USER MOD reduce.3.24.130724 H: found=0, std=0, add=1045, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 853 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 56 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 10 TYR OH : rot 180:sc= 0 USER MOD Single : A 12 ASN : amide:sc=-0.00017 X(o=-0.00017,f=-0.00017) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 15 ASN : amide:sc= -0.0942 X(o=-0.094,f=-0.094) USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 27 TYR OH : rot 180:sc= 0 USER MOD Single : A 29 GLN : amide:sc= -0.216 K(o=-0.22,f=-2.8!) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 THR OG1 : rot -54:sc= 0.168 USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 52 TYR OH : rot 180:sc= 0 USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 TYR OH : rot 180:sc= 0 USER MOD Single : A 59 LYS NZ :NH3+ -138:sc= 0.132 (180deg=0) USER MOD Single : A 61 GLN : amide:sc= 0 X(o=0,f=-0.32) USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 ASN :FLIP amide:sc= -0.315 F(o=-3.4!,f=-0.31) USER MOD Single : A 72 THR OG1 : rot 180:sc= 0 USER MOD Single : A 76 ASN : amide:sc=-0.00842 K(o=-0.0084,f=-1.3) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 THR OG1 : rot 180:sc= 0 USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 GLN : amide:sc= 0 X(o=0,f=-0.18) USER MOD Single : A 94 SER OG : rot -122:sc= 0.565 USER MOD Single : A 96 ASN : amide:sc= 0 X(o=0,f=-0.0034) USER MOD Single : A 103 GLN : amide:sc= -0.312 K(o=-0.31,f=-0.87) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 TYR OH : rot 180:sc= 0 USER MOD Single : A 112 SER OG : rot 48:sc= 0.00605 USER MOD Single : A 113 THR OG1 : rot 180:sc= 0 USER MOD Single : A 114 SER OG : rot 179:sc= 1.83 USER MOD Single : A 115 ASN : amide:sc= 0 X(o=0,f=-0.013) USER MOD Single : A 123 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 124 GLN : amide:sc= 0 X(o=0,f=-0.11) USER MOD Single : A 130 GLN : amide:sc= 0 X(o=0,f=-0.21) USER MOD Single : A 131 THR OG1 : rot 180:sc= 0 USER MOD Single : A 134 MET CE :methyl -125:sc= 0 (180deg=-0.0268) USER MOD Single : A 135 LYS NZ :NH3+ -176:sc= 0.469 (180deg=0.459) USER MOD Single : A 138 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 139 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 GLN : amide:sc= 0 X(o=0,f=-0.32) USER MOD ----------------------------------------------------------------- ATOM 29 N SER A 3 -12.677 14.033 9.904 1.00 0.00 N ATOM 30 CA SER A 3 -13.015 12.662 9.466 1.00 0.00 C ATOM 31 C SER A 3 -13.290 12.656 7.961 1.00 0.00 C ATOM 32 O SER A 3 -14.315 13.169 7.509 1.00 0.00 O ATOM 33 CB SER A 3 -14.242 12.126 10.227 1.00 0.00 C ATOM 34 OG SER A 3 -13.836 11.534 11.450 1.00 0.00 O ATOM 0 HA SER A 3 -12.169 12.011 9.685 1.00 0.00 H new ATOM 0 HB2 SER A 3 -14.942 12.938 10.422 1.00 0.00 H new ATOM 0 HB3 SER A 3 -14.767 11.392 9.615 1.00 0.00 H new ATOM 0 HG SER A 3 -14.623 11.198 11.928 1.00 0.00 H new ATOM 39 N ILE A 4 -12.364 12.084 7.180 1.00 0.00 N ATOM 40 CA ILE A 4 -12.426 11.995 5.705 1.00 0.00 C ATOM 41 C ILE A 4 -12.316 10.546 5.195 1.00 0.00 C ATOM 42 O ILE A 4 -12.981 10.208 4.221 1.00 0.00 O ATOM 43 CB ILE A 4 -11.360 12.878 5.002 1.00 0.00 C ATOM 44 CG1 ILE A 4 -10.032 13.114 5.770 1.00 0.00 C ATOM 45 CG2 ILE A 4 -11.979 14.197 4.531 1.00 0.00 C ATOM 46 CD1 ILE A 4 -10.004 14.253 6.795 1.00 0.00 C ATOM 0 H ILE A 4 -11.522 11.655 7.564 1.00 0.00 H new ATOM 0 HA ILE A 4 -13.412 12.379 5.442 1.00 0.00 H new ATOM 0 HB ILE A 4 -11.045 12.283 4.145 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -9.772 12.190 6.286 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -9.247 13.301 5.037 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -11.216 14.802 4.041 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -12.785 13.990 3.828 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -12.376 14.739 5.389 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -9.017 14.304 7.255 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -10.221 15.197 6.296 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -10.754 14.069 7.564 1.00 0.00 H new ATOM 57 N VAL A 5 -11.556 9.687 5.891 1.00 0.00 N ATOM 58 CA VAL A 5 -11.401 8.236 5.627 1.00 0.00 C ATOM 59 C VAL A 5 -10.989 7.912 4.178 1.00 0.00 C ATOM 60 O VAL A 5 -11.805 7.660 3.289 1.00 0.00 O ATOM 61 CB VAL A 5 -12.620 7.409 6.080 1.00 0.00 C ATOM 62 CG1 VAL A 5 -12.223 5.926 6.205 1.00 0.00 C ATOM 63 CG2 VAL A 5 -13.164 7.871 7.438 1.00 0.00 C ATOM 0 H VAL A 5 -11.004 9.993 6.692 1.00 0.00 H new ATOM 0 HA VAL A 5 -10.563 7.927 6.252 1.00 0.00 H new ATOM 0 HB VAL A 5 -13.396 7.549 5.328 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -13.087 5.344 6.525 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -11.877 5.559 5.239 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -11.424 5.824 6.939 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -14.022 7.258 7.714 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -12.387 7.769 8.195 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -13.470 8.915 7.371 1.00 0.00 H new ATOM 73 N LEU A 6 -9.678 7.929 3.962 1.00 0.00 N ATOM 74 CA LEU A 6 -9.006 7.677 2.697 1.00 0.00 C ATOM 75 C LEU A 6 -8.377 6.271 2.642 1.00 0.00 C ATOM 76 O LEU A 6 -8.545 5.478 3.565 1.00 0.00 O ATOM 77 CB LEU A 6 -7.970 8.790 2.478 1.00 0.00 C ATOM 78 CG LEU A 6 -8.328 9.909 1.481 1.00 0.00 C ATOM 79 CD1 LEU A 6 -8.641 9.380 0.075 1.00 0.00 C ATOM 80 CD2 LEU A 6 -9.492 10.759 1.986 1.00 0.00 C ATOM 0 H LEU A 6 -9.018 8.132 4.713 1.00 0.00 H new ATOM 0 HA LEU A 6 -9.734 7.694 1.886 1.00 0.00 H new ATOM 0 HB2 LEU A 6 -7.764 9.253 3.443 1.00 0.00 H new ATOM 0 HB3 LEU A 6 -7.043 8.325 2.143 1.00 0.00 H new ATOM 0 HG LEU A 6 -7.438 10.533 1.406 1.00 0.00 H new ATOM 0 HD11 LEU A 6 -8.886 10.215 -0.582 1.00 0.00 H new ATOM 0 HD12 LEU A 6 -7.771 8.853 -0.317 1.00 0.00 H new ATOM 0 HD13 LEU A 6 -9.488 8.696 0.124 1.00 0.00 H new ATOM 0 HD21 LEU A 6 -9.717 11.538 1.257 1.00 0.00 H new ATOM 0 HD22 LEU A 6 -10.370 10.128 2.125 1.00 0.00 H new ATOM 0 HD23 LEU A 6 -9.221 11.219 2.937 1.00 0.00 H new ATOM 91 N GLU A 7 -7.680 5.944 1.538 1.00 0.00 N ATOM 92 CA GLU A 7 -7.179 4.595 1.210 1.00 0.00 C ATOM 93 C GLU A 7 -8.170 3.462 1.650 1.00 0.00 C ATOM 94 O GLU A 7 -7.818 2.632 2.488 1.00 0.00 O ATOM 95 CB GLU A 7 -5.716 4.443 1.726 1.00 0.00 C ATOM 96 CG GLU A 7 -4.730 3.976 0.647 1.00 0.00 C ATOM 97 CD GLU A 7 -3.336 3.713 1.243 1.00 0.00 C ATOM 98 OE1 GLU A 7 -3.141 2.651 1.883 1.00 0.00 O ATOM 99 OE2 GLU A 7 -2.426 4.555 1.038 1.00 0.00 O ATOM 0 H GLU A 7 -7.442 6.634 0.826 1.00 0.00 H new ATOM 0 HA GLU A 7 -7.136 4.473 0.128 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -5.379 5.400 2.125 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -5.703 3.731 2.551 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -5.105 3.067 0.177 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -4.657 4.732 -0.135 1.00 0.00 H new ATOM 104 N PRO A 8 -9.445 3.478 1.195 1.00 0.00 N ATOM 105 CA PRO A 8 -10.516 2.621 1.733 1.00 0.00 C ATOM 106 C PRO A 8 -10.438 1.202 1.146 1.00 0.00 C ATOM 107 O PRO A 8 -10.966 0.953 0.053 1.00 0.00 O ATOM 108 CB PRO A 8 -11.830 3.358 1.402 1.00 0.00 C ATOM 109 CG PRO A 8 -11.499 4.096 0.106 1.00 0.00 C ATOM 110 CD PRO A 8 -10.001 4.401 0.214 1.00 0.00 C ATOM 0 HA PRO A 8 -10.433 2.468 2.809 1.00 0.00 H new ATOM 0 HB2 PRO A 8 -12.659 2.663 1.269 1.00 0.00 H new ATOM 0 HB3 PRO A 8 -12.116 4.047 2.196 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -11.718 3.482 -0.768 1.00 0.00 H new ATOM 0 HG3 PRO A 8 -12.085 5.010 0.008 1.00 0.00 H new ATOM 0 HD2 PRO A 8 -9.512 4.277 -0.752 1.00 0.00 H new ATOM 0 HD3 PRO A 8 -9.840 5.434 0.522 1.00 0.00 H new ATOM 115 N ILE A 9 -9.759 0.262 1.825 1.00 0.00 N ATOM 116 CA ILE A 9 -9.503 -1.089 1.303 1.00 0.00 C ATOM 117 C ILE A 9 -10.283 -2.102 2.147 1.00 0.00 C ATOM 118 O ILE A 9 -9.925 -2.366 3.289 1.00 0.00 O ATOM 119 CB ILE A 9 -7.999 -1.428 1.240 1.00 0.00 C ATOM 120 CG1 ILE A 9 -7.022 -0.252 1.110 1.00 0.00 C ATOM 121 CG2 ILE A 9 -7.739 -2.431 0.111 1.00 0.00 C ATOM 122 CD1 ILE A 9 -7.155 0.600 -0.141 1.00 0.00 C ATOM 0 H ILE A 9 -9.371 0.420 2.755 1.00 0.00 H new ATOM 0 HA ILE A 9 -9.851 -1.134 0.271 1.00 0.00 H new ATOM 0 HB ILE A 9 -7.787 -1.846 2.224 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -7.147 0.394 1.979 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -6.006 -0.645 1.149 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -6.675 -2.667 0.071 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -8.306 -3.343 0.297 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -8.050 -1.998 -0.839 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -6.412 1.397 -0.119 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -6.995 -0.021 -1.023 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -8.154 1.035 -0.180 1.00 0.00 H new ATOM 133 N TYR A 10 -11.363 -2.654 1.592 1.00 0.00 N ATOM 134 CA TYR A 10 -12.349 -3.493 2.305 1.00 0.00 C ATOM 135 C TYR A 10 -12.445 -4.891 1.672 1.00 0.00 C ATOM 136 O TYR A 10 -13.482 -5.269 1.127 1.00 0.00 O ATOM 137 CB TYR A 10 -13.716 -2.784 2.356 1.00 0.00 C ATOM 138 CG TYR A 10 -13.733 -1.417 3.008 1.00 0.00 C ATOM 139 CD1 TYR A 10 -13.132 -1.212 4.274 1.00 0.00 C ATOM 140 CD2 TYR A 10 -14.399 -0.348 2.372 1.00 0.00 C ATOM 141 CE1 TYR A 10 -13.192 0.048 4.884 1.00 0.00 C ATOM 142 CE2 TYR A 10 -14.462 0.909 2.985 1.00 0.00 C ATOM 143 CZ TYR A 10 -13.858 1.121 4.244 1.00 0.00 C ATOM 144 OH TYR A 10 -13.936 2.340 4.829 1.00 0.00 O ATOM 0 H TYR A 10 -11.590 -2.531 0.605 1.00 0.00 H new ATOM 0 HA TYR A 10 -12.012 -3.634 3.332 1.00 0.00 H new ATOM 0 HB2 TYR A 10 -14.088 -2.683 1.337 1.00 0.00 H new ATOM 0 HB3 TYR A 10 -14.417 -3.427 2.889 1.00 0.00 H new ATOM 0 HD1 TYR A 10 -12.627 -2.028 4.770 1.00 0.00 H new ATOM 0 HD2 TYR A 10 -14.862 -0.500 1.408 1.00 0.00 H new ATOM 0 HE1 TYR A 10 -12.728 0.201 5.847 1.00 0.00 H new ATOM 0 HE2 TYR A 10 -14.975 1.721 2.492 1.00 0.00 H new ATOM 0 HH TYR A 10 -14.429 2.953 4.244 1.00 0.00 H new ATOM 153 N TRP A 11 -11.330 -5.628 1.656 1.00 0.00 N ATOM 154 CA TRP A 11 -11.088 -6.855 0.867 1.00 0.00 C ATOM 155 C TRP A 11 -11.014 -6.604 -0.656 1.00 0.00 C ATOM 156 O TRP A 11 -10.118 -7.127 -1.313 1.00 0.00 O ATOM 157 CB TRP A 11 -12.081 -7.983 1.228 1.00 0.00 C ATOM 158 CG TRP A 11 -13.037 -8.427 0.130 1.00 0.00 C ATOM 159 CD1 TRP A 11 -14.344 -8.160 0.133 1.00 0.00 C ATOM 160 CD2 TRP A 11 -12.746 -9.136 -1.105 1.00 0.00 C ATOM 161 NE1 TRP A 11 -14.906 -8.639 -1.078 1.00 0.00 N ATOM 162 CE2 TRP A 11 -13.957 -9.190 -1.867 1.00 0.00 C ATOM 163 CE3 TRP A 11 -11.588 -9.680 -1.714 1.00 0.00 C ATOM 164 CZ2 TRP A 11 -13.986 -9.716 -3.198 1.00 0.00 C ATOM 165 CZ3 TRP A 11 -11.613 -10.196 -3.015 1.00 0.00 C ATOM 166 CH2 TRP A 11 -12.804 -10.208 -3.760 1.00 0.00 C ATOM 0 H TRP A 11 -10.521 -5.375 2.224 1.00 0.00 H new ATOM 0 HA TRP A 11 -10.094 -7.199 1.153 1.00 0.00 H new ATOM 0 HB2 TRP A 11 -11.507 -8.851 1.552 1.00 0.00 H new ATOM 0 HB3 TRP A 11 -12.673 -7.655 2.083 1.00 0.00 H new ATOM 0 HD1 TRP A 11 -14.884 -7.662 0.925 1.00 0.00 H new ATOM 0 HE1 TRP A 11 -15.895 -8.576 -1.321 1.00 0.00 H new ATOM 0 HE3 TRP A 11 -10.661 -9.697 -1.160 1.00 0.00 H new ATOM 0 HZ2 TRP A 11 -14.908 -9.733 -3.760 1.00 0.00 H new ATOM 0 HZ3 TRP A 11 -10.707 -10.589 -3.451 1.00 0.00 H new ATOM 0 HH2 TRP A 11 -12.807 -10.597 -4.767 1.00 0.00 H new ATOM 176 N ASN A 12 -11.926 -5.785 -1.203 1.00 0.00 N ATOM 177 CA ASN A 12 -12.092 -5.455 -2.629 1.00 0.00 C ATOM 178 C ASN A 12 -10.819 -4.977 -3.351 1.00 0.00 C ATOM 179 O ASN A 12 -10.759 -5.043 -4.582 1.00 0.00 O ATOM 180 CB ASN A 12 -13.219 -4.400 -2.752 1.00 0.00 C ATOM 181 CG ASN A 12 -14.598 -4.913 -2.364 1.00 0.00 C ATOM 182 OD1 ASN A 12 -15.111 -5.874 -2.926 1.00 0.00 O ATOM 183 ND2 ASN A 12 -15.257 -4.283 -1.414 1.00 0.00 N ATOM 0 H ASN A 12 -12.613 -5.303 -0.623 1.00 0.00 H new ATOM 0 HA ASN A 12 -12.348 -6.385 -3.137 1.00 0.00 H new ATOM 0 HB2 ASN A 12 -12.971 -3.545 -2.123 1.00 0.00 H new ATOM 0 HB3 ASN A 12 -13.254 -4.040 -3.780 1.00 0.00 H new ATOM 0 HD21 ASN A 12 -16.191 -4.595 -1.148 1.00 0.00 H new ATOM 0 HD22 ASN A 12 -14.834 -3.483 -0.944 1.00 0.00 H new ATOM 189 N SER A 13 -9.792 -4.516 -2.614 1.00 0.00 N ATOM 190 CA SER A 13 -8.481 -4.110 -3.130 1.00 0.00 C ATOM 191 C SER A 13 -8.574 -3.085 -4.278 1.00 0.00 C ATOM 192 O SER A 13 -8.095 -3.282 -5.396 1.00 0.00 O ATOM 193 CB SER A 13 -7.601 -5.339 -3.425 1.00 0.00 C ATOM 194 OG SER A 13 -6.779 -5.596 -2.298 1.00 0.00 O ATOM 0 H SER A 13 -9.860 -4.414 -1.601 1.00 0.00 H new ATOM 0 HA SER A 13 -7.966 -3.558 -2.344 1.00 0.00 H new ATOM 0 HB2 SER A 13 -8.225 -6.206 -3.642 1.00 0.00 H new ATOM 0 HB3 SER A 13 -6.986 -5.160 -4.307 1.00 0.00 H new ATOM 0 HG SER A 13 -6.216 -6.378 -2.475 1.00 0.00 H new ATOM 199 N SER A 14 -9.226 -1.971 -3.945 1.00 0.00 N ATOM 200 CA SER A 14 -9.470 -0.805 -4.811 1.00 0.00 C ATOM 201 C SER A 14 -9.279 0.501 -4.038 1.00 0.00 C ATOM 202 O SER A 14 -9.023 0.513 -2.830 1.00 0.00 O ATOM 203 CB SER A 14 -10.889 -0.892 -5.408 1.00 0.00 C ATOM 204 OG SER A 14 -10.818 -1.358 -6.742 1.00 0.00 O ATOM 0 H SER A 14 -9.622 -1.846 -3.013 1.00 0.00 H new ATOM 0 HA SER A 14 -8.745 -0.812 -5.625 1.00 0.00 H new ATOM 0 HB2 SER A 14 -11.505 -1.564 -4.810 1.00 0.00 H new ATOM 0 HB3 SER A 14 -11.366 0.087 -5.380 1.00 0.00 H new ATOM 0 HG SER A 14 -11.721 -1.414 -7.118 1.00 0.00 H new ATOM 209 N ASN A 15 -9.417 1.620 -4.748 1.00 0.00 N ATOM 210 CA ASN A 15 -9.228 2.973 -4.236 1.00 0.00 C ATOM 211 C ASN A 15 -10.500 3.815 -4.438 1.00 0.00 C ATOM 212 O ASN A 15 -11.299 3.507 -5.322 1.00 0.00 O ATOM 213 CB ASN A 15 -8.020 3.554 -4.994 1.00 0.00 C ATOM 214 CG ASN A 15 -6.700 2.828 -4.759 1.00 0.00 C ATOM 215 OD1 ASN A 15 -6.011 2.449 -5.693 1.00 0.00 O ATOM 216 ND2 ASN A 15 -6.291 2.630 -3.529 1.00 0.00 N ATOM 0 H ASN A 15 -9.674 1.606 -5.735 1.00 0.00 H new ATOM 0 HA ASN A 15 -9.039 2.976 -3.163 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -8.240 3.540 -6.062 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -7.899 4.599 -4.707 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -5.401 2.162 -3.357 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -6.862 2.944 -2.745 1.00 0.00 H new ATOM 222 N SER A 16 -10.688 4.893 -3.668 1.00 0.00 N ATOM 223 CA SER A 16 -11.876 5.764 -3.835 1.00 0.00 C ATOM 224 C SER A 16 -11.919 6.452 -5.206 1.00 0.00 C ATOM 225 O SER A 16 -12.978 6.564 -5.827 1.00 0.00 O ATOM 226 CB SER A 16 -11.944 6.829 -2.729 1.00 0.00 C ATOM 227 OG SER A 16 -10.816 7.687 -2.781 1.00 0.00 O ATOM 0 H SER A 16 -10.047 5.187 -2.931 1.00 0.00 H new ATOM 0 HA SER A 16 -12.742 5.106 -3.762 1.00 0.00 H new ATOM 0 HB2 SER A 16 -12.857 7.415 -2.839 1.00 0.00 H new ATOM 0 HB3 SER A 16 -11.992 6.344 -1.754 1.00 0.00 H new ATOM 0 HG SER A 16 -10.882 8.357 -2.069 1.00 0.00 H new ATOM 232 N LYS A 17 -10.744 6.869 -5.706 1.00 0.00 N ATOM 233 CA LYS A 17 -10.543 7.441 -7.050 1.00 0.00 C ATOM 234 C LYS A 17 -10.633 6.423 -8.187 1.00 0.00 C ATOM 235 O LYS A 17 -11.194 6.759 -9.227 1.00 0.00 O ATOM 236 CB LYS A 17 -9.202 8.194 -7.096 1.00 0.00 C ATOM 237 CG LYS A 17 -9.338 9.631 -6.544 1.00 0.00 C ATOM 238 CD LYS A 17 -8.858 10.690 -7.550 1.00 0.00 C ATOM 239 CE LYS A 17 -9.502 12.053 -7.259 1.00 0.00 C ATOM 240 NZ LYS A 17 -8.602 13.183 -7.582 1.00 0.00 N ATOM 0 H LYS A 17 -9.879 6.816 -5.169 1.00 0.00 H new ATOM 0 HA LYS A 17 -11.370 8.131 -7.219 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -8.458 7.649 -6.515 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -8.840 8.231 -8.123 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -10.380 9.822 -6.288 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -8.762 9.720 -5.623 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -7.773 10.778 -7.501 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -9.107 10.374 -8.563 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -10.422 12.148 -7.836 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -9.780 12.103 -6.206 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -9.082 14.081 -7.369 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -7.735 13.110 -7.013 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -8.356 13.153 -8.592 1.00 0.00 H new ATOM 250 N PHE A 18 -10.110 5.206 -7.992 1.00 0.00 N ATOM 251 CA PHE A 18 -10.105 4.096 -8.964 1.00 0.00 C ATOM 252 C PHE A 18 -9.895 4.570 -10.424 1.00 0.00 C ATOM 253 O PHE A 18 -10.787 4.482 -11.268 1.00 0.00 O ATOM 254 CB PHE A 18 -11.339 3.207 -8.705 1.00 0.00 C ATOM 255 CG PHE A 18 -11.630 2.126 -9.736 1.00 0.00 C ATOM 256 CD1 PHE A 18 -10.707 1.088 -9.978 1.00 0.00 C ATOM 257 CD2 PHE A 18 -12.820 2.190 -10.491 1.00 0.00 C ATOM 258 CE1 PHE A 18 -10.965 0.135 -10.981 1.00 0.00 C ATOM 259 CE2 PHE A 18 -13.079 1.242 -11.493 1.00 0.00 C ATOM 260 CZ PHE A 18 -12.146 0.219 -11.741 1.00 0.00 C ATOM 0 H PHE A 18 -9.657 4.953 -7.114 1.00 0.00 H new ATOM 0 HA PHE A 18 -9.230 3.464 -8.812 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -11.215 2.727 -7.734 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -12.214 3.852 -8.632 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -9.801 1.024 -9.393 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -13.537 2.974 -10.297 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -10.258 -0.660 -11.167 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -13.990 1.298 -12.071 1.00 0.00 H new ATOM 0 HZ PHE A 18 -12.337 -0.506 -12.519 1.00 0.00 H new ATOM 269 N LEU A 19 -8.710 5.126 -10.716 1.00 0.00 N ATOM 270 CA LEU A 19 -8.379 5.723 -12.020 1.00 0.00 C ATOM 271 C LEU A 19 -7.004 5.231 -12.547 1.00 0.00 C ATOM 272 O LEU A 19 -6.174 4.796 -11.745 1.00 0.00 O ATOM 273 CB LEU A 19 -8.529 7.268 -11.920 1.00 0.00 C ATOM 274 CG LEU A 19 -7.258 8.112 -11.695 1.00 0.00 C ATOM 275 CD1 LEU A 19 -6.729 8.721 -13.001 1.00 0.00 C ATOM 276 CD2 LEU A 19 -7.549 9.307 -10.780 1.00 0.00 C ATOM 0 H LEU A 19 -7.944 5.175 -10.045 1.00 0.00 H new ATOM 0 HA LEU A 19 -9.082 5.386 -12.781 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -9.001 7.616 -12.838 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -9.220 7.483 -11.105 1.00 0.00 H new ATOM 0 HG LEU A 19 -6.530 7.428 -11.260 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -5.834 9.307 -12.793 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -6.486 7.923 -13.702 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -7.492 9.367 -13.436 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -6.637 9.886 -10.637 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -8.312 9.938 -11.237 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -7.906 8.948 -9.815 1.00 0.00 H new ATOM 287 N PRO A 20 -6.720 5.325 -13.861 1.00 0.00 N ATOM 288 CA PRO A 20 -5.420 5.026 -14.469 1.00 0.00 C ATOM 289 C PRO A 20 -4.348 6.102 -14.152 1.00 0.00 C ATOM 290 O PRO A 20 -3.693 6.655 -15.038 1.00 0.00 O ATOM 291 CB PRO A 20 -5.719 4.857 -15.964 1.00 0.00 C ATOM 292 CG PRO A 20 -6.893 5.803 -16.205 1.00 0.00 C ATOM 293 CD PRO A 20 -7.678 5.697 -14.893 1.00 0.00 C ATOM 0 HA PRO A 20 -4.971 4.121 -14.060 1.00 0.00 H new ATOM 0 HB2 PRO A 20 -4.858 5.122 -16.577 1.00 0.00 H new ATOM 0 HB3 PRO A 20 -5.978 3.827 -16.207 1.00 0.00 H new ATOM 0 HG2 PRO A 20 -6.560 6.823 -16.397 1.00 0.00 H new ATOM 0 HG3 PRO A 20 -7.492 5.496 -17.062 1.00 0.00 H new ATOM 0 HD2 PRO A 20 -8.158 6.645 -14.652 1.00 0.00 H new ATOM 0 HD3 PRO A 20 -8.469 4.951 -14.974 1.00 0.00 H new ATOM 298 N GLY A 21 -4.188 6.445 -12.863 1.00 0.00 N ATOM 299 CA GLY A 21 -3.407 7.568 -12.324 1.00 0.00 C ATOM 300 C GLY A 21 -2.306 7.113 -11.374 1.00 0.00 C ATOM 301 O GLY A 21 -2.139 7.674 -10.296 1.00 0.00 O ATOM 0 H GLY A 21 -4.632 5.907 -12.119 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -2.963 8.126 -13.148 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -4.075 8.252 -11.800 1.00 0.00 H new ATOM 304 N GLN A 22 -1.606 6.044 -11.747 1.00 0.00 N ATOM 305 CA GLN A 22 -0.648 5.324 -10.888 1.00 0.00 C ATOM 306 C GLN A 22 -1.264 4.871 -9.546 1.00 0.00 C ATOM 307 O GLN A 22 -0.594 4.838 -8.519 1.00 0.00 O ATOM 308 CB GLN A 22 0.683 6.111 -10.743 1.00 0.00 C ATOM 309 CG GLN A 22 1.153 6.790 -12.047 1.00 0.00 C ATOM 310 CD GLN A 22 2.594 7.277 -12.000 1.00 0.00 C ATOM 311 OE1 GLN A 22 3.101 7.795 -11.008 1.00 0.00 O ATOM 312 NE2 GLN A 22 3.338 7.113 -13.077 1.00 0.00 N ATOM 0 H GLN A 22 -1.686 5.638 -12.679 1.00 0.00 H new ATOM 0 HA GLN A 22 -0.394 4.392 -11.392 1.00 0.00 H new ATOM 0 HB2 GLN A 22 0.562 6.872 -9.972 1.00 0.00 H new ATOM 0 HB3 GLN A 22 1.461 5.430 -10.399 1.00 0.00 H new ATOM 0 HG2 GLN A 22 1.044 6.086 -12.872 1.00 0.00 H new ATOM 0 HG3 GLN A 22 0.500 7.636 -12.261 1.00 0.00 H new ATOM 0 HE21 GLN A 22 2.939 6.685 -13.912 1.00 0.00 H new ATOM 0 HE22 GLN A 22 4.313 7.414 -13.074 1.00 0.00 H new ATOM 319 N GLY A 23 -2.558 4.515 -9.558 1.00 0.00 N ATOM 320 CA GLY A 23 -3.289 3.905 -8.448 1.00 0.00 C ATOM 321 C GLY A 23 -4.144 4.933 -7.709 1.00 0.00 C ATOM 322 O GLY A 23 -5.202 5.339 -8.193 1.00 0.00 O ATOM 0 H GLY A 23 -3.145 4.653 -10.381 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -3.926 3.105 -8.826 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -2.584 3.450 -7.753 1.00 0.00 H new ATOM 325 N LEU A 24 -3.655 5.399 -6.555 1.00 0.00 N ATOM 326 CA LEU A 24 -4.247 6.483 -5.762 1.00 0.00 C ATOM 327 C LEU A 24 -3.154 7.328 -5.112 1.00 0.00 C ATOM 328 O LEU A 24 -2.284 6.829 -4.400 1.00 0.00 O ATOM 329 CB LEU A 24 -5.214 5.874 -4.729 1.00 0.00 C ATOM 330 CG LEU A 24 -5.708 6.814 -3.622 1.00 0.00 C ATOM 331 CD1 LEU A 24 -6.611 7.935 -4.132 1.00 0.00 C ATOM 332 CD2 LEU A 24 -6.480 6.062 -2.542 1.00 0.00 C ATOM 0 H LEU A 24 -2.808 5.020 -6.133 1.00 0.00 H new ATOM 0 HA LEU A 24 -4.816 7.155 -6.405 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -6.083 5.486 -5.261 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -4.721 5.022 -4.260 1.00 0.00 H new ATOM 0 HG LEU A 24 -4.797 7.251 -3.213 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -6.923 8.560 -3.295 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -6.065 8.541 -4.855 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -7.491 7.504 -4.610 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -6.812 6.764 -1.777 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -7.347 5.574 -2.988 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -5.833 5.311 -2.089 1.00 0.00 H new ATOM 343 N VAL A 25 -3.231 8.638 -5.339 1.00 0.00 N ATOM 344 CA VAL A 25 -2.395 9.660 -4.693 1.00 0.00 C ATOM 345 C VAL A 25 -2.959 9.993 -3.321 1.00 0.00 C ATOM 346 O VAL A 25 -4.157 10.232 -3.186 1.00 0.00 O ATOM 347 CB VAL A 25 -2.324 10.915 -5.585 1.00 0.00 C ATOM 348 CG1 VAL A 25 -1.604 12.072 -4.906 1.00 0.00 C ATOM 349 CG2 VAL A 25 -1.609 10.555 -6.885 1.00 0.00 C ATOM 0 H VAL A 25 -3.899 9.035 -6.000 1.00 0.00 H new ATOM 0 HA VAL A 25 -1.383 9.277 -4.562 1.00 0.00 H new ATOM 0 HB VAL A 25 -3.344 11.245 -5.782 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -1.582 12.931 -5.577 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -2.130 12.341 -3.990 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -0.584 11.774 -4.664 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -1.552 11.435 -7.525 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -0.602 10.204 -6.661 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -2.162 9.768 -7.398 1.00 0.00 H new ATOM 359 N LEU A 26 -2.074 10.063 -2.329 1.00 0.00 N ATOM 360 CA LEU A 26 -2.370 10.471 -0.956 1.00 0.00 C ATOM 361 C LEU A 26 -1.516 11.662 -0.489 1.00 0.00 C ATOM 362 O LEU A 26 -0.547 12.078 -1.123 1.00 0.00 O ATOM 363 CB LEU A 26 -2.237 9.263 0.011 1.00 0.00 C ATOM 364 CG LEU A 26 -3.550 8.644 0.527 1.00 0.00 C ATOM 365 CD1 LEU A 26 -4.505 9.698 1.094 1.00 0.00 C ATOM 366 CD2 LEU A 26 -4.285 7.855 -0.549 1.00 0.00 C ATOM 0 H LEU A 26 -1.091 9.828 -2.465 1.00 0.00 H new ATOM 0 HA LEU A 26 -3.403 10.817 -0.941 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -1.668 8.483 -0.495 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -1.648 9.579 0.872 1.00 0.00 H new ATOM 0 HG LEU A 26 -3.248 7.964 1.324 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -5.416 9.213 1.445 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -4.025 10.214 1.926 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -4.755 10.419 0.316 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -5.203 7.440 -0.133 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -4.530 8.515 -1.381 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -3.649 7.044 -0.904 1.00 0.00 H new ATOM 377 N TYR A 27 -1.903 12.222 0.654 1.00 0.00 N ATOM 378 CA TYR A 27 -1.353 13.439 1.244 1.00 0.00 C ATOM 379 C TYR A 27 -1.023 13.150 2.726 1.00 0.00 C ATOM 380 O TYR A 27 -1.946 12.867 3.501 1.00 0.00 O ATOM 381 CB TYR A 27 -2.380 14.577 1.105 1.00 0.00 C ATOM 382 CG TYR A 27 -2.430 15.233 -0.266 1.00 0.00 C ATOM 383 CD1 TYR A 27 -2.962 14.546 -1.388 1.00 0.00 C ATOM 384 CD2 TYR A 27 -1.950 16.555 -0.426 1.00 0.00 C ATOM 385 CE1 TYR A 27 -2.989 15.162 -2.647 1.00 0.00 C ATOM 386 CE2 TYR A 27 -1.995 17.175 -1.680 1.00 0.00 C ATOM 387 CZ TYR A 27 -2.494 16.480 -2.804 1.00 0.00 C ATOM 388 OH TYR A 27 -2.483 17.080 -4.019 1.00 0.00 O ATOM 0 H TYR A 27 -2.647 11.818 1.223 1.00 0.00 H new ATOM 0 HA TYR A 27 -0.441 13.748 0.734 1.00 0.00 H new ATOM 0 HB2 TYR A 27 -3.369 14.184 1.340 1.00 0.00 H new ATOM 0 HB3 TYR A 27 -2.156 15.341 1.849 1.00 0.00 H new ATOM 0 HD1 TYR A 27 -3.348 13.544 -1.271 1.00 0.00 H new ATOM 0 HD2 TYR A 27 -1.547 17.087 0.423 1.00 0.00 H new ATOM 0 HE1 TYR A 27 -3.388 14.631 -3.499 1.00 0.00 H new ATOM 0 HE2 TYR A 27 -1.646 18.191 -1.789 1.00 0.00 H new ATOM 0 HH TYR A 27 -2.109 17.982 -3.935 1.00 0.00 H new ATOM 397 N PRO A 28 0.262 13.172 3.138 1.00 0.00 N ATOM 398 CA PRO A 28 0.681 12.944 4.517 1.00 0.00 C ATOM 399 C PRO A 28 0.345 14.163 5.393 1.00 0.00 C ATOM 400 O PRO A 28 1.194 15.016 5.664 1.00 0.00 O ATOM 401 CB PRO A 28 2.175 12.612 4.454 1.00 0.00 C ATOM 402 CG PRO A 28 2.663 13.334 3.204 1.00 0.00 C ATOM 403 CD PRO A 28 1.425 13.432 2.305 1.00 0.00 C ATOM 0 HA PRO A 28 0.150 12.117 4.988 1.00 0.00 H new ATOM 0 HB2 PRO A 28 2.698 12.959 5.345 1.00 0.00 H new ATOM 0 HB3 PRO A 28 2.342 11.537 4.384 1.00 0.00 H new ATOM 0 HG2 PRO A 28 3.057 14.321 3.445 1.00 0.00 H new ATOM 0 HG3 PRO A 28 3.465 12.781 2.715 1.00 0.00 H new ATOM 0 HD2 PRO A 28 1.358 14.420 1.850 1.00 0.00 H new ATOM 0 HD3 PRO A 28 1.483 12.710 1.491 1.00 0.00 H new ATOM 408 N GLN A 29 -0.923 14.261 5.800 1.00 0.00 N ATOM 409 CA GLN A 29 -1.498 15.365 6.567 1.00 0.00 C ATOM 410 C GLN A 29 -2.325 14.831 7.739 1.00 0.00 C ATOM 411 O GLN A 29 -3.341 14.163 7.553 1.00 0.00 O ATOM 412 CB GLN A 29 -2.352 16.253 5.640 1.00 0.00 C ATOM 413 CG GLN A 29 -1.614 17.508 5.145 1.00 0.00 C ATOM 414 CD GLN A 29 -1.487 18.580 6.234 1.00 0.00 C ATOM 415 OE1 GLN A 29 -0.987 18.350 7.331 1.00 0.00 O ATOM 416 NE2 GLN A 29 -1.947 19.789 5.994 1.00 0.00 N ATOM 0 H GLN A 29 -1.609 13.536 5.592 1.00 0.00 H new ATOM 0 HA GLN A 29 -0.693 15.972 6.981 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -2.671 15.665 4.779 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -3.254 16.557 6.171 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -0.620 17.228 4.797 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -2.145 17.925 4.289 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -2.367 20.005 5.090 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -1.884 20.511 6.712 1.00 0.00 H new ATOM 423 N ILE A 30 -1.872 15.141 8.957 1.00 0.00 N ATOM 424 CA ILE A 30 -2.513 14.755 10.224 1.00 0.00 C ATOM 425 C ILE A 30 -3.921 15.345 10.314 1.00 0.00 C ATOM 426 O ILE A 30 -4.114 16.533 10.577 1.00 0.00 O ATOM 427 CB ILE A 30 -1.624 15.117 11.437 1.00 0.00 C ATOM 428 CG1 ILE A 30 -0.227 14.442 11.364 1.00 0.00 C ATOM 429 CG2 ILE A 30 -2.290 14.752 12.771 1.00 0.00 C ATOM 430 CD1 ILE A 30 -0.212 12.909 11.276 1.00 0.00 C ATOM 0 H ILE A 30 -1.021 15.686 9.096 1.00 0.00 H new ATOM 0 HA ILE A 30 -2.623 13.671 10.246 1.00 0.00 H new ATOM 0 HB ILE A 30 -1.494 16.198 11.392 1.00 0.00 H new ATOM 0 HG12 ILE A 30 0.299 14.839 10.496 1.00 0.00 H new ATOM 0 HG13 ILE A 30 0.342 14.739 12.245 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -1.629 15.024 13.594 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -3.232 15.293 12.867 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -2.483 13.680 12.800 1.00 0.00 H new ATOM 0 HD11 ILE A 30 0.819 12.557 11.230 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -0.700 12.489 12.156 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -0.744 12.591 10.379 1.00 0.00 H new ATOM 441 N GLY A 31 -4.909 14.492 10.049 1.00 0.00 N ATOM 442 CA GLY A 31 -6.350 14.759 10.053 1.00 0.00 C ATOM 443 C GLY A 31 -7.132 13.636 9.345 1.00 0.00 C ATOM 444 O GLY A 31 -8.258 13.327 9.723 1.00 0.00 O ATOM 0 H GLY A 31 -4.710 13.521 9.807 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -6.701 14.857 11.080 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -6.547 15.710 9.557 1.00 0.00 H new ATOM 447 N ASP A 32 -6.515 12.986 8.356 1.00 0.00 N ATOM 448 CA ASP A 32 -7.066 11.803 7.689 1.00 0.00 C ATOM 449 C ASP A 32 -6.871 10.488 8.464 1.00 0.00 C ATOM 450 O ASP A 32 -6.246 10.416 9.525 1.00 0.00 O ATOM 451 CB ASP A 32 -6.563 11.719 6.230 1.00 0.00 C ATOM 452 CG ASP A 32 -5.169 11.092 6.010 1.00 0.00 C ATOM 453 OD1 ASP A 32 -4.337 11.085 6.951 1.00 0.00 O ATOM 454 OD2 ASP A 32 -4.913 10.621 4.879 1.00 0.00 O ATOM 0 H ASP A 32 -5.606 13.270 7.990 1.00 0.00 H new ATOM 0 HA ASP A 32 -8.148 11.936 7.670 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -7.288 11.146 5.653 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -6.551 12.727 5.816 1.00 0.00 H new ATOM 458 N LYS A 33 -7.444 9.404 7.931 1.00 0.00 N ATOM 459 CA LYS A 33 -7.233 8.030 8.393 1.00 0.00 C ATOM 460 C LYS A 33 -7.304 7.100 7.189 1.00 0.00 C ATOM 461 O LYS A 33 -7.932 7.447 6.195 1.00 0.00 O ATOM 462 CB LYS A 33 -8.245 7.660 9.499 1.00 0.00 C ATOM 463 CG LYS A 33 -9.703 7.567 9.046 1.00 0.00 C ATOM 464 CD LYS A 33 -10.652 7.059 10.147 1.00 0.00 C ATOM 465 CE LYS A 33 -11.434 8.173 10.862 1.00 0.00 C ATOM 466 NZ LYS A 33 -10.749 8.692 12.064 1.00 0.00 N ATOM 0 H LYS A 33 -8.087 9.461 7.142 1.00 0.00 H new ATOM 0 HA LYS A 33 -6.247 7.928 8.847 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -7.954 6.702 9.929 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -8.176 8.401 10.295 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -10.036 8.550 8.714 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -9.767 6.901 8.185 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -11.360 6.357 