USER MOD reduce.3.24.130724 H: found=0, std=0, add=1030, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 861 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 39 SER OG : rot 105:sc= 0.336 USER MOD Set 1.2: A 68 GLN :FLIP amide:sc= -0.101 F(o=-0.96,f=0.23) USER MOD Set 2.1: A 25 ASN : amide:sc= -0.156 X(o=1.1,f=0.89) USER MOD Set 2.2: A 31 SER OG : rot -178:sc= 1.25 USER MOD Single : A 4 LYS NZ :NH3+ -164:sc= 1.15 (180deg=0.65) USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 THR OG1 : rot 10:sc= 0.587 USER MOD Single : A 10 TYR OH : rot 180:sc= 0 USER MOD Single : A 11 TYR OH : rot 180:sc= 0 USER MOD Single : A 17 THR OG1 : rot -102:sc= -0.0833 USER MOD Single : A 18 LYS NZ :NH3+ -143:sc= 0.0798 (180deg=-0.113) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 MET CE :methyl -148:sc= -0.44 (180deg=-1.96!) USER MOD Single : A 23 LYS NZ :NH3+ 166:sc= -0.171 (180deg=-0.293) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 LYS NZ :NH3+ -166:sc= 0 (180deg=-0.105) USER MOD Single : A 57 GLN : amide:sc= -0.393 K(o=-0.39,f=-1.5) USER MOD Single : A 59 GLN : amide:sc= 0 X(o=0,f=-0.06) USER MOD Single : A 61 ASN : amide:sc= 1.16 K(o=1.2,f=-5.4!) USER MOD Single : A 62 LYS NZ :NH3+ -158:sc= -0.0482 (180deg=-0.322) USER MOD Single : A 71 ASN :FLIP amide:sc= -0.12 F(o=-0.64,f=-0.12) USER MOD Single : A 74 TYR OH : rot 180:sc= 0 USER MOD Single : A 75 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 76 ASN :FLIP amide:sc= -0.219 F(o=-1.6,f=-0.22) USER MOD Single : A 77 TYR OH : rot 180:sc= 0 USER MOD Single : A 84 SER OG : rot 24:sc= 0.891 USER MOD Single : A 88 SER OG : rot -150:sc= 0 USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 THR OG1 : rot 90:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 THR OG1 : rot 138:sc= -0.187 USER MOD Single : A 101 GLN : amide:sc= 0.0284 K(o=0.028,f=-1.1) USER MOD Single : A 102 MET CE :methyl 157:sc= -1.32 (180deg=-2.6) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 105 TYR OH : rot 30:sc= -0.24 USER MOD Single : A 111 SER OG : rot 24:sc= 0.147 USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 SER OG : rot 115:sc= 0.304 USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 ASN : amide:sc= -1.01 K(o=-1,f=-3.8!) USER MOD Single : A 120 HIS : no HD1:sc= -0.0656 K(o=-0.066,f=-1.3) USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 TYR OH : rot 180:sc= 0 USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD Single : A 126 HIS : no HE2:sc= 0.347 K(o=0.35,f=-2.3!) USER MOD Single : A 128 ASN : amide:sc= 0.67 K(o=0.67,f=-0.011) USER MOD Single : A 135 ASN : amide:sc= -0.359 X(o=-0.36,f=-0.015) USER MOD Single : A 144 SER OG : rot 180:sc= 0 USER MOD Single : A 148 LYS NZ :NH3+ 167:sc= 1.09 (180deg=0.954) USER MOD Single : A 150 SER OG : rot 55:sc= 0.418 USER MOD Single : A 151 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 23 N ALA A 3 -1.126 -20.119 -10.791 1.00 25.22 N ATOM 24 CA ALA A 3 -0.299 -18.967 -11.083 1.00 74.50 C ATOM 25 C ALA A 3 -0.270 -18.138 -9.813 1.00 32.14 C ATOM 26 O ALA A 3 -1.328 -17.754 -9.308 1.00 41.42 O ATOM 27 CB ALA A 3 -0.839 -18.126 -12.241 1.00 43.20 C ATOM 0 HA ALA A 3 0.693 -19.297 -11.392 1.00 74.50 H new ATOM 0 HB1 ALA A 3 -0.178 -17.277 -12.413 1.00 43.20 H new ATOM 0 HB2 ALA A 3 -0.888 -18.737 -13.142 1.00 43.20 H new ATOM 0 HB3 ALA A 3 -1.837 -17.764 -11.993 1.00 43.20 H new ATOM 33 N LYS A 4 0.923 -17.853 -9.300 1.00 41.14 N ATOM 34 CA LYS A 4 1.122 -16.871 -8.241 1.00 21.55 C ATOM 35 C LYS A 4 2.026 -15.735 -8.693 1.00 54.02 C ATOM 36 O LYS A 4 3.250 -15.778 -8.555 1.00 24.33 O ATOM 37 CB LYS A 4 1.476 -17.505 -6.896 1.00 63.43 C ATOM 38 CG LYS A 4 2.813 -18.245 -6.772 1.00 65.21 C ATOM 39 CD LYS A 4 3.753 -17.595 -5.745 1.00 33.53 C ATOM 40 CE LYS A 4 3.322 -17.841 -4.290 1.00 1.22 C ATOM 41 NZ LYS A 4 2.698 -16.653 -3.664 1.00 22.13 N ATOM 0 H LYS A 4 1.785 -18.301 -9.610 1.00 41.14 H new ATOM 0 HA LYS A 4 0.162 -16.396 -8.041 1.00 21.55 H new ATOM 0 HB2 LYS A 4 1.461 -16.717 -6.143 1.00 63.43 H new ATOM 0 HB3 LYS A 4 0.682 -18.207 -6.640 1.00 63.43 H new ATOM 0 HG2 LYS A 4 2.626 -19.280 -6.485 1.00 65.21 H new ATOM 0 HG3 LYS A 4 3.303 -18.268 -7.745 1.00 65.21 H new ATOM 0 HD2 LYS A 4 4.762 -17.982 -5.889 1.00 33.53 H new ATOM 0 HD3 LYS A 4 3.795 -16.521 -5.928 1.00 33.53 H new ATOM 0 HE2 LYS A 4 2.618 -18.673 -4.261 1.00 1.22 H new ATOM 0 HE3 LYS A 4 4.192 -18.139 -3.704 1.00 1.22 H new ATOM 0 HZ1 LYS A 4 2.676 -16.776 -2.632 1.00 22.13 H new ATOM 0 HZ2 LYS A 4 3.252 -15.805 -3.900 1.00 22.13 H new ATOM 0 HZ3 LYS A 4 1.727 -16.542 -4.020 1.00 22.13 H new ATOM 51 N LYS A 5 1.377 -14.723 -9.267 1.00 33.34 N ATOM 52 CA LYS A 5 1.968 -13.438 -9.616 1.00 25.55 C ATOM 53 C LYS A 5 2.207 -12.621 -8.365 1.00 74.43 C ATOM 54 O LYS A 5 1.706 -12.931 -7.284 1.00 22.31 O ATOM 55 CB LYS A 5 1.010 -12.620 -10.495 1.00 32.11 C ATOM 56 CG LYS A 5 0.407 -13.326 -11.705 1.00 22.41 C ATOM 57 CD LYS A 5 1.415 -13.335 -12.843 1.00 45.01 C ATOM 58 CE LYS A 5 0.985 -14.058 -14.123 1.00 74.31 C ATOM 59 NZ LYS A 5 -0.162 -13.411 -14.781 1.00 12.02 N ATOM 0 H LYS A 5 0.388 -14.781 -9.510 1.00 33.34 H new ATOM 0 HA LYS A 5 2.900 -13.642 -10.144 1.00 25.55 H new ATOM 0 HB2 LYS A 5 0.192 -12.267 -9.867 1.00 32.11 H new ATOM 0 HB3 LYS A 5 1.544 -11.738 -10.849 1.00 32.11 H new ATOM 0 HG2 LYS A 5 0.130 -14.347 -11.443 1.00 22.41 H new ATOM 0 HG3 LYS A 5 -0.506 -12.819 -12.018 1.00 22.41 H new ATOM 0 HD2 LYS A 5 1.654 -12.302 -13.097 1.00 45.01 H new ATOM 0 HD3 LYS A 5 2.335 -13.795 -12.482 1.00 45.01 H new ATOM 0 HE2 LYS A 5 1.825 -14.092 -14.816 1.00 74.31 H new ATOM 0 HE3 LYS A 5 0.727 -15.090 -13.884 1.00 74.31 H new ATOM 0 HZ1 LYS A 5 -0.412 -13.939 -15.641 1.00 12.02 H new ATOM 0 HZ2 LYS A 5 -0.975 -13.401 -14.132 1.00 12.02 H new ATOM 0 HZ3 LYS A 5 0.089 -12.434 -15.036 1.00 12.02 H new ATOM 69 N THR A 6 2.811 -11.464 -8.567 1.00 24.11 N ATOM 70 CA THR A 6 2.779 -10.363 -7.615 1.00 42.32 C ATOM 71 C THR A 6 2.827 -9.043 -8.386 1.00 45.11 C ATOM 72 O THR A 6 3.463 -8.975 -9.438 1.00 31.50 O ATOM 73 CB THR A 6 3.939 -10.529 -6.627 1.00 0.24 C ATOM 74 OG1 THR A 6 3.713 -11.663 -5.818 1.00 33.10 O ATOM 75 CG2 THR A 6 4.122 -9.330 -5.690 1.00 35.34 C ATOM 0 H THR A 6 3.347 -11.257 -9.410 1.00 24.11 H new ATOM 0 HA THR A 6 1.858 -10.361 -7.032 1.00 42.32 H new ATOM 0 HB THR A 6 4.838 -10.627 -7.236 1.00 0.24 H new ATOM 0 HG1 THR A 6 2.958 -12.175 -6.176 1.00 33.10 H new ATOM 0 HG21 THR A 6 4.960 -9.517 -5.019 1.00 35.34 H new ATOM 0 HG22 THR A 6 4.322 -8.435 -6.279 1.00 35.34 H new ATOM 0 HG23 THR A 6 3.214 -9.184 -5.105 1.00 35.34 H new ATOM 83 N LEU A 7 2.163 -8.003 -7.877 1.00 21.53 N ATOM 84 CA LEU A 7 2.317 -6.631 -8.352 1.00 30.43 C ATOM 85 C LEU A 7 3.049 -5.842 -7.276 1.00 64.14 C ATOM 86 O LEU A 7 2.862 -6.106 -6.087 1.00 63.53 O ATOM 87 CB LEU A 7 0.942 -6.007 -8.653 1.00 22.43 C ATOM 88 CG LEU A 7 0.994 -4.614 -9.319 1.00 32.21 C ATOM 89 CD1 LEU A 7 1.731 -4.600 -10.661 1.00 14.40 C ATOM 90 CD2 LEU A 7 -0.429 -4.121 -9.561 1.00 34.52 C ATOM 0 H LEU A 7 1.494 -8.094 -7.112 1.00 21.53 H new ATOM 0 HA LEU A 7 2.890 -6.613 -9.279 1.00 30.43 H new ATOM 0 HB2 LEU A 7 0.386 -6.684 -9.302 1.00 22.43 H new ATOM 0 HB3 LEU A 7 0.383 -5.928 -7.721 1.00 22.43 H new ATOM 0 HG LEU A 7 1.544 -3.969 -8.634 1.00 32.21 H new ATOM 0 HD11 LEU A 7 1.727 -3.589 -11.068 1.00 14.40 H new ATOM 0 HD12 LEU A 7 2.760 -4.928 -10.514 1.00 14.40 H new ATOM 0 HD13 LEU A 7 1.232 -5.274 -11.357 1.00 14.40 H new ATOM 0 HD21 LEU A 7 -0.399 -3.138 -10.031 1.00 34.52 H new ATOM 0 HD22 LEU A 7 -0.950 -4.820 -10.215 1.00 34.52 H new ATOM 0 HD23 LEU A 7 -0.957 -4.052 -8.610 1.00 34.52 H new ATOM 101 N ILE A 8 3.830 -4.850 -7.680 1.00 14.14 N ATOM 102 CA ILE A 8 4.370 -3.823 -6.800 1.00 32.52 C ATOM 103 C ILE A 8 3.866 -2.492 -7.370 1.00 63.35 C ATOM 104 O ILE A 8 3.981 -2.292 -8.583 1.00 53.43 O ATOM 105 CB ILE A 8 5.915 -3.928 -6.737 1.00 3.44 C ATOM 106 CG1 ILE A 8 6.426 -5.296 -6.210 1.00 72.11 C ATOM 107 CG2 ILE A 8 6.485 -2.848 -5.804 1.00 71.13 C ATOM 108 CD1 ILE A 8 6.934 -6.230 -7.305 1.00 20.41 C ATOM 0 H ILE A 8 4.113 -4.734 -8.653 1.00 14.14 H new ATOM 0 HA ILE A 8 4.041 -3.928 -5.766 1.00 32.52 H new ATOM 0 HB ILE A 8 6.252 -3.802 -7.766 1.00 3.44 H new ATOM 0 HG12 ILE A 8 7.229 -5.121 -5.494 1.00 72.11 H new ATOM 0 HG13 ILE A 8 5.619 -5.791 -5.670 1.00 72.11 H new ATOM 0 HG21 ILE A 8 7.571 -2.934 -5.769 1.00 71.13 H new ATOM 0 HG22 ILE A 8 6.210 -1.862 -6.178 1.00 71.13 H new ATOM 0 HG23 ILE A 8 6.078 -2.982 -4.802 1.00 71.13 H new ATOM 0 HD11 ILE A 8 7.273 -7.164 -6.858 1.00 20.41 H new ATOM 0 HD12 ILE A 8 6.128 -6.437 -8.010 1.00 20.41 H new ATOM 0 HD13 ILE A 8 7.763 -5.757 -7.831 1.00 20.41 H new ATOM 119 N LEU A 9 3.295 -1.619 -6.526 1.00 0.00 N ATOM 120 CA LEU A 9 2.776 -0.308 -6.876 1.00 40.15 C ATOM 121 C LEU A 9 3.523 0.735 -6.062 1.00 13.03 C ATOM 122 O LEU A 9 3.264 0.906 -4.867 1.00 40.44 O ATOM 123 CB LEU A 9 1.277 -0.224 -6.566 1.00 32.40 C ATOM 124 CG LEU A 9 0.396 -0.997 -7.551 1.00 2.12 C ATOM 125 CD1 LEU A 9 -1.053 -0.792 -7.113 1.00 11.40 C ATOM 126 CD2 LEU A 9 0.619 -0.515 -8.989 1.00 31.43 C ATOM 0 H LEU A 9 3.182 -1.828 -5.534 1.00 0.00 H new ATOM 0 HA LEU A 9 2.916 -0.132 -7.943 1.00 40.15 H new ATOM 0 HB2 LEU A 9 1.102 -0.606 -5.560 1.00 32.40 H new ATOM 0 HB3 LEU A 9 0.974 0.823 -6.567 1.00 32.40 H new ATOM 0 HG LEU A 9 0.649 -2.057 -7.542 1.00 2.12 H new ATOM 0 HD11 LEU A 9 -1.717 -1.328 -7.791 1.00 11.40 H new ATOM 0 HD12 LEU A 9 -1.184 -1.172 -6.100 1.00 11.40 H new ATOM 0 HD13 LEU A 9 -1.293 0.271 -7.135 1.00 11.40 H new ATOM 0 HD21 LEU A 9 -0.020 -1.082 -9.666 1.00 31.43 H new ATOM 0 HD22 LEU A 9 0.373 0.544 -9.060 1.00 31.43 H new ATOM 0 HD23 LEU A 9 1.663 -0.664 -9.265 1.00 31.43 H new ATOM 137 N TYR A 10 4.439 1.438 -6.715 1.00 55.03 N ATOM 138 CA TYR A 10 5.268 2.479 -6.127 1.00 40.32 C ATOM 139 C TYR A 10 4.844 3.806 -6.738 1.00 21.21 C ATOM 140 O TYR A 10 4.692 3.913 -7.954 1.00 54.35 O ATOM 141 CB TYR A 10 6.749 2.169 -6.376 1.00 73.34 C ATOM 142 CG TYR A 10 7.116 1.799 -7.793 1.00 51.04 C ATOM 143 CD1 TYR A 10 6.912 0.476 -8.212 1.00 1.40 C ATOM 144 CD2 TYR A 10 7.637 2.755 -8.685 1.00 42.14 C ATOM 145 CE1 TYR A 10 7.221 0.101 -9.522 1.00 24.22 C ATOM 146 CE2 TYR A 10 7.947 2.384 -10.006 1.00 24.43 C ATOM 147 CZ TYR A 10 7.742 1.049 -10.422 1.00 61.41 C ATOM 148 OH TYR A 10 8.052 0.653 -11.678 1.00 63.32 O ATOM 0 H TYR A 10 4.631 1.292 -7.706 1.00 55.03 H new ATOM 0 HA TYR A 10 5.137 2.530 -5.046 1.00 40.32 H new ATOM 0 HB2 TYR A 10 7.336 3.040 -6.085 1.00 73.34 H new ATOM 0 HB3 TYR A 10 7.044 1.351 -5.719 1.00 73.34 H new ATOM 0 HD1 TYR A 10 6.516 -0.254 -7.521 1.00 1.40 H new ATOM 0 HD2 TYR A 10 7.798 3.771 -8.356 1.00 42.14 H new ATOM 0 HE1 TYR A 10 7.060 -0.917 -9.844 1.00 24.22 H new ATOM 0 HE2 TYR A 10 8.339 3.115 -10.698 1.00 24.43 H new ATOM 0 HH TYR A 10 8.400 1.416 -12.185 1.00 63.32 H new ATOM 157 N TYR A 11 4.561 4.808 -5.913 1.00 42.35 N ATOM 158 CA TYR A 11 4.106 6.096 -6.393 1.00 40.21 C ATOM 159 C TYR A 11 5.321 6.998 -6.657 1.00 44.14 C ATOM 160 O TYR A 11 6.457 6.553 -6.475 1.00 34.34 O ATOM 161 CB TYR A 11 3.033 6.605 -5.416 1.00 21.14 C ATOM 162 CG TYR A 11 3.412 7.561 -4.306 1.00 12.11 C ATOM 163 CD1 TYR A 11 4.427 7.192 -3.420 1.00 0.22 C ATOM 164 CD2 TYR A 11 2.737 8.790 -4.127 1.00 4.21 C ATOM 165 CE1 TYR A 11 4.800 8.021 -2.360 1.00 43.02 C ATOM 166 CE2 TYR A 11 3.121 9.645 -3.074 1.00 62.11 C ATOM 167 CZ TYR A 11 4.148 9.252 -2.179 1.00 64.33 C ATOM 168 OH TYR A 11 4.533 10.022 -1.132 1.00 34.22 O ATOM 0 H TYR A 11 4.642 4.745 -4.898 1.00 42.35 H new ATOM 0 HA TYR A 11 3.609 6.061 -7.362 1.00 40.21 H new ATOM 0 HB2 TYR A 11 2.258 7.089 -6.010 1.00 21.14 H new ATOM 0 HB3 TYR A 11 2.578 5.731 -4.950 1.00 21.14 H new ATOM 0 HD1 TYR A 11 4.933 6.248 -3.557 1.00 0.22 H new ATOM 0 HD2 TYR A 11 1.934 9.072 -4.792 1.00 4.21 H new ATOM 0 HE1 TYR A 11 5.585 7.718 -1.683 1.00 43.02 H new ATOM 0 HE2 TYR A 11 2.633 10.600 -2.949 1.00 62.11 H new ATOM 0 HH TYR A 11 4.004 10.847 -1.121 1.00 34.22 H new ATOM 227 N GLU A 16 11.291 8.268 -5.803 1.00 31.40 N ATOM 228 CA GLU A 16 11.572 8.123 -4.378 1.00 14.24 C ATOM 229 C GLU A 16 11.824 6.645 -4.052 1.00 21.33 C ATOM 230 O GLU A 16 12.783 6.310 -3.357 1.00 14.13 O ATOM 231 CB GLU A 16 10.464 8.798 -3.543 1.00 13.24 C ATOM 232 CG GLU A 16 9.046 8.168 -3.535 1.00 3.24 C ATOM 233 CD GLU A 16 8.634 7.446 -2.236 1.00 20.32 C ATOM 234 OE1 GLU A 16 9.163 7.814 -1.159 1.00 24.42 O ATOM 235 OE2 GLU A 16 7.759 6.545 -2.286 1.00 55.13 O ATOM 0 HA GLU A 16 12.488 8.646 -4.105 1.00 14.24 H new ATOM 0 HB2 GLU A 16 10.811 8.844 -2.511 1.00 13.24 H new ATOM 0 HB3 GLU A 16 10.367 9.826 -3.893 1.00 13.24 H new ATOM 0 HG2 GLU A 16 8.319 8.955 -3.736 1.00 3.24 H new ATOM 0 HG3 GLU A 16 8.981 7.457 -4.359 1.00 3.24 H new ATOM 240 N THR A 17 11.045 5.759 -4.668 1.00 51.42 N ATOM 241 CA THR A 17 11.052 4.310 -4.506 1.00 51.14 C ATOM 242 C THR A 17 11.615 3.575 -5.719 1.00 71.31 C ATOM 243 O THR A 17 11.622 2.339 -5.758 1.00 32.24 O ATOM 244 CB THR A 17 9.627 3.858 -4.172 1.00 24.52 C ATOM 245 OG1 THR A 17 8.662 4.673 -4.823 1.00 14.10 O ATOM 246 CG2 THR A 17 9.463 3.992 -2.671 1.00 51.45 C ATOM 0 H THR A 17 10.341 6.059 -5.343 1.00 51.42 H new ATOM 0 HA THR A 17 11.725 4.052 -3.688 1.00 51.14 H new ATOM 0 HB THR A 17 9.474 2.833 -4.508 1.00 24.52 H new ATOM 0 HG1 THR A 17 8.283 5.308 -4.180 1.00 14.10 H new ATOM 0 HG21 THR A 17 8.458 3.680 -2.385 1.00 51.45 H new ATOM 0 HG22 THR A 17 10.196 3.362 -2.167 1.00 51.45 H new ATOM 0 HG23 THR A 17 9.617 5.031 -2.380 1.00 51.45 H new ATOM 254 N LYS A 18 12.209 4.304 -6.668 1.00 33.42 N ATOM 255 CA LYS A 18 13.250 3.688 -7.476 1.00 52.43 C ATOM 256 C LYS A 18 14.337 3.194 -6.511 1.00 0.12 C ATOM 257 O LYS A 18 14.385 3.629 -5.359 1.00 71.22 O ATOM 258 CB LYS A 18 13.710 4.683 -8.550 1.00 20.54 C ATOM 259 CG LYS A 18 14.625 4.019 -9.583 1.00 20.13 C ATOM 260 CD LYS A 18 14.629 4.744 -10.936 1.00 52.01 C ATOM 261 CE LYS A 18 13.398 4.495 -11.829 1.00 33.53 C ATOM 262 NZ LYS A 18 13.181 3.068 -12.168 1.00 73.31 N ATOM 0 H LYS A 18 11.996 5.278 -6.886 1.00 33.42 H new ATOM 0 HA LYS A 18 12.911 2.818 -8.038 1.00 52.43 H new ATOM 0 HB2 LYS A 18 12.839 5.104 -9.053 1.00 20.54 H new ATOM 0 HB3 LYS A 18 14.237 5.512 -8.077 1.00 20.54 H new ATOM 0 HG2 LYS A 18 15.642 3.986 -9.192 1.00 20.13 H new ATOM 0 HG3 LYS A 18 14.307 2.987 -9.731 1.00 20.13 H new ATOM 0 HD2 LYS A 18 14.712 5.815 -10.753 1.00 52.01 H new ATOM 0 HD3 LYS A 18 15.521 4.444 -11.486 1.00 52.01 H new ATOM 0 HE2 LYS A 18 12.511 4.877 -11.323 1.00 33.53 H new ATOM 0 HE3 LYS A 18 13.509 5.065 -12.752 1.00 33.53 H new ATOM 0 HZ1 LYS A 18 12.833 2.992 -13.145 1.00 73.31 H new ATOM 0 HZ2 LYS A 18 14.078 2.550 -12.079 1.00 73.31 H new ATOM 0 HZ3 LYS A 18 12.479 2.660 -11.518 1.00 73.31 H new ATOM 272 N LYS A 19 15.166 2.229 -6.922 1.00 44.45 N ATOM 273 CA LYS A 19 15.871 1.329 -6.016 1.00 40.13 C ATOM 274 C LYS A 19 14.859 0.453 -5.292 1.00 62.14 C ATOM 275 O LYS A 19 14.665 -0.690 -5.705 1.00 4.14 O ATOM 