USER MOD reduce.3.24.130724 H: found=0, std=0, add=1057, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 1058 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 41 TYR OH : rot 61:sc= -1.66 USER MOD Set 1.2: A 123 HIS : no HD1:sc= -4.96! C(o=-6.6!,f=-10!) USER MOD Set 2.1: A 88 GLN : amide:sc= -1.88 K(o=-2.1,f=-3.2) USER MOD Set 2.2: A 89 GLN : amide:sc= -0.262 K(o=-2.1,f=-4.8!) USER MOD Set 3.1: A 53 ASN : amide:sc= -0.681 K(o=-3.3,f=-2.8) USER MOD Set 3.2: A 70 HIS : no HE2:sc= -2.66! C(o=-3.3!,f=-4!) USER MOD Single : A 5 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 ASN : amide:sc= -2.66! K(o=-2.7!,f=-1.1) USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 10 ASN : amide:sc= -0.522 K(o=-0.52,f=0) USER MOD Single : A 11 ASN : amide:sc= -14! C(o=-14!,f=-11!) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 MET CE :methyl 141:sc= -5.59! (180deg=-13.7!) USER MOD Single : A 18 GLN : amide:sc= -0.515 K(o=-0.52,f=-1.9!) USER MOD Single : A 20 LYS NZ :NH3+ -161:sc=-0.00149 (180deg=-0.0947) USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 28 SER OG : rot 180:sc= -0.571 USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 ASN : amide:sc= -2.58 K(o=-2.6,f=-0.11) USER MOD Single : A 38 LYS NZ :NH3+ 137:sc= -0.291 (180deg=-2.54!) USER MOD Single : A 43 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 ASN : amide:sc= -2.26! K(o=-2.3!,f=-1.1) USER MOD Single : A 69 HIS : no HD1:sc= -0.882 K(o=-0.88,f=-1.9) USER MOD Single : A 72 ASN : amide:sc= -1.26 K(o=-1.3,f=-0.47!) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 MET CE :methyl -114:sc= -10.2! (180deg=-19.8!) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 HIS : no HE2:sc= -1.31 K(o=-1.3,f=-4.2!) USER MOD Single : A 85 THR OG1 : rot 180:sc= -1.12 USER MOD Single : A 86 MET CE :methyl 172:sc= -4.09! (180deg=-4.3!) USER MOD Single : A 95 HIS : no HD1:sc= -5.23! C(o=-5.2!,f=-6!) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 104 ASN : amide:sc= -0.168 K(o=-0.17,f=-5.3!) USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 MET CE :methyl -107:sc= -0.0512 (180deg=-0.696) USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 THR OG1 : rot -150:sc= -0.954 USER MOD Single : A 116 MET CE :methyl 160:sc= -1.96 (180deg=-2.53) USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 ASN : amide:sc= -0.0405 X(o=-0.04,f=-0.04) USER MOD Single : A 130 ASN : amide:sc= -0.033 X(o=-0.033,f=-0.11) USER MOD Single : A 131 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 26 N GLU A 3 -5.932 -10.331 -9.996 1.00 0.00 N ATOM 27 CA GLU A 3 -6.195 -9.676 -8.725 1.00 0.00 C ATOM 28 C GLU A 3 -6.837 -8.306 -8.957 1.00 0.00 C ATOM 29 O GLU A 3 -7.541 -7.793 -8.091 1.00 0.00 O ATOM 30 CB GLU A 3 -4.913 -9.546 -7.900 1.00 0.00 C ATOM 31 CG GLU A 3 -4.354 -10.924 -7.537 1.00 0.00 C ATOM 32 CD GLU A 3 -3.379 -11.420 -8.606 1.00 0.00 C ATOM 33 OE1 GLU A 3 -2.408 -10.682 -8.874 1.00 0.00 O ATOM 34 OE2 GLU A 3 -3.628 -12.527 -9.131 1.00 0.00 O ATOM 0 HA GLU A 3 -6.893 -10.292 -8.158 1.00 0.00 H new ATOM 0 HB2 GLU A 3 -4.168 -8.984 -8.464 1.00 0.00 H new ATOM 0 HB3 GLU A 3 -5.117 -8.981 -6.991 1.00 0.00 H new ATOM 0 HG2 GLU A 3 -3.847 -10.872 -6.573 1.00 0.00 H new ATOM 0 HG3 GLU A 3 -5.173 -11.635 -7.429 1.00 0.00 H new ATOM 41 N ILE A 4 -6.570 -7.755 -10.132 1.00 0.00 N ATOM 42 CA ILE A 4 -7.112 -6.455 -10.489 1.00 0.00 C ATOM 43 C ILE A 4 -8.641 -6.513 -10.436 1.00 0.00 C ATOM 44 O ILE A 4 -9.287 -5.554 -10.018 1.00 0.00 O ATOM 45 CB ILE A 4 -6.562 -5.997 -11.842 1.00 0.00 C ATOM 46 CG1 ILE A 4 -5.078 -6.345 -11.975 1.00 0.00 C ATOM 47 CG2 ILE A 4 -6.824 -4.507 -12.064 1.00 0.00 C ATOM 48 CD1 ILE A 4 -4.314 -5.991 -10.698 1.00 0.00 C ATOM 0 H ILE A 4 -5.986 -8.185 -10.849 1.00 0.00 H new ATOM 0 HA ILE A 4 -6.795 -5.700 -9.770 1.00 0.00 H new ATOM 0 HB ILE A 4 -7.091 -6.537 -12.627 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -4.968 -7.409 -12.185 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -4.649 -5.807 -12.820 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -6.423 -4.207 -13.032 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -7.897 -4.319 -12.042 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -6.338 -3.931 -11.276 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -3.262 -6.249 -10.820 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -4.406 -4.922 -10.504 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -4.729 -6.549 -9.859 1.00 0.00 H new ATOM 60 N MET A 5 -9.173 -7.648 -10.865 1.00 0.00 N ATOM 61 CA MET A 5 -10.613 -7.844 -10.870 1.00 0.00 C ATOM 62 C MET A 5 -11.112 -8.287 -9.493 1.00 0.00 C ATOM 63 O MET A 5 -12.311 -8.478 -9.295 1.00 0.00 O ATOM 64 CB MET A 5 -10.980 -8.903 -11.913 1.00 0.00 C ATOM 65 CG MET A 5 -12.000 -8.356 -12.915 1.00 0.00 C ATOM 66 SD MET A 5 -13.593 -8.181 -12.129 1.00 0.00 S ATOM 67 CE MET A 5 -13.970 -6.492 -12.568 1.00 0.00 C ATOM 0 H MET A 5 -8.633 -8.441 -11.211 1.00 0.00 H new ATOM 0 HA MET A 5 -11.089 -6.896 -11.119 1.00 0.00 H new ATOM 0 HB2 MET A 5 -10.082 -9.225 -12.441 1.00 0.00 H new ATOM 0 HB3 MET A 5 -11.389 -9.782 -11.415 1.00 0.00 H new ATOM 0 HG2 MET A 5 -11.666 -7.391 -13.297 1.00 0.00 H new ATOM 0 HG3 MET A 5 -12.079 -9.028 -13.770 1.00 0.00 H new ATOM 0 HE1 MET A 5 -14.940 -6.216 -12.154 1.00 0.00 H new ATOM 0 HE2 MET A 5 -13.202 -5.831 -12.165 1.00 0.00 H new ATOM 0 HE3 MET A 5 -13.999 -6.396 -13.653 1.00 0.00 H new ATOM 77 N LYS A 6 -10.166 -8.441 -8.579 1.00 0.00 N ATOM 78 CA LYS A 6 -10.494 -8.857 -7.226 1.00 0.00 C ATOM 79 C LYS A 6 -10.145 -7.732 -6.250 1.00 0.00 C ATOM 80 O LYS A 6 -8.973 -7.504 -5.953 1.00 0.00 O ATOM 81 CB LYS A 6 -9.817 -10.190 -6.897 1.00 0.00 C ATOM 82 CG LYS A 6 -10.094 -10.604 -5.451 1.00 0.00 C ATOM 83 CD LYS A 6 -9.137 -11.710 -5.004 1.00 0.00 C ATOM 84 CE LYS A 6 -9.679 -12.439 -3.772 1.00 0.00 C ATOM 85 NZ LYS A 6 -10.229 -13.760 -4.151 1.00 0.00 N ATOM 0 H LYS A 6 -9.172 -8.285 -8.748 1.00 0.00 H new ATOM 0 HA LYS A 6 -11.565 -9.037 -7.133 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -10.178 -10.963 -7.576 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -8.742 -10.105 -7.055 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -9.988 -9.740 -4.795 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -11.124 -10.950 -5.359 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -8.992 -12.421 -5.817 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -8.161 -11.282 -4.777 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -8.883 -12.567 -3.038 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -10.455 -11.838 -3.299 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -10.592 -14.241 -3.303 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -11.002 -13.631 -4.834 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -9.479 -14.338 -4.582 1.00 0.00 H new ATOM 99 N ASN A 7 -11.183 -7.057 -5.778 1.00 0.00 N ATOM 100 CA ASN A 7 -11.000 -5.962 -4.842 1.00 0.00 C ATOM 101 C ASN A 7 -11.951 -6.144 -3.658 1.00 0.00 C ATOM 102 O ASN A 7 -13.103 -6.536 -3.837 1.00 0.00 O ATOM 103 CB ASN A 7 -11.318 -4.617 -5.500 1.00 0.00 C ATOM 104 CG ASN A 7 -12.826 -4.436 -5.680 1.00 0.00 C ATOM 105 OD1 ASN A 7 -13.425 -4.907 -6.631 1.00 0.00 O ATOM 106 ND2 ASN A 7 -13.405 -3.730 -4.713 1.00 0.00 N ATOM 0 H ASN A 7 -12.154 -7.248 -6.027 1.00 0.00 H new ATOM 0 HA ASN A 7 -9.960 -5.968 -4.515 1.00 0.00 H new ATOM 0 HB2 ASN A 7 -10.922 -3.807 -4.888 1.00 0.00 H new ATOM 0 HB3 ASN A 7 -10.823 -4.556 -6.469 1.00 0.00 H new ATOM 0 HD21 ASN A 7 -14.410 -3.555 -4.741 1.00 0.00 H new ATOM 0 HD22 ASN A 7 -12.845 -3.363 -3.944 1.00 0.00 H new ATOM 113 N LEU A 8 -11.433 -5.852 -2.473 1.00 0.00 N ATOM 114 CA LEU A 8 -12.221 -5.979 -1.260 1.00 0.00 C ATOM 115 C LEU A 8 -13.442 -5.062 -1.351 1.00 0.00 C ATOM 116 O LEU A 8 -13.541 -4.241 -2.263 1.00 0.00 O ATOM 117 CB LEU A 8 -11.353 -5.725 -0.027 1.00 0.00 C ATOM 118 CG LEU A 8 -11.841 -6.353 1.280 1.00 0.00 C ATOM 119 CD1 LEU A 8 -12.801 -5.417 2.013 1.00 0.00 C ATOM 120 CD2 LEU A 8 -12.462 -7.728 1.028 1.00 0.00 C ATOM 0 H LEU A 8 -10.477 -5.528 -2.328 1.00 0.00 H new ATOM 0 HA LEU A 8 -12.594 -6.998 -1.154 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -10.349 -6.096 -0.232 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -11.271 -4.648 0.119 1.00 0.00 H new ATOM 0 HG LEU A 8 -10.979 -6.503 1.930 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -13.133 -5.888 2.938 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -12.292 -4.481 2.244 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -13.665 -5.213 1.380 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -12.801 -8.153 1.973 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -13.310 -7.626 0.351 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -11.718 -8.387 0.580 1.00 0.00 H new ATOM 132 N SER A 9 -14.344 -5.231 -0.394 1.00 0.00 N ATOM 133 CA SER A 9 -15.555 -4.428 -0.356 1.00 0.00 C ATOM 134 C SER A 9 -15.210 -2.952 -0.565 1.00 0.00 C ATOM 135 O SER A 9 -15.389 -2.417 -1.656 1.00 0.00 O ATOM 136 CB SER A 9 -16.299 -4.618 0.968 1.00 0.00 C ATOM 137 OG SER A 9 -16.698 -5.971 1.166 1.00 0.00 O ATOM 0 H SER A 9 -14.260 -5.912 0.361 1.00 0.00 H new ATOM 0 HA SER A 9 -16.211 -4.758 -1.161 1.00 0.00 H new ATOM 0 HB2 SER A 9 -15.658 -4.305 1.792 1.00 0.00 H new ATOM 0 HB3 SER A 9 -17.178 -3.974 0.985 1.00 0.00 H new ATOM 0 HG SER A 9 -17.168 -6.052 2.022 1.00 0.00 H new ATOM 143 N ASN A 10 -14.722 -2.334 0.502 1.00 0.00 N ATOM 144 CA ASN A 10 -14.351 -0.931 0.450 1.00 0.00 C ATOM 145 C ASN A 10 -12.871 -0.784 0.810 1.00 0.00 C ATOM 146 O ASN A 10 -12.160 0.026 0.216 1.00 0.00 O ATOM 147 CB ASN A 10 -15.164 -0.109 1.451 1.00 0.00 C ATOM 148 CG ASN A 10 -16.652 -0.120 1.090 1.00 0.00 C ATOM 149 OD1 ASN A 10 -17.413 -0.973 1.513 1.00 0.00 O ATOM 150 ND2 ASN A 10 -17.021 0.873 0.287 1.00 0.00 N ATOM 0 H ASN A 10 -14.575 -2.780 1.407 1.00 0.00 H new ATOM 0 HA ASN A 10 -14.547 -0.568 -0.559 1.00 0.00 H new ATOM 0 HB2 ASN A 10 -15.027 -0.512 2.454 1.00 0.00 H new ATOM 0 HB3 ASN A 10 -14.798 0.917 1.467 1.00 0.00 H new ATOM 0 HD21 ASN A 10 -17.993 0.953 -0.011 1.00 0.00 H new ATOM 0 HD22 ASN A 10 -16.332 1.555 -0.031 1.00 0.00 H new ATOM 157 N ASN A 11 -12.449 -1.581 1.781 1.00 0.00 N ATOM 158 CA ASN A 11 -11.068 -1.551 2.227 1.00 0.00 C ATOM 159 C ASN A 11 -10.152 -1.319 1.023 1.00 0.00 C ATOM 160 O ASN A 11 -9.108 -0.681 1.147 1.00 0.00 O ATOM 161 CB ASN A 11 -10.669 -2.878 2.875 1.00 0.00 C ATOM 162 CG ASN A 11 -9.509 -2.684 3.855 1.00 0.00 C ATOM 163 OD1 ASN A 11 -8.430 -2.241 3.497 1.00 0.00 O ATOM 164 ND2 ASN A 11 -9.790 -3.039 5.104 1.00 0.00 N ATOM 0 H ASN A 11 -13.041 -2.252 2.271 1.00 0.00 H new ATOM 0 HA ASN A 11 -10.968 -0.748 2.958 1.00 0.00 H new ATOM 0 HB2 ASN A 11 -11.525 -3.303 3.399 1.00 0.00 H new ATOM 0 HB3 ASN A 11 -10.382 -3.592 2.103 1.00 0.00 H new ATOM 0 HD21 ASN A 11 -9.081 -2.948 5.832 1.00 0.00 H new ATOM 0 HD22 ASN A 11 -10.714 -3.403 5.335 1.00 0.00 H new ATOM 171 N PHE A 12 -10.578 -1.851 -0.113 1.00 0.00 N ATOM 172 CA PHE A 12 -9.809 -1.709 -1.338 1.00 0.00 C ATOM 173 C PHE A 12 -10.580 -0.893 -2.378 1.00 0.00 C ATOM 174 O PHE A 12 -10.202 0.235 -2.689 1.00 0.00 O ATOM 175 CB PHE A 12 -9.578 -3.120 -1.887 1.00 0.00 C ATOM 176 CG PHE A 12 -8.117 -3.576 -1.833 1.00 0.00 C ATOM 177 CD1 PHE A 12 -7.141 -2.792 -2.365 1.00 0.00 C ATOM 178 CD2 PHE A 12 -7.797 -4.764 -1.254 1.00 0.00 C ATOM 179 CE1 PHE A 12 -5.787 -3.215 -2.316 1.00 0.00 C ATOM 180 CE2 PHE A 12 -6.443 -5.187 -1.207 1.00 0.00 C ATOM 181 CZ PHE A 12 -5.466 -4.405 -1.737 1.00 0.00 C ATOM 0 H PHE A 12 -11.444 -2.380 -0.211 1.00 0.00 H new ATOM 0 HA PHE A 12 -8.872 -1.193 -1.131 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -10.189 -3.824 -1.322 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -9.922 -3.158 -2.921 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -7.396 -1.848 -2.824 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -8.572 -5.385 -0.830 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -5.011 -2.593 -2.738 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -6.189 -6.132 -0.749 1.00 0.00 H new ATOM 0 HZ PHE A 12 -4.436 -4.727 -1.699 1.00 0.00 H new ATOM 191 N GLY A 13 -11.646 -1.494 -2.886 1.00 0.00 N ATOM 192 CA GLY A 13 -12.472 -0.836 -3.883 1.00 0.00 C ATOM 193 C GLY A 13 -12.695 0.636 -3.527 1.00 0.00 C ATOM 194 O GLY A 13 -12.784 1.486 -4.410 1.00 0.00 O ATOM 0 H GLY A 13 -11.956 -2.430 -2.625 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -11.996 -0.909 -4.861 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -13.433 -1.345 -3.958 1.00 0.00 H new ATOM 198 N LYS A 14 -12.777 0.891 -2.229 1.00 0.00 N ATOM 199 CA LYS A 14 -12.987 2.245 -1.745 1.00 0.00 C ATOM 200 C LYS A 14 -11.652 2.992 -1.735 1.00 0.00 C ATOM 201 O LYS A 14 -11.537 4.071 -2.312 1.00 0.00 O ATOM 202 CB LYS A 14 -13.692 2.225 -0.387 1.00 0.00 C ATOM 203 CG LYS A 14 -14.349 3.575 -0.089 1.00 0.00 C ATOM 204 CD LYS A 14 -13.571 