA ASP A 61 -11.242 -3.833 -3.530 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -12.938 -3.215 -5.486 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -13.479 -4.197 -4.139 1.00 0.00 H new ATOM 849 N LEU A 62 -10.088 -2.469 -5.311 1.00 0.00 N ATOM 850 CA LEU A 62 -9.226 -1.602 -6.159 1.00 0.00 C ATOM 851 C LEU A 62 -9.461 -1.953 -7.632 1.00 0.00 C ATOM 852 O LEU A 62 -10.402 -2.644 -7.970 1.00 0.00 O ATOM 853 CB LEU A 62 -7.756 -1.845 -5.805 1.00 0.00 C ATOM 854 CG LEU A 62 -7.314 -0.848 -4.734 1.00 0.00 C ATOM 855 CD1 LEU A 62 -7.324 -1.529 -3.365 1.00 0.00 C ATOM 856 CD2 LEU A 62 -5.897 -0.364 -5.049 1.00 0.00 C ATOM 0 H LEU A 62 -9.936 -3.471 -5.426 1.00 0.00 H new ATOM 0 HA LEU A 62 -9.471 -0.554 -5.986 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -7.622 -2.865 -5.444 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -7.135 -1.738 -6.694 1.00 0.00 H new ATOM 0 HG LEU A 62 -7.998 0.000 -4.722 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -7.009 -0.817 -2.602 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -8.331 -1.879 -3.140 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -6.639 -2.377 -3.375 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -5.578 0.347 -4.287 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -5.216 -1.215 -5.059 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -5.887 0.121 -6.025 1.00 0.00 H new ATOM 868 N ALA A 63 -8.616 -1.488 -8.511 1.00 0.00 N ATOM 869 CA ALA A 63 -8.798 -1.803 -9.957 1.00 0.00 C ATOM 870 C ALA A 63 -8.799 -3.322 -10.150 1.00 0.00 C ATOM 871 O ALA A 63 -9.313 -3.833 -11.125 1.00 0.00 O ATOM 872 CB ALA A 63 -7.652 -1.185 -10.762 1.00 0.00 C ATOM 0 H ALA A 63 -7.809 -0.905 -8.291 1.00 0.00 H new ATOM 0 HA ALA A 63 -9.746 -1.392 -10.303 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -7.785 -1.415 -11.819 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -7.651 -0.104 -10.623 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -6.703 -1.595 -10.418 1.00 0.00 H new ATOM 878 N GLY A 64 -8.229 -4.047 -9.226 1.00 0.00 N ATOM 879 CA GLY A 64 -8.200 -5.532 -9.355 1.00 0.00 C ATOM 880 C GLY A 64 -9.574 -6.102 -8.999 1.00 0.00 C ATOM 881 O GLY A 64 -10.539 -5.911 -9.712 1.00 0.00 O ATOM 0 H GLY A 64 -7.782 -3.675 -8.388 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -7.930 -5.814 -10.373 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -7.439 -5.950 -8.696 1.00 0.00 H new ATOM 885 N VAL A 65 -9.674 -6.798 -7.898 1.00 0.00 N ATOM 886 CA VAL A 65 -10.989 -7.375 -7.499 1.00 0.00 C ATOM 887 C VAL A 65 -11.329 -6.923 -6.076 1.00 0.00 C ATOM 888 O VAL A 65 -10.884 -5.888 -5.622 1.00 0.00 O ATOM 889 CB VAL A 65 -10.918 -8.904 -7.546 1.00 0.00 C ATOM 890 CG1 VAL A 65 -12.299 -9.468 -7.878 1.00 0.00 C ATOM 891 CG2 VAL A 65 -9.921 -9.339 -8.624 1.00 0.00 C ATOM 0 H VAL A 65 -8.903 -6.991 -7.259 1.00 0.00 H new ATOM 0 HA VAL A 65 -11.760 -7.030 -8.188 1.00 0.00 H new ATOM 0 HB VAL A 65 -10.592 -9.280 -6.576 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -12.249 -10.556 -7.912 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -13.011 -9.161 -7.112 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -12.623 -9.090 -8.847 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -9.872 -10.427 -8.656 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -10.246 -8.962 -9.594 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -8.935 -8.938 -8.391 1.00 0.00 H new ATOM 901 N HIS A 66 -12.113 -7.689 -5.368 1.00 0.00 N ATOM 902 CA HIS A 66 -12.476 -7.297 -3.978 1.00 0.00 C ATOM 903 C HIS A 66 -11.426 -7.841 -3.005 1.00 0.00 C ATOM 904 O HIS A 66 -11.277 -9.036 -2.840 1.00 0.00 O ATOM 905 CB HIS A 66 -13.854 -7.865 -3.628 1.00 0.00 C ATOM 906 CG HIS A 66 -13.755 -9.353 -3.446 1.00 0.00 C ATOM 907 ND1 HIS A 66 -13.822 -10.233 -4.513 1.00 0.00 N ATOM 908 CD2 HIS A 66 -13.598 -10.132 -2.326 1.00 0.00 C ATOM 909 CE1 HIS A 66 -13.707 -11.479 -4.019 1.00 0.00 C ATOM 910 NE2 HIS A 66 -13.567 -11.475 -2.692 1.00 0.00 N ATOM 0 H HIS A 66 -12.517 -8.568 -5.692 1.00 0.00 H new ATOM 0 HA HIS A 66 -12.508 -6.210 -3.902 1.00 0.00 H new ATOM 0 HB2 HIS A 66 -14.229 -7.401 -2.716 1.00 0.00 H new ATOM 0 HB3 HIS A 66 -14.566 -7.632 -4.420 1.00 0.00 H new ATOM 0 HD1 HIS A 66 -13.938 -9.982 -5.495 1.00 0.00 H new ATOM 0 HD2 HIS A 66 -13.512 -9.760 -1.316 1.00 0.00 H new ATOM 0 HE1 HIS A 66 -13.726 -12.374 -4.623 1.00 0.00 H new ATOM 918 N TYR A 67 -10.690 -6.973 -2.364 1.00 0.00 N ATOM 919 CA TYR A 67 -9.645 -7.440 -1.408 1.00 0.00 C ATOM 920 C TYR A 67 -10.211 -7.451 0.012 1.00 0.00 C ATOM 921 O TYR A 67 -11.223 -6.837 0.295 1.00 0.00 O ATOM 922 CB TYR A 67 -8.440 -6.496 -1.463 1.00 0.00 C ATOM 923 CG TYR A 67 -7.652 -6.723 -2.737 1.00 0.00 C ATOM 924 CD1 TYR A 67 -8.081 -7.665 -3.683 1.00 0.00 C ATOM 925 CD2 TYR A 67 -6.486 -5.983 -2.970 1.00 0.00 C ATOM 926 CE1 TYR A 67 -7.344 -7.865 -4.857 1.00 0.00 C ATOM 927 CE2 TYR A 67 -5.750 -6.184 -4.143 1.00 0.00 C ATOM 928 CZ TYR A 67 -6.179 -7.124 -5.088 1.00 0.00 C ATOM 929 OH TYR A 67 -5.453 -7.321 -6.245 1.00 0.00 O ATOM 0 H TYR A 67 -10.767 -5.961 -2.461 1.00 0.00 H new ATOM 0 HA TYR A 67 -9.334 -8.448 -1.683 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -8.778 -5.461 -1.416 1.00 0.00 H new ATOM 0 HB3 TYR A 67 -7.800 -6.662 -0.597 1.00 0.00 H new ATOM 0 HD1 TYR A 67 -8.980 -8.237 -3.506 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -6.154 -5.256 -2.243 1.00 0.00 H new ATOM 0 HE1 TYR A 67 -7.675 -8.591 -5.585 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -4.850 -5.614 -4.320 1.00 0.00 H new ATOM 0 HH TYR A 67 -4.674 -6.726 -6.248 1.00 0.00 H new ATOM 939 N VAL A 68 -9.564 -8.142 0.911 1.00 0.00 N ATOM 940 CA VAL A 68 -10.065 -8.192 2.313 1.00 0.00 C ATOM 941 C VAL A 68 -9.099 -7.437 3.226 1.00 0.00 C ATOM 942 O VAL A 68 -8.007 -7.076 2.831 1.00 0.00 O ATOM 943 CB VAL A 68 -10.163 -9.649 2.768 1.00 0.00 C ATOM 944 CG1 VAL A 68 -10.829 -9.713 4.144 1.00 0.00 C ATOM 945 CG2 VAL A 68 -11.000 -10.440 1.761 1.00 0.00 C ATOM 0 H VAL A 68 -8.711 -8.673 0.735 1.00 0.00 H new ATOM 0 HA VAL A 68 -11.050 -7.729 2.364 1.00 0.00 H new ATOM 0 HB VAL A 68 -9.163 -10.078 2.829 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -10.898 -10.752 4.467 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -10.235 -9.149 4.862 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -11.829 -9.284 4.084 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -11.071 -11.479 2.083 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -12.000 -10.009 1.701 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -10.526 -10.396 0.780 1.00 0.00 H new ATOM 955 N THR A 69 -9.491 -7.195 4.446 1.00 0.00 N ATOM 956 CA THR A 69 -8.597 -6.462 5.384 1.00 0.00 C ATOM 957 C THR A 69 -8.340 -7.320 6.625 1.00 0.00 C ATOM 958 O THR A 69 -9.253 -7.847 7.229 1.00 0.00 O ATOM 959 CB THR A 69 -9.263 -5.150 5.800 1.00 0.00 C ATOM 960 OG1 THR A 69 -9.549 -4.379 4.642 1.00 0.00 O ATOM 961 CG2 THR A 69 -8.322 -4.368 6.718 1.00 0.00 C ATOM 0 H THR A 69 -10.392 -7.474 4.834 1.00 0.00 H new ATOM 0 HA THR A 69 -7.649 -6.249 4.890 1.00 0.00 H new