276 CB LYS A 19 16.854 2.114 -5.110 1.00 35.24 C ATOM 277 CG LYS A 19 18.254 1.506 -4.998 1.00 75.45 C ATOM 278 CD LYS A 19 18.335 0.350 -3.989 1.00 0.31 C ATOM 279 CE LYS A 19 18.853 -0.925 -4.648 1.00 63.44 C ATOM 280 NZ LYS A 19 20.261 -0.830 -5.087 1.00 75.33 N ATOM 0 H LYS A 19 15.366 2.052 -7.906 1.00 44.45 H new ATOM 0 HA LYS A 19 16.515 0.643 -6.566 1.00 40.13 H new ATOM 0 HB2 LYS A 19 16.945 3.130 -5.493 1.00 35.24 H new ATOM 0 HB3 LYS A 19 16.425 2.187 -4.111 1.00 35.24 H new ATOM 0 HG2 LYS A 19 18.566 1.146 -5.978 1.00 75.45 H new ATOM 0 HG3 LYS A 19 18.958 2.285 -4.705 1.00 75.45 H new ATOM 0 HD2 LYS A 19 18.992 0.629 -3.165 1.00 0.31 H new ATOM 0 HD3 LYS A 19 17.349 0.167 -3.562 1.00 0.31 H new ATOM 0 HE2 LYS A 19 18.754 -1.753 -3.946 1.00 63.44 H new ATOM 0 HE3 LYS A 19 18.227 -1.160 -5.509 1.00 63.44 H new ATOM 0 HZ1 LYS A 19 20.549 -1.728 -5.525 1.00 75.33 H new ATOM 0 HZ2 LYS A 19 20.358 -0.060 -5.779 1.00 75.33 H new ATOM 0 HZ3 LYS A 19 20.868 -0.635 -4.266 1.00 75.33 H new ATOM 290 N MET A 20 14.190 0.952 -4.257 1.00 51.25 N ATOM 291 CA MET A 20 13.575 0.087 -3.261 1.00 43.03 C ATOM 292 C MET A 20 12.306 -0.634 -3.724 1.00 55.42 C ATOM 293 O MET A 20 11.800 -1.437 -2.959 1.00 72.54 O ATOM 294 CB MET A 20 13.322 0.872 -1.966 1.00 33.31 C ATOM 295 CG MET A 20 13.481 0.008 -0.709 1.00 24.43 C ATOM 296 SD MET A 20 15.192 -0.269 -0.172 1.00 35.14 S ATOM 297 CE MET A 20 15.610 -1.809 -1.018 1.00 51.02 C ATOM 0 H MET A 20 14.061 1.950 -4.088 1.00 51.25 H new ATOM 0 HA MET A 20 14.294 -0.712 -3.081 1.00 43.03 H new ATOM 0 HB2 MET A 20 14.014 1.712 -1.914 1.00 33.31 H new ATOM 0 HB3 MET A 20 12.315 1.290 -1.990 1.00 33.31 H new ATOM 0 HG2 MET A 20 12.933 0.478 0.107 1.00 24.43 H new ATOM 0 HG3 MET A 20 13.013 -0.960 -0.891 1.00 24.43 H new ATOM 0 HE1 MET A 20 16.311 -2.380 -0.409 1.00 51.02 H new ATOM 0 HE2 MET A 20 14.705 -2.395 -1.175 1.00 51.02 H new ATOM 0 HE3 MET A 20 16.067 -1.582 -1.981 1.00 51.02 H new ATOM 305 N ALA A 21 11.775 -0.388 -4.925 1.00 13.01 N ATOM 306 CA ALA A 21 10.708 -1.189 -5.529 1.00 13.10 C ATOM 307 C ALA A 21 11.240 -2.066 -6.667 1.00 4.43 C ATOM 308 O ALA A 21 10.747 -3.169 -6.897 1.00 54.23 O ATOM 309 CB ALA A 21 9.633 -0.240 -6.062 1.00 60.54 C ATOM 0 H ALA A 21 12.080 0.387 -5.514 1.00 13.01 H new ATOM 0 HA ALA A 21 10.292 -1.853 -4.771 1.00 13.10 H new ATOM 0 HB1 ALA A 21 8.829 -0.819 -6.516 1.00 60.54 H new ATOM 0 HB2 ALA A 21 9.233 0.354 -5.241 1.00 60.54 H new ATOM 0 HB3 ALA A 21 10.070 0.422 -6.810 1.00 60.54 H new ATOM 315 N GLU A 22 12.266 -1.588 -7.373 1.00 15.44 N ATOM 316 CA GLU A 22 12.867 -2.245 -8.532 1.00 42.25 C ATOM 317 C GLU A 22 13.555 -3.538 -8.128 1.00 20.30 C ATOM 318 O GLU A 22 13.557 -4.504 -8.890 1.00 71.42 O ATOM 319 CB GLU A 22 13.910 -1.299 -9.124 1.00 20.30 C ATOM 320 CG GLU A 22 13.257 -0.096 -9.827 1.00 41.35 C ATOM 321 CD GLU A 22 12.658 -0.339 -11.218 1.00 22.51 C ATOM 322 OE1 GLU A 22 13.074 -1.286 -11.919 1.00 13.40 O ATOM 323 OE2 GLU A 22 11.873 0.519 -11.683 1.00 41.03 O ATOM 0 H GLU A 22 12.716 -0.702 -7.144 1.00 15.44 H new ATOM 0 HA GLU A 22 12.086 -2.480 -9.256 1.00 42.25 H new ATOM 0 HB2 GLU A 22 14.569 -0.943 -8.332 1.00 20.30 H new ATOM 0 HB3 GLU A 22 14.531 -1.843 -9.836 1.00 20.30 H new ATOM 0 HG2 GLU A 22 12.467 0.285 -9.180 1.00 41.35 H new ATOM 0 HG3 GLU A 22 14.005 0.692 -9.914 1.00 41.35 H new ATOM 328 N LYS A 23 14.126 -3.551 -6.923 1.00 23.53 N ATOM 329 CA LYS A 23 14.699 -4.719 -6.299 1.00 4.32 C ATOM 330 C LYS A 23 13.712 -5.870 -6.317 1.00 73.33 C ATOM 331 O LYS A 23 13.908 -6.817 -7.072 1.00 13.11 O ATOM 332 CB LYS A 23 15.141 -4.329 -4.882 1.00 31.24 C ATOM 333 CG LYS A 23 16.381 -3.424 -4.826 1.00 61.23 C ATOM 334 CD LYS A 23 17.684 -4.175 -5.104 1.00 31.53 C ATOM 335 CE LYS A 23 17.881 -4.449 -6.601 1.00 13.04 C ATOM 336 NZ LYS A 23 17.966 -5.900 -6.889 1.00 43.34 N ATOM 0 H LYS A 23 14.199 -2.714 -6.344 1.00 23.53 H new ATOM 0 HA LYS A 23 15.572 -5.069 -6.849 1.00 4.32 H new ATOM 0 HB2 LYS A 23 14.314 -3.822 -4.384 1.00 31.24 H new ATOM 0 HB3 LYS A 23 15.345 -5.238 -4.316 1.00 31.24 H new ATOM 0 HG2 LYS A 23 16.270 -2.620 -5.553 1.00 61.23 H new ATOM 0 HG3 LYS A 23 16.440 -2.958 -3.842 1.00 61.23 H new ATOM 0 HD2 LYS A 23 18.525 -3.593 -4.728 1.00 31.53 H new ATOM 0 HD3 LYS A 23 17.681 -5.119 -4.560 1.00 31.53 H new ATOM 0 HE2 LYS A 23 17.053 -4.015 -7.162 1.00 13.04 H new ATOM 0 HE3 LYS A 23 18.791 -3.957 -6.944 1.00 13.04 H new ATOM 0 HZ1 LYS A 23 17.860 -6.058 -7.912 1.00 43.34 H new ATOM 0 HZ2 LYS A 23 18.889 -6.262 -6.576 1.00 43.34 H new ATOM 0 HZ3 LYS A 23 17.208 -6.400 -6.382 1.00 43.34 H new ATOM 346 N ILE A 24 12.634 -5.731 -5.558 1.00 34.41 N ATOM 347 CA ILE A 24 11.708 -6.807 -5.266 1.00 15.42 C ATOM 348 C ILE A 24 11.108 -7.386 -6.547 1.00 1.44 C ATOM 349 O ILE A 24 10.887 -8.593 -6.630 1.00 75.32 O ATOM 350 CB ILE A 24 10.613 -6.253 -4.333 1.00 71.43 C ATOM 351 CG1 ILE A 24 11.232 -5.747 -3.017 1.00 11.20 C ATOM 352 CG2 ILE A 24 9.564 -7.329 -4.036 1.00 40.13 C ATOM 353 CD1 ILE A 24 11.384 -4.235 -2.961 1.00 22.42 C ATOM 0 H ILE A 24 12.377 -4.846 -5.120 1.00 34.41 H new ATOM 0 HA ILE A 24 12.233 -7.626 -4.774 1.00 15.42 H new ATOM 0 HB ILE A 24 10.126 -5.418 -4.838 1.00 71.43 H new ATOM 0 HG12 ILE A 24 10.610 -6.073 -2.183 1.00 11.20 H new ATOM 0 HG13 ILE A 24 12.211 -6.208 -2.884 1.00 11.20 H new ATOM 0 HG21 ILE A 24 8.799 -6.919 -3.376 1.00 40.13 H new ATOM 0 HG22 ILE A 24 9.102 -7.654 -4.968 1.00 40.13 H new ATOM 0 HG23 ILE A 24 10.043 -8.180 -3.552 1.00 40.13 H new ATOM 0 HD11 ILE A 24 11.826 -3.949 -2.007 1.00 22.42 H new ATOM 0 HD12 ILE A 24 12.030 -3.904 -3.774 1.00 22.42 H new ATOM 0 HD13 ILE A 24 10.405 -3.767 -3.062 1.00 22.42 H new ATOM 364 N ASN A 25 10.876 -6.544 -7.563 1.00 35.23 N ATOM 365 CA ASN A 25 10.421 -6.993 -8.870 1.00 53.02 C ATOM 366 C ASN A 25 11.261 -8.163 -9.374 1.00 11.41 C ATOM 367 O ASN A 25 10.706 -9.196 -9.753 1.00 4.21 O ATOM 368 CB ASN A 25 10.473 -5.839 -9.882 1.00 2.12 C ATOM 369 CG ASN A 25 10.298 -6.332 -11.318 1.00 22.34 C ATOM 370 OD1 ASN A 25 10.971 -5.883 -12.236 1.00 32.21 O ATOM 371 ND2 ASN A 25 9.362 -7.226 -11.556 1.00 62.51 N ATOM 0 H ASN A 25 11.001 -5.534 -7.494 1.00 35.23 H new ATOM 0 HA ASN A 25 9.390 -7.330 -8.765 1.00 53.02 H new ATOM 0 HB2 ASN A 25 9.691 -5.116 -9.649 1.00 2.12 H new ATOM 0 HB3 ASN A 25 11.426 -5.319 -9.790 1.00 2.12 H new ATOM 0 HD21 ASN A 25 9.195 -7.548 -12.509 1.00 62.51 H new ATOM 0 HD22 ASN A 25 8.804 -7.597 -10.787 1.00 62.51 H new ATOM 377 N SER A 26 12.581 -7.991 -9.356 1.00 43.33 N ATOM 378 CA SER A 26 13.541 -8.950 -9.854 1.00 63.15 C ATOM 379 C SER A 26 13.559 -10.270 -9.069 1.00 75.51 C ATOM 380 O SER A 26 14.188 -11.228 -9.524 1.00 64.52 O ATOM 381 CB SER A 26 14.908 -8.289 -9.833 1.00 41.31 C ATOM 382 OG SER A 26 15.332 -7.943 -11.135 1.00 73.41 O ATOM 0 H SER A 26 13.017 -7.149 -8.980 1.00 43.33 H new ATOM 0 HA SER A 26 13.252 -9.229 -10.867 1.00 63.15 H new ATOM 0 HB2 SER A 26 14.872 -7.395 -9.211 1.00 41.31 H new ATOM 0 HB3 SER A 26 15.634 -8.964 -9.380 1.00 41.31 H new ATOM 0 HG SER A 26 16.214 -7.518 -11.090 1.00 73.41 H new ATOM 387 N GLU A 27 12.923 -10.311 -7.896 1.00 15.04 N ATOM 388 CA GLU A 27 13.181 -11.283 -6.840 1.00 75.42 C ATOM 389 C GLU A 27 11.964 -12.181 -6.600 1.00 62.22 C ATOM 390 O GLU A 27 12.042 -13.157 -5.845 1.00 13.13 O ATOM 391 CB GLU A 27 13.631 -10.535 -5.569 1.00 3.02 C ATOM 392 CG GLU A 27 14.931 -9.766 -5.856 1.00 64.23 C ATOM 393 CD GLU A 27 15.513 -9.012 -4.665 1.00 75.45 C ATOM 394 OE1 GLU A 27 14.944 -7.986 -4.250 1.00 43.22 O ATOM 395 OE2 GLU A 27 16.625 -9.399 -4.223 1.00 63.52 O ATOM 0 H GLU A 27 12.191 -9.645 -7.651 1.00 15.04 H new ATOM 0 HA GLU A 27 13.986 -11.952 -7.144 1.00 75.42 H new ATOM 0 HB2 GLU A 27 12.852 -9.844 -5.246 1.00 3.02 H new ATOM 0 HB3 GLU A 27 13.787 -11.242 -4.755 1.00 3.02 H new ATOM 0 HG2 GLU A 27 15.679 -10.470 -6.221 1.00 64.23 H new ATOM 0 HG3 GLU A 27 14.744 -9.055 -6.660 1.00 64.23 H new ATOM 400 N ILE A 28 10.852 -11.911 -7.288 1.00 61.24 N ATOM 401 CA ILE A 28 9.616 -12.679 -7.225 1.00 24.44 C ATOM 402 C ILE A 28 9.376 -13.258 -8.612 1.00 73.53 C ATOM 403 O ILE A 28 9.542 -12.562 -9.618 1.00 63.12 O ATOM 404 CB ILE A 28 8.448 -11.785 -6.772 1.00 40.21 C ATOM 405 CG1 ILE A 28 8.738 -11.163 -5.391 1.00 23.40 C ATOM 406 CG2 ILE A 28 7.154 -12.616 -6.724 1.00 55.02 C ATOM 407 CD1 ILE A 28 7.698 -10.121 -4.980 1.00 64.11 C ATOM 0 H ILE A 28 10.790 -11.119 -7.928 1.00 61.24 H new ATOM 0 HA ILE A 28 9.691 -13.484 -6.494 1.00 24.44 H new ATOM 0 HB ILE A 28 8.328 -10.972 -7.488 1.00 40.21 H new ATOM 0 HG12 ILE A 28 8.770 -11.953 -4.641 1.00 23.40 H new ATOM 0 HG13 ILE A 28 9.724 -10.699 -5.407 1.00 23.40 H new ATOM 0 HG21 ILE A 28 6.327 -11.983 -6.403 1.00 55.02 H new ATOM 0 HG22 ILE A 28 6.941 -13.016 -7.715 1.00 55.02 H new ATOM 0 HG23 ILE A 28 7.276 -13.439 -6.019 1.00 55.02 H new ATOM 0 HD11 ILE A 28 7.954 -9.718 -4.000 1.00 64.11 H new ATOM 0 HD12 ILE A 28 7.683 -9.313 -5.712 1.00 64.11 H new ATOM 0 HD13 ILE A 28 6.714 -10.587 -4.934 1.00 64.11 H new ATOM 418 N LYS A 29 8.968 -14.524 -8.674 1.00 63.33 N ATOM 419 CA LYS A 29 8.603 -15.147 -9.938 1.00 72.51 C ATOM 420 C LYS A 29 7.288 -14.561 -10.427 1.00 62.44 C ATOM 421 O LYS A 29 6.371 -14.326 -9.642 1.00 74.41 O ATOM 422 CB LYS A 29 8.511 -16.661 -9.758 1.00 24.32 C ATOM 423 CG LYS A 29 8.192 -17.461 -11.026 1.00 4.21 C ATOM 424 CD LYS A 29 8.460 -18.958 -10.803 1.00 63.52 C ATOM 425 CE LYS A 29 7.483 -19.857 -11.568 1.00 34.53 C ATOM 426 NZ LYS A 29 6.296 -20.215 -10.764 1.00 71.34 N ATOM 0 H LYS A 29 8.883 -15.136 -7.862 1.00 63.33 H new ATOM 0 HA LYS A 29 9.366 -14.946 -10.690 1.00 72.51 H new ATOM 0 HB2 LYS A 29 9.458 -17.019 -9.353 1.00 24.32 H new ATOM 0 HB3 LYS A 29 7.744 -16.874 -9.013 1.00 24.32 H new ATOM 0 HG2 LYS A 29 7.149 -17.310 -11.305 1.00 4.21 H new ATOM 0 HG3 LYS A 29 8.799 -17.097 -11.855 1.00 4.21 H new ATOM 0 HD2 LYS A 29 9.479 -19.190 -11.113 1.00 63.52 H new ATOM 0 HD3 LYS A 29 8.393 -19.180 -9.738 1.00 63.52 H new ATOM 0 HE2 LYS A 29 7.162 -19.349 -12.477 1.00 34.53 H new ATOM 0 HE3 LYS A 29 7.997 -20.767 -11.876 1.00 34.53 H new ATOM 0 HZ1 LYS A 29 5.667 -20.823 -11.326 1.00 71.34 H new ATOM 0 HZ2 LYS A 29 6.597 -20.724 -9.909 1.00 71.34 H new ATOM 0 HZ3 LYS A 29 5.788 -19.350 -10.491 1.00 71.34 H new ATOM 436 N ASP A 30 7.183 -14.418 -11.738 1.00 21.54 N ATOM 437 CA ASP A 30 5.997 -13.952 -12.465 1.00 1.04 C ATOM 438 C ASP A 30 5.431 -12.622 -11.919 1.00 12.45 C ATOM 439 O ASP A 30 4.227 -12.368 -11.913 1.00 50.31 O ATOM 440 CB ASP A 30 4.972 -15.100 -12.564 1.00 54.21 C ATOM 441 CG ASP A 30 4.448 -15.262 -13.991 1.00 31.13 C ATOM 442 OD1 ASP A 30 4.019 -14.279 -14.619 1.00 53.21 O ATOM 443 OD2 ASP A 30 4.538 -16.390 -14.536 1.00 54.11 O ATOM 0 H ASP A 30 7.960 -14.633 -12.363 1.00 21.54 H new ATOM 0 HA ASP A 30 6.286 -13.691 -13.483 1.00 1.04 H new ATOM 0 HB2 ASP A 30 5.435 -16.031 -12.237 1.00 54.21 H new ATOM 0 HB3 ASP A 30 4.139 -14.904 -11.889 1.00 54.21 H new ATOM 447 N SER A 31 6.303 -11.762 -11.395 1.00 44.10 N ATOM 448 CA SER A 31 6.010 -10.425 -10.932 1.00 71.21 C ATOM 449 C SER A 31 5.650 -9.455 -12.079 1.00 3.01 C ATOM 450 O SER A 31 5.911 -9.727 -13.255 1.00 54.20 O ATOM 451 CB SER A 31 7.265 -10.015 -10.155 1.00 62.24 C ATOM 452 OG SER A 31 8.436 -10.112 -10.958 1.00 11.23 O ATOM 0 H SER A 31 7.287 -12.003 -11.280 1.00 44.10 H new ATOM 0 HA SER A 31 5.119 -10.391 -10.305 1.00 71.21 H new ATOM 0 HB2 SER A 31 7.153 -8.992 -9.797 1.00 62.24 H new ATOM 0 HB3 SER A 31 7.373 -10.651 -9.276 1.00 62.24 H new ATOM 0 HG SER A 31 9.221 -9.870 -10.423 1.00 11.23 H new ATOM 457 N GLU A 32 5.084 -8.293 -11.742 1.00 74.41 N ATOM 458 CA GLU A 32 4.895 -7.096 -12.577 1.00 74.53 C ATOM 459 C GLU A 32 5.086 -5.877 -11.680 1.00 61.52 C ATOM 460 O GLU A 32 4.779 -5.939 -10.484 1.00 54.33 O ATOM 461 CB GLU A 32 3.486 -7.080 -13.206 1.00 70.54 C ATOM 462 CG GLU A 32 3.499 -7.747 -14.585 1.00 64.42 C ATOM 463 CD GLU A 32 2.140 -8.236 -15.101 1.00 65.51 C ATOM 464 OE1 GLU A 32 1.775 -9.419 -14.889 1.00 25.22 O ATOM 465 OE2 GLU A 32 1.472 -7.505 -15.868 1.00 41.30 O ATOM 0 H GLU A 32 4.715 -8.150 -10.802 1.00 74.41 H new ATOM 0 HA GLU A 32 5.616 -7.092 -13.395 1.00 74.53 H new ATOM 0 HB2 GLU A 32 2.785 -7.599 -12.552 1.00 70.54 H new ATOM 0 HB3 GLU A 32 3.135 -6.052 -13.297 1.00 70.54 H new ATOM 0 HG2 GLU A 32 3.907 -7.039 -15.306 1.00 64.42 H new ATOM 0 HG3 GLU A 32 4.181 -8.597 -14.551 1.00 64.42 H new ATOM 470 N LEU A 33 5.701 -4.808 -12.185 1.00 2.14 N ATOM 471 CA LEU A 33 5.970 -3.587 -11.451 1.00 52.41 C ATOM 472 C LEU A 33 5.337 -2.423 -12.204 1.00 42.41 C ATOM 473 O LEU A 33 5.581 -2.229 -13.398 1.00 42.42 O ATOM 474 CB LEU A 33 7.476 -3.442 -11.176 1.00 3.24 C ATOM 475 CG LEU A 33 8.378 -2.726 -12.206 1.00 60.12 C ATOM 476 CD1 LEU A 33 9.758 -2.418 -11.595 1.00 35.31 C ATOM 477 CD2 LEU A 33 8.527 -3.614 -13.440 1.00 64.20 C ATOM 0 H LEU A 33 6.034 -4.774 -13.149 1.00 2.14 H new ATOM 0 HA LEU A 33 5.514 -3.606 -10.461 1.00 52.41 H new ATOM 0 HB2 LEU A 33 7.584 -2.916 -10.227 1.00 3.24 H new ATOM 0 HB3 LEU A 33 7.879 -4.445 -11.032 1.00 3.24 H new ATOM 0 HG LEU A 33 7.919 -1.780 -12.492 1.00 60.12 H new ATOM 0 HD11 LEU A 33 10.379 -1.914 -12.335 1.00 35.31 H new ATOM 0 HD12 LEU A 33 9.635 -1.773 -10.725 1.00 35.31 H new ATOM 0 HD13 LEU A 33 10.238 -3.349 -11.292 1.00 35.31 H new ATOM 0 HD21 LEU A 33 9.162 -3.116 -14.172 1.00 64.20 H new ATOM 0 HD22 LEU A 33 8.980 -4.563 -13.153 1.00 64.20 H new ATOM 0 HD23 LEU A 33 7.545 -3.798 -13.877 1.00 64.20 H new ATOM 488 N LYS A 34 4.467 -1.686 -11.524 1.00 43.11 N ATOM 489 CA LYS A 34 3.740 -0.566 -12.098 1.00 45.15 C ATOM 490 C LYS A 34 3.773 0.558 -11.086 1.00 53.02 C ATOM 491 O LYS A 34 4.107 0.353 -9.918 1.00 74.45 O ATOM 492 CB LYS A 34 2.295 -0.978 -12.436 1.00 34.21 C ATOM 493 CG LYS A 34 2.179 -2.078 -13.505 1.00 12.45 C ATOM 494 CD LYS A 34 2.591 -1.696 -14.937 1.00 74.44 C ATOM 495 CE LYS A 34 1.386 -1.249 -15.780 1.00 25.15 C ATOM 496 NZ LYS A 34 1.720 -1.175 -17.222 1.00 21.54 N ATOM 0 H LYS A 34 4.245 -1.854 -10.543 1.00 43.11 H new ATOM 0 HA LYS A 34 4.200 -0.240 -13.031 1.00 45.15 H new ATOM 0 HB2 LYS A 34 1.806 -1.322 -11.525 1.00 34.21 H new ATOM 0 HB3 LYS A 34 1.750 -0.098 -12.778 1.00 34.21 H new ATOM 0 HG2 LYS A 34 2.789 -2.924 -13.190 1.00 12.45 H new ATOM 0 HG3 LYS A 34 1.145 -2.422 -13.529 1.00 12.45 H new ATOM 0 HD2 LYS A 34 3.327 -0.893 -14.901 1.00 74.44 H new ATOM 0 HD3 LYS A 34 3.073 -2.548 -15.416 1.00 74.44 H new ATOM 0 HE2 LYS A 34 0.561 -1.946 -15.633 1.00 25.15 H new ATOM 0 HE3 LYS A 34 1.044 -0.273 -15.436 1.00 25.15 H new ATOM 0 HZ1 LYS A 34 0.882 -0.870 -17.757 1.00 21.54 H new ATOM 0 HZ2 LYS A 34 2.490 -0.491 -17.365 1.00 21.54 H new ATOM 0 HZ3 LYS A 34 2.023 -2.112 -17.557 1.00 21.54 H new ATOM 506 N GLU A 35 3.405 1.752 -11.520 1.00 61.35 N ATOM 507 CA GLU A 35 3.489 2.924 -10.667 1.00 42.02 C ATOM 508 C GLU A 35 2.110 3.525 -10.459 1.00 3.24 C ATOM 509 O GLU A 35 1.244 3.440 -11.337 1.00 74.34 O ATOM 510 CB GLU A 35 4.493 