4.339 0.983 1.00 0.00 C ATOM 205 CE LYS A 14 -13.673 3.638 2.339 1.00 0.00 C ATOM 206 NZ LYS A 14 -14.974 3.935 2.980 1.00 0.00 N ATOM 0 H LYS A 14 -12.702 0.183 -1.498 1.00 0.00 H new ATOM 0 HA LYS A 14 -13.652 2.790 -2.415 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -14.447 1.439 -0.377 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -12.973 1.986 0.396 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -14.397 4.169 -1.001 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -15.375 3.418 0.244 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -12.524 4.420 0.689 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -13.959 5.354 1.064 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -13.563 2.562 2.208 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -12.859 3.965 2.986 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -15.027 3.451 3.899 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -15.064 4.961 3.123 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -15.746 3.601 2.369 1.00 0.00 H new ATOM 220 N ALA A 15 -10.677 2.386 -1.074 1.00 0.00 N ATOM 221 CA ALA A 15 -9.354 2.981 -0.981 1.00 0.00 C ATOM 222 C ALA A 15 -8.803 3.208 -2.389 1.00 0.00 C ATOM 223 O ALA A 15 -8.224 4.256 -2.672 1.00 0.00 O ATOM 224 CB ALA A 15 -8.449 2.081 -0.138 1.00 0.00 C ATOM 0 H ALA A 15 -10.776 1.489 -0.598 1.00 0.00 H new ATOM 0 HA ALA A 15 -9.402 3.951 -0.486 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -7.457 2.526 -0.068 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -8.871 1.975 0.861 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -8.374 1.100 -0.606 1.00 0.00 H new ATOM 230 N MET A 16 -9.002 2.209 -3.237 1.00 0.00 N ATOM 231 CA MET A 16 -8.532 2.288 -4.609 1.00 0.00 C ATOM 232 C MET A 16 -9.249 3.403 -5.373 1.00 0.00 C ATOM 233 O MET A 16 -8.623 4.150 -6.122 1.00 0.00 O ATOM 234 CB MET A 16 -8.777 0.950 -5.310 1.00 0.00 C ATOM 235 CG MET A 16 -8.013 -0.181 -4.617 1.00 0.00 C ATOM 236 SD MET A 16 -6.256 0.064 -4.809 1.00 0.00 S ATOM 237 CE MET A 16 -5.936 1.127 -3.411 1.00 0.00 C ATOM 0 H MET A 16 -9.482 1.341 -3.000 1.00 0.00 H new ATOM 0 HA MET A 16 -7.465 2.512 -4.595 1.00 0.00 H new ATOM 0 HB2 MET A 16 -9.844 0.726 -5.311 1.00 0.00 H new ATOM 0 HB3 MET A 16 -8.465 1.019 -6.352 1.00 0.00 H new ATOM 0 HG2 MET A 16 -8.271 -0.210 -3.558 1.00 0.00 H new ATOM 0 HG3 MET A 16 -8.303 -1.142 -5.043 1.00 0.00 H new ATOM 0 HE1 MET A 16 -4.985 0.852 -2.955 1.00 0.00 H new ATOM 0 HE2 MET A 16 -5.892 2.164 -3.745 1.00 0.00 H new ATOM 0 HE3 MET A 16 -6.735 1.015 -2.678 1.00 0.00 H new ATOM 247 N ASP A 17 -10.555 3.480 -5.156 1.00 0.00 N ATOM 248 CA ASP A 17 -11.365 4.491 -5.814 1.00 0.00 C ATOM 249 C ASP A 17 -11.046 5.862 -5.214 1.00 0.00 C ATOM 250 O ASP A 17 -10.830 6.828 -5.944 1.00 0.00 O ATOM 251 CB ASP A 17 -12.856 4.220 -5.611 1.00 0.00 C ATOM 252 CG ASP A 17 -13.793 5.253 -6.240 1.00 0.00 C ATOM 253 OD1 ASP A 17 -13.692 6.432 -5.836 1.00 0.00 O ATOM 254 OD2 ASP A 17 -14.588 4.841 -7.112 1.00 0.00 O ATOM 0 H ASP A 17 -11.071 2.858 -4.534 1.00 0.00 H new ATOM 0 HA ASP A 17 -11.137 4.466 -6.880 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -13.091 3.239 -6.024 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -13.059 4.172 -4.541 1.00 0.00 H new ATOM 259 N GLN A 18 -11.028 5.903 -3.889 1.00 0.00 N ATOM 260 CA GLN A 18 -10.741 7.140 -3.184 1.00 0.00 C ATOM 261 C GLN A 18 -9.312 7.600 -3.479 1.00 0.00 C ATOM 262 O GLN A 18 -9.064 8.791 -3.656 1.00 0.00 O ATOM 263 CB GLN A 18 -10.965 6.977 -1.679 1.00 0.00 C ATOM 264 CG GLN A 18 -12.356 7.469 -1.275 1.00 0.00 C ATOM 265 CD GLN A 18 -12.430 7.729 0.230 1.00 0.00 C ATOM 266 OE1 GLN A 18 -11.429 7.843 0.917 1.00 0.00 O ATOM 267 NE2 GLN A 18 -13.671 7.819 0.705 1.00 0.00 N ATOM 0 H GLN A 18 -11.207 5.100 -3.286 1.00 0.00 H new ATOM 0 HA GLN A 18 -11.429 7.907 -3.540 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -10.852 5.929 -1.402 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -10.205 7.535 -1.132 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -12.594 8.384 -1.818 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -13.104 6.728 -1.557 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -14.467 7.714 0.076 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -13.826 7.993 1.698 1.00 0.00 H new ATOM 276 N CYS A 19 -8.409 6.630 -3.520 1.00 0.00 N ATOM 277 CA CYS A 19 -7.012 6.920 -3.790 1.00 0.00 C ATOM 278 C CYS A 19 -6.916 7.587 -5.163 1.00 0.00 C ATOM 279 O CYS A 19 -6.128 8.512 -5.356 1.00 0.00 O ATOM 280 CB CYS A 19 -6.146 5.662 -3.704 1.00 0.00 C ATOM 281 SG CYS A 19 -5.591 5.224 -2.016 1.00 0.00 S ATOM 0 H CYS A 19 -8.619 5.643 -3.371 1.00 0.00 H new ATOM 0 HA CYS A 19 -6.626 7.599 -3.030 1.00 0.00 H new ATOM 0 HB2 CYS A 19 -6.707 4.823 -4.116 1.00 0.00 H new ATOM 0 HB3 CYS A 19 -5.268 5.799 -4.336 1.00 0.00 H new ATOM 286 N LYS A 20 -7.729 7.091 -6.085 1.00 0.00 N ATOM 287 CA LYS A 20 -7.746 7.627 -7.434 1.00 0.00 C ATOM 288 C LYS A 20 -8.312 9.048 -7.407 1.00 0.00 C ATOM 289 O LYS A 20 -8.329 9.734 -8.429 1.00 0.00 O ATOM 290 CB LYS A 20 -8.498 6.684 -8.376 1.00 0.00 C ATOM 291 CG LYS A 20 -7.761 6.538 -9.709 1.00 0.00 C ATOM 292 CD LYS A 20 -8.635 5.829 -10.745 1.00 0.00 C ATOM 293 CE LYS A 20 -8.810 6.690 -11.997 1.00 0.00 C ATOM 294 NZ LYS A 20 -9.587 7.910 -11.684 1.00 0.00 N ATOM 0 H LYS A 20 -8.381 6.323 -5.923 1.00 0.00 H new ATOM 0 HA LYS A 20 -6.732 7.694 -7.829 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -8.606 5.706 -7.907 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -9.504 7.066 -8.552 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -7.476 7.522 -10.081 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -6.840 5.975 -9.559 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -8.183 4.875 -11.016 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -9.611 5.608 -10.312 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -7.833 6.966 -12.395 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -9.319 6.116 -12.771 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -9.971 8.312 -12.563 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -10.370 7.668 -11.043 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -8.967 8.608 -11.226 1.00 0.00 H new ATOM 308 N ASP A 21 -8.762 9.449 -6.227 1.00 0.00 N ATOM 309 CA ASP A 21 -9.328 10.776 -6.055 1.00 0.00 C ATOM 310 C ASP A 21 -8.399 11.611 -5.171 1.00 0.00 C ATOM 311 O ASP A 21 -7.768 12.554 -5.645 1.00 0.00 O ATOM 312 CB ASP A 21 -10.695 10.708 -5.370 1.00 0.00 C ATOM 313 CG ASP A 21 -11.373 12.060 -5.144 1.00 0.00 C ATOM 314 OD1 ASP A 21 -11.447 12.829 -6.127 1.00 0.00 O ATOM 315 OD2 ASP A 21 -11.803 12.294 -3.995 1.00 0.00 O ATOM 0 H ASP A 21 -8.746 8.879 -5.381 1.00 0.00 H new ATOM 0 HA ASP A 21 -9.441 11.225 -7.042 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -11.355 10.083 -5.972 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -10.578 10.212 -4.407 1.00 0.00 H new ATOM 320 N GLU A 22 -8.343 11.233 -3.902 1.00 0.00 N ATOM 321 CA GLU A 22 -7.500 11.933 -2.948 1.00 0.00 C ATOM 322 C GLU A 22 -6.117 12.191 -3.549 1.00 0.00 C ATOM 323 O GLU A 22 -5.575 13.286 -3.420 1.00 0.00 O ATOM 324 CB GLU A 22 -7.393 11.153 -1.635 1.00 0.00 C ATOM 325 CG GLU A 22 -7.133 9.670 -1.900 1.00 0.00 C ATOM 326 CD GLU A 22 -8.188 8.797 -1.214 1.00 0.00 C ATOM 327 OE1 GLU A 22 -9.150 9.389 -0.678 1.00 0.00 O ATOM 328 OE2 GLU A 22 -8.009 7.562 -1.243 1.00 0.00 O ATOM 0 H GLU A 22 -8.868 10.450 -3.512 1.00 0.00 H new ATOM 0 HA GLU A 22 -7.960 12.895 -2.724 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -6.587 11.565 -1.028 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -8.314 11.268 -1.063 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -7.142 9.482 -2.974 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -6.141 9.400 -1.537 1.00 0.00 H new ATOM 335 N LEU A 23 -5.586 11.160 -4.193 1.00 0.00 N ATOM 336 CA LEU A 23 -4.277 11.260 -4.814 1.00 0.00 C ATOM 337 C LEU A 23 -4.447 11.530 -6.309 1.00 0.00 C ATOM 338 O LEU A 23 -3.484 11.867 -6.997 1.00 0.00 O ATOM 339 CB LEU A 23 -3.441 10.018 -4.503 1.00 0.00 C ATOM 340 CG LEU A 23 -3.682 9.371 -3.138 1.00 0.00 C ATOM 341 CD1 LEU A 23 -3.712 7.845 -3.252 1.00 0.00 C ATOM 342 CD2 LEU A 23 -2.648 9.848 -2.115 1.00 0.00 C ATOM 0 H LEU A 23 -6.039 10.252 -4.297 1.00 0.00 H new ATOM 0 HA LEU A 23 -3.721 12.101 -4.400 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -3.633 9.273 -5.275 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -2.387 10.287 -4.574 1.00 0.00 H new ATOM 0 HG LEU A 23 -4.661 9.687 -2.779 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -3.885 7.410 -2.268 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -4.514 7.546 -3.927 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -2.758 7.491 -3.643 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -2.842 9.373 -1.153 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -1.648 9.581 -2.457 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -2.717 10.930 -2.006 1.00 0.00 H new ATOM 354 N SER A 24 -5.678 11.371 -6.772 1.00 0.00 N ATOM 355 CA SER A 24 -5.985 11.592 -8.174 1.00 0.00 C ATOM 356 C SER A 24 -5.030 10.784 -9.054 1.00 0.00 C ATOM 357 O SER A 24 -4.900 11.055 -10.246 1.00 0.00 O ATOM 358 CB SER A 24 -5.904 13.079 -8.528 1.00 0.00 C ATOM 359 OG SER A 24 -6.820 13.433 -9.560 1.00 0.00 O ATOM 0 H SER A 24 -6.475 11.091 -6.200 1.00 0.00 H new ATOM 0 HA SER A 24 -7.006 11.258 -8.357 1.00 0.00 H new ATOM 0 HB2 SER A 24 -6.111 13.675 -7.639 1.00 0.00 H new ATOM 0 HB3 SER A 24 -4.890 13.321 -8.845 1.00 0.00 H new ATOM 0 HG SER A 24 -6.738 14.390 -9.756 1.00 0.00 H new ATOM 365 N LEU A 25 -4.388 9.807 -8.431 1.00 0.00 N ATOM 366 CA LEU A 25 -3.448 8.957 -9.143 1.00 0.00 C ATOM 367 C LEU A 25 -4.213 7.833 -9.842 1.00 0.00 C ATOM 368 O LEU A 25 -5.392 7.615 -9.567 1.00 0.00 O ATOM 369 CB LEU A 25 -2.353 8.460 -8.197 1.00 0.00 C ATOM 370 CG LEU A 25 -2.680 7.198 -7.397 1.00 0.00 C ATOM 371 CD1 LEU A 25 -4.153 7.176 -6.984 1.00 0.00 C ATOM 372 CD2 LEU A 25 -2.284 5.939 -8.174 1.00 0.00 C ATOM 0 H LEU A 25 -4.500 9.585 -7.442 1.00 0.00 H new ATOM 0 HA LEU A 25 -2.934 9.524 -9.919 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -1.453 8.272 -8.782 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -2.116 9.260 -7.495 1.00 0.00 H new ATOM 0 HG LEU A 25 -2.089 7.212 -6.481 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -4.358 6.268 -6.417 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -4.371 8.047 -6.366 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -4.781 7.197 -7.875 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -2.527 5.056 -7.584 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -2.830 5.907 -9.117 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -1.213 5.958 -8.375 1.00 0.00 H new ATOM 384 N PRO A 26 -3.493 7.130 -10.757 1.00 0.00 N ATOM 385 CA PRO A 26 -4.091 6.032 -11.498 1.00 0.00 C ATOM 386 C PRO A 26 -4.246 4.793 -10.615 1.00 0.00 C ATOM 387 O PRO A 26 -3.262 4.280 -10.082 1.00 0.00 O ATOM 388 CB PRO A 26 -3.167 5.806 -12.683 1.00 0.00 C ATOM 389 CG PRO A 26 -1.847 6.465 -12.313 1.00 0.00 C ATOM 390 CD PRO A 26 -2.095 7.359 -11.108 1.00 0.00 C ATOM 0 HA PRO A 26 -5.103 6.256 -11.837 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -3.032 4.742 -12.876 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -3.582 6.244 -13.591 1.00 0.00 H new ATOM 0 HG2 PRO A 26 -1.095 5.711 -12.081 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -1.464 7.049 -13.150 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -1.432 7.102 -10.282 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -1.914 8.407 -11.348 1.00 0.00 H new ATOM 398 N ASP A 27 -5.486 4.346 -10.487 1.00 0.00 N ATOM 399 CA ASP A 27 -5.781 3.176 -9.676 1.00 0.00 C ATOM 400 C ASP A 27 -5.190 1.936 -10.347 1.00 0.00 C ATOM 401 O ASP A 27 -5.306 0.828 -9.825 1.00 0.00 O ATOM 402 CB ASP A 27 -7.289 2.968 -9.539 1.00 0.00 C ATOM 403 CG ASP A 27 -7.710 1.969 -8.458 1.00 0.00 C ATOM 404 OD1 ASP A 27 -6.805 1.514 -7.726 1.00 0.00 O ATOM 405 OD2 ASP A 27 -8.924 1.686 -8.388 1.00 0.00 O ATOM 0 H ASP A 27 -6.299 4.773 -10.931 1.00 0.00 H new ATOM 0 HA ASP A 27 -5.348 3.331 -8.688 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -7.755 3.930 -9.325 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -7.682 2.630 -10.498 1.00 0.00 H new ATOM 410 N SER A 28 -4.569 2.162 -11.496 1.00 0.00 N ATOM 411 CA SER A 28 -3.960 1.076 -12.244 1.00 0.00 C ATOM 412 C SER A 28 -2.582 0.749 -11.664 1.00 0.00 C ATOM 413 O SER A 28 -2.222 -0.419 -11.528 1.00 0.00 O ATOM 414 CB SER A 28 -3.842 1.427 -13.728 1.00 0.00 C ATOM 415 OG SER A 28 -3.208 2.686 -13.929 1.00 0.00 O ATOM 0 H SER A 28 -4.475 3.082 -11.927 1.00 0.00 H new ATOM 0 HA SER A 28 -4.601 0.199 -12.156 1.00 0.00 H new ATOM 0 HB2 SER A 28 -3.275 0.650 -14.241 1.00 0.00 H new ATOM 0 HB3 SER A 28 -4.835 1.445 -14.176 1.00 0.00 H new ATOM 0 HG SER A 28 -3.150 