ATOM 0 HB THR A 69 -10.190 -5.364 6.332 1.00 0.00 H new ATOM 0 HG1 THR A 69 -9.977 -3.538 4.906 1.00 0.00 H new ATOM 0 HG21 THR A 69 -8.797 -3.433 7.014 1.00 0.00 H new ATOM 0 HG22 THR A 69 -8.104 -4.961 7.606 1.00 0.00 H new ATOM 0 HG23 THR A 69 -7.394 -4.152 6.189 1.00 0.00 H new ATOM 969 N LEU A 70 -7.101 -7.461 7.009 1.00 0.00 N ATOM 970 CA LEU A 70 -6.780 -8.281 8.211 1.00 0.00 C ATOM 971 C LEU A 70 -5.870 -7.475 9.139 1.00 0.00 C ATOM 972 O LEU A 70 -5.192 -8.017 9.990 1.00 0.00 O ATOM 973 CB LEU A 70 -6.066 -9.563 7.779 1.00 0.00 C ATOM 974 CG LEU A 70 -7.091 -10.686 7.615 1.00 0.00 C ATOM 975 CD1 LEU A 70 -7.047 -11.215 6.179 1.00 0.00 C ATOM 976 CD2 LEU A 70 -6.763 -11.821 8.588 1.00 0.00 C ATOM 0 H LEU A 70 -6.296 -7.043 6.542 1.00 0.00 H new ATOM 0 HA LEU A 70 -7.700 -8.541 8.735 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -5.537 -9.399 6.840 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -5.319 -9.844 8.521 1.00 0.00 H new ATOM 0 HG LEU A 70 -8.088 -10.301 7.828 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -7.778 -12.015 6.064 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -7.281 -10.407 5.486 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -6.050 -11.600 5.963 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -7.493 -12.622 8.472 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -5.765 -12.206 8.375 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -6.797 -11.445 9.610 1.00 0.00 H new ATOM 988 N ARG A 71 -5.851 -6.179 8.978 1.00 0.00 N ATOM 989 CA ARG A 71 -4.990 -5.328 9.844 1.00 0.00 C ATOM 990 C ARG A 71 -5.216 -3.857 9.487 1.00 0.00 C ATOM 991 O ARG A 71 -4.496 -3.281 8.696 1.00 0.00 O ATOM 992 CB ARG A 71 -3.520 -5.688 9.613 1.00 0.00 C ATOM 993 CG ARG A 71 -2.950 -6.346 10.872 1.00 0.00 C ATOM 994 CD ARG A 71 -1.562 -5.773 11.164 1.00 0.00 C ATOM 995 NE ARG A 71 -1.091 -6.266 12.489 1.00 0.00 N ATOM 996 CZ ARG A 71 0.166 -6.144 12.826 1.00 0.00 C ATOM 997 NH1 ARG A 71 1.014 -5.580 12.008 1.00 0.00 N ATOM 998 NH2 ARG A 71 0.574 -6.585 13.984 1.00 0.00 N ATOM 0 H ARG A 71 -6.397 -5.673 8.281 1.00 0.00 H new ATOM 0 HA ARG A 71 -5.244 -5.495 10.891 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -3.430 -6.365 8.764 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -2.950 -4.792 9.368 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -3.613 -6.170 11.719 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -2.888 -7.426 10.735 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -0.862 -6.071 10.383 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -1.598 -4.684 11.161 1.00 0.00 H new ATOM 0 HE ARG A 71 -1.751 -6.700 13.134 1.00 0.00 H new ATOM 0 HH11 ARG A 71 0.696 -5.233 11.103 1.00 0.00 H new ATOM 0 HH12 ARG A 71 1.994 -5.486 12.274 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -0.087 -7.024 14.624 1.00 0.00 H new ATOM 0 HH22 ARG A 71 1.554 -6.491 14.249 1.00 0.00 H new ATOM 1012 N ALA A 72 -6.216 -3.244 10.061 1.00 0.00 N ATOM 1013 CA ALA A 72 -6.489 -1.811 9.748 1.00 0.00 C ATOM 1014 C ALA A 72 -6.927 -1.081 11.020 1.00 0.00 C ATOM 1015 O ALA A 72 -7.778 -0.215 10.985 1.00 0.00 O ATOM 1016 CB ALA A 72 -7.601 -1.723 8.701 1.00 0.00 C ATOM 0 H ALA A 72 -6.854 -3.672 10.732 1.00 0.00 H new ATOM 0 HA ALA A 72 -5.583 -1.346 9.359 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -7.802 -0.677 8.471 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -7.289 -2.240 7.794 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -8.506 -2.189 9.091 1.00 0.00 H new ATOM 1022 N ASP A 73 -6.352 -1.421 12.141 1.00 0.00 N ATOM 1023 CA ASP A 73 -6.740 -0.740 13.412 1.00 0.00 C ATOM 1024 C ASP A 73 -5.660 0.271 13.798 1.00 0.00 C ATOM 1025 O ASP A 73 -5.920 1.241 14.480 1.00 0.00 O ATOM 1026 CB ASP A 73 -6.898 -1.762 14.549 1.00 0.00 C ATOM 1027 CG ASP A 73 -6.662 -3.185 14.031 1.00 0.00 C ATOM 1028 OD1 ASP A 73 -5.519 -3.514 13.763 1.00 0.00 O ATOM 1029 OD2 ASP A 73 -7.628 -3.920 13.915 1.00 0.00 O ATOM 0 H ASP A 73 -5.633 -2.138 12.233 1.00 0.00 H new ATOM 0 HA ASP A 73 -7.692 -0.233 13.256 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -6.191 -1.538 15.348 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -7.897 -1.686 14.977 1.00 0.00 H new ATOM 1034 N ASP A 74 -4.449 0.051 13.367 1.00 0.00 N ATOM 1035 CA ASP A 74 -3.354 1.004 13.713 1.00 0.00 C ATOM 1036 C ASP A 74 -3.255 2.086 12.628 1.00 0.00 C ATOM 1037 O ASP A 74 -4.091 2.963 12.545 1.00 0.00 O ATOM 1038 CB ASP A 74 -2.022 0.251 13.835 1.00 0.00 C ATOM 1039 CG ASP A 74 -1.966 -0.885 12.811 1.00 0.00 C ATOM 1040 OD1 ASP A 74 -2.297 -0.638 11.662 1.00 0.00 O ATOM 1041 OD2 ASP A 74 -1.595 -1.983 13.193 1.00 0.00 O ATOM 0 H ASP A 74 -4.169 -0.744 12.792 1.00 0.00 H new ATOM 0 HA ASP A 74 -3.575 1.477 14.670 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -1.191 0.938 13.674 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -1.913 -0.151 14.842 1.00 0.00 H new ATOM 1046 N ARG A 75 -2.247 2.041 11.796 1.00 0.00 N ATOM 1047 CA ARG A 75 -2.121 3.077 10.732 1.00 0.00 C ATOM 1048 C ARG A 75 -1.658 2.421 9.431 1.00 0.00 C ATOM 1049 O ARG A 75 -1.077 3.059 8.576 1.00 0.00 O ATOM 1050 CB ARG A 75 -1.097 4.131 11.158 1.00 0.00 C ATOM 1051 CG ARG A 75 -1.178 4.349 12.671 1.00 0.00 C ATOM 1052 CD ARG A 75 -2.439 5.146 13.007 1.00 0.00 C ATOM 1053 NE ARG A 75 -2.070 6.334 13.829 1.00 0.00 N ATOM 1054 CZ ARG A 75 -2.921 7.312 13.987 1.00 0.00 C ATOM 1055 NH1 ARG A 75 -4.099 7.253 13.428 1.00 0.00 N ATOM 1056 NH2 ARG A 75 -2.591 8.351 14.706 1.00 0.00 N ATOM 0 H ARG A 75 -1.510 1.336 11.808 1.00 0.00 H new ATOM 0 HA ARG A 75 -3.090 3.552 10.578 1.00 0.00 H new ATOM 0 HB2 ARG A 75 -0.093 3.809 10.881 1.00 0.00 H new ATOM 0 HB3 ARG A 75 -1.287 5.068 10.635 1.00 0.00 H new ATOM 0 HG2 ARG A 75 -1.194 3.389 13.187 1.00 0.00 H new ATOM 0 HG3 ARG A 75 -0.294 4.883 13.020 1.00 0.00 H new ATOM 0 HD2 ARG A 75 -2.936 5.464 12.091 1.00 0.00 H new ATOM 0 HD3 ARG A 75 -3.145 4.519 13.551 1.00 0.00 H new ATOM 0 HE ARG A 75 -1.151 6.383 14.269 1.00 0.00 H new ATOM 0 HH11 ARG A 75 -4.357 6.442 12.866 1.00 0.00 H new ATOM 0 HH12 ARG A 75 -4.762 8.018 13.553 1.00 0.00 H new ATOM 0 HH21 ARG A 75 -1.670 8.397 15.143 1.00 0.00 H new ATOM 0 HH22 ARG A 75 -3.254 9.116 14.831 1.00 0.00 H new ATOM 1070 N SER A 76 -1.909 1.151 9.274 1.00 0.00 N ATOM 1071 CA SER A 76 -1.482 0.459 8.027 1.00 0.00 C ATOM 1072 C SER A 76 -2.621 -0.428 7.525 1.00 0.00 C ATOM 1073 O SER A 76 -3.480 -0.839 8.279 1.00 0.00 O ATOM 1074 CB SER A 76 -0.253 -0.405 8.318 1.00 0.00 C ATOM 1075 OG SER A 76 0.389 0.069 9.494 1.00 0.00 O ATOM 0 H SER A 76 -2.391 0.563 9.955 1.00 0.00 H new ATOM 0 HA SER A 76 -1.233 1.199 7.266 1.00 0.00 H new ATOM 0 HB2 SER A 76 -0.549 -1.446 8.446 1.00 0.00 H new ATOM 0 HB3 SER A 76 0.437 -0.371 7.475 1.00 0.00 H new ATOM 0 HG SER A 76 1.060 -0.583 9.785 1.00 0.00 H new ATOM 1081 N ILE A 77 -2.637 -0.728 6.255 1.00 0.00 N ATOM 1082 CA ILE A 77 -3.722 -1.589 5.711 1.00 0.00 C ATOM 1083 C ILE A 77 -3.185 -2.399 4.531 1.00 0.00 C ATOM 1084 O ILE A 77 -3.565 -2.185 3.397 1.00 0.00 O ATOM 1085 CB ILE A 77 -4.885 -0.715 5.239 1.00 