3.924 -11.237 1.00 15.40 C ATOM 511 CG GLU A 35 3.891 4.747 -12.378 1.00 13.04 C ATOM 512 CD GLU A 35 4.933 5.651 -12.996 1.00 41.22 C ATOM 513 OE1 GLU A 35 5.453 6.493 -12.232 1.00 71.24 O ATOM 514 OE2 GLU A 35 5.176 5.519 -14.219 1.00 42.22 O ATOM 0 H GLU A 35 3.046 1.934 -12.457 1.00 61.35 H new ATOM 0 HA GLU A 35 3.858 2.633 -9.683 1.00 42.02 H new ATOM 0 HB2 GLU A 35 4.829 4.593 -10.445 1.00 15.40 H new ATOM 0 HB3 GLU A 35 5.372 3.390 -11.598 1.00 15.40 H new ATOM 0 HG2 GLU A 35 3.485 4.080 -13.138 1.00 13.04 H new ATOM 0 HG3 GLU A 35 3.061 5.345 -12.002 1.00 13.04 H new ATOM 519 N VAL A 36 1.926 4.184 -9.321 1.00 23.10 N ATOM 520 CA VAL A 36 0.660 4.788 -8.935 1.00 63.35 C ATOM 521 C VAL A 36 0.829 6.316 -8.959 1.00 31.22 C ATOM 522 O VAL A 36 1.955 6.808 -8.823 1.00 25.44 O ATOM 523 CB VAL A 36 0.207 4.136 -7.605 1.00 62.52 C ATOM 524 CG1 VAL A 36 0.944 4.456 -6.336 1.00 45.24 C ATOM 525 CG2 VAL A 36 -1.300 4.291 -7.382 1.00 43.25 C ATOM 0 H VAL A 36 2.665 4.315 -8.631 1.00 23.10 H new ATOM 0 HA VAL A 36 -0.162 4.599 -9.626 1.00 63.35 H new ATOM 0 HB VAL A 36 0.490 3.100 -7.791 1.00 62.52 H new ATOM 0 HG11 VAL A 36 0.492 3.913 -5.506 1.00 45.24 H new ATOM 0 HG12 VAL A 36 1.988 4.161 -6.437 1.00 45.24 H new ATOM 0 HG13 VAL A 36 0.887 5.527 -6.142 1.00 45.24 H new ATOM 0 HG21 VAL A 36 -1.579 3.821 -6.439 1.00 43.25 H new ATOM 0 HG22 VAL A 36 -1.556 5.350 -7.349 1.00 43.25 H new ATOM 0 HG23 VAL A 36 -1.840 3.813 -8.199 1.00 43.25 H new ATOM 535 N LYS A 37 -0.243 7.087 -9.176 1.00 64.42 N ATOM 536 CA LYS A 37 -0.233 8.550 -9.100 1.00 3.43 C ATOM 537 C LYS A 37 -1.328 8.985 -8.136 1.00 70.13 C ATOM 538 O LYS A 37 -2.201 8.183 -7.802 1.00 4.23 O ATOM 539 CB LYS A 37 -0.483 9.133 -10.498 1.00 63.15 C ATOM 540 CG LYS A 37 0.714 8.981 -11.444 1.00 5.34 C ATOM 541 CD LYS A 37 0.280 9.266 -12.889 1.00 74.33 C ATOM 542 CE LYS A 37 1.462 9.629 -13.790 1.00 10.43 C ATOM 543 NZ LYS A 37 1.986 10.976 -13.480 1.00 43.22 N ATOM 0 H LYS A 37 -1.158 6.703 -9.414 1.00 64.42 H new ATOM 0 HA LYS A 37 0.731 8.911 -8.743 1.00 3.43 H new ATOM 0 HB2 LYS A 37 -1.350 8.641 -10.939 1.00 63.15 H new ATOM 0 HB3 LYS A 37 -0.730 10.190 -10.404 1.00 63.15 H new ATOM 0 HG2 LYS A 37 1.508 9.668 -11.152 1.00 5.34 H new ATOM 0 HG3 LYS A 37 1.121 7.973 -11.370 1.00 5.34 H new ATOM 0 HD2 LYS A 37 -0.226 8.390 -13.293 1.00 74.33 H new ATOM 0 HD3 LYS A 37 -0.442 10.082 -12.895 1.00 74.33 H new ATOM 0 HE2 LYS A 37 2.255 8.892 -13.666 1.00 10.43 H new ATOM 0 HE3 LYS A 37 1.151 9.590 -14.834 1.00 10.43 H new ATOM 0 HZ1 LYS A 37 2.617 11.288 -14.246 1.00 43.22 H new ATOM 0 HZ2 LYS A 37 1.194 11.644 -13.390 1.00 43.22 H new ATOM 0 HZ3 LYS A 37 2.516 10.945 -12.586 1.00 43.22 H new ATOM 553 N VAL A 38 -1.333 10.247 -7.719 1.00 14.23 N ATOM 554 CA VAL A 38 -2.447 10.820 -6.967 1.00 62.15 C ATOM 555 C VAL A 38 -3.385 11.548 -7.935 1.00 32.31 C ATOM 556 O VAL A 38 -2.969 11.977 -9.011 1.00 52.12 O ATOM 557 CB VAL A 38 -1.972 11.729 -5.811 1.00 51.42 C ATOM 558 CG1 VAL A 38 -1.804 10.891 -4.541 1.00 41.33 C ATOM 559 CG2 VAL A 38 -0.671 12.486 -6.103 1.00 65.41 C ATOM 0 H VAL A 38 -0.569 10.900 -7.891 1.00 14.23 H new ATOM 0 HA VAL A 38 -2.998 10.011 -6.487 1.00 62.15 H new ATOM 0 HB VAL A 38 -2.743 12.489 -5.682 1.00 51.42 H new ATOM 0 HG11 VAL A 38 -1.469 11.531 -3.725 1.00 41.33 H new ATOM 0 HG12 VAL A 38 -2.758 10.435 -4.277 1.00 41.33 H new ATOM 0 HG13 VAL A 38 -1.065 10.109 -4.716 1.00 41.33 H new ATOM 0 HG21 VAL A 38 -0.407 13.101 -5.243 1.00 65.41 H new ATOM 0 HG22 VAL A 38 0.129 11.772 -6.299 1.00 65.41 H new ATOM 0 HG23 VAL A 38 -0.809 13.124 -6.976 1.00 65.41 H new ATOM 569 N SER A 39 -4.647 11.684 -7.548 1.00 50.31 N ATOM 570 CA SER A 39 -5.645 12.532 -8.177 1.00 12.43 C ATOM 571 C SER A 39 -5.598 13.932 -7.532 1.00 13.31 C ATOM 572 O SER A 39 -4.701 14.236 -6.738 1.00 54.23 O ATOM 573 CB SER A 39 -6.993 11.839 -7.954 1.00 50.45 C ATOM 574 OG SER A 39 -7.957 12.196 -8.916 1.00 41.11 O ATOM 0 H SER A 39 -5.019 11.178 -6.744 1.00 50.31 H new ATOM 0 HA SER A 39 -5.471 12.669 -9.244 1.00 12.43 H new ATOM 0 HB2 SER A 39 -6.849 10.759 -7.975 1.00 50.45 H new ATOM 0 HB3 SER A 39 -7.366 12.092 -6.962 1.00 50.45 H new ATOM 0 HG SER A 39 -8.071 11.460 -9.553 1.00 41.11 H new ATOM 770 N ALA A 54 4.257 15.953 6.378 1.00 54.24 N ATOM 771 CA ALA A 54 3.918 15.752 7.789 1.00 31.51 C ATOM 772 C ALA A 54 2.409 15.779 8.026 1.00 35.23 C ATOM 773 O ALA A 54 1.808 14.737 8.256 1.00 40.34 O ATOM 774 CB ALA A 54 4.623 16.801 8.661 1.00 2.01 C ATOM 0 HA ALA A 54 4.270 14.760 8.073 1.00 31.51 H new ATOM 0 HB1 ALA A 54 4.362 16.640 9.707 1.00 2.01 H new ATOM 0 HB2 ALA A 54 5.702 16.710 8.538 1.00 2.01 H new ATOM 0 HB3 ALA A 54 4.306 17.799 8.358 1.00 2.01 H new ATOM 780 N LEU A 55 1.809 16.972 8.034 1.00 43.05 N ATOM 781 CA LEU A 55 0.433 17.246 8.418 1.00 60.14 C ATOM 782 C LEU A 55 -0.540 17.252 7.242 1.00 44.15 C ATOM 783 O LEU A 55 -1.662 17.722 7.422 1.00 1.43 O ATOM 784 CB LEU A 55 0.454 18.620 9.115 1.00 32.22 C ATOM 785 CG LEU A 55 0.362 18.565 10.634 1.00 61.44 C ATOM 786 CD1 LEU A 55 -1.070 18.288 11.086 1.00 13.53 C ATOM 787 CD2 LEU A 55 1.287 17.559 11.320 1.00 20.40 C ATOM 0 H LEU A 55 2.305 17.819 7.755 1.00 43.05 H new ATOM 0 HA LEU A 55 0.071 16.452 9.071 1.00 60.14 H new ATOM 0 HB2 LEU A 55 1.372 19.138 8.839 1.00 32.22 H new ATOM 0 HB3 LEU A 55 -0.375 19.217 8.736 1.00 32.22 H new ATOM 0 HG LEU A 55 0.698 19.554 10.945 1.00 61.44 H new ATOM 0 HD11 LEU A 55 -1.108 18.254 12.175 1.00 13.53 H new ATOM 0 HD12 LEU A 55 -1.725 19.081 10.725 1.00 13.53 H new ATOM 0 HD13 LEU A 55 -1.401 17.331 10.681 1.00 13.53 H new ATOM 0 HD21 LEU A 55 1.138 17.605 12.399 1.00 20.40 H new ATOM 0 HD22 LEU A 55 1.059 16.554 10.965 1.00 20.40 H new ATOM 0 HD23 LEU A 55 2.324 17.800 11.086 1.00 20.40 H new ATOM 798 N ASP A 56 -0.129 16.792 6.057 1.00 62.45 N ATOM 799 CA ASP A 56 -0.833 17.053 4.801 1.00 13.53 C ATOM 800 C ASP A 56 -2.318 16.712 4.887 1.00 62.02 C ATOM 801 O ASP A 56 -3.142 17.627 4.912 1.00 53.55 O ATOM 802 CB ASP A 56 -0.174 16.349 3.618 1.00 0.11 C ATOM 803 CG ASP A 56 -0.952 16.700 2.348 1.00 62.22 C ATOM 804 OD1 ASP A 56 -0.929 17.898 1.972 1.00 41.32 O ATOM 805 OD2 ASP A 56 -1.620 15.797 1.803 1.00 51.12 O ATOM 0 H ASP A 56 0.710 16.223 5.943 1.00 62.45 H new ATOM 0 HA ASP A 56 -0.758 18.126 4.627 1.00 13.53 H new ATOM 0 HB2 ASP A 56 0.866 16.661 3.523 1.00 0.11 H new ATOM 0 HB3 ASP A 56 -0.170 15.270 3.774 1.00 0.11 H new ATOM 809 N GLN A 57 -2.666 15.430 5.013 1.00 43.54 N ATOM 810 CA GLN A 57 -4.044 14.966 5.082 1.00 53.15 C ATOM 811 C GLN A 57 -4.200 14.051 6.287 1.00 1.44 C ATOM 812 O GLN A 57 -4.015 12.843 6.191 1.00 22.14 O ATOM 813 CB GLN A 57 -4.433 14.302 3.758 1.00 43.44 C ATOM 814 CG GLN A 57 -5.931 14.372 3.452 1.00 50.14 C ATOM 815 CD GLN A 57 -6.872 13.718 4.473 1.00 4.41 C ATOM 816 OE1 GLN A 57 -6.620 12.668 5.049 1.00 30.02 O ATOM 817 NE2 GLN A 57 -8.004 14.341 4.741 1.00 52.43 N ATOM 0 H GLN A 57 -1.982 14.675 5.071 1.00 43.54 H new ATOM 0 HA GLN A 57 -4.731 15.800 5.221 1.00 53.15 H new ATOM 0 HB2 GLN A 57 -3.883 14.779 2.947 1.00 43.44 H new ATOM 0 HB3 GLN A 57 -4.124 13.257 3.781 1.00 43.44 H new ATOM 0 HG2 GLN A 57 -6.210 15.421 3.355 1.00 50.14 H new ATOM 0 HG3 GLN A 57 -6.103 13.905 2.482 1.00 50.14 H new ATOM 0 HE21 GLN A 57 -8.228 15.217 4.269 1.00 52.43 H new ATOM 0 HE22 GLN A 57 -8.655 13.947 5.420 1.00 52.43 H new ATOM 824 N ILE A 58 -4.492 14.650 7.439 1.00 61.35 N ATOM 825 CA ILE A 58 -4.702 13.950 8.699 1.00 60.21 C ATOM 826 C ILE A 58 -5.797 14.687 9.460 1.00 40.34 C ATOM 827 O ILE A 58 -6.849 14.125 9.773 1.00 22.22 O ATOM 828 CB ILE A 58 -3.378 13.895 9.504 1.00 64.04 C ATOM 829 CG1 ILE A 58 -2.336 12.979 8.819 1.00 75.03 C ATOM 830 CG2 ILE A 58 -3.617 13.446 10.956 1.00 34.10 C ATOM 831 CD1 ILE A 58 -1.251 13.782 8.108 1.00 34.42 C ATOM 0 H ILE A 58 -4.591 15.662 7.522 1.00 61.35 H new ATOM 0 HA ILE A 58 -5.012 12.919 8.528 1.00 60.21 H new ATOM 0 HB ILE A 58 -2.977 14.908 9.526 1.00 64.04 H new ATOM 0 HG12 ILE A 58 -1.877 12.330 9.565 1.00 75.03 H new ATOM 0 HG13 ILE A 58 -2.839 12.332 8.100 1.00 75.03 H new ATOM 0 HG21 ILE A 58 -2.667 13.419 11.490 1.00 34.10 H new ATOM 0 HG22 ILE A 58 -4.290 14.148 11.448 1.00 34.10 H new ATOM 0 HG23 ILE A 58 -4.064 12.452 10.961 1.00 34.10 H new ATOM 0 HD11 ILE A 58 -0.541 13.100 7.641 1.00 34.42 H new ATOM 0 HD12 ILE A 58 -1.706 14.411 7.343 1.00 34.42 H new ATOM 0 HD13 ILE A 58 -0.730 14.409 8.831 1.00 34.42 H new ATOM 842 N GLN A 59 -5.540 15.953 9.796 1.00 31.04 N ATOM 843 CA GLN A 59 -6.312 16.712 10.743 1.00 2.52 C ATOM 844 C GLN A 59 -6.737 18.027 10.123 1.00 44.31 C ATOM 845 O GLN A 59 -5.932 18.941 9.901 1.00 60.02 O ATOM 846 CB GLN A 59 -5.590 16.873 12.079 1.00 64.41 C ATOM 847 CG GLN A 59 -4.077 17.109 12.051 1.00 60.31 C ATOM 848 CD GLN A 59 -3.505 17.319 13.456 1.00 1.14 C ATOM 849 OE1 GLN A 59 -3.161 18.437 13.833 1.00 22.11 O ATOM 850 NE2 GLN A 59 -3.359 16.272 14.254 1.00 22.31 N ATOM 0 H GLN A 59 -4.763 16.480 9.397 1.00 31.04 H new ATOM 0 HA GLN A 59 -7.219 16.157 10.983 1.00 2.52 H new ATOM 0 HB2 GLN A 59 -6.049 17.708 12.609 1.00 64.41 H new ATOM 0 HB3 GLN A 59 -5.778 15.977 12.671 1.00 64.41 H new ATOM 0 HG2 GLN A 59 -3.585 16.256 11.583 1.00 60.31 H new ATOM 0 HG3 GLN A 59 -3.857 17.981 11.436 1.00 60.31 H new ATOM 0 HE21 GLN A 59 -3.646 15.346 13.938 1.00 22.31 H new ATOM 0 HE22 GLN A 59 -2.960 16.392 15.185 1.00 22.31 H new ATOM 857 N GLY A 60 -8.029 18.092 9.820 1.00 73.32 N ATOM 858 CA GLY A 60 -8.686 19.271 9.313 1.00 54.54 C ATOM 859 C GLY A 60 -8.701 19.296 7.794 1.00 70.33 C ATOM 860 O GLY A 60 -9.502 20.054 7.255 1.00 52.52 O ATOM 0 H GLY A 60 -8.659 17.297 9.927 1.00 73.32 H new ATOM 0 HA2 GLY A 60 -9.709 19.307 9.688 1.00 54.54 H new ATOM 0 HA3 GLY A 60 -8.178 20.160 9.687 1.00 54.54 H new ATOM 864 N ASN A 61 -7.867 18.507 7.100 1.00 3.42 N ATOM 865 CA ASN A 61 -7.840 18.601 5.621 1.00 22.42 C ATOM 866 C ASN A 61 -9.109 17.976 5.007 1.00 62.13 C ATOM 867 O ASN A 61 -9.782 17.159 5.644 1.00 65.01 O ATOM 868 CB ASN A 61 -6.537 18.038 5.028 1.00 30.22 C ATOM 869 CG ASN A 61 -6.249 18.502 3.590 1.00 12.40 C ATOM 870 OD1 ASN A 61 -6.994 19.276 2.990 1.00 53.15 O ATOM 871 ND2 ASN A 61 -5.144 18.071 3.011 1.00 63.05 N ATOM 0 H ASN A 61 -7.228 17.825 7.509 1.00 3.42 H new ATOM 0 HA ASN A 61 -7.847 19.657 5.350 1.00 22.42 H new ATOM 0 HB2 ASN A 61 -5.704 18.331 5.667 1.00 30.22 H new ATOM 0 HB3 ASN A 61 -6.584 16.949 5.044 1.00 30.22 H new ATOM 0 HD21 ASN A 61 -4.909 18.380 2.068 1.00 63.05 H new ATOM 0 HD22 ASN A 61 -4.525 17.429 3.507 1.00 63.05 H new ATOM 877 N LYS A 62 -9.485 18.394 3.796 1.00 44.55 N ATOM 878 CA LYS A 62 -10.768 18.111 3.149 1.00 25.42 C ATOM 879 C LYS A 62 -10.707 16.764 2.417 1.00 34.10 C ATOM 880 O LYS A 62 -10.633 16.739 1.190 1.00 14.23 O ATOM 881 CB LYS A 62 -11.120 19.225 2.141 1.00 14.52 C ATOM 882 CG LYS A 62 -11.706 20.539 2.670 1.00 14.11 C ATOM 883 CD LYS A 62 -10.752 21.361 3.544 1.00 23.43 C ATOM 884 CE LYS A 62 -10.913 21.065 5.033 1.00 41.55 C ATOM 885 NZ LYS A 62 -12.227 21.472 5.570 1.00 13.40 N ATOM 0 H LYS A 62 -8.874 18.966 3.213 1.00 44.55 H new ATOM 0 HA LYS A 62 -11.538 18.069 3.920 1.00 25.42 H new ATOM 0 HB2 LYS A 62 -10.213 19.467 1.586 1.00 14.52 H new ATOM 0 HB3 LYS A 62 -11.830 18.811 1.426 1.00 14.52 H new ATOM 0 HG2 LYS A 62 -12.017 21.149 1.822 1.00 14.11 H new ATOM 0 HG3 LYS A 62 -12.603 20.314 3.247 1.00 14.11 H new ATOM 0 HD2 LYS A 62 -9.724 21.154 3.246 1.00 23.43 H new ATOM 0 HD3 LYS A 62 -10.928 22.422 3.368 1.00 23.43 H new ATOM 0 HE2 LYS A 62 -10.774 19.997 5.201 1.00 41.55 H new ATOM 0 HE3 LYS A 62 -10.127 21.579 5.586 1.00 41.55 H new ATOM 0 HZ1 LYS A 62 -12.157 21.600 6.600 1.00 13.40 H new ATOM 0 HZ2 LYS A 62 -12.520 22.367 5.129 1.00 13.40 H new ATOM 0 HZ3 LYS A 62 -12.931 20.736 5.360 1.00 13.40 H new ATOM 895 N ASP A 63 -10.762 15.655 3.157 1.00 50.55 N ATOM 896 CA ASP A 63 -10.589 14.298 2.610 1.00 31.41 C ATOM 897 C ASP A 63 -9.248 14.207 1.868 1.00 30.12 C ATOM 898 O ASP A 63 -8.414 15.116 1.972 1.00 71.04 O ATOM 899 CB ASP A 63 -11.769 13.853 1.714 1.00 34.00 C ATOM 900 CG ASP A 63 -13.129 14.003 2.381 1.00 53.43 C ATOM 901 OD1 ASP A 63 -13.434 13.201 3.287 1.00 45.32 O ATOM 902 OD2 ASP A 63 -13.846 14.983 2.062 1.00 4.21 O ATOM 0 H ASP A 63 -10.929 15.668 4.163 1.00 50.55 H new ATOM 0 HA ASP A 63 -10.581 13.602 3.448 1.00 31.41 H new ATOM 0 HB2 ASP A 63 -11.758 14.439 0.795 1.00 34.00 H new ATOM 0 HB3 ASP A 63 -11.626 12.811 1.430 1.00 34.00 H new ATOM 906 N PHE A 64 -9.002 13.111 1.156 1.00 2.52 N ATOM 907 CA PHE A 64 -7.828 12.913 0.314 1.00 5.40 C ATOM 908 C PHE A 64 -8.269 12.755 -1.147 1.00 64.32 C ATOM 909 O PHE A 64 -9.431 12.409 -1.413 1.00 72.33 O ATOM 910 CB PHE A 64 -7.012 11.698 0.795 1.00 64.25 C ATOM 911 CG PHE A 64 -7.833 10.520 1.257 1.00 11.34 C ATOM 912 CD1 PHE A 64 -8.520 9.741 0.317 1.00 25.20 C ATOM 913 CD2 PHE A 64 -7.938 10.235 2.627 1.00 21.21 C ATOM 914 CE1 PHE A 64 -9.341 8.686 0.750 1.00 70.34 C ATOM 915 CE2 PHE A 64 -8.761 9.185 3.061 1.00 14.13 C ATOM 916 CZ PHE A 64 -9.486 8.427 2.124 1.00 24.03 C ATOM 0 H PHE A 64 -9.635 12.311 1.150 1.00 2.52 H new ATOM 0 HA PHE A 64 -7.178 13.785 0.386 1.00 5.40 H new ATOM 0 HB2 PHE A 64 -6.362 11.372 -0.017 1.00 64.25 H new ATOM 0 HB3 PHE A 64 -6.366 12.015 1.614 1.00 64.25 H new ATOM 0 HD1 PHE A 64 -8.419 9.951 -0.738 1.00 25.20 H new ATOM 0 HD2 PHE A 64 -7.386 10.823 3.346 1.00 21.21 H new ATOM 0 HE1 PHE A 64 -9.860 8.074 0.027 1.00 70.34 H new ATOM 0 HE2 PHE A 64 -8.838 8.959 4.114 1.00 14.13 H new ATOM 0 HZ PHE A 64 -10.153 7.647 2.460 1.00 24.03 H new ATOM 925 N PRO A 65 -7.363 13.006 -2.104 1.00 62.32 N ATOM 926 CA PRO A 65 -7.590 12.723 -3.504 1.00 12.13 C ATOM 927 C PRO A 65 -7.752 11.219 -3.703 1.00 73.22 C ATOM 928 O PRO A 65 -7.342 10.423 -2.858 1.00 10.14 O ATOM 929 CB PRO A 65 -6.388 13.292 -4.257 1.00 14.40 C ATOM 930 CG PRO A 65 -5.284 13.368 -3.213 1.00 54.45 C ATOM 931 CD PRO A 65 -6.041 13.556 -1.900 1.00 22.01 C ATOM 0 HA PRO A 65 -8.505 13.180 -3.881 1.00 12.13 H new ATOM 0 HB2 PRO A 65 -6.102 12.650 -5.091 1.00 14.40 H new ATOM 0 HB3 PRO A 65 -6.609 14.275 -4.673 1.00 14.40 H new ATOM 0 HG2 PRO A 65 -4.681 12.460 -3.201 1.00 54.45 H new ATOM 0 HG3 PRO A 65 -4.606 14.199 -3.407 1.00 54.45 H new ATOM 0 HD2 PRO A 65 -5.531 13.047 -1.082 1.00 22.01 H new ATOM 0 HD3 PRO A 65 -6.097 14.611 -1.633 1.00 22.01 H new ATOM 936 N GLU A 66 -8.280 10.823 -4.857 1.00 62.13 N ATOM 937 CA GLU A 66 -8.142 9.451 -5.312 1.00 61.44 C ATOM 938 C GLU A 66 -6.674 9.187 -5.666 1.00 21.54 C ATOM 939 O GLU A 66 -5.801 10.058 -5.548 1.00 73.11 O ATOM 940 CB GLU A 66 -9.094 9.163 -6.490 1.00 73.01 C ATOM 941 CG GLU A 66 -10.514 8.844 -6.001 1.00 25.01 C ATOM 942 CD GLU A 66 -11.102 7.638 -6.738 1.00 30.03 C ATOM 943 OE1 GLU A 66 -10.832 6.481 -6.350 1.00 61.41 O ATOM 944 OE2 GLU A 66 -11.918 7.837 -7.661 1.00 74.15 O ATOM 0 H GLU A 66 -8.803 11.431 -5.488 1.00 62.13 H new ATOM 0 HA GLU A 66 -8.429 8.766 -4.514 1.00 61.44 H new ATOM 0 HB2 GLU A 66 -9.122 10.026 -7.155 