2.873 -14.889 1.00 0.00 H new ATOM 421 N VAL A 29 -1.847 1.803 -11.338 1.00 0.00 N ATOM 422 CA VAL A 29 -0.517 1.643 -10.777 1.00 0.00 C ATOM 423 C VAL A 29 -0.623 0.970 -9.406 1.00 0.00 C ATOM 424 O VAL A 29 0.229 0.162 -9.040 1.00 0.00 O ATOM 425 CB VAL A 29 0.195 2.997 -10.724 1.00 0.00 C ATOM 426 CG1 VAL A 29 0.192 3.670 -12.097 1.00 0.00 C ATOM 427 CG2 VAL A 29 -0.435 3.907 -9.667 1.00 0.00 C ATOM 0 H VAL A 29 -2.148 2.771 -11.452 1.00 0.00 H new ATOM 0 HA VAL A 29 0.089 0.996 -11.411 1.00 0.00 H new ATOM 0 HB VAL A 29 1.232 2.820 -10.439 1.00 0.00 H new ATOM 0 HG11 VAL A 29 0.704 4.630 -12.033 1.00 0.00 H new ATOM 0 HG12 VAL A 29 0.706 3.032 -12.816 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -0.836 3.828 -12.423 1.00 0.00 H new ATOM 0 HG21 VAL A 29 0.090 4.862 -9.650 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -1.485 4.074 -9.909 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -0.359 3.434 -8.688 1.00 0.00 H new ATOM 437 N VAL A 30 -1.676 1.328 -8.687 1.00 0.00 N ATOM 438 CA VAL A 30 -1.905 0.769 -7.366 1.00 0.00 C ATOM 439 C VAL A 30 -2.478 -0.643 -7.506 1.00 0.00 C ATOM 440 O VAL A 30 -2.211 -1.510 -6.677 1.00 0.00 O ATOM 441 CB VAL A 30 -2.804 1.701 -6.552 1.00 0.00 C ATOM 442 CG1 VAL A 30 -4.205 1.785 -7.162 1.00 0.00 C ATOM 443 CG2 VAL A 30 -2.871 1.259 -5.089 1.00 0.00 C ATOM 0 H VAL A 30 -2.380 1.999 -8.994 1.00 0.00 H new ATOM 0 HA VAL A 30 -0.966 0.686 -6.819 1.00 0.00 H new ATOM 0 HB VAL A 30 -2.365 2.698 -6.582 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -4.823 2.454 -6.563 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -4.136 2.168 -8.180 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -4.655 0.792 -7.178 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -3.517 1.939 -4.533 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -3.274 0.248 -5.032 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -1.870 1.275 -4.658 1.00 0.00 H new ATOM 453 N ALA A 31 -3.256 -0.828 -8.563 1.00 0.00 N ATOM 454 CA ALA A 31 -3.870 -2.120 -8.823 1.00 0.00 C ATOM 455 C ALA A 31 -2.784 -3.128 -9.202 1.00 0.00 C ATOM 456 O ALA A 31 -3.012 -4.336 -9.161 1.00 0.00 O ATOM 457 CB ALA A 31 -4.933 -1.969 -9.913 1.00 0.00 C ATOM 0 H ALA A 31 -3.475 -0.106 -9.249 1.00 0.00 H new ATOM 0 HA ALA A 31 -4.370 -2.495 -7.930 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -5.394 -2.937 -10.108 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -5.696 -1.264 -9.582 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -4.468 -1.598 -10.826 1.00 0.00 H new ATOM 463 N ASP A 32 -1.626 -2.595 -9.562 1.00 0.00 N ATOM 464 CA ASP A 32 -0.504 -3.433 -9.949 1.00 0.00 C ATOM 465 C ASP A 32 0.121 -4.050 -8.696 1.00 0.00 C ATOM 466 O ASP A 32 0.633 -5.167 -8.738 1.00 0.00 O ATOM 467 CB ASP A 32 0.574 -2.616 -10.662 1.00 0.00 C ATOM 468 CG ASP A 32 1.752 -3.429 -11.202 1.00 0.00 C ATOM 469 OD1 ASP A 32 1.807 -4.635 -10.873 1.00 0.00 O ATOM 470 OD2 ASP A 32 2.571 -2.830 -11.932 1.00 0.00 O ATOM 0 H ASP A 32 -1.440 -1.593 -9.594 1.00 0.00 H new ATOM 0 HA ASP A 32 -0.876 -4.204 -10.623 1.00 0.00 H new ATOM 0 HB2 ASP A 32 0.113 -2.079 -11.491 1.00 0.00 H new ATOM 0 HB3 ASP A 32 0.957 -1.866 -9.970 1.00 0.00 H new ATOM 475 N LEU A 33 0.060 -3.294 -7.609 1.00 0.00 N ATOM 476 CA LEU A 33 0.612 -3.752 -6.346 1.00 0.00 C ATOM 477 C LEU A 33 0.017 -5.119 -5.998 1.00 0.00 C ATOM 478 O LEU A 33 0.652 -5.919 -5.314 1.00 0.00 O ATOM 479 CB LEU A 33 0.409 -2.698 -5.257 1.00 0.00 C ATOM 480 CG LEU A 33 1.620 -2.407 -4.368 1.00 0.00 C ATOM 481 CD1 LEU A 33 2.569 -1.415 -5.042 1.00 0.00 C ATOM 482 CD2 LEU A 33 1.182 -1.930 -2.982 1.00 0.00 C ATOM 0 H LEU A 33 -0.364 -2.367 -7.578 1.00 0.00 H new ATOM 0 HA LEU A 33 1.691 -3.886 -6.430 1.00 0.00 H new ATOM 0 HB2 LEU A 33 0.102 -1.767 -5.733 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -0.416 -3.017 -4.620 1.00 0.00 H new ATOM 0 HG LEU A 33 2.172 -3.337 -4.228 1.00 0.00 H new ATOM 0 HD11 LEU A 33 3.421 -1.226 -4.389 1.00 0.00 H new ATOM 0 HD12 LEU A 33 2.921 -1.832 -5.986 1.00 0.00 H new ATOM 0 HD13 LEU A 33 2.043 -0.480 -5.232 1.00 0.00 H new ATOM 0 HD21 LEU A 33 2.062 -1.730 -2.371 1.00 0.00 H new ATOM 0 HD22 LEU A 33 0.594 -1.017 -3.080 1.00 0.00 H new ATOM 0 HD23 LEU A 33 0.577 -2.702 -2.506 1.00 0.00 H new ATOM 494 N TYR A 34 -1.194 -5.342 -6.487 1.00 0.00 N ATOM 495 CA TYR A 34 -1.882 -6.596 -6.236 1.00 0.00 C ATOM 496 C TYR A 34 -1.268 -7.732 -7.057 1.00 0.00 C ATOM 497 O TYR A 34 -1.351 -8.896 -6.672 1.00 0.00 O ATOM 498 CB TYR A 34 -3.328 -6.382 -6.687 1.00 0.00 C ATOM 499 CG TYR A 34 -4.369 -6.995 -5.749 1.00 0.00 C ATOM 500 CD1 TYR A 34 -4.077 -8.151 -5.054 1.00 0.00 C ATOM 501 CD2 TYR A 34 -5.601 -6.391 -5.597 1.00 0.00 C ATOM 502 CE1 TYR A 34 -5.058 -8.729 -4.172 1.00 0.00 C ATOM 503 CE2 TYR A 34 -6.582 -6.969 -4.714 1.00 0.00 C ATOM 504 CZ TYR A 34 -6.262 -8.109 -4.045 1.00 0.00 C ATOM 505 OH TYR A 34 -7.188 -8.653 -3.212 1.00 0.00 O ATOM 0 H TYR A 34 -1.716 -4.675 -7.056 1.00 0.00 H new ATOM 0 HA TYR A 34 -1.808 -6.870 -5.183 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -3.517 -5.312 -6.773 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -3.454 -6.809 -7.682 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -3.112 -8.622 -5.172 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -5.829 -5.486 -6.140 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -4.843 -9.634 -3.624 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -7.550 -6.507 -4.586 1.00 0.00 H new ATOM 0 HH TYR A 34 -7.999 -8.103 -3.220 1.00 0.00 H new ATOM 515 N ASN A 35 -0.663 -7.353 -8.173 1.00 0.00 N ATOM 516 CA ASN A 35 -0.035 -8.324 -9.052 1.00 0.00 C ATOM 517 C ASN A 35 1.220 -8.881 -8.375 1.00 0.00 C ATOM 518 O ASN A 35 1.221 -10.014 -7.899 1.00 0.00 O ATOM 519 CB ASN A 35 0.387 -7.679 -10.374 1.00 0.00 C ATOM 520 CG ASN A 35 -0.327 -8.336 -11.557 1.00 0.00 C ATOM 521 OD1 ASN A 35 0.045 -9.398 -12.028 1.00 0.00 O ATOM 522 ND2 ASN A 35 -1.371 -7.647 -12.008 1.00 0.00 N ATOM 0 H ASN A 35 -0.594 -6.386 -8.489 1.00 0.00 H new ATOM 0 HA ASN A 35 -0.758 -9.115 -9.252 1.00 0.00 H new ATOM 0 HB2 ASN A 35 0.158 -6.614 -10.352 1.00 0.00 H new ATOM 0 HB3 ASN A 35 1.466 -7.771 -10.499 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -1.915 -8.002 -12.795 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -1.628 -6.764 -11.567 1.00 0.00 H new ATOM 529 N PHE A 36 2.258 -8.056 -8.355 1.00 0.00 N ATOM 530 CA PHE A 36 3.515 -8.452 -7.745 1.00 0.00 C ATOM 531 C PHE A 36 4.670 -7.588 -8.258 1.00 0.00 C ATOM 532 O PHE A 36 5.791 -8.070 -8.405 1.00 0.00 O ATOM 533 CB PHE A 36 3.768 -9.908 -8.144 1.00 0.00 C ATOM 534 CG PHE A 36 3.288 -10.260 -9.554 1.00 0.00 C ATOM 535 CD1 PHE A 36 3.350 -9.329 -10.544 1.00 0.00 C ATOM 536 CD2 PHE A 36 2.800 -11.501 -9.816 1.00 0.00 C ATOM 537 CE1 PHE A 36 2.904 -9.656 -11.852 1.00 0.00 C ATOM 538 CE2 PHE A 36 2.355 -11.826 -11.124 1.00 0.00 C ATOM 539 CZ PHE A 36 2.417 -10.897 -12.114 1.00 0.00 C ATOM 0 H PHE A 36 2.253 -7.116 -8.751 1.00 0.00 H new ATOM 0 HA PHE A 36 3.457 -8.330 -6.663 1.00 0.00 H new ATOM 0 HB2 PHE A 36 4.836 -10.113 -8.073 1.00 0.00 H new ATOM 0 HB3 PHE A 36 3.270 -10.562 -7.428 1.00 0.00 H new ATOM 0 HD1 PHE A 36 3.738 -8.343 -10.336 1.00 0.00 H new ATOM 0 HD2 PHE A 36 2.751 -12.239 -9.029 1.00 0.00 H new ATOM 0 HE1 PHE A 36 2.952 -8.918 -12.639 1.00 0.00 H new ATOM 0 HE2 PHE A 36 1.967 -12.812 -11.333 1.00 0.00 H new ATOM 0 HZ PHE A 36 2.079 -11.145 -13.109 1.00 0.00 H new ATOM 549 N TRP A 37 4.354 -6.328 -8.515 1.00 0.00 N ATOM 550 CA TRP A 37 5.350 -5.393 -9.009 1.00 0.00 C ATOM 551 C TRP A 37 5.946 -4.659 -7.806 1.00 0.00 C ATOM 552 O TRP A 37 6.449 -3.543 -7.941 1.00 0.00 O ATOM 553 CB TRP A 37 4.747 -4.446 -10.048 1.00 0.00 C ATOM 554 CG TRP A 37 3.921 -3.307 -9.447 1.00 0.00 C ATOM 555 CD1 TRP A 37 2.922 -3.392 -8.558 1.00 0.00 C ATOM 556 CD2 TRP A 37 4.064 -1.899 -9.730 1.00 0.00 C ATOM 557 NE1 TRP A 37 2.413 -2.146 -8.248 1.00 0.00 N ATOM 558 CE2 TRP A 37 3.130 -1.210 -8.983 1.00 0.00 C ATOM 559 CE3 TRP A 37 4.955 -1.229 -10.588 1.00 0.00 C ATOM 560 CZ2 TRP A 37 2.997 0.184 -9.020 1.00 0.00 C ATOM 561 CZ3 TRP A 37 4.808 0.162 -10.613 1.00 0.00 C ATOM 562 CH2 TRP A 37 3.872 0.871 -9.867 1.00 0.00 C ATOM 0 H TRP A 37 3.422 -5.932 -8.390 1.00 0.00 H new ATOM 0 HA TRP A 37 6.150 -5.921 -9.527 1.00 0.00 H new ATOM 0 HB2 TRP A 37 5.552 -4.020 -10.647 1.00 0.00 H new ATOM 0 HB3 TRP A 37 4.115 -5.021 -10.725 1.00 0.00 H new ATOM 0 HD1 TRP A 37 2.560 -4.318 -8.137 1.00 0.00 H new ATOM 0 HE1 TRP A 37 1.651 -1.949 -7.599 1.00 0.00 H new ATOM 0 HE3 TRP A 37 5.694 -1.748 -11.181 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 2.258 0.701 -8.426 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 5.468 0.725 -11.257 1.00 0.00 H new ATOM 0 HH2 TRP A 37 3.821 1.947 -9.942 1.00 0.00 H new ATOM 573 N LYS A 38 5.868 -5.312 -6.655 1.00 0.00 N ATOM 574 CA LYS A 38 6.393 -4.736 -5.430 1.00 0.00 C ATOM 575 C LYS A 38 7.806 -4.206 -5.685 1.00 0.00 C ATOM 576 O LYS A 38 8.168 -3.134 -5.202 1.00 0.00 O ATOM 577 CB LYS A 38 6.312 -5.746 -4.285 1.00 0.00 C ATOM 578 CG LYS A 38 4.891 -5.829 -3.726 1.00 0.00 C ATOM 579 CD LYS A 38 4.834 -6.749 -2.505 1.00 0.00 C ATOM 580 CE LYS A 38 3.387 -7.013 -2.083 1.00 0.00 C ATOM 581 NZ LYS A 38 3.348 -7.753 -0.802 1.00 0.00 N ATOM 0 H LYS A 38 5.448 -6.235 -6.546 1.00 0.00 H new ATOM 0 HA LYS A 38 5.785 -3.887 -5.118 1.00 0.00 H new ATOM 0 HB2 LYS A 38 6.625 -6.728 -4.639 1.00 0.00 H new ATOM 0 HB3 LYS A 38 7.002 -5.458 -3.492 1.00 0.00 H new ATOM 0 HG2 LYS A 38 4.546 -4.832 -3.451 1.00 0.00 H new ATOM 0 HG3 LYS A 38 4.215 -6.199 -4.496 1.00 0.00 H new ATOM 0 HD2 LYS A 38 5.328 -7.693 -2.734 1.00 0.00 H new ATOM 0 HD3 LYS A 38 5.381 -6.296 -1.678 1.00 0.00 H new ATOM 0 HE2 LYS A 38 2.854 -6.068 -1.980 1.00 0.00 H new ATOM 0 HE3 LYS A 38 2.875 -7.586 -2.856 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 2.614 -7.346 -0.188 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 3.130 -8.753 -0.985 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 4.272 -7.681 -0.331 1.00 0.00 H new ATOM 595 N ASP A 39 8.566 -4.982 -6.443 1.00 0.00 N ATOM 596 CA ASP A 39 9.931 -4.604 -6.768 1.00 0.00 C ATOM 597 C ASP A 39 9.950 -3.162 -7.276 1.00 0.00 C ATOM 598 O ASP A 39 10.977 -2.488 -7.207 1.00 0.00 O ATOM 599 CB ASP A 39 10.504 -5.501 -7.868 1.00 0.00 C ATOM 600 CG ASP A 39 9.743 -5.462 -9.194 1.00 0.00 C ATOM 601 OD1 ASP A 39 8.495 -5.444 -9.131 1.00 0.00 O ATOM 602 OD2 ASP A 39 10.426 -5.454 -10.240 1.00 0.00 O ATOM 0 H ASP A 39 8.263 -5.871 -6.842 1.00 0.00 H new ATOM 0 HA ASP A 39 10.534 -4.710 -5.866 1.00 0.00 H new ATOM 0 HB2 ASP A 39 11.538 -5.210 -8.051 1.00 0.00 H new ATOM 0 HB3 ASP A 39 10.521 -6.529 -7.506 1.00 0.00 H new ATOM 607 N ASP A 40 8.802 -2.729 -7.777 1.00 0.00 N ATOM 608 CA ASP A 40 8.673 -1.380 -8.298 1.00 0.00 C ATOM 609 C ASP A 40 8.257 -0.438 -7.165 1.00 0.00 C ATOM 610 O ASP A 40 7.070 -0.284 -6.884 1.00 0.00 O ATOM 611 CB ASP A 40 7.601 -1.309 -9.388 1.00 0.00 C ATOM 612 CG ASP A 40 7.491 0.041 -10.098 1.00 0.00 C ATOM 613 OD1 ASP A 40 7.056 1.003 -9.426 1.00 0.00 O ATOM 614 OD2 ASP A 40 7.842 0.083 -11.296 1.00 0.00 O ATOM 0 H ASP A 40 7.952 -3.290 -7.833 1.00 0.00 H new ATOM 0 HA ASP A 40 9.635 -1.089 -8.719 1.00 0.00 H new ATOM 0 HB2 ASP A 40 7.809 -2.078 -10.132 1.00 0.00 H new ATOM 0 HB3 ASP A 40 6.635 -1.549 -8.943 1.00 0.00 H new ATOM 619 N TYR A 41 9.261 0.166 -6.544 1.00 0.00 N ATOM 620 CA TYR A 41 9.014 1.089 -5.448 1.00 0.00 C ATOM 621 C TYR A 41 8.791 2.510 -5.967 1.00 0.00 C ATOM 622 O TYR A 41 8.913 2.764 -7.164 1.00 0.00 O ATOM 623 CB TYR A 41 10.278 1.066 -4.585 1.00 0.00 C ATOM 624 CG TYR A 41 10.896 -0.325 -4.426 1.00 0.00 C ATOM 625 CD1 TYR A 41 10.081 -1.431 -4.288 1.00 0.00 C ATOM 626 CD2 TYR A 41 12.268 -0.473 -4.417 1.00 0.00 C ATOM 627 CE1 TYR A 41 10.664 -2.740 -4.138 1.00 0.00 C ATOM 628 CE2 TYR A 41 12.851 -1.782 -4.267 1.00 0.00 C ATOM 629 CZ TYR A 41 12.019 -2.850 -4.135 1.00 0.00 C ATOM 630 OH TYR A 41 12.569 -4.086 -3.991 1.00 0.00 O ATOM 0 H TYR A 41 10.245 0.035 -6.778 1.00 0.00 H new ATOM 0 HA TYR A 41 8.123 0.796 -4.893 1.00 0.00 H new ATOM 0 HB2 TYR A 41 11.019 1.734 -5.025 1.00 0.00 H new ATOM 0 HB3 TYR A 41 10.039 1.462 -3.598 1.00 0.00 H new ATOM 0 HD1 TYR A 41 9.007 -1.315 -4.292 1.00 0.00 H new ATOM 0 HD2 TYR A 41 12.905 0.393 -4.522 1.00 0.00 H new ATOM 0 HE1 TYR A 41 10.039 -3.614 -4.030 1.00 0.00 H new ATOM 0 HE2 TYR A 41 13.923 -1.912 -4.260 1.00 0.00 H new ATOM 0 HH TYR A 41 12.285 -4.659 -4.734 1.00 0.00 H new ATOM 640 N VAL A 42 8.469 3.401 -5.041 1.00 0.00 N ATOM 641 CA VAL A 42 8.228 4.790 -5.388 1.00 0.00 C ATOM 642 C VAL A 42 9.250 5.232 -6.439 1.00 0.00 C ATOM 643 O VAL A 42 8.963 6.102 -7.261 1.00 0.00 O ATOM 644 CB VAL A 42 8.253 5.658 -4.129 1.00 0.00 C ATOM 645 CG1 VAL A 42 8.395 7.139 -4.486 1.00 0.00 C ATOM 646 CG2 VAL A 42 7.007 5.417 -3.274 1.00 0.00 C ATOM 0 H VAL A 42 8.369 3.187 -4.049 1.00 0.00 H new ATOM 