9.706 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -10.072 6.505 10.885 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -11.601 8.994 10.165 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -12.415 7.793 11.148 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -11.328 9.439 12.498 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -10.612 7.919 12.746 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -9.824 9.084 11.795 1.00 0.00 H new ATOM 476 N LEU A 34 -6.649 5.952 7.285 1.00 0.00 N ATOM 477 CA LEU A 34 -6.654 4.926 6.246 1.00 0.00 C ATOM 478 C LEU A 34 -6.675 3.521 6.844 1.00 0.00 C ATOM 479 O LEU A 34 -5.903 3.191 7.744 1.00 0.00 O ATOM 480 CB LEU A 34 -5.524 5.101 5.201 1.00 0.00 C ATOM 481 CG LEU A 34 -4.126 5.580 5.658 1.00 0.00 C ATOM 482 CD1 LEU A 34 -3.069 5.192 4.619 1.00 0.00 C ATOM 483 CD2 LEU A 34 -4.038 7.103 5.788 1.00 0.00 C ATOM 0 H LEU A 34 -6.089 5.701 8.100 1.00 0.00 H new ATOM 0 HA LEU A 34 -7.583 5.061 5.692 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -5.392 4.142 4.700 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -5.881 5.806 4.450 1.00 0.00 H new ATOM 0 HG LEU A 34 -3.956 5.109 6.626 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -2.089 5.534 4.952 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -3.054 4.108 4.502 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -3.311 5.657 3.663 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -3.036 7.383 6.111 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -4.250 7.563 4.823 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -4.766 7.448 6.522 1.00 0.00 H new ATOM 494 N ASP A 35 -7.586 2.690 6.334 1.00 0.00 N ATOM 495 CA ASP A 35 -7.868 1.332 6.806 1.00 0.00 C ATOM 496 C ASP A 35 -7.710 0.330 5.659 1.00 0.00 C ATOM 497 O ASP A 35 -8.479 0.297 4.697 1.00 0.00 O ATOM 498 CB ASP A 35 -9.240 1.232 7.512 1.00 0.00 C ATOM 499 CG ASP A 35 -10.350 2.140 6.944 1.00 0.00 C ATOM 500 OD1 ASP A 35 -10.704 2.043 5.763 1.00 0.00 O ATOM 501 OD2 ASP A 35 -10.910 2.948 7.750 1.00 0.00 O ATOM 0 H ASP A 35 -8.174 2.957 5.545 1.00 0.00 H new ATOM 0 HA ASP A 35 -7.134 1.074 7.569 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -9.580 0.198 7.461 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -9.104 1.471 8.567 1.00 0.00 H new ATOM 505 N ILE A 36 -6.668 -0.498 5.780 1.00 0.00 N ATOM 506 CA ILE A 36 -6.353 -1.571 4.843 1.00 0.00 C ATOM 507 C ILE A 36 -6.798 -2.894 5.449 1.00 0.00 C ATOM 508 O ILE A 36 -6.392 -3.240 6.555 1.00 0.00 O ATOM 509 CB ILE A 36 -4.864 -1.497 4.440 1.00 0.00 C ATOM 510 CG1 ILE A 36 -4.540 -2.364 3.212 1.00 0.00 C ATOM 511 CG2 ILE A 36 -3.897 -1.855 5.583 1.00 0.00 C ATOM 512 CD1 ILE A 36 -3.335 -1.809 2.431 1.00 0.00 C ATOM 0 H ILE A 36 -6.006 -0.436 6.553 1.00 0.00 H new ATOM 0 HA ILE A 36 -6.901 -1.468 3.906 1.00 0.00 H new ATOM 0 HB ILE A 36 -4.708 -0.449 4.186 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -4.329 -3.385 3.531 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -5.410 -2.408 2.557 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -2.869 -1.781 5.227 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -4.044 -1.164 6.413 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -4.092 -2.873 5.919 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -3.135 -2.447 1.570 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -3.557 -0.798 2.090 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -2.459 -1.789 3.079 1.00 0.00 H new ATOM 523 N ILE A 37 -7.678 -3.603 4.747 1.00 0.00 N ATOM 524 CA ILE A 37 -8.265 -4.879 5.164 1.00 0.00 C ATOM 525 C ILE A 37 -8.163 -5.849 3.990 1.00 0.00 C ATOM 526 O ILE A 37 -8.616 -5.541 2.884 1.00 0.00 O ATOM 527 CB ILE A 37 -9.748 -4.741 5.604 1.00 0.00 C ATOM 528 CG1 ILE A 37 -9.966 -3.558 6.569 1.00 0.00 C ATOM 529 CG2 ILE A 37 -10.220 -6.068 6.217 1.00 0.00 C ATOM 530 CD1 ILE A 37 -11.376 -3.446 7.148 1.00 0.00 C ATOM 0 H ILE A 37 -8.017 -3.295 3.836 1.00 0.00 H new ATOM 0 HA ILE A 37 -7.716 -5.244 6.032 1.00 0.00 H new ATOM 0 HB ILE A 37 -10.350 -4.520 4.722 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -9.258 -3.646 7.393 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -9.731 -2.632 6.044 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -11.261 -5.976 6.527 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -10.131 -6.863 5.476 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -9.603 -6.309 7.083 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -11.429 -2.584 7.814 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -12.094 -3.322 6.337 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -11.613 -4.351 7.707 1.00 0.00 H new ATOM 541 N CYS A 38 -7.604 -7.031 4.248 1.00 0.00 N ATOM 542 CA CYS A 38 -7.402 -8.107 3.282 1.00 0.00 C ATOM 543 C CYS A 38 -7.804 -9.464 3.883 1.00 0.00 C ATOM 544 O CYS A 38 -7.418 -9.776 5.018 1.00 0.00 O ATOM 545 CB CYS A 38 -5.931 -8.141 2.877 1.00 0.00 C ATOM 546 SG CYS A 38 -5.509 -7.011 1.534 1.00 0.00 S ATOM 0 H CYS A 38 -7.265 -7.274 5.179 1.00 0.00 H new ATOM 0 HA CYS A 38 -8.028 -7.921 2.409 1.00 0.00 H new ATOM 0 HB2 CYS A 38 -5.320 -7.899 3.747 1.00 0.00 H new ATOM 0 HB3 CYS A 38 -5.671 -9.156 2.578 1.00 0.00 H new ATOM 550 N PRO A 39 -8.543 -10.293 3.125 1.00 0.00 N ATOM 551 CA PRO A 39 -8.946 -11.611 3.563 1.00 0.00 C ATOM 552 C PRO A 39 -7.794 -12.611 3.368 1.00 0.00 C ATOM 553 O PRO A 39 -6.821 -12.350 2.659 1.00 0.00 O ATOM 554 CB PRO A 39 -10.142 -11.947 2.672 1.00 0.00 C ATOM 555 CG PRO A 39 -9.787 -11.303 1.330 1.00 0.00 C ATOM 556 CD PRO A 39 -8.918 -10.105 1.728 1.00 0.00 C ATOM 0 HA PRO A 39 -9.203 -11.654 4.621 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -10.279 -13.024 2.575 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -11.069 -11.543 3.077 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -9.246 -11.994 0.684 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -10.678 -10.990 0.787 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -8.032 -10.045 1.096 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -9.466 -9.172 1.598 1.00 0.00 H new ATOM 561 N LYS A 40 -7.953 -13.785 3.981 1.00 0.00 N ATOM 562 CA LYS A 40 -7.042 -14.941 3.831 1.00 0.00 C ATOM 563 C LYS A 40 -7.438 -15.922 2.734 1.00 0.00 C ATOM 564 O LYS A 40 -6.673 -16.832 2.434 1.00 0.00 O ATOM 565 CB LYS A 40 -6.910 -15.653 5.185 1.00 0.00 C ATOM 566 CG LYS A 40 -8.252 -16.175 5.743 1.00 0.00 C ATOM 567 CD LYS A 40 -8.670 -15.465 7.036 1.00 0.00 C ATOM 568 CE LYS A 40 -10.121 -15.752 7.445 1.00 0.00 C ATOM 569 NZ LYS A 40 -11.100 -14.853 6.782 1.00 0.00 N ATOM 0 H LYS A 40 -8.733 -13.972 4.611 1.00 0.00 H new ATOM 0 HA LYS A 40 -6.079 -14.543 3.510 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -6.220 -16.490 5.080 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -6.469 -14.965 5.906 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -9.030 -16.041 4.992 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -8.171 -17.246 5.931 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -8.005 -15.773 7.843 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -8.541 -14.390 6.910 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -10.363 -16.786 7.202 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -10.215 -15.648 8.526 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -12.061 -15.094 7.097 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -10.891 -13.866 7.034 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -11.034 -14.969 5.751 1.00 0.00 H new ATOM 579 N VAL A 41 -8.649 -15.787 2.177 1.00 0.00 N ATOM 580 CA VAL A 41 -9.245 -16.661 1.157 1.00 0.00 C ATOM 581 C VAL A 41 -10.483 -16.000 0.535 1.00 0.00 C ATOM 582 O VAL A 41 -11.339 -15.501 1.256 1.00 0.00 O ATOM 583 CB VAL A 41 -9.654 -18.057 1.703 1.00 0.00 C ATOM 584 CG1 VAL A 41 -8.655 -19.134 1.267 1.00 0.00 C ATOM 585 CG2 VAL A 41 -9.827 -18.164 3.219 1.00 0.00 C ATOM 0 H VAL A 41 -9.273 -15.024 2.440 1.00 0.00 H new ATOM 0 HA VAL A 41 -8.468 -16.810 0.408 1.00 0.00 H new ATOM 0 HB VAL A 41 -10.641 -18.212 1.266 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -8.966 -20.101 1.663 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -8.623 -19.181 0.178 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -7.664 -18.887 1.649 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -10.112 -19.183 3.482 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -8.888 -17.912 3.711 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -10.604 -17.474 3.546 1.00 0.00 H new ATOM 595 N ASP A 42 -10.569 -16.014 -0.794 1.00 0.00 N ATOM 596 CA ASP A 42 -11.742 -15.578 -1.579 1.00 0.00 C ATOM 597 C ASP A 42 -11.713 -16.161 -3.011 1.00 0.00 C ATOM 598 O ASP A 42 -12.513 -17.045 -3.330 1.00 0.00 O ATOM 599 CB ASP A 42 -11.829 -14.034 -1.619 1.00 0.00 C ATOM 600 CG ASP A 42 -13.009 -13.510 -0.780 1.00 0.00 C ATOM 601 OD1 ASP A 42 -14.167 -13.915 -1.061 1.00 0.00 O ATOM 602 OD2 ASP A 42 -12.789 -12.683 0.138 1.00 0.00 O ATOM 0 H ASP A 42 -9.802 -16.339 -1.382 1.00 0.00 H new ATOM 0 HA ASP A 42 -12.634 -15.962 -1.083 1.00 0.00 H new ATOM 0 HB2 ASP A 42 -10.898 -13.607 -1.245 1.00 0.00 H new ATOM 0 HB3 ASP A 42 -11.940 -13.702 -2.651 1.00 0.00 H new ATOM 606 N SER A 43 -10.769 -15.730 -3.865 1.00 0.00 N ATOM 607 CA SER A 43 -10.649 -16.190 -5.259 1.00 0.00 C ATOM 608 C SER A 43 -10.235 -17.669 -5.379 1.00 0.00 C ATOM 609 O SER A 43 -10.744 -18.390 -6.239 1.00 0.00 O ATOM 610 CB SER A 43 -9.646 -15.312 -6.029 1.00 0.00 C ATOM 611 OG SER A 43 -10.166 -14.996 -7.310 1.00 0.00 O ATOM 0 H SER A 43 -10.060 -15.045 -3.604 1.00 0.00 H new ATOM 0 HA SER A 43 -11.643 -16.098 -5.696 1.00 0.00 H new ATOM 0 HB2 SER A 43 -9.448 -14.397 -5.471 1.00 0.00 H new ATOM 0 HB3 SER A 43 -8.695 -15.835 -6.132 1.00 0.00 H new ATOM 0 HG SER A 43 -9.524 -14.436 -7.794 1.00 0.00 H new ATOM 616 N LYS A 44 -9.326 -18.140 -4.502 1.00 0.00 N ATOM 617 CA LYS A 44 -8.859 -19.553 -4.440 1.00 0.00 C ATOM 618 C LYS A 44 -9.664 -20.405 -3.442 1.00 0.00 C ATOM 619 O LYS A 44 -9.860 -21.597 -3.665 1.00 0.00 O ATOM 620 CB LYS A 44 -7.340 -19.618 -4.142 1.00 0.00 C ATOM 621 CG LYS A 44 -6.437 -18.671 -4.953 1.00 0.00 C ATOM 622 CD LYS A 44 -6.581 -18.775 -6.470 1.00 0.00 C ATOM 623 CE LYS A 44 -5.714 -17.703 -7.145 1.00 0.00 C ATOM 624 NZ LYS A 44 -4.491 -18.263 -7.761 1.00 0.00 N ATOM 0 H LYS A 44 -8.884 -17.544 -3.802 1.00 0.00 H new ATOM 0 HA LYS A 44 -9.036 -19.988 -5.424 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -7.191 -19.407 -3.083 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -7.003 -20.640 -4.313 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -6.652 -17.645 -4.653 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -5.399 -18.870 -4.688 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -6.279 -19.767 -6.807 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -7.625 -18.646 -6.756 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -6.301 -17.195 -7.910 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -5.433 -16.951 -6.407 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -3.943 -17.497 -8.202 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -3.914 -18.725 -7.029 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -4.755 -18.961 -8.485 1.00 0.00 H new ATOM 634 N THR A 45 -10.128 -19.778 -2.356 1.00 0.00 N ATOM 635 CA THR A 45 -10.886 -20.347 -1.224 1.00 0.00 C ATOM 636 C THR A 45 -10.387 -21.729 -0.715 1.00 0.00 C ATOM 637 O THR A 45 -11.154 -22.590 -0.264 1.00 0.00 O ATOM 638 CB THR A 45 -12.407 -20.261 -1.487 1.00 0.00 C ATOM 639 OG1 THR A 45 -13.140 -20.458 -0.305 1.00 0.00 O ATOM 640 CG2 THR A 45 -12.947 -21.165 -2.592 1.00 0.00 C ATOM 0 H THR A 45 -9.973 -18.778 -2.231 1.00 0.00 H new ATOM 0 HA THR A 45 -10.675 -19.714 -0.362 1.00 0.00 H new ATOM 0 HB THR A 45 -12.546 -19.245 -1.858 1.00 0.00 H new ATOM 0 HG1 THR A 45 -12.869 -21.303 0.111 1.00 0.00 H new ATOM 0 HG21 THR A 45 -14.023 -21.020 -2.687 1.00 0.00 H new ATOM 0 HG22 THR A 45 -12.462 -20.915 -3.536 1.00 0.00 H new ATOM 0 HG23 THR A 45 -12.742 -22.206 -2.343 1.00 0.00 H new ATOM 705 N GLU A 50 -4.277 -17.298 -1.811 1.00 0.00 N ATOM 706 CA GLU A 50 -5.133 -16.099 -1.943 1.00 0.00 C ATOM 707 C GLU A 50 -4.739 -14.981 -0.959 1.00 0.00 C ATOM 708 O GLU A 50 -5.487 -14.580 -0.064 1.00 0.00 O ATOM 709 CB GLU A 50 -6.620 -16.474 -1.870 1.00 0.00 C ATOM 710 CG GLU A 50 -7.605 -15.331 -2.175 1.00 0.00 C ATOM 711 CD GLU A 50 -7.198 -14.421 -3.352 1.00 0.00 C ATOM 712 OE1 GLU A 50 -6.886 -14.962 -4.438 1.00 0.00 O ATOM 713 OE2 GLU A 50 -7.246 -13.174 -3.204 1.00 0.00 O ATOM 0 HA GLU A 50 -4.962 -15.678 -2.934 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -6.807 -17.288 -2.570 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -6.832 -16.857 -0.872 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -8.583 -15.761 -2.389 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -7.715 -14.717 -1.281 1.00 0.00 H new ATOM 718 N TYR A 51 -3.520 -14.486 -1.156 1.00 0.00 N ATOM 719 CA TYR A 51 -2.925 -13.374 -0.414 1.00 0.00 C ATOM 720 C TYR A 51 -2.370 -12.325 -1.382 1.00 0.00 C ATOM 721 O TYR A 51 -2.136 -12.583 -2.565 1.00 0.00 O ATOM 722 CB TYR A 51 -1.865 -13.916 0.573 1.00 0.00 C ATOM 723 CG TYR A 51 -0.692 -14.608 -0.088 1.00 0.00 C ATOM 724 CD1 TYR A 51 0.360 -13.846 -0.652 1.00 0.00 C ATOM 725 CD2 TYR A 51 -0.626 -16.018 -0.121 1.00 0.00 C ATOM 726 CE1 TYR A 51 1.448 -14.482 -1.264 1.00 0.00 C ATOM 727 CE2 TYR A 51 0.472 -16.656 -0.712 1.00 0.00 C ATOM 728 CZ TYR A 51 1.510 -15.895 -1.304 1.00 0.00 C ATOM 729 OH TYR A 51 2.565 -16.529 -1.868 1.00 0.00 O ATOM 0 H TYR A 51 -2.892 -14.863 -1.866 1.00 0.00 H new ATOM 0 HA TYR A 51 -3.686 -12.869 0.181 1.00 0.00 H new ATOM 0 HB2 TYR A 51 -1.491 -13.089 1.176 1.00 0.00 H new ATOM 0 HB3 TYR A 51 -2.346 -14.616 1.256 1.00 0.00 H new ATOM 0 HD1 TYR A 51 0.323 -12.767 -0.610 1.00 0.00 H new ATOM 0 HD2 TYR A 51 -1.423 -16.605 0.310 1.00 0.00 H new ATOM 0 HE1 TYR A 51 2.239 -13.894 -1.705 1.00 0.00 H new ATOM 0 HE2 TYR A 51 0.528 -17.735 -0.716 1.00 0.00 H new ATOM 0 HH TYR A 51 2.437 -17.498 -1.803 1.00 0.00 H new ATOM 738 N TYR A 52 -2.152 -11.127 -0.853 1.00 0.00 N ATOM 739 CA TYR A 52 -1.532 -9.996 -1.533 1.00 0.00 C ATOM 740 C TYR A 52 -0.337 -9.530 -0.692 1.00 0.00 C ATOM 741 O TYR A 52 -0.189 -9.884 0.484 1.00 0.00 O ATOM 742 CB TYR A 52 -2.569 -8.872 -1.771 1.00 0.00 C ATOM 743 CG TYR A 52 -3.498 -9.075 -2.955 1.00 0.00 C ATOM 744 CD1 TYR A 52 -4.438 -10.133 -2.966 1.00 0.00 C ATOM 745 CD2 TYR A 52 -3.465 -8.169 -4.039 1.00 0.00 C ATOM 746 CE1 TYR A 52 -5.265 -10.330 -4.077 1.00 0.00 C ATOM 747 CE2 TYR A 52 -4.314 -8.354 -5.146 1.00 0.00 C ATOM 748 CZ TYR A 52 -5.199 -9.454 -5.186 1.00 0.00 C ATOM 749 OH TYR A 52 -6.004 -9.669 -6.254 1.00 0.00 O ATOM 0 H TYR A 52 -2.415 -10.907 0.108 1.00 0.00 H new ATOM 0 HA TYR A 52 -1.170 -10.287 -2.519 1.00 0.00 H new ATOM 0 HB2 TYR A 52 -3.175 -8.765 -0.871 1.00 0.00 H new ATOM 0 HB3 TYR A 52 -2.034 -7.932 -1.909 1.00 0.00 H new ATOM 0 HD1 TYR A 52 -4.517 -10.791 -2.113 1.00 0.00 H new ATOM 0 HD2 TYR A 52 -2.785 -7.330 -4.018 1.00 0.00 H new ATOM 0 HE1 TYR A 52 -5.959 -11.157 -4.088 1.00 0.00 H new ATOM 0 HE2 TYR A 52 -4.289 -7.653 -5.967 1.00 0.00 H new ATOM 0 HH TYR A 52 -5.839 -8.980 -6.932 1.00 0.00 H new ATOM 758 N LYS A 53 0.533 -8.719 -1.291 1.00 0.00 