1.00 73.01 H new ATOM 0 HB3 GLU A 66 -8.711 8.324 -7.072 1.00 73.01 H new ATOM 0 HG2 GLU A 66 -10.495 8.643 -4.930 1.00 25.01 H new ATOM 0 HG3 GLU A 66 -11.156 9.712 -6.151 1.00 25.01 H new ATOM 949 N ILE A 67 -6.385 7.981 -6.131 1.00 12.42 N ATOM 950 CA ILE A 67 -5.196 7.678 -6.898 1.00 73.41 C ATOM 951 C ILE A 67 -5.606 7.474 -8.345 1.00 22.50 C ATOM 952 O ILE A 67 -6.744 7.101 -8.641 1.00 1.02 O ATOM 953 CB ILE A 67 -4.489 6.442 -6.326 1.00 32.54 C ATOM 954 CG1 ILE A 67 -5.412 5.207 -6.232 1.00 11.40 C ATOM 955 CG2 ILE A 67 -3.899 6.811 -4.958 1.00 43.42 C ATOM 956 CD1 ILE A 67 -5.305 4.260 -7.415 1.00 65.22 C ATOM 0 H ILE A 67 -6.987 7.171 -5.980 1.00 12.42 H new ATOM 0 HA ILE A 67 -4.484 8.502 -6.841 1.00 73.41 H new ATOM 0 HB ILE A 67 -3.693 6.151 -7.011 1.00 32.54 H new ATOM 0 HG12 ILE A 67 -5.176 4.659 -5.320 1.00 11.40 H new ATOM 0 HG13 ILE A 67 -6.445 5.545 -6.143 1.00 11.40 H new ATOM 0 HG21 ILE A 67 -3.392 5.944 -4.535 1.00 43.42 H new ATOM 0 HG22 ILE A 67 -3.186 7.626 -5.077 1.00 43.42 H new ATOM 0 HG23 ILE A 67 -4.700 7.125 -4.289 1.00 43.42 H new ATOM 0 HD11 ILE A 67 -5.985 3.420 -7.271 1.00 65.22 H new ATOM 0 HD12 ILE A 67 -5.571 4.789 -8.330 1.00 65.22 H new ATOM 0 HD13 ILE A 67 -4.283 3.890 -7.494 1.00 65.22 H new ATOM 967 N GLN A 68 -4.636 7.662 -9.223 1.00 1.02 N ATOM 968 CA GLN A 68 -4.716 7.303 -10.617 1.00 61.33 C ATOM 969 C GLN A 68 -3.695 6.211 -10.881 1.00 41.01 C ATOM 970 O GLN A 68 -2.711 6.061 -10.150 1.00 45.05 O ATOM 971 CB GLN A 68 -4.436 8.534 -11.480 1.00 65.23 C ATOM 972 CG GLN A 68 -5.552 9.595 -11.500 1.00 22.23 C ATOM 973 CD GLN A 68 -6.983 9.073 -11.355 1.00 32.53 C ATOM 974 OE1 GLN A 68 -7.747 9.585 -10.401 1.00 24.53 O flip ATOM 975 NE2 GLN A 68 -7.437 8.241 -12.130 1.00 30.30 N flip ATOM 0 H GLN A 68 -3.742 8.084 -8.970 1.00 1.02 H new ATOM 0 HA GLN A 68 -5.712 6.937 -10.867 1.00 61.33 H new ATOM 0 HB2 GLN A 68 -3.518 9.003 -11.126 1.00 65.23 H new ATOM 0 HB3 GLN A 68 -4.252 8.205 -12.503 1.00 65.23 H new ATOM 0 HG2 GLN A 68 -5.363 10.306 -10.695 1.00 22.23 H new ATOM 0 HG3 GLN A 68 -5.482 10.148 -12.437 1.00 22.23 H new ATOM 0 HE21 GLN A 68 -6.845 7.850 -12.863 1.00 30.30 H new ATOM 0 HE22 GLN A 68 -8.407 7.939 -12.043 1.00 30.30 H new ATOM 982 N LEU A 69 -3.941 5.446 -11.935 1.00 51.12 N ATOM 983 CA LEU A 69 -3.134 4.318 -12.360 1.00 44.42 C ATOM 984 C LEU A 69 -3.542 3.940 -13.782 1.00 14.41 C ATOM 985 O LEU A 69 -4.339 4.633 -14.414 1.00 54.34 O ATOM 986 CB LEU A 69 -3.251 3.134 -11.374 1.00 30.13 C ATOM 987 CG LEU A 69 -4.444 2.180 -11.551 1.00 31.45 C ATOM 988 CD1 LEU A 69 -4.369 1.049 -10.521 1.00 62.13 C ATOM 989 CD2 LEU A 69 -5.775 2.925 -11.406 1.00 51.25 C ATOM 0 H LEU A 69 -4.745 5.604 -12.542 1.00 51.12 H new ATOM 0 HA LEU A 69 -2.080 4.595 -12.360 1.00 44.42 H new ATOM 0 HB2 LEU A 69 -2.336 2.546 -11.444 1.00 30.13 H new ATOM 0 HB3 LEU A 69 -3.292 3.540 -10.363 1.00 30.13 H new ATOM 0 HG LEU A 69 -4.394 1.761 -12.556 1.00 31.45 H new ATOM 0 HD11 LEU A 69 -5.218 0.379 -10.654 1.00 62.13 H new ATOM 0 HD12 LEU A 69 -3.442 0.492 -10.659 1.00 62.13 H new ATOM 0 HD13 LEU A 69 -4.393 1.470 -9.516 1.00 62.13 H new ATOM 0 HD21 LEU A 69 -6.600 2.225 -11.536 1.00 51.25 H new ATOM 0 HD22 LEU A 69 -5.834 3.375 -10.415 1.00 51.25 H new ATOM 0 HD23 LEU A 69 -5.839 3.706 -12.164 1.00 51.25 H new ATOM 1000 N ASP A 70 -2.967 2.849 -14.272 1.00 74.24 N ATOM 1001 CA ASP A 70 -3.071 2.376 -15.641 1.00 54.20 C ATOM 1002 C ASP A 70 -3.975 1.141 -15.721 1.00 1.24 C ATOM 1003 O ASP A 70 -4.494 0.673 -14.703 1.00 2.22 O ATOM 1004 CB ASP A 70 -1.652 2.063 -16.111 1.00 4.12 C ATOM 1005 CG ASP A 70 -1.353 2.703 -17.465 1.00 63.32 C ATOM 1006 OD1 ASP A 70 -0.947 3.890 -17.502 1.00 11.31 O ATOM 1007 OD2 ASP A 70 -1.478 1.993 -18.486 1.00 65.44 O ATOM 0 H ASP A 70 -2.387 2.241 -13.694 1.00 74.24 H new ATOM 0 HA ASP A 70 -3.524 3.131 -16.283 1.00 54.20 H new ATOM 0 HB2 ASP A 70 -0.936 2.423 -15.372 1.00 4.12 H new ATOM 0 HB3 ASP A 70 -1.522 0.983 -16.182 1.00 4.12 H new ATOM 1011 N ASN A 71 -4.175 0.588 -16.919 1.00 14.35 N ATOM 1012 CA ASN A 71 -5.136 -0.496 -17.130 1.00 71.14 C ATOM 1013 C ASN A 71 -4.547 -1.833 -16.690 1.00 12.05 C ATOM 1014 O ASN A 71 -4.067 -2.633 -17.501 1.00 64.24 O ATOM 1015 CB ASN A 71 -5.630 -0.571 -18.573 1.00 43.24 C ATOM 1016 CG ASN A 71 -6.910 -1.400 -18.656 1.00 43.12 C ATOM 1017 OD1 ASN A 71 -6.868 -2.689 -18.364 1.00 24.43 O flip ATOM 1018 ND2 ASN A 71 -7.969 -0.876 -18.996 1.00 50.30 N flip ATOM 0 H ASN A 71 -3.680 0.876 -17.763 1.00 14.35 H new ATOM 0 HA ASN A 71 -6.005 -0.273 -16.511 1.00 71.14 H new ATOM 0 HB2 ASN A 71 -5.815 0.434 -18.953 1.00 43.24 H new ATOM 0 HB3 ASN A 71 -4.860 -1.015 -19.205 1.00 43.24 H new ATOM 0 HD21 ASN A 71 -7.997 0.119 -19.220 1.00 50.30 H new ATOM 0 HD22 ASN A 71 -8.820 -1.436 -19.054 1.00 50.30 H new ATOM 1024 N ILE A 72 -4.595 -2.060 -15.394 1.00 3.05 N ATOM 1025 CA ILE A 72 -4.266 -3.288 -14.689 1.00 62.42 C ATOM 1026 C ILE A 72 -5.607 -3.903 -14.297 1.00 41.24 C ATOM 1027 O ILE A 72 -6.639 -3.225 -14.307 1.00 13.24 O ATOM 1028 CB ILE A 72 -3.387 -2.933 -13.465 1.00 24.43 C ATOM 1029 CG1 ILE A 72 -2.092 -2.212 -13.926 1.00 10.23 C ATOM 1030 CG2 ILE A 72 -2.981 -4.140 -12.601 1.00 65.23 C ATOM 1031 CD1 ILE A 72 -1.471 -1.354 -12.831 1.00 70.44 C ATOM 0 H ILE A 72 -4.891 -1.328 -14.748 1.00 3.05 H new ATOM 0 HA ILE A 72 -3.696 -4.000 -15.286 1.00 62.42 H new ATOM 0 HB ILE A 72 -4.010 -2.287 -12.846 1.00 24.43 H new ATOM 0 HG12 ILE A 72 -1.365 -2.955 -14.255 1.00 10.23 H new ATOM 0 HG13 ILE A 72 -2.318 -1.585 -14.788 1.00 10.23 H new ATOM 0 HG21 ILE A 72 -2.367 -3.800 -11.767 1.00 65.23 H new ATOM 0 HG22 ILE A 72 -3.876 -4.630 -12.217 1.00 65.23 H new ATOM 0 HG23 ILE A 72 -2.412 -4.846 -13.206 1.00 65.23 H new ATOM 0 HD11 ILE A 72 -0.569 -0.875 -13.212 1.00 70.44 H new ATOM 0 HD12 ILE A 72 -2.183 -0.590 -12.519 1.00 70.44 H new ATOM 0 HD13 ILE A 72 -1.216 -1.982 -11.977 1.00 70.44 H new ATOM 1042 N ASP A 73 -5.603 -5.171 -13.911 1.00 44.43 N ATOM 1043 CA ASP A 73 -6.714 -5.759 -13.193 1.00 2.31 C ATOM 1044 C ASP A 73 -6.136 -6.519 -12.007 1.00 50.11 C ATOM 1045 O ASP A 73 -5.164 -7.254 -12.176 1.00 10.45 O ATOM 1046 CB ASP A 73 -7.531 -6.627 -14.144 1.00 72.12 C ATOM 1047 CG ASP A 73 -8.835 -7.029 -13.472 1.00 23.14 C ATOM 1048 OD1 ASP A 73 -8.805 -7.777 -12.475 1.00 50.23 O ATOM 1049 OD2 ASP A 73 -9.886 -6.504 -13.910 1.00 5.21 O ATOM 0 H ASP A 73 -4.832 -5.814 -14.088 1.00 44.43 H new ATOM 0 HA ASP A 73 -7.406 -5.010 -12.808 1.00 2.31 H new ATOM 0 HB2 ASP A 73 -7.737 -6.081 -15.065 1.00 72.12 H new ATOM 0 HB3 ASP A 73 -6.963 -7.515 -14.421 1.00 72.12 H new ATOM 1053 N TYR A 74 -6.649 -6.303 -10.797 1.00 72.34 N ATOM 1054 CA TYR A 74 -6.063 -6.923 -9.611 1.00 3.04 C ATOM 1055 C TYR A 74 -6.291 -8.435 -9.588 1.00 54.24 C ATOM 1056 O TYR A 74 -5.518 -9.153 -8.955 1.00 4.35 O ATOM 1057 CB TYR A 74 -6.617 -6.291 -8.323 1.00 34.14 C ATOM 1058 CG TYR A 74 -6.525 -4.776 -8.250 1.00 63.53 C ATOM 1059 CD1 TYR A 74 -5.368 -4.108 -8.691 1.00 23.24 C ATOM 1060 CD2 TYR A 74 -7.615 -4.031 -7.765 1.00 74.53 C ATOM 1061 CE1 TYR A 74 -5.320 -2.703 -8.713 1.00 62.42 C ATOM 1062 CE2 TYR A 74 -7.576 -2.626 -7.778 1.00 12.11 C ATOM 1063 CZ TYR A 74 -6.432 -1.956 -8.266 1.00 4.10 C ATOM 1064 OH TYR A 74 -6.407 -0.601 -8.327 1.00 70.23 O ATOM 0 H TYR A 74 -7.459 -5.711 -10.613 1.00 72.34 H new ATOM 0 HA TYR A 74 -4.989 -6.742 -9.659 1.00 3.04 H new ATOM 0 HB2 TYR A 74 -7.663 -6.580 -8.217 1.00 34.14 H new ATOM 0 HB3 TYR A 74 -6.082 -6.712 -7.472 1.00 34.14 H new ATOM 0 HD1 TYR A 74 -4.510 -4.679 -9.015 1.00 23.24 H new ATOM 0 HD2 TYR A 74 -8.486 -4.541 -7.381 1.00 74.53 H new ATOM 0 HE1 TYR A 74 -4.436 -2.197 -9.071 1.00 62.42 H new ATOM 0 HE2 TYR A 74 -8.420 -2.059 -7.415 1.00 12.11 H new ATOM 0 HH TYR A 74 -7.251 -0.242 -7.981 1.00 70.23 H new ATOM 1073 N ASN A 75 -7.344 -8.924 -10.252 1.00 74.23 N ATOM 1074 CA ASN A 75 -7.892 -10.248 -9.974 1.00 74.42 C ATOM 1075 C ASN A 75 -6.925 -11.372 -10.334 1.00 72.11 C ATOM 1076 O ASN A 75 -6.864 -12.395 -9.659 1.00 42.24 O ATOM 1077 CB ASN A 75 -9.220 -10.450 -10.712 1.00 31.21 C ATOM 1078 CG ASN A 75 -10.104 -11.380 -9.906 1.00 63.40 C ATOM 1079 OD1 ASN A 75 -10.207 -12.577 -10.154 1.00 23.55 O ATOM 1080 ND2 ASN A 75 -10.743 -10.827 -8.894 1.00 33.35 N ATOM 0 H ASN A 75 -7.833 -8.416 -10.989 1.00 74.23 H new ATOM 0 HA ASN A 75 -8.061 -10.294 -8.898 1.00 74.42 H new ATOM 0 HB2 ASN A 75 -9.718 -9.491 -10.857 1.00 31.21 H new ATOM 0 HB3 ASN A 75 -9.039 -10.869 -11.702 1.00 31.21 H new ATOM 0 HD21 ASN A 75 -11.340 -11.397 -8.295 1.00 33.35 H new ATOM 0 HD22 ASN A 75 -10.640 -9.829 -8.710 1.00 33.35 H new ATOM 1086 N ASN A 76 -6.140 -11.157 -11.391 1.00 74.24 N ATOM 1087 CA ASN A 76 -5.180 -12.104 -11.950 1.00 42.41 C ATOM 1088 C ASN A 76 -3.904 -12.278 -11.119 1.00 23.31 C ATOM 1089 O ASN A 76 -3.055 -13.077 -11.527 1.00 42.33 O ATOM 1090 CB ASN A 76 -4.817 -11.729 -13.405 1.00 54.12 C ATOM 1091 CG ASN A 76 -4.475 -10.269 -13.583 1.00 34.12 C ATOM 1092 OD1 ASN A 76 -5.490 -9.462 -13.811 1.00 22.42 O flip ATOM 1093 ND2 ASN A 76 -3.320 -9.860 -13.526 1.00 65.40 N flip ATOM 0 H ASN A 76 -6.159 -10.275 -11.903 1.00 74.24 H new ATOM 0 HA ASN A 76 -5.688 -13.068 -11.930 1.00 42.41 H new ATOM 0 HB2 ASN A 76 -3.970 -12.334 -13.727 1.00 54.12 H new ATOM 0 HB3 ASN A 76 -5.654 -11.980 -14.056 1.00 54.12 H new ATOM 0 HD21 ASN A 76 -2.556 -10.512 -13.348 1.00 65.40 H new ATOM 0 HD22 ASN A 76 -3.123 -8.868 -13.657 1.00 65.40 H new ATOM 1099 N TYR A 77 -3.734 -11.568 -9.999 1.00 50.20 N ATOM 1100 CA TYR A 77 -2.528 -11.646 -9.178 1.00 30.42 C ATOM 1101 C TYR A 77 -2.701 -12.625 -8.003 1.00 34.24 C ATOM 1102 O TYR A 77 -3.786 -13.172 -7.798 1.00 41.40 O ATOM 1103 CB TYR A 77 -2.162 -10.237 -8.692 1.00 10.04 C ATOM 1104 CG TYR A 77 -1.570 -9.386 -9.794 1.00 61.40 C ATOM 1105 CD1 TYR A 77 -0.188 -9.448 -10.033 1.00 44.40 C ATOM 1106 CD2 TYR A 77 -2.384 -8.570 -10.599 1.00 54.02 C ATOM 1107 CE1 TYR A 77 0.389 -8.694 -11.065 1.00 44.11 C ATOM 1108 CE2 TYR A 77 -1.809 -7.783 -11.613 1.00 62.54 C ATOM 1109 CZ TYR A 77 -0.419 -7.848 -11.853 1.00 54.11 C ATOM 1110 OH TYR A 77 0.156 -7.114 -12.836 1.00 1.12 O ATOM 0 H TYR A 77 -4.434 -10.921 -9.637 1.00 50.20 H new ATOM 0 HA TYR A 77 -1.711 -12.038 -9.783 1.00 30.42 H new ATOM 0 HB2 TYR A 77 -3.053 -9.748 -8.297 1.00 10.04 H new ATOM 0 HB3 TYR A 77 -1.449 -10.312 -7.871 1.00 10.04 H new ATOM 0 HD1 TYR A 77 0.435 -10.081 -9.418 1.00 44.40 H new ATOM 0 HD2 TYR A 77 -3.452 -8.547 -10.439 1.00 54.02 H new ATOM 0 HE1 TYR A 77 1.450 -8.761 -11.256 1.00 44.11 H new ATOM 0 HE2 TYR A 77 -2.430 -7.129 -12.208 1.00 62.54 H new ATOM 0 HH TYR A 77 -0.530 -6.582 -13.291 1.00 1.12 H new ATOM 1119 N ASP A 78 -1.643 -12.843 -7.208 1.00 52.01 N ATOM 1120 CA ASP A 78 -1.692 -13.595 -5.939 1.00 73.43 C ATOM 1121 C ASP A 78 -1.119 -12.795 -4.768 1.00 73.21 C ATOM 1122 O ASP A 78 -1.394 -13.113 -3.611 1.00 63.42 O ATOM 1123 CB ASP A 78 -0.949 -14.925 -6.086 1.00 70.21 C ATOM 1124 CG ASP A 78 -1.056 -15.831 -4.854 1.00 74.14 C ATOM 1125 OD1 ASP A 78 -2.177 -16.210 -4.470 1.00 65.43 O ATOM 1126 OD2 ASP A 78 -0.005 -16.252 -4.305 1.00 30.13 O ATOM 0 H ASP A 78 -0.710 -12.496 -7.431 1.00 52.01 H new ATOM 0 HA ASP A 78 -2.741 -13.787 -5.715 1.00 73.43 H new ATOM 0 HB2 ASP A 78 -1.343 -15.457 -6.952 1.00 70.21 H new ATOM 0 HB3 ASP A 78 0.103 -14.723 -6.287 1.00 70.21 H new ATOM 1130 N LEU A 79 -0.374 -11.718 -5.048 1.00 70.25 N ATOM 1131 CA LEU A 79 0.117 -10.803 -4.016 1.00 5.23 C ATOM 1132 C LEU A 79 0.250 -9.379 -4.558 1.00 52.41 C ATOM 1133 O LEU A 79 0.407 -9.198 -5.770 1.00 52.03 O ATOM 1134 CB LEU A 79 1.454 -11.358 -3.501 1.00 52.21 C ATOM 1135 CG LEU A 79 1.434 -11.591 -1.983 1.00 20.20 C ATOM 1136 CD1 LEU A 79 2.432 -12.696 -1.665 1.00 42.35 C ATOM 1137 CD2 LEU A 79 1.782 -10.313 -1.206 1.00 15.00 C ATOM 0 H LEU A 79 -0.097 -11.459 -5.995 1.00 70.25 H new ATOM 0 HA LEU A 79 -0.592 -10.740 -3.190 1.00 5.23 H new ATOM 0 HB2 LEU A 79 1.677 -12.296 -4.009 1.00 52.21 H new ATOM 0 HB3 LEU A 79 2.255 -10.663 -3.750 1.00 52.21 H new ATOM 0 HG LEU A 79 0.429 -11.881 -1.676 1.00 20.20 H new ATOM 0 HD11 LEU A 79 2.438 -12.882 -0.591 1.00 42.35 H new ATOM 0 HD12 LEU A 79 2.145 -13.607 -2.190 1.00 42.35 H new ATOM 0 HD13 LEU A 79 3.428 -12.390 -1.986 1.00 42.35 H new ATOM 0 HD21 LEU A 79 1.757 -10.520 -0.136 1.00 15.00 H new ATOM 0 HD22 LEU A 79 2.780 -9.976 -1.487 1.00 15.00 H new ATOM 0 HD23 LEU A 79 1.056 -9.535 -1.442 1.00 15.00 H new ATOM 1148 N ILE A 80 0.179 -8.365 -3.688 1.00 32.32 N ATOM 1149 CA ILE A 80 0.237 -6.948 -4.054 1.00 34.33 C ATOM 1150 C ILE A 80 1.057 -6.217 -2.979 1.00 21.34 C ATOM 1151 O ILE A 80 0.700 -6.253 -1.795 1.00 12.21 O ATOM 1152 CB ILE A 80 -1.203 -6.386 -4.228 1.00 41.12 C ATOM 1153 CG1 ILE A 80 -1.902 -7.033 -5.446 1.00 73.22 C ATOM 1154 CG2 ILE A 80 -1.198 -4.848 -4.346 1.00 14.32 C ATOM 1155 CD1 ILE A 80 -3.365 -6.627 -5.668 1.00 64.34 C ATOM 0 H ILE A 80 0.077 -8.513 -2.684 1.00 32.32 H new ATOM 0 HA ILE A 80 0.732 -6.798 -5.014 1.00 34.33 H new ATOM 0 HB ILE A 80 -1.770 -6.644 -3.334 1.00 41.12 H new ATOM 0 HG12 ILE A 80 -1.335 -6.782 -6.342 1.00 73.22 H new ATOM 0 HG13 ILE A 80 -1.858 -8.116 -5.334 1.00 73.22 H new ATOM 0 HG21 ILE A 80 -2.220 -4.489 -4.466 1.00 14.32 H new ATOM 0 HG22 ILE A 80 -0.765 -4.415 -3.444 1.00 14.32 H new ATOM 0 HG23 ILE A 80 -0.605 -4.551 -5.211 1.00 14.32 H new ATOM 0 HD11 ILE A 80 -3.755 -7.139 -6.548 1.00 64.34 H new ATOM 0 HD12 ILE A 80 -3.956 -6.904 -4.795 1.00 64.34 H new ATOM 0 HD13 ILE A 80 -3.425 -5.549 -5.819 1.00 64.34 H new ATOM 1166 N LEU A 81 2.147 -5.551 -3.381 1.00 44.12 N ATOM 1167 CA LEU A 81 3.044 -4.778 -2.518 1.00 15.13 C ATOM 1168 C LEU A 81 2.904 -3.282 -2.800 1.00 55.21 C ATOM 1169 O LEU A 81 2.618 -2.884 -3.933 1.00 55.23 O ATOM 1170 CB LEU A 81 4.505 -5.189 -2.756 1.00 12.10 C ATOM 1171 CG LEU A 81 4.831 -6.619 -2.288 1.00 13.40 C ATOM 1172 CD1 LEU A 81 5.964 -7.221 -3.116 1.00 63.12 C ATOM 1173 CD2 LEU A 81 5.246 -6.576 -0.821 1.00 71.44 C ATOM 0 H LEU A 81 2.439 -5.537 -4.358 1.00 44.12 H new ATOM 0 HA LEU A 81 2.768 -4.982 -1.483 1.00 15.13 H new ATOM 0 HB2 LEU A 81 4.728 -5.105 -3.820 1.00 12.10 H new ATOM 0 HB3 LEU A 81 5.159 -4.489 -2.237 1.00 12.10 H new ATOM 0 HG LEU A 81 3.945 -7.241 -2.416 1.00 13.40 H new ATOM 0 HD11 LEU A 81 6.174 -8.231 -2.765 1.00 63.12 H new ATOM 0 HD12 LEU A 81 5.670 -7.255 -4.165 1.00 63.12 H new ATOM 0 HD13 LEU A 81 6.858 -6.607 -3.010 1.00 63.12 H new ATOM 0 HD21 LEU A 81 5.479 -7.584 -0.479 1.00 71.44 H new ATOM 0 HD22 LEU A 81 6.126 -5.943 -0.710 1.00 71.44 H new ATOM 0 HD23 LEU A 81 4.430 -6.170 -0.224 1.00 71.44 H new ATOM 1184 N ILE A 82 3.143 -2.441 -1.787 1.00 23.23 N ATOM 1185 CA ILE A 82 2.960 -0.990 -1.856 1.00 43.31 C ATOM 1186 C ILE A 82 4.027 -0.295 -0.989 1.00 1.33 C ATOM 1187 O ILE A 82 4.289 -0.781 0.109 1.00 72.44 O ATOM 1188 CB ILE A 82 1.539 -0.646 -1.333 1.00 41.41 C ATOM 1189 CG1 ILE A 82 0.382 -1.466 -1.967 1.00 63.32 C ATOM 1190 CG2 ILE A 82 1.319 0.851 -1.558 1.00 54.33 C ATOM 1191 CD1 ILE