0 HA VAL A 42 7.237 4.907 -5.826 1.00 0.00 H new ATOM 0 HB VAL A 42 9.125 5.371 -3.541 1.00 0.00 H new ATOM 0 HG11 VAL A 42 8.410 7.734 -3.573 1.00 0.00 H new ATOM 0 HG12 VAL A 42 9.324 7.293 -5.035 1.00 0.00 H new ATOM 0 HG13 VAL A 42 7.552 7.446 -5.105 1.00 0.00 H new ATOM 0 HG21 VAL A 42 7.049 6.046 -2.385 1.00 0.00 H new ATOM 0 HG22 VAL A 42 6.116 5.664 -3.852 1.00 0.00 H new ATOM 0 HG23 VAL A 42 6.967 4.369 -2.976 1.00 0.00 H new ATOM 656 N MET A 43 10.419 4.613 -6.377 1.00 0.00 N ATOM 657 CA MET A 43 11.486 4.933 -7.312 1.00 0.00 C ATOM 658 C MET A 43 10.933 5.139 -8.724 1.00 0.00 C ATOM 659 O MET A 43 11.529 5.851 -9.530 1.00 0.00 O ATOM 660 CB MET A 43 12.510 3.797 -7.326 1.00 0.00 C ATOM 661 CG MET A 43 13.885 4.293 -6.878 1.00 0.00 C ATOM 662 SD MET A 43 14.142 3.908 -5.153 1.00 0.00 S ATOM 663 CE MET A 43 14.430 5.548 -4.510 1.00 0.00 C ATOM 0 H MET A 43 10.652 3.892 -5.695 1.00 0.00 H new ATOM 0 HA MET A 43 11.962 5.859 -6.989 1.00 0.00 H new ATOM 0 HB2 MET A 43 12.177 2.994 -6.668 1.00 0.00 H new ATOM 0 HB3 MET A 43 12.580 3.378 -8.330 1.00 0.00 H new ATOM 0 HG2 MET A 43 14.663 3.827 -7.483 1.00 0.00 H new ATOM 0 HG3 MET A 43 13.961 5.369 -7.034 1.00 0.00 H new ATOM 0 HE1 MET A 43 14.610 5.492 -3.436 1.00 0.00 H new ATOM 0 HE2 MET A 43 15.300 5.984 -5.001 1.00 0.00 H new ATOM 0 HE3 MET A 43 13.556 6.172 -4.699 1.00 0.00 H new ATOM 673 N THR A 44 9.798 4.505 -8.979 1.00 0.00 N ATOM 674 CA THR A 44 9.157 4.610 -10.279 1.00 0.00 C ATOM 675 C THR A 44 7.836 5.372 -10.163 1.00 0.00 C ATOM 676 O THR A 44 7.653 6.406 -10.803 1.00 0.00 O ATOM 677 CB THR A 44 8.997 3.196 -10.842 1.00 0.00 C ATOM 678 OG1 THR A 44 10.238 2.937 -11.491 1.00 0.00 O ATOM 679 CG2 THR A 44 7.966 3.130 -11.971 1.00 0.00 C ATOM 0 H THR A 44 9.305 3.916 -8.307 1.00 0.00 H new ATOM 0 HA THR A 44 9.766 5.186 -10.976 1.00 0.00 H new ATOM 0 HB THR A 44 8.704 2.518 -10.041 1.00 0.00 H new ATOM 0 HG1 THR A 44 10.221 2.039 -11.883 1.00 0.00 H new ATOM 0 HG21 THR A 44 7.891 2.105 -12.335 1.00 0.00 H new ATOM 0 HG22 THR A 44 6.995 3.454 -11.597 1.00 0.00 H new ATOM 0 HG23 THR A 44 8.277 3.783 -12.786 1.00 0.00 H new ATOM 687 N ASP A 45 6.948 4.831 -9.342 1.00 0.00 N ATOM 688 CA ASP A 45 5.649 5.447 -9.133 1.00 0.00 C ATOM 689 C ASP A 45 5.355 5.510 -7.633 1.00 0.00 C ATOM 690 O ASP A 45 5.051 4.493 -7.013 1.00 0.00 O ATOM 691 CB ASP A 45 4.540 4.631 -9.798 1.00 0.00 C ATOM 692 CG ASP A 45 3.214 5.372 -9.984 1.00 0.00 C ATOM 693 OD1 ASP A 45 3.132 6.150 -10.958 1.00 0.00 O ATOM 694 OD2 ASP A 45 2.314 5.144 -9.147 1.00 0.00 O ATOM 0 H ASP A 45 7.103 3.972 -8.813 1.00 0.00 H new ATOM 0 HA ASP A 45 5.674 6.445 -9.570 1.00 0.00 H new ATOM 0 HB2 ASP A 45 4.892 4.296 -10.774 1.00 0.00 H new ATOM 0 HB3 ASP A 45 4.359 3.738 -9.200 1.00 0.00 H new ATOM 699 N ARG A 46 5.454 6.717 -7.093 1.00 0.00 N ATOM 700 CA ARG A 46 5.201 6.927 -5.679 1.00 0.00 C ATOM 701 C ARG A 46 3.709 6.783 -5.378 1.00 0.00 C ATOM 702 O ARG A 46 3.329 6.315 -4.305 1.00 0.00 O ATOM 703 CB ARG A 46 5.673 8.313 -5.234 1.00 0.00 C ATOM 704 CG ARG A 46 4.707 9.399 -5.712 1.00 0.00 C ATOM 705 CD ARG A 46 3.669 9.722 -4.635 1.00 0.00 C ATOM 706 NE ARG A 46 4.258 10.618 -3.615 1.00 0.00 N ATOM 707 CZ ARG A 46 4.483 11.925 -3.805 1.00 0.00 C ATOM 708 NH1 ARG A 46 4.170 12.497 -4.975 1.00 0.00 N ATOM 709 NH2 ARG A 46 5.022 12.661 -2.823 1.00 0.00 N ATOM 0 H ARG A 46 5.706 7.559 -7.611 1.00 0.00 H new ATOM 0 HA ARG A 46 5.760 6.171 -5.128 1.00 0.00 H new ATOM 0 HB2 ARG A 46 5.751 8.343 -4.147 1.00 0.00 H new ATOM 0 HB3 ARG A 46 6.669 8.507 -5.631 1.00 0.00 H new ATOM 0 HG2 ARG A 46 5.265 10.300 -5.967 1.00 0.00 H new ATOM 0 HG3 ARG A 46 4.203 9.069 -6.620 1.00 0.00 H new ATOM 0 HD2 ARG A 46 2.799 10.196 -5.088 1.00 0.00 H new ATOM 0 HD3 ARG A 46 3.322 8.802 -4.165 1.00 0.00 H new ATOM 0 HE ARG A 46 4.508 10.216 -2.712 1.00 0.00 H new ATOM 0 HH11 ARG A 46 3.760 11.937 -5.723 1.00 0.00 H new ATOM 0 HH12 ARG A 46 4.342 13.492 -5.118 1.00 0.00 H new ATOM 0 HH21 ARG A 46 5.261 12.226 -1.932 1.00 0.00 H new ATOM 0 HH22 ARG A 46 5.194 13.656 -2.967 1.00 0.00 H new ATOM 723 N LEU A 47 2.901 7.194 -6.345 1.00 0.00 N ATOM 724 CA LEU A 47 1.458 7.117 -6.197 1.00 0.00 C ATOM 725 C LEU A 47 1.075 5.727 -5.684 1.00 0.00 C ATOM 726 O LEU A 47 0.243 5.599 -4.787 1.00 0.00 O ATOM 727 CB LEU A 47 0.764 7.501 -7.506 1.00 0.00 C ATOM 728 CG LEU A 47 1.248 8.793 -8.168 1.00 0.00 C ATOM 729 CD1 LEU A 47 1.512 9.878 -7.123 1.00 0.00 C ATOM 730 CD2 LEU A 47 2.475 8.532 -9.046 1.00 0.00 C ATOM 0 H LEU A 47 3.219 7.581 -7.234 1.00 0.00 H new ATOM 0 HA LEU A 47 1.113 7.838 -5.456 1.00 0.00 H new ATOM 0 HB2 LEU A 47 0.891 6.683 -8.215 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -0.305 7.593 -7.314 1.00 0.00 H new ATOM 0 HG LEU A 47 0.456 9.160 -8.821 1.00 0.00 H new ATOM 0 HD11 LEU A 47 1.855 10.786 -7.620 1.00 0.00 H new ATOM 0 HD12 LEU A 47 0.593 10.088 -6.577 1.00 0.00 H new ATOM 0 HD13 LEU A 47 2.277 9.534 -6.427 1.00 0.00 H new ATOM 0 HD21 LEU A 47 2.799 9.466 -9.505 1.00 0.00 H new ATOM 0 HD22 LEU A 47 3.282 8.129 -8.433 1.00 0.00 H new ATOM 0 HD23 LEU A 47 2.219 7.814 -9.825 1.00 0.00 H new ATOM 742 N ALA A 48 1.700 4.720 -6.277 1.00 0.00 N ATOM 743 CA ALA A 48 1.434 3.344 -5.890 1.00 0.00 C ATOM 744 C ALA A 48 1.713 3.176 -4.395 1.00 0.00 C ATOM 745 O ALA A 48 1.058 2.379 -3.725 1.00 0.00 O ATOM 746 CB ALA A 48 2.279 2.401 -6.750 1.00 0.00 C ATOM 0 H ALA A 48 2.389 4.829 -7.021 1.00 0.00 H new ATOM 0 HA ALA A 48 0.387 3.092 -6.060 1.00 0.00 H new ATOM 0 HB1 ALA A 48 2.081 1.369 -6.461 1.00 0.00 H new ATOM 0 HB2 ALA A 48 2.023 2.539 -7.800 1.00 0.00 H new ATOM 0 HB3 ALA A 48 3.336 2.622 -6.602 1.00 0.00 H new ATOM 752 N GLY A 49 2.683 3.939 -3.917 1.00 0.00 N ATOM 753 CA GLY A 49 3.056 3.885 -2.514 1.00 0.00 C ATOM 754 C GLY A 49 2.120 4.748 -1.664 1.00 0.00 C ATOM 755 O GLY A 49 1.880 4.445 -0.497 1.00 0.00 O ATOM 0 H GLY A 49 3.223 4.599 -4.477 1.00 0.00 H new ATOM 0 HA2 GLY A 49 3.022 2.853 -2.165 1.00 0.00 H new ATOM 0 HA3 GLY A 49 4.083 4.229 -2.394 1.00 0.00 H new ATOM 759 N CYS A 50 1.617 5.806 -2.284 1.00 0.00 N ATOM 760 CA CYS A 50 0.715 6.715 -1.599 1.00 0.00 C ATOM 761 C CYS A 50 -0.679 6.081 -1.578 1.00 0.00 C ATOM 762 O CYS A 50 -1.360 6.105 -0.555 1.00 0.00 O ATOM 763 CB CYS A 50 0.701 8.098 -2.252 1.00 0.00 C ATOM 764 SG CYS A 50 1.738 9.352 -1.414 1.00 0.00 S ATOM 0 H CYS A 50 1.817 6.053 -3.253 1.00 0.00 H new ATOM 0 HA CYS A 50 1.060 6.872 -0.577 1.00 0.00 H new ATOM 0 HB2 CYS A 50 1.037 8.000 -3.284 1.00 0.00 H new ATOM 0 HB3 CYS A 50 -0.327 8.459 -2.284 1.00 0.00 H new ATOM 769 N ALA A 51 -1.060 5.529 -2.720 1.00 0.00 N ATOM 770 CA ALA A 51 -2.359 4.889 -2.845 1.00 0.00 C ATOM 771 C ALA A 51 -2.460 3.748 -1.832 1.00 0.00 C ATOM 772 O ALA A 51 -3.453 3.635 -1.115 1.00 0.00 O ATOM 773 CB ALA A 51 -2.557 4.411 -4.285 1.00 0.00 C ATOM 0 H ALA A 51 -0.492 5.511 -3.567 1.00 0.00 H new ATOM 0 HA ALA A 51 -3.158 5.597 -2.625 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -3.531 3.931 -4.378 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -2.506 5.264 -4.962 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -1.775 3.697 -4.542 1.00 0.00 H new ATOM 779 N ILE A 52 -1.419 2.927 -1.808 1.00 0.00 N ATOM 780 CA ILE A 52 -1.378 1.797 -0.895 1.00 0.00 C ATOM 781 C ILE A 52 -1.469 2.307 0.545 1.00 0.00 C ATOM 782 O ILE A 52 -2.147 1.705 1.378 1.00 0.00 O ATOM 783 CB ILE A 52 -0.144 0.934 -1.165 1.00 0.00 C ATOM 784 CG1 ILE A 52 -0.187 -0.358 -0.347 1.00 0.00 C ATOM 785 CG2 ILE A 52 1.143 1.725 -0.918 1.00 0.00 C ATOM 786 CD1 ILE A 52 -1.616 -0.898 -0.253 1.00 0.00 C ATOM 0 H ILE A 52 -0.598 3.022 -2.406 1.00 0.00 H new ATOM 0 HA ILE A 52 -2.236 1.145 -1.058 1.00 0.00 H new ATOM 0 HB ILE A 52 -0.151 0.649 -2.217 1.00 0.00 H new ATOM 0 HG12 ILE A 52 0.459 -1.106 -0.807 1.00 0.00 H new ATOM 0 HG13 ILE A 52 0.202 -0.172 0.654 1.00 0.00 H new ATOM 0 HG21 ILE A 52 2.005 1.088 -1.117 1.00 0.00 H new ATOM 0 HG22 ILE A 52 1.171 2.591 -1.580 1.00 0.00 H new ATOM 0 HG23 ILE A 52 1.171 2.060 0.119 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -1.620 -1.817 0.333 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -2.254 -0.157 0.229 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -1.993 -1.105 -1.254 1.00 0.00 H new ATOM 798 N ASN A 53 -0.778 3.409 0.794 1.00 0.00 N ATOM 799 CA ASN A 53 -0.774 4.005 2.119 1.00 0.00 C ATOM 800 C ASN A 53 -2.195 4.441 2.483 1.00 0.00 C ATOM 801 O ASN A 53 -2.642 4.234 3.609 1.00 0.00 O ATOM 802 CB ASN A 53 0.126 5.243 2.162 1.00 0.00 C ATOM 803 CG ASN A 53 1.277 5.050 3.150 1.00 0.00 C ATOM 804 OD1 ASN A 53 1.497 5.843 4.050 1.00 0.00 O ATOM 805 ND2 ASN A 53 1.998 3.953 2.932 1.00 0.00 N ATOM 0 H ASN A 53 -0.217 3.905 0.101 1.00 0.00 H new ATOM 0 HA ASN A 53 -0.400 3.261 2.822 1.00 0.00 H new ATOM 0 HB2 ASN A 53 0.525 5.441 1.167 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -0.462 6.115 2.449 1.00 0.00 H new ATOM 0 HD21 ASN A 53 2.789 3.734 3.537 1.00 0.00 H new ATOM 0 HD22 ASN A 53 1.759 3.331 2.160 1.00 0.00 H new ATOM 812 N CYS A 54 -2.865 5.037 1.506 1.00 0.00 N ATOM 813 CA CYS A 54 -4.225 5.503 1.711 1.00 0.00 C ATOM 814 C CYS A 54 -5.121 4.286 1.943 1.00 0.00 C ATOM 815 O CYS A 54 -6.227 4.414 2.464 1.00 0.00 O ATOM 816 CB CYS A 54 -4.713 6.355 0.538 1.00 0.00 C ATOM 817 SG CYS A 54 -6.160 5.677 -0.354 1.00 0.00 S ATOM 0 H CYS A 54 -2.491 5.207 0.572 1.00 0.00 H new ATOM 0 HA CYS A 54 -4.261 6.151 2.587 1.00 0.00 H new ATOM 0 HB2 CYS A 54 -4.965 7.348 0.909 1.00 0.00 H new ATOM 0 HB3 CYS A 54 -3.893 6.478 -0.169 1.00 0.00 H new ATOM 822 N LEU A 55 -4.610 3.131 1.544 1.00 0.00 N ATOM 823 CA LEU A 55 -5.350 1.889 1.701 1.00 0.00 C ATOM 824 C LEU A 55 -5.790 1.745 3.160 1.00 0.00 C ATOM 825 O LEU A 55 -6.867 1.222 3.437 1.00 0.00 O ATOM 826 CB LEU A 55 -4.527 0.706 1.188 1.00 0.00 C ATOM 827 CG LEU A 55 -5.321 -0.543 0.797 1.00 0.00 C ATOM 828 CD1 LEU A 55 -6.027 -1.146 2.013 1.00 0.00 C ATOM 829 CD2 LEU A 55 -6.298 -0.239 -0.340 1.00 0.00 C ATOM 0 H LEU A 55 -3.692 3.028 1.112 1.00 0.00 H new ATOM 0 HA LEU A 55 -6.255 1.905 1.094 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -3.955 1.035 0.320 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -3.807 0.429 1.958 1.00 0.00 H new ATOM 0 HG LEU A 55 -4.620 -1.291 0.427 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -6.584 -2.032 1.708 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -5.286 -1.423 2.763 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -6.714 -0.413 2.435 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -6.849 -1.143 -0.598 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -6.998 0.534 -0.022 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -5.744 0.110 -1.212 1.00 0.00 H new ATOM 841 N ALA A 56 -4.934 2.220 4.053 1.00 0.00 N ATOM 842 CA ALA A 56 -5.221 2.151 5.475 1.00 0.00 C ATOM 843 C ALA A 56 -6.272 3.204 5.831 1.00 0.00 C ATOM 844 O ALA A 56 -6.832 3.183 6.926 1.00 0.00 O ATOM 845 CB ALA A 56 -3.924 2.328 6.268 1.00 0.00 C ATOM 0 H ALA A 56 -4.041 2.654 3.819 1.00 0.00 H new ATOM 0 HA ALA A 56 -5.631 1.176 5.737 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -4.140 2.276 7.335 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -3.223 1.537 6.001 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -3.484 3.297 6.034 1.00 0.00 H new ATOM 851 N THR A 57 -6.506 4.102 4.886 1.00 0.00 N ATOM 852 CA THR A 57 -7.479 5.162 5.086 1.00 0.00 C ATOM 853 C THR A 57 -8.385 4.838 6.275 1.00 0.00 C ATOM 854 O THR A 57 -8.458 5.606 7.233 1.00 0.00 O ATOM 855 CB THR A 57 -8.243 5.357 3.775 1.00 0.00 C ATOM 856 OG1 THR A 57 -9.464 5.976 4.173 1.00 0.00 O ATOM 857 CG2 THR A 57 -8.684 4.031 3.152 1.00 0.00 C ATOM 0 H THR A 57 -6.039 4.117 3.980 1.00 0.00 H new ATOM 0 HA THR A 57 -6.991 6.104 5.337 1.00 0.00 H new ATOM 0 HB THR A 57 -7.617 5.900 3.068 1.00 0.00 H new ATOM 0 HG1 THR A 57 -10.020 6.140 3.383 1.00 0.00 H new ATOM 0 HG21 THR A 57 -9.222 4.226 2.224 1.00 0.00 H new ATOM 0 HG22 THR A 57 -7.807 3.418 2.942 1.00 0.00 H new ATOM 0 HG23 THR A 57 -9.338 3.503 3.846 1.00 0.00 H new ATOM 865 N LYS A 58 -9.054 3.698 6.175 1.00 0.00 N ATOM 866 CA LYS A 58 -9.952 3.261 7.230 1.00 0.00 C ATOM 867 C LYS A 58 -9.337 2.062 7.954 1.00 0.00 C ATOM 868 O LYS A 58 -9.323 0.953 7.422 1.00 0.00 O ATOM 869 CB LYS A 58 -11.349 2.990 6.667 1.00 0.00 C ATOM 870 CG LYS A 58 -12.117 4.296 6.453 1.00 0.00 C ATOM 871 CD LYS A 58 -12.953 4.649 7.685 1.00 0.00 C ATOM 872 CE LYS A 58 -14.100 5.593 7.317 1.00 0.00 C ATOM 873 NZ LYS A 58 -14.255 6.645 8.346 1.00 0.00 N ATOM 0 H LYS A 58 -8.992 3.064 5.379 1.00 0.00 H new ATOM 0 HA LYS A 58 -10.080 4.049 7.972 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -11.266 2.454 5.722 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -11.902 2.347 7.351 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -11.416 5.104 6.241 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -12.767 4.201 5.583 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -13.355 