0.00 C ATOM 1086 CG1 ILE A 77 -5.521 -0.017 6.445 1.00 0.00 C ATOM 1087 CG2 ILE A 77 -5.931 -1.590 4.547 1.00 0.00 C ATOM 1088 CD1 ILE A 77 -6.858 0.603 6.032 1.00 0.00 C ATOM 0 H ILE A 77 -1.947 -0.414 5.573 1.00 0.00 H new ATOM 0 HA ILE A 77 -4.071 -2.266 6.491 1.00 0.00 H new ATOM 0 HB ILE A 77 -4.516 0.034 4.538 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -5.674 -0.732 7.253 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -4.852 0.755 6.826 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -6.760 -0.968 4.210 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -5.479 -2.088 3.689 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -6.300 -2.339 5.248 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -7.310 1.099 6.891 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -6.692 1.331 5.238 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -7.526 -0.179 5.672 1.00 0.00 H new ATOM 1100 N TYR A 78 -2.311 -3.333 4.787 1.00 0.00 N ATOM 1101 CA TYR A 78 -1.762 -4.159 3.672 1.00 0.00 C ATOM 1102 C TYR A 78 -2.592 -5.437 3.552 1.00 0.00 C ATOM 1103 O TYR A 78 -2.359 -6.410 4.242 1.00 0.00 O ATOM 1104 CB TYR A 78 -0.288 -4.529 3.926 1.00 0.00 C ATOM 1105 CG TYR A 78 0.199 -3.955 5.240 1.00 0.00 C ATOM 1106 CD1 TYR A 78 -0.121 -4.595 6.444 1.00 0.00 C ATOM 1107 CD2 TYR A 78 0.973 -2.787 5.251 1.00 0.00 C ATOM 1108 CE1 TYR A 78 0.331 -4.068 7.659 1.00 0.00 C ATOM 1109 CE2 TYR A 78 1.426 -2.260 6.468 1.00 0.00 C ATOM 1110 CZ TYR A 78 1.104 -2.900 7.671 1.00 0.00 C ATOM 1111 OH TYR A 78 1.551 -2.381 8.870 1.00 0.00 O ATOM 0 H TYR A 78 -1.954 -3.560 5.715 1.00 0.00 H new ATOM 0 HA TYR A 78 -1.813 -3.581 2.750 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -0.179 -5.613 3.936 1.00 0.00 H new ATOM 0 HB3 TYR A 78 0.330 -4.154 3.110 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -0.717 -5.496 6.435 1.00 0.00 H new ATOM 0 HD2 TYR A 78 1.220 -2.293 4.323 1.00 0.00 H new ATOM 0 HE1 TYR A 78 0.084 -4.562 8.587 1.00 0.00 H new ATOM 0 HE2 TYR A 78 2.023 -1.360 6.478 1.00 0.00 H new ATOM 0 HH TYR A 78 2.402 -1.916 8.728 1.00 0.00 H new ATOM 1121 N GLY A 79 -3.564 -5.439 2.683 1.00 0.00 N ATOM 1122 CA GLY A 79 -4.417 -6.651 2.519 1.00 0.00 C ATOM 1123 C GLY A 79 -4.180 -7.255 1.136 1.00 0.00 C ATOM 1124 O GLY A 79 -3.489 -6.690 0.315 1.00 0.00 O ATOM 0 H GLY A 79 -3.805 -4.654 2.079 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -4.182 -7.382 3.292 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -5.468 -6.388 2.638 1.00 0.00 H new ATOM 1128 N LYS A 80 -4.746 -8.399 0.871 1.00 0.00 N ATOM 1129 CA LYS A 80 -4.550 -9.035 -0.462 1.00 0.00 C ATOM 1130 C LYS A 80 -5.771 -9.887 -0.800 1.00 0.00 C ATOM 1131 O LYS A 80 -6.778 -9.842 -0.122 1.00 0.00 O ATOM 1132 CB LYS A 80 -3.299 -9.917 -0.430 1.00 0.00 C ATOM 1133 CG LYS A 80 -3.114 -10.498 0.972 1.00 0.00 C ATOM 1134 CD LYS A 80 -2.753 -11.980 0.865 1.00 0.00 C ATOM 1135 CE LYS A 80 -1.503 -12.142 -0.003 1.00 0.00 C ATOM 1136 NZ LYS A 80 -1.432 -13.541 -0.513 1.00 0.00 N ATOM 0 H LYS A 80 -5.336 -8.921 1.519 1.00 0.00 H new ATOM 0 HA LYS A 80 -4.425 -8.262 -1.221 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -3.391 -10.722 -1.159 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -2.423 -9.332 -0.710 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -2.328 -9.958 1.500 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -4.029 -10.376 1.552 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -2.575 -12.394 1.858 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -3.584 -12.537 0.432 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -1.532 -11.440 -0.837 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -0.611 -11.909 0.578 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -0.583 -13.653 -1.103 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -1.385 -14.201 0.289 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -2.278 -13.747 -1.082 1.00 0.00 H new ATOM 1150 N LYS A 81 -5.694 -10.664 -1.843 1.00 0.00 N ATOM 1151 CA LYS A 81 -6.854 -11.518 -2.218 1.00 0.00 C ATOM 1152 C LYS A 81 -6.552 -12.246 -3.529 1.00 0.00 C ATOM 1153 O LYS A 81 -6.458 -11.643 -4.579 1.00 0.00 O ATOM 1154 CB LYS A 81 -8.093 -10.638 -2.396 1.00 0.00 C ATOM 1155 CG LYS A 81 -9.315 -11.354 -1.820 1.00 0.00 C ATOM 1156 CD LYS A 81 -9.539 -12.667 -2.572 1.00 0.00 C ATOM 1157 CE LYS A 81 -11.026 -13.020 -2.542 1.00 0.00 C ATOM 1158 NZ LYS A 81 -11.524 -12.944 -1.139 1.00 0.00 N ATOM 0 H LYS A 81 -4.879 -10.745 -2.451 1.00 0.00 H new ATOM 0 HA LYS A 81 -7.036 -12.251 -1.432 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -7.948 -9.682 -1.893 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -8.250 -10.422 -3.453 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -9.167 -11.551 -0.758 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -10.196 -10.718 -1.906 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -9.197 -12.572 -3.603 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -8.955 -13.465 -2.115 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -11.587 -12.334 -3.176 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -11.181 -14.022 -2.941 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -11.953 -13.853 -0.873 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -10.731 -12.735 -0.500 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -12.237 -12.190 -1.064 1.00 0.00 H new ATOM 1172 N GLY A 82 -6.397 -13.541 -3.476 1.00 0.00 N ATOM 1173 CA GLY A 82 -6.100 -14.306 -4.722 1.00 0.00 C ATOM 1174 C GLY A 82 -4.597 -14.574 -4.812 1.00 0.00 C ATOM 1175 O GLY A 82 -3.965 -14.963 -3.850 1.00 0.00 O ATOM 0 H GLY A 82 -6.463 -14.102 -2.626 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -6.648 -15.248 -4.722 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -6.432 -13.743 -5.594 1.00 0.00 H new ATOM 1179 N SER A 83 -4.018 -14.371 -5.963 1.00 0.00 N ATOM 1180 CA SER A 83 -2.556 -14.614 -6.116 1.00 0.00 C ATOM 1181 C SER A 83 -1.802 -13.284 -6.046 1.00 0.00 C ATOM 1182 O SER A 83 -0.588 -13.247 -6.065 1.00 0.00 O ATOM 1183 CB SER A 83 -2.289 -15.281 -7.467 1.00 0.00 C ATOM 1184 OG SER A 83 -3.172 -14.739 -8.441 1.00 0.00 O ATOM 0 H SER A 83 -4.494 -14.047 -6.805 1.00 0.00 H new ATOM 0 HA SER A 83 -2.213 -15.266 -5.313 1.00 0.00 H new ATOM 0 HB2 SER A 83 -1.254 -15.119 -7.767 1.00 0.00 H new ATOM 0 HB3 SER A 83 -2.433 -16.359 -7.388 1.00 0.00 H new ATOM 0 HG SER A 83 -3.002 -15.163 -9.308 1.00 0.00 H new ATOM 1190 N ALA A 84 -2.510 -12.191 -5.966 1.00 0.00 N ATOM 1191 CA ALA A 84 -1.830 -10.868 -5.896 1.00 0.00 C ATOM 1192 C ALA A 84 -2.084 -10.239 -4.525 1.00 0.00 C ATOM 1193 O ALA A 84 -2.929 -10.684 -3.775 1.00 0.00 O ATOM 1194 CB ALA A 84 -2.382 -9.954 -6.992 1.00 0.00 C ATOM 0 H ALA A 84 -3.529 -12.157 -5.946 1.00 0.00 H new ATOM 0 HA ALA A 84 -0.758 -10.999 -6.041 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -1.885 -8.985 -6.942 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -2.200 -10.405 -7.968 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -3.454 -9.820 -6.848 1.00 0.00 H new ATOM 1200 N GLY A 85 -1.356 -9.207 -4.192 1.00 0.00 N ATOM 1201 CA GLY A 85 -1.557 -8.551 -2.868 1.00 0.00 C ATOM 1202 C GLY A 85 -1.211 -7.065 -2.976 1.00 0.00 C ATOM 1203 O GLY A 85 -0.476 -6.651 -3.850 1.00 0.00 O ATOM 0 H GLY A 85 -0.632 -8.791 -4.778 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -2.591 -8.672 -2.544 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -0.929 -9.028 -2.115 1.00 0.00 H new ATOM 1207 N VAL A 86 -1.738 -6.257 -2.097 1.00 0.00 N ATOM 1208 CA VAL A 86 -1.442 -4.797 -2.156 1.00 0.00 C ATOM 1209 C VAL A 86 -1.138 -4.266 -0.752 1.00 0.00 C ATOM 1210 O VAL A 86 -1.814 -4.586 0.208 1.00 0.00 O ATOM 1211 CB VAL A 86 -2.652 -4.052 -2.726 1.00 0.00 C ATOM 1212 CG1 VAL A 86 -3.825 -4.159 -1.750 1.00 0.00 C ATOM 1213 CG2 VAL A 86 -2.292 -2.578 -2.928 1.00 0.00 C ATOM 0 H VAL A 86 -2.360 -6.544 -1.341 1.00 0.00 H new ATOM 0 HA VAL A 86 -0.575 -4.637 -2.797 1.00 0.00 H new ATOM 0 HB VAL A 86 -2.933 -4.494 -3.682 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -4.686 -3.628 -2.156 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -4.082 -5.208 -1.603 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -3.544 -3.717 -0.794 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -3.152 -2.046 -3.334 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -2.011 -2.138 -1.971 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -1.456 -2.500 -3.623 1.00 0.00 H new ATOM 1223 N ILE A 87 -0.128 -3.447 -0.632 1.00 0.00 N ATOM 1224 CA ILE A 87 0.230 -2.876 0.698 1.00 0.00 C ATOM 1225 C ILE A 87 -0.101 -1.379 0.695 1.00 0.00 C ATOM 1226 O ILE A 87 0.679 -0.564 0.245 1.00 0.00 O ATOM 1227 CB ILE A 87 1.737 -3.088 0.948 1.00 0.00 C ATOM 1228 CG1 ILE A 87 2.005 -4.503 1.502 1.00 0.00 C ATOM 1229 CG2 ILE A 87 2.251 -2.060 1.960 1.00 0.00 C ATOM 1230 CD1 ILE A 87 0.897 -5.478 1.084 1.00 0.00 C ATOM 0 H ILE A 87 0.468 -3.147 -1.403 1.00 0.00 H new ATOM 0 HA ILE A 87 -0.334 -3.369 1.490 1.00 0.00 H new ATOM 0 HB ILE A 87 2.256 -2.968 -0.003 1.00 0.00 H new ATOM 0 HG12 ILE A 87 2.967 -4.863 1.138 1.00 0.00 H new ATOM 0 HG13 ILE A 87 2.069 -4.465 2.589 1.00 0.00 H new ATOM 0 HG21 ILE A 87 3.316 -2.218 2.130 1.00 0.00 H new ATOM 0 HG22 ILE A 87 2.091 -1.055 1.571 1.00 0.00 H new ATOM 0 HG23 ILE A 87 1.713 -2.175 2.901 1.00 0.00 H new ATOM 0 HD11 ILE A 87 1.111 -6.467 1.488 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -0.060 -5.128 1.470 1.00 0.00 H new ATOM 0 HD13 ILE A 87 0.851 -5.532 -0.004 1.00 0.00 H new ATOM 1242 N THR A 88 -1.254 -1.013 1.185 1.00 0.00 N ATOM 1243 CA THR A 88 -1.632 0.429 1.197 1.00 0.00 C ATOM 1244 C THR A 88 -1.552 0.976 2.623 1.00 0.00 C ATOM 1245 O THR A 88 -2.288 0.566 3.499 1.00 0.00 O ATOM 1246 CB THR A 88 -3.061 0.582 0.673 1.00 0.00 C ATOM 1247 OG1 THR A 88 -3.979 0.252 1.705 1.00 0.00 O ATOM 1248 CG2 THR A 88 -3.273 -0.350 -0.520 1.00 0.00 C ATOM 0 H THR A 88 -1.949 -1.648 1.577 1.00 0.00 H new ATOM 0 HA THR A 88 -0.945 0.986 0.561 1.00 0.00 H new ATOM 0 HB THR A 88 -3.224 1.612 0.357 1.00 0.00 H new ATOM 0 HG1 THR A 88 -3.513 -0.244 2.411 1.00 0.00 H new ATOM 0 HG21 THR A 88 -4.292 -0.239 -0.892 1.00 0.00 H new ATOM 0 HG22 THR A 88 -2.568 -0.094 -1.311 1.00 0.00 H new ATOM 0 HG23 THR A 88 -3.110 -1.382 -0.209 1.00 0.00 H new ATOM 1256 N VAL A 89 -0.669 1.906 2.862 1.00 0.00 N ATOM 1257 CA VAL A 89 -0.548 2.486 4.229 1.00 0.00 C ATOM 1258 C VAL A 89 -0.443 4.010 4.131 1.00 0.00 C ATOM 1259 O VAL A 89 0.300 4.541 3.327 1.00 0.00 O ATOM 1260 CB VAL A 89 0.702 1.926 4.916 1.00 0.00 C ATOM 1261 CG1 VAL A 89 0.778 0.416 4.689 1.00 0.00 C ATOM 1262 CG2 VAL A 89 1.950 2.590 4.331 1.00 0.00 C ATOM 0 H VAL A 89 -0.026 2.289 2.169 1.00 0.00 H new ATOM 0 HA VAL A 89 -1.429 2.222 4.814 1.00 0.00 H new ATOM 0 HB VAL A 89 0.648 2.131 5.985 1.00 0.00 H new ATOM 0 HG11 VAL A 89 1.667 0.019 5.178 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -0.109 -0.060 5.107 1.00 0.00 H new ATOM 0 HG13 VAL A 89 0.830 0.211 3.620 1.00 0.00 H new ATOM 0 HG21 VAL A 89 2.838 2.191 4.821 1.00 0.00 H new ATOM 0 HG22 VAL A 89 2.003 2.387 3.261 1.00 0.00 H new ATOM 0 HG23 VAL A 89 1.899 3.667 4.493 1.00 0.00 H new ATOM 1272 N LYS A 90 -1.180 4.717 4.945 1.00 0.00 N ATOM 1273 CA LYS A 90 -1.120 6.204 4.903 1.00 0.00 C ATOM 1274 C LYS A 90 -0.169 6.698 5.994 1.00 0.00 C ATOM 1275 O LYS A 90 -0.069 6.109 7.053 1.00 0.00 O ATOM 1276 CB LYS A 90 -2.516 6.781 5.146 1.00 0.00 C ATOM 1277 CG LYS A 90 -3.111 7.254 3.819 1.00 0.00 C ATOM 1278 CD LYS A 90 -3.009 8.778 3.732 1.00 0.00 C ATOM 1279 CE LYS A 90 -3.853 9.410 4.839 1.00 0.00 C ATOM 1280 NZ LYS A 90 -2.983 10.247 5.712 1.00 0.00 N ATOM 0 H LYS A 90 -1.821 4.328 5.637 1.00 0.00 H new ATOM 0 HA LYS A 90 -0.761 6.528 3.926 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -3.160 6.026 5.597 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -2.460 7.613 5.849 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -2.580 6.795 2.985 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -4.153 6.943 3.743 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -1.969 9.090 3.830 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -3.354 9.121 2.757 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -4.644 10.020 4.404 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -4.338 8.633 5.429 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -3.560 10.972 6.184 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -2.529 9.645 6.429 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -2.252 10.708 5.134 1.00 0.00 H new ATOM 1294 N THR A 91 0.534 7.768 5.746 1.00 0.00 N ATOM 1295 CA THR A 91 1.482 8.288 6.772 1.00 0.00 C ATOM 1296 C THR A 91 1.537 9.820 6.704 1.00 0.00 C ATOM 1297 O THR A 91 0.549 10.475 6.438 1.00 0.00 O ATOM 1298 CB THR A 91 2.874 7.716 6.502 1.00 0.00 C ATOM 1299 OG1 THR A 91 3.416 8.336 5.347 1.00 0.00 O ATOM 1300 CG2 THR A 91 2.778 6.206 6.275 1.00 0.00 C ATOM 0 H THR A 91 0.494 8.304 4.879 1.00 0.00 H new ATOM 0 HA THR A 91 1.144 7.988 7.764 1.00 0.00 H new ATOM 0 HB THR A 91 3.519 7.908 7.360 1.00 0.00 H new ATOM 0 HG1 THR A 91 4.378 8.475 5.471 1.00 0.00 H new ATOM 0 HG21 THR A 91 3.772 5.803 6.083 1.00 0.00 H new ATOM 0 HG22 THR A 91 2.359 5.731 7.162 1.00 0.00 H new ATOM 0 HG23 THR A 91 2.134 6.007 5.418 1.00 0.00 H new ATOM 1308 N SER A 92 2.686 10.394 6.954 1.00 0.00 N ATOM 1309 CA SER A 92 2.815 11.881 6.918 1.00 0.00 C ATOM 1310 C SER A 92 2.041 12.459 5.730 1.00 0.00 C ATOM 1311 O SER A 92 0.992 13.050 5.892 1.00 0.00 O ATOM 1312 CB SER A 92 4.291 12.260 6.791 1.00 0.00 C ATOM 1313 OG SER A 92 5.028 11.136 6.331 1.00 0.00 O ATOM 0 H SER A 92 3.545 9.893 7.183 1.00 0.00 H new ATOM 0 HA SER A 92 2.403 12.290 7.840 1.00 0.00 H new ATOM 0 HB2 SER A 92 4.406 13.093 6.097 1.00 0.00 H new ATOM 0 HB3 SER A 92 4.677 12.592 7.755 1.00 0.00 H new ATOM 0 HG SER A 92 4.996 11.102 5.352 1.00 0.00 H new ATOM 1319 N LYS A 93 2.556 12.311 4.537 1.00 0.00 N ATOM 1320 CA LYS A 93 1.849 12.873 3.351 1.00 0.00 C ATOM 1321 C LYS A 93 2.140 12.016 2.117 1.00 0.00 C ATOM 1322 O LYS A 93 2.561 12.513 1.092 1.00 0.00 O ATOM 1323 CB LYS A 93 2.342 14.300 3.099 1.00 0.00 C ATOM 1324 