A 82 -1.006 -1.193 -1.364 1.00 73.51 C ATOM 0 H ILE A 82 3.476 -2.759 -0.877 1.00 23.23 H new ATOM 0 HA ILE A 82 3.066 -0.644 -2.884 1.00 43.31 H new ATOM 0 HB ILE A 82 1.508 -0.917 -0.278 1.00 41.41 H new ATOM 0 HG12 ILE A 82 0.347 -1.253 -3.035 1.00 63.32 H new ATOM 0 HG13 ILE A 82 0.607 -2.527 -1.861 1.00 63.32 H new ATOM 0 HG21 ILE A 82 0.328 1.131 -1.202 1.00 54.33 H new ATOM 0 HG22 ILE A 82 2.074 1.416 -1.011 1.00 54.33 H new ATOM 0 HG23 ILE A 82 1.398 1.075 -2.622 1.00 54.33 H new ATOM 0 HD11 ILE A 82 -1.750 -1.810 -1.869 1.00 73.51 H new ATOM 0 HD12 ILE A 82 -0.995 -1.435 -0.301 1.00 73.51 H new ATOM 0 HD13 ILE A 82 -1.259 -0.141 -1.494 1.00 73.51 H new ATOM 1202 N GLY A 83 4.589 0.856 -1.392 1.00 40.05 N ATOM 1203 CA GLY A 83 5.497 1.619 -0.522 1.00 43.03 C ATOM 1204 C GLY A 83 5.250 3.131 -0.483 1.00 21.21 C ATOM 1205 O GLY A 83 4.576 3.686 -1.358 1.00 23.50 O ATOM 0 H GLY A 83 4.432 1.276 -2.308 1.00 40.05 H new ATOM 0 HA2 GLY A 83 5.416 1.228 0.492 1.00 43.03 H new ATOM 0 HA3 GLY A 83 6.521 1.443 -0.850 1.00 43.03 H new ATOM 1209 N SER A 84 5.802 3.823 0.524 1.00 33.20 N ATOM 1210 CA SER A 84 5.635 5.260 0.796 1.00 71.13 C ATOM 1211 C SER A 84 6.623 5.745 1.884 1.00 24.54 C ATOM 1212 O SER A 84 7.125 4.918 2.653 1.00 41.14 O ATOM 1213 CB SER A 84 4.226 5.479 1.342 1.00 11.02 C ATOM 1214 OG SER A 84 3.245 5.403 0.330 1.00 32.32 O ATOM 0 H SER A 84 6.410 3.372 1.208 1.00 33.20 H new ATOM 0 HA SER A 84 5.815 5.808 -0.129 1.00 71.13 H new ATOM 0 HB2 SER A 84 4.015 4.732 2.108 1.00 11.02 H new ATOM 0 HB3 SER A 84 4.173 6.455 1.825 1.00 11.02 H new ATOM 0 HG SER A 84 3.584 4.863 -0.414 1.00 32.32 H new ATOM 1219 N PRO A 85 6.862 7.067 2.007 1.00 42.31 N ATOM 1220 CA PRO A 85 7.670 7.670 3.070 1.00 44.31 C ATOM 1221 C PRO A 85 6.878 7.869 4.373 1.00 4.33 C ATOM 1222 O PRO A 85 5.649 7.767 4.381 1.00 52.35 O ATOM 1223 CB PRO A 85 8.074 9.027 2.500 1.00 1.43 C ATOM 1224 CG PRO A 85 6.845 9.433 1.688 1.00 52.34 C ATOM 1225 CD PRO A 85 6.414 8.101 1.079 1.00 73.21 C ATOM 0 HA PRO A 85 8.513 7.032 3.335 1.00 44.31 H new ATOM 0 HB2 PRO A 85 8.294 9.747 3.288 1.00 1.43 H new ATOM 0 HB3 PRO A 85 8.965 8.955 1.876 1.00 1.43 H new ATOM 0 HG2 PRO A 85 6.066 9.866 2.316 1.00 52.34 H new ATOM 0 HG3 PRO A 85 7.086 10.172 0.924 1.00 52.34 H new ATOM 0 HD2 PRO A 85 5.333 8.064 0.948 1.00 73.21 H new ATOM 0 HD3 PRO A 85 6.860 7.960 0.094 1.00 73.21 H new ATOM 1230 N VAL A 86 7.567 8.225 5.467 1.00 75.11 N ATOM 1231 CA VAL A 86 6.959 8.483 6.768 1.00 61.54 C ATOM 1232 C VAL A 86 7.879 9.328 7.669 1.00 72.55 C ATOM 1233 O VAL A 86 8.955 8.880 8.057 1.00 41.14 O ATOM 1234 CB VAL A 86 6.495 7.158 7.403 1.00 24.53 C ATOM 1235 CG1 VAL A 86 7.507 6.028 7.555 1.00 1.01 C ATOM 1236 CG2 VAL A 86 5.811 7.425 8.745 1.00 63.15 C ATOM 0 H VAL A 86 8.580 8.342 5.466 1.00 75.11 H new ATOM 0 HA VAL A 86 6.066 9.094 6.636 1.00 61.54 H new ATOM 0 HB VAL A 86 5.807 6.768 6.653 1.00 24.53 H new ATOM 0 HG11 VAL A 86 7.024 5.167 8.018 1.00 1.01 H new ATOM 0 HG12 VAL A 86 7.888 5.746 6.573 1.00 1.01 H new ATOM 0 HG13 VAL A 86 8.333 6.362 8.183 1.00 1.01 H new ATOM 0 HG21 VAL A 86 5.488 6.481 9.183 1.00 63.15 H new ATOM 0 HG22 VAL A 86 6.512 7.917 9.419 1.00 63.15 H new ATOM 0 HG23 VAL A 86 4.945 8.068 8.590 1.00 63.15 H new ATOM 1246 N TRP A 87 7.456 10.541 8.050 1.00 52.14 N ATOM 1247 CA TRP A 87 8.281 11.426 8.886 1.00 62.25 C ATOM 1248 C TRP A 87 7.561 12.040 10.091 1.00 0.30 C ATOM 1249 O TRP A 87 8.226 12.621 10.957 1.00 31.23 O ATOM 1250 CB TRP A 87 8.956 12.483 7.995 1.00 11.02 C ATOM 1251 CG TRP A 87 10.326 12.894 8.439 1.00 61.35 C ATOM 1252 CD1 TRP A 87 11.413 12.092 8.420 1.00 14.13 C ATOM 1253 CD2 TRP A 87 10.788 14.170 8.969 1.00 75.22 C ATOM 1254 NE1 TRP A 87 12.510 12.773 8.905 1.00 54.04 N ATOM 1255 CE2 TRP A 87 12.178 14.059 9.270 1.00 4.21 C ATOM 1256 CE3 TRP A 87 10.165 15.400 9.271 1.00 42.33 C ATOM 1257 CZ2 TRP A 87 12.905 15.114 9.838 1.00 74.53 C ATOM 1258 CZ3 TRP A 87 10.888 16.467 9.837 1.00 11.42 C ATOM 1259 CH2 TRP A 87 12.257 16.326 10.122 1.00 0.32 C ATOM 0 H TRP A 87 6.549 10.932 7.794 1.00 52.14 H new ATOM 0 HA TRP A 87 9.043 10.800 9.351 1.00 62.25 H new ATOM 0 HB2 TRP A 87 9.020 12.094 6.979 1.00 11.02 H new ATOM 0 HB3 TRP A 87 8.320 13.368 7.959 1.00 11.02 H new ATOM 0 HD1 TRP A 87 11.422 11.068 8.076 1.00 14.13 H new ATOM 0 HE1 TRP A 87 13.446 12.376 8.983 1.00 54.04 H new ATOM 0 HE3 TRP A 87 9.112 15.525 9.064 1.00 42.33 H new ATOM 0 HZ2 TRP A 87 13.956 14.995 10.056 1.00 74.53 H new ATOM 0 HZ3 TRP A 87 10.388 17.399 10.053 1.00 11.42 H new ATOM 0 HH2 TRP A 87 12.808 17.147 10.558 1.00 0.32 H new ATOM 1269 N SER A 88 6.237 11.880 10.185 1.00 42.33 N ATOM 1270 CA SER A 88 5.441 12.337 11.321 1.00 61.25 C ATOM 1271 C SER A 88 4.289 11.378 11.670 1.00 2.43 C ATOM 1272 O SER A 88 3.310 11.791 12.282 1.00 75.43 O ATOM 1273 CB SER A 88 4.923 13.761 11.052 1.00 54.05 C ATOM 1274 OG SER A 88 5.977 14.683 10.848 1.00 54.03 O ATOM 0 H SER A 88 5.683 11.422 9.461 1.00 42.33 H new ATOM 0 HA SER A 88 6.092 12.350 12.195 1.00 61.25 H new ATOM 0 HB2 SER A 88 4.276 13.751 10.175 1.00 54.05 H new ATOM 0 HB3 SER A 88 4.313 14.089 11.894 1.00 54.05 H new ATOM 0 HG SER A 88 5.696 15.573 11.148 1.00 54.03 H new ATOM 1279 N GLY A 89 4.374 10.097 11.303 1.00 60.33 N ATOM 1280 CA GLY A 89 3.400 9.075 11.667 1.00 40.14 C ATOM 1281 C GLY A 89 2.722 8.476 10.447 1.00 23.34 C ATOM 1282 O GLY A 89 2.751 7.254 10.300 1.00 54.44 O ATOM 0 H GLY A 89 5.139 9.738 10.733 1.00 60.33 H new ATOM 0 HA2 GLY A 89 3.897 8.285 12.230 1.00 40.14 H new ATOM 0 HA3 GLY A 89 2.647 9.510 12.324 1.00 40.14 H new ATOM 1286 N TYR A 90 2.121 9.318 9.607 1.00 62.35 N ATOM 1287 CA TYR A 90 1.303 8.952 8.450 1.00 40.05 C ATOM 1288 C TYR A 90 1.156 10.178 7.527 1.00 73.41 C ATOM 1289 O TYR A 90 0.062 10.729 7.431 1.00 43.42 O ATOM 1290 CB TYR A 90 -0.064 8.369 8.904 1.00 60.25 C ATOM 1291 CG TYR A 90 -0.854 8.997 10.060 1.00 13.30 C ATOM 1292 CD1 TYR A 90 -0.563 10.269 10.597 1.00 2.14 C ATOM 1293 CD2 TYR A 90 -1.927 8.271 10.616 1.00 21.14 C ATOM 1294 CE1 TYR A 90 -1.269 10.762 11.707 1.00 3.23 C ATOM 1295 CE2 TYR A 90 -2.638 8.752 11.730 1.00 72.41 C ATOM 1296 CZ TYR A 90 -2.297 10.000 12.296 1.00 35.20 C ATOM 1297 OH TYR A 90 -2.976 10.492 13.369 1.00 21.23 O ATOM 0 H TYR A 90 2.195 10.329 9.721 1.00 62.35 H new ATOM 0 HA TYR A 90 1.793 8.163 7.880 1.00 40.05 H new ATOM 0 HB2 TYR A 90 -0.718 8.376 8.032 1.00 60.25 H new ATOM 0 HB3 TYR A 90 0.107 7.325 9.166 1.00 60.25 H new ATOM 0 HD1 TYR A 90 0.213 10.872 10.149 1.00 2.14 H new ATOM 0 HD2 TYR A 90 -2.209 7.325 10.177 1.00 21.14 H new ATOM 0 HE1 TYR A 90 -1.022 11.732 12.112 1.00 3.23 H new ATOM 0 HE2 TYR A 90 -3.443 8.168 12.152 1.00 72.41 H new ATOM 0 HH TYR A 90 -3.653 9.843 13.654 1.00 21.23 H new ATOM 1306 N PRO A 91 2.247 10.684 6.914 1.00 33.52 N ATOM 1307 CA PRO A 91 2.270 12.025 6.331 1.00 41.03 C ATOM 1308 C PRO A 91 1.625 12.170 4.953 1.00 72.55 C ATOM 1309 O PRO A 91 1.413 13.309 4.536 1.00 60.45 O ATOM 1310 CB PRO A 91 3.751 12.395 6.241 1.00 40.32 C ATOM 1311 CG PRO A 91 4.406 11.044 5.999 1.00 73.21 C ATOM 1312 CD PRO A 91 3.600 10.148 6.942 1.00 43.44 C ATOM 0 HA PRO A 91 1.671 12.679 6.965 1.00 41.03 H new ATOM 0 HB2 PRO A 91 3.947 13.094 5.428 1.00 40.32 H new ATOM 0 HB3 PRO A 91 4.110 12.863 7.158 1.00 40.32 H new ATOM 0 HG2 PRO A 91 4.323 10.727 4.959 1.00 73.21 H new ATOM 0 HG3 PRO A 91 5.468 11.051 6.246 1.00 73.21 H new ATOM 0 HD2 PRO A 91 3.619 9.110 6.611 1.00 43.44 H new ATOM 0 HD3 PRO A 91 4.011 10.168 7.951 1.00 43.44 H new ATOM 1317 N ALA A 92 1.354 11.075 4.243 1.00 2.32 N ATOM 1318 CA ALA A 92 0.764 11.083 2.911 1.00 23.40 C ATOM 1319 C ALA A 92 -0.473 10.185 2.935 1.00 44.45 C ATOM 1320 O ALA A 92 -0.575 9.300 3.793 1.00 42.22 O ATOM 1321 CB ALA A 92 1.819 10.587 1.904 1.00 11.14 C ATOM 0 H ALA A 92 1.545 10.135 4.590 1.00 2.32 H new ATOM 0 HA ALA A 92 0.457 12.084 2.609 1.00 23.40 H new ATOM 0 HB1 ALA A 92 1.393 10.587 0.901 1.00 11.14 H new ATOM 0 HB2 ALA A 92 2.686 11.248 1.930 1.00 11.14 H new ATOM 0 HB3 ALA A 92 2.126 9.575 2.168 1.00 11.14 H new ATOM 1327 N THR A 93 -1.360 10.300 1.942 1.00 35.32 N ATOM 1328 CA THR A 93 -2.474 9.367 1.791 1.00 31.54 C ATOM 1329 C THR A 93 -2.636 8.902 0.325 1.00 25.34 C ATOM 1330 O THR A 93 -3.761 8.651 -0.096 1.00 54.03 O ATOM 1331 CB THR A 93 -3.742 10.149 2.249 1.00 15.22 C ATOM 1332 OG1 THR A 93 -3.779 11.456 1.685 1.00 23.23 O ATOM 1333 CG2 THR A 93 -3.860 10.319 3.768 1.00 43.25 C ATOM 0 H THR A 93 -1.326 11.031 1.232 1.00 35.32 H new ATOM 0 HA THR A 93 -2.307 8.466 2.382 1.00 31.54 H new ATOM 0 HB THR A 93 -4.571 9.534 1.898 1.00 15.22 H new ATOM 0 HG1 THR A 93 -4.251 11.429 0.827 1.00 23.23 H new ATOM 0 HG21 THR A 93 -4.769 10.873 4.003 1.00 43.25 H new ATOM 0 HG22 THR A 93 -3.901 9.338 4.242 1.00 43.25 H new ATOM 0 HG23 THR A 93 -2.995 10.867 4.141 1.00 43.25 H new ATOM 1341 N PRO A 94 -1.577 8.442 -0.377 1.00 23.32 N ATOM 1342 CA PRO A 94 -1.745 7.749 -1.652 1.00 10.22 C ATOM 1343 C PRO A 94 -2.227 6.326 -1.369 1.00 13.01 C ATOM 1344 O PRO A 94 -3.030 5.744 -2.100 1.00 51.05 O ATOM 1345 CB PRO A 94 -0.366 7.788 -2.326 1.00 73.45 C ATOM 1346 CG PRO A 94 0.606 7.876 -1.148 1.00 40.34 C ATOM 1347 CD PRO A 94 -0.167 8.690 -0.130 1.00 32.40 C ATOM 0 HA PRO A 94 -2.485 8.206 -2.309 1.00 10.22 H new ATOM 0 HB2 PRO A 94 -0.188 6.896 -2.927 1.00 73.45 H new ATOM 0 HB3 PRO A 94 -0.269 8.646 -2.991 1.00 73.45 H new ATOM 0 HG2 PRO A 94 0.865 6.889 -0.764 1.00 40.34 H new ATOM 0 HG3 PRO A 94 1.539 8.363 -1.430 1.00 40.34 H new ATOM 0 HD2 PRO A 94 0.105 8.399 0.885 1.00 32.40 H new ATOM 0 HD3 PRO A 94 0.062 9.751 -0.229 1.00 32.40 H new ATOM 1352 N ILE A 95 -1.781 5.741 -0.257 1.00 31.51 N ATOM 1353 CA ILE A 95 -2.184 4.407 0.142 1.00 72.45 C ATOM 1354 C ILE A 95 -3.424 4.561 1.022 1.00 44.42 C ATOM 1355 O ILE A 95 -3.470 4.181 2.189 1.00 14.42 O ATOM 1356 CB ILE A 95 -1.030 3.620 0.779 1.00 61.21 C ATOM 1357 CG1 ILE A 95 0.384 3.971 0.243 1.00 75.23 C ATOM 1358 CG2 ILE A 95 -1.342 2.116 0.654 1.00 42.32 C ATOM 1359 CD1 ILE A 95 0.603 4.061 -1.281 1.00 24.54 C ATOM 0 H ILE A 95 -1.129 6.186 0.389 1.00 31.51 H new ATOM 0 HA ILE A 95 -2.447 3.794 -0.720 1.00 72.45 H new ATOM 0 HB ILE A 95 -0.976 3.915 1.827 1.00 61.21 H new ATOM 0 HG12 ILE A 95 0.671 4.930 0.674 1.00 75.23 H new ATOM 0 HG13 ILE A 95 1.078 3.226 0.632 1.00 75.23 H new ATOM 0 HG21 ILE A 95 -0.533 1.538 1.101 1.00 42.32 H new ATOM 0 HG22 ILE A 95 -2.276 1.894 1.171 1.00 42.32 H new ATOM 0 HG23 ILE A 95 -1.438 1.851 -0.399 1.00 42.32 H new ATOM 0 HD11 ILE A 95 1.643 4.315 -1.485 1.00 24.54 H new ATOM 0 HD12 ILE A 95 0.367 3.101 -1.740 1.00 24.54 H new ATOM 0 HD13 ILE A 95 -0.046 4.831 -1.697 1.00 24.54 H new ATOM 1370 N LYS A 96 -4.452 5.135 0.423 1.00 42.24 N ATOM 1371 CA LYS A 96 -5.825 5.092 0.885 1.00 23.24 C ATOM 1372 C LYS A 96 -6.656 4.527 -0.246 1.00 1.12 C ATOM 1373 O LYS A 96 -7.206 3.442 -0.100 1.00 51.33 O ATOM 1374 CB LYS A 96 -6.285 6.483 1.362 1.00 64.43 C ATOM 1375 CG LYS A 96 -6.355 6.575 2.896 1.00 50.32 C ATOM 1376 CD LYS A 96 -7.556 5.784 3.436 1.00 34.11 C ATOM 1377 CE LYS A 96 -7.785 6.041 4.930 1.00 3.20 C ATOM 1378 NZ LYS A 96 -9.137 5.632 5.357 1.00 14.33 N ATOM 0 H LYS A 96 -4.345 5.669 -0.440 1.00 42.24 H new ATOM 0 HA LYS A 96 -5.940 4.448 1.757 1.00 23.24 H new ATOM 0 HB2 LYS A 96 -5.598 7.241 0.985 1.00 64.43 H new ATOM 0 HB3 LYS A 96 -7.266 6.704 0.941 1.00 64.43 H new ATOM 0 HG2 LYS A 96 -5.434 6.187 3.330 1.00 50.32 H new ATOM 0 HG3 LYS A 96 -6.436 7.619 3.199 1.00 50.32 H new ATOM 0 HD2 LYS A 96 -8.452 6.059 2.879 1.00 34.11 H new ATOM 0 HD3 LYS A 96 -7.393 4.719 3.272 1.00 34.11 H new ATOM 0 HE2 LYS A 96 -7.040 5.496 5.511 1.00 3.20 H new ATOM 0 HE3 LYS A 96 -7.642 7.101 5.142 1.00 3.20 H new ATOM 0 HZ1 LYS A 96 -9.252 5.822 6.373 1.00 14.33 H new ATOM 0 HZ2 LYS A 96 -9.848 6.170 4.821 1.00 14.33 H new ATOM 0 HZ3 LYS A 96 -9.265 4.616 5.178 1.00 14.33 H new ATOM 1388 N THR A 97 -6.667 5.166 -1.412 1.00 63.21 N ATOM 1389 CA THR A 97 -7.593 4.795 -2.456 1.00 11.34 C ATOM 1390 C THR A 97 -7.299 3.405 -3.018 1.00 21.41 C ATOM 1391 O THR A 97 -8.231 2.709 -3.395 1.00 72.24 O ATOM 1392 CB THR A 97 -7.512 5.877 -3.522 1.00 74.21 C ATOM 1393 OG1 THR A 97 -7.610 7.145 -2.913 1.00 25.31 O ATOM 1394 CG2 THR A 97 -8.579 5.694 -4.591 1.00 23.14 C ATOM 0 H THR A 97 -6.045 5.939 -1.649 1.00 63.21 H new ATOM 0 HA THR A 97 -8.607 4.728 -2.061 1.00 11.34 H new ATOM 0 HB THR A 97 -6.548 5.798 -4.025 1.00 74.21 H new ATOM 0 HG1 THR A 97 -6.961 7.755 -3.322 1.00 25.31 H new ATOM 0 HG21 THR A 97 -8.489 6.486 -5.334 1.00 23.14 H new ATOM 0 HG22 THR A 97 -8.448 4.726 -5.074 1.00 23.14 H new ATOM 0 HG23 THR A 97 -9.566 5.739 -4.131 1.00 23.14 H new ATOM 1402 N LEU A 98 -6.045 2.932 -3.033 1.00 24.50 N ATOM 1403 CA LEU A 98 -5.786 1.567 -3.503 1.00 11.14 C ATOM 1404 C LEU A 98 -6.589 0.570 -2.657 1.00 24.31 C ATOM 1405 O LEU A 98 -7.311 -0.259 -3.191 1.00 44.11 O ATOM 1406 CB LEU A 98 -4.276 1.244 -3.522 1.00 3.11 C ATOM 1407 CG LEU A 98 -3.752 0.657 -4.851 1.00 43.25 C ATOM 1408 CD1 LEU A 98 -4.432 -0.632 -5.305 1.00 44.02 C ATOM 1409 CD2 LEU A 98 -3.863 1.681 -5.973 1.00 41.11 C ATOM 0 H LEU A 98 -5.221 3.454 -2.736 1.00 24.50 H new ATOM 0 HA LEU A 98 -6.120 1.481 -4.537 1.00 11.14 H new ATOM 0 HB2 LEU A 98 -3.722 2.156 -3.301 1.00 3.11 H new ATOM 0 HB3 LEU A 98 -4.060 0.538 -2.720 1.00 3.11 H new ATOM 0 HG LEU A 98 -2.713 0.405 -4.641 1.00 43.25 H new ATOM 0 HD11 LEU A 98 -3.993 -0.963 -6.247 1.00 44.02 H new ATOM 0 HD12 LEU A 98 -4.291 -1.404 -4.548 1.00 44.02 H new ATOM 0 HD13 LEU A 98 -5.498 -0.451 -5.445 1.00 44.02 H new ATOM 0 HD21 LEU A 98 -3.489 1.247 -6.900 1.00 41.11 H new ATOM 0 HD22 LEU A 98 -4.907 1.968 -6.102 1.00 41.11 H new ATOM 0 HD23 LEU A 98 -3.273 2.562 -5.721 1.00 41.11 H new ATOM 1420 N LEU A 99 -6.571 0.715 -1.332 1.00 52.21 N ATOM 1421 CA LEU A 99 -7.269 -0.162 -0.391 1.00 54.12 C ATOM 1422 C LEU A 99 -8.790 -0.113 -0.563 1.00 50.51 C ATOM 1423 O LEU A 99 -9.487 -1.026 -0.124 1.00 73.33 O ATOM 1424 CB LEU A 99 -6.963 0.314 1.037 1.00 42.52 C ATOM 1425 CG LEU A 99 -5.508 0.185 1.547 1.00 13.00 C ATOM 1426 CD1 LEU A 99 -4.466 -0.412 0.590 1.00 30.33 C ATOM 1427 CD2 LEU A 99 -4.983 1.551 1.985 1.00 51.24 C ATOM 0 H LEU A 99 -6.057 1.466 -0.871 1.00 52.21 H new ATOM 0 HA LEU A 99 -6.926 -1.179 -0.580 1.00 54.12 H new ATOM 0 HB2 LEU A 99 -7.251 1.363 1.109 1.00 42.52 H new ATOM 0 HB3 LEU A 99 -7.607 -0.241 1.720 1.00 42.52 H new ATOM 0 HG LEU A 99 -5.608 -0.534 2.360 1.00 13.00 H new ATOM 0 HD11 LEU A 99 -3.494 -0.440 1.082 1.00 30.33 H new ATOM 0 HD12 LEU A 99 -4.763 -1.424 0.314 1.00 30.33 H new ATOM 0 HD13 LEU A 99 -4.401 0.204 -0.307 1.00 30.33 H new ATOM 0 HD21 LEU A 99 -3.958 1.449 2.342 1.00 51.24 H new ATOM 0 HD22 LEU A 99 -5.006 2.238 1.139 1.00 51.24 H new ATOM 0 HD23 LEU A 99 -5.610 1.942 2.787 1.00 51.24 H new ATOM 1438 N ASP A 100 -9.316 0.958 -1.149 1.00 52.21 N ATOM 1439 CA ASP A 100 -10.728 1.129 -1.492 1.00 61.13 C ATOM 1440 C ASP A 100 -11.069 0.503 -2.837 1.00 62.42 C ATOM 