3.738 8.129 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -12.319 5.118 8.437 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -13.905 6.051 6.347 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -15.028 5.028 7.223 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -15.037 7.277 8.081 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -14.462 6.204 9.265 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -13.375 7.194 8.416 1.00 0.00 H new ATOM 887 N LEU A 59 -8.845 2.324 9.156 1.00 0.00 N ATOM 888 CA LEU A 59 -8.230 1.280 9.958 1.00 0.00 C ATOM 889 C LEU A 59 -9.317 0.338 10.480 1.00 0.00 C ATOM 890 O LEU A 59 -9.022 -0.762 10.938 1.00 0.00 O ATOM 891 CB LEU A 59 -7.363 1.892 11.060 1.00 0.00 C ATOM 892 CG LEU A 59 -6.607 3.168 10.688 1.00 0.00 C ATOM 893 CD1 LEU A 59 -5.659 3.591 11.812 1.00 0.00 C ATOM 894 CD2 LEU A 59 -5.875 3.002 9.353 1.00 0.00 C ATOM 0 H LEU A 59 -8.860 3.245 9.594 1.00 0.00 H new ATOM 0 HA LEU A 59 -7.553 0.680 9.350 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -8.000 2.108 11.918 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -6.638 1.144 11.381 1.00 0.00 H new ATOM 0 HG LEU A 59 -7.333 3.971 10.560 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -5.134 4.501 11.522 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -6.232 3.777 12.721 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -4.935 2.797 11.995 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -5.345 3.924 9.111 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -5.161 2.182 9.429 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -6.597 2.782 8.567 1.00 0.00 H new ATOM 906 N ASP A 60 -10.554 0.808 10.394 1.00 0.00 N ATOM 907 CA ASP A 60 -11.687 0.022 10.853 1.00 0.00 C ATOM 908 C ASP A 60 -11.968 -1.095 9.846 1.00 0.00 C ATOM 909 O ASP A 60 -12.455 -2.162 10.216 1.00 0.00 O ATOM 910 CB ASP A 60 -12.946 0.884 10.967 1.00 0.00 C ATOM 911 CG ASP A 60 -13.394 1.185 12.398 1.00 0.00 C ATOM 912 OD1 ASP A 60 -12.544 1.039 13.303 1.00 0.00 O ATOM 913 OD2 ASP A 60 -14.576 1.557 12.556 1.00 0.00 O ATOM 0 H ASP A 60 -10.796 1.723 10.013 1.00 0.00 H new ATOM 0 HA ASP A 60 -11.440 -0.386 11.833 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -12.770 1.828 10.451 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -13.761 0.382 10.445 1.00 0.00 H new ATOM 918 N VAL A 61 -11.649 -0.810 8.591 1.00 0.00 N ATOM 919 CA VAL A 61 -11.861 -1.778 7.528 1.00 0.00 C ATOM 920 C VAL A 61 -10.776 -2.854 7.599 1.00 0.00 C ATOM 921 O VAL A 61 -11.041 -4.027 7.341 1.00 0.00 O ATOM 922 CB VAL A 61 -11.911 -1.066 6.175 1.00 0.00 C ATOM 923 CG1 VAL A 61 -13.015 -0.006 6.153 1.00 0.00 C ATOM 924 CG2 VAL A 61 -10.552 -0.451 5.829 1.00 0.00 C ATOM 0 H VAL A 61 -11.246 0.076 8.287 1.00 0.00 H new ATOM 0 HA VAL A 61 -12.822 -2.278 7.652 1.00 0.00 H new ATOM 0 HB VAL A 61 -12.146 -1.809 5.413 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -13.029 0.485 5.180 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -13.979 -0.481 6.333 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -12.824 0.734 6.930 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -10.614 0.049 4.863 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -10.275 0.273 6.595 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -9.798 -1.237 5.783 1.00 0.00 H new ATOM 934 N VAL A 62 -9.575 -2.416 7.949 1.00 0.00 N ATOM 935 CA VAL A 62 -8.449 -3.327 8.058 1.00 0.00 C ATOM 936 C VAL A 62 -8.465 -3.991 9.436 1.00 0.00 C ATOM 937 O VAL A 62 -8.300 -5.204 9.546 1.00 0.00 O ATOM 938 CB VAL A 62 -7.145 -2.582 7.768 1.00 0.00 C ATOM 939 CG1 VAL A 62 -6.786 -2.659 6.282 1.00 0.00 C ATOM 940 CG2 VAL A 62 -7.227 -1.128 8.236 1.00 0.00 C ATOM 0 H VAL A 62 -9.358 -1.442 8.161 1.00 0.00 H new ATOM 0 HA VAL A 62 -8.527 -4.121 7.315 1.00 0.00 H new ATOM 0 HB VAL A 62 -6.350 -3.071 8.331 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -5.855 -2.121 6.104 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -6.664 -3.702 5.991 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -7.584 -2.209 5.691 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -6.287 -0.622 8.018 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -8.040 -0.623 7.715 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -7.412 -1.101 9.310 1.00 0.00 H new ATOM 950 N ASP A 63 -8.664 -3.165 10.452 1.00 0.00 N ATOM 951 CA ASP A 63 -8.703 -3.656 11.819 1.00 0.00 C ATOM 952 C ASP A 63 -10.007 -3.206 12.482 1.00 0.00 C ATOM 953 O ASP A 63 -10.190 -2.021 12.755 1.00 0.00 O ATOM 954 CB ASP A 63 -7.539 -3.098 12.639 1.00 0.00 C ATOM 955 CG ASP A 63 -6.986 -1.757 12.150 1.00 0.00 C ATOM 956 OD1 ASP A 63 -6.294 -1.774 11.110 1.00 0.00 O ATOM 957 OD2 ASP A 63 -7.270 -0.745 12.827 1.00 0.00 O ATOM 0 H ASP A 63 -8.800 -2.159 10.356 1.00 0.00 H new ATOM 0 HA ASP A 63 -8.633 -4.743 11.788 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -7.865 -2.984 13.673 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -6.731 -3.829 12.638 1.00 0.00 H new ATOM 962 N PRO A 64 -10.902 -4.201 12.726 1.00 0.00 N ATOM 963 CA PRO A 64 -12.182 -3.918 13.350 1.00 0.00 C ATOM 964 C PRO A 64 -12.015 -3.652 14.848 1.00 0.00 C ATOM 965 O PRO A 64 -12.649 -2.752 15.397 1.00 0.00 O ATOM 966 CB PRO A 64 -13.042 -5.136 13.056 1.00 0.00 C ATOM 967 CG PRO A 64 -12.073 -6.248 12.681 1.00 0.00 C ATOM 968 CD PRO A 64 -10.718 -5.614 12.415 1.00 0.00 C ATOM 0 HA PRO A 64 -12.649 -3.014 12.959 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -13.637 -5.413 13.926 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -13.740 -4.935 12.243 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -12.001 -6.979 13.486 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -12.426 -6.780 11.798 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -9.943 -6.059 13.039 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -10.412 -5.755 11.378 1.00 0.00 H new ATOM 976 N ASP A 65 -11.159 -4.454 15.467 1.00 0.00 N ATOM 977 CA ASP A 65 -10.901 -4.316 16.890 1.00 0.00 C ATOM 978 C ASP A 65 -9.489 -3.766 17.097 1.00 0.00 C ATOM 979 O ASP A 65 -9.035 -3.624 18.231 1.00 0.00 O ATOM 980 CB ASP A 65 -10.991 -5.670 17.598 1.00 0.00 C ATOM 981 CG ASP A 65 -12.162 -5.814 18.572 1.00 0.00 C ATOM 982 OD1 ASP A 65 -12.703 -4.760 18.969 1.00 0.00 O ATOM 983 OD2 ASP A 65 -12.489 -6.975 18.897 1.00 0.00 O ATOM 0 H ASP A 65 -10.636 -5.201 15.009 1.00 0.00 H new ATOM 0 HA ASP A 65 -11.649 -3.641 17.306 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -11.067 -6.453 16.844 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -10.062 -5.841 18.142 1.00 0.00 H new ATOM 988 N GLY A 66 -8.834 -3.472 15.984 1.00 0.00 N ATOM 989 CA GLY A 66 -7.482 -2.940 16.029 1.00 0.00 C ATOM 990 C GLY A 66 -6.451 -4.041 15.766 1.00 0.00 C ATOM 991 O GLY A 66 -5.440 -4.128 16.460 1.00 0.00 O ATOM 0 H GLY A 66 -9.214 -3.592 15.045 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -7.373 -2.150 15.286 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -7.297 -2.489 17.004 1.00 0.00 H new ATOM 995 N ASN A 67 -6.743 -4.854 14.761 1.00 0.00 N ATOM 996 CA ASN A 67 -5.856 -5.944 14.398 1.00 0.00 C ATOM 997 C ASN A 67 -4.434 -5.405 14.233 1.00 0.00 C ATOM 998 O ASN A 67 -3.465 -6.079 14.584 1.00 0.00 O ATOM 999 CB ASN A 67 -6.276 -6.579 13.072 1.00 0.00 C ATOM 1000 CG ASN A 67 -5.055 -6.954 12.231 1.00 0.00 C ATOM 1001 OD1 ASN A 67 -4.907 -6.551 11.089 1.00 0.00 O ATOM 1002 ND2 ASN A 67 -4.189 -7.748 12.857 1.00 0.00 N ATOM 0 H ASN A 67 -7.583 -4.779 14.187 1.00 0.00 H new ATOM 0 HA ASN A 67 -5.904 -6.694 15.188 1.00 0.00 H new ATOM 0 HB2 ASN A 67 -6.876 -7.468 13.265 1.00 0.00 H new ATOM 0 HB3 ASN A 67 -6.905 -5.884 12.516 1.00 0.00 H new ATOM 0 HD21 ASN A 67 -3.341 -8.055 12.380 1.00 0.00 H new ATOM 0 HD22 ASN A 67 -4.373 -8.049 13.814 1.00 0.00 H new ATOM 1009 N LEU A 68 -4.353 -4.194 13.699 1.00 0.00 N ATOM 1010 CA LEU A 68 -3.065 -3.557 13.485 1.00 0.00 C ATOM 1011 C LEU A 68 -3.284 -2.094 13.095 1.00 0.00 C ATOM 1012 O LEU A 68 -4.413 -1.606 13.110 1.00 0.00 O ATOM 1013 CB LEU A 68 -2.239 -4.346 12.467 1.00 0.00 C ATOM 1014 CG LEU A 68 -2.468 -3.990 10.996 1.00 0.00 C ATOM 1015 CD1 LEU A 68 -3.756 -3.184 10.822 1.00 0.00 C ATOM 1016 CD2 LEU A 68 -1.254 -3.264 10.412 1.00 0.00 C ATOM 0 H LEU A 68 -5.158 -3.638 13.409 1.00 0.00 H new ATOM 0 HA LEU A 68 -2.481 -3.560 14.406 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -1.183 -4.201 12.695 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -2.451 -5.407 12.601 1.00 0.00 H new ATOM 0 HG LEU A 68 -2.589 -4.917 10.435 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -3.895 -2.944 9.768 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -4.603 -3.771 11.175 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -3.689 -2.261 11.398 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -1.443 -3.023 9.366 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -1.077 -2.345 10.970 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -0.377 -3.907 10.483 1.00 0.00 H new ATOM 1028 N HIS A 69 -2.186 -1.433 12.757 1.00 0.00 N ATOM 1029 CA HIS A 69 -2.245 -0.035 12.365 1.00 0.00 C ATOM 1030 C HIS A 69 -1.185 0.243 11.297 1.00 0.00 C ATOM 1031 O HIS A 69 0.012 0.161 11.568 1.00 0.00 O ATOM 1032 CB HIS A 69 -2.109 0.877 13.587 1.00 0.00 C ATOM 1033 CG HIS A 69 -3.360 0.971 14.425 1.00 0.00 C ATOM 1034 ND1 HIS A 69 -4.271 2.006 14.299 1.00 0.00 N ATOM 1035 CD2 HIS A 69 -3.844 0.151 15.399 1.00 0.00 C ATOM 1036 CE1 HIS A 69 -5.253 1.807 15.165 1.00 0.00 C ATOM 1037 NE2 HIS A 69 -4.987 0.657 15.847 1.00 0.00 N ATOM 0 H HIS A 69 -1.251 -1.840 12.747 1.00 0.00 H new ATOM 0 HA HIS A 69 -3.219 0.184 11.927 1.00 0.00 H new ATOM 0 HB2 HIS A 69 -1.293 0.512 14.211 1.00 0.00 H new ATOM 0 HB3 HIS A 69 -1.832 1.877 13.252 1.00 0.00 H new ATOM 0 HD2 HIS A 69 -3.377 -0.758 15.748 1.00 0.00 H new ATOM 0 HE1 HIS A 69 -6.114 2.444 15.306 1.00 0.00 H new ATOM 0 HE2 HIS A 69 -5.569 0.252 16.580 1.00 0.00 H new ATOM 1046 N HIS A 70 -1.665 0.564 10.104 1.00 0.00 N ATOM 1047 CA HIS A 70 -0.774 0.855 8.993 1.00 0.00 C ATOM 1048 C HIS A 70 0.444 1.630 9.501 1.00 0.00 C ATOM 1049 O HIS A 70 0.322 2.475 10.386 1.00 0.00 O ATOM 1050 CB HIS A 70 -1.520 1.588 7.877 1.00 0.00 C ATOM 1051 CG HIS A 70 -0.896 1.423 6.510 1.00 0.00 C ATOM 1052 ND1 HIS A 70 -1.190 0.359 5.676 1.00 0.00 N ATOM 1053 CD2 HIS A 70 0.006 2.198 5.843 1.00 0.00 C ATOM 1054 CE1 HIS A 70 -0.489 0.497 4.561 1.00 0.00 C ATOM 1055 NE2 HIS A 70 0.251 1.639 4.666 1.00 0.00 N ATOM 0 H HIS A 70 -2.659 0.629 9.883 1.00 0.00 H new ATOM 0 HA HIS A 70 -0.412 -0.077 8.558 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -2.548 1.226 7.842 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -1.564 2.650 8.120 1.00 0.00 H new ATOM 0 HD1 HIS A 70 -1.836 -0.402 5.884 1.00 0.00 H new ATOM 0 HD2 HIS A 70 0.446 3.113 6.211 1.00 0.00 H new ATOM 0 HE1 HIS A 70 -0.501 -0.176 3.717 1.00 0.00 H new ATOM 1064 N GLY A 71 1.590 1.315 8.918 1.00 0.00 N ATOM 1065 CA GLY A 71 2.830 1.970 9.299 1.00 0.00 C ATOM 1066 C GLY A 71 3.402 1.358 10.579 1.00 0.00 C ATOM 1067 O GLY A 71 4.598 1.079 10.657 1.00 0.00 O ATOM 0 H GLY A 71 1.687 0.614 8.183 1.00 0.00 H new ATOM 0 HA2 GLY A 71 3.557 1.879 8.492 1.00 0.00 H new ATOM 0 HA3 GLY A 71 2.652 3.035 9.449 1.00 0.00 H new ATOM 1071 N ASN A 72 2.522 1.168 11.552 1.00 0.00 N ATOM 1072 CA ASN A 72 2.925 0.593 12.825 1.00 0.00 C ATOM 1073 C ASN A 72 2.054 -0.627 13.128 1.00 0.00 C ATOM 1074 O ASN A 72 1.160 -0.562 13.970 1.00 0.00 O ATOM 1075 CB ASN A 72 2.744 1.598 13.964 1.00 0.00 C ATOM 1076 CG ASN A 72 3.093 0.966 15.313 1.00 0.00 C ATOM 1077 OD1 ASN A 72 2.296 0.278 15.928 1.00 0.00 O ATOM 1078 ND2 ASN A 72 4.324 1.237 15.735 1.00 0.00 N ATOM 0 H ASN A 72 1.532 1.402 11.484 1.00 0.00 H new ATOM 0 HA ASN A 72 3.977 0.315 12.752 1.00 0.00 H new ATOM 0 HB2 ASN A 72 3.378 2.468 13.791 1.00 0.00 H new ATOM 0 HB3 ASN A 72 1.714 1.953 13.980 1.00 0.00 H new ATOM 0 HD21 ASN A 72 4.653 0.861 16.624 1.00 0.00 H new ATOM 0 HD22 ASN A 72 4.940 1.821 15.169 1.00 0.00 H new ATOM 1085 N ALA A 73 2.345 -1.712 12.423 1.00 0.00 N ATOM 1086 CA ALA A 73 1.599 -2.944 12.606 1.00 0.00 C ATOM 1087 C ALA A 73 1.841 -3.477 14.018 1.00 0.00 C ATOM 1088 O ALA A 73 2.985 -3.583 14.458 1.00 0.00 O ATOM 1089 CB ALA A 73 2.002 -3.951 11.527 1.00 0.00 C ATOM 0 H ALA A 73 3.087 -1.762 11.725 1.00 0.00 H new ATOM 0 HA ALA A 73 0.529 -2.763 12.500 1.00 0.00 H new ATOM 0 HB1 ALA A 73 1.442 -4.876 11.665 1.00 0.00 H new ATOM 0 HB2 ALA A 73 1.783 -3.537 10.543 1.00 0.00 H new ATOM 0 HB3 ALA A 73 3.069 -4.159 11.604 1.00 0.00 H new ATOM 1095 N LYS A 74 0.746 -3.799 14.693 1.00 0.00 N ATOM 1096 CA LYS A 74 0.825 -4.316 16.047 1.00 0.00 C ATOM 1097 C LYS A 74 1.615 -5.628 16.041 1.00 0.00 C ATOM 1098 O LYS A 74 1.937 -6.158 14.978 1.00 0.00 O ATOM 1099 CB LYS A 74 -0.574 -4.446 16.654 1.00 0.00 C ATOM 1100 CG LYS A 74 -0.561 -4.085 18.142 1.00 0.00 C ATOM 1101 CD LYS A 74 -1.092 -2.668 