CG LYS A 93 1.362 15.300 3.715 1.00 0.00 C ATOM 1325 CD LYS A 93 2.114 16.568 4.126 1.00 0.00 C ATOM 1326 CE LYS A 93 2.625 17.288 2.875 1.00 0.00 C ATOM 1327 NZ LYS A 93 2.089 18.678 2.849 1.00 0.00 N ATOM 0 H LYS A 93 3.431 11.828 4.335 1.00 0.00 H new ATOM 0 HA LYS A 93 0.776 12.878 3.542 1.00 0.00 H new ATOM 0 HB2 LYS A 93 3.334 14.434 3.531 1.00 0.00 H new ATOM 0 HB3 LYS A 93 2.434 14.479 2.028 1.00 0.00 H new ATOM 0 HG2 LYS A 93 0.579 15.546 2.998 1.00 0.00 H new ATOM 0 HG3 LYS A 93 0.873 14.858 4.583 1.00 0.00 H new ATOM 0 HD2 LYS A 93 1.456 17.226 4.694 1.00 0.00 H new ATOM 0 HD3 LYS A 93 2.949 16.313 4.778 1.00 0.00 H new ATOM 0 HE2 LYS A 93 3.715 17.307 2.873 1.00 0.00 H new ATOM 0 HE3 LYS A 93 2.314 16.750 1.980 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 2.436 19.168 2.000 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 1.050 18.649 2.832 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 2.407 19.189 3.697 1.00 0.00 H new ATOM 1341 N SER A 94 1.921 10.734 2.206 1.00 0.00 N ATOM 1342 CA SER A 94 2.186 9.855 1.032 1.00 0.00 C ATOM 1343 C SER A 94 1.620 8.460 1.300 1.00 0.00 C ATOM 1344 O SER A 94 1.534 8.022 2.429 1.00 0.00 O ATOM 1345 CB SER A 94 3.695 9.761 0.802 1.00 0.00 C ATOM 1346 OG SER A 94 3.942 9.085 -0.424 1.00 0.00 O ATOM 0 H SER A 94 1.571 10.258 3.037 1.00 0.00 H new ATOM 0 HA SER A 94 1.708 10.273 0.146 1.00 0.00 H new ATOM 0 HB2 SER A 94 4.133 10.759 0.775 1.00 0.00 H new ATOM 0 HB3 SER A 94 4.168 9.227 1.627 1.00 0.00 H new ATOM 0 HG SER A 94 4.908 9.025 -0.575 1.00 0.00 H new ATOM 1352 N ILE A 95 1.235 7.755 0.270 1.00 0.00 N ATOM 1353 CA ILE A 95 0.680 6.389 0.473 1.00 0.00 C ATOM 1354 C ILE A 95 1.403 5.409 -0.450 1.00 0.00 C ATOM 1355 O ILE A 95 1.511 5.627 -1.640 1.00 0.00 O ATOM 1356 CB ILE A 95 -0.813 6.388 0.147 1.00 0.00 C ATOM 1357 CG1 ILE A 95 -1.480 7.597 0.807 1.00 0.00 C ATOM 1358 CG2 ILE A 95 -1.449 5.101 0.677 1.00 0.00 C ATOM 1359 CD1 ILE A 95 -2.989 7.546 0.560 1.00 0.00 C ATOM 0 H ILE A 95 1.281 8.066 -0.700 1.00 0.00 H new ATOM 0 HA ILE A 95 0.823 6.089 1.511 1.00 0.00 H new ATOM 0 HB ILE A 95 -0.950 6.443 -0.933 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -1.276 7.599 1.878 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -1.066 8.520 0.402 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -2.514 5.099 0.445 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -0.974 4.240 0.207 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -1.313 5.046 1.757 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -3.464 8.407 1.030 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -3.183 7.565 -0.512 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -3.397 6.629 0.986 1.00 0.00 H new ATOM 1371 N LEU A 96 1.898 4.332 0.088 1.00 0.00 N ATOM 1372 CA LEU A 96 2.612 3.342 -0.763 1.00 0.00 C ATOM 1373 C LEU A 96 1.664 2.195 -1.108 1.00 0.00 C ATOM 1374 O LEU A 96 0.722 1.917 -0.391 1.00 0.00 O ATOM 1375 CB LEU A 96 3.820 2.792 -0.003 1.00 0.00 C ATOM 1376 CG LEU A 96 3.433 2.546 1.454 1.00 0.00 C ATOM 1377 CD1 LEU A 96 4.136 1.288 1.967 1.00 0.00 C ATOM 1378 CD2 LEU A 96 3.854 3.748 2.302 1.00 0.00 C ATOM 0 H LEU A 96 1.840 4.094 1.078 1.00 0.00 H new ATOM 0 HA LEU A 96 2.950 3.826 -1.679 1.00 0.00 H new ATOM 0 HB2 LEU A 96 4.161 1.864 -0.462 1.00 0.00 H new ATOM 0 HB3 LEU A 96 4.649 3.497 -0.057 1.00 0.00 H new ATOM 0 HG LEU A 96 2.354 2.410 1.524 1.00 0.00 H new ATOM 0 HD11 LEU A 96 3.858 1.114 3.007 1.00 0.00 H new ATOM 0 HD12 LEU A 96 3.836 0.432 1.363 1.00 0.00 H new ATOM 0 HD13 LEU A 96 5.216 1.420 1.897 1.00 0.00 H new ATOM 0 HD21 LEU A 96 3.578 3.574 3.342 1.00 0.00 H new ATOM 0 HD22 LEU A 96 4.933 3.884 2.230 1.00 0.00 H new ATOM 0 HD23 LEU A 96 3.351 4.644 1.938 1.00 0.00 H new ATOM 1390 N VAL A 97 1.898 1.527 -2.202 1.00 0.00 N ATOM 1391 CA VAL A 97 1.005 0.400 -2.590 1.00 0.00 C ATOM 1392 C VAL A 97 1.848 -0.772 -3.092 1.00 0.00 C ATOM 1393 O VAL A 97 1.774 -1.150 -4.243 1.00 0.00 O ATOM 1394 CB VAL A 97 0.063 0.860 -3.702 1.00 0.00 C ATOM 1395 CG1 VAL A 97 -0.869 -0.289 -4.087 1.00 0.00 C ATOM 1396 CG2 VAL A 97 -0.768 2.047 -3.208 1.00 0.00 C ATOM 0 H VAL A 97 2.668 1.712 -2.844 1.00 0.00 H new ATOM 0 HA VAL A 97 0.423 0.083 -1.724 1.00 0.00 H new ATOM 0 HB VAL A 97 0.647 1.162 -4.572 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -1.541 0.038 -4.880 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -0.278 -1.135 -4.438 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -1.453 -0.591 -3.218 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -1.440 2.376 -4.001 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -1.352 1.745 -2.339 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -0.104 2.866 -2.932 1.00 0.00 H new ATOM 1406 N GLY A 98 2.647 -1.352 -2.240 1.00 0.00 N ATOM 1407 CA GLY A 98 3.487 -2.503 -2.677 1.00 0.00 C ATOM 1408 C GLY A 98 2.608 -3.529 -3.396 1.00 0.00 C ATOM 1409 O GLY A 98 1.691 -4.082 -2.822 1.00 0.00 O ATOM 0 H GLY A 98 2.755 -1.080 -1.263 1.00 0.00 H new ATOM 0 HA2 GLY A 98 4.280 -2.158 -3.341 1.00 0.00 H new ATOM 0 HA3 GLY A 98 3.971 -2.962 -1.815 1.00 0.00 H new ATOM 1413 N VAL A 99 2.876 -3.788 -4.647 1.00 0.00 N ATOM 1414 CA VAL A 99 2.045 -4.780 -5.393 1.00 0.00 C ATOM 1415 C VAL A 99 2.896 -6.013 -5.715 1.00 0.00 C ATOM 1416 O VAL A 99 3.851 -5.944 -6.467 1.00 0.00 O ATOM 1417 CB VAL A 99 1.513 -4.163 -6.700 1.00 0.00 C ATOM 1418 CG1 VAL A 99 -0.017 -4.194 -6.685 1.00 0.00 C ATOM 1419 CG2 VAL A 99 1.979 -2.707 -6.841 1.00 0.00 C ATOM 0 H VAL A 99 3.630 -3.359 -5.184 1.00 0.00 H new ATOM 0 HA VAL A 99 1.196 -5.068 -4.773 1.00 0.00 H new ATOM 0 HB VAL A 99 1.897 -4.741 -7.540 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -0.399 -3.758 -7.608 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -0.359 -5.226 -6.602 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -0.384 -3.620 -5.834 1.00 0.00 H new ATOM 0 HG21 VAL A 99 1.592 -2.290 -7.771 1.00 0.00 H new ATOM 0 HG22 VAL A 99 1.608 -2.123 -5.999 1.00 0.00 H new ATOM 0 HG23 VAL A 99 3.068 -2.673 -6.853 1.00 0.00 H new ATOM 1429 N TYR A 100 2.563 -7.142 -5.142 1.00 0.00 N ATOM 1430 CA TYR A 100 3.354 -8.380 -5.407 1.00 0.00 C ATOM 1431 C TYR A 100 2.428 -9.481 -5.931 1.00 0.00 C ATOM 1432 O TYR A 100 1.288 -9.236 -6.273 1.00 0.00 O ATOM 1433 CB TYR A 100 4.025 -8.850 -4.112 1.00 0.00 C ATOM 1434 CG TYR A 100 3.017 -8.855 -2.988 1.00 0.00 C ATOM 1435 CD1 TYR A 100 2.138 -9.935 -2.841 1.00 0.00 C ATOM 1436 CD2 TYR A 100 2.966 -7.783 -2.089 1.00 0.00 C ATOM 1437 CE1 TYR A 100 1.208 -9.943 -1.796 1.00 0.00 C ATOM 1438 CE2 TYR A 100 2.035 -7.791 -1.043 1.00 0.00 C ATOM 1439 CZ TYR A 100 1.156 -8.871 -0.897 1.00 0.00 C ATOM 1440 OH TYR A 100 0.240 -8.878 0.134 1.00 0.00 O ATOM 0 H TYR A 100 1.777 -7.259 -4.502 1.00 0.00 H new ATOM 0 HA TYR A 100 4.118 -8.164 -6.153 1.00 0.00 H new ATOM 0 HB2 TYR A 100 4.438 -9.850 -4.247 1.00 0.00 H new ATOM 0 HB3 TYR A 100 4.858 -8.192 -3.863 1.00 0.00 H new ATOM 0 HD1 TYR A 100 2.178 -10.762 -3.534 1.00 0.00 H new ATOM 0 HD2 TYR A 100 3.644 -6.950 -2.202 1.00 0.00 H new ATOM 0 HE1 TYR A 100 0.530 -10.776 -1.683 1.00 0.00 H new ATOM 0 HE2 TYR A 100 1.995 -6.964 -0.349 1.00 0.00 H new ATOM 0 HH TYR A 100 0.056 -9.803 0.402 1.00 0.00 H new ATOM 1450 N ASN A 101 2.910 -10.694 -6.002 1.00 0.00 N ATOM 1451 CA ASN A 101 2.057 -11.807 -6.511 1.00 0.00 C ATOM 1452 C ASN A 101 2.162 -13.016 -5.574 1.00 0.00 C ATOM 1453 O ASN A 101 2.684 -12.923 -4.480 1.00 0.00 O ATOM 1454 CB ASN A 101 2.525 -12.201 -7.913 1.00 0.00 C ATOM 1455 CG ASN A 101 1.850 -11.298 -8.946 1.00 0.00 C ATOM 1456 OD1 ASN A 101 2.513 -10.631 -9.714 1.00 0.00 O ATOM 1457 ND2 ASN A 101 0.546 -11.248 -8.996 1.00 0.00 N ATOM 0 H ASN A 101 3.856 -10.961 -5.730 1.00 0.00 H new ATOM 0 HA ASN A 101 1.019 -11.478 -6.550 1.00 0.00 H new ATOM 0 HB2 ASN A 101 3.609 -12.109 -7.986 1.00 0.00 H new ATOM 0 HB3 ASN A 101 2.280 -13.245 -8.110 1.00 0.00 H new ATOM 0 HD21 ASN A 101 0.084 -10.649 -9.680 1.00 0.00 H new ATOM 0 HD22 ASN A 101 -0.011 -11.808 -8.351 1.00 0.00 H new ATOM 1464 N GLU A 102 1.662 -14.148 -5.993 1.00 0.00 N ATOM 1465 CA GLU A 102 1.724 -15.363 -5.129 1.00 0.00 C ATOM 1466 C GLU A 102 3.179 -15.799 -4.947 1.00 0.00 C ATOM 1467 O GLU A 102 3.480 -16.664 -4.148 1.00 0.00 O ATOM 1468 CB GLU A 102 0.929 -16.495 -5.787 1.00 0.00 C ATOM 1469 CG GLU A 102 1.596 -16.886 -7.108 1.00 0.00 C ATOM 1470 CD GLU A 102 0.674 -17.826 -7.889 1.00 0.00 C ATOM 1471 OE1 GLU A 102 0.125 -18.728 -7.279 1.00 0.00 O ATOM 1472 OE2 GLU A 102 0.532 -17.626 -9.084 1.00 0.00 O ATOM 0 H GLU A 102 1.212 -14.284 -6.898 1.00 0.00 H new ATOM 0 HA GLU A 102 1.296 -15.133 -4.153 1.00 0.00 H new ATOM 0 HB2 GLU A 102 0.884 -17.357 -5.121 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -0.098 -16.176 -5.966 1.00 0.00 H new ATOM 0 HG2 GLU A 102 1.808 -15.994 -7.698 1.00 0.00 H new ATOM 0 HG3 GLU A 102 2.551 -17.374 -6.914 1.00 0.00 H new ATOM 1479 N LYS A 103 4.083 -15.211 -5.679 1.00 0.00 N ATOM 1480 CA LYS A 103 5.517 -15.598 -5.543 1.00 0.00 C ATOM 1481 C LYS A 103 6.079 -15.035 -4.235 1.00 0.00 C ATOM 1482 O LYS A 103 7.109 -15.466 -3.755 1.00 0.00 O ATOM 1483 CB LYS A 103 6.313 -15.031 -6.721 1.00 0.00 C ATOM 1484 CG LYS A 103 6.109 -15.917 -7.951 1.00 0.00 C ATOM 1485 CD LYS A 103 7.468 -16.415 -8.448 1.00 0.00 C ATOM 1486 CE LYS A 103 7.448 -16.510 -9.975 1.00 0.00 C ATOM 1487 NZ LYS A 103 6.145 -17.079 -10.422 1.00 0.00 N ATOM 0 H LYS A 103 3.893 -14.480 -6.365 1.00 0.00 H new ATOM 0 HA LYS A 103 5.598 -16.685 -5.536 1.00 0.00 H new ATOM 0 HB2 LYS A 103 5.989 -14.013 -6.936 1.00 0.00 H new ATOM 0 HB3 LYS A 103 7.372 -14.981 -6.467 1.00 0.00 H new ATOM 0 HG2 LYS A 103 5.468 -16.763 -7.702 1.00 0.00 H new ATOM 0 HG3 LYS A 103 5.605 -15.356 -8.738 1.00 0.00 H new ATOM 0 HD2 LYS A 103 8.257 -15.735 -8.125 1.00 0.00 H new ATOM 0 HD3 LYS A 103 7.691 -17.390 -8.015 1.00 0.00 H new ATOM 0 HE2 LYS A 103 7.595 -15.523 -10.413 1.00 0.00 H new ATOM 0 HE3 LYS A 103 8.269 -17.138 -10.321 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 6.275 -17.576 -11.327 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 5.795 -17.748 -9.707 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 5.455 -16.311 -10.545 1.00 0.00 H new ATOM 1501 N ILE A 104 5.414 -14.073 -3.656 1.00 0.00 N ATOM 1502 CA ILE A 104 5.917 -13.485 -2.383 1.00 0.00 C ATOM 1503 C ILE A 104 4.896 -13.730 -1.268 1.00 0.00 C ATOM 1504 O ILE A 104 3.877 -13.074 -1.192 1.00 0.00 O ATOM 1505 CB ILE A 104 6.127 -11.980 -2.566 1.00 0.00 C ATOM 1506 CG1 ILE A 104 7.235 -11.744 -3.596 1.00 0.00 C ATOM 1507 CG2 ILE A 104 6.535 -11.351 -1.233 1.00 0.00 C ATOM 1508 CD1 ILE A 104 6.890 -10.519 -4.447 1.00 0.00 C ATOM 0 H ILE A 104 4.546 -13.670 -4.009 1.00 0.00 H new ATOM 0 HA ILE A 104 6.864 -13.953 -2.114 1.00 0.00 H new ATOM 0 HB ILE A 104 5.199 -11.525 -2.912 1.00 0.00 H new ATOM 0 HG12 ILE A 104 8.189 -11.592 -3.091 1.00 0.00 H new ATOM 0 HG13 ILE A 104 7.347 -12.622 -4.232 1.00 0.00 H new ATOM 0 HG21 ILE A 104 6.684 -10.280 -1.367 1.00 0.00 H new ATOM 0 HG22 ILE A 104 5.750 -11.519 -0.496 1.00 0.00 H new ATOM 0 HG23 ILE A 104 7.463 -11.805 -0.885 1.00 0.00 H new ATOM 0 HD11 ILE A 104 7.679 -10.351 -5.180 1.00 0.00 H new ATOM 0 HD12 ILE A 104 5.945 -10.689 -4.963 1.00 0.00 H new ATOM 0 HD13 ILE A 104 6.800 -9.643 -3.804 1.00 0.00 H new ATOM 1520 N GLN A 105 5.163 -14.670 -0.402 1.00 0.00 N ATOM 1521 CA GLN A 105 4.209 -14.958 0.707 1.00 0.00 C ATOM 1522 C GLN A 105 4.118 -13.734 1.627 1.00 0.00 C ATOM 1523 O GLN A 105 5.109 -13.077 1.874 1.00 0.00 O ATOM 1524 CB GLN A 105 4.710 -16.163 1.508 1.00 0.00 C ATOM 1525 CG GLN A 105 3.532 -17.076 1.856 1.00 0.00 C ATOM 1526 CD GLN A 105 4.052 -18.470 2.216 1.00 0.00 C ATOM 1527 OE1 GLN A 105 4.945 -18.606 3.027 1.00 0.00 O ATOM 1528 NE2 GLN A 105 3.527 -19.519 1.642 1.00 0.00 N ATOM 0 H GLN A 105 6.001 -15.251 -0.415 1.00 0.00 H new ATOM 0 HA GLN A 105 3.224 -15.180 0.296 1.00 0.00 H new ATOM 0 HB2 GLN A 105 5.451 -16.714 0.929 1.00 0.00 H new ATOM 0 HB3 GLN A 105 5.204 -15.826 2.420 1.00 0.00 H new ATOM 0 HG2 GLN A 105 2.970 -16.659 2.692 1.00 0.00 H new ATOM 0 HG3 GLN A 105 2.846 -17.140 1.011 1.00 0.00 H new ATOM 0 HE21 GLN A 105 2.777 -19.405 0.960 1.00 0.00 H new ATOM 0 HE22 GLN A 105 3.867 -20.452 1.875 1.00 0.00 H new ATOM 1537 N PRO A 106 2.930 -13.464 2.108 1.00 0.00 N ATOM 1538 CA PRO A 106 2.691 -12.318 3.005 1.00 0.00 C ATOM 1539 C PRO A 106 3.508 -12.477 4.290 1.00 0.00 C ATOM 1540 O PRO A 106 3.819 -13.576 4.707 1.00 0.00 O ATOM 1541 CB PRO A 106 1.188 -12.362 3.310 1.00 0.00 C ATOM 1542 CG PRO A 106 0.590 -13.579 2.556 1.00 0.00 C ATOM 1543 CD PRO A 106 1.735 -14.270 1.801 1.00 0.00 C ATOM 0 HA PRO A 106 2.987 -11.370 2.557 1.00 0.00 H new ATOM 0 HB2 PRO A 106 1.018 -12.455 4.383 1.00 0.00 H new ATOM 0 HB3 PRO A 106 0.705 -11.439 2.990 1.00 0.00 H new ATOM 0 HG2 PRO A 106 0.122 -14.270 3.257 1.00 0.00 H new ATOM 0 HG3 PRO A 106 -0.185 -13.255 1.862 1.00 0.00 H new ATOM 0 HD2 PRO A 106 1.859 -15.302 2.129 1.00 0.00 H new ATOM 0 HD3 PRO A 106 1.542 -14.298 0.729 1.00 0.00 H new ATOM 1551 N GLY A 107 3.859 -11.390 4.922 1.00 0.00 N ATOM 1552 CA GLY A 107 4.656 -11.482 6.178 1.00 0.00 C ATOM 1553 C GLY A 107 6.081 -10.987 5.919 1.00 0.00 C ATOM 1554 O GLY A 107 6.779 -10.577 6.823 1.00 0.00 O ATOM 0 H GLY A 107 3.628 -10.443 4.623 1.00 0.00 H new ATOM 0 HA2 GLY A 107 4.189 -10.885 6.961 1.00 0.00 H new ATOM 0 HA3 GLY A 107 4.677 -12.512 6.533 1.00 0.00 H new ATOM 1558 N THR A 108 6.516 -11.021 4.688 1.00 0.00 N ATOM 1559 CA THR A 108 7.894 -10.551 4.373 1.00 0.00 C ATOM 1560 C THR A 108 7.839 -9.112 3.856 1.00 0.00 C ATOM 1561 O THR A 108 8.517 -8.237 4.357 1.00 0.00 O ATOM 1562 CB THR A 108 8.509 -11.453 3.300 1.00 0.00 C ATOM 1563 OG1 THR A 108 8.356 -12.813 3.682 1.00 0.00 O ATOM 1564 CG2 THR A 108 9.996 -11.127 3.150 1.00 0.00 C ATOM 0 H THR A 108 5.977 -11.354 3.889 1.00 0.00 H new ATOM 0 HA THR A 108 8.504 -10.590 5.275 1.00 0.00 H new ATOM 0 HB THR A 108 8.004 -11.284 2.349 1.00 0.00 H new ATOM 0 HG1 THR A 108 8.748 -13.392 2.995 1.00 0.00 H new ATOM 0 HG21 THR A 108 10.434 -11.769 2.386 1.00 0.00 H new ATOM 0 HG22 THR A 108 10.112 -10.084 2.857 1.00 0.00 H new ATOM 0 HG23 THR A 108 