N ATOM 759 CA LYS A 53 1.670 -8.084 -0.615 1.00 0.00 C ATOM 760 C LYS A 53 1.959 -6.740 -1.261 1.00 0.00 C ATOM 761 O LYS A 53 1.820 -6.600 -2.475 1.00 0.00 O ATOM 762 CB LYS A 53 2.885 -9.032 -0.629 1.00 0.00 C ATOM 763 CG LYS A 53 3.564 -9.159 -2.004 1.00 0.00 C ATOM 764 CD LYS A 53 4.611 -10.280 -2.025 1.00 0.00 C ATOM 765 CE LYS A 53 5.521 -10.164 -3.255 1.00 0.00 C ATOM 766 NZ LYS A 53 5.312 -11.266 -4.223 1.00 0.00 N ATOM 0 H LYS A 53 0.469 -8.478 -2.280 1.00 0.00 H new ATOM 0 HA LYS A 53 1.432 -7.893 0.431 1.00 0.00 H new ATOM 0 HB2 LYS A 53 3.618 -8.677 0.095 1.00 0.00 H new ATOM 0 HB3 LYS A 53 2.565 -10.021 -0.300 1.00 0.00 H new ATOM 0 HG2 LYS A 53 2.808 -9.354 -2.765 1.00 0.00 H new ATOM 0 HG3 LYS A 53 4.040 -8.213 -2.262 1.00 0.00 H new ATOM 0 HD2 LYS A 53 5.214 -10.236 -1.118 1.00 0.00 H new ATOM 0 HD3 LYS A 53 4.111 -11.249 -2.029 1.00 0.00 H new ATOM 0 HE2 LYS A 53 5.337 -9.210 -3.750 1.00 0.00 H new ATOM 0 HE3 LYS A 53 6.562 -10.160 -2.933 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 5.950 -11.141 -5.035 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 5.513 -12.176 -3.762 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 4.326 -11.256 -4.553 1.00 0.00 H new ATOM 776 N VAL A 54 2.360 -5.760 -0.459 1.00 0.00 N ATOM 777 CA VAL A 54 2.591 -4.388 -0.931 1.00 0.00 C ATOM 778 C VAL A 54 3.851 -3.840 -0.275 1.00 0.00 C ATOM 779 O VAL A 54 4.048 -3.958 0.934 1.00 0.00 O ATOM 780 CB VAL A 54 1.385 -3.453 -0.684 1.00 0.00 C ATOM 781 CG1 VAL A 54 1.395 -2.349 -1.734 1.00 0.00 C ATOM 782 CG2 VAL A 54 0.004 -4.118 -0.769 1.00 0.00 C ATOM 0 H VAL A 54 2.536 -5.888 0.538 1.00 0.00 H new ATOM 0 HA VAL A 54 2.721 -4.425 -2.013 1.00 0.00 H new ATOM 0 HB VAL A 54 1.513 -3.098 0.339 1.00 0.00 H new ATOM 0 HG11 VAL A 54 0.548 -1.683 -1.570 1.00 0.00 H new ATOM 0 HG12 VAL A 54 2.323 -1.782 -1.657 1.00 0.00 H new ATOM 0 HG13 VAL A 54 1.321 -2.791 -2.728 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -0.770 -3.374 -0.580 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -0.135 -4.542 -1.763 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -0.065 -4.911 -0.024 1.00 0.00 H new ATOM 792 N TYR A 55 4.720 -3.259 -1.099 1.00 0.00 N ATOM 793 CA TYR A 55 6.081 -2.864 -0.743 1.00 0.00 C ATOM 794 C TYR A 55 6.328 -1.415 -1.175 1.00 0.00 C ATOM 795 O TYR A 55 5.933 -0.992 -2.267 1.00 0.00 O ATOM 796 CB TYR A 55 7.085 -3.796 -1.442 1.00 0.00 C ATOM 797 CG TYR A 55 7.287 -5.154 -0.791 1.00 0.00 C ATOM 798 CD1 TYR A 55 6.314 -6.174 -0.921 1.00 0.00 C ATOM 799 CD2 TYR A 55 8.478 -5.425 -0.075 1.00 0.00 C ATOM 800 CE1 TYR A 55 6.515 -7.419 -0.311 1.00 0.00 C ATOM 801 CE2 TYR A 55 8.689 -6.681 0.511 1.00 0.00 C ATOM 802 CZ TYR A 55 7.708 -7.689 0.403 1.00 0.00 C ATOM 803 OH TYR A 55 7.915 -8.894 0.985 1.00 0.00 O ATOM 0 H TYR A 55 4.487 -3.042 -2.068 1.00 0.00 H new ATOM 0 HA TYR A 55 6.210 -2.940 0.337 1.00 0.00 H new ATOM 0 HB2 TYR A 55 6.754 -3.951 -2.469 1.00 0.00 H new ATOM 0 HB3 TYR A 55 8.049 -3.290 -1.491 1.00 0.00 H new ATOM 0 HD1 TYR A 55 5.415 -5.992 -1.491 1.00 0.00 H new ATOM 0 HD2 TYR A 55 9.231 -4.657 0.021 1.00 0.00 H new ATOM 0 HE1 TYR A 55 5.753 -8.180 -0.386 1.00 0.00 H new ATOM 0 HE2 TYR A 55 9.606 -6.878 1.047 1.00 0.00 H new ATOM 0 HH TYR A 55 8.788 -8.897 1.429 1.00 0.00 H new ATOM 812 N MET A 56 7.004 -0.649 -0.318 1.00 0.00 N ATOM 813 CA MET A 56 7.532 0.661 -0.695 1.00 0.00 C ATOM 814 C MET A 56 8.579 0.535 -1.806 1.00 0.00 C ATOM 815 O MET A 56 9.245 -0.490 -1.905 1.00 0.00 O ATOM 816 CB MET A 56 8.090 1.366 0.544 1.00 0.00 C ATOM 817 CG MET A 56 9.372 0.746 1.107 1.00 0.00 C ATOM 818 SD MET A 56 10.900 1.585 0.598 1.00 0.00 S ATOM 819 CE MET A 56 11.266 2.493 2.129 1.00 0.00 C ATOM 0 H MET A 56 7.199 -0.916 0.647 1.00 0.00 H new ATOM 0 HA MET A 56 6.723 1.271 -1.098 1.00 0.00 H new ATOM 0 HB2 MET A 56 8.285 2.409 0.295 1.00 0.00 H new ATOM 0 HB3 MET A 56 7.327 1.361 1.323 1.00 0.00 H new ATOM 0 HG2 MET A 56 9.315 0.750 2.196 1.00 0.00 H new ATOM 0 HG3 MET A 56 9.424 -0.297 0.795 1.00 0.00 H new ATOM 0 HE1 MET A 56 12.181 3.071 2.000 1.00 0.00 H new ATOM 0 HE2 MET A 56 10.441 3.167 2.358 1.00 0.00 H new ATOM 0 HE3 MET A 56 11.396 1.787 2.949 1.00 0.00 H new ATOM 827 N VAL A 57 8.751 1.559 -2.642 1.00 0.00 N ATOM 828 CA VAL A 57 9.832 1.658 -3.651 1.00 0.00 C ATOM 829 C VAL A 57 9.993 3.112 -4.133 1.00 0.00 C ATOM 830 O VAL A 57 9.144 3.929 -3.824 1.00 0.00 O ATOM 831 CB VAL A 57 9.595 0.653 -4.811 1.00 0.00 C ATOM 832 CG1 VAL A 57 8.826 1.206 -6.007 1.00 0.00 C ATOM 833 CG2 VAL A 57 10.925 0.034 -5.251 1.00 0.00 C ATOM 0 H VAL A 57 8.132 2.369 -2.645 1.00 0.00 H new ATOM 0 HA VAL A 57 10.779 1.378 -3.189 1.00 0.00 H new ATOM 0 HB VAL A 57 8.940 -0.115 -4.400 1.00 0.00 H new ATOM 0 HG11 VAL A 57 8.714 0.426 -6.760 1.00 0.00 H new ATOM 0 HG12 VAL A 57 7.841 1.541 -5.683 1.00 0.00 H new ATOM 0 HG13 VAL A 57 9.373 2.047 -6.434 1.00 0.00 H new ATOM 0 HG21 VAL A 57 10.748 -0.669 -6.065 1.00 0.00 H new ATOM 0 HG22 VAL A 57 11.598 0.821 -5.592 1.00 0.00 H new ATOM 0 HG23 VAL A 57 11.378 -0.491 -4.410 1.00 0.00 H new ATOM 843 N ASP A 58 11.049 3.484 -4.866 1.00 0.00 N ATOM 844 CA ASP A 58 11.218 4.857 -5.398 1.00 0.00 C ATOM 845 C ASP A 58 10.238 5.189 -6.550 1.00 0.00 C ATOM 846 O ASP A 58 9.749 4.285 -7.206 1.00 0.00 O ATOM 847 CB ASP A 58 12.656 5.040 -5.922 1.00 0.00 C ATOM 848 CG ASP A 58 13.732 4.710 -4.879 1.00 0.00 C ATOM 849 OD1 ASP A 58 13.669 5.243 -3.748 1.00 0.00 O ATOM 850 OD2 ASP A 58 14.653 3.920 -5.214 1.00 0.00 O ATOM 0 H ASP A 58 11.811 2.852 -5.111 1.00 0.00 H new ATOM 0 HA ASP A 58 11.006 5.534 -4.571 1.00 0.00 H new ATOM 0 HB2 ASP A 58 12.800 4.404 -6.795 1.00 0.00 H new ATOM 0 HB3 ASP A 58 12.786 6.070 -6.253 1.00 0.00 H new ATOM 854 N LYS A 59 10.018 6.470 -6.895 1.00 0.00 N ATOM 855 CA LYS A 59 9.211 6.895 -8.070 1.00 0.00 C ATOM 856 C LYS A 59 9.625 6.189 -9.369 1.00 0.00 C ATOM 857 O LYS A 59 8.786 5.664 -10.094 1.00 0.00 O ATOM 858 CB LYS A 59 9.263 8.432 -8.229 1.00 0.00 C ATOM 859 CG LYS A 59 8.615 8.978 -9.517 1.00 0.00 C ATOM 860 CD LYS A 59 9.612 9.215 -10.677 1.00 0.00 C ATOM 861 CE LYS A 59 9.362 8.374 -11.941 1.00 0.00 C ATOM 862 NZ LYS A 59 8.453 9.023 -12.911 1.00 0.00 N ATOM 0 H LYS A 59 10.397 7.254 -6.364 1.00 0.00 H new ATOM 0 HA LYS A 59 8.182 6.593 -7.877 1.00 0.00 H new ATOM 0 HB2 LYS A 59 8.769 8.888 -7.371 1.00 0.00 H new ATOM 0 HB3 LYS A 59 10.305 8.750 -8.202 1.00 0.00 H new ATOM 0 HG2 LYS A 59 7.848 8.279 -9.849 1.00 0.00 H new ATOM 0 HG3 LYS A 59 8.112 9.917 -9.287 1.00 0.00 H new ATOM 0 HD2 LYS A 59 9.582 10.270 -10.950 1.00 0.00 H new ATOM 0 HD3 LYS A 59 10.620 9.008 -10.316 1.00 0.00 H new ATOM 0 HE2 LYS A 59 10.316 8.172 -12.428 1.00 0.00 H new ATOM 0 HE3 LYS A 59 8.942 7.411 -11.650 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 7.791 8.317 -13.292 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 7.918 9.777 -12.435 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 9.010 9.431 -13.689 1.00 0.00 H new ATOM 872 N ASP A 60 10.925 6.168 -9.674 1.00 0.00 N ATOM 873 CA ASP A 60 11.493 5.492 -10.842 1.00 0.00 C ATOM 874 C ASP A 60 11.193 3.985 -10.818 1.00 0.00 C ATOM 875 O ASP A 60 10.665 3.448 -11.783 1.00 0.00 O ATOM 876 CB ASP A 60 13.001 5.776 -10.887 1.00 0.00 C ATOM 877 CG ASP A 60 13.713 4.904 -11.936 1.00 0.00 C ATOM 878 OD1 ASP A 60 13.625 5.225 -13.145 1.00 0.00 O ATOM 879 OD2 ASP A 60 14.370 3.911 -11.539 1.00 0.00 O ATOM 0 H ASP A 60 11.629 6.633 -9.101 1.00 0.00 H new ATOM 0 HA ASP A 60 11.031 5.879 -11.750 1.00 0.00 H new ATOM 0 HB2 ASP A 60 13.166 6.829 -11.116 1.00 0.00 H new ATOM 0 HB3 ASP A 60 13.436 5.591 -9.905 1.00 0.00 H new ATOM 883 N GLN A 61 11.466 3.325 -9.695 1.00 0.00 N ATOM 884 CA GLN A 61 11.248 1.893 -9.490 1.00 0.00 C ATOM 885 C GLN A 61 9.744 1.512 -9.569 1.00 0.00 C ATOM 886 O GLN A 61 9.369 0.470 -10.105 1.00 0.00 O ATOM 887 CB GLN A 61 11.831 1.488 -8.126 1.00 0.00 C ATOM 888 CG GLN A 61 13.344 1.720 -7.918 1.00 0.00 C ATOM 889 CD GLN A 61 14.239 0.604 -8.461 1.00 0.00 C ATOM 890 OE1 GLN A 61 13.963 -0.587 -8.353 1.00 0.00 O ATOM 891 NE2 GLN A 61 15.380 0.933 -9.032 1.00 0.00 N ATOM 0 H GLN A 61 11.858 3.787 -8.874 1.00 0.00 H new ATOM 0 HA GLN A 61 11.754 1.352 -10.290 1.00 0.00 H new ATOM 0 HB2 GLN A 61 11.294 2.035 -7.351 1.00 0.00 H new ATOM 0 HB3 GLN A 61 11.625 0.429 -7.970 1.00 0.00 H new ATOM 0 HG2 GLN A 61 13.624 2.658 -8.397 1.00 0.00 H new ATOM 0 HG3 GLN A 61 13.537 1.837 -6.852 1.00 0.00 H new ATOM 0 HE21 GLN A 61 15.634 1.915 -9.135 1.00 0.00 H new ATOM 0 HE22 GLN A 61 16.009 0.205 -9.371 1.00 0.00 H new ATOM 898 N ALA A 62 8.867 2.400 -9.089 1.00 0.00 N ATOM 899 CA ALA A 62 7.422 2.297 -9.170 1.00 0.00 C ATOM 900 C ALA A 62 6.946 2.357 -10.634 1.00 0.00 C ATOM 901 O ALA A 62 6.203 1.490 -11.082 1.00 0.00 O ATOM 902 CB ALA A 62 6.784 3.404 -8.316 1.00 0.00 C ATOM 0 H ALA A 62 9.170 3.249 -8.611 1.00 0.00 H new ATOM 0 HA ALA A 62 7.106 1.331 -8.776 1.00 0.00 H new ATOM 0 HB1 ALA A 62 5.698 3.329 -8.375 1.00 0.00 H new ATOM 0 HB2 ALA A 62 7.100 3.291 -7.279 1.00 0.00 H new ATOM 0 HB3 ALA A 62 7.101 4.378 -8.688 1.00 0.00 H new ATOM 908 N ASP A 63 7.393 3.347 -11.412 1.00 0.00 N ATOM 909 CA ASP A 63 7.066 3.491 -12.839 1.00 0.00 C ATOM 910 C ASP A 63 7.682 2.360 -13.702 1.00 0.00 C ATOM 911 O ASP A 63 7.073 1.901 -14.668 1.00 0.00 O ATOM 912 CB ASP A 63 7.504 4.884 -13.334 1.00 0.00 C ATOM 913 CG ASP A 63 6.444 5.594 -14.200 1.00 0.00 C ATOM 914 OD1 ASP A 63 5.665 4.919 -14.914 1.00 0.00 O ATOM 915 OD2 ASP A 63 6.386 6.849 -14.139 1.00 0.00 O ATOM 0 H ASP A 63 8.004 4.086 -11.064 1.00 0.00 H new ATOM 0 HA ASP A 63 5.985 3.400 -12.949 1.00 0.00 H new ATOM 0 HB2 ASP A 63 7.735 5.510 -12.472 1.00 0.00 H new ATOM 0 HB3 ASP A 63 8.423 4.783 -13.911 1.00 0.00 H new ATOM 919 N ARG A 64 8.856 1.853 -13.300 1.00 0.00 N ATOM 920 CA ARG A 64 9.502 0.627 -13.807 1.00 0.00 C ATOM 921 C ARG A 64 8.708 -0.656 -13.568 1.00 0.00 C ATOM 922 O ARG A 64 8.996 -1.679 -14.193 1.00 0.00 O ATOM 923 CB ARG A 64 10.895 0.474 -13.159 1.00 0.00 C ATOM 924 CG ARG A 64 12.016 1.287 -13.823 1.00 0.00 C ATOM 925 CD ARG A 64 12.277 0.790 -15.256 1.00 0.00 C ATOM 926 NE ARG A 64 13.702 0.809 -15.589 1.00 0.00 N ATOM 927 CZ ARG A 64 14.281 0.137 -16.570 1.00 0.00 C ATOM 928 NH1 ARG A 64 13.588 -0.560 -17.424 1.00 0.00 N ATOM 929 NH2 ARG A 64 15.575 0.150 -16.714 1.00 0.00 N ATOM 0 H ARG A 64 9.412 2.308 -12.576 1.00 0.00 H new ATOM 0 HA ARG A 64 9.567 0.754 -14.888 1.00 0.00 H new ATOM 0 HB2 ARG A 64 10.826 0.768 -12.112 1.00 0.00 H new ATOM 0 HB3 ARG A 64 11.173 -0.580 -13.176 1.00 0.00 H new ATOM 0 HG2 ARG A 64 11.743 2.342 -13.843 1.00 0.00 H new ATOM 0 HG3 ARG A 64 12.929 1.205 -13.233 1.00 0.00 H new ATOM 0 HD2 ARG A 64 11.892 -0.224 -15.364 1.00 0.00 H new ATOM 0 HD3 ARG A 64 11.731 1.415 -15.962 1.00 0.00 H new ATOM 0 HE ARG A 64 14.304 1.395 -15.011 1.00 0.00 H new ATOM 0 HH11 ARG A 64 12.572 -0.597 -17.346 1.00 0.00 H new ATOM 0 HH12 ARG A 64 14.061 -1.068 -18.171 1.00 0.00 H new ATOM 0 HH21 ARG A 64 16.155 0.683 -16.066 1.00 0.00 H new ATOM 0 HH22 ARG A 64 16.009 -0.373 -17.475 1.00 0.00 H new ATOM 940 N CYS A 65 7.724 -0.620 -12.667 1.00 0.00 N ATOM 941 CA CYS A 65 6.989 -1.773 -12.173 1.00 0.00 C ATOM 942 C CYS A 65 7.873 -2.849 -11.524 1.00 0.00 C ATOM 943 O CYS A 65 7.725 -4.033 -11.801 1.00 0.00 O ATOM 944 CB CYS A 65 6.064 -2.301 -13.269 1.00 0.00 C ATOM 945 SG CYS A 65 4.803 -1.147 -13.824 1.00 0.00 S ATOM 0 H CYS A 65 7.408 0.254 -12.247 1.00 0.00 H new ATOM 0 HA CYS A 65 6.366 -1.442 -11.342 1.00 0.00 H new ATOM 0 HB2 CYS A 65 6.671 -2.592 -14.126 1.00 0.00 H new ATOM 0 HB3 CYS A 65 5.573 -3.204 -12.905 1.00 0.00 H new ATOM 949 N THR A 66 8.798 -2.444 -10.657 1.00 0.00 N ATOM 950 CA THR A 66 9.710 -3.367 -9.944 1.00 0.00 C ATOM 951 C THR A 66 9.817 -3.029 -8.455 1.00 0.00 C ATOM 952 O THR A 66 9.588 -1.898 -8.027 1.00 0.00 O ATOM 953 CB THR A 66 11.093 -3.418 -10.619 1.00 0.00 C ATOM 954 OG1 THR A 66 11.677 -2.134 -10.670 1.00 0.00 O ATOM 955 CG2 THR A 66 11.020 -3.933 -12.062 1.00 0.00 C ATOM 0 H THR A 66 8.945 -1.463 -10.420 1.00 0.00 H new ATOM 0 HA THR A 66 9.277 -4.365 -10.009 1.00 0.00 H new ATOM 0 HB THR A 66 11.691 -4.100 -10.014 1.00 0.00 H new ATOM 0 HG1 THR A 66 12.555 -2.191 -11.101 1.00 0.00 H new ATOM 0 HG21 THR A 66 12.021 -3.950 -12.493 1.00 0.00 H new ATOM 0 HG22 THR A 66 10.605 -4.941 -12.068 1.00 0.00 H new ATOM 0 HG23 THR A 66 10.382 -3.275 -12.651 1.00 0.00 H new ATOM 963 N ILE A 67 10.138 -4.038 -7.641 1.00 0.00 N ATOM 964 CA ILE A 67 10.318 -3.949 -6.189 1.00 0.00 C ATOM 965 C ILE A 67 11.785 -4.270 -5.876 1.00 0.00 C ATOM 966 O ILE A 67 12.314 -5.282 -6.339 1.00 0.00 O ATOM 967 CB ILE A 67 9.421 -4.936 -5.395 1.00 0.00 C ATOM 968 CG1 ILE A 67 8.026 -5.250 -5.987 1.00 0.00 C ATOM 969 CG2 ILE A 67 9.294 -4.475 -3.946 1.00 0.00 C ATOM 970 CD1 ILE A 67 7.035 -4.093 -6.001 1.00 0.00 C ATOM 0 H ILE A 67 10.287 -4.984 -7.993 1.00 0.00 H new ATOM 0 HA ILE A 67 10.034 -2.942 -5.883 1.00 0.00 H new ATOM 0 HB ILE A 67 9.948 -5.888 -5.467 1.00 0.00 H new ATOM 0 HG12 ILE A 67 8.158 -5.603 -7.010 1.00 0.00 H new ATOM 0 HG13 ILE A 67 7.588 -6.072 -5.420 1.00 0.00 H new ATOM 0 HG21 ILE A 67 8.663 -5.173 -3.396 1.00 0.00 H new ATOM 0 HG22 ILE A 67 10.282 -4.440 -3.487 1.00 0.00 H new ATOM 0 HG23 ILE A 67 8.846 -3.482 -3.918 1.00 0.00 H new ATOM 0 HD11 ILE A 67 6.093 -4.426 -6.436 1.00 0.00 H new ATOM 0 HD12 ILE A 67 6.862 -3.750 -4.981 1.00 0.00 H new ATOM 0 HD13 ILE A 67 7.440 -3.274 -6.596 1.00 0.00 H new ATOM 981 N LYS A 68 12.447 -3.421 -5.083 1.00 0.00 N ATOM 982 CA LYS A 68 13.822 -3.635 -4.603 1.00 0.00 C ATOM 983 C LYS A 68 13.851 -4.754 -3.549 1.00 0.00 C ATOM 984 O LYS A 68 13.079 -4.707 -2.594 1.00 0.00 O ATOM 985 CB LYS A 68 14.344 -2.302 -4.009 1.00 0.00 C ATOM 986 CG LYS A 68 15.859 -2.127 -4.137 1.00 0.00 C ATOM 987 CD LYS A 68 16.257 -1.707 -5.556 1.00 0.00 C ATOM 988 CE LYS A 68 17.775 -1.534 -5.627 1.00 0.00 C ATOM 989 NZ LYS A 68 18.227 -1.159 -6.985 1.00 0.00 N ATOM 0 H LYS A 68 12.037 -2.549 -4.749 1.00 0.00 H new ATOM 0 HA LYS A 68 14.464 -3.943 -5.428 1.00 0.00 H new ATOM 0 HB2 LYS A 68 13.847 -1.471 -4.510 1.00 0.00 H new ATOM 0 HB3 LYS A 68 14.068 -2.250 -2.956 1.00 0.00 H new ATOM 0 HG2 LYS A 68 16.201 -1.376 -3.425 1.00 0.00 H new ATOM 0 HG3 LYS A 68 16.357 -3.062 -3.880 1.00 0.00 H new ATOM 0 HD2 LYS A 68 15.932 -2.459 -6.275 1.00 0.00 H new ATOM 0 HD3 LYS A 68 15.761 -0.774 -5.824 1.00 0.00 H new ATOM 0 HE2 LYS A 68 18.086 -0.768 -4.917 1.00 0.00 H new ATOM 0 HE3 LYS A 68 18.260 -2.463 -5.327 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 19.261 -1.052 -6.989 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 17.953 -1.902 -7.659 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 17.785 -0.259 -7.262 1.00 0.00 H new ATOM 999 N LYS A 69 14.773 -5.721 -3.647 1.00 0.00 N ATOM 1000 CA LYS A 69 15.006 -6.726 -2.577 1.00 0.00 C ATOM 1001 C LYS A 69 15.559 -6.116 -1.275 1.00 0.00 C ATOM 1002 O LYS A 69 15.450 -6.730 -0.216 1.00 0.00 O ATOM 1003 CB LYS A 69 15.897 -7.883 -3.064 1.00 0.00 C ATOM 1004 CG LYS A 69 15.123 -8.850 -3.977 1.00 0.00 C ATOM 1005 CD LYS A 69 15.850 -10.198 -4.126 1.00 0.00 C ATOM 1006 CE LYS A 69 16.033 -10.584 -5.596 1.00 0.00 C ATOM 1007 NZ LYS A 69 16.497 -11.979 -5.747 1.00 0.00 N ATOM 0 H LYS A 69 15.379 -5.837 -4.459 1.00 0.00 H new