1441 O ASP A 100 -12.193 0.077 -3.077 1.00 2.34 O ATOM 1442 CB ASP A 100 -11.001 2.627 -1.554 1.00 41.53 C ATOM 1443 CG ASP A 100 -12.411 2.975 -2.053 1.00 4.22 C ATOM 1444 OD1 ASP A 100 -13.405 2.526 -1.440 1.00 71.45 O ATOM 1445 OD2 ASP A 100 -12.518 3.735 -3.046 1.00 1.53 O ATOM 0 H ASP A 100 -8.749 1.765 -1.409 1.00 52.21 H new ATOM 0 HA ASP A 100 -11.341 0.633 -0.740 1.00 61.13 H new ATOM 0 HB2 ASP A 100 -10.860 3.055 -0.561 1.00 41.53 H new ATOM 0 HB3 ASP A 100 -10.267 3.095 -2.210 1.00 41.53 H new ATOM 1449 N GLN A 101 -10.080 0.405 -3.716 1.00 45.11 N ATOM 1450 CA GLN A 101 -10.254 -0.120 -5.060 1.00 4.44 C ATOM 1451 C GLN A 101 -10.082 -1.647 -5.033 1.00 13.42 C ATOM 1452 O GLN A 101 -10.562 -2.349 -5.919 1.00 63.24 O ATOM 1453 CB GLN A 101 -9.289 0.608 -6.009 1.00 14.04 C ATOM 1454 CG GLN A 101 -9.568 2.115 -6.070 1.00 30.22 C ATOM 1455 CD GLN A 101 -10.435 2.527 -7.230 1.00 64.42 C ATOM 1456 OE1 GLN A 101 -10.999 1.709 -7.952 1.00 64.13 O ATOM 1457 NE2 GLN A 101 -10.522 3.805 -7.494 1.00 4.50 N ATOM 0 H GLN A 101 -9.123 0.692 -3.511 1.00 45.11 H new ATOM 0 HA GLN A 101 -11.259 0.065 -5.440 1.00 4.44 H new ATOM 0 HB2 GLN A 101 -8.263 0.443 -5.679 1.00 14.04 H new ATOM 0 HB3 GLN A 101 -9.375 0.183 -7.009 1.00 14.04 H new ATOM 0 HG2 GLN A 101 -10.049 2.424 -5.142 1.00 30.22 H new ATOM 0 HG3 GLN A 101 -8.619 2.648 -6.130 1.00 30.22 H new ATOM 0 HE21 GLN A 101 -10.053 4.483 -6.893 1.00 4.50 H new ATOM 0 HE22 GLN A 101 -11.059 4.124 -8.301 1.00 4.50 H new ATOM 1464 N MET A 102 -9.443 -2.184 -3.988 1.00 72.52 N ATOM 1465 CA MET A 102 -9.103 -3.593 -3.813 1.00 4.01 C ATOM 1466 C MET A 102 -10.167 -4.437 -3.090 1.00 13.31 C ATOM 1467 O MET A 102 -9.893 -5.591 -2.760 1.00 14.31 O ATOM 1468 CB MET A 102 -7.779 -3.671 -3.048 1.00 32.54 C ATOM 1469 CG MET A 102 -6.597 -3.218 -3.906 1.00 2.32 C ATOM 1470 SD MET A 102 -4.972 -3.461 -3.134 1.00 1.23 S ATOM 1471 CE MET A 102 -5.050 -5.231 -2.819 1.00 33.21 C ATOM 0 H MET A 102 -9.134 -1.613 -3.201 1.00 72.52 H new ATOM 0 HA MET A 102 -9.033 -4.023 -4.812 1.00 4.01 H new ATOM 0 HB2 MET A 102 -7.839 -3.049 -2.155 1.00 32.54 H new ATOM 0 HB3 MET A 102 -7.613 -4.695 -2.713 1.00 32.54 H new ATOM 0 HG2 MET A 102 -6.621 -3.760 -4.851 1.00 2.32 H new ATOM 0 HG3 MET A 102 -6.719 -2.161 -4.142 1.00 2.32 H new ATOM 0 HE1 MET A 102 -4.039 -5.631 -2.736 1.00 33.21 H new ATOM 0 HE2 MET A 102 -5.589 -5.412 -1.889 1.00 33.21 H new ATOM 0 HE3 MET A 102 -5.569 -5.724 -3.641 1.00 33.21 H new ATOM 1479 N LYS A 103 -11.372 -3.919 -2.830 1.00 62.42 N ATOM 1480 CA LYS A 103 -12.388 -4.602 -2.009 1.00 21.24 C ATOM 1481 C LYS A 103 -12.688 -6.044 -2.458 1.00 10.53 C ATOM 1482 O LYS A 103 -13.037 -6.885 -1.635 1.00 3.54 O ATOM 1483 CB LYS A 103 -13.693 -3.790 -2.027 1.00 13.43 C ATOM 1484 CG LYS A 103 -13.587 -2.343 -1.505 1.00 42.51 C ATOM 1485 CD LYS A 103 -13.915 -2.141 -0.019 1.00 41.41 C ATOM 1486 CE LYS A 103 -12.637 -2.142 0.807 1.00 42.13 C ATOM 1487 NZ LYS A 103 -12.897 -1.973 2.246 1.00 62.14 N ATOM 0 H LYS A 103 -11.675 -3.011 -3.182 1.00 62.42 H new ATOM 0 HA LYS A 103 -11.973 -4.666 -1.003 1.00 21.24 H new ATOM 0 HB2 LYS A 103 -14.067 -3.761 -3.050 1.00 13.43 H new ATOM 0 HB3 LYS A 103 -14.437 -4.318 -1.430 1.00 13.43 H new ATOM 0 HG2 LYS A 103 -12.573 -1.986 -1.685 1.00 42.51 H new ATOM 0 HG3 LYS A 103 -14.256 -1.715 -2.094 1.00 42.51 H new ATOM 0 HD2 LYS A 103 -14.445 -1.198 0.119 1.00 41.41 H new ATOM 0 HD3 LYS A 103 -14.579 -2.934 0.325 1.00 41.41 H new ATOM 0 HE2 LYS A 103 -12.104 -3.079 0.645 1.00 42.13 H new ATOM 0 HE3 LYS A 103 -11.984 -1.340 0.462 1.00 42.13 H new ATOM 0 HZ1 LYS A 103 -11.996 -1.980 2.765 1.00 62.14 H new ATOM 0 HZ2 LYS A 103 -13.382 -1.067 2.407 1.00 62.14 H new ATOM 0 HZ3 LYS A 103 -13.497 -2.752 2.584 1.00 62.14 H new ATOM 1497 N ASN A 104 -12.557 -6.356 -3.752 1.00 73.45 N ATOM 1498 CA ASN A 104 -12.864 -7.661 -4.345 1.00 24.13 C ATOM 1499 C ASN A 104 -11.589 -8.466 -4.651 1.00 44.22 C ATOM 1500 O ASN A 104 -11.649 -9.423 -5.425 1.00 22.23 O ATOM 1501 CB ASN A 104 -13.728 -7.469 -5.612 1.00 65.31 C ATOM 1502 CG ASN A 104 -15.167 -7.124 -5.270 1.00 53.25 C ATOM 1503 OD1 ASN A 104 -16.010 -8.013 -5.152 1.00 23.14 O ATOM 1504 ND2 ASN A 104 -15.495 -5.855 -5.088 1.00 70.32 N ATOM 0 H ASN A 104 -12.222 -5.681 -4.440 1.00 73.45 H new ATOM 0 HA ASN A 104 -13.431 -8.242 -3.618 1.00 24.13 H new ATOM 0 HB2 ASN A 104 -13.301 -6.676 -6.226 1.00 65.31 H new ATOM 0 HB3 ASN A 104 -13.705 -8.381 -6.208 1.00 65.31 H new ATOM 0 HD21 ASN A 104 -16.454 -5.606 -4.847 1.00 70.32 H new ATOM 0 HD22 ASN A 104 -14.788 -5.126 -5.188 1.00 70.32 H new ATOM 1510 N TYR A 105 -10.416 -8.062 -4.162 1.00 4.12 N ATOM 1511 CA TYR A 105 -9.143 -8.735 -4.431 1.00 71.54 C ATOM 1512 C TYR A 105 -9.046 -10.100 -3.728 1.00 31.54 C ATOM 1513 O TYR A 105 -9.696 -10.316 -2.700 1.00 72.34 O ATOM 1514 CB TYR A 105 -8.014 -7.793 -3.989 1.00 65.42 C ATOM 1515 CG TYR A 105 -6.630 -8.375 -4.156 1.00 53.45 C ATOM 1516 CD1 TYR A 105 -6.221 -8.844 -5.418 1.00 70.44 C ATOM 1517 CD2 TYR A 105 -5.789 -8.524 -3.037 1.00 12.14 C ATOM 1518 CE1 TYR A 105 -4.996 -9.508 -5.556 1.00 33.52 C ATOM 1519 CE2 TYR A 105 -4.535 -9.136 -3.183 1.00 70.14 C ATOM 1520 CZ TYR A 105 -4.152 -9.654 -4.438 1.00 32.21 C ATOM 1521 OH TYR A 105 -2.970 -10.299 -4.569 1.00 3.41 O ATOM 0 H TYR A 105 -10.321 -7.245 -3.558 1.00 4.12 H new ATOM 0 HA TYR A 105 -9.062 -8.948 -5.497 1.00 71.54 H new ATOM 0 HB2 TYR A 105 -8.080 -6.868 -4.562 1.00 65.42 H new ATOM 0 HB3 TYR A 105 -8.163 -7.530 -2.942 1.00 65.42 H new ATOM 0 HD1 TYR A 105 -6.852 -8.692 -6.281 1.00 70.44 H new ATOM 0 HD2 TYR A 105 -6.108 -8.168 -2.069 1.00 12.14 H new ATOM 0 HE1 TYR A 105 -4.700 -9.906 -6.515 1.00 33.52 H new ATOM 0 HE2 TYR A 105 -3.866 -9.210 -2.338 1.00 70.14 H new ATOM 0 HH TYR A 105 -2.631 -10.178 -5.480 1.00 3.41 H new ATOM 1530 N ARG A 106 -8.220 -10.999 -4.283 1.00 10.33 N ATOM 1531 CA ARG A 106 -7.918 -12.348 -3.804 1.00 53.14 C ATOM 1532 C ARG A 106 -6.400 -12.513 -3.772 1.00 1.43 C ATOM 1533 O ARG A 106 -5.790 -12.657 -4.841 1.00 1.42 O ATOM 1534 CB ARG A 106 -8.566 -13.399 -4.716 1.00 5.11 C ATOM 1535 CG ARG A 106 -10.091 -13.270 -4.696 1.00 41.12 C ATOM 1536 CD ARG A 106 -10.800 -14.563 -4.311 1.00 12.43 C ATOM 1537 NE ARG A 106 -10.949 -15.513 -5.424 1.00 71.24 N ATOM 1538 CZ ARG A 106 -11.784 -15.386 -6.463 1.00 53.20 C ATOM 1539 NH1 ARG A 106 -12.539 -14.301 -6.621 1.00 14.14 N ATOM 1540 NH2 ARG A 106 -11.871 -16.365 -7.354 1.00 2.24 N ATOM 0 H ARG A 106 -7.711 -10.783 -5.140 1.00 10.33 H new ATOM 0 HA ARG A 106 -8.324 -12.492 -2.803 1.00 53.14 H new ATOM 0 HB2 ARG A 106 -8.200 -13.278 -5.735 1.00 5.11 H new ATOM 0 HB3 ARG A 106 -8.277 -14.398 -4.390 1.00 5.11 H new ATOM 0 HG2 ARG A 106 -10.373 -12.486 -3.993 1.00 41.12 H new ATOM 0 HG3 ARG A 106 -10.435 -12.954 -5.681 1.00 41.12 H new ATOM 0 HD2 ARG A 106 -10.245 -15.045 -3.506 1.00 12.43 H new ATOM 0 HD3 ARG A 106 -11.787 -14.322 -3.917 1.00 12.43 H new ATOM 0 HE ARG A 106 -10.361 -16.346 -5.402 1.00 71.24 H new ATOM 0 HH11 ARG A 106 -12.489 -13.542 -5.942 1.00 14.14 H new ATOM 0 HH12 ARG A 106 -13.167 -14.229 -7.421 1.00 14.14 H new ATOM 0 HH21 ARG A 106 -11.304 -17.206 -7.244 1.00 2.24 H new ATOM 0 HH22 ARG A 106 -12.504 -16.277 -8.149 1.00 2.24 H new ATOM 1551 N GLY A 107 -5.781 -12.446 -2.599 1.00 1.01 N ATOM 1552 CA GLY A 107 -4.345 -12.583 -2.402 1.00 34.23 C ATOM 1553 C GLY A 107 -3.959 -11.954 -1.070 1.00 25.43 C ATOM 1554 O GLY A 107 -4.713 -12.087 -0.103 1.00 21.24 O ATOM 0 H GLY A 107 -6.286 -12.289 -1.727 1.00 1.01 H new ATOM 0 HA2 GLY A 107 -4.063 -13.636 -2.416 1.00 34.23 H new ATOM 0 HA3 GLY A 107 -3.806 -12.098 -3.216 1.00 34.23 H new ATOM 1558 N GLU A 108 -2.803 -11.291 -0.980 1.00 25.42 N ATOM 1559 CA GLU A 108 -2.313 -10.761 0.296 1.00 44.34 C ATOM 1560 C GLU A 108 -1.795 -9.332 0.161 1.00 34.51 C ATOM 1561 O GLU A 108 -1.619 -8.805 -0.946 1.00 5.20 O ATOM 1562 CB GLU A 108 -1.235 -11.670 0.917 1.00 74.34 C ATOM 1563 CG GLU A 108 -1.666 -13.124 1.114 1.00 12.12 C ATOM 1564 CD GLU A 108 -0.686 -13.911 1.983 1.00 24.44 C ATOM 1565 OE1 GLU A 108 0.538 -13.850 1.745 1.00 53.01 O ATOM 1566 OE2 GLU A 108 -1.189 -14.570 2.925 1.00 41.05 O ATOM 0 H GLU A 108 -2.189 -11.108 -1.774 1.00 25.42 H new ATOM 0 HA GLU A 108 -3.169 -10.743 0.971 1.00 44.34 H new ATOM 0 HB2 GLU A 108 -0.350 -11.650 0.280 1.00 74.34 H new ATOM 0 HB3 GLU A 108 -0.942 -11.257 1.882 1.00 74.34 H new ATOM 0 HG2 GLU A 108 -2.654 -13.148 1.573 1.00 12.12 H new ATOM 0 HG3 GLU A 108 -1.755 -13.608 0.142 1.00 12.12 H new ATOM 1571 N VAL A 109 -1.547 -8.714 1.318 1.00 2.33 N ATOM 1572 CA VAL A 109 -1.082 -7.341 1.448 1.00 51.14 C ATOM 1573 C VAL A 109 0.258 -7.322 2.167 1.00 20.12 C ATOM 1574 O VAL A 109 0.385 -7.815 3.288 1.00 52.43 O ATOM 1575 CB VAL A 109 -2.136 -6.466 2.167 1.00 52.02 C ATOM 1576 CG1 VAL A 109 -1.695 -4.993 2.202 1.00 33.10 C ATOM 1577 CG2 VAL A 109 -3.517 -6.601 1.516 1.00 34.43 C ATOM 0 H VAL A 109 -1.670 -9.177 2.219 1.00 2.33 H new ATOM 0 HA VAL A 109 -0.942 -6.913 0.455 1.00 51.14 H new ATOM 0 HB VAL A 109 -2.215 -6.826 3.193 1.00 52.02 H new ATOM 0 HG11 VAL A 109 -2.453 -4.398 2.713 1.00 33.10 H new ATOM 0 HG12 VAL A 109 -0.748 -4.909 2.735 1.00 33.10 H new ATOM 0 HG13 VAL A 109 -1.571 -4.626 1.183 1.00 33.10 H new ATOM 0 HG21 VAL A 109 -4.232 -5.973 2.047 1.00 34.43 H new ATOM 0 HG22 VAL A 109 -3.460 -6.286 0.474 1.00 34.43 H new ATOM 0 HG23 VAL A 109 -3.842 -7.640 1.564 1.00 34.43 H new ATOM 1587 N ALA A 110 1.260 -6.697 1.559 1.00 41.34 N ATOM 1588 CA ALA A 110 2.458 -6.295 2.268 1.00 24.32 C ATOM 1589 C ALA A 110 2.811 -4.870 1.854 1.00 40.42 C ATOM 1590 O ALA A 110 2.408 -4.407 0.783 1.00 72.42 O ATOM 1591 CB ALA A 110 3.579 -7.305 2.010 1.00 74.33 C ATOM 0 H ALA A 110 1.261 -6.458 0.567 1.00 41.34 H new ATOM 0 HA ALA A 110 2.299 -6.292 3.346 1.00 24.32 H new ATOM 0 HB1 ALA A 110 4.477 -6.997 2.546 1.00 74.33 H new ATOM 0 HB2 ALA A 110 3.269 -8.290 2.358 1.00 74.33 H new ATOM 0 HB3 ALA A 110 3.791 -7.348 0.942 1.00 74.33 H new ATOM 1597 N SER A 111 3.549 -4.164 2.704 1.00 24.41 N ATOM 1598 CA SER A 111 3.892 -2.772 2.503 1.00 22.52 C ATOM 1599 C SER A 111 5.335 -2.555 2.948 1.00 1.30 C ATOM 1600 O SER A 111 5.779 -3.168 3.925 1.00 20.21 O ATOM 1601 CB SER A 111 2.874 -1.911 3.263 1.00 32.33 C ATOM 1602 OG SER A 111 2.955 -0.539 2.945 1.00 32.41 O ATOM 0 H SER A 111 3.929 -4.556 3.566 1.00 24.41 H new ATOM 0 HA SER A 111 3.840 -2.479 1.454 1.00 22.52 H new ATOM 0 HB2 SER A 111 1.869 -2.269 3.042 1.00 32.33 H new ATOM 0 HB3 SER A 111 3.029 -2.038 4.334 1.00 32.33 H new ATOM 0 HG SER A 111 3.364 -0.432 2.061 1.00 32.41 H new ATOM 1607 N PHE A 112 6.056 -1.668 2.262 1.00 71.14 N ATOM 1608 CA PHE A 112 7.493 -1.482 2.399 1.00 71.52 C ATOM 1609 C PHE A 112 7.818 0.018 2.383 1.00 40.04 C ATOM 1610 O PHE A 112 7.614 0.666 1.359 1.00 73.41 O ATOM 1611 CB PHE A 112 8.207 -2.306 1.302 1.00 24.43 C ATOM 1612 CG PHE A 112 7.972 -1.934 -0.163 1.00 31.41 C ATOM 1613 CD1 PHE A 112 6.793 -2.315 -0.839 1.00 14.34 C ATOM 1614 CD2 PHE A 112 8.972 -1.254 -0.886 1.00 75.25 C ATOM 1615 CE1 PHE A 112 6.594 -1.941 -2.181 1.00 2.00 C ATOM 1616 CE2 PHE A 112 8.762 -0.863 -2.217 1.00 60.45 C ATOM 1617 CZ PHE A 112 7.568 -1.200 -2.866 1.00 75.21 C ATOM 0 H PHE A 112 5.638 -1.041 1.574 1.00 71.14 H new ATOM 0 HA PHE A 112 7.862 -1.854 3.355 1.00 71.52 H new ATOM 0 HB2 PHE A 112 9.279 -2.249 1.490 1.00 24.43 H new ATOM 0 HB3 PHE A 112 7.916 -3.349 1.429 1.00 24.43 H new ATOM 0 HD1 PHE A 112 6.041 -2.895 -0.325 1.00 14.34 H new ATOM 0 HD2 PHE A 112 9.914 -1.030 -0.408 1.00 75.25 H new ATOM 0 HE1 PHE A 112 5.684 -2.227 -2.687 1.00 2.00 H new ATOM 0 HE2 PHE A 112 9.522 -0.302 -2.741 1.00 60.45 H new ATOM 0 HZ PHE A 112 7.398 -0.891 -3.887 1.00 75.21 H new ATOM 1626 N PHE A 113 8.295 0.603 3.491 1.00 63.15 N ATOM 1627 CA PHE A 113 8.668 2.028 3.549 1.00 43.04 C ATOM 1628 C PHE A 113 10.190 2.208 3.514 1.00 61.52 C ATOM 1629 O PHE A 113 10.943 1.255 3.742 1.00 34.54 O ATOM 1630 CB PHE A 113 8.014 2.741 4.752 1.00 72.25 C ATOM 1631 CG PHE A 113 8.127 2.061 6.105 1.00 23.13 C ATOM 1632 CD1 PHE A 113 9.212 2.309 6.962 1.00 61.21 C ATOM 1633 CD2 PHE A 113 7.107 1.198 6.529 1.00 74.51 C ATOM 1634 CE1 PHE A 113 9.288 1.675 8.213 1.00 63.25 C ATOM 1635 CE2 PHE A 113 7.195 0.534 7.766 1.00 41.03 C ATOM 1636 CZ PHE A 113 8.289 0.768 8.609 1.00 72.12 C ATOM 0 H PHE A 113 8.434 0.106 4.371 1.00 63.15 H new ATOM 0 HA PHE A 113 8.274 2.511 2.655 1.00 43.04 H new ATOM 0 HB2 PHE A 113 8.453 3.735 4.835 1.00 72.25 H new ATOM 0 HB3 PHE A 113 6.956 2.878 4.530 1.00 72.25 H new ATOM 0 HD1 PHE A 113 9.992 2.991 6.657 1.00 61.21 H new ATOM 0 HD2 PHE A 113 6.244 1.041 5.899 1.00 74.51 H new ATOM 0 HE1 PHE A 113 10.117 1.885 8.873 1.00 63.25 H new ATOM 0 HE2 PHE A 113 6.420 -0.156 8.066 1.00 41.03 H new ATOM 0 HZ PHE A 113 8.365 0.255 9.557 1.00 72.12 H new ATOM 1645 N THR A 114 10.638 3.436 3.237 1.00 60.12 N ATOM 1646 CA THR A 114 12.048 3.844 3.139 1.00 32.43 C ATOM 1647 C THR A 114 12.404 4.901 4.206 1.00 40.15 C ATOM 1648 O THR A 114 13.379 5.648 4.084 1.00 11.43 O ATOM 1649 CB THR A 114 12.346 4.329 1.705 1.00 55.11 C ATOM 1650 OG1 THR A 114 11.413 5.313 1.282 1.00 13.21 O ATOM 1651 CG2 THR A 114 12.346 3.177 0.700 1.00 62.24 C ATOM 0 H THR A 114 9.999 4.212 3.066 1.00 60.12 H new ATOM 0 HA THR A 114 12.685 2.984 3.343 1.00 32.43 H new ATOM 0 HB THR A 114 13.343 4.769 1.735 1.00 55.11 H new ATOM 0 HG1 THR A 114 11.631 5.600 0.371 1.00 13.21 H new ATOM 0 HG21 THR A 114 12.560 3.563 -0.296 1.00 62.24 H new ATOM 0 HG22 THR A 114 13.109 2.451 0.979 1.00 62.24 H new ATOM 0 HG23 THR A 114 11.369 2.694 0.700 1.00 62.24 H new ATOM 1659 N SER A 115 11.568 5.006 5.238 1.00 55.43 N ATOM 1660 CA SER A 115 11.551 6.067 6.223 1.00 4.31 C ATOM 1661 C SER A 115 11.508 5.436 7.601 1.00 60.15 C ATOM 1662 O SER A 115 10.473 4.958 8.076 1.00 20.13 O ATOM 1663 CB SER A 115 10.328 6.931 5.978 1.00 2.32 C ATOM 1664 OG SER A 115 10.612 8.157 5.338 1.00 43.32 O ATOM 0 H SER A 115 10.845 4.308 5.412 1.00 55.43 H new ATOM 0 HA SER A 115 12.440 6.693 6.151 1.00 4.31 H new ATOM 0 HB2 SER A 115 9.616 6.372 5.371 1.00 2.32 H new ATOM 0 HB3 SER A 115 9.842 7.135 6.932 1.00 2.32 H new ATOM 0 HG SER A 115 10.192 8.169 4.453 1.00 43.32 H new ATOM 1669 N ALA A 116 12.670 5.433 8.232 1.00 52.34 N ATOM 1670 CA ALA A 116 12.839 5.018 9.614 1.00 64.35 C ATOM 1671 C ALA A 116 13.234 6.190 10.518 1.00 44.44 C ATOM 1672 O ALA A 116 13.437 5.977 11.716 1.00 44.24 O ATOM 1673 CB ALA A 116 13.859 3.887 9.688 1.00 75.32 C ATOM 0 H ALA A 116 13.541 5.725 7.788 1.00 52.34 H new ATOM 0 HA ALA A 116 11.881 4.653 9.984 1.00 64.35 H new ATOM 0 HB1 ALA A 116 13.984 3.577 10.726 1.00 75.32 H new ATOM 0 HB2 ALA A 116 13.508 3.041 9.097 1.00 75.32 H new ATOM 0 HB3 ALA A 116 14.815 4.233 9.295 1.00 75.32 H new ATOM 1679 N GLY A 117 13.371 7.396 9.948 1.00 34.51 N ATOM 1680 CA GLY A 117 14.087 8.515 10.563 1.00 73.14 C ATOM 1681 C GLY A 117 13.548 8.807 11.951 1.00 72.31 C ATOM 1682 O GLY A 117 14.225 8.585 12.957 1.00 74.22 O ATOM 