18.367 1.00 0.00 C ATOM 1102 CE LYS A 74 -1.576 -2.487 19.807 1.00 0.00 C ATOM 1103 NZ LYS A 74 -0.509 -1.887 20.639 1.00 0.00 N ATOM 0 H LYS A 74 -0.201 -3.711 14.325 1.00 0.00 H new ATOM 0 HA LYS A 74 1.364 -3.619 16.690 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -1.267 -3.793 16.123 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -0.937 -5.466 16.527 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -1.170 -4.798 18.698 1.00 0.00 H new ATOM 0 HG3 LYS A 74 0.455 -4.162 18.530 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -0.308 -1.943 18.149 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -1.911 -2.469 17.676 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -2.460 -1.849 19.823 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -1.871 -3.451 20.222 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -0.853 -1.771 21.614 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 0.324 -2.510 20.638 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -0.247 -0.958 20.251 1.00 0.00 H new ATOM 1117 N ASP A 75 1.906 -6.111 17.240 1.00 0.00 N ATOM 1118 CA ASP A 75 2.653 -7.349 17.386 1.00 0.00 C ATOM 1119 C ASP A 75 1.779 -8.522 16.939 1.00 0.00 C ATOM 1120 O ASP A 75 2.226 -9.669 16.937 1.00 0.00 O ATOM 1121 CB ASP A 75 3.049 -7.585 18.844 1.00 0.00 C ATOM 1122 CG ASP A 75 4.324 -6.867 19.293 1.00 0.00 C ATOM 1123 OD1 ASP A 75 4.523 -5.721 18.832 1.00 0.00 O ATOM 1124 OD2 ASP A 75 5.072 -7.479 20.084 1.00 0.00 O ATOM 0 H ASP A 75 1.638 -5.668 18.119 1.00 0.00 H new ATOM 0 HA ASP A 75 3.553 -7.274 16.775 1.00 0.00 H new ATOM 0 HB2 ASP A 75 2.226 -7.267 19.484 1.00 0.00 H new ATOM 0 HB3 ASP A 75 3.179 -8.656 19.001 1.00 0.00 H new ATOM 1129 N PHE A 76 0.550 -8.196 16.569 1.00 0.00 N ATOM 1130 CA PHE A 76 -0.391 -9.209 16.120 1.00 0.00 C ATOM 1131 C PHE A 76 -0.274 -9.436 14.612 1.00 0.00 C ATOM 1132 O PHE A 76 -0.235 -10.577 14.153 1.00 0.00 O ATOM 1133 CB PHE A 76 -1.793 -8.690 16.440 1.00 0.00 C ATOM 1134 CG PHE A 76 -2.219 -8.897 17.894 1.00 0.00 C ATOM 1135 CD1 PHE A 76 -1.660 -8.143 18.879 1.00 0.00 C ATOM 1136 CD2 PHE A 76 -3.154 -9.834 18.203 1.00 0.00 C ATOM 1137 CE1 PHE A 76 -2.055 -8.335 20.229 1.00 0.00 C ATOM 1138 CE2 PHE A 76 -3.548 -10.027 19.553 1.00 0.00 C ATOM 1139 CZ PHE A 76 -2.990 -9.274 20.538 1.00 0.00 C ATOM 0 H PHE A 76 0.183 -7.244 16.571 1.00 0.00 H new ATOM 0 HA PHE A 76 -0.185 -10.156 16.619 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -1.836 -7.626 16.208 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -2.511 -9.188 15.788 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -0.916 -7.399 18.634 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -3.597 -10.432 17.421 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -1.613 -7.735 21.011 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -4.291 -10.772 19.798 1.00 0.00 H new ATOM 0 HZ PHE A 76 -3.289 -9.421 21.565 1.00 0.00 H new ATOM 1149 N ALA A 77 -0.223 -8.331 13.882 1.00 0.00 N ATOM 1150 CA ALA A 77 -0.111 -8.395 12.434 1.00 0.00 C ATOM 1151 C ALA A 77 1.214 -9.062 12.058 1.00 0.00 C ATOM 1152 O ALA A 77 1.227 -10.083 11.372 1.00 0.00 O ATOM 1153 CB ALA A 77 -0.242 -6.987 11.850 1.00 0.00 C ATOM 0 H ALA A 77 -0.257 -7.387 14.266 1.00 0.00 H new ATOM 0 HA ALA A 77 -0.915 -8.999 12.013 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -0.158 -7.034 10.764 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -1.212 -6.569 12.121 1.00 0.00 H new ATOM 0 HB3 ALA A 77 0.550 -6.353 12.248 1.00 0.00 H new ATOM 1159 N MET A 78 2.297 -8.458 12.523 1.00 0.00 N ATOM 1160 CA MET A 78 3.625 -8.979 12.244 1.00 0.00 C ATOM 1161 C MET A 78 3.943 -10.175 13.143 1.00 0.00 C ATOM 1162 O MET A 78 5.060 -10.299 13.644 1.00 0.00 O ATOM 1163 CB MET A 78 4.664 -7.879 12.469 1.00 0.00 C ATOM 1164 CG MET A 78 4.563 -7.310 13.885 1.00 0.00 C ATOM 1165 SD MET A 78 5.868 -7.974 14.905 1.00 0.00 S ATOM 1166 CE MET A 78 4.908 -9.013 15.998 1.00 0.00 C ATOM 0 H MET A 78 2.282 -7.612 13.092 1.00 0.00 H new ATOM 0 HA MET A 78 3.655 -9.310 11.206 1.00 0.00 H new ATOM 0 HB2 MET A 78 5.664 -8.280 12.305 1.00 0.00 H new ATOM 0 HB3 MET A 78 4.517 -7.081 11.741 1.00 0.00 H new ATOM 0 HG2 MET A 78 4.632 -6.223 13.854 1.00 0.00 H new ATOM 0 HG3 MET A 78 3.593 -7.556 14.316 1.00 0.00 H new ATOM 0 HE1 MET A 78 4.962 -8.621 17.014 1.00 0.00 H new ATOM 0 HE2 MET A 78 3.869 -9.025 15.669 1.00 0.00 H new ATOM 0 HE3 MET A 78 5.306 -10.027 15.979 1.00 0.00 H new ATOM 1176 N LYS A 79 2.943 -11.025 13.321 1.00 0.00 N ATOM 1177 CA LYS A 79 3.102 -12.206 14.151 1.00 0.00 C ATOM 1178 C LYS A 79 2.127 -13.289 13.685 1.00 0.00 C ATOM 1179 O LYS A 79 2.531 -14.417 13.407 1.00 0.00 O ATOM 1180 CB LYS A 79 2.959 -11.845 15.631 1.00 0.00 C ATOM 1181 CG LYS A 79 3.331 -13.031 16.523 1.00 0.00 C ATOM 1182 CD LYS A 79 4.723 -12.846 17.128 1.00 0.00 C ATOM 1183 CE LYS A 79 5.163 -14.101 17.888 1.00 0.00 C ATOM 1184 NZ LYS A 79 6.597 -14.018 18.239 1.00 0.00 N ATOM 0 H LYS A 79 2.018 -10.919 12.904 1.00 0.00 H new ATOM 0 HA LYS A 79 4.107 -12.614 14.042 1.00 0.00 H new ATOM 0 HB2 LYS A 79 3.599 -10.994 15.865 1.00 0.00 H new ATOM 0 HB3 LYS A 79 1.934 -11.538 15.837 1.00 0.00 H new ATOM 0 HG2 LYS A 79 2.595 -13.136 17.320 1.00 0.00 H new ATOM 0 HG3 LYS A 79 3.303 -13.952 15.940 1.00 0.00 H new ATOM 0 HD2 LYS A 79 5.440 -12.625 16.338 1.00 0.00 H new ATOM 0 HD3 LYS A 79 4.719 -11.990 17.803 1.00 0.00 H new ATOM 0 HE2 LYS A 79 4.567 -14.213 18.794 1.00 0.00 H new ATOM 0 HE3 LYS A 79 4.983 -14.985 17.277 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 6.879 -14.877 18.754 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 7.163 -13.934 17.370 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 6.760 -13.185 18.840 1.00 0.00 H new ATOM 1198 N HIS A 80 0.860 -12.906 13.613 1.00 0.00 N ATOM 1199 CA HIS A 80 -0.177 -13.830 13.184 1.00 0.00 C ATOM 1200 C HIS A 80 0.013 -14.165 11.703 1.00 0.00 C ATOM 1201 O HIS A 80 -0.692 -15.012 11.160 1.00 0.00 O ATOM 1202 CB HIS A 80 -1.566 -13.268 13.491 1.00 0.00 C ATOM 1203 CG HIS A 80 -2.122 -12.379 12.405 1.00 0.00 C ATOM 1204 ND1 HIS A 80 -1.336 -11.511 11.669 1.00 0.00 N ATOM 1205 CD2 HIS A 80 -3.397 -12.235 11.937 1.00 0.00 C ATOM 1206 CE1 HIS A 80 -2.110 -10.877 10.801 1.00 0.00 C ATOM 1207 NE2 HIS A 80 -3.387 -11.327 10.969 1.00 0.00 N ATOM 0 H HIS A 80 0.528 -11.970 13.844 1.00 0.00 H new ATOM 0 HA HIS A 80 -0.093 -14.761 13.744 1.00 0.00 H new ATOM 0 HB2 HIS A 80 -2.254 -14.097 13.655 1.00 0.00 H new ATOM 0 HB3 HIS A 80 -1.520 -12.702 14.422 1.00 0.00 H new ATOM 0 HD1 HIS A 80 -0.330 -11.381 11.776 1.00 0.00 H new ATOM 0 HD2 HIS A 80 -4.265 -12.769 12.294 1.00 0.00 H new ATOM 0 HE1 HIS A 80 -1.787 -10.135 10.086 1.00 0.00 H new ATOM 1216 N GLY A 81 0.970 -13.481 11.093 1.00 0.00 N ATOM 1217 CA GLY A 81 1.262 -13.695 9.687 1.00 0.00 C ATOM 1218 C GLY A 81 2.669 -13.205 9.337 1.00 0.00 C ATOM 1219 O GLY A 81 2.894 -12.677 8.249 1.00 0.00 O ATOM 0 H GLY A 81 1.553 -12.778 11.548 1.00 0.00 H new ATOM 0 HA2 GLY A 81 1.173 -14.755 9.451 1.00 0.00 H new ATOM 0 HA3 GLY A 81 0.528 -13.170 9.076 1.00 0.00 H new ATOM 1223 N ALA A 82 3.579 -13.399 10.282 1.00 0.00 N ATOM 1224 CA ALA A 82 4.957 -12.984 10.088 1.00 0.00 C ATOM 1225 C ALA A 82 5.889 -14.141 10.452 1.00 0.00 C ATOM 1226 O ALA A 82 5.753 -14.743 11.516 1.00 0.00 O ATOM 1227 CB ALA A 82 5.234 -11.729 10.918 1.00 0.00 C ATOM 0 H ALA A 82 3.388 -13.838 11.183 1.00 0.00 H new ATOM 0 HA ALA A 82 5.138 -12.730 9.043 1.00 0.00 H new ATOM 0 HB1 ALA A 82 6.268 -11.417 10.772 1.00 0.00 H new ATOM 0 HB2 ALA A 82 4.566 -10.928 10.601 1.00 0.00 H new ATOM 0 HB3 ALA A 82 5.065 -11.946 11.973 1.00 0.00 H new ATOM 1233 N ASP A 83 6.817 -14.419 9.546 1.00 0.00 N ATOM 1234 CA ASP A 83 7.771 -15.493 9.758 1.00 0.00 C ATOM 1235 C ASP A 83 8.743 -15.096 10.870 1.00 0.00 C ATOM 1236 O ASP A 83 9.163 -13.942 10.949 1.00 0.00 O ATOM 1237 CB ASP A 83 8.587 -15.763 8.493 1.00 0.00 C ATOM 1238 CG ASP A 83 7.763 -15.929 7.215 1.00 0.00 C ATOM 1239 OD1 ASP A 83 7.318 -17.071 6.971 1.00 0.00 O ATOM 1240 OD2 ASP A 83 7.596 -14.909 6.511 1.00 0.00 O ATOM 0 H ASP A 83 6.927 -13.918 8.664 1.00 0.00 H new ATOM 0 HA ASP A 83 7.213 -16.390 10.026 1.00 0.00 H new ATOM 0 HB2 ASP A 83 9.290 -14.942 8.350 1.00 0.00 H new ATOM 0 HB3 ASP A 83 9.178 -16.666 8.646 1.00 0.00 H new ATOM 1245 N GLU A 84 9.071 -16.072 11.705 1.00 0.00 N ATOM 1246 CA GLU A 84 9.986 -15.837 12.809 1.00 0.00 C ATOM 1247 C GLU A 84 11.191 -15.024 12.336 1.00 0.00 C ATOM 1248 O GLU A 84 11.739 -14.222 13.091 1.00 0.00 O ATOM 1249 CB GLU A 84 10.429 -17.157 13.443 1.00 0.00 C ATOM 1250 CG GLU A 84 10.329 -17.093 14.968 1.00 0.00 C ATOM 1251 CD GLU A 84 10.430 -18.490 15.583 1.00 0.00 C ATOM 1252 OE1 GLU A 84 11.224 -19.292 15.045 1.00 0.00 O ATOM 1253 OE2 GLU A 84 9.711 -18.727 16.577 1.00 0.00 O ATOM 0 H GLU A 84 8.719 -17.027 11.639 1.00 0.00 H new ATOM 0 HA GLU A 84 9.463 -15.262 13.573 1.00 0.00 H new ATOM 0 HB2 GLU A 84 9.809 -17.971 13.068 1.00 0.00 H new ATOM 0 HB3 GLU A 84 11.456 -17.378 13.151 1.00 0.00 H new ATOM 0 HG2 GLU A 84 11.124 -16.460 15.362 1.00 0.00 H new ATOM 0 HG3 GLU A 84 9.384 -16.633 15.255 1.00 0.00 H new ATOM 1260 N THR A 85 11.570 -15.257 11.088 1.00 0.00 N ATOM 1261 CA THR A 85 12.702 -14.554 10.506 1.00 0.00 C ATOM 1262 C THR A 85 12.299 -13.135 10.102 1.00 0.00 C ATOM 1263 O THR A 85 13.033 -12.182 10.358 1.00 0.00 O ATOM 1264 CB THR A 85 13.227 -15.393 9.338 1.00 0.00 C ATOM 1265 OG1 THR A 85 14.429 -14.732 8.951 1.00 0.00 O ATOM 1266 CG2 THR A 85 12.334 -15.297 8.101 1.00 0.00 C ATOM 0 H THR A 85 11.114 -15.922 10.464 1.00 0.00 H new ATOM 0 HA THR A 85 13.509 -14.434 11.229 1.00 0.00 H new ATOM 0 HB THR A 85 13.308 -16.435 9.646 1.00 0.00 H new ATOM 0 HG1 THR A 85 14.838 -15.210 8.199 1.00 0.00 H new ATOM 0 HG21 THR A 85 12.751 -15.910 7.302 1.00 0.00 H new ATOM 0 HG22 THR A 85 11.333 -15.653 8.346 1.00 0.00 H new ATOM 0 HG23 THR A 85 12.280 -14.260 7.771 1.00 0.00 H new ATOM 1274 N MET A 86 11.133 -13.040 9.478 1.00 0.00 N ATOM 1275 CA MET A 86 10.624 -11.753 9.036 1.00 0.00 C ATOM 1276 C MET A 86 10.523 -10.773 10.206 1.00 0.00 C ATOM 1277 O MET A 86 10.584 -9.560 10.011 1.00 0.00 O ATOM 1278 CB MET A 86 9.242 -11.940 8.406 1.00 0.00 C ATOM 1279 CG MET A 86 8.136 -11.542 9.384 1.00 0.00 C ATOM 1280 SD MET A 86 7.880 -9.776 9.331 1.00 0.00 S ATOM 1281 CE MET A 86 6.294 -9.716 8.514 1.00 0.00 C ATOM 0 H MET A 86 10.527 -13.833 9.268 1.00 0.00 H new ATOM 0 HA MET A 86 11.316 -11.342 8.301 1.00 0.00 H new ATOM 0 HB2 MET A 86 9.166 -11.337 7.501 1.00 0.00 H new ATOM 0 HB3 MET A 86 9.112 -12.980 8.108 1.00 0.00 H new ATOM 0 HG2 MET A 86 7.211 -12.060 9.130 1.00 0.00 H new ATOM 0 HG3 MET A 86 8.405 -11.848 10.395 1.00 0.00 H new ATOM 0 HE1 MET A 86 5.917 -8.693 8.526 1.00 0.00 H new ATOM 0 HE2 MET A 86 6.403 -10.050 7.482 1.00 0.00 H new ATOM 0 HE3 MET A 86 5.592 -10.368 9.034 1.00 0.00 H new ATOM 1291 N ALA A 87 10.369 -11.335 11.397 1.00 0.00 N ATOM 1292 CA ALA A 87 10.259 -10.526 12.598 1.00 0.00 C ATOM 1293 C ALA A 87 11.565 -9.756 12.810 1.00 0.00 C ATOM 1294 O ALA A 87 11.545 -8.545 13.035 1.00 0.00 O ATOM 1295 CB ALA A 87 9.912 -11.422 13.788 1.00 0.00 C ATOM 0 H ALA A 87 10.318 -12.341 11.555 1.00 0.00 H new ATOM 0 HA ALA A 87 9.457 -9.795 12.496 1.00 0.00 H new ATOM 0 HB1 ALA A 87 9.830 -10.814 14.689 1.00 0.00 H new ATOM 0 HB2 ALA A 87 8.963 -11.924 13.601 1.00 0.00 H new ATOM 0 HB3 ALA A 87 10.696 -12.167 13.923 1.00 0.00 H new ATOM 1301 N GLN A 88 12.666 -10.487 12.730 1.00 0.00 N ATOM 1302 CA GLN A 88 13.977 -9.888 12.911 1.00 0.00 C ATOM 1303 C GLN A 88 14.489 -9.320 11.585 1.00 0.00 C ATOM 1304 O GLN A 88 14.965 -8.187 11.533 1.00 0.00 O ATOM 1305 CB GLN A 88 14.967 -10.898 13.493 1.00 0.00 C ATOM 1306 CG GLN A 88 16.410 -10.425 13.302 1.00 0.00 C ATOM 1307 CD GLN A 88 17.088 -11.179 12.156 1.00 0.00 C ATOM 1308 OE1 GLN A 88 17.529 -12.308 12.296 1.00 0.00 O ATOM 1309 NE2 GLN A 88 17.143 -10.493 11.017 1.00 0.00 N ATOM 0 H GLN A 88 12.678 -11.489 12.542 1.00 0.00 H new ATOM 0 HA GLN A 88 13.884 -9.069 13.624 1.00 0.00 H new ATOM 0 HB2 GLN A 88 14.765 -11.040 14.555 1.00 0.00 H new ATOM 0 HB3 GLN A 88 14.831 -11.866 13.010 1.00 0.00 H new ATOM 0 HG2 GLN A 88 16.421 -9.355 13.095 1.00 0.00 H new ATOM 0 HG3 GLN A 88 16.971 -10.577 14.224 1.00 0.00 H new ATOM 0 HE21 GLN A 88 16.754 -9.551 10.970 1.00 0.00 H new ATOM 0 HE22 GLN A 88 17.574 -10.909 10.191 1.00 0.00 H new ATOM 1318 N GLN A 89 14.373 -10.134 10.546 1.00 0.00 N ATOM 1319 CA GLN A 89 14.817 -9.727 9.223 1.00 0.00 C ATOM 1320 C GLN A 89 14.394 -8.283 8.942 1.00 0.00 C ATOM 1321 O GLN A 89 15.230 -7.438 8.627 1.00 0.00 O ATOM 1322 CB GLN A 89 14.280 -10.675 8.149 1.00 0.00 C ATOM 1323 CG GLN A 89 15.030 -12.008 8.170 1.00 0.00 C ATOM 1324 CD GLN A 89 16.535 -11.791 8.000 1.00 0.00 C ATOM 1325 OE1 GLN A 89 17.316 -11.925 8.929 1.00 0.00 O ATOM 1326 NE2 GLN A 89 16.898 -11.453 6.766 1.00 0.00 N ATOM 0 H GLN A 89 13.978 -11.073 