ATOM 0 HA LYS A 69 14.022 -7.130 -2.336 1.00 0.00 H new ATOM 0 HB2 LYS A 69 16.754 -7.480 -3.603 1.00 0.00 H new ATOM 0 HB3 LYS A 69 16.288 -8.428 -2.205 1.00 0.00 H new ATOM 0 HG2 LYS A 69 14.127 -9.017 -3.568 1.00 0.00 H new ATOM 0 HG3 LYS A 69 14.992 -8.397 -4.960 1.00 0.00 H new ATOM 0 HD2 LYS A 69 16.824 -10.141 -3.641 1.00 0.00 H new ATOM 0 HD3 LYS A 69 15.283 -10.975 -3.614 1.00 0.00 H new ATOM 0 HE2 LYS A 69 15.088 -10.457 -6.125 1.00 0.00 H new ATOM 0 HE3 LYS A 69 16.752 -9.910 -6.061 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 16.608 -12.200 -6.757 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 17.411 -12.095 -5.264 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 15.799 -12.625 -5.326 1.00 0.00 H new ATOM 1017 N GLU A 70 16.111 -4.902 -1.332 1.00 0.00 N ATOM 1018 CA GLU A 70 16.524 -4.129 -0.154 1.00 0.00 C ATOM 1019 C GLU A 70 15.341 -3.531 0.651 1.00 0.00 C ATOM 1020 O GLU A 70 15.538 -3.042 1.772 1.00 0.00 O ATOM 1021 CB GLU A 70 17.514 -3.023 -0.551 1.00 0.00 C ATOM 1022 CG GLU A 70 18.765 -3.568 -1.260 1.00 0.00 C ATOM 1023 CD GLU A 70 19.949 -2.586 -1.159 1.00 0.00 C ATOM 1024 OE1 GLU A 70 19.923 -1.518 -1.822 1.00 0.00 O ATOM 1025 OE2 GLU A 70 20.923 -2.877 -0.419 1.00 0.00 O ATOM 0 H GLU A 70 16.287 -4.418 -2.213 1.00 0.00 H new ATOM 0 HA GLU A 70 17.015 -4.840 0.511 1.00 0.00 H new ATOM 0 HB2 GLU A 70 17.012 -2.311 -1.206 1.00 0.00 H new ATOM 0 HB3 GLU A 70 17.817 -2.476 0.342 1.00 0.00 H new ATOM 0 HG2 GLU A 70 19.046 -4.524 -0.819 1.00 0.00 H new ATOM 0 HG3 GLU A 70 18.536 -3.756 -2.309 1.00 0.00 H new ATOM 1030 N ASN A 71 14.116 -3.581 0.115 1.00 0.00 N ATOM 1031 CA ASN A 71 12.896 -3.248 0.848 1.00 0.00 C ATOM 1032 C ASN A 71 12.539 -4.305 1.910 1.00 0.00 C ATOM 1033 O ASN A 71 13.209 -5.333 2.071 1.00 0.00 O ATOM 1034 CB ASN A 71 11.745 -3.074 -0.153 1.00 0.00 C ATOM 1035 CG ASN A 71 11.962 -1.984 -1.174 1.00 0.00 C ATOM 1036 OD1 ASN A 71 11.379 -2.145 -2.334 1.00 0.00 O flip ATOM 1037 ND2 ASN A 71 12.620 -0.974 -0.950 1.00 0.00 N flip ATOM 0 H ASN A 71 13.945 -3.858 -0.852 1.00 0.00 H new ATOM 0 HA ASN A 71 13.067 -2.317 1.388 1.00 0.00 H new ATOM 0 HB2 ASN A 71 11.589 -4.018 -0.676 1.00 0.00 H new ATOM 0 HB3 ASN A 71 10.830 -2.860 0.399 1.00 0.00 H new ATOM 0 HD21 ASN A 71 13.073 -0.851 -0.045 1.00 0.00 H new ATOM 0 HD22 ASN A 71 12.714 -0.257 -1.669 1.00 0.00 H new ATOM 1043 N THR A 72 11.436 -4.066 2.620 1.00 0.00 N ATOM 1044 CA THR A 72 10.943 -4.903 3.723 1.00 0.00 C ATOM 1045 C THR A 72 9.426 -5.166 3.572 1.00 0.00 C ATOM 1046 O THR A 72 8.747 -4.364 2.917 1.00 0.00 O ATOM 1047 CB THR A 72 11.245 -4.243 5.082 1.00 0.00 C ATOM 1048 OG1 THR A 72 10.412 -3.128 5.300 1.00 0.00 O ATOM 1049 CG2 THR A 72 12.690 -3.757 5.206 1.00 0.00 C ATOM 0 H THR A 72 10.839 -3.259 2.440 1.00 0.00 H new ATOM 0 HA THR A 72 11.462 -5.860 3.684 1.00 0.00 H new ATOM 0 HB THR A 72 11.065 -5.023 5.822 1.00 0.00 H new ATOM 0 HG1 THR A 72 10.622 -2.728 6.170 1.00 0.00 H new ATOM 0 HG21 THR A 72 12.838 -3.302 6.185 1.00 0.00 H new ATOM 0 HG22 THR A 72 13.369 -4.602 5.092 1.00 0.00 H new ATOM 0 HG23 THR A 72 12.894 -3.020 4.429 1.00 0.00 H new ATOM 1057 N PRO A 73 8.877 -6.263 4.139 1.00 0.00 N ATOM 1058 CA PRO A 73 7.450 -6.586 4.059 1.00 0.00 C ATOM 1059 C PRO A 73 6.601 -5.614 4.902 1.00 0.00 C ATOM 1060 O PRO A 73 6.245 -5.910 6.048 1.00 0.00 O ATOM 1061 CB PRO A 73 7.330 -8.056 4.489 1.00 0.00 C ATOM 1062 CG PRO A 73 8.551 -8.302 5.369 1.00 0.00 C ATOM 1063 CD PRO A 73 9.597 -7.313 4.847 1.00 0.00 C ATOM 0 HA PRO A 73 7.055 -6.465 3.050 1.00 0.00 H new ATOM 0 HB2 PRO A 73 6.405 -8.234 5.037 1.00 0.00 H new ATOM 0 HB3 PRO A 73 7.323 -8.722 3.626 1.00 0.00 H new ATOM 0 HG2 PRO A 73 8.326 -8.125 6.421 1.00 0.00 H new ATOM 0 HG3 PRO A 73 8.900 -9.331 5.287 1.00 0.00 H new ATOM 0 HD2 PRO A 73 10.177 -6.895 5.670 1.00 0.00 H new ATOM 0 HD3 PRO A 73 10.302 -7.813 4.182 1.00 0.00 H new ATOM 1068 N LEU A 74 6.291 -4.431 4.347 1.00 0.00 N ATOM 1069 CA LEU A 74 5.445 -3.429 4.997 1.00 0.00 C ATOM 1070 C LEU A 74 4.007 -3.950 5.145 1.00 0.00 C ATOM 1071 O LEU A 74 3.480 -3.997 6.262 1.00 0.00 O ATOM 1072 CB LEU A 74 5.506 -2.107 4.206 1.00 0.00 C ATOM 1073 CG LEU A 74 4.983 -0.841 4.906 1.00 0.00 C ATOM 1074 CD1 LEU A 74 3.494 -0.850 5.223 1.00 0.00 C ATOM 1075 CD2 LEU A 74 5.748 -0.535 6.194 1.00 0.00 C ATOM 0 H LEU A 74 6.626 -4.145 3.427 1.00 0.00 H new ATOM 0 HA LEU A 74 5.817 -3.235 6.003 1.00 0.00 H new ATOM 0 HB2 LEU A 74 6.544 -1.931 3.922 1.00 0.00 H new ATOM 0 HB3 LEU A 74 4.941 -2.240 3.283 1.00 0.00 H new ATOM 0 HG LEU A 74 5.154 -0.059 4.166 1.00 0.00 H new ATOM 0 HD11 LEU A 74 3.221 0.084 5.715 1.00 0.00 H new ATOM 0 HD12 LEU A 74 2.926 -0.953 4.298 1.00 0.00 H new ATOM 0 HD13 LEU A 74 3.268 -1.687 5.883 1.00 0.00 H new ATOM 0 HD21 LEU A 74 5.343 0.367 6.652 1.00 0.00 H new ATOM 0 HD22 LEU A 74 5.645 -1.371 6.886 1.00 0.00 H new ATOM 0 HD23 LEU A 74 6.802 -0.383 5.963 1.00 0.00 H new ATOM 1086 N LEU A 75 3.406 -4.397 4.034 1.00 0.00 N ATOM 1087 CA LEU A 75 2.009 -4.811 3.998 1.00 0.00 C ATOM 1088 C LEU A 75 1.865 -6.267 3.547 1.00 0.00 C ATOM 1089 O LEU A 75 2.255 -6.646 2.442 1.00 0.00 O ATOM 1090 CB LEU A 75 1.204 -3.834 3.133 1.00 0.00 C ATOM 1091 CG LEU A 75 -0.308 -3.728 3.420 1.00 0.00 C ATOM 1092 CD1 LEU A 75 -1.115 -4.951 3.011 1.00 0.00 C ATOM 1093 CD2 LEU A 75 -0.639 -3.459 4.891 1.00 0.00 C ATOM 0 H LEU A 75 3.882 -4.479 3.136 1.00 0.00 H new ATOM 0 HA LEU A 75 1.598 -4.775 5.007 1.00 0.00 H new ATOM 0 HB2 LEU A 75 1.641 -2.842 3.246 1.00 0.00 H new ATOM 0 HB3 LEU A 75 1.332 -4.121 2.089 1.00 0.00 H new ATOM 0 HG LEU A 75 -0.593 -2.876 2.802 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -2.166 -4.790 3.249 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -1.007 -5.116 1.939 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -0.751 -5.825 3.551 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -1.720 -3.397 5.015 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -0.249 -4.270 5.506 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -0.184 -2.518 5.200 1.00 0.00 H new ATOM 1104 N ASN A 76 1.271 -7.065 4.433 1.00 0.00 N ATOM 1105 CA ASN A 76 1.216 -8.524 4.402 1.00 0.00 C ATOM 1106 C ASN A 76 -0.244 -9.001 4.390 1.00 0.00 C ATOM 1107 O ASN A 76 -0.695 -9.632 5.337 1.00 0.00 O ATOM 1108 CB ASN A 76 2.064 -9.031 5.600 1.00 0.00 C ATOM 1109 CG ASN A 76 3.529 -9.248 5.287 1.00 0.00 C ATOM 1110 OD1 ASN A 76 4.033 -8.943 4.219 1.00 0.00 O ATOM 1111 ND2 ASN A 76 4.255 -9.847 6.199 1.00 0.00 N ATOM 0 H ASN A 76 0.784 -6.684 5.244 1.00 0.00 H new ATOM 0 HA ASN A 76 1.642 -8.944 3.491 1.00 0.00 H new ATOM 0 HB2 ASN A 76 1.983 -8.313 6.416 1.00 0.00 H new ATOM 0 HB3 ASN A 76 1.639 -9.969 5.958 1.00 0.00 H new ATOM 0 HD21 ASN A 76 5.236 -10.056 6.014 1.00 0.00 H new ATOM 0 HD22 ASN A 76 3.839 -10.104 7.094 1.00 0.00 H new ATOM 1117 N CYS A 77 -0.989 -8.649 3.334 1.00 0.00 N ATOM 1118 CA CYS A 77 -2.379 -9.035 3.063 1.00 0.00 C ATOM 1119 C CYS A 77 -2.603 -10.565 3.075 1.00 0.00 C ATOM 1120 O CYS A 77 -2.692 -11.189 2.027 1.00 0.00 O ATOM 1121 CB CYS A 77 -2.841 -8.379 1.740 1.00 0.00 C ATOM 1122 SG CYS A 77 -3.534 -6.719 1.855 1.00 0.00 S ATOM 0 H CYS A 77 -0.613 -8.049 2.600 1.00 0.00 H new ATOM 0 HA CYS A 77 -2.999 -8.663 3.879 1.00 0.00 H new ATOM 0 HB2 CYS A 77 -1.988 -8.345 1.062 1.00 0.00 H new ATOM 0 HB3 CYS A 77 -3.587 -9.028 1.282 1.00 0.00 H new ATOM 1126 N ALA A 78 -2.654 -11.152 4.271 1.00 0.00 N ATOM 1127 CA ALA A 78 -2.661 -12.583 4.588 1.00 0.00 C ATOM 1128 C ALA A 78 -1.375 -13.343 4.203 1.00 0.00 C ATOM 1129 O ALA A 78 -1.422 -14.500 3.787 1.00 0.00 O ATOM 1130 CB ALA A 78 -3.962 -13.230 4.099 1.00 0.00 C ATOM 0 H ALA A 78 -2.695 -10.588 5.120 1.00 0.00 H new ATOM 0 HA ALA A 78 -2.647 -12.668 5.675 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -3.953 -14.293 4.341 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -4.812 -12.753 4.588 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -4.047 -13.105 3.020 1.00 0.00 H new ATOM 1136 N LYS A 79 -0.196 -12.717 4.387 1.00 0.00 N ATOM 1137 CA LYS A 79 1.120 -13.359 4.215 1.00 0.00 C ATOM 1138 C LYS A 79 1.288 -14.700 4.977 1.00 0.00 C ATOM 1139 O LYS A 79 1.795 -15.635 4.351 1.00 0.00 O ATOM 1140 CB LYS A 79 2.249 -12.373 4.563 1.00 0.00 C ATOM 1141 CG LYS A 79 3.623 -12.793 4.028 1.00 0.00 C ATOM 1142 CD LYS A 79 3.882 -12.266 2.607 1.00 0.00 C ATOM 1143 CE LYS A 79 4.465 -13.361 1.708 1.00 0.00 C ATOM 1144 NZ LYS A 79 4.915 -12.814 0.413 1.00 0.00 N ATOM 0 H LYS A 79 -0.131 -11.737 4.663 1.00 0.00 H new ATOM 0 HA LYS A 79 1.184 -13.627 3.160 1.00 0.00 H new ATOM 0 HB2 LYS A 79 1.998 -11.391 4.162 1.00 0.00 H new ATOM 0 HB3 LYS A 79 2.307 -12.269 5.646 1.00 0.00 H new ATOM 0 HG2 LYS A 79 4.400 -12.423 4.697 1.00 0.00 H new ATOM 0 HG3 LYS A 79 3.694 -13.881 4.028 1.00 0.00 H new ATOM 0 HD2 LYS A 79 2.951 -11.897 2.178 1.00 0.00 H new ATOM 0 HD3 LYS A 79 4.570 -11.422 2.649 1.00 0.00 H new ATOM 0 HE2 LYS A 79 5.304 -13.840 2.213 1.00 0.00 H new ATOM 0 HE3 LYS A 79 3.713 -14.132 1.537 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 5.304 -13.581 -0.171 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 4.109 -12.379 -0.079 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 5.650 -12.096 0.576 1.00 0.00 H new ATOM 1154 N PRO A 80 0.905 -14.834 6.269 1.00 0.00 N ATOM 1155 CA PRO A 80 1.009 -16.104 6.975 1.00 0.00 C ATOM 1156 C PRO A 80 -0.125 -17.058 6.548 1.00 0.00 C ATOM 1157 O PRO A 80 0.067 -17.875 5.644 1.00 0.00 O ATOM 1158 CB PRO A 80 1.026 -15.754 8.465 1.00 0.00 C ATOM 1159 CG PRO A 80 0.255 -14.441 8.565 1.00 0.00 C ATOM 1160 CD PRO A 80 0.407 -13.797 7.173 1.00 0.00 C ATOM 0 HA PRO A 80 1.918 -16.655 6.733 1.00 0.00 H new ATOM 0 HB2 PRO A 80 0.555 -16.536 9.061 1.00 0.00 H new ATOM 0 HB3 PRO A 80 2.046 -15.643 8.834 1.00 0.00 H new ATOM 0 HG2 PRO A 80 -0.793 -14.614 8.810 1.00 0.00 H new ATOM 0 HG3 PRO A 80 0.663 -13.799 9.346 1.00 0.00 H new ATOM 0 HD2 PRO A 80 -0.549 -13.408 6.823 1.00 0.00 H new ATOM 0 HD3 PRO A 80 1.099 -12.956 7.212 1.00 0.00 H new ATOM 1165 N ASP A 81 -1.318 -16.952 7.158 1.00 0.00 N ATOM 1166 CA ASP A 81 -2.520 -17.742 6.814 1.00 0.00 C ATOM 1167 C ASP A 81 -3.820 -17.163 7.426 1.00 0.00 C ATOM 1168 O ASP A 81 -4.759 -17.887 7.771 1.00 0.00 O ATOM 1169 CB ASP A 81 -2.314 -19.213 7.238 1.00 0.00 C ATOM 1170 CG ASP A 81 -3.017 -20.223 6.310 1.00 0.00 C ATOM 1171 OD1 ASP A 81 -3.897 -19.841 5.501 1.00 0.00 O ATOM 1172 OD2 ASP A 81 -2.654 -21.422 6.383 1.00 0.00 O ATOM 0 H ASP A 81 -1.481 -16.299 7.924 1.00 0.00 H new ATOM 0 HA ASP A 81 -2.648 -17.689 5.733 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -1.246 -19.431 7.258 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -2.685 -19.346 8.254 1.00 0.00 H new ATOM 1176 N GLN A 82 -3.857 -15.845 7.654 1.00 0.00 N ATOM 1177 CA GLN A 82 -4.917 -15.162 8.419 1.00 0.00 C ATOM 1178 C GLN A 82 -5.211 -13.756 7.876 1.00 0.00 C ATOM 1179 O GLN A 82 -4.346 -13.127 7.273 1.00 0.00 O ATOM 1180 CB GLN A 82 -4.517 -15.088 9.906 1.00 0.00 C ATOM 1181 CG GLN A 82 -5.654 -15.581 10.811 1.00 0.00 C ATOM 1182 CD GLN A 82 -5.309 -15.422 12.287 1.00 0.00 C ATOM 1183 OE1 GLN A 82 -4.504 -16.158 12.851 1.00 0.00 O ATOM 1184 NE2 GLN A 82 -5.887 -14.456 12.970 1.00 0.00 N ATOM 0 H GLN A 82 -3.140 -15.208 7.307 1.00 0.00 H new ATOM 0 HA GLN A 82 -5.832 -15.744 8.312 1.00 0.00 H new ATOM 0 HB2 GLN A 82 -3.625 -15.692 10.076 1.00 0.00 H new ATOM 0 HB3 GLN A 82 -4.261 -14.061 10.166 1.00 0.00 H new ATOM 0 HG2 GLN A 82 -6.564 -15.024 10.588 1.00 0.00 H new ATOM 0 HG3 GLN A 82 -5.861 -16.629 10.597 1.00 0.00 H new ATOM 0 HE21 GLN A 82 -6.557 -13.838 12.512 1.00 0.00 H new ATOM 0 HE22 GLN A 82 -5.664 -14.325 13.957 1.00 0.00 H new ATOM 1191 N ASP A 83 -6.436 -13.264 8.071 1.00 0.00 N ATOM 1192 CA ASP A 83 -6.837 -11.918 7.653 1.00 0.00 C ATOM 1193 C ASP A 83 -5.927 -10.867 8.289 1.00 0.00 C ATOM 1194 O ASP A 83 -5.633 -10.924 9.485 1.00 0.00 O ATOM 1195 CB ASP A 83 -8.315 -11.641 7.979 1.00 0.00 C ATOM 1196 CG ASP A 83 -8.693 -11.967 9.435 1.00 0.00 C ATOM 1197 OD1 ASP A 83 -8.746 -13.173 9.783 1.00 0.00 O ATOM 1198 OD2 ASP A 83 -8.980 -11.027 10.217 1.00 0.00 O ATOM 0 H ASP A 83 -7.182 -13.790 8.526 1.00 0.00 H new ATOM 0 HA ASP A 83 -6.728 -11.857 6.570 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -8.532 -10.591 7.782 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -8.943 -12.228 7.309 1.00 0.00 H new ATOM 1202 N ILE A 84 -5.502 -9.887 7.489 1.00 0.00 N ATOM 1203 CA ILE A 84 -4.737 -8.737 7.969 1.00 0.00 C ATOM 1204 C ILE A 84 -5.613 -7.498 7.883 1.00 0.00 C ATOM 1205 O ILE A 84 -6.312 -7.263 6.896 1.00 0.00 O ATOM 1206 CB ILE A 84 -3.361 -8.604 7.261 1.00 0.00 C ATOM 1207 CG1 ILE A 84 -2.199 -8.533 8.279 1.00 0.00 C ATOM 1208 CG2 ILE A 84 -3.241 -7.391 6.323 1.00 0.00 C ATOM 1209 CD1 ILE A 84 -2.009 -9.801 9.124 1.00 0.00 C ATOM 0 H ILE A 84 -5.680 -9.870 6.485 1.00 0.00 H new ATOM 0 HA ILE A 84 -4.471 -8.880 9.016 1.00 0.00 H new ATOM 0 HB ILE A 84 -3.293 -9.506 6.653 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -1.274 -8.330 7.740 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -2.371 -7.689 8.948 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -2.249 -7.377 5.872 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -3.995 -7.461 5.539 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -3.394 -6.474 6.892 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -1.173 -9.660 9.809 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -2.917 -9.997 9.695 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -1.803 -10.647 8.469 1.00 0.00 H new ATOM 1220 N LYS A 85 -5.554 -6.701 8.947 1.00 0.00 N ATOM 1221 CA LYS A 85 -6.222 -5.406 9.080 1.00 0.00 C ATOM 1222 C LYS A 85 -5.285 -4.451 9.800 1.00 0.00 C ATOM 1223 O LYS A 85 -4.768 -4.753 10.872 1.00 0.00 O ATOM 1224 CB LYS A 85 -7.582 -5.596 9.781 1.00 0.00 C ATOM 1225 CG LYS A 85 -8.314 -4.272 10.047 1.00 0.00 C ATOM 1226 CD LYS A 85 -8.100 -3.689 11.454 1.00 0.00 C ATOM 1227 CE LYS A 85 -9.257 -4.010 12.418 1.00 0.00 C ATOM 1228 NZ LYS A 85 -9.057 -5.260 13.183 1.00 0.00 N ATOM 0 H LYS A 85 -5.016 -6.950 9.777 1.00 0.00 H new ATOM 0 HA LYS A 85 -6.444 -4.965 8.108 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -8.214 -6.237 9.166 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -7.427 -6.115 10.727 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -7.987 -3.538 9.311 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -9.382 -4.426 9.891 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -7.170 -4.081 11.867 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -7.985 -2.608 11.380 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -9.379 -3.182 13.116 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -10.183 -4.086 11.849 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -9.871 -5.416 13.811 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -8.970 -6.060 12.524 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -8.190 -5.184 13.752 1.00 0.00 H new ATOM 1238 N PHE A 86 -5.085 -3.289 9.194 1.00 0.00 N ATOM 1239 CA PHE A 86 -4.273 -2.195 9.716 1.00 0.00 C ATOM 1240 C PHE A 86 -5.066 -0.897 9.534 1.00 0.00 C ATOM 1241 O PHE A 86 -5.373 -0.488 8.415 1.00 0.00 O ATOM 1242 CB PHE A 86 -2.906 -2.160 9.007 1.00 0.00 C ATOM 1243 CG PHE A 86 -1.785 -2.788 9.813 1.00 0.00 C ATOM 1244 CD1 PHE A 86 -1.493 -4.162 9.693 1.00 0.00 C ATOM 1245 CD2 PHE A 86 -1.015 -1.988 10.682 1.00 0.00 C ATOM 1246 CE1 PHE A 86 -0.440 -4.731 10.436 1.00 0.00 C ATOM 1247 CE2 PHE A 86 0.037 -2.555 11.423 1.00 0.00 C ATOM 1248 CZ PHE A 86 0.319 -3.926 11.303 1.00 0.00 C ATOM 0 H PHE A 86 -5.500 -3.072 8.288 1.00 0.00 H new ATOM 0 HA PHE A 86 -4.062 -2.331 10.777 1.00 0.00 H new ATOM 0 HB2 PHE A 86 -2.989 -2.678 8.051 1.00 0.00 H new ATOM 0 HB3 PHE A 86 -2.647 -1.124 8.787 1.00 0.00 H new ATOM 0 HD1 PHE A 86 -2.079 -4.781 9.029 1.00 0.00 H new ATOM 0 HD2 PHE A 86 -1.234 -0.935 10.779 1.00 0.00 H new ATOM 0 HE1 PHE A 86 -0.216 -5.783 10.340 1.00 0.00 H new ATOM 0 HE2 PHE A 86 0.627 -1.937 12.084 1.00 0.00 H new ATOM 0 HZ PHE A 86 1.122 -4.363 11.879 1.00 0.00 H new ATOM 1257 N THR A 87 -5.423 -0.251 10.642 1.00 0.00 N ATOM 1258 CA THR A 87 -6.059 1.067 10.633 1.00 0.00 C ATOM 1259 C THR A 87 -5.094 2.086 11.217 1.00 0.00 C ATOM 1260 O THR A 87 -4.639 1.963 12.354 1.00 0.00 O ATOM 1261 CB THR A 87 -7.435 1.059 11.323 1.00 0.00 C ATOM 1262 OG1 THR A 87 -8.029 2.320 11.151 1.00 0.00 O ATOM 1263 CG2 THR A 87 -7.439 0.718 12.813 1.00 0.00 C ATOM 0 H THR A 87 -5.279 -0.629 11.578 1.00 0.00 H new ATOM 0 HA THR A 87 -6.274 1.356 9.604 1.00 0.00 H new ATOM 0 HB THR A 87 -7.990 0.253 10.844 1.00 0.00 H new ATOM 0 HG1 THR A 87 -8.908 2.329 11.584 1.00 0.00 H new ATOM 0 HG21 THR A 87 -8.462 0.743 13.189 1.00 0.00 H new ATOM 0 HG22 THR A 87 -7.023 -0.279 12.959 1.00 0.00 H new ATOM 0 HG23 THR A 87 -6.835 1.446 13.354 1.00 0.00 H new ATOM 1271 N ILE A 88 -4.738 3.074 10.401 1.00 0.00 N ATOM 1272 CA ILE A 88 -3.986 4.261 10.804 1.00 0.00 C ATOM 1273 C ILE A 88 -4.996 5.382 10.958 1.00 0.00 C ATOM 1274 O ILE A 88 -5.768 5.670 10.047 1.00 0.00 O ATOM 1275 CB ILE A 88 -2.852 4.551 9.778 1.00 0.00 C ATOM 1276 CG1 ILE A 88 -1.471 4.358 10.455 1.00 0.00 C ATOM 1277 CG2 ILE A 88 -2.888 5.949 9.127 1.00 0.00 C ATOM 1278 CD1 ILE A 88 -0.365 3.962 9.470 1.00 0.00 C ATOM 0 H ILE A 88 -4.972 3.071 9.408 1.00 0.00 H new ATOM 0 HA ILE A 88 -3.470 4.132 11.755 1.00 0.00 H new ATOM 0 HB ILE A 88 -3.019 3.838 8.971 1.00 0.00 H new ATOM 0 HG12 ILE A 88 -1.187 5.283 10.957 1.00 0.00 H new ATOM 0 HG13 ILE A 88 -1.555 3.591 11.225 1.00 0.00 H new ATOM 0 HG21 ILE A 88 -2.056 6.047 8.430 1.00 0.00 H new ATOM 0 HG22 ILE A 88 -3.828 6.076 8.590 1.00 0.00 H new ATOM 0 HG23 ILE A 88 -2.805 6.713 9.900 1.00 0.00 H new ATOM 0 HD11 ILE A 88 0.576 3.843 10.008 1.00 0.00 H new ATOM 0 HD12 ILE A 88 -0.628 3.021 8.986 1.00 0.00 H new ATOM 0 HD13 ILE A 88 -0.255 4.740 8.715 1.00 0.00 H new ATOM 1289 N LYS A 89 -4.996 6.013 12.131 1.00 0.00 N ATOM 1290 CA LYS A 89 -5.719 7.254 12.443 1.00 0.00 C ATOM 1291 C LYS A 89 -4.694 8.393 12.544 1.00 0.00 C ATOM 1292 O LYS A 89 -3.533 8.134 12.844 1.00 0.00 O ATOM 1293 CB LYS A 89 -6.512 7.058 13.755 1.00 0.00 C ATOM 1294 CG LYS A 89 -7.593 8.132 13.979 1.00 0.00 C ATOM 1295 CD LYS A 89 -7.568 8.780 15.362 1.00 0.00 C ATOM 1296 CE LYS A 89 -8.056 7.824 16.462 1.00 0.00 C ATOM 1297 NZ LYS A 89 -8.480 8.552 17.682 1.00 0.00 N ATOM 0 H LYS A 89 -4.469 5.660 12.930 1.00 0.00 H new ATOM 0 HA LYS A 89 -6.437 7.509 11.663 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -6.983 6.075 13.743 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -5.819 7.069 14.596 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -7.475 8.910 13.225 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -8.573 7.681 13.821 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -6.553 9.105 15.590 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -8.194 9.672 15.354 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -8.890 7.232 16.084 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -7.259 7.125 16.715 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -8.802 7.871 18.399 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -7.678 9.097 18.058 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -9.258 9.200 17.447 1.00 0.00 H new ATOM 1307 N PHE A 90 -5.119 9.625 12.283 1.00 0.00 N ATOM 1308 CA PHE A 90 -4.325 10.845 12.468 1.00 0.00 C ATOM 1309 C PHE A 90 -3.634 10.882 13.845 1.00 0.00 C ATOM 1310 O PHE A 90 -4.267 11.111 14.871 1.00 0.00 O ATOM 1311 CB PHE A 90 -5.172 12.104 12.179 1.00 0.00 C ATOM 1312 CG PHE A 90 -6.421 12.293 13.040 1.00 0.00 C ATOM 1313 CD1 PHE A 90 -7.632 11.643 12.725 1.00 0.00 C ATOM 1314 CD2 PHE A 90 -6.377 13.147 14.169 1.00 0.00 C ATOM 1315 CE1 PHE A 90 -8.763 11.799 13.558 1.00 0.00 C ATOM 1316 CE2 PHE A 90 -7.495 13.299 14.997 1.00 0.00 C ATOM 1317 CZ PHE A 90 -8.688 12.612 14.696 1.00 0.00 C ATOM 0 H PHE A 90 -6.055 9.813 11.925 1.00 0.00 H new ATOM 0 HA PHE A 90 -3.517 10.835 11.737 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -4.536 12.980 12.303 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -5.478 12.078 11.133 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -7.696 11.023 11.843 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -5.469 13.688 14.394 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -9.685 11.291 13.317 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -7.444 13.941 15.864 1.00 0.00 H new ATOM 0 HZ PHE A 90 -9.546 12.713 15.344 1.00 0.00 H new ATOM 1326 N GLN A 91 -2.318 10.628 13.880 1.00 0.00 N ATOM 1327 CA GLN A 91 -1.519 10.541 15.097 1.00 0.00 C ATOM 1328 C GLN A 91 -0.146 11.196 14.884 1.00 0.00 C ATOM 1329 O GLN A 91 0.650 10.745 14.069 1.00 0.00 O ATOM 1330 CB GLN A 91 -1.380 9.068 15.558 1.00 0.00 C ATOM 1331 CG GLN A 91 -1.733 8.873 17.037 1.00 0.00 C ATOM 1332 CD GLN A 91 -3.235 8.902 17.343 1.00 0.00 C ATOM 1333 OE1 GLN A 91 -4.059 8.330 16.642 1.00 0.00 O ATOM 1334 NE2 GLN A 91 -3.653 9.538 18.419 1.00 0.00 N ATOM 0 H GLN A 91 -1.770 10.474 13.034 1.00 0.00 H new ATOM 0 HA GLN A 91 -2.030 11.086 15.890 1.00 0.00 H new ATOM 0 HB2 GLN A 91 -2.028 8.439 14.948 1.00 0.00 H new ATOM 0 HB3 GLN A 91 -0.357 8.733 15.386 1.00 0.00 H new ATOM 0 HG2 GLN A 91 -1.326 7.919 17.372 1.00 0.00 H new ATOM 0 HG3 GLN A 91 -1.241 9.652 17.620 1.00 0.00 H new ATOM 0 HE21 GLN A 91 -2.984 10.022 19.018 1.00 0.00 H new ATOM 0 HE22 GLN A 91 -4.646 9.547 18.653 1.00 0.00 H new ATOM 1341 N GLU A 92 0.122 12.277 15.621 1.00 0.00 N ATOM 1342 CA GLU A 92 1.400 13.008 15.566 1.00 0.00 C ATOM 1343 C GLU A 92 2.575 12.205 16.154 1.00 0.00 C ATOM 1344 O GLU A 92 3.695 12.311 15.662 1.00 0.00 O ATOM 1345 CB GLU A 92 1.268 14.347 16.325 1.00 0.00 C ATOM 1346 CG GLU A 92 1.196 15.542 15.370 1.00 0.00 C ATOM 1347 CD GLU A 92 1.332 16.875 16.129 1.00 0.00 C ATOM 1348 OE1 GLU A 92 0.617 17.093 17.140 1.00 0.00 O ATOM 1349 OE2 GLU A 92 2.158 17.728 15.712 1.00 0.00 O ATOM 0 H GLU A 92 -0.546 12.677 16.280 1.00 0.00 H new ATOM 0 HA GLU A 92 1.620 13.183 14.513 1.00 0.00 H new ATOM 0 HB2 GLU A 92 0.373 14.325 16.946 1.00 0.00 H new ATOM 0 HB3 GLU A 92 2.119 14.469 16.996 1.00 0.00 H new ATOM 0 HG2 GLU A 92 1.988 15.463 14.625 1.00 0.00 H new ATOM 0 HG3 GLU A 92 0.249 15.523 14.831 1.00 0.00 H new ATOM 1354 N PHE A 93 2.312 11.390 17.182 1.00 0.00 N ATOM 1355 CA PHE A 93 3.284 10.535 17.862 1.00 0.00 C ATOM 1356 C PHE A 93 2.627 9.181 18.170 1.00 0.00 C ATOM 1357 O PHE A 93 1.585 9.119 18.834 1.00 0.00 O ATOM 1358 CB PHE A 93 3.773 11.202 19.159 1.00 0.00 C ATOM 1359 CG PHE A 93 4.996 12.090 18.993 1.00 0.00 C ATOM 1360 CD1 PHE A 93 4.869 13.397 18.478 1.00 0.00 C ATOM 1361 CD2 PHE A 93 6.273 11.610 19.353 1.00 0.00 C ATOM 1362 CE1 PHE A 93 6.008 14.203 18.291 1.00 0.00 C ATOM 1363 CE2 PHE A 93 7.412 12.418 19.182 1.00 0.00 C ATOM 1364 CZ PHE A 93 7.277 13.711 18.640 1.00 0.00 C ATOM 0 H PHE A 93 1.375 11.307 17.577 1.00 0.00 H new ATOM 0 HA PHE A 93 4.149 10.382 17.216 1.00 0.00 H new ATOM 0 HB2 PHE A 93 2.961 11.799 19.573 1.00 0.00 H new ATOM 0 HB3 PHE A 93 4.001 10.424 19.888 1.00 0.00 H new ATOM 0 HD1 PHE A 93 3.892 13.782 18.226 1.00 0.00 H new ATOM 0 HD2 PHE A 93 6.377 10.616 19.762 1.00 0.00 H new ATOM 0 HE1 PHE A 93 5.907 15.197 17.880 1.00 0.00 H new ATOM 0 HE2 PHE A 93 8.386 12.048 19.465 1.00 0.00 H new ATOM 0 HZ PHE A 93 8.152 14.326 18.492 1.00 0.00 H new ATOM 1373 N SER A 94 3.233 8.093 17.691 1.00 0.00 N ATOM 1374 CA SER A 94 2.786 6.730 17.987 1.00 0.00 C ATOM 1375 C SER A 94 3.444 6.212 19.282 1.00 0.00 C ATOM 1376 O SER A 94 4.669 6.332 19.417 1.00 0.00 O ATOM 1377 CB SER A 94 3.170 5.804 16.829 1.00 0.00 C ATOM 1378 OG SER A 94 2.550 4.565 17.078 1.00 0.00 O ATOM 0 H SER A 94 4.052 8.133 17.084 1.00 0.00 H new ATOM 0 HA SER A 94 1.704 6.741 18.117 1.00 0.00 H new ATOM 0 HB2 SER A 94 2.839 6.218 15.877 1.00 0.00 H new ATOM 0 HB3 SER A 94 4.252 5.690 16.768 1.00 0.00 H new ATOM 0 HG SER A 94 3.230 3.860 17.115 1.00 0.00 H new ATOM 1383 N PRO A 95 2.691 5.620 20.231 1.00 0.00 N ATOM 1384 CA PRO A 95 3.252 5.022 21.445 1.00 0.00 C ATOM 1385 C PRO A 95 3.984 3.688 21.189 1.00 0.00 C ATOM 1386 O PRO A 95 4.731 3.223 22.054 1.00 0.00 O ATOM 1387 CB PRO A 95 2.070 4.858 22.398 1.00 0.00 C ATOM 1388 CG PRO A 95 0.867 4.675 21.474 1.00 0.00 C ATOM 1389 CD PRO A 95 1.242 5.478 20.220 1.00 0.00 C ATOM 0 HA PRO A 95 4.027 5.662 21.866 1.00 0.00 H new ATOM 0 HB2 PRO A 95 2.203 3.997 23.054 1.00 0.00 H new ATOM 0 HB3 PRO A 95 1.951 5.732 23.039 1.00 0.00 H new ATOM 0 HG2 PRO A 95 0.699 3.624 21.240 1.00 0.00 H new ATOM 0 HG3 PRO A 95 -0.049 5.051 21.930 1.00 0.00 H new ATOM 0 HD2 PRO A 95 0.911 4.964 19.318 1.00 0.00 H new ATOM 0 HD3 PRO A 95 0.758 6.454 20.227 1.00 0.00 H new ATOM 1394 N ASN A 96 3.792 3.071 20.012 1.00 0.00 N ATOM 1395 CA ASN A 96 4.437 1.821 19.598 1.00 0.00 C ATOM 1396 C ASN A 96 4.650 1.819 18.076 1.00 0.00 C ATOM 1397 O ASN A 96 3.683 1.934 17.322 1.00 0.00 O ATOM 1398 CB ASN A 96 3.566 0.630 20.067 1.00 0.00 C ATOM 1399 CG ASN A 96 4.376 -0.478 20.714 1.00 0.00 C ATOM 1400 OD1 ASN A 96 5.014 -0.298 21.744 1.00 0.00 O ATOM 1401 ND2 ASN A 96 4.383 -1.666 20.151 1.00 0.00 N ATOM 0 H ASN A 96 3.162 3.443 19.301 1.00 0.00 H new ATOM 0 HA ASN A 96 5.420 1.728 20.059 1.00 0.00 H new ATOM 0 HB2 ASN A 96 2.821 0.989 20.776 1.00 0.00 H new ATOM 0 HB3 ASN A 96 3.024 0.225 19.213 1.00 0.00 H new ATOM 0 HD21 ASN A 96 4.916 -2.427 20.572 1.00 0.00 H new ATOM 0 HD22 ASN A 96 3.855 -1.827 19.293 1.00 0.00 H new ATOM 1407 N LEU A 97 5.905 1.670 17.632 1.00 0.00 N ATOM 1408 CA LEU A 97 6.364 1.758 16.232 1.00 0.00 C ATOM 1409 C LEU A 97 6.179 3.156 15.585 1.00 0.00 C ATOM 1410 O LEU A 97 5.069 3.600 15.310 1.00 0.00 O ATOM 1411 CB LEU A 97 5.719 0.643 15.364 1.00 0.00 C ATOM 1412 CG LEU A 97 6.663 -0.425 14.779 1.00 0.00 C ATOM 1413 CD1 LEU A 97 7.726 0.170 13.851 1.00 0.00 C ATOM 1414 CD2 LEU A 97 7.343 -1.237 15.882 1.00 0.00 C ATOM 0 H LEU A 97 6.674 1.474 18.273 1.00 0.00 H new ATOM 0 HA LEU A 97 7.442 1.600 16.267 1.00 0.00 H new ATOM 0 HB2 LEU A 97 4.968 0.136 15.969 1.00 0.00 H new ATOM 0 HB3 LEU A 97 5.193 1.120 14.537 1.00 0.00 H new ATOM 0 HG LEU A 97 6.032 -1.086 14.185 1.00 0.00 H new ATOM 0 HD11 LEU A 97 8.363 -0.628 13.468 1.00 0.00 H new ATOM 0 HD12 LEU A 97 7.239 0.677 13.018 1.00 0.00 H new ATOM 0 HD13 LEU A 97 8.334 0.885 14.405 1.00 0.00 H new ATOM 0 HD21 LEU A 97 8.001 -1.981 15.433 1.00 0.00 H new ATOM 0 HD22 LEU A 97 7.928 -0.571 16.517 1.00 0.00 H new ATOM 0 HD23 LEU A 97 6.585 -1.739 16.484 1.00 0.00 H new ATOM 1425 N TRP A 98 7.293 3.818 15.245 1.00 0.00 N ATOM 1426 CA TRP A 98 7.320 5.042 14.424 1.00 0.00 C ATOM 1427 C TRP A 98 6.914 4.820 12.935 1.00 0.00 C ATOM 1428 O TRP A 98 6.898 5.770 12.158 1.00 0.00 O ATOM 1429 CB TRP A 98 8.677 5.750 14.551 1.00 0.00 C ATOM 1430 CG TRP A 98 8.922 6.409 15.886 1.00 0.00 C ATOM 1431 CD1 TRP A 98 8.345 7.548 16.257 1.00 0.00 C ATOM 1432 CD2 TRP A 98 9.800 6.002 16.956 1.00 0.00 C ATOM 1433 NE1 TRP A 98 8.805 7.892 17.555 1.00 0.00 N ATOM 1434 CE2 TRP A 98 9.688 6.975 18.004 1.00 0.00 C ATOM 1435 CE3 TRP A 98 10.694 4.921 17.178 1.00 0.00 C ATOM 1436 CZ2 TRP A 98 10.433 6.862 19.220 1.00 0.00 C ATOM 1437 CZ3 TRP A 98 11.426 4.809 18.362 1.00 0.00 C ATOM 1438 CH2 TRP A 98 11.297 5.773 19.382 1.00 0.00 C ATOM 0 H TRP A 98 8.221 3.513 15.538 1.00 0.00 H new ATOM 0 HA TRP A 98 6.547 5.696 14.827 1.00 0.00 H new ATOM 0 HB2 TRP A 98 9.469 5.023 14.369 1.00 0.00 H new ATOM 0 HB3 TRP A 98 8.752 6.506 13.769 1.00 0.00 H new ATOM 0 HD1 TRP A 98 7.642 8.118 15.668 1.00 0.00 H new ATOM 0 HE1 TRP A 98 8.509 8.717 18.076 1.00 0.00 H new ATOM 0 HE3 TRP A 98 10.811 4.168 16.413 1.00 0.00 H new ATOM 0 HZ2 TRP A 98 10.331 7.603 19.999 1.00 0.00 H new ATOM 0 HZ3 TRP A 98 12.098 3.975 18.498 1.00 0.00 H new ATOM 0 HH2 TRP A 98 11.868 5.671 20.293 1.00 0.00 H new ATOM 1448 N GLY A 99 6.543 3.597 12.534 1.00 0.00 N ATOM 1449 CA GLY A 99 5.953 3.307 11.227 1.00 0.00 C ATOM 1450 C GLY A 99 4.649 4.089 10.957 1.00 0.00 C ATOM 1451 O GLY A 99 4.310 4.336 9.807 1.00 0.00 O ATOM 0 H GLY A 99 6.648 2.769 13.121 1.00 0.00 H new ATOM 0 HA2 GLY A 99 6.678 3.544 10.448 1.00 0.00 H new ATOM 0 HA3 GLY A 99 5.748 2.239 11.158 1.00 0.00 H new ATOM 1454 N LEU A 100 3.910 4.484 12.004 1.00 0.00 N ATOM 1455 CA LEU A 100 2.692 5.319 11.909 1.00 0.00 C ATOM 1456 C LEU A 100 2.979 6.829 12.010 1.00 0.00 C ATOM 1457 O LEU A 100 2.101 7.652 11.775 1.00 0.00 O ATOM 1458 CB LEU A 100 1.637 4.923 12.967 1.00 0.00 C ATOM 1459 CG LEU A 100 1.607 3.477 13.517 1.00 0.00 C ATOM 1460 CD1 LEU A 100 0.421 3.351 14.456 1.00 0.00 C ATOM 1461 CD2 LEU A 100 1.477 2.391 12.468 1.00 0.00 C ATOM 0 H LEU A 100 4.143 4.229 12.964 1.00 0.00 H new ATOM 0 HA LEU A 100 2.292 5.124 10.914 1.00 0.00 H new ATOM 0 HB2 LEU A 100 1.762 5.592 13.818 1.00 0.00 H new ATOM 0 HB3 LEU A 100 0.655 5.130 12.541 1.00 0.00 H new ATOM 0 HG LEU A 100 2.570 3.324 14.004 1.00 0.00 H new ATOM 0 HD11 LEU A 100 0.380 2.338 14.856 1.00 0.00 H new ATOM 0 HD12 LEU A 100 0.529 4.061 15.276 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -0.499 3.563 13.911 1.00 0.00 H new ATOM 0 HD21 LEU A 100 1.465 1.415 12.954 1.00 0.00 H new ATOM 0 HD22 LEU A 100 0.550 2.531 11.912 1.00 0.00 H new ATOM 0 HD23 LEU A 100 2.322 2.445 11.782 1.00 0.00 H new ATOM 1472 N GLU A 101 4.209 7.196 12.375 1.00 0.00 N ATOM 1473 CA GLU A 101 4.724 8.566 12.308 1.00 0.00 C ATOM 1474 C GLU A 101 5.274 8.865 10.893 1.00 0.00 C ATOM 1475 O GLU A 101 5.904 8.015 10.258 1.00 0.00 O ATOM 1476 CB GLU A 101 5.843 8.757 13.362 1.00 0.00 C ATOM 1477 CG GLU A 101 5.381 9.505 14.622 1.00 0.00 C ATOM 1478 CD GLU A 101 6.327 10.682 14.949 1.00 0.00 C ATOM 1479 OE1 GLU A 101 6.462 11.608 14.105 1.00 0.00 O ATOM 1480 OE2 GLU A 101 6.975 10.658 16.021 1.00 0.00 O ATOM 0 H GLU A 101 4.893 6.531 12.735 1.00 0.00 H new ATOM 0 HA GLU A 101 3.910 9.259 12.519 1.00 0.00 H new ATOM 0 HB2 GLU A 101 6.229 7.779 13.651 1.00 0.00 H new ATOM 0 HB3 GLU A 101 6.669 9.304 12.907 1.00 0.00 H new ATOM 0 HG2 GLU A 101 4.368 9.879 14.476 1.00 0.00 H new ATOM 0 HG3 GLU A 101 5.348 8.816 15.466 1.00 0.00 H new ATOM 1485 N PHE A 102 5.084 10.099 10.426 1.00 0.00 N ATOM 1486 CA PHE A 102 5.525 10.560 9.112 1.00 0.00 C ATOM 1487 C PHE A 102 6.178 11.941 9.228 1.00 0.00 C ATOM 1488 O PHE A 102 5.881 12.703 10.154 1.00 0.00 O ATOM 1489 CB PHE A 102 4.342 10.618 8.128 1.00 0.00 C ATOM 1490 CG PHE A 102 3.381 9.434 8.209 1.00 0.00 C ATOM 1491 CD1 PHE A 102 3.808 8.132 7.865 1.00 0.00 C ATOM 1492 CD2 PHE A 102 2.057 9.629 8.664 1.00 0.00 C ATOM 1493 CE1 