10.503 -11.296 4.100 1.00 0.00 H new ATOM 1572 N ALA A 109 7.039 -8.859 2.857 1.00 0.00 N ATOM 1573 CA ALA A 109 6.944 -7.475 2.311 1.00 0.00 C ATOM 1574 C ALA A 109 6.159 -6.595 3.286 1.00 0.00 C ATOM 1575 O ALA A 109 6.405 -5.411 3.405 1.00 0.00 O ATOM 1576 CB ALA A 109 6.223 -7.507 0.960 1.00 0.00 C ATOM 0 H ALA A 109 6.447 -9.550 2.395 1.00 0.00 H new ATOM 0 HA ALA A 109 7.946 -7.067 2.179 1.00 0.00 H new ATOM 0 HB1 ALA A 109 6.153 -6.495 0.561 1.00 0.00 H new ATOM 0 HB2 ALA A 109 6.781 -8.134 0.265 1.00 0.00 H new ATOM 0 HB3 ALA A 109 5.221 -7.915 1.092 1.00 0.00 H new ATOM 1582 N ALA A 110 5.215 -7.165 3.982 1.00 0.00 N ATOM 1583 CA ALA A 110 4.411 -6.362 4.948 1.00 0.00 C ATOM 1584 C ALA A 110 5.283 -5.976 6.145 1.00 0.00 C ATOM 1585 O ALA A 110 5.062 -4.968 6.786 1.00 0.00 O ATOM 1586 CB ALA A 110 3.221 -7.192 5.433 1.00 0.00 C ATOM 0 H ALA A 110 4.965 -8.152 3.924 1.00 0.00 H new ATOM 0 HA ALA A 110 4.050 -5.459 4.456 1.00 0.00 H new ATOM 0 HB1 ALA A 110 2.633 -6.606 6.139 1.00 0.00 H new ATOM 0 HB2 ALA A 110 2.598 -7.467 4.582 1.00 0.00 H new ATOM 0 HB3 ALA A 110 3.583 -8.095 5.924 1.00 0.00 H new ATOM 1592 N ASN A 111 6.271 -6.770 6.452 1.00 0.00 N ATOM 1593 CA ASN A 111 7.153 -6.451 7.610 1.00 0.00 C ATOM 1594 C ASN A 111 8.155 -5.364 7.212 1.00 0.00 C ATOM 1595 O ASN A 111 8.329 -4.382 7.907 1.00 0.00 O ATOM 1596 CB ASN A 111 7.911 -7.710 8.032 1.00 0.00 C ATOM 1597 CG ASN A 111 7.555 -8.063 9.477 1.00 0.00 C ATOM 1598 OD1 ASN A 111 6.489 -7.725 9.951 1.00 0.00 O ATOM 1599 ND2 ASN A 111 8.409 -8.732 10.202 1.00 0.00 N ATOM 0 H ASN A 111 6.506 -7.627 5.951 1.00 0.00 H new ATOM 0 HA ASN A 111 6.544 -6.094 8.440 1.00 0.00 H new ATOM 0 HB2 ASN A 111 7.656 -8.539 7.371 1.00 0.00 H new ATOM 0 HB3 ASN A 111 8.985 -7.548 7.941 1.00 0.00 H new ATOM 0 HD21 ASN A 111 8.181 -8.971 11.167 1.00 0.00 H new ATOM 0 HD22 ASN A 111 9.304 -9.016 9.804 1.00 0.00 H new ATOM 1606 N VAL A 112 8.819 -5.531 6.101 1.00 0.00 N ATOM 1607 CA VAL A 112 9.810 -4.508 5.664 1.00 0.00 C ATOM 1608 C VAL A 112 9.110 -3.159 5.492 1.00 0.00 C ATOM 1609 O VAL A 112 9.735 -2.117 5.522 1.00 0.00 O ATOM 1610 CB VAL A 112 10.429 -4.937 4.331 1.00 0.00 C ATOM 1611 CG1 VAL A 112 9.376 -4.845 3.227 1.00 0.00 C ATOM 1612 CG2 VAL A 112 11.602 -4.013 3.993 1.00 0.00 C ATOM 0 H VAL A 112 8.718 -6.332 5.477 1.00 0.00 H new ATOM 0 HA VAL A 112 10.593 -4.415 6.416 1.00 0.00 H new ATOM 0 HB VAL A 112 10.785 -5.964 4.410 1.00 0.00 H new ATOM 0 HG11 VAL A 112 9.816 -5.150 2.278 1.00 0.00 H new ATOM 0 HG12 VAL A 112 8.539 -5.501 3.467 1.00 0.00 H new ATOM 0 HG13 VAL A 112 9.020 -3.818 3.148 1.00 0.00 H new ATOM 0 HG21 VAL A 112 12.043 -4.318 3.044 1.00 0.00 H new ATOM 0 HG22 VAL A 112 11.245 -2.986 3.914 1.00 0.00 H new ATOM 0 HG23 VAL A 112 12.354 -4.077 4.780 1.00 0.00 H new ATOM 1622 N VAL A 113 7.818 -3.168 5.309 1.00 0.00 N ATOM 1623 CA VAL A 113 7.081 -1.885 5.131 1.00 0.00 C ATOM 1624 C VAL A 113 6.864 -1.219 6.492 1.00 0.00 C ATOM 1625 O VAL A 113 6.860 -0.011 6.607 1.00 0.00 O ATOM 1626 CB VAL A 113 5.728 -2.163 4.476 1.00 0.00 C ATOM 1627 CG1 VAL A 113 4.921 -0.867 4.395 1.00 0.00 C ATOM 1628 CG2 VAL A 113 5.949 -2.713 3.066 1.00 0.00 C ATOM 0 H VAL A 113 7.241 -4.008 5.275 1.00 0.00 H new ATOM 0 HA VAL A 113 7.664 -1.219 4.495 1.00 0.00 H new ATOM 0 HB VAL A 113 5.181 -2.894 5.072 1.00 0.00 H new ATOM 0 HG11 VAL A 113 3.957 -1.067 3.928 1.00 0.00 H new ATOM 0 HG12 VAL A 113 4.763 -0.474 5.399 1.00 0.00 H new ATOM 0 HG13 VAL A 113 5.467 -0.135 3.800 1.00 0.00 H new ATOM 0 HG21 VAL A 113 4.985 -2.912 2.598 1.00 0.00 H new ATOM 0 HG22 VAL A 113 6.497 -1.982 2.472 1.00 0.00 H new ATOM 0 HG23 VAL A 113 6.523 -3.638 3.122 1.00 0.00 H new ATOM 1638 N GLU A 114 6.685 -1.997 7.524 1.00 0.00 N ATOM 1639 CA GLU A 114 6.470 -1.402 8.873 1.00 0.00 C ATOM 1640 C GLU A 114 7.678 -0.544 9.249 1.00 0.00 C ATOM 1641 O GLU A 114 7.565 0.646 9.462 1.00 0.00 O ATOM 1642 CB GLU A 114 6.302 -2.521 9.903 1.00 0.00 C ATOM 1643 CG GLU A 114 4.925 -3.167 9.740 1.00 0.00 C ATOM 1644 CD GLU A 114 4.894 -4.502 10.486 1.00 0.00 C ATOM 1645 OE1 GLU A 114 4.661 -4.485 11.683 1.00 0.00 O ATOM 1646 OE2 GLU A 114 5.102 -5.520 9.845 1.00 0.00 O ATOM 0 H GLU A 114 6.678 -3.016 7.492 1.00 0.00 H new ATOM 0 HA GLU A 114 5.573 -0.783 8.858 1.00 0.00 H new ATOM 0 HB2 GLU A 114 7.084 -3.269 9.772 1.00 0.00 H new ATOM 0 HB3 GLU A 114 6.410 -2.120 10.911 1.00 0.00 H new ATOM 0 HG2 GLU A 114 4.152 -2.504 10.129 1.00 0.00 H new ATOM 0 HG3 GLU A 114 4.708 -3.324 8.683 1.00 0.00 H new ATOM 1653 N LYS A 115 8.836 -1.140 9.335 1.00 0.00 N ATOM 1654 CA LYS A 115 10.049 -0.357 9.701 1.00 0.00 C ATOM 1655 C LYS A 115 10.312 0.711 8.637 1.00 0.00 C ATOM 1656 O LYS A 115 10.711 1.817 8.943 1.00 0.00 O ATOM 1657 CB LYS A 115 11.253 -1.297 9.793 1.00 0.00 C ATOM 1658 CG LYS A 115 11.310 -1.910 11.193 1.00 0.00 C ATOM 1659 CD LYS A 115 11.652 -3.397 11.089 1.00 0.00 C ATOM 1660 CE LYS A 115 10.554 -4.120 10.307 1.00 0.00 C ATOM 1661 NZ LYS A 115 11.069 -4.500 8.963 1.00 0.00 N ATOM 0 H LYS A 115 8.994 -2.134 9.168 1.00 0.00 H new ATOM 0 HA LYS A 115 9.891 0.127 10.665 1.00 0.00 H new ATOM 0 HB2 LYS A 115 11.173 -2.083 9.042 1.00 0.00 H new ATOM 0 HB3 LYS A 115 12.173 -0.750 9.585 1.00 0.00 H new ATOM 0 HG2 LYS A 115 12.059 -1.396 11.796 1.00 0.00 H new ATOM 0 HG3 LYS A 115 10.352 -1.781 11.697 1.00 0.00 H new ATOM 0 HD2 LYS A 115 12.613 -3.526 10.591 1.00 0.00 H new ATOM 0 HD3 LYS A 115 11.749 -3.829 12.085 1.00 0.00 H new ATOM 0 HE2 LYS A 115 10.232 -5.009 10.849 1.00 0.00 H new ATOM 0 HE3 LYS A 115 9.681 -3.475 10.205 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 10.327 -4.346 8.251 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 11.898 -3.917 8.731 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 11.342 -5.504 8.967 1.00 0.00 H new ATOM 1675 N LEU A 116 10.095 0.391 7.389 1.00 0.00 N ATOM 1676 CA LEU A 116 10.336 1.396 6.314 1.00 0.00 C ATOM 1677 C LEU A 116 9.481 2.637 6.573 1.00 0.00 C ATOM 1678 O LEU A 116 9.799 3.724 6.132 1.00 0.00 O ATOM 1679 CB LEU A 116 9.970 0.795 4.955 1.00 0.00 C ATOM 1680 CG LEU A 116 11.249 0.440 4.196 1.00 0.00 C ATOM 1681 CD1 LEU A 116 10.893 -0.324 2.920 1.00 0.00 C ATOM 1682 CD2 LEU A 116 11.996 1.724 3.828 1.00 0.00 C ATOM 0 H LEU A 116 9.763 -0.519 7.069 1.00 0.00 H new ATOM 0 HA LEU A 116 11.389 1.676 6.312 1.00 0.00 H new ATOM 0 HB2 LEU A 116 9.356 -0.095 5.092 1.00 0.00 H new ATOM 0 HB3 LEU A 116 9.377 1.505 4.379 1.00 0.00 H new ATOM 0 HG LEU A 116 11.883 -0.183 4.827 1.00 0.00 H new ATOM 0 HD11 LEU A 116 11.806 -0.576 2.380 1.00 0.00 H new ATOM 0 HD12 LEU A 116 10.361 -1.239 3.180 1.00 0.00 H new ATOM 0 HD13 LEU A 116 10.258 0.298 2.289 1.00 0.00 H new ATOM 0 HD21 LEU A 116 12.908 1.472 3.287 1.00 0.00 H new ATOM 0 HD22 LEU A 116 11.361 2.347 3.198 1.00 0.00 H new ATOM 0 HD23 LEU A 116 12.252 2.269 4.737 1.00 0.00 H new ATOM 1694 N ALA A 117 8.399 2.486 7.286 1.00 0.00 N ATOM 1695 CA ALA A 117 7.527 3.660 7.573 1.00 0.00 C ATOM 1696 C ALA A 117 8.125 4.463 8.731 1.00 0.00 C ATOM 1697 O ALA A 117 7.961 5.660 8.818 1.00 0.00 O ATOM 1698 CB ALA A 117 6.126 