0 H GLY A 117 12.980 7.621 9.033 1.00 34.51 H new ATOM 0 HA2 GLY A 117 15.150 8.282 10.623 1.00 73.14 H new ATOM 0 HA3 GLY A 117 13.990 9.402 9.937 1.00 73.14 H new ATOM 1686 N THR A 118 12.289 9.230 11.998 1.00 0.44 N ATOM 1687 CA THR A 118 11.610 9.575 13.237 1.00 32.53 C ATOM 1688 C THR A 118 10.397 8.668 13.474 1.00 21.10 C ATOM 1689 O THR A 118 9.730 8.768 14.505 1.00 0.13 O ATOM 1690 CB THR A 118 11.245 11.071 13.225 1.00 4.21 C ATOM 1691 OG1 THR A 118 12.141 11.841 12.441 1.00 22.31 O ATOM 1692 CG2 THR A 118 11.311 11.618 14.646 1.00 22.11 C ATOM 0 H THR A 118 11.708 9.343 11.168 1.00 0.44 H new ATOM 0 HA THR A 118 12.281 9.405 14.079 1.00 32.53 H new ATOM 0 HB THR A 118 10.244 11.147 12.800 1.00 4.21 H new ATOM 0 HG1 THR A 118 11.868 12.782 12.462 1.00 22.31 H new ATOM 0 HG21 THR A 118 11.053 12.677 14.641 1.00 22.11 H new ATOM 0 HG22 THR A 118 10.607 11.076 15.277 1.00 22.11 H new ATOM 0 HG23 THR A 118 12.320 11.492 15.038 1.00 22.11 H new ATOM 1700 N ASN A 119 10.122 7.731 12.562 1.00 42.25 N ATOM 1701 CA ASN A 119 9.018 6.789 12.655 1.00 75.15 C ATOM 1702 C ASN A 119 9.521 5.388 12.422 1.00 23.51 C ATOM 1703 O ASN A 119 10.389 5.175 11.584 1.00 13.04 O ATOM 1704 CB ASN A 119 7.938 7.125 11.634 1.00 15.42 C ATOM 1705 CG ASN A 119 7.031 8.196 12.195 1.00 42.25 C ATOM 1706 OD1 ASN A 119 6.945 9.281 11.640 1.00 4.12 O ATOM 1707 ND2 ASN A 119 6.345 7.900 13.291 1.00 24.50 N ATOM 0 H ASN A 119 10.681 7.609 11.717 1.00 42.25 H new ATOM 0 HA ASN A 119 8.586 6.858 13.653 1.00 75.15 H new ATOM 0 HB2 ASN A 119 8.394 7.469 10.706 1.00 15.42 H new ATOM 0 HB3 ASN A 119 7.360 6.233 11.393 1.00 15.42 H new ATOM 0 HD21 ASN A 119 5.717 8.591 13.701 1.00 24.50 H new ATOM 0 HD22 ASN A 119 6.446 6.982 13.723 1.00 24.50 H new ATOM 1713 N HIS A 120 8.926 4.437 13.132 1.00 43.14 N ATOM 1714 CA HIS A 120 8.961 3.035 12.789 1.00 15.02 C ATOM 1715 C HIS A 120 7.618 2.454 13.218 1.00 52.23 C ATOM 1716 O HIS A 120 6.673 2.414 12.428 1.00 3.14 O ATOM 1717 CB HIS A 120 10.204 2.360 13.388 1.00 23.20 C ATOM 1718 CG HIS A 120 10.377 0.931 12.950 1.00 64.13 C ATOM 1719 ND1 HIS A 120 10.754 -0.130 13.742 1.00 73.34 N ATOM 1720 CD2 HIS A 120 10.221 0.467 11.674 1.00 63.35 C ATOM 1721 CE1 HIS A 120 10.822 -1.212 12.949 1.00 52.44 C ATOM 1722 NE2 HIS A 120 10.487 -0.903 11.683 1.00 40.01 N ATOM 0 H HIS A 120 8.395 4.632 13.981 1.00 43.14 H new ATOM 0 HA HIS A 120 9.074 2.858 11.719 1.00 15.02 H new ATOM 0 HB2 HIS A 120 11.089 2.929 13.105 1.00 23.20 H new ATOM 0 HB3 HIS A 120 10.138 2.394 14.475 1.00 23.20 H new ATOM 0 HD2 HIS A 120 9.942 1.055 10.813 1.00 63.35 H new ATOM 0 HE1 HIS A 120 11.108 -2.199 13.283 1.00 52.44 H new ATOM 0 HE2 HIS A 120 10.437 -1.542 10.889 1.00 40.01 H new ATOM 1729 N LYS A 121 7.473 2.070 14.489 1.00 71.24 N ATOM 1730 CA LYS A 121 6.292 1.325 14.919 1.00 32.13 C ATOM 1731 C LYS A 121 5.002 2.153 14.901 1.00 24.13 C ATOM 1732 O LYS A 121 3.940 1.537 14.884 1.00 0.32 O ATOM 1733 CB LYS A 121 6.556 0.646 16.276 1.00 33.22 C ATOM 1734 CG LYS A 121 5.999 -0.787 16.375 1.00 34.41 C ATOM 1735 CD LYS A 121 4.677 -0.916 17.141 1.00 60.42 C ATOM 1736 CE LYS A 121 4.318 -2.393 17.376 1.00 13.31 C ATOM 1737 NZ LYS A 121 3.904 -3.111 16.150 1.00 62.22 N ATOM 0 H LYS A 121 8.150 2.260 15.228 1.00 71.24 H new ATOM 0 HA LYS A 121 6.115 0.543 14.181 1.00 32.13 H new ATOM 0 HB2 LYS A 121 7.631 0.621 16.456 1.00 33.22 H new ATOM 0 HB3 LYS A 121 6.115 1.253 17.067 1.00 33.22 H new ATOM 0 HG2 LYS A 121 5.857 -1.176 15.367 1.00 34.41 H new ATOM 0 HG3 LYS A 121 6.745 -1.418 16.858 1.00 34.41 H new ATOM 0 HD2 LYS A 121 4.755 -0.400 18.098 1.00 60.42 H new ATOM 0 HD3 LYS A 121 3.879 -0.429 16.581 1.00 60.42 H new ATOM 0 HE2 LYS A 121 5.179 -2.902 17.810 1.00 13.31 H new ATOM 0 HE3 LYS A 121 3.512 -2.449 18.108 1.00 13.31 H new ATOM 0 HZ1 LYS A 121 3.678 -4.098 16.386 1.00 62.22 H new ATOM 0 HZ2 LYS A 121 3.064 -2.651 15.745 1.00 62.22 H new ATOM 0 HZ3 LYS A 121 4.679 -3.089 15.457 1.00 62.22 H new ATOM 1747 N ALA A 122 5.043 3.499 14.841 1.00 60.14 N ATOM 1748 CA ALA A 122 3.807 4.265 14.674 1.00 32.54 C ATOM 1749 C ALA A 122 3.135 3.889 13.355 1.00 62.15 C ATOM 1750 O ALA A 122 1.942 3.599 13.317 1.00 63.44 O ATOM 1751 CB ALA A 122 4.121 5.760 14.684 1.00 54.25 C ATOM 0 H ALA A 122 5.894 4.058 14.904 1.00 60.14 H new ATOM 0 HA ALA A 122 3.131 4.033 15.497 1.00 32.54 H new ATOM 0 HB1 ALA A 122 3.198 6.326 14.559 1.00 54.25 H new ATOM 0 HB2 ALA A 122 4.586 6.028 15.633 1.00 54.25 H new ATOM 0 HB3 ALA A 122 4.803 5.994 13.867 1.00 54.25 H new ATOM 1757 N TYR A 123 3.921 3.871 12.273 1.00 61.21 N ATOM 1758 CA TYR A 123 3.439 3.618 10.926 1.00 1.31 C ATOM 1759 C TYR A 123 2.764 2.257 10.835 1.00 4.02 C ATOM 1760 O TYR A 123 1.762 2.115 10.148 1.00 15.44 O ATOM 1761 CB TYR A 123 4.614 3.683 9.951 1.00 0.40 C ATOM 1762 CG TYR A 123 4.201 3.623 8.495 1.00 14.43 C ATOM 1763 CD1 TYR A 123 3.809 4.794 7.814 1.00 62.21 C ATOM 1764 CD2 TYR A 123 4.211 2.390 7.818 1.00 0.02 C ATOM 1765 CE1 TYR A 123 3.527 4.753 6.440 1.00 20.44 C ATOM 1766 CE2 TYR A 123 3.892 2.335 6.452 1.00 4.32 C ATOM 1767 CZ TYR A 123 3.586 3.522 5.751 1.00 34.30 C ATOM 1768 OH TYR A 123 3.372 3.474 4.413 1.00 2.11 O ATOM 0 H TYR A 123 4.927 4.036 12.318 1.00 61.21 H new ATOM 0 HA TYR A 123 2.702 4.378 10.669 1.00 1.31 H new ATOM 0 HB2 TYR A 123 5.168 4.605 10.125 1.00 0.40 H new ATOM 0 HB3 TYR A 123 5.295 2.858 10.161 1.00 0.40 H new ATOM 0 HD1 TYR A 123 3.725 5.727 8.352 1.00 62.21 H new ATOM 0 HD2 TYR A 123 4.464 1.485 8.350 1.00 0.02 H new ATOM 0 HE1 TYR A 123 3.266 5.658 5.912 1.00 20.44 H new ATOM 0 HE2 TYR A 123 3.881 1.385 5.938 1.00 4.32 H new ATOM 0 HH TYR A 123 3.452 2.548 4.102 1.00 2.11 H new ATOM 1777 N VAL A 124 3.285 1.255 11.545 1.00 73.41 N ATOM 1778 CA VAL A 124 2.734 -0.089 11.519 1.00 4.14 C ATOM 1779 C VAL A 124 1.289 -0.096 12.028 1.00 73.51 C ATOM 1780 O VAL A 124 0.446 -0.767 11.432 1.00 15.01 O ATOM 1781 CB VAL A 124 3.664 -1.047 12.288 1.00 73.34 C ATOM 1782 CG1 VAL A 124 3.106 -2.477 12.303 1.00 72.45 C ATOM 1783 CG2 VAL A 124 5.065 -1.038 11.647 1.00 52.02 C ATOM 0 H VAL A 124 4.099 1.358 12.151 1.00 73.41 H new ATOM 0 HA VAL A 124 2.686 -0.450 10.492 1.00 4.14 H new ATOM 0 HB VAL A 124 3.730 -0.701 13.319 1.00 73.34 H new ATOM 0 HG11 VAL A 124 3.786 -3.127 12.853 1.00 72.45 H new ATOM 0 HG12 VAL A 124 2.129 -2.481 12.786 1.00 72.45 H new ATOM 0 HG13 VAL A 124 3.006 -2.839 11.280 1.00 72.45 H new ATOM 0 HG21 VAL A 124 5.720 -1.717 12.194 1.00 52.02 H new ATOM 0 HG22 VAL A 124 4.992 -1.362 10.609 1.00 52.02 H new ATOM 0 HG23 VAL A 124 5.476 -0.029 11.684 1.00 52.02 H new ATOM 1793 N SER A 125 0.993 0.657 13.089 1.00 55.14 N ATOM 1794 CA SER A 125 -0.373 0.797 13.567 1.00 44.14 C ATOM 1795 C SER A 125 -1.177 1.619 12.556 1.00 4.30 C ATOM 1796 O SER A 125 -2.229 1.180 12.093 1.00 72.22 O ATOM 1797 CB SER A 125 -0.363 1.399 14.976 1.00 75.45 C ATOM 1798 OG SER A 125 -1.593 1.163 15.641 1.00 52.41 O ATOM 0 H SER A 125 1.684 1.177 13.630 1.00 55.14 H new ATOM 0 HA SER A 125 -0.863 -0.173 13.648 1.00 44.14 H new ATOM 0 HB2 SER A 125 0.455 0.967 15.553 1.00 75.45 H new ATOM 0 HB3 SER A 125 -0.179 2.472 14.915 1.00 75.45 H new ATOM 0 HG SER A 125 -1.560 1.555 16.538 1.00 52.41 H new ATOM 1803 N HIS A 126 -0.665 2.785 12.152 1.00 14.12 N ATOM 1804 CA HIS A 126 -1.376 3.692 11.260 1.00 55.25 C ATOM 1805 C HIS A 126 -1.763 3.046 9.925 1.00 61.23 C ATOM 1806 O HIS A 126 -2.829 3.355 9.382 1.00 72.14 O ATOM 1807 CB HIS A 126 -0.520 4.934 10.998 1.00 23.52 C ATOM 1808 CG HIS A 126 -0.269 5.818 12.194 1.00 12.32 C ATOM 1809 ND1 HIS A 126 0.868 6.563 12.397 1.00 62.53 N ATOM 1810 CD2 HIS A 126 -1.147 6.113 13.203 1.00 52.35 C ATOM 1811 CE1 HIS A 126 0.689 7.276 13.523 1.00 31.33 C ATOM 1812 NE2 HIS A 126 -0.525 7.041 14.048 1.00 21.11 N ATOM 0 H HIS A 126 0.254 3.123 12.437 1.00 14.12 H new ATOM 0 HA HIS A 126 -2.304 3.964 11.762 1.00 55.25 H new ATOM 0 HB2 HIS A 126 0.442 4.612 10.598 1.00 23.52 H new ATOM 0 HB3 HIS A 126 -1.004 5.530 10.224 1.00 23.52 H new ATOM 0 HD1 HIS A 126 1.696 6.573 11.802 1.00 62.53 H new ATOM 0 HD2 HIS A 126 -2.139 5.704 13.325 1.00 52.35 H new ATOM 0 HE1 HIS A 126 1.422 7.946 13.948 1.00 31.33 H new ATOM 1819 N PHE A 127 -0.900 2.192 9.371 1.00 24.42 N ATOM 1820 CA PHE A 127 -1.169 1.463 8.144 1.00 35.52 C ATOM 1821 C PHE A 127 -2.283 0.456 8.378 1.00 40.24 C ATOM 1822 O PHE A 127 -3.210 0.402 7.576 1.00 21.13 O ATOM 1823 CB PHE A 127 0.093 0.744 7.640 1.00 62.15 C ATOM 1824 CG PHE A 127 -0.137 -0.093 6.389 1.00 42.04 C ATOM 1825 CD1 PHE A 127 -0.754 0.485 5.266 1.00 32.43 C ATOM 1826 CD2 PHE A 127 0.227 -1.452 6.344 1.00 15.03 C ATOM 1827 CE1 PHE A 127 -0.960 -0.257 4.089 1.00 40.14 C ATOM 1828 CE2 PHE A 127 0.011 -2.206 5.175 1.00 51.02 C ATOM 1829 CZ PHE A 127 -0.579 -1.608 4.047 1.00 4.32 C ATOM 0 H PHE A 127 0.016 1.989 9.772 1.00 24.42 H new ATOM 0 HA PHE A 127 -1.479 2.177 7.381 1.00 35.52 H new ATOM 0 HB2 PHE A 127 0.865 1.486 7.433 1.00 62.15 H new ATOM 0 HB3 PHE A 127 0.474 0.100 8.432 1.00 62.15 H new ATOM 0 HD1 PHE A 127 -1.075 1.515 5.308 1.00 32.43 H new ATOM 0 HD2 PHE A 127 0.674 -1.918 7.210 1.00 15.03 H new ATOM 0 HE1 PHE A 127 -1.408 0.209 3.224 1.00 40.14 H new ATOM 0 HE2 PHE A 127 0.299 -3.246 5.144 1.00 51.02 H new ATOM 0 HZ PHE A 127 -0.739 -2.187 3.150 1.00 4.32 H new ATOM 1838 N ASN A 128 -2.196 -0.321 9.464 1.00 1.22 N ATOM 1839 CA ASN A 128 -3.117 -1.413 9.757 1.00 52.23 C ATOM 1840 C ASN A 128 -4.558 -0.942 9.718 1.00 54.54 C ATOM 1841 O ASN A 128 -5.398 -1.628 9.136 1.00 22.13 O ATOM 1842 CB ASN A 128 -2.815 -2.059 11.116 1.00 61.35 C ATOM 1843 CG ASN A 128 -2.053 -3.352 10.922 1.00 32.22 C ATOM 1844 OD1 ASN A 128 -2.607 -4.337 10.444 1.00 75.41 O ATOM 1845 ND2 ASN A 128 -0.769 -3.378 11.230 1.00 22.51 N ATOM 0 H ASN A 128 -1.471 -0.203 10.172 1.00 1.22 H new ATOM 0 HA ASN A 128 -2.973 -2.165 8.981 1.00 52.23 H new ATOM 0 HB2 ASN A 128 -2.232 -1.374 11.731 1.00 61.35 H new ATOM 0 HB3 ASN A 128 -3.746 -2.253 11.649 1.00 61.35 H new ATOM 0 HD21 ASN A 128 -0.223 -4.225 11.071 1.00 22.51 H new ATOM 0 HD22 ASN A 128 -0.323 -2.551 11.627 1.00 22.51 H new ATOM 1851 N GLU A 129 -4.846 0.234 10.280 1.00 40.45 N ATOM 1852 CA GLU A 129 -6.193 0.784 10.291 1.00 4.24 C ATOM 1853 C GLU A 129 -6.704 1.057 8.885 1.00 22.30 C ATOM 1854 O GLU A 129 -7.861 0.767 8.566 1.00 24.43 O ATOM 1855 CB GLU A 129 -6.232 2.091 11.097 1.00 41.41 C ATOM 1856 CG GLU A 129 -5.709 1.972 12.529 1.00 52.42 C ATOM 1857 CD GLU A 129 -6.294 0.781 13.294 1.00 73.05 C ATOM 1858 OE1 GLU A 129 -7.516 0.533 13.160 1.00 71.12 O ATOM 1859 OE2 GLU A 129 -5.527 0.112 14.027 1.00 60.23 O ATOM 0 H GLU A 129 -4.152 0.825 10.737 1.00 40.45 H new ATOM 0 HA GLU A 129 -6.838 0.039 10.756 1.00 4.24 H new ATOM 0 HB2 GLU A 129 -5.645 2.844 10.571 1.00 41.41 H new ATOM 0 HB3 GLU A 129 -7.260 2.452 11.128 1.00 41.41 H new ATOM 0 HG2 GLU A 129 -4.623 1.881 12.505 1.00 52.42 H new ATOM 0 HG3 GLU A 129 -5.940 2.890 13.069 1.00 52.42 H new ATOM 1864 N TRP A 130 -5.854 1.634 8.039 1.00 22.21 N ATOM 1865 CA TRP A 130 -6.246 2.025 6.700 1.00 4.44 C ATOM 1866 C TRP A 130 -6.217 0.810 5.756 1.00 2.13 C ATOM 1867 O TRP A 130 -6.787 0.888 4.667 1.00 63.35 O ATOM 1868 CB TRP A 130 -5.326 3.166 6.261 1.00 41.15 C ATOM 1869 CG TRP A 130 -5.470 4.482 6.987 1.00 15.50 C ATOM 1870 CD1 TRP A 130 -6.286 4.772 8.034 1.00 31.24 C ATOM 1871 CD2 TRP A 130 -4.756 5.723 6.702 1.00 43.22 C ATOM 1872 NE1 TRP A 130 -6.167 6.111 8.364 1.00 4.52 N ATOM 1873 CE2 TRP A 130 -5.198 6.734 7.606 1.00 3.24 C ATOM 1874 CE3 TRP A 130 -3.766 6.089 5.766 1.00 13.32 C ATOM 1875 CZ2 TRP A 130 -4.670 8.035 7.583 1.00 3.20 C ATOM 1876 CZ3 TRP A 130 -3.206 7.379 5.765 1.00 0.50 C ATOM 1877 CH2 TRP A 130 -3.655 8.353 6.672 1.00 3.41 C ATOM 0 H TRP A 130 -4.881 1.840 8.267 1.00 22.21 H new ATOM 0 HA TRP A 130 -7.274 2.387 6.673 1.00 4.44 H new ATOM 0 HB2 TRP A 130 -4.295 2.830 6.370 1.00 41.15 H new ATOM 0 HB3 TRP A 130 -5.492 3.345 5.199 1.00 41.15 H new ATOM 0 HD1 TRP A 130 -6.931 4.064 8.534 1.00 31.24 H new ATOM 0 HE1 TRP A 130 -6.726 6.578 9.078 1.00 4.52 H new ATOM 0 HE3 TRP A 130 -3.432 5.365 5.037 1.00 13.32 H new ATOM 0 HZ2 TRP A 130 -5.044 8.786 8.263 1.00 3.20 H new ATOM 0 HZ3 TRP A 130 -2.424 7.623 5.061 1.00 0.50 H new ATOM 0 HH2 TRP A 130 -3.220 9.341 6.667 1.00 3.41 H new ATOM 1887 N ALA A 131 -5.603 -0.306 6.166 1.00 22.40 N ATOM 1888 CA ALA A 131 -5.476 -1.539 5.387 1.00 23.30 C ATOM 1889 C ALA A 131 -6.530 -2.580 5.770 1.00 45.53 C ATOM 1890 O ALA A 131 -6.844 -3.463 4.965 1.00 33.40 O ATOM 1891 CB ALA A 131 -4.075 -2.129 5.589 1.00 15.40 C ATOM 0 H ALA A 131 -5.165 -0.376 7.085 1.00 22.40 H new ATOM 0 HA ALA A 131 -5.634 -1.284 4.339 1.00 23.30 H new ATOM 0 HB1 ALA A 131 -3.980 -3.047 5.009 1.00 15.40 H new ATOM 0 HB2 ALA A 131 -3.326 -1.410 5.256 1.00 15.40 H new ATOM 0 HB3 ALA A 131 -3.922 -2.349 6.645 1.00 15.40 H new ATOM 1897 N ASP A 132 -7.082 -2.455 6.980 1.00 50.24 N ATOM 1898 CA ASP A 132 -8.030 -3.350 7.625 1.00 34.30 C ATOM 1899 C ASP A 132 -9.124 -3.758 6.651 1.00 24.11 C ATOM 1900 O ASP A 132 -9.733 -2.897 6.010 1.00 61.03 O ATOM 1901 CB ASP A 132 -8.612 -2.658 8.863 1.00 11.54 C ATOM 1902 CG ASP A 132 -9.420 -3.631 9.704 1.00 72.15 C ATOM 1903 OD1 ASP A 132 -8.801 -4.458 10.406 1.00 52.13 O ATOM 1904 OD2 ASP A 132 -10.668 -3.537 9.691 1.00 32.10 O ATOM 0 H ASP A 132 -6.855 -1.659 7.577 1.00 50.24 H new ATOM 0 HA ASP A 132 -7.520 -4.260 7.940 1.00 34.30 H new ATOM 0 HB2 ASP A 132 -7.804 -2.238 9.462 1.00 11.54 H new ATOM 0 HB3 ASP A 132 -9.245 -1.826 8.555 1.00 11.54 H new ATOM 1908 N GLY A 133 -9.275 -5.068 6.475 1.00 21.42 N ATOM 1909 CA GLY A 133 -10.191 -5.703 5.536 1.00 22.34 C ATOM 1910 C GLY A 133 -9.492 -6.679 4.595 1.00 25.00 C ATOM 1911 O GLY A 133 -10.136 -7.588 4.071 1.00 73.03 O ATOM 0 H GLY A 133 -8.735 -5.747 7.010 1.00 21.42 H new ATOM 0 HA2 GLY A 133 -10.964 -6.233 6.092 1.00 22.34 H new ATOM 0 HA3 GLY A 133 -10.692 -4.934 4.948 1.00 22.34 H new ATOM 1915 N LEU A 134 -8.174 -6.559 4.408 1.00 23.02 N ATOM 1916 CA LEU A 134 -7.399 -7.423 3.516 1.00 11.30 C ATOM 1917 C LEU A 134 -6.289 -8.133 4.290 1.00 65.32 C ATOM 1918 O LEU A 134 -6.004 -7.775 5.437 1.00 25.50 O ATOM 1919 CB LEU A 134 -6.837 -6.587 2.363 1.00 21.42 C ATOM 1920 CG LEU A 134 -7.890 -6.016 1.400 1.00 62.12 C ATOM 1921 CD1 LEU A 134 -7.182 -5.012 0.487 1.00 50.13 C ATOM 1922 CD2 LEU A 134 -8.574 -7.094 0.548 1.00 62.11 C ATOM 0 H LEU A 134 -7.610 -5.851 4.878 1.00 23.02 H new ATOM 0 HA LEU A 134 -8.047 -8.194 3.099 1.00 11.30 H new ATOM 0 HB2 LEU A 134 -6.262 -5.760 2.780 1.00 21.42 H new ATOM 0 HB3 LEU A 134 -6.142 -7.203 1.793 1.00 21.42 H new ATOM 0 HG LEU A 134 -8.678 -5.547 1.989 1.00 62.12 H new ATOM 0 HD11 LEU A 134 -7.902 -4.585 -0.212 1.00 50.13 H new ATOM 0 HD12 LEU A 134 -6.746 -4.216 1.091 1.00 50.13 H new ATOM 0 HD13 LEU A 134 -6.393 -5.519 -0.069 1.00 50.13 H new ATOM 0 HD21 LEU A 134 -9.306 -6.627 -0.111 1.00 62.11 H new ATOM 0 HD22 LEU A 134 -7.826 -7.613 -0.051 1.00 62.11 H new ATOM 0 HD23 LEU A 134 -9.076 -7.809 1.200 1.00 