PHE A 102 2.925 7.040 7.980 1.00 0.00 C ATOM 1494 CE2 PHE A 102 1.172 8.539 8.766 1.00 0.00 C ATOM 1495 CZ PHE A 102 1.610 7.247 8.430 1.00 0.00 C ATOM 0 H PHE A 102 4.608 10.822 10.965 1.00 0.00 H new ATOM 0 HA PHE A 102 6.258 9.850 8.729 1.00 0.00 H new ATOM 0 HB2 PHE A 102 3.782 11.535 8.309 1.00 0.00 H new ATOM 0 HB3 PHE A 102 4.735 10.680 7.113 1.00 0.00 H new ATOM 0 HD1 PHE A 102 4.816 7.973 7.512 1.00 0.00 H new ATOM 0 HD2 PHE A 102 1.723 10.620 8.935 1.00 0.00 H new ATOM 0 HE1 PHE A 102 3.258 6.045 7.723 1.00 0.00 H new ATOM 0 HE2 PHE A 102 0.158 8.696 9.102 1.00 0.00 H new ATOM 0 HZ PHE A 102 0.933 6.410 8.518 1.00 0.00 H new ATOM 1504 N GLN A 103 7.031 12.291 8.262 1.00 0.00 N ATOM 1505 CA GLN A 103 7.753 13.568 8.221 1.00 0.00 C ATOM 1506 C GLN A 103 7.341 14.378 6.984 1.00 0.00 C ATOM 1507 O GLN A 103 7.211 13.834 5.881 1.00 0.00 O ATOM 1508 CB GLN A 103 9.276 13.343 8.226 1.00 0.00 C ATOM 1509 CG GLN A 103 9.797 12.552 9.441 1.00 0.00 C ATOM 1510 CD GLN A 103 9.607 11.030 9.364 1.00 0.00 C ATOM 1511 OE1 GLN A 103 9.556 10.420 8.300 1.00 0.00 O ATOM 1512 NE2 GLN A 103 9.481 10.343 10.483 1.00 0.00 N ATOM 0 H GLN A 103 7.244 11.684 7.471 1.00 0.00 H new ATOM 0 HA GLN A 103 7.489 14.132 9.115 1.00 0.00 H new ATOM 0 HB2 GLN A 103 9.556 12.813 7.315 1.00 0.00 H new ATOM 0 HB3 GLN A 103 9.775 14.312 8.197 1.00 0.00 H new ATOM 0 HG2 GLN A 103 10.859 12.763 9.563 1.00 0.00 H new ATOM 0 HG3 GLN A 103 9.294 12.920 10.336 1.00 0.00 H new ATOM 0 HE21 GLN A 103 9.519 10.822 11.383 1.00 0.00 H new ATOM 0 HE22 GLN A 103 9.345 9.333 10.449 1.00 0.00 H new ATOM 1519 N LYS A 104 7.164 15.694 7.167 1.00 0.00 N ATOM 1520 CA LYS A 104 6.978 16.687 6.090 1.00 0.00 C ATOM 1521 C LYS A 104 8.269 16.920 5.289 1.00 0.00 C ATOM 1522 O LYS A 104 9.325 16.395 5.630 1.00 0.00 O ATOM 1523 CB LYS A 104 6.410 17.998 6.674 1.00 0.00 C ATOM 1524 CG LYS A 104 7.374 18.717 7.630 1.00 0.00 C ATOM 1525 CD LYS A 104 6.893 18.678 9.083 1.00 0.00 C ATOM 1526 CE LYS A 104 7.821 19.523 9.968 1.00 0.00 C ATOM 1527 NZ LYS A 104 7.096 20.158 11.091 1.00 0.00 N ATOM 0 H LYS A 104 7.145 16.114 8.096 1.00 0.00 H new ATOM 0 HA LYS A 104 6.254 16.289 5.379 1.00 0.00 H new ATOM 0 HB2 LYS A 104 6.156 18.670 5.855 1.00 0.00 H new ATOM 0 HB3 LYS A 104 5.483 17.778 7.204 1.00 0.00 H new ATOM 0 HG2 LYS A 104 8.359 18.255 7.564 1.00 0.00 H new ATOM 0 HG3 LYS A 104 7.487 19.754 7.315 1.00 0.00 H new ATOM 0 HD2 LYS A 104 5.873 19.056 9.147 1.00 0.00 H new ATOM 0 HD3 LYS A 104 6.874 17.649 9.441 1.00 0.00 H new ATOM 0 HE2 LYS A 104 8.618 18.892 10.362 1.00 0.00 H new ATOM 0 HE3 LYS A 104 8.296 20.294 9.362 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 7.761 20.718 11.661 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 6.352 20.781 10.716 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 6.664 19.422 11.686 1.00 0.00 H new ATOM 1537 N ASN A 105 8.177 17.709 4.222 1.00 0.00 N ATOM 1538 CA ASN A 105 9.264 17.885 3.235 1.00 0.00 C ATOM 1539 C ASN A 105 9.795 16.554 2.677 1.00 0.00 C ATOM 1540 O ASN A 105 10.969 16.432 2.311 1.00 0.00 O ATOM 1541 CB ASN A 105 10.355 18.830 3.808 1.00 0.00 C ATOM 1542 CG ASN A 105 9.929 20.275 3.783 1.00 0.00 C ATOM 1543 OD1 ASN A 105 9.198 20.754 4.637 1.00 0.00 O ATOM 1544 ND2 ASN A 105 10.357 21.022 2.790 1.00 0.00 N ATOM 0 H ASN A 105 7.342 18.254 4.007 1.00 0.00 H new ATOM 0 HA ASN A 105 8.854 18.377 2.353 1.00 0.00 H new ATOM 0 HB2 ASN A 105 10.583 18.538 4.833 1.00 0.00 H new ATOM 0 HB3 ASN A 105 11.273 18.714 3.231 1.00 0.00 H new ATOM 0 HD21 ASN A 105 10.079 22.002 2.732 1.00 0.00 H new ATOM 0 HD22 ASN A 105 10.967 20.622 2.077 1.00 0.00 H new ATOM 1550 N LYS A 106 8.929 15.525 2.615 1.00 0.00 N ATOM 1551 CA LYS A 106 9.282 14.148 2.282 1.00 0.00 C ATOM 1552 C LYS A 106 8.084 13.441 1.646 1.00 0.00 C ATOM 1553 O LYS A 106 6.941 13.615 2.055 1.00 0.00 O ATOM 1554 CB LYS A 106 9.761 13.434 3.559 1.00 0.00 C ATOM 1555 CG LYS A 106 10.996 12.540 3.362 1.00 0.00 C ATOM 1556 CD LYS A 106 10.678 11.141 2.811 1.00 0.00 C ATOM 1557 CE LYS A 106 11.544 10.075 3.509 1.00 0.00 C ATOM 1558 NZ LYS A 106 10.794 8.834 3.788 1.00 0.00 N ATOM 0 H LYS A 106 7.933 15.642 2.803 1.00 0.00 H new ATOM 0 HA LYS A 106 10.092 14.129 1.553 1.00 0.00 H new ATOM 0 HB2 LYS A 106 9.988 14.184 4.317 1.00 0.00 H new ATOM 0 HB3 LYS A 106 8.945 12.825 3.948 1.00 0.00 H new ATOM 0 HG2 LYS A 106 11.687 13.038 2.682 1.00 0.00 H new ATOM 0 HG3 LYS A 106 11.510 12.434 4.317 1.00 0.00 H new ATOM 0 HD2 LYS A 106 9.622 10.916 2.962 1.00 0.00 H new ATOM 0 HD3 LYS A 106 10.858 11.118 1.736 1.00 0.00 H new ATOM 0 HE2 LYS A 106 12.405 9.843 2.882 1.00 0.00 H new ATOM 0 HE3 LYS A 106 11.931 10.480 4.444 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 11.419 8.149 4.258 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 9.987 9.048 4.408 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 10.446 8.430 2.895 1.00 0.00 H new ATOM 1568 N ASP A 107 8.384 12.647 0.635 1.00 0.00 N ATOM 1569 CA ASP A 107 7.449 11.959 -0.253 1.00 0.00 C ATOM 1570 C ASP A 107 7.689 10.447 -0.112 1.00 0.00 C ATOM 1571 O ASP A 107 8.775 9.996 0.275 1.00 0.00 O ATOM 1572 CB ASP A 107 7.665 12.560 -1.659 1.00 0.00 C ATOM 1573 CG ASP A 107 7.492 11.577 -2.828 1.00 0.00 C ATOM 1574 OD1 ASP A 107 8.353 10.692 -2.998 1.00 0.00 O ATOM 1575 OD2 ASP A 107 6.525 11.757 -3.610 1.00 0.00 O ATOM 0 H ASP A 107 9.354 12.448 0.391 1.00 0.00 H new ATOM 0 HA ASP A 107 6.394 12.098 -0.015 1.00 0.00 H new ATOM 0 HB2 ASP A 107 6.967 13.386 -1.794 1.00 0.00 H new ATOM 0 HB3 ASP A 107 8.669 12.981 -1.706 1.00 0.00 H new ATOM 1579 N TYR A 108 6.655 9.654 -0.384 1.00 0.00 N ATOM 1580 CA TYR A 108 6.672 8.194 -0.278 1.00 0.00 C ATOM 1581 C TYR A 108 6.025 7.585 -1.521 1.00 0.00 C ATOM 1582 O TYR A 108 5.068 8.132 -2.074 1.00 0.00 O ATOM 1583 CB TYR A 108 5.942 7.745 1.006 1.00 0.00 C ATOM 1584 CG TYR A 108 6.729 6.791 1.886 1.00 0.00 C ATOM 1585 CD1 TYR A 108 6.825 5.417 1.558 1.00 0.00 C ATOM 1586 CD2 TYR A 108 7.330 7.263 3.078 1.00 0.00 C ATOM 1587 CE1 TYR A 108 7.521 4.540 2.405 1.00 0.00 C ATOM 1588 CE2 TYR A 108 8.028 6.385 3.921 1.00 0.00 C ATOM 1589 CZ TYR A 108 8.135 5.014 3.586 1.00 0.00 C ATOM 1590 OH TYR A 108 8.796 4.143 4.388 1.00 0.00 O ATOM 0 H TYR A 108 5.754 10.019 -0.694 1.00 0.00 H new ATOM 0 HA TYR A 108 7.703 7.845 -0.216 1.00 0.00 H new ATOM 0 HB2 TYR A 108 5.687 8.629 1.590 1.00 0.00 H new ATOM 0 HB3 TYR A 108 5.003 7.267 0.725 1.00 0.00 H new ATOM 0 HD1 TYR A 108 6.363 5.044 0.656 1.00 0.00 H new ATOM 0 HD2 TYR A 108 7.250 8.308 3.341 1.00 0.00 H new ATOM 0 HE1 TYR A 108 7.588 3.492 2.151 1.00 0.00 H new ATOM 0 HE2 TYR A 108 8.484 6.756 4.827 1.00 0.00 H new ATOM 0 HH TYR A 108 9.164 4.623 5.159 1.00 0.00 H new ATOM 1599 N TYR A 109 6.526 6.423 -1.922 1.00 0.00 N ATOM 1600 CA TYR A 109 5.982 5.628 -3.018 1.00 0.00 C ATOM 1601 C TYR A 109 5.866 4.163 -2.590 1.00 0.00 C ATOM 1602 O TYR A 109 6.717 3.624 -1.871 1.00 0.00 O ATOM 1603 CB TYR A 109 6.833 5.807 -4.290 1.00 0.00 C ATOM 1604 CG TYR A 109 6.465 6.983 -5.161 1.00 0.00 C ATOM 1605 CD1 TYR A 109 7.046 8.247 -4.921 1.00 0.00 C ATOM 1606 CD2 TYR A 109 5.609 6.806 -6.273 1.00 0.00 C ATOM 1607 CE1 TYR A 109 6.773 9.321 -5.777 1.00 0.00 C ATOM 1608 CE2 TYR A 109 5.351 7.876 -7.140 1.00 0.00 C ATOM 1609 CZ TYR A 109 5.924 9.151 -6.888 1.00 0.00 C ATOM 1610 OH TYR A 109 5.697 10.200 -7.718 1.00 0.00 O ATOM 0 H TYR A 109 7.342 5.996 -1.484 1.00 0.00 H new ATOM 0 HA TYR A 109 4.979 5.978 -3.260 1.00 0.00 H new ATOM 0 HB2 TYR A 109 7.877 5.909 -3.995 1.00 0.00 H new ATOM 0 HB3 TYR A 109 6.757 4.898 -4.887 1.00 0.00 H new ATOM 0 HD1 TYR A 109 7.703 8.386 -4.075 1.00 0.00 H new ATOM 0 HD2 TYR A 109 5.153 5.844 -6.454 1.00 0.00 H new ATOM 0 HE1 TYR A 109 7.217 10.287 -5.584 1.00 0.00 H new ATOM 0 HE2 TYR A 109 4.716 7.731 -8.001 1.00 0.00 H new ATOM 0 HH TYR A 109 5.091 9.923 -8.437 1.00 0.00 H new ATOM 1619 N ILE A 110 4.784 3.519 -3.022 1.00 0.00 N ATOM 1620 CA ILE A 110 4.439 2.118 -2.742 1.00 0.00 C ATOM 1621 C ILE A 110 3.944 1.504 -4.052 1.00 0.00 C ATOM 1622 O ILE A 110 3.440 2.220 -4.908 1.00 0.00 O ATOM 1623 CB ILE A 110 3.394 2.033 -1.607 1.00 0.00 C ATOM 1624 CG1 ILE A 110 3.937 2.632 -0.285 1.00 0.00 C ATOM 1625 CG2 ILE A 110 2.902 0.601 -1.383 1.00 0.00 C ATOM 1626 CD1 ILE A 110 3.010 2.460 0.927 1.00 0.00 C ATOM 0 H ILE A 110 4.086 3.979 -3.607 1.00 0.00 H new ATOM 0 HA ILE A 110 5.304 1.557 -2.389 1.00 0.00 H new ATOM 0 HB ILE A 110 2.541 2.631 -1.927 1.00 0.00 H new ATOM 0 HG12 ILE A 110 4.897 2.168 -0.059 1.00 0.00 H new ATOM 0 HG13 ILE A 110 4.124 3.695 -0.434 1.00 0.00 H new ATOM 0 HG21 ILE A 110 2.169 0.590 -0.576 1.00 0.00 H new ATOM 0 HG22 ILE A 110 2.441 0.228 -2.297 1.00 0.00 H new ATOM 0 HG23 ILE A 110 3.745 -0.036 -1.116 1.00 0.00 H new ATOM 0 HD11 ILE A 110 3.473 2.910 1.806 1.00 0.00 H new ATOM 0 HD12 ILE A 110 2.057 2.950 0.728 1.00 0.00 H new ATOM 0 HD13 ILE A 110 2.842 1.398 1.109 1.00 0.00 H new ATOM 1637 N ILE A 111 4.077 0.192 -4.219 1.00 0.00 N ATOM 1638 CA ILE A 111 3.736 -0.585 -5.416 1.00 0.00 C ATOM 1639 C ILE A 111 3.279 -2.002 -5.026 1.00 0.00 C ATOM 1640 O ILE A 111 3.731 -2.573 -4.033 1.00 0.00 O ATOM 1641 CB ILE A 111 4.959 -0.591 -6.378 1.00 0.00 C ATOM 1642 CG1 ILE A 111 4.733 -1.529 -7.580 1.00 0.00 C ATOM 1643 CG2 ILE A 111 6.263 -0.908 -5.613 1.00 0.00 C ATOM 1644 CD1 ILE A 111 5.734 -1.379 -8.743 1.00 0.00 C ATOM 0 H ILE A 111 4.450 -0.399 -3.476 1.00 0.00 H new ATOM 0 HA ILE A 111 2.898 -0.126 -5.940 1.00 0.00 H new ATOM 0 HB ILE A 111 5.068 0.412 -6.791 1.00 0.00 H new ATOM 0 HG12 ILE A 111 4.768 -2.559 -7.225 1.00 0.00 H new ATOM 0 HG13 ILE A 111 3.728 -1.359 -7.966 1.00 0.00 H new ATOM 0 HG21 ILE A 111 7.102 -0.906 -6.308 1.00 0.00 H new ATOM 0 HG22 ILE A 111 6.427 -0.153 -4.844 1.00 0.00 H new ATOM 0 HG23 ILE A 111 6.181 -1.889 -5.146 1.00 0.00 H new ATOM 0 HD11 ILE A 111 5.482 -2.086 -9.534 1.00 0.00 H new ATOM 0 HD12 ILE A 111 5.686 -0.363 -9.135 1.00 0.00 H new ATOM 0 HD13 ILE A 111 6.743 -1.582 -8.383 1.00 0.00 H new ATOM 1655 N SER A 112 2.384 -2.583 -5.833 1.00 0.00 N ATOM 1656 CA SER A 112 1.860 -3.947 -5.686 1.00 0.00 C ATOM 1657 C SER A 112 2.042 -4.761 -6.963 1.00 0.00 C ATOM 1658 O SER A 112 1.852 -4.255 -8.076 1.00 0.00 O ATOM 1659 CB SER A 112 0.374 -3.889 -5.325 1.00 0.00 C ATOM 1660 OG SER A 112 -0.028 -5.131 -4.794 1.00 0.00 O ATOM 0 H SER A 112 1.989 -2.097 -6.638 1.00 0.00 H new ATOM 0 HA SER A 112 2.421 -4.438 -4.891 1.00 0.00 H new ATOM 0 HB2 SER A 112 0.196 -3.096 -4.599 1.00 0.00 H new ATOM 0 HB3 SER A 112 -0.217 -3.651 -6.209 1.00 0.00 H new ATOM 0 HG SER A 112 0.616 -5.420 -4.114 1.00 0.00 H new ATOM 1665 N THR A 113 2.415 -6.038 -6.820 1.00 0.00 N ATOM 1666 CA THR A 113 2.790 -6.933 -7.947 1.00 0.00 C ATOM 1667 C THR A 113 2.204 -8.351 -7.853 1.00 0.00 C ATOM 1668 O THR A 113 2.717 -9.297 -8.462 1.00 0.00 O ATOM 1669 CB THR A 113 4.319 -6.931 -8.187 1.00 0.00 C ATOM 1670 OG1 THR A 113 5.013 -7.157 -6.982 1.00 0.00 O ATOM 1671 CG2 THR A 113 4.803 -5.599 -8.764 1.00 0.00 C ATOM 0 H THR A 113 2.469 -6.495 -5.910 1.00 0.00 H new ATOM 0 HA THR A 113 2.317 -6.507 -8.832 1.00 0.00 H new ATOM 0 HB THR A 113 4.521 -7.730 -8.901 1.00 0.00 H new ATOM 0 HG1 THR A 113 5.978 -7.154 -7.155 1.00 0.00 H new ATOM 0 HG21 THR A 113 5.881 -5.639 -8.918 1.00 0.00 H new ATOM 0 HG22 THR A 113 4.307 -5.414 -9.717 1.00 0.00 H new ATOM 0 HG23 THR A 113 4.565 -4.794 -8.069 1.00 0.00 H new ATOM 1679 N SER A 114 1.083 -8.481 -7.138 1.00 0.00 N ATOM 1680 CA SER A 114 0.339 -9.733 -6.884 1.00 0.00 C ATOM 1681 C SER A 114 -0.187 -10.479 -8.128 1.00 0.00 C ATOM 1682 O SER A 114 -0.317 -11.702 -8.085 1.00 0.00 O ATOM 1683 CB SER A 114 -0.858 -9.408 -5.966 1.00 0.00 C ATOM 1684 OG SER A 114 -1.584 -8.346 -6.554 1.00 0.00 O ATOM 0 H SER A 114 0.640 -7.676 -6.694 1.00 0.00 H new ATOM 0 HA SER A 114 1.063 -10.411 -6.432 1.00 0.00 H new ATOM 0 HB2 SER A 114 -1.495 -10.284 -5.846 1.00 0.00 H new ATOM 0 HB3 SER A 114 -0.511 -9.128 -4.972 1.00 0.00 H new ATOM 0 HG SER A 114 -2.364 -8.136 -5.999 1.00 0.00 H new ATOM 1689 N ASN A 115 -0.452 -9.786 -9.250 1.00 0.00 N ATOM 1690 CA ASN A 115 -0.808 -10.411 -10.534 1.00 0.00 C ATOM 1691 C ASN A 115 0.327 -11.314 -11.078 1.00 0.00 C ATOM 1692 O ASN A 115 0.061 -12.265 -11.814 1.00 0.00 O ATOM 1693 CB ASN A 115 -1.234 -9.316 -11.551 1.00 0.00 C ATOM 1694 CG ASN A 115 -1.628 -9.869 -12.910 1.00 0.00 C ATOM 1695 OD1 ASN A 115 -0.793 -10.054 -13.783 1.00 0.00 O ATOM 1696 ND2 ASN A 115 -2.896 -10.126 -13.143 1.00 0.00 N ATOM 0 H ASN A 115 -0.424 -8.767 -9.290 1.00 0.00 H new ATOM 0 HA ASN A 115 -1.658 -11.074 -10.372 1.00 0.00 H new ATOM 0 HB2 ASN A 115 -2.073 -8.756 -11.139 1.00 0.00 H new ATOM 0 HB3 ASN A 115 -0.412 -8.611 -11.679 1.00 0.00 H new ATOM 0 HD21 ASN A 115 -3.185 -10.481 -14.054 1.00 0.00 H new ATOM 0 HD22 ASN A 115 -3.591 -9.971 -12.412 1.00 0.00 H new ATOM 1702 N GLY A 116 1.587 -11.043 -10.689 1.00 0.00 N ATOM 1703 CA GLY A 116 2.778 -11.829 -11.039 1.00 0.00 C ATOM 1704 C GLY A 116 2.901 -12.051 -12.560 1.00 0.00 C ATOM 1705 O GLY A 116 2.991 -13.205 -12.994 1.00 0.00 O ATOM 0 H GLY A 116 1.808 -10.240 -10.100 1.00 0.00 H new ATOM 0 HA2 GLY A 116 3.669 -11.318 -10.675 1.00 0.00 H new ATOM 0 HA3 GLY A 116 2.736 -12.794 -10.535 1.00 0.00 H new ATOM 1784 N ASN A 123 9.154 -12.812 -9.814 1.00 0.00 N ATOM 1785 CA ASN A 123 8.517 -12.060 -8.740 1.00 0.00 C ATOM 1786 C ASN A 123 9.107 -10.645 -8.622 1.00 0.00 C ATOM 1787 O ASN A 123 10.118 -10.328 -9.243 1.00 0.00 O ATOM 1788 CB ASN A 123 8.539 -12.848 -7.408 1.00 0.00 C ATOM 1789 CG ASN A 123 8.277 -14.338 -7.561 1.00 0.00 C ATOM 1790 OD1 ASN A 123 7.153 -14.772 -7.785 1.00 0.00 O ATOM 1791 ND2 ASN A 123 9.304 -15.152 -7.426 1.00 0.00 N ATOM 0 HA ASN A 123 7.465 -11.928 -8.993 1.00 0.00 H new ATOM 0 HB2 ASN A 123 9.510 -12.708 -6.932 1.00 0.00 H new ATOM 0 HB3 ASN A 123 7.791 -12.426 -6.737 1.00 0.00 H new ATOM 0 HD21 ASN A 123 9.170 -16.160 -7.508 1.00 0.00 H new ATOM 0 HD22 ASN A 123 10.233 -14.774 -7.240 1.00 0.00 H new ATOM 1797 N GLN A 124 8.475 -9.789 -7.810 1.00 0.00 N ATOM 1798 CA GLN A 124 8.920 -8.402 -7.573 1.00 0.00 C ATOM 1799 C GLN A 124 9.066 -7.556 -8.861 1.00 0.00 C ATOM 1800 O GLN A 124 9.768 -6.546 -8.868 1.00 0.00 O ATOM 1801 CB GLN A 124 10.214 -8.414 -6.739 1.00 0.00 C ATOM 1802 CG GLN A 124 10.041 -9.013 -5.327 1.00 0.00 C ATOM 1803 CD GLN A 124 10.744 -10.358 -5.142 1.00 0.00 C ATOM 1804 OE1 GLN A 124 11.911 -10.541 -5.469 1.00 0.00 O ATOM 1805 NE2 GLN A 124 10.081 -11.357 -4.595 1.00 0.00 N ATOM 0 H GLN A 124 7.632 -10.038 -7.292 1.00 0.00 H new ATOM 0 HA GLN A 124 8.131 -7.902 -7.011 1.00 0.00 H new ATOM 0 HB2 GLN A 124 10.974 -8.983 -7.274 1.00 0.00 H new ATOM 0 HB3 GLN A 124 10.585 -7.393 -6.647 1.00 0.00 H new ATOM 0 HG2 GLN A 124 10.427 -8.307 -4.592 1.00 0.00 H new ATOM 0 HG3 GLN A 124 8.978 -9.137 -5.122 1.00 0.00 H new ATOM 0 HE21 GLN A 124 9.109 -11.231 -4.314 1.00 0.00 H new ATOM 0 HE22 GLN A 124 10.540 -12.257 -4.453 1.00 0.00 H new ATOM 1812 N GLU A 125 8.414 -7.929 -9.971 1.00 0.00 N ATOM 1813 CA GLU A 125 8.528 -7.257 -11.277 1.00 0.00 C ATOM 1814 C GLU A 125 7.210 -7.379 -12.065 1.00 0.00 C ATOM 1815 O GLU A 125 6.425 -8.295 -11.821 1.00 0.00 O ATOM 1816 CB GLU A 125 9.680 -7.876 -12.100 1.00 0.00 C ATOM 1817 CG GLU A 125 11.086 -7.743 -11.468 1.00 0.00 C ATOM 1818 CD