10.593 1.00 0.00 H new ATOM 0 HA GLN A 89 15.905 -9.778 9.194 1.00 0.00 H new ATOM 0 HB2 GLN A 89 13.216 -10.849 8.312 1.00 0.00 H new ATOM 0 HB3 GLN A 89 14.381 -10.212 7.167 1.00 0.00 H new ATOM 0 HG2 GLN A 89 14.837 -12.524 9.111 1.00 0.00 H new ATOM 0 HG3 GLN A 89 14.659 -12.651 7.372 1.00 0.00 H new ATOM 0 HE21 GLN A 89 16.193 -11.358 6.035 1.00 0.00 H new ATOM 0 HE22 GLN A 89 17.881 -11.289 6.551 1.00 0.00 H new ATOM 1335 N LEU A 90 13.097 -8.046 9.066 1.00 0.00 N ATOM 1336 CA LEU A 90 12.553 -6.718 8.830 1.00 0.00 C ATOM 1337 C LEU A 90 13.415 -5.682 9.552 1.00 0.00 C ATOM 1338 O LEU A 90 13.787 -4.664 8.971 1.00 0.00 O ATOM 1339 CB LEU A 90 11.074 -6.668 9.220 1.00 0.00 C ATOM 1340 CG LEU A 90 10.073 -6.901 8.086 1.00 0.00 C ATOM 1341 CD1 LEU A 90 10.350 -8.227 7.374 1.00 0.00 C ATOM 1342 CD2 LEU A 90 8.635 -6.816 8.599 1.00 0.00 C ATOM 0 H LEU A 90 12.406 -8.750 9.327 1.00 0.00 H new ATOM 0 HA LEU A 90 12.587 -6.476 7.768 1.00 0.00 H new ATOM 0 HB2 LEU A 90 10.897 -7.415 9.993 1.00 0.00 H new ATOM 0 HB3 LEU A 90 10.869 -5.694 9.665 1.00 0.00 H new ATOM 0 HG LEU A 90 10.200 -6.107 7.350 1.00 0.00 H new ATOM 0 HD11 LEU A 90 9.625 -8.368 6.573 1.00 0.00 H new ATOM 0 HD12 LEU A 90 11.356 -8.211 6.954 1.00 0.00 H new ATOM 0 HD13 LEU A 90 10.267 -9.047 8.087 1.00 0.00 H new ATOM 0 HD21 LEU A 90 7.944 -6.985 7.774 1.00 0.00 H new ATOM 0 HD22 LEU A 90 8.477 -7.574 9.366 1.00 0.00 H new ATOM 0 HD23 LEU A 90 8.458 -5.828 9.024 1.00 0.00 H new ATOM 1354 N VAL A 91 13.709 -5.978 10.811 1.00 0.00 N ATOM 1355 CA VAL A 91 14.520 -5.084 11.618 1.00 0.00 C ATOM 1356 C VAL A 91 15.832 -4.791 10.888 1.00 0.00 C ATOM 1357 O VAL A 91 16.547 -3.852 11.236 1.00 0.00 O ATOM 1358 CB VAL A 91 14.733 -5.683 13.010 1.00 0.00 C ATOM 1359 CG1 VAL A 91 15.234 -4.625 13.994 1.00 0.00 C ATOM 1360 CG2 VAL A 91 13.451 -6.345 13.522 1.00 0.00 C ATOM 0 H VAL A 91 13.400 -6.824 11.290 1.00 0.00 H new ATOM 0 HA VAL A 91 14.009 -4.132 11.762 1.00 0.00 H new ATOM 0 HB VAL A 91 15.500 -6.453 12.929 1.00 0.00 H new ATOM 0 HG11 VAL A 91 15.377 -5.079 14.975 1.00 0.00 H new ATOM 0 HG12 VAL A 91 16.182 -4.219 13.641 1.00 0.00 H new ATOM 0 HG13 VAL A 91 14.501 -3.822 14.069 1.00 0.00 H new ATOM 0 HG21 VAL A 91 13.628 -6.763 14.513 1.00 0.00 H new ATOM 0 HG22 VAL A 91 12.655 -5.602 13.579 1.00 0.00 H new ATOM 0 HG23 VAL A 91 13.155 -7.142 12.840 1.00 0.00 H new ATOM 1370 N ASP A 92 16.111 -5.614 9.887 1.00 0.00 N ATOM 1371 CA ASP A 92 17.324 -5.456 9.103 1.00 0.00 C ATOM 1372 C ASP A 92 17.135 -4.315 8.103 1.00 0.00 C ATOM 1373 O ASP A 92 17.731 -3.249 8.252 1.00 0.00 O ATOM 1374 CB ASP A 92 17.641 -6.729 8.315 1.00 0.00 C ATOM 1375 CG ASP A 92 17.649 -8.016 9.142 1.00 0.00 C ATOM 1376 OD1 ASP A 92 17.021 -8.002 10.221 1.00 0.00 O ATOM 1377 OD2 ASP A 92 18.282 -8.987 8.674 1.00 0.00 O ATOM 0 H ASP A 92 15.517 -6.393 9.601 1.00 0.00 H new ATOM 0 HA ASP A 92 18.144 -5.244 9.790 1.00 0.00 H new ATOM 0 HB2 ASP A 92 16.909 -6.834 7.514 1.00 0.00 H new ATOM 0 HB3 ASP A 92 18.616 -6.612 7.842 1.00 0.00 H new ATOM 1382 N ILE A 93 16.305 -4.577 7.105 1.00 0.00 N ATOM 1383 CA ILE A 93 16.029 -3.585 6.080 1.00 0.00 C ATOM 1384 C ILE A 93 15.285 -2.403 6.706 1.00 0.00 C ATOM 1385 O ILE A 93 15.638 -1.248 6.473 1.00 0.00 O ATOM 1386 CB ILE A 93 15.291 -4.222 4.901 1.00 0.00 C ATOM 1387 CG1 ILE A 93 13.775 -4.142 5.096 1.00 0.00 C ATOM 1388 CG2 ILE A 93 15.763 -5.658 4.670 1.00 0.00 C ATOM 1389 CD1 ILE A 93 13.288 -5.228 6.056 1.00 0.00 C ATOM 0 H ILE A 93 15.814 -5.463 6.984 1.00 0.00 H new ATOM 0 HA ILE A 93 16.960 -3.194 5.669 1.00 0.00 H new ATOM 0 HB ILE A 93 15.531 -3.655 4.001 1.00 0.00 H new ATOM 0 HG12 ILE A 93 13.506 -3.160 5.485 1.00 0.00 H new ATOM 0 HG13 ILE A 93 13.275 -4.251 4.134 1.00 0.00 H new ATOM 0 HG21 ILE A 93 15.223 -6.087 3.826 1.00 0.00 H new ATOM 0 HG22 ILE A 93 16.832 -5.660 4.455 1.00 0.00 H new ATOM 0 HG23 ILE A 93 15.572 -6.252 5.564 1.00 0.00 H new ATOM 0 HD11 ILE A 93 12.208 -5.149 6.177 1.00 0.00 H new ATOM 0 HD12 ILE A 93 13.537 -6.209 5.652 1.00 0.00 H new ATOM 0 HD13 ILE A 93 13.772 -5.101 7.024 1.00 0.00 H new ATOM 1401 N ILE A 94 14.267 -2.735 7.488 1.00 0.00 N ATOM 1402 CA ILE A 94 13.470 -1.715 8.150 1.00 0.00 C ATOM 1403 C ILE A 94 14.396 -0.762 8.908 1.00 0.00 C ATOM 1404 O ILE A 94 14.035 0.386 9.165 1.00 0.00 O ATOM 1405 CB ILE A 94 12.398 -2.362 9.030 1.00 0.00 C ATOM 1406 CG1 ILE A 94 11.519 -3.313 8.214 1.00 0.00 C ATOM 1407 CG2 ILE A 94 11.572 -1.298 9.757 1.00 0.00 C ATOM 1408 CD1 ILE A 94 10.036 -2.989 8.408 1.00 0.00 C ATOM 0 H ILE A 94 13.976 -3.694 7.678 1.00 0.00 H new ATOM 0 HA ILE A 94 12.930 -1.117 7.416 1.00 0.00 H new ATOM 0 HB ILE A 94 12.896 -2.960 9.793 1.00 0.00 H new ATOM 0 HG12 ILE A 94 11.777 -3.236 7.158 1.00 0.00 H new ATOM 0 HG13 ILE A 94 11.713 -4.342 8.516 1.00 0.00 H new ATOM 0 HG21 ILE A 94 10.817 -1.783 10.376 1.00 0.00 H new ATOM 0 HG22 ILE A 94 12.227 -0.697 10.388 1.00 0.00 H new ATOM 0 HG23 ILE A 94 11.083 -0.655 9.026 1.00 0.00 H new ATOM 0 HD11 ILE A 94 9.433 -3.679 7.818 1.00 0.00 H new ATOM 0 HD12 ILE A 94 9.776 -3.090 9.462 1.00 0.00 H new ATOM 0 HD13 ILE A 94 9.841 -1.967 8.083 1.00 0.00 H new ATOM 1420 N HIS A 95 15.572 -1.272 9.244 1.00 0.00 N ATOM 1421 CA HIS A 95 16.551 -0.480 9.968 1.00 0.00 C ATOM 1422 C HIS A 95 17.209 0.519 9.014 1.00 0.00 C ATOM 1423 O HIS A 95 17.596 1.612 9.424 1.00 0.00 O ATOM 1424 CB HIS A 95 17.566 -1.383 10.673 1.00 0.00 C ATOM 1425 CG HIS A 95 17.307 -1.562 12.149 1.00 0.00 C ATOM 1426 ND1 HIS A 95 18.315 -1.540 13.095 1.00 0.00 N ATOM 1427 CD2 HIS A 95 16.143 -1.766 12.831 1.00 0.00 C ATOM 1428 CE1 HIS A 95 17.774 -1.725 14.291 1.00 0.00 C ATOM 1429 NE2 HIS A 95 16.427 -1.865 14.124 1.00 0.00 N ATOM 0 H HIS A 95 15.869 -2.224 9.028 1.00 0.00 H new ATOM 0 HA HIS A 95 16.054 0.092 10.752 1.00 0.00 H new ATOM 0 HB2 HIS A 95 17.562 -2.361 10.193 1.00 0.00 H new ATOM 0 HB3 HIS A 95 18.564 -0.966 10.538 1.00 0.00 H new ATOM 0 HD2 HIS A 95 15.158 -1.835 12.393 1.00 0.00 H new ATOM 0 HE1 HIS A 95 18.305 -1.759 15.231 1.00 0.00 H new ATOM 0 HE2 HIS A 95 15.749 -2.020 14.870 1.00 0.00 H new ATOM 1438 N GLY A 96 17.314 0.108 7.758 1.00 0.00 N ATOM 1439 CA GLY A 96 17.917 0.954 6.742 1.00 0.00 C ATOM 1440 C GLY A 96 16.870 1.858 6.088 1.00 0.00 C ATOM 1441 O GLY A 96 17.204 2.910 5.546 1.00 0.00 O ATOM 0 H GLY A 96 16.992 -0.799 7.421 1.00 0.00 H new ATOM 0 HA2 GLY A 96 18.701 1.565 7.191 1.00 0.00 H new ATOM 0 HA3 GLY A 96 18.392 0.333 5.982 1.00 0.00 H new ATOM 1445 N CYS A 97 15.625 1.414 6.159 1.00 0.00 N ATOM 1446 CA CYS A 97 14.526 2.169 5.579 1.00 0.00 C ATOM 1447 C CYS A 97 14.001 3.140 6.638 1.00 0.00 C ATOM 1448 O CYS A 97 14.082 4.356 6.464 1.00 0.00 O ATOM 1449 CB CYS A 97 13.423 1.249 5.053 1.00 0.00 C ATOM 1450 SG CYS A 97 13.347 1.107 3.229 1.00 0.00 S ATOM 0 H CYS A 97 15.351 0.541 6.609 1.00 0.00 H new ATOM 0 HA CYS A 97 14.882 2.731 4.715 1.00 0.00 H new ATOM 0 HB2 CYS A 97 13.567 0.254 5.475 1.00 0.00 H new ATOM 0 HB3 CYS A 97 12.462 1.613 5.415 1.00 0.00 H new ATOM 1455 N GLU A 98 13.474 2.570 7.711 1.00 0.00 N ATOM 1456 CA GLU A 98 12.936 3.370 8.796 1.00 0.00 C ATOM 1457 C GLU A 98 13.897 4.509 9.144 1.00 0.00 C ATOM 1458 O GLU A 98 13.467 5.593 9.535 1.00 0.00 O ATOM 1459 CB GLU A 98 12.644 2.506 10.025 1.00 0.00 C ATOM 1460 CG GLU A 98 11.637 3.189 10.952 1.00 0.00 C ATOM 1461 CD GLU A 98 10.700 2.164 11.593 1.00 0.00 C ATOM 1462 OE1 GLU A 98 11.232 1.247 12.256 1.00 0.00 O ATOM 1463 OE2 GLU A 98 9.473 2.321 11.408 1.00 0.00 O ATOM 0 H GLU A 98 13.408 1.562 7.852 1.00 0.00 H new ATOM 0 HA GLU A 98 11.992 3.804 8.466 1.00 0.00 H new ATOM 0 HB2 GLU A 98 12.254 1.539 9.709 1.00 0.00 H new ATOM 0 HB3 GLU A 98 13.570 2.314 10.567 1.00 0.00 H new ATOM 0 HG2 GLU A 98 12.168 3.738 11.730 1.00 0.00 H new ATOM 0 HG3 GLU A 98 11.054 3.917 10.388 1.00 0.00 H new ATOM 1470 N LYS A 99 15.182 4.224 8.989 1.00 0.00 N ATOM 1471 CA LYS A 99 16.209 5.210 9.281 1.00 0.00 C ATOM 1472 C LYS A 99 16.226 6.265 8.173 1.00 0.00 C ATOM 1473 O LYS A 99 16.539 7.428 8.422 1.00 0.00 O ATOM 1474 CB LYS A 99 17.560 4.527 9.503 1.00 0.00 C ATOM 1475 CG LYS A 99 18.176 4.086 8.174 1.00 0.00 C ATOM 1476 CD LYS A 99 19.695 3.955 8.290 1.00 0.00 C ATOM 1477 CE LYS A 99 20.349 3.899 6.909 1.00 0.00 C ATOM 1478 NZ LYS A 99 21.681 4.543 6.939 1.00 0.00 N ATOM 0 H LYS A 99 15.535 3.324 8.665 1.00 0.00 H new ATOM 0 HA LYS A 99 15.985 5.730 10.213 1.00 0.00 H new ATOM 0 HB2 LYS A 99 18.238 5.211 10.013 1.00 0.00 H new ATOM 0 HB3 LYS A 99 17.432 3.662 10.153 1.00 0.00 H new ATOM 0 HG2 LYS A 99 17.747 3.131 7.870 1.00 0.00 H new ATOM 0 HG3 LYS A 99 17.928 4.809 7.397 1.00 0.00 H new ATOM 0 HD2 LYS A 99 20.094 4.800 8.851 1.00 0.00 H new ATOM 0 HD3 LYS A 99 19.944 3.054 8.851 1.00 0.00 H new ATOM 0 HE2 LYS A 99 20.447 2.862 6.589 1.00 0.00 H new ATOM 0 HE3 LYS A 99 19.713 4.399 6.179 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 22.111 4.496 5.993 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 21.579 5.538 7.224 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 22.291 4.048 7.621 1.00 0.00 H new ATOM 1492 N SER A 100 15.887 5.820 6.971 1.00 0.00 N ATOM 1493 CA SER A 100 15.861 6.712 5.825 1.00 0.00 C ATOM 1494 C SER A 100 14.441 7.237 5.603 1.00 0.00 C ATOM 1495 O SER A 100 14.226 8.130 4.785 1.00 0.00 O ATOM 1496 CB SER A 100 16.369 6.004 4.566 1.00 0.00 C ATOM 1497 OG SER A 100 17.479 6.681 3.985 1.00 0.00 O ATOM 0 H SER A 100 15.629 4.855 6.767 1.00 0.00 H new ATOM 0 HA SER A 100 16.524 7.553 6.029 1.00 0.00 H new ATOM 0 HB2 SER A 100 16.657 4.983 4.816 1.00 0.00 H new ATOM 0 HB3 SER A 100 15.562 5.938 3.836 1.00 0.00 H new ATOM 0 HG SER A 100 17.775 6.198 3.186 1.00 0.00 H new ATOM 1503 N ALA A 101 13.507 6.659 6.345 1.00 0.00 N ATOM 1504 CA ALA A 101 12.114 7.057 6.240 1.00 0.00 C ATOM 1505 C ALA A 101 11.647 7.625 7.581 1.00 0.00 C ATOM 1506 O ALA A 101 10.994 6.932 8.359 1.00 0.00 O ATOM 1507 CB ALA A 101 11.274 5.861 5.789 1.00 0.00 C ATOM 0 H ALA A 101 13.689 5.918 7.022 1.00 0.00 H new ATOM 0 HA ALA A 101 11.994 7.840 5.491 1.00 0.00 H new ATOM 0 HB1 ALA A 101 10.229 6.160 5.710 1.00 0.00 H new ATOM 0 HB2 ALA A 101 11.627 5.514 4.818 1.00 0.00 H new ATOM 0 HB3 ALA A 101 11.367 5.055 6.517 1.00 0.00 H new ATOM 1513 N PRO A 102 12.011 8.915 7.817 1.00 0.00 N ATOM 1514 CA PRO A 102 11.637 9.584 9.051 1.00 0.00 C ATOM 1515 C PRO A 102 10.155 9.967 9.040 1.00 0.00 C ATOM 1516 O PRO A 102 9.480 9.817 8.023 1.00 0.00 O ATOM 1517 CB PRO A 102 12.561 10.787 9.142 1.00 0.00 C ATOM 1518 CG PRO A 102 13.097 11.008 7.737 1.00 0.00 C ATOM 1519 CD PRO A 102 12.785 9.766 6.918 1.00 0.00 C ATOM 0 HA PRO A 102 11.750 8.945 9.927 1.00 0.00 H new ATOM 0 HB2 PRO A 102 12.024 11.666 9.498 1.00 0.00 H new ATOM 0 HB3 PRO A 102 13.373 10.603 9.845 1.00 0.00 H new ATOM 0 HG2 PRO A 102 12.637 11.888 7.287 1.00 0.00 H new ATOM 0 HG3 PRO A 102 14.172 11.188 7.762 1.00 0.00 H new ATOM 0 HD2 PRO A 102 12.217 10.015 6.022 1.00 0.00 H new ATOM 0 HD3 PRO A 102 13.698 9.269 6.589 1.00 0.00 H new ATOM 1527 N PRO A 103 9.682 10.468 10.212 1.00 0.00 N ATOM 1528 CA PRO A 103 8.293 10.874 10.347 1.00 0.00 C ATOM 1529 C PRO A 103 8.041 12.205 9.637 1.00 0.00 C ATOM 1530 O PRO A 103 7.357 13.078 10.171 1.00 0.00 O ATOM 1531 CB PRO A 103 8.046 10.943 11.845 1.00 0.00 C ATOM 1532 CG PRO A 103 9.421 11.028 12.490 1.00 0.00 C ATOM 1533 CD PRO A 103 10.454 10.659 11.437 1.00 0.00 C ATOM 0 HA PRO A 103 7.602 10.175 9.876 1.00 0.00 H new ATOM 0 HB2 PRO A 103 7.440 11.812 12.101 1.00 0.00 H new ATOM 0 HB3 PRO A 103 7.505 10.063 12.193 1.00 0.00 H new ATOM 0 HG2 PRO A 103 9.604 12.034 12.868 1.00 0.00 H new ATOM 0 HG3 PRO A 103 9.486 10.351 13.342 1.00 0.00 H new ATOM 0 HD2 PRO A 103 11.197 11.447 11.318 1.00 0.00 H new ATOM 0 HD3 PRO A 103 10.993 9.752 11.711 1.00 0.00 H new ATOM 1541 N ASN A 104 8.604 12.319 8.442 1.00 0.00 N ATOM 1542 CA ASN A 104 8.448 13.529 7.654 1.00 0.00 C ATOM 1543 C ASN A 104 6.967 13.735 7.331 1.00 0.00 C ATOM 1544 O ASN A 104 6.221 12.768 7.179 1.00 0.00 O ATOM 1545 CB ASN A 104 9.211 13.427 6.332 1.00 0.00 C ATOM 1546 CG ASN A 104 9.756 14.791 5.906 1.00 0.00 C ATOM 1547 OD1 ASN A 104 9.167 15.829 6.155 1.00 0.00 O ATOM 1548 ND2 ASN A 104 10.912 14.731 5.252 1.00 0.00 N ATOM 0 H ASN A 104 9.169 11.593 8.001 1.00 0.00 H new ATOM 0 HA ASN A 104 8.842 14.363 8.235 1.00 0.00 H new ATOM 0 HB2 ASN A 104 10.034 12.719 6.437 1.00 0.00 H new ATOM 0 HB3 ASN A 104 8.552 13.037 5.557 1.00 0.00 H new ATOM 0 HD21 ASN A 104 11.359 15.588 4.926 1.00 0.00 H new ATOM 0 HD22 ASN A 104 11.352 13.828 5.076 1.00 0.00 H new ATOM 1555 N ASP A 105 6.585 14.999 7.237 1.00 0.00 N ATOM 1556 CA ASP A 105 5.206 15.345 6.935 1.00 0.00 C ATOM 1557 C ASP A 105 4.769 14.612 5.664 1.00 0.00 C ATOM 1558 O ASP A 105 3.582 14.353 5.470 1.00 0.00 O ATOM 1559 CB ASP A 105 5.055 16.847 6.689 1.00 0.00 C ATOM 1560 CG ASP A 105 5.800 17.381 5.463 1.00 0.00 C ATOM 1561 OD1 ASP A 105 7.047 17.304 5.481 1.00 0.00 O ATOM 1562 OD2 