62.11 H new ATOM 1933 N ASN A 135 -5.692 -9.163 3.689 1.00 24.32 N ATOM 1934 CA ASN A 135 -4.845 -10.125 4.390 1.00 71.51 C ATOM 1935 C ASN A 135 -3.409 -9.623 4.492 1.00 40.11 C ATOM 1936 O ASN A 135 -2.561 -9.980 3.672 1.00 2.31 O ATOM 1937 CB ASN A 135 -4.891 -11.491 3.696 1.00 10.01 C ATOM 1938 CG ASN A 135 -4.330 -12.551 4.630 1.00 62.52 C ATOM 1939 OD1 ASN A 135 -4.941 -12.879 5.642 1.00 65.51 O ATOM 1940 ND2 ASN A 135 -3.156 -13.085 4.376 1.00 2.11 N ATOM 0 H ASN A 135 -5.785 -9.354 2.691 1.00 24.32 H new ATOM 0 HA ASN A 135 -5.233 -10.238 5.402 1.00 71.51 H new ATOM 0 HB2 ASN A 135 -5.917 -11.738 3.422 1.00 10.01 H new ATOM 0 HB3 ASN A 135 -4.313 -11.462 2.772 1.00 10.01 H new ATOM 0 HD21 ASN A 135 -2.757 -13.769 5.019 1.00 2.11 H new ATOM 0 HD22 ASN A 135 -2.644 -12.816 3.536 1.00 2.11 H new ATOM 1946 N VAL A 136 -3.129 -8.757 5.461 1.00 62.51 N ATOM 1947 CA VAL A 136 -1.824 -8.122 5.583 1.00 21.41 C ATOM 1948 C VAL A 136 -0.868 -8.995 6.398 1.00 20.12 C ATOM 1949 O VAL A 136 -1.077 -9.263 7.586 1.00 43.32 O ATOM 1950 CB VAL A 136 -1.933 -6.646 6.020 1.00 1.40 C ATOM 1951 CG1 VAL A 136 -2.865 -6.480 7.207 1.00 11.33 C ATOM 1952 CG2 VAL A 136 -0.576 -5.980 6.281 1.00 51.22 C ATOM 0 H VAL A 136 -3.797 -8.478 6.179 1.00 62.51 H new ATOM 0 HA VAL A 136 -1.364 -8.054 4.597 1.00 21.41 H new ATOM 0 HB VAL A 136 -2.367 -6.121 5.169 1.00 1.40 H new ATOM 0 HG11 VAL A 136 -2.916 -5.427 7.485 1.00 11.33 H new ATOM 0 HG12 VAL A 136 -3.861 -6.833 6.940 1.00 11.33 H new ATOM 0 HG13 VAL A 136 -2.488 -7.060 8.049 1.00 11.33 H new ATOM 0 HG21 VAL A 136 -0.731 -4.945 6.584 1.00 51.22 H new ATOM 0 HG22 VAL A 136 -0.054 -6.516 7.074 1.00 51.22 H new ATOM 0 HG23 VAL A 136 0.023 -6.006 5.371 1.00 51.22 H new ATOM 1962 N ILE A 137 0.225 -9.409 5.763 1.00 34.30 N ATOM 1963 CA ILE A 137 1.292 -10.238 6.320 1.00 22.51 C ATOM 1964 C ILE A 137 2.644 -9.494 6.332 1.00 43.02 C ATOM 1965 O ILE A 137 3.660 -10.037 6.782 1.00 73.25 O ATOM 1966 CB ILE A 137 1.312 -11.622 5.622 1.00 31.22 C ATOM 1967 CG1 ILE A 137 1.968 -11.674 4.226 1.00 11.03 C ATOM 1968 CG2 ILE A 137 -0.094 -12.249 5.551 1.00 44.45 C ATOM 1969 CD1 ILE A 137 1.587 -10.593 3.225 1.00 14.14 C ATOM 0 H ILE A 137 0.401 -9.161 4.789 1.00 34.30 H new ATOM 0 HA ILE A 137 1.089 -10.438 7.372 1.00 22.51 H new ATOM 0 HB ILE A 137 1.961 -12.209 6.272 1.00 31.22 H new ATOM 0 HG12 ILE A 137 3.049 -11.639 4.362 1.00 11.03 H new ATOM 0 HG13 ILE A 137 1.733 -12.641 3.781 1.00 11.03 H new ATOM 0 HG21 ILE A 137 -0.036 -13.218 5.055 1.00 44.45 H new ATOM 0 HG22 ILE A 137 -0.485 -12.381 6.560 1.00 44.45 H new ATOM 0 HG23 ILE A 137 -0.757 -11.592 4.988 1.00 44.45 H new ATOM 0 HD11 ILE A 137 2.124 -10.757 2.291 1.00 14.14 H new ATOM 0 HD12 ILE A 137 0.514 -10.632 3.038 1.00 14.14 H new ATOM 0 HD13 ILE A 137 1.850 -9.615 3.628 1.00 14.14 H new ATOM 1980 N GLY A 138 2.669 -8.241 5.863 1.00 43.44 N ATOM 1981 CA GLY A 138 3.888 -7.470 5.716 1.00 1.40 C ATOM 1982 C GLY A 138 3.715 -6.004 6.038 1.00 61.41 C ATOM 1983 O GLY A 138 3.032 -5.277 5.320 1.00 22.54 O ATOM 0 H GLY A 138 1.830 -7.738 5.575 1.00 43.44 H new ATOM 0 HA2 GLY A 138 4.655 -7.889 6.368 1.00 1.40 H new ATOM 0 HA3 GLY A 138 4.250 -7.569 4.693 1.00 1.40 H new ATOM 1987 N VAL A 139 4.390 -5.559 7.090 1.00 62.12 N ATOM 1988 CA VAL A 139 4.602 -4.156 7.390 1.00 15.42 C ATOM 1989 C VAL A 139 6.046 -4.055 7.904 1.00 34.41 C ATOM 1990 O VAL A 139 6.317 -4.380 9.066 1.00 35.20 O ATOM 1991 CB VAL A 139 3.530 -3.603 8.368 1.00 34.11 C ATOM 1992 CG1 VAL A 139 3.398 -2.086 8.171 1.00 43.23 C ATOM 1993 CG2 VAL A 139 2.120 -4.204 8.218 1.00 33.43 C ATOM 0 H VAL A 139 4.815 -6.184 7.775 1.00 62.12 H new ATOM 0 HA VAL A 139 4.482 -3.523 6.511 1.00 15.42 H new ATOM 0 HB VAL A 139 3.890 -3.883 9.358 1.00 34.11 H new ATOM 0 HG11 VAL A 139 2.646 -1.694 8.856 1.00 43.23 H new ATOM 0 HG12 VAL A 139 4.357 -1.608 8.373 1.00 43.23 H new ATOM 0 HG13 VAL A 139 3.097 -1.877 7.144 1.00 43.23 H new ATOM 0 HG21 VAL A 139 1.451 -3.748 8.948 1.00 33.43 H new ATOM 0 HG22 VAL A 139 1.747 -4.010 7.213 1.00 33.43 H new ATOM 0 HG23 VAL A 139 2.163 -5.280 8.387 1.00 33.43 H new ATOM 2003 N ALA A 140 6.999 -3.725 7.024 1.00 40.25 N ATOM 2004 CA ALA A 140 8.429 -3.599 7.319 1.00 73.52 C ATOM 2005 C ALA A 140 9.051 -2.462 6.490 1.00 13.13 C ATOM 2006 O ALA A 140 8.338 -1.770 5.752 1.00 53.25 O ATOM 2007 CB ALA A 140 9.123 -4.940 7.045 1.00 2.31 C ATOM 0 H ALA A 140 6.784 -3.531 6.046 1.00 40.25 H new ATOM 0 HA ALA A 140 8.565 -3.346 8.370 1.00 73.52 H new ATOM 0 HB1 ALA A 140 10.187 -4.850 7.263 1.00 2.31 H new ATOM 0 HB2 ALA A 140 8.686 -5.712 7.679 1.00 2.31 H new ATOM 0 HB3 ALA A 140 8.989 -5.212 5.998 1.00 2.31 H new ATOM 2013 N ARG A 141 10.369 -2.258 6.608 1.00 52.43 N ATOM 2014 CA ARG A 141 11.146 -1.315 5.815 1.00 32.21 C ATOM 2015 C ARG A 141 12.162 -2.047 4.946 1.00 1.13 C ATOM 2016 O ARG A 141 12.504 -3.201 5.217 1.00 72.42 O ATOM 2017 CB ARG A 141 11.850 -0.305 6.730 1.00 21.31 C ATOM 2018 CG ARG A 141 12.858 -0.920 7.706 1.00 4.30 C ATOM 2019 CD ARG A 141 13.490 0.122 8.634 1.00 31.40 C ATOM 2020 NE ARG A 141 14.558 -0.468 9.454 1.00 44.22 N ATOM 2021 CZ ARG A 141 14.418 -1.420 10.387 1.00 55.24 C ATOM 2022 NH1 ARG A 141 13.216 -1.826 10.783 1.00 62.33 N ATOM 2023 NH2 ARG A 141 15.483 -1.976 10.942 1.00 35.12 N ATOM 0 H ARG A 141 10.938 -2.767 7.285 1.00 52.43 H new ATOM 0 HA ARG A 141 10.464 -0.775 5.158 1.00 32.21 H new ATOM 0 HB2 ARG A 141 12.366 0.428 6.110 1.00 21.31 H new ATOM 0 HB3 ARG A 141 11.095 0.235 7.301 1.00 21.31 H new ATOM 0 HG2 ARG A 141 12.359 -1.681 8.306 1.00 4.30 H new ATOM 0 HG3 ARG A 141 13.644 -1.423 7.142 1.00 4.30 H new ATOM 0 HD2 ARG A 141 13.895 0.942 8.041 1.00 31.40 H new ATOM 0 HD3 ARG A 141 12.724 0.546 9.282 1.00 31.40 H new ATOM 0 HE ARG A 141 15.503 -0.117 9.297 1.00 44.22 H new ATOM 0 HH11 ARG A 141 12.378 -1.412 10.375 1.00 62.33 H new ATOM 0 HH12 ARG A 141 13.132 -2.552 11.495 1.00 62.33 H new ATOM 0 HH21 ARG A 141 16.418 -1.681 10.660 1.00 35.12 H new ATOM 0 HH22 ARG A 141 15.369 -2.700 11.651 1.00 35.12 H new ATOM 2034 N ASP A 142 12.696 -1.321 3.963 1.00 74.25 N ATOM 2035 CA ASP A 142 13.600 -1.818 2.924 1.00 0.43 C ATOM 2036 C ASP A 142 13.039 -3.109 2.308 1.00 63.35 C ATOM 2037 O ASP A 142 11.815 -3.276 2.259 1.00 13.13 O ATOM 2038 CB ASP A 142 15.059 -1.874 3.430 1.00 35.42 C ATOM 2039 CG ASP A 142 15.648 -0.484 3.693 1.00 20.50 C ATOM 2040 OD1 ASP A 142 15.182 0.519 3.109 1.00 51.23 O ATOM 2041 OD2 ASP A 142 16.607 -0.352 4.493 1.00 61.34 O ATOM 0 H ASP A 142 12.501 -0.325 3.865 1.00 74.25 H new ATOM 0 HA ASP A 142 13.650 -1.116 2.092 1.00 0.43 H new ATOM 0 HB2 ASP A 142 15.098 -2.460 4.348 1.00 35.42 H new ATOM 0 HB3 ASP A 142 15.675 -2.392 2.694 1.00 35.42 H new ATOM 2045 N ASP A 143 13.892 -3.971 1.754 1.00 60.33 N ATOM 2046 CA ASP A 143 13.571 -5.261 1.128 1.00 72.53 C ATOM 2047 C ASP A 143 13.817 -6.444 2.088 1.00 60.24 C ATOM 2048 O ASP A 143 13.737 -7.604 1.677 1.00 71.14 O ATOM 2049 CB ASP A 143 14.351 -5.447 -0.198 1.00 13.23 C ATOM 2050 CG ASP A 143 15.860 -5.189 -0.089 1.00 72.33 C ATOM 2051 OD1 ASP A 143 16.419 -5.285 1.028 1.00 71.13 O ATOM 2052 OD2 ASP A 143 16.471 -4.787 -1.108 1.00 11.34 O ATOM 0 H ASP A 143 14.893 -3.777 1.727 1.00 60.33 H new ATOM 0 HA ASP A 143 12.506 -5.251 0.896 1.00 72.53 H new ATOM 0 HB2 ASP A 143 14.194 -6.464 -0.558 1.00 13.23 H new ATOM 0 HB3 ASP A 143 13.933 -4.775 -0.948 1.00 13.23 H new ATOM 2056 N SER A 144 14.091 -6.194 3.376 1.00 73.35 N ATOM 2057 CA SER A 144 14.467 -7.242 4.324 1.00 12.42 C ATOM 2058 C SER A 144 13.394 -8.335 4.463 1.00 21.53 C ATOM 2059 O SER A 144 13.741 -9.509 4.617 1.00 64.12 O ATOM 2060 CB SER A 144 14.798 -6.628 5.693 1.00 14.31 C ATOM 2061 OG SER A 144 15.510 -7.563 6.483 1.00 64.43 O ATOM 0 H SER A 144 14.057 -5.260 3.785 1.00 73.35 H new ATOM 0 HA SER A 144 15.356 -7.730 3.924 1.00 12.42 H new ATOM 0 HB2 SER A 144 15.392 -5.724 5.561 1.00 14.31 H new ATOM 0 HB3 SER A 144 13.879 -6.335 6.201 1.00 14.31 H new ATOM 0 HG SER A 144 15.719 -7.164 7.353 1.00 64.43 H new ATOM 2066 N GLU A 145 12.104 -8.007 4.378 1.00 42.11 N ATOM 2067 CA GLU A 145 11.008 -8.938 4.653 1.00 23.51 C ATOM 2068 C GLU A 145 10.346 -9.458 3.367 1.00 60.15 C ATOM 2069 O GLU A 145 9.342 -10.157 3.427 1.00 75.44 O ATOM 2070 CB GLU A 145 10.016 -8.308 5.649 1.00 44.43 C ATOM 2071 CG GLU A 145 10.684 -7.952 6.995 1.00 60.11 C ATOM 2072 CD GLU A 145 9.785 -8.018 8.238 1.00 52.44 C ATOM 2073 OE1 GLU A 145 8.595 -8.415 8.169 1.00 75.23 O ATOM 2074 OE2 GLU A 145 10.276 -7.703 9.350 1.00 15.24 O ATOM 0 H GLU A 145 11.787 -7.075 4.113 1.00 42.11 H new ATOM 0 HA GLU A 145 11.419 -9.828 5.129 1.00 23.51 H new ATOM 0 HB2 GLU A 145 9.586 -7.408 5.210 1.00 44.43 H new ATOM 0 HB3 GLU A 145 9.193 -9.001 5.826 1.00 44.43 H new ATOM 0 HG2 GLU A 145 11.528 -8.625 7.147 1.00 60.11 H new ATOM 0 HG3 GLU A 145 11.090 -6.943 6.919 1.00 60.11 H new ATOM 2079 N VAL A 146 10.915 -9.194 2.193 1.00 33.30 N ATOM 2080 CA VAL A 146 10.399 -9.681 0.911 1.00 22.24 C ATOM 2081 C VAL A 146 10.281 -11.208 0.898 1.00 1.02 C ATOM 2082 O VAL A 146 9.329 -11.756 0.337 1.00 53.23 O ATOM 2083 CB VAL A 146 11.330 -9.158 -0.194 1.00 14.41 C ATOM 2084 CG1 VAL A 146 11.053 -9.726 -1.593 1.00 13.33 C ATOM 2085 CG2 VAL A 146 11.182 -7.634 -0.236 1.00 32.50 C ATOM 0 H VAL A 146 11.759 -8.628 2.102 1.00 33.30 H new ATOM 0 HA VAL A 146 9.388 -9.309 0.742 1.00 22.24 H new ATOM 0 HB VAL A 146 12.340 -9.483 0.057 1.00 14.41 H new ATOM 0 HG11 VAL A 146 11.759 -9.299 -2.305 1.00 13.33 H new ATOM 0 HG12 VAL A 146 11.166 -10.810 -1.575 1.00 13.33 H new ATOM 0 HG13 VAL A 146 10.036 -9.473 -1.894 1.00 13.33 H new ATOM 0 HG21 VAL A 146 11.831 -7.227 -1.012 1.00 32.50 H new ATOM 0 HG22 VAL A 146 10.146 -7.375 -0.456 1.00 32.50 H new ATOM 0 HG23 VAL A 146 11.464 -7.214 0.730 1.00 32.50 H new ATOM 2095 N ASP A 147 11.214 -11.893 1.559 1.00 51.34 N ATOM 2096 CA ASP A 147 11.376 -13.346 1.635 1.00 23.24 C ATOM 2097 C ASP A 147 10.272 -14.067 2.430 1.00 31.53 C ATOM 2098 O ASP A 147 10.332 -15.277 2.648 1.00 71.34 O ATOM 2099 CB ASP A 147 12.737 -13.602 2.281 1.00 55.43 C ATOM 2100 CG ASP A 147 13.274 -15.001 2.005 1.00 54.24 C ATOM 2101 OD1 ASP A 147 13.414 -15.384 0.820 1.00 2.33 O ATOM 2102 OD2 ASP A 147 13.678 -15.690 2.967 1.00 44.44 O ATOM 0 H ASP A 147 11.933 -11.409 2.097 1.00 51.34 H new ATOM 0 HA ASP A 147 11.304 -13.752 0.626 1.00 23.24 H new ATOM 0 HB2 ASP A 147 13.452 -12.866 1.913 1.00 55.43 H new ATOM 0 HB3 ASP A 147 12.655 -13.456 3.358 1.00 55.43 H new ATOM 2106 N LYS A 148 9.271 -13.326 2.908 1.00 22.40 N ATOM 2107 CA LYS A 148 8.057 -13.818 3.568 1.00 40.45 C ATOM 2108 C LYS A 148 6.779 -13.226 2.970 1.00 43.23 C ATOM 2109 O LYS A 148 5.689 -13.500 3.473 1.00 63.25 O ATOM 2110 CB LYS A 148 8.146 -13.562 5.078 1.00 52.04 C ATOM 2111 CG LYS A 148 8.462 -12.104 5.438 1.00 73.41 C ATOM 2112 CD LYS A 148 8.234 -11.703 6.896 1.00 13.04 C ATOM 2113 CE LYS A 148 6.771 -11.303 7.128 1.00 15.44 C ATOM 2114 NZ LYS A 148 6.583 -10.445 8.318 1.00 53.13 N ATOM 0 H LYS A 148 9.285 -12.308 2.842 1.00 22.40 H new ATOM 0 HA LYS A 148 7.996 -14.892 3.395 1.00 40.45 H new ATOM 0 HB2 LYS A 148 7.201 -13.845 5.542 1.00 52.04 H new ATOM 0 HB3 LYS A 148 8.915 -14.207 5.502 1.00 52.04 H new ATOM 0 HG2 LYS A 148 9.505 -11.908 5.188 1.00 73.41 H new ATOM 0 HG3 LYS A 148 7.855 -11.456 4.806 1.00 73.41 H new ATOM 0 HD2 LYS A 148 8.497 -12.533 7.552 1.00 13.04 H new ATOM 0 HD3 LYS A 148 8.889 -10.871 7.156 1.00 13.04 H new ATOM 0 HE2 LYS A 148 6.401 -10.778 6.247 1.00 15.44 H new ATOM 0 HE3 LYS A 148 6.168 -12.204 7.239 1.00 15.44 H new ATOM 0 HZ1 LYS A 148 5.629 -10.031 8.300 1.00 53.13 H new ATOM 0 HZ2 LYS A 148 6.696 -11.017 9.179 1.00 53.13 H new ATOM 0 HZ3 LYS A 148 7.291 -9.683 8.312 1.00 53.13 H new ATOM 2124 N TRP A 149 6.890 -12.415 1.920 1.00 75.44 N ATOM 2125 CA TRP A 149 5.761 -11.813 1.213 1.00 1.11 C ATOM 2126 C TRP A 149 5.637 -12.364 -0.210 1.00 31.53 C ATOM 2127 O TRP A 149 5.345 -11.607 -1.139 1.00 23.53 O ATOM 2128 CB TRP A 149 5.904 -10.288 1.186 1.00 34.43 C ATOM 2129 CG TRP A 149 6.204 -9.579 2.462 1.00 4.20 C ATOM 2130 CD1 TRP A 149 5.826 -9.963 3.699 1.00 33.54 C ATOM 2131 CD2 TRP A 149 6.877 -8.297 2.620 1.00 14.04 C ATOM 2132 NE1 TRP A 149 6.259 -9.024 4.609 1.00 3.04 N ATOM 2133 CE2 TRP A 149 6.806 -7.921 3.989 1.00 52.42 C ATOM 2134 CE3 TRP A 149 7.474 -7.379 1.732 1.00 3.33 C ATOM 2135 CZ2 TRP A 149 7.208 -6.655 4.441 1.00 3.33 C ATOM 2136 CZ3 TRP A 149 7.922 -6.124 2.175 1.00 51.04 C ATOM 2137 CH2 TRP A 149 7.762 -5.746 3.521 1.00 72.51 C ATOM 0 H TRP A 149 7.793 -12.151 1.526 1.00 75.44 H new ATOM 0 HA TRP A 149 4.850 -12.073 1.751 1.00 1.11 H new ATOM 0 HB2 TRP A 149 6.694 -10.042 0.476 1.00 34.43 H new ATOM 0 HB3 TRP A 149 4.977 -9.875 0.787 1.00 34.43 H new ATOM 0 HD1 TRP A 149 5.274 -10.860 3.937 1.00 33.54 H new ATOM 0 HE1 TRP A 149 6.184 -9.132 5.620 1.00 3.04 H new ATOM 0 HE3 TRP A 149 7.589 -7.646 0.692 1.00 3.33 H new ATOM 0 HZ2 TRP A 149 7.094 -6.382 5.480 1.00 3.33 H new ATOM 0 HZ3 TRP A 149 8.392 -5.445 1.479 1.00 51.04 H new ATOM 0 HH2 TRP A 149 8.063 -4.761 3.847 1.00 72.51 H new ATOM 2147 N SER A 150 5.981 -13.629 -0.443 1.00 72.24 N ATOM 2148 CA SER A 150 5.751 -14.313 -1.698 1.00 20.24 C ATOM 2149 C SER A 150 5.895 -15.831 -1.594 1.00 1.44 C ATOM 2150 O SER A 150 5.247 -16.513 -2.387 1.00 75.21 O ATOM 2151 CB SER A 150 6.722 -13.765 -2.745 1.00 54.04 C ATOM 2152 OG SER A 150 6.029 -12.895 -3.609 1.00 64.24 O ATOM 0 H SER A 150 6.438 -14.214 0.257 1.00 72.24 H new ATOM 0 HA SER A 150 4.718 -14.124 -1.989 1.00 20.24 H new ATOM 0 HB2 SER A 150 7.541 -13.236 -2.257 1.00 54.04 H new ATOM 0 HB3 SER A 150 7.164 -14.584 -3.312 1.00 54.04 H new ATOM 0 HG SER A 150 5.583 -12.198 -3.083 1.00 64.24 H new ATOM 2157 N LYS A 151 6.716 -16.349 -0.671 1.00 24.31 N ATOM 2158 CA LYS A 151 7.090 -17.760 -0.617 1.00 63.33 C ATOM 2159 C LYS A 151 5.900 -18.708 -0.634 1.00 44.04 C ATOM 2160 O LYS A 151 5.674 -19.337 -1.693 1.00 64.22 O ATOM 2161 CB LYS A 151 8.016 -18.035 0.578 1.00 33.14 C ATOM 2162 CG LYS A 151 9.478 -17.688 0.280 1.00 14.33 C ATOM 2163 CD LYS A 151 10.397 -18.449 1.238 1.00 41.14 C ATOM 2164 CE LYS A 151 11.837 -18.241 0.786 1.00 11.03 C ATOM 2165 NZ LYS A 151 12.747 -19.270 1.318 1.00 22.31 N ATOM 0 H LYS A 151 7.142 -15.789 0.067 1.00 24.31 H new ATOM 0 HA LYS A 151 7.639 -17.967 -1.536 1.00 63.33 H new ATOM 0 HB2 LYS A 151 7.677 -17.456 1.437 1.00 33.14 H new ATOM 0 HB3 LYS A 151 7.945 -19.087 0.854 1.00 33.14 H new ATOM 0 HG2 LYS A 151 9.719 -17.945 -0.751 1.00 14.33 H new ATOM 0 HG3 LYS A 151 9.635 -16.615 0.386 1.00 14.33 H new ATOM 0 HD2 LYS A 151 10.264 -18.089 2.258 1.00 41.14 H new ATOM 0 HD3 LYS A 151 10.149 -19.510 1.239 1.00 41.14 H new ATOM 0 HE2 LYS A 151 11.878 -18.252 -0.303 1.00 11.03 H new ATOM 0 HE3 LYS A 151 12.178 -17.257 1.108 1.00 11.03 H new ATOM 0 HZ1 LYS A 151 13.714 -19.085 0.983 1.00 22.31 H new ATOM 0 HZ2 LYS A 151 12.730 -19.244 2.358 1.00 22.31 H new ATOM 0 HZ3 LYS A 151 12.440 -20.208 0.990 1.00 22.31 H new