3.178 7.951 1.00 0.00 C ATOM 0 H ALA A 117 8.081 1.601 7.682 1.00 0.00 H new ATOM 0 HA ALA A 117 7.462 4.292 6.687 1.00 0.00 H new ATOM 0 HB1 ALA A 117 5.490 4.038 8.161 1.00 0.00 H new ATOM 0 HB2 ALA A 117 5.703 2.606 7.125 1.00 0.00 H new ATOM 0 HB3 ALA A 117 6.185 2.546 8.837 1.00 0.00 H new ATOM 1704 N ASP A 118 8.819 3.815 9.622 1.00 0.00 N ATOM 1705 CA ASP A 118 9.424 4.551 10.767 1.00 0.00 C ATOM 1706 C ASP A 118 10.575 5.425 10.259 1.00 0.00 C ATOM 1707 O ASP A 118 10.769 6.538 10.708 1.00 0.00 O ATOM 1708 CB ASP A 118 9.958 3.550 11.794 1.00 0.00 C ATOM 1709 CG ASP A 118 9.377 3.872 13.172 1.00 0.00 C ATOM 1710 OD1 ASP A 118 9.618 4.967 13.653 1.00 0.00 O ATOM 1711 OD2 ASP A 118 8.702 3.018 13.723 1.00 0.00 O ATOM 0 H ASP A 118 8.994 2.810 9.608 1.00 0.00 H new ATOM 0 HA ASP A 118 8.667 5.181 11.235 1.00 0.00 H new ATOM 0 HB2 ASP A 118 9.688 2.535 11.502 1.00 0.00 H new ATOM 0 HB3 ASP A 118 11.047 3.593 11.828 1.00 0.00 H new ATOM 1716 N TYR A 119 11.342 4.931 9.323 1.00 0.00 N ATOM 1717 CA TYR A 119 12.480 5.733 8.787 1.00 0.00 C ATOM 1718 C TYR A 119 11.944 6.823 7.852 1.00 0.00 C ATOM 1719 O TYR A 119 12.321 7.974 7.948 1.00 0.00 O ATOM 1720 CB TYR A 119 13.429 4.809 8.016 1.00 0.00 C ATOM 1721 CG TYR A 119 14.381 5.631 7.178 1.00 0.00 C ATOM 1722 CD1 TYR A 119 15.401 6.366 7.793 1.00 0.00 C ATOM 1723 CD2 TYR A 119 14.243 5.655 5.784 1.00 0.00 C ATOM 1724 CE1 TYR A 119 16.284 7.124 7.016 1.00 0.00 C ATOM 1725 CE2 TYR A 119 15.126 6.413 5.006 1.00 0.00 C ATOM 1726 CZ TYR A 119 16.147 7.149 5.622 1.00 0.00 C ATOM 1727 OH TYR A 119 17.017 7.896 4.855 1.00 0.00 O ATOM 0 H TYR A 119 11.229 4.007 8.907 1.00 0.00 H new ATOM 0 HA TYR A 119 13.019 6.202 9.610 1.00 0.00 H new ATOM 0 HB2 TYR A 119 13.990 4.186 8.713 1.00 0.00 H new ATOM 0 HB3 TYR A 119 12.856 4.137 7.377 1.00 0.00 H new ATOM 0 HD1 TYR A 119 15.507 6.348 8.868 1.00 0.00 H new ATOM 0 HD2 TYR A 119 13.455 5.089 5.310 1.00 0.00 H new ATOM 0 HE1 TYR A 119 17.072 7.690 7.491 1.00 0.00 H new ATOM 0 HE2 TYR A 119 15.020 6.431 3.931 1.00 0.00 H new ATOM 0 HH TYR A 119 16.782 7.802 3.908 1.00 0.00 H new ATOM 1737 N LEU A 120 11.068 6.471 6.952 1.00 0.00 N ATOM 1738 CA LEU A 120 10.510 7.489 6.017 1.00 0.00 C ATOM 1739 C LEU A 120 9.779 8.569 6.818 1.00 0.00 C ATOM 1740 O LEU A 120 10.087 9.741 6.730 1.00 0.00 O ATOM 1741 CB LEU A 120 9.524 6.811 5.062 1.00 0.00 C ATOM 1742 CG LEU A 120 10.177 6.626 3.692 1.00 0.00 C ATOM 1743 CD1 LEU A 120 9.599 5.382 3.014 1.00 0.00 C ATOM 1744 CD2 LEU A 120 9.894 7.853 2.825 1.00 0.00 C ATOM 0 H LEU A 120 10.714 5.523 6.823 1.00 0.00 H new ATOM 0 HA LEU A 120 11.320 7.944 5.446 1.00 0.00 H new ATOM 0 HB2 LEU A 120 9.220 5.845 5.464 1.00 0.00 H new ATOM 0 HB3 LEU A 120 8.622 7.415 4.967 1.00 0.00 H new ATOM 0 HG LEU A 120 11.253 6.506 3.816 1.00 0.00 H new ATOM 0 HD11 LEU A 120 10.065 5.250 2.037 1.00 0.00 H new ATOM 0 HD12 LEU A 120 9.797 4.506 3.631 1.00 0.00 H new ATOM 0 HD13 LEU A 120 8.523 5.502 2.890 1.00 0.00 H new ATOM 0 HD21 LEU A 120 10.359 7.723 1.848 1.00 0.00 H new ATOM 0 HD22 LEU A 120 8.817 7.971 2.702 1.00 0.00 H new ATOM 0 HD23 LEU A 120 10.304 8.741 3.306 1.00 0.00 H new ATOM 1756 N ILE A 121 8.807 8.177 7.594 1.00 0.00 N ATOM 1757 CA ILE A 121 8.038 9.163 8.406 1.00 0.00 C ATOM 1758 C ILE A 121 8.975 9.877 9.386 1.00 0.00 C ATOM 1759 O ILE A 121 8.625 10.883 9.970 1.00 0.00 O ATOM 1760 CB ILE A 121 6.949 8.427 9.189 1.00 0.00 C ATOM 1761 CG1 ILE A 121 6.085 7.619 8.217 1.00 0.00 C ATOM 1762 CG2 ILE A 121 6.072 9.437 9.931 1.00 0.00 C ATOM 1763 CD1 ILE A 121 5.515 6.393 8.933 1.00 0.00 C ATOM 0 H ILE A 121 8.510 7.207 7.702 1.00 0.00 H new ATOM 0 HA ILE A 121 7.585 9.901 7.744 1.00 0.00 H new ATOM 0 HB ILE A 121 7.414 7.757 9.912 1.00 0.00 H new ATOM 0 HG12 ILE A 121 5.274 8.239 7.834 1.00 0.00 H new ATOM 0 HG13 ILE A 121 6.680 7.307 7.359 1.00 0.00 H new ATOM 0 HG21 ILE A 121 5.298 8.908 10.487 1.00 0.00 H new ATOM 0 HG22 ILE A 121 6.686 10.013 10.623 1.00 0.00 H new ATOM 0 HG23 ILE A 121 5.606 10.111 9.212 1.00 0.00 H new ATOM 0 HD11 ILE A 121 4.900 5.819 8.239 1.00 0.00 H new ATOM 0 HD12 ILE A 121 6.333 5.769 9.294 1.00 0.00 H new ATOM 0 HD13 ILE A 121 4.905 6.715 9.777 1.00 0.00 H new ATOM 1775 N GLY A 122 10.160 9.367 9.574 1.00 0.00 N ATOM 1776 CA GLY A 122 11.109 10.020 10.522 1.00 0.00 C ATOM 1777 C GLY A 122 11.488 11.409 10.003 1.00 0.00 C ATOM 1778 O GLY A 122 12.110 12.190 10.695 1.00 0.00 O ATOM 0 H GLY A 122 10.513 8.528 9.114 1.00 0.00 H new ATOM 0 HA2 GLY A 122 10.653 10.103 11.508 1.00 0.00 H new ATOM 0 HA3 GLY A 122 12.004 9.407 10.635 1.00 0.00 H new ATOM 1782 N GLN A 123 11.121 11.724 8.792 1.00 0.00 N ATOM 1783 CA GLN A 123 11.465 13.063 8.233 1.00 0.00 C ATOM 1784 C GLN A 123 10.179 13.815 7.883 1.00 0.00 C ATOM 1785 O GLN A 123 9.943 14.911 8.351 1.00 0.00 O ATOM 1786 CB GLN A 123 12.312 12.884 6.972 1.00 0.00 C ATOM 1787 CG GLN A 123 13.192 11.640 7.120 1.00 0.00 C ATOM 1788 CD GLN A 123 14.160 11.835 8.288 1.00 0.00 C ATOM 1789 OE1 GLN A 123 14.259 10.990 9.157 1.00 0.00 O ATOM 1790 NE2 GLN A 123 14.883 12.919 8.348 1.00 0.00 N ATOM 0 H GLN A 123 10.598 11.113 8.165 1.00 0.00 H new ATOM 0 HA GLN A 123 12.028 13.633 8.972 1.00 0.00 H new ATOM 0 HB2 GLN A 123 11.667 12.784 6.099 1.00 0.00 H new ATOM 0 HB3 GLN A 123 12.933 13.765 6.810 1.00 0.00 H new ATOM 0 HG2 GLN A 123 12.571 10.761 7.292 1.00 0.00 H new ATOM 0 HG3 GLN A 123 13.748 11.463 6.199 1.00 0.00 H new ATOM 0 HE21 GLN A 123 14.800 13.628 7.619 1.00 0.00 H new ATOM 0 HE22 GLN A 123 15.531 13.058 9.123 1.00 0.00 H new ATOM 1799 N GLY A 124 9.346 13.234 7.062 1.00 0.00 N ATOM 1800 CA GLY A 124 8.078 13.915 6.683 1.00 0.00 C ATOM 1801 C GLY A 124 8.102 14.246 5.190 1.00 0.00 C ATOM 1802 O GLY A 124 8.871 15.071 4.740 1.00 0.00 O ATOM 0 H GLY A 124 9.490 12.317 6.638 1.00 0.00 H new ATOM 0 HA2 GLY A 124 7.227 13.274 6.910 1.00 0.00 H new ATOM 0 HA3 GLY A 124 7.955 14.827 7.266 1.00 0.00 H new ATOM 1806 N PHE A 125 7.266 13.608 4.419 1.00 0.00 N ATOM 1807 CA PHE A 125 7.242 13.887 2.954 1.00 0.00 C ATOM 1808 C PHE A 125 6.392 15.130 2.691 1.00 0.00 C ATOM 1809 O PHE A 125 5.979 15.314 1.558 1.00 0.00 O ATOM 1810 CB PHE A 125 6.640 12.696 2.194 1.00 0.00 C ATOM 1811 CG PHE A 125 6.739 11.440 3.025 1.00 0.00 C ATOM 1812 CD1 PHE A 125 7.930 11.130 3.692 1.00 0.00 C ATOM 1813 CD2 PHE A 125 5.638 10.584 3.126 1.00 0.00 C ATOM 1814 CE1 PHE A 125 8.017 9.964 4.460 1.00 0.00 C ATOM 1815 CE2 PHE A 125 5.725 9.420 3.894 1.00 0.00 C ATOM 1816 CZ PHE A 125 6.913 9.108 4.561 1.00 0.00 C ATOM 1817 OXT PHE A 125 6.165 15.878 3.629 1.00 0.00 O ATOM 0 H PHE A 125 6.599 12.906 4.739 1.00 0.00 H new ATOM 0 HA PHE A 125 8.263 14.051 2.609 1.00 0.00 H new ATOM 0 HB2 PHE A 125 5.597 12.899 1.953 1.00 0.00 H new ATOM 0 HB3 PHE A 125 7.164 12.557 1.248 1.00 0.00 H new ATOM 0 HD1 PHE A 125 8.781 11.790 3.614 1.00 0.00 H new ATOM 0 HD2 PHE A 125 4.720 10.823 2.610 1.00 0.00 H new ATOM 0 HE1 PHE A 125 8.935 9.724 4.975 1.00 0.00 H new ATOM 0 HE2 PHE A 125 4.873 8.761 3.972 1.00 0.00 H new ATOM 0 HZ PHE A 125 6.980 8.208 5.154 1.00 0.00 H new TER 1827 PHE A 125