GLU A 125 12.231 -8.257 -12.369 1.00 0.00 C ATOM 1819 OE1 GLU A 125 12.017 -8.568 -13.567 1.00 0.00 O ATOM 1820 OE2 GLU A 125 13.380 -8.358 -11.872 1.00 0.00 O ATOM 0 H GLU A 125 7.777 -8.725 -9.988 1.00 0.00 H new ATOM 0 HA GLU A 125 8.739 -6.203 -11.099 1.00 0.00 H new ATOM 0 HB2 GLU A 125 9.467 -8.934 -12.255 1.00 0.00 H new ATOM 0 HB3 GLU A 125 9.695 -7.407 -13.084 1.00 0.00 H new ATOM 0 HG2 GLU A 125 11.268 -6.695 -11.229 1.00 0.00 H new ATOM 0 HG3 GLU A 125 11.104 -8.292 -10.527 1.00 0.00 H new ATOM 1825 N GLY A 126 6.977 -6.462 -13.011 1.00 0.00 N ATOM 1826 CA GLY A 126 5.767 -6.306 -13.837 1.00 0.00 C ATOM 1827 C GLY A 126 4.489 -6.119 -13.020 1.00 0.00 C ATOM 1828 O GLY A 126 4.004 -5.006 -12.859 1.00 0.00 O ATOM 0 H GLY A 126 7.678 -5.757 -13.238 1.00 0.00 H new ATOM 0 HA2 GLY A 126 5.896 -5.448 -14.497 1.00 0.00 H new ATOM 0 HA3 GLY A 126 5.656 -7.184 -14.474 1.00 0.00 H new ATOM 1831 N GLY A 127 3.959 -7.215 -12.471 1.00 0.00 N ATOM 1832 CA GLY A 127 2.759 -7.291 -11.644 1.00 0.00 C ATOM 1833 C GLY A 127 1.548 -6.492 -12.134 1.00 0.00 C ATOM 1834 O GLY A 127 1.387 -6.200 -13.313 1.00 0.00 O ATOM 0 H GLY A 127 4.387 -8.131 -12.603 1.00 0.00 H new ATOM 0 HA2 GLY A 127 2.467 -8.338 -11.559 1.00 0.00 H new ATOM 0 HA3 GLY A 127 3.012 -6.948 -10.641 1.00 0.00 H new ATOM 1837 N VAL A 128 0.659 -6.138 -11.202 1.00 0.00 N ATOM 1838 CA VAL A 128 -0.510 -5.303 -11.524 1.00 0.00 C ATOM 1839 C VAL A 128 -0.061 -3.928 -12.055 1.00 0.00 C ATOM 1840 O VAL A 128 -0.696 -3.365 -12.941 1.00 0.00 O ATOM 1841 CB VAL A 128 -1.558 -5.236 -10.385 1.00 0.00 C ATOM 1842 CG1 VAL A 128 -1.434 -6.347 -9.320 1.00 0.00 C ATOM 1843 CG2 VAL A 128 -1.510 -3.935 -9.599 1.00 0.00 C ATOM 0 H VAL A 128 0.722 -6.413 -10.222 1.00 0.00 H new ATOM 0 HA VAL A 128 -1.053 -5.792 -12.333 1.00 0.00 H new ATOM 0 HB VAL A 128 -2.489 -5.345 -10.942 1.00 0.00 H new ATOM 0 HG11 VAL A 128 -2.210 -6.216 -8.566 1.00 0.00 H new ATOM 0 HG12 VAL A 128 -1.551 -7.321 -9.795 1.00 0.00 H new ATOM 0 HG13 VAL A 128 -0.454 -6.289 -8.847 1.00 0.00 H new ATOM 0 HG21 VAL A 128 -2.269 -3.954 -8.817 1.00 0.00 H new ATOM 0 HG22 VAL A 128 -0.525 -3.820 -9.146 1.00 0.00 H new ATOM 0 HG23 VAL A 128 -1.701 -3.097 -10.270 1.00 0.00 H new ATOM 1853 N CYS A 129 1.074 -3.394 -11.578 1.00 0.00 N ATOM 1854 CA CYS A 129 1.657 -2.134 -12.031 1.00 0.00 C ATOM 1855 C CYS A 129 1.700 -1.979 -13.577 1.00 0.00 C ATOM 1856 O CYS A 129 1.434 -0.892 -14.089 1.00 0.00 O ATOM 1857 CB CYS A 129 3.049 -1.979 -11.427 1.00 0.00 C ATOM 1858 SG CYS A 129 3.983 -0.562 -12.056 1.00 0.00 S ATOM 0 H CYS A 129 1.623 -3.844 -10.846 1.00 0.00 H new ATOM 0 HA CYS A 129 1.003 -1.335 -11.682 1.00 0.00 H new ATOM 0 HB2 CYS A 129 2.954 -1.885 -10.345 1.00 0.00 H new ATOM 0 HB3 CYS A 129 3.619 -2.888 -11.619 1.00 0.00 H new ATOM 1862 N GLN A 130 1.966 -3.071 -14.301 1.00 0.00 N ATOM 1863 CA GLN A 130 2.054 -3.131 -15.753 1.00 0.00 C ATOM 1864 C GLN A 130 0.824 -2.548 -16.499 1.00 0.00 C ATOM 1865 O GLN A 130 0.966 -2.051 -17.616 1.00 0.00 O ATOM 1866 CB GLN A 130 2.284 -4.597 -16.144 1.00 0.00 C ATOM 1867 CG GLN A 130 2.739 -4.792 -17.601 1.00 0.00 C ATOM 1868 CD GLN A 130 2.953 -6.262 -17.964 1.00 0.00 C ATOM 1869 OE1 GLN A 130 2.215 -7.150 -17.553 1.00 0.00 O ATOM 1870 NE2 GLN A 130 3.964 -6.589 -18.737 1.00 0.00 N ATOM 0 H GLN A 130 2.133 -3.977 -13.864 1.00 0.00 H new ATOM 0 HA GLN A 130 2.884 -2.495 -16.062 1.00 0.00 H new ATOM 0 HB2 GLN A 130 3.034 -5.026 -15.479 1.00 0.00 H new ATOM 0 HB3 GLN A 130 1.361 -5.154 -15.985 1.00 0.00 H new ATOM 0 HG2 GLN A 130 1.994 -4.362 -18.270 1.00 0.00 H new ATOM 0 HG3 GLN A 130 3.667 -4.244 -17.763 1.00 0.00 H new ATOM 0 HE21 GLN A 130 4.591 -5.866 -19.090 1.00 0.00 H new ATOM 0 HE22 GLN A 130 4.122 -7.566 -18.984 1.00 0.00 H new ATOM 1877 N THR A 131 -0.369 -2.590 -15.894 1.00 0.00 N ATOM 1878 CA THR A 131 -1.623 -2.105 -16.506 1.00 0.00 C ATOM 1879 C THR A 131 -2.677 -1.592 -15.505 1.00 0.00 C ATOM 1880 O THR A 131 -3.179 -0.476 -15.658 1.00 0.00 O ATOM 1881 CB THR A 131 -2.227 -3.171 -17.451 1.00 0.00 C ATOM 1882 OG1 THR A 131 -3.500 -2.789 -17.914 1.00 0.00 O ATOM 1883 CG2 THR A 131 -2.341 -4.567 -16.843 1.00 0.00 C ATOM 0 H THR A 131 -0.498 -2.965 -14.954 1.00 0.00 H new ATOM 0 HA THR A 131 -1.335 -1.228 -17.086 1.00 0.00 H new ATOM 0 HB THR A 131 -1.514 -3.227 -18.274 1.00 0.00 H new ATOM 0 HG1 THR A 131 -3.853 -3.483 -18.509 1.00 0.00 H new ATOM 0 HG21 THR A 131 -2.774 -5.248 -17.575 1.00 0.00 H new ATOM 0 HG22 THR A 131 -1.350 -4.922 -16.558 1.00 0.00 H new ATOM 0 HG23 THR A 131 -2.980 -4.529 -15.961 1.00 0.00 H new ATOM 1891 N ARG A 132 -2.945 -2.337 -14.420 1.00 0.00 N ATOM 1892 CA ARG A 132 -3.740 -1.890 -13.253 1.00 0.00 C ATOM 1893 C ARG A 132 -3.110 -0.687 -12.536 1.00 0.00 C ATOM 1894 O ARG A 132 -3.819 0.073 -11.878 1.00 0.00 O ATOM 1895 CB ARG A 132 -3.875 -3.042 -12.253 1.00 0.00 C ATOM 1896 CG ARG A 132 -4.969 -4.071 -12.567 1.00 0.00 C ATOM 1897 CD ARG A 132 -6.327 -3.710 -11.931 1.00 0.00 C ATOM 1898 NE ARG A 132 -6.892 -4.849 -11.186 1.00 0.00 N ATOM 1899 CZ ARG A 132 -7.293 -6.011 -11.678 1.00 0.00 C ATOM 1900 NH1 ARG A 132 -7.311 -6.257 -12.958 1.00 0.00 N ATOM 1901 NH2 ARG A 132 -7.678 -6.966 -10.881 1.00 0.00 N ATOM 0 H ARG A 132 -2.607 -3.295 -14.323 1.00 0.00 H new ATOM 0 HA ARG A 132 -4.715 -1.583 -13.630 1.00 0.00 H new ATOM 0 HB2 ARG A 132 -2.919 -3.562 -12.195 1.00 0.00 H new ATOM 0 HB3 ARG A 132 -4.070 -2.621 -11.266 1.00 0.00 H new ATOM 0 HG2 ARG A 132 -5.088 -4.150 -13.648 1.00 0.00 H new ATOM 0 HG3 ARG A 132 -4.654 -5.051 -12.209 1.00 0.00 H new ATOM 0 HD2 ARG A 132 -6.202 -2.861 -11.260 1.00 0.00 H new ATOM 0 HD3 ARG A 132 -7.024 -3.401 -12.710 1.00 0.00 H new ATOM 0 HE ARG A 132 -6.985 -4.729 -10.177 1.00 0.00 H new ATOM 0 HH11 ARG A 132 -7.009 -5.541 -13.619 1.00 0.00 H new ATOM 0 HH12 ARG A 132 -7.627 -7.165 -13.298 1.00 0.00 H new ATOM 0 HH21 ARG A 132 -7.672 -6.821 -9.871 1.00 0.00 H new ATOM 0 HH22 ARG A 132 -7.986 -7.859 -11.266 1.00 0.00 H new ATOM 1912 N ALA A 133 -1.784 -0.517 -12.663 1.00 0.00 N ATOM 1913 CA ALA A 133 -1.002 0.605 -12.139 1.00 0.00 C ATOM 1914 C ALA A 133 -1.145 0.822 -10.606 1.00 0.00 C ATOM 1915 O ALA A 133 -1.172 1.979 -10.154 1.00 0.00 O ATOM 1916 CB ALA A 133 -1.287 1.844 -13.013 1.00 0.00 C ATOM 0 H ALA A 133 -1.204 -1.194 -13.159 1.00 0.00 H new ATOM 0 HA ALA A 133 0.060 0.374 -12.220 1.00 0.00 H new ATOM 0 HB1 ALA A 133 -0.714 2.692 -12.639 1.00 0.00 H new ATOM 0 HB2 ALA A 133 -0.999 1.637 -14.043 1.00 0.00 H new ATOM 0 HB3 ALA A 133 -2.351 2.080 -12.974 1.00 0.00 H new ATOM 1922 N MET A 134 -1.225 -0.266 -9.805 1.00 0.00 N ATOM 1923 CA MET A 134 -1.379 -0.147 -8.346 1.00 0.00 C ATOM 1924 C MET A 134 -0.092 0.346 -7.678 1.00 0.00 C ATOM 1925 O MET A 134 0.762 -0.442 -7.254 1.00 0.00 O ATOM 1926 CB MET A 134 -1.859 -1.444 -7.702 1.00 0.00 C ATOM 1927 CG MET A 134 -2.187 -1.290 -6.216 1.00 0.00 C ATOM 1928 SD MET A 134 -3.483 -2.418 -5.622 1.00 0.00 S ATOM 1929 CE MET A 134 -4.925 -1.539 -6.290 1.00 0.00 C ATOM 0 H MET A 134 -1.185 -1.226 -10.146 1.00 0.00 H new ATOM 0 HA MET A 134 -2.154 0.602 -8.183 1.00 0.00 H new ATOM 0 HB2 MET A 134 -2.745 -1.798 -8.229 1.00 0.00 H new ATOM 0 HB3 MET A 134 -1.091 -2.208 -7.821 1.00 0.00 H new ATOM 0 HG2 MET A 134 -1.280 -1.458 -5.635 1.00 0.00 H new ATOM 0 HG3 MET A 134 -2.500 -0.263 -6.028 1.00 0.00 H new ATOM 0 HE1 MET A 134 -5.629 -1.331 -5.485 1.00 0.00 H new ATOM 0 HE2 MET A 134 -4.602 -0.601 -6.742 1.00 0.00 H new ATOM 0 HE3 MET A 134 -5.410 -2.157 -7.045 1.00 0.00 H new ATOM 1937 N LYS A 135 0.016 1.675 -7.552 1.00 0.00 N ATOM 1938 CA LYS A 135 0.979 2.365 -6.700 1.00 0.00 C ATOM 1939 C LYS A 135 0.281 3.357 -5.798 1.00 0.00 C ATOM 1940 O LYS A 135 -0.928 3.557 -5.877 1.00 0.00 O ATOM 1941 CB LYS A 135 2.095 2.990 -7.574 1.00 0.00 C ATOM 1942 CG LYS A 135 2.890 1.926 -8.371 1.00 0.00 C ATOM 1943 CD LYS A 135 2.490 1.857 -9.845 1.00 0.00 C ATOM 1944 CE LYS A 135 3.303 2.869 -10.667 1.00 0.00 C ATOM 1945 NZ LYS A 135 3.075 2.731 -12.128 1.00 0.00 N ATOM 0 H LYS A 135 -0.590 2.318 -8.062 1.00 0.00 H new ATOM 0 HA LYS A 135 1.465 1.654 -6.032 1.00 0.00 H new ATOM 0 HB2 LYS A 135 1.651 3.703 -8.269 1.00 0.00 H new ATOM 0 HB3 LYS A 135 2.780 3.549 -6.937 1.00 0.00 H new ATOM 0 HG2 LYS A 135 3.955 2.148 -8.300 1.00 0.00 H new ATOM 0 HG3 LYS A 135 2.737 0.949 -7.913 1.00 0.00 H new ATOM 0 HD2 LYS A 135 2.657 0.850 -10.227 1.00 0.00 H new ATOM 0 HD3 LYS A 135 1.425 2.065 -9.950 1.00 0.00 H new ATOM 0 HE2 LYS A 135 3.040 3.880 -10.356 1.00 0.00 H new ATOM 0 HE3 LYS A 135 4.364 2.736 -10.454 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 3.696 3.389 -12.640 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 3.286 1.756 -12.422 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 2.082 2.951 -12.347 1.00 0.00 H new ATOM 1955 N ILE A 136 1.061 3.961 -4.919 1.00 0.00 N ATOM 1956 CA ILE A 136 0.666 5.149 -4.153 1.00 0.00 C ATOM 1957 C ILE A 136 1.756 6.210 -4.268 1.00 0.00 C ATOM 1958 O ILE A 136 2.924 5.848 -4.318 1.00 0.00 O ATOM 1959 CB ILE A 136 0.237 4.803 -2.667 1.00 0.00 C ATOM 1960 CG1 ILE A 136 1.306 4.983 -1.529 1.00 0.00 C ATOM 1961 CG2 ILE A 136 -0.391 3.394 -2.534 1.00 0.00 C ATOM 1962 CD1 ILE A 136 1.359 6.381 -0.912 1.00 0.00 C ATOM 0 H ILE A 136 2.006 3.640 -4.707 1.00 0.00 H new ATOM 0 HA ILE A 136 -0.241 5.572 -4.586 1.00 0.00 H new ATOM 0 HB ILE A 136 -0.502 5.585 -2.494 1.00 0.00 H new ATOM 0 HG12 ILE A 136 1.100 4.261 -0.739 1.00 0.00 H new ATOM 0 HG13 ILE A 136 2.289 4.742 -1.933 1.00 0.00 H new ATOM 0 HG21 ILE A 136 -0.664 3.214 -1.494 1.00 0.00 H new ATOM 0 HG22 ILE A 136 -1.282 3.332 -3.159 1.00 0.00 H new ATOM 0 HG23 ILE A 136 0.330 2.642 -2.855 1.00 0.00 H new ATOM 0 HD11 ILE A 136 2.125 6.408 -0.137 1.00 0.00 H new ATOM 0 HD12 ILE A 136 1.599 7.111 -1.685 1.00 0.00 H new ATOM 0 HD13 ILE A 136 0.391 6.622 -0.473 1.00 0.00 H new ATOM 1973 N LEU A 137 1.360 7.475 -4.296 1.00 0.00 N ATOM 1974 CA LEU A 137 2.245 8.634 -4.306 1.00 0.00 C ATOM 1975 C LEU A 137 1.811 9.540 -3.147 1.00 0.00 C ATOM 1976 O LEU A 137 0.668 9.949 -3.090 1.00 0.00 O ATOM 1977 CB LEU A 137 2.195 9.313 -5.710 1.00 0.00 C ATOM 1978 CG LEU A 137 2.110 10.855 -5.818 1.00 0.00 C ATOM 1979 CD1 LEU A 137 3.306 11.596 -5.232 1.00 0.00 C ATOM 1980 CD2 LEU A 137 1.988 11.283 -7.276 1.00 0.00 C ATOM 0 H LEU A 137 0.373 7.733 -4.313 1.00 0.00 H new ATOM 0 HA LEU A 137 3.291 8.372 -4.150 1.00 0.00 H new ATOM 0 HB2 LEU A 137 3.085 8.998 -6.255 1.00 0.00 H new ATOM 0 HB3 LEU A 137 1.335 8.902 -6.239 1.00 0.00 H new ATOM 0 HG LEU A 137 1.228 11.121 -5.235 1.00 0.00 H new ATOM 0 HD11 LEU A 137 3.162 12.670 -5.351 1.00 0.00 H new ATOM 0 HD12 LEU A 137 3.398 11.357 -4.173 1.00 0.00 H new ATOM 0 HD13 LEU A 137 4.214 11.291 -5.753 1.00 0.00 H new ATOM 0 HD21 LEU A 137 1.929 12.370 -7.332 1.00 0.00 H new ATOM 0 HD22 LEU A 137 2.860 10.937 -7.831 1.00 0.00 H new ATOM 0 HD23 LEU A 137 1.087 10.848 -7.709 1.00 0.00 H new ATOM 1991 N MET A 138 2.695 9.787 -2.184 1.00 0.00 N ATOM 1992 CA MET A 138 2.479 10.675 -1.055 1.00 0.00 C ATOM 1993 C MET A 138 3.047 12.059 -1.382 1.00 0.00 C ATOM 1994 O MET A 138 4.248 12.179 -1.611 1.00 0.00 O ATOM 1995 CB MET A 138 3.201 10.138 0.191 1.00 0.00 C ATOM 1996 CG MET A 138 2.257 9.698 1.311 1.00 0.00 C ATOM 1997 SD MET A 138 3.148 9.274 2.826 1.00 0.00 S ATOM 1998 CE MET A 138 2.170 7.864 3.397 1.00 0.00 C ATOM 0 H MET A 138 3.618 9.354 -2.172 1.00 0.00 H new ATOM 0 HA MET A 138 1.408 10.737 -0.860 1.00 0.00 H new ATOM 0 HB2 MET A 138 3.825 9.292 -0.099 1.00 0.00 H new ATOM 0 HB3 MET A 138 3.868 10.910 0.574 1.00 0.00 H new ATOM 0 HG2 MET A 138 1.547 10.498 1.521 1.00 0.00 H new ATOM 0 HG3 MET A 138 1.678 8.836 0.979 1.00 0.00 H new ATOM 0 HE1 MET A 138 2.590 7.483 4.328 1.00 0.00 H new ATOM 0 HE2 MET A 138 1.141 8.180 3.566 1.00 0.00 H new ATOM 0 HE3 MET A 138 2.189 7.078 2.642 1.00 0.00 H new ATOM 2006 N LYS A 139 2.204 13.099 -1.367 1.00 0.00 N ATOM 2007 CA LYS A 139 2.645 14.492 -1.554 1.00 0.00 C ATOM 2008 C LYS A 139 3.787 14.851 -0.582 1.00 0.00 C ATOM 2009 O LYS A 139 3.794 14.388 0.551 1.00 0.00 O ATOM 2010 CB LYS A 139 1.446 15.470 -1.411 1.00 0.00 C ATOM 2011 CG LYS A 139 1.560 16.638 -2.402 1.00 0.00 C ATOM 2012 CD LYS A 139 1.148 16.206 -3.831 1.00 0.00 C ATOM 2013 CE LYS A 139 2.019 16.812 -4.951 1.00 0.00 C ATOM 2014 NZ LYS A 139 1.920 18.283 -5.028 1.00 0.00 N ATOM 0 H LYS A 139 1.199 13.002 -1.225 1.00 0.00 H new ATOM 0 HA LYS A 139 3.039 14.591 -2.566 1.00 0.00 H new ATOM 0 HB2 LYS A 139 0.513 14.933 -1.583 1.00 0.00 H new ATOM 0 HB3 LYS A 139 1.408 15.856 -0.392 1.00 0.00 H new ATOM 0 HG2 LYS A 139 0.926 17.461 -2.072 1.00 0.00 H new ATOM 0 HG3 LYS A 139 2.585 17.009 -2.413 1.00 0.00 H new ATOM 0 HD2 LYS A 139 1.195 15.119 -3.898 1.00 0.00 H new ATOM 0 HD3 LYS A 139 0.109 16.491 -3.999 1.00 0.00 H new ATOM 0 HE2 LYS A 139 3.059 16.532 -4.786 1.00 0.00 H new ATOM 0 HE3 LYS A 139 1.721 16.383 -5.908 1.00 0.00 H new ATOM 0 HZ1 LYS A 139 2.526 18.632 -5.798 1.00 0.00 H new ATOM 0 HZ2 LYS A 139 0.934 18.555 -5.214 1.00 0.00 H new ATOM 0 HZ3 LYS A 139 2.230 18.699 -4.127 1.00 0.00 H new ATOM 2024 N VAL A 140 4.718 15.717 -0.986 1.00 0.00 N ATOM 2025 CA VAL A 140 5.855 16.189 -0.158 1.00 0.00 C ATOM 2026 C VAL A 140 5.407 16.830 1.176 1.00 0.00 C ATOM 2027 O VAL A 140 6.123 16.761 2.185 1.00 0.00 O ATOM 2028 CB VAL A 140 6.731 17.154 -0.982 1.00 0.00 C ATOM 2029 CG1 VAL A 140 7.831 17.855 -0.179 1.00 0.00 C ATOM 2030 CG2 VAL A 140 7.430 16.389 -2.112 1.00 0.00 C ATOM 0 H VAL A 140 4.712 16.126 -1.920 1.00 0.00 H new ATOM 0 HA VAL A 140 6.445 15.316 0.120 1.00 0.00 H new ATOM 0 HB VAL A 140 6.041 17.914 -1.348 1.00 0.00 H new ATOM 0 HG11 VAL A 140 8.398 18.514 -0.837 1.00 0.00 H new ATOM 0 HG12 VAL A 140 7.380 18.442 0.621 1.00 0.00 H new ATOM 0 HG13 VAL A 140 8.499 17.109 0.251 1.00 0.00 H new ATOM 0 HG21 VAL A 140 8.047 17.077 -2.690 1.00 0.00 H new ATOM 0 HG22 VAL A 140 8.059 15.607 -1.687 1.00 0.00 H new ATOM 0 HG23 VAL A 140 6.681 15.938 -2.764 1.00 0.00 H new ATOM 2040 N GLY A 141 4.208 17.433 1.190 1.00 0.00 N ATOM 2041 CA GLY A 141 3.479 17.903 2.373 1.00 0.00 C ATOM 2042 C GLY A 141 2.907 19.309 2.191 1.00 0.00 C ATOM 2043 O GLY A 141 1.709 19.515 2.388 1.00 0.00 O ATOM 0 H GLY A 141 3.695 17.615 0.327 1.00 0.00 H new ATOM 0 HA2 GLY A 141 2.667 17.210 2.594 1.00 0.00 H new ATOM 0 HA3 GLY A 141 4.147 17.895 3.234 1.00 0.00 H new ATOM 2046 N GLN A 142 3.754 20.255 1.762 1.00 0.00 N ATOM 2047 CA GLN A 142 3.416 21.667 1.471 1.00 0.00 C ATOM 2048 C GLN A 142 4.424 22.287 0.477 1.00 0.00 C ATOM 2049 O GLN A 142 3.977 22.837 -0.558 1.00 0.00 O ATOM 2050 CB GLN A 142 3.337 22.453 2.800 1.00 0.00 C ATOM 2051 CG GLN A 142 2.230 23.522 2.809 1.00 0.00 C ATOM 2052 CD GLN A 142 2.529 24.803 2.020 1.00 0.00 C ATOM 2053 OE1 GLN A 142 3.666 25.246 1.860 1.00 0.00 O ATOM 2054 NE2 GLN A 142 1.514 25.486 1.520 1.00 0.00 N ATOM 0 H GLN A 142 4.741 20.054 1.599 1.00 0.00 H new ATOM 0 HA GLN A 142 2.441 21.719 0.986 1.00 0.00 H new ATOM 0 HB2 GLN A 142 3.164 21.754 3.618 1.00 0.00 H new ATOM 0 HB3 GLN A 142 4.298 22.933 2.988 1.00 0.00 H new ATOM 0 HG2 GLN A 142 1.319 23.077 2.410 1.00 0.00 H new ATOM 0 HG3 GLN A 142 2.024 23.795 3.844 1.00 0.00 H new ATOM 0 HE21 GLN A 142 0.561 25.142 1.638 1.00 0.00 H new ATOM 0 HE22 GLN A 142 1.684 26.357 1.017 1.00 0.00 H new