ASP A 105 5.105 17.853 4.539 1.00 0.00 O ATOM 0 H ASP A 105 7.207 15.798 7.365 1.00 0.00 H new ATOM 0 HA ASP A 105 4.591 15.056 7.788 1.00 0.00 H new ATOM 0 HB2 ASP A 105 3.995 17.077 6.580 1.00 0.00 H new ATOM 0 HB3 ASP A 105 5.408 17.381 7.571 1.00 0.00 H new ATOM 1567 N ASP A 106 5.751 14.300 4.831 1.00 0.00 N ATOM 1568 CA ASP A 106 5.482 13.603 3.585 1.00 0.00 C ATOM 1569 C ASP A 106 5.397 12.099 3.855 1.00 0.00 C ATOM 1570 O ASP A 106 5.715 11.289 2.986 1.00 0.00 O ATOM 1571 CB ASP A 106 6.600 13.839 2.568 1.00 0.00 C ATOM 1572 CG ASP A 106 6.645 15.246 1.971 1.00 0.00 C ATOM 1573 OD1 ASP A 106 6.000 16.137 2.566 1.00 0.00 O ATOM 1574 OD2 ASP A 106 7.323 15.401 0.933 1.00 0.00 O ATOM 0 H ASP A 106 6.734 14.517 4.995 1.00 0.00 H new ATOM 0 HA ASP A 106 4.543 13.983 3.182 1.00 0.00 H new ATOM 0 HB2 ASP A 106 7.557 13.634 3.048 1.00 0.00 H new ATOM 0 HB3 ASP A 106 6.490 13.120 1.756 1.00 0.00 H new ATOM 1579 N LYS A 107 4.966 11.770 5.064 1.00 0.00 N ATOM 1580 CA LYS A 107 4.836 10.378 5.459 1.00 0.00 C ATOM 1581 C LYS A 107 4.273 9.570 4.289 1.00 0.00 C ATOM 1582 O LYS A 107 4.565 8.383 4.151 1.00 0.00 O ATOM 1583 CB LYS A 107 4.009 10.261 6.741 1.00 0.00 C ATOM 1584 CG LYS A 107 2.585 10.775 6.526 1.00 0.00 C ATOM 1585 CD LYS A 107 1.884 11.028 7.861 1.00 0.00 C ATOM 1586 CE LYS A 107 0.378 10.788 7.745 1.00 0.00 C ATOM 1587 NZ LYS A 107 -0.371 12.023 8.073 1.00 0.00 N ATOM 0 H LYS A 107 4.702 12.444 5.783 1.00 0.00 H new ATOM 0 HA LYS A 107 5.813 9.957 5.696 1.00 0.00 H new ATOM 0 HB2 LYS A 107 3.978 9.220 7.064 1.00 0.00 H new ATOM 0 HB3 LYS A 107 4.487 10.829 7.539 1.00 0.00 H new ATOM 0 HG2 LYS A 107 2.612 11.697 5.945 1.00 0.00 H new ATOM 0 HG3 LYS A 107 2.017 10.049 5.945 1.00 0.00 H new ATOM 0 HD2 LYS A 107 2.302 10.373 8.625 1.00 0.00 H new ATOM 0 HD3 LYS A 107 2.069 12.053 8.184 1.00 0.00 H new ATOM 0 HE2 LYS A 107 0.132 10.464 6.734 1.00 0.00 H new ATOM 0 HE3 LYS A 107 0.079 9.985 8.418 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -1.392 11.842 7.989 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -0.150 12.315 9.046 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -0.098 12.780 7.414 1.00 0.00 H new ATOM 1601 N CYS A 108 3.476 10.246 3.474 1.00 0.00 N ATOM 1602 CA CYS A 108 2.869 9.607 2.319 1.00 0.00 C ATOM 1603 C CYS A 108 3.974 8.918 1.515 1.00 0.00 C ATOM 1604 O CYS A 108 3.834 7.760 1.124 1.00 0.00 O ATOM 1605 CB CYS A 108 2.081 10.604 1.469 1.00 0.00 C ATOM 1606 SG CYS A 108 0.867 9.849 0.325 1.00 0.00 S ATOM 0 H CYS A 108 3.237 11.231 3.591 1.00 0.00 H new ATOM 0 HA CYS A 108 2.145 8.863 2.651 1.00 0.00 H new ATOM 0 HB2 CYS A 108 1.555 11.290 2.133 1.00 0.00 H new ATOM 0 HB3 CYS A 108 2.785 11.200 0.888 1.00 0.00 H new ATOM 1611 N MET A 109 5.049 9.660 1.293 1.00 0.00 N ATOM 1612 CA MET A 109 6.178 9.137 0.542 1.00 0.00 C ATOM 1613 C MET A 109 7.313 8.722 1.479 1.00 0.00 C ATOM 1614 O MET A 109 8.298 8.129 1.041 1.00 0.00 O ATOM 1615 CB MET A 109 6.683 10.203 -0.432 1.00 0.00 C ATOM 1616 CG MET A 109 7.629 9.595 -1.469 1.00 0.00 C ATOM 1617 SD MET A 109 8.250 10.870 -2.552 1.00 0.00 S ATOM 1618 CE MET A 109 9.878 10.222 -2.894 1.00 0.00 C ATOM 0 H MET A 109 5.162 10.619 1.620 1.00 0.00 H new ATOM 0 HA MET A 109 5.847 8.257 -0.010 1.00 0.00 H new ATOM 0 HB2 MET A 109 5.837 10.670 -0.936 1.00 0.00 H new ATOM 0 HB3 MET A 109 7.199 10.989 0.119 1.00 0.00 H new ATOM 0 HG2 MET A 109 8.459 9.096 -0.968 1.00 0.00 H new ATOM 0 HG3 MET A 109 7.105 8.836 -2.050 1.00 0.00 H new ATOM 0 HE1 MET A 109 10.624 10.813 -2.362 1.00 0.00 H new ATOM 0 HE2 MET A 109 9.934 9.185 -2.563 1.00 0.00 H new ATOM 0 HE3 MET A 109 10.072 10.272 -3.965 1.00 0.00 H new ATOM 1628 N LYS A 110 7.139 9.050 2.751 1.00 0.00 N ATOM 1629 CA LYS A 110 8.137 8.719 3.753 1.00 0.00 C ATOM 1630 C LYS A 110 7.825 7.341 4.342 1.00 0.00 C ATOM 1631 O LYS A 110 8.438 6.346 3.958 1.00 0.00 O ATOM 1632 CB LYS A 110 8.231 9.828 4.803 1.00 0.00 C ATOM 1633 CG LYS A 110 9.691 10.182 5.096 1.00 0.00 C ATOM 1634 CD LYS A 110 10.288 11.023 3.966 1.00 0.00 C ATOM 1635 CE LYS A 110 11.288 10.207 3.144 1.00 0.00 C ATOM 1636 NZ LYS A 110 11.002 10.342 1.698 1.00 0.00 N ATOM 0 H LYS A 110 6.321 9.542 3.110 1.00 0.00 H new ATOM 0 HA LYS A 110 9.126 8.656 3.299 1.00 0.00 H new ATOM 0 HB2 LYS A 110 7.702 10.713 4.451 1.00 0.00 H new ATOM 0 HB3 LYS A 110 7.739 9.507 5.721 1.00 0.00 H new ATOM 0 HG2 LYS A 110 9.754 10.731 6.035 1.00 0.00 H new ATOM 0 HG3 LYS A 110 10.273 9.269 5.221 1.00 0.00 H new ATOM 0 HD2 LYS A 110 9.490 11.387 3.318 1.00 0.00 H new ATOM 0 HD3 LYS A 110 10.784 11.899 4.383 1.00 0.00 H new ATOM 0 HE2 LYS A 110 12.302 10.546 3.353 1.00 0.00 H new ATOM 0 HE3 LYS A 110 11.236 9.158 3.435 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 11.690 9.782 1.154 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 10.041 9.997 1.500 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 11.074 11.342 1.422 1.00 0.00 H new ATOM 1650 N THR A 111 6.872 7.328 5.262 1.00 0.00 N ATOM 1651 CA THR A 111 6.472 6.089 5.907 1.00 0.00 C ATOM 1652 C THR A 111 6.355 4.964 4.876 1.00 0.00 C ATOM 1653 O THR A 111 6.794 3.843 5.123 1.00 0.00 O ATOM 1654 CB THR A 111 5.171 6.352 6.670 1.00 0.00 C ATOM 1655 OG1 THR A 111 5.427 7.555 7.387 1.00 0.00 O ATOM 1656 CG2 THR A 111 4.915 5.314 7.765 1.00 0.00 C ATOM 0 H THR A 111 6.365 8.156 5.576 1.00 0.00 H new ATOM 0 HA THR A 111 7.224 5.755 6.622 1.00 0.00 H new ATOM 0 HB THR A 111 4.335 6.357 5.971 1.00 0.00 H new ATOM 0 HG1 THR A 111 4.907 7.558 8.218 1.00 0.00 H new ATOM 0 HG21 THR A 111 3.980 5.547 8.275 1.00 0.00 H new ATOM 0 HG22 THR A 111 4.847 4.322 7.318 1.00 0.00 H new ATOM 0 HG23 THR A 111 5.735 5.333 8.483 1.00 0.00 H new ATOM 1664 N ILE A 112 5.759 5.306 3.742 1.00 0.00 N ATOM 1665 CA ILE A 112 5.578 4.338 2.673 1.00 0.00 C ATOM 1666 C ILE A 112 6.884 3.570 2.460 1.00 0.00 C ATOM 1667 O ILE A 112 6.876 2.346 2.339 1.00 0.00 O ATOM 1668 CB ILE A 112 5.057 5.027 1.411 1.00 0.00 C ATOM 1669 CG1 ILE A 112 4.367 4.024 0.483 1.00 0.00 C ATOM 1670 CG2 ILE A 112 6.176 5.791 0.699 1.00 0.00 C ATOM 1671 CD1 ILE A 112 5.296 2.854 0.155 1.00 0.00 C ATOM 0 H ILE A 112 5.396 6.238 3.541 1.00 0.00 H new ATOM 0 HA ILE A 112 4.818 3.606 2.946 1.00 0.00 H new ATOM 0 HB ILE A 112 4.307 5.760 1.708 1.00 0.00 H new ATOM 0 HG12 ILE A 112 3.459 3.651 0.956 1.00 0.00 H new ATOM 0 HG13 ILE A 112 4.065 4.523 -0.438 1.00 0.00 H new ATOM 0 HG21 ILE A 112 5.777 6.271 -0.195 1.00 0.00 H new ATOM 0 HG22 ILE A 112 6.581 6.550 1.368 1.00 0.00 H new ATOM 0 HG23 ILE A 112 6.967 5.097 0.416 1.00 0.00 H new ATOM 0 HD11 ILE A 112 4.782 2.156 -0.506 1.00 0.00 H new ATOM 0 HD12 ILE A 112 6.192 3.229 -0.339 1.00 0.00 H new ATOM 0 HD13 ILE A 112 5.576 2.343 1.076 1.00 0.00 H new ATOM 1683 N ASP A 113 7.975 4.322 2.418 1.00 0.00 N ATOM 1684 CA ASP A 113 9.286 3.727 2.221 1.00 0.00 C ATOM 1685 C ASP A 113 9.399 2.458 3.070 1.00 0.00 C ATOM 1686 O ASP A 113 9.769 1.400 2.563 1.00 0.00 O ATOM 1687 CB ASP A 113 10.397 4.686 2.655 1.00 0.00 C ATOM 1688 CG ASP A 113 11.665 4.636 1.800 1.00 0.00 C ATOM 1689 OD1 ASP A 113 11.557 4.147 0.655 1.00 0.00 O ATOM 1690 OD2 ASP A 113 12.712 5.089 2.311 1.00 0.00 O ATOM 0 H ASP A 113 7.978 5.337 2.517 1.00 0.00 H new ATOM 0 HA ASP A 113 9.398 3.501 1.160 1.00 0.00 H new ATOM 0 HB2 ASP A 113 10.005 5.703 2.638 1.00 0.00 H new ATOM 0 HB3 ASP A 113 10.665 4.464 3.688 1.00 0.00 H new ATOM 1695 N VAL A 114 9.073 2.606 4.344 1.00 0.00 N ATOM 1696 CA VAL A 114 9.133 1.487 5.268 1.00 0.00 C ATOM 1697 C VAL A 114 7.978 0.527 4.974 1.00 0.00 C ATOM 1698 O VAL A 114 8.198 -0.648 4.688 1.00 0.00 O ATOM 1699 CB VAL A 114 9.135 1.995 6.711 1.00 0.00 C ATOM 1700 CG1 VAL A 114 9.991 1.097 7.608 1.00 0.00 C ATOM 1701 CG2 VAL A 114 9.610 3.448 6.778 1.00 0.00 C ATOM 0 H VAL A 114 8.766 3.485 4.759 1.00 0.00 H new ATOM 0 HA VAL A 114 10.061 0.932 5.134 1.00 0.00 H new ATOM 0 HB VAL A 114 8.110 1.958 7.081 1.00 0.00 H new ATOM 0 HG11 VAL A 114 9.975 1.481 8.628 1.00 0.00 H new ATOM 0 HG12 VAL A 114 9.591 0.083 7.595 1.00 0.00 H new ATOM 0 HG13 VAL A 114 11.017 1.087 7.240 1.00 0.00 H new ATOM 0 HG21 VAL A 114 9.602 3.786 7.814 1.00 0.00 H new ATOM 0 HG22 VAL A 114 10.623 3.518 6.381 1.00 0.00 H new ATOM 0 HG23 VAL A 114 8.944 4.076 6.187 1.00 0.00 H new ATOM 1711 N ALA A 115 6.769 1.065 5.058 1.00 0.00 N ATOM 1712 CA ALA A 115 5.578 0.271 4.804 1.00 0.00 C ATOM 1713 C ALA A 115 5.780 -0.553 3.530 1.00 0.00 C ATOM 1714 O ALA A 115 5.124 -1.575 3.339 1.00 0.00 O ATOM 1715 CB ALA A 115 4.360 1.194 4.715 1.00 0.00 C ATOM 0 H ALA A 115 6.589 2.040 5.298 1.00 0.00 H new ATOM 0 HA ALA A 115 5.400 -0.427 5.622 1.00 0.00 H new ATOM 0 HB1 ALA A 115 3.466 0.600 4.525 1.00 0.00 H new ATOM 0 HB2 ALA A 115 4.243 1.734 5.655 1.00 0.00 H new ATOM 0 HB3 ALA A 115 4.502 1.906 3.902 1.00 0.00 H new ATOM 1721 N MET A 116 6.691 -0.077 2.695 1.00 0.00 N ATOM 1722 CA MET A 116 6.988 -0.757 1.446 1.00 0.00 C ATOM 1723 C MET A 116 8.278 -1.573 1.558 1.00 0.00 C ATOM 1724 O MET A 116 8.387 -2.653 0.978 1.00 0.00 O ATOM 1725 CB MET A 116 7.133 0.274 0.325 1.00 0.00 C ATOM 1726 CG MET A 116 7.872 -0.321 -0.877 1.00 0.00 C ATOM 1727 SD MET A 116 7.884 0.846 -2.226 1.00 0.00 S ATOM 1728 CE MET A 116 8.898 2.132 -1.513 1.00 0.00 C ATOM 0 H MET A 116 7.233 0.771 2.859 1.00 0.00 H new ATOM 0 HA MET A 116 6.167 -1.438 1.222 1.00 0.00 H new ATOM 0 HB2 MET A 116 6.147 0.620 0.015 1.00 0.00 H new ATOM 0 HB3 MET A 116 7.675 1.145 0.695 1.00 0.00 H new ATOM 0 HG2 MET A 116 8.894 -0.575 -0.596 1.00 0.00 H new ATOM 0 HG3 MET A 116 7.388 -1.246 -1.190 1.00 0.00 H new ATOM 0 HE1 MET A 116 9.302 2.759 -2.308 1.00 0.00 H new ATOM 0 HE2 MET A 116 8.293 2.742 -0.842 1.00 0.00 H new ATOM 0 HE3 MET A 116 9.718 1.681 -0.954 1.00 0.00 H new ATOM 1738 N CYS A 117 9.222 -1.026 2.309 1.00 0.00 N ATOM 1739 CA CYS A 117 10.499 -1.690 2.507 1.00 0.00 C ATOM 1740 C CYS A 117 10.230 -3.152 2.870 1.00 0.00 C ATOM 1741 O CYS A 117 10.866 -4.057 2.331 1.00 0.00 O ATOM 1742 CB CYS A 117 11.347 -0.985 3.566 1.00 0.00 C ATOM 1743 SG CYS A 117 13.151 -1.027 3.260 1.00 0.00 S ATOM 0 H CYS A 117 9.128 -0.130 2.788 1.00 0.00 H new ATOM 0 HA CYS A 117 11.080 -1.647 1.586 1.00 0.00 H new ATOM 0 HB2 CYS A 117 11.028 0.055 3.633 1.00 0.00 H new ATOM 0 HB3 CYS A 117 11.147 -1.442 4.535 1.00 0.00 H new ATOM 1748 N PHE A 118 9.287 -3.336 3.783 1.00 0.00 N ATOM 1749 CA PHE A 118 8.927 -4.673 4.225 1.00 0.00 C ATOM 1750 C PHE A 118 8.336 -5.491 3.076 1.00 0.00 C ATOM 1751 O PHE A 118 8.774 -6.611 2.816 1.00 0.00 O ATOM 1752 CB PHE A 118 7.867 -4.511 5.317 1.00 0.00 C ATOM 1753 CG PHE A 118 6.993 -5.750 5.525 1.00 0.00 C ATOM 1754 CD1 PHE A 118 7.507 -6.989 5.297 1.00 0.00 C ATOM 1755 CD2 PHE A 118 5.705 -5.612 5.939 1.00 0.00 C ATOM 1756 CE1 PHE A 118 6.697 -8.140 5.491 1.00 0.00 C ATOM 1757 CE2 PHE A 118 4.896 -6.762 6.132 1.00 0.00 C ATOM 1758 CZ PHE A 118 5.407 -8.002 5.904 1.00 0.00 C ATOM 0 H PHE A 118 8.762 -2.583 4.228 1.00 0.00 H new ATOM 0 HA PHE A 118 9.812 -5.195 4.589 1.00 0.00 H new ATOM 0 HB2 PHE A 118 8.363 -4.267 6.257 1.00 0.00 H new ATOM 0 HB3 PHE A 118 7.227 -3.666 5.065 1.00 0.00 H new ATOM 0 HD1 PHE A 118 8.530 -7.097 4.969 1.00 0.00 H new ATOM 0 HD2 PHE A 118 5.298 -4.628 6.121 1.00 0.00 H new ATOM 0 HE1 PHE A 118 7.104 -9.124 5.311 1.00 0.00 H new ATOM 0 HE2 PHE A 118 3.873 -6.653 6.460 1.00 0.00 H new ATOM 0 HZ PHE A 118 4.790 -8.876 6.050 1.00 0.00 H new ATOM 1768 N LYS A 119 7.350 -4.899 2.417 1.00 0.00 N ATOM 1769 CA LYS A 119 6.695 -5.559 1.300 1.00 0.00 C ATOM 1770 C LYS A 119 7.713 -5.790 0.181 1.00 0.00 C ATOM 1771 O LYS A 119 7.599 -6.752 -0.577 1.00 0.00 O ATOM 1772 CB LYS A 119 5.463 -4.768 0.857 1.00 0.00 C ATOM 1773 CG LYS A 119 4.209 -5.250 1.589 1.00 0.00 C ATOM 1774 CD LYS A 119 3.110 -4.186 1.555 1.00 0.00 C ATOM 1775 CE LYS A 119 2.333 -4.159 2.873 1.00 0.00 C ATOM 1776 NZ LYS A 119 1.512 -2.931 2.965 1.00 0.00 N ATOM 0 H LYS A 119 6.989 -3.970 2.635 1.00 0.00 H new ATOM 0 HA LYS A 119 6.324 -6.539 1.601 1.00 0.00 H new ATOM 0 HB2 LYS A 119 5.618 -3.707 1.053 1.00 0.00 H new ATOM 0 HB3 LYS A 119 5.325 -4.876 -0.219 1.00 0.00 H new ATOM 0 HG2 LYS A 119 3.845 -6.168 1.128 1.00 0.00 H new ATOM 0 HG3 LYS A 119 4.457 -5.489 2.623 1.00 0.00 H new ATOM 0 HD2 LYS A 119 3.552 -3.207 1.369 1.00 0.00 H new ATOM 0 HD3 LYS A 119 2.427 -4.389 0.730 1.00 0.00 H new ATOM 0 HE2 LYS A 119 1.692 -5.038 2.942 1.00 0.00 H new ATOM 0 HE3 LYS A 119 3.027 -4.203 3.712 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 0.991 -2.928 3.865 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 2.130 -2.096 2.920 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 0.837 -2.905 2.174 1.00 0.00 H new ATOM 1790 N LYS A 120 8.683 -4.890 0.113 1.00 0.00 N ATOM 1791 CA LYS A 120 9.720 -4.983 -0.902 1.00 0.00 C ATOM 1792 C LYS A 120 10.492 -6.292 -0.717 1.00 0.00 C ATOM 1793 O LYS A 120 11.058 -6.822 -1.671 1.00 0.00 O ATOM 1794 CB LYS A 120 10.607 -3.737 -0.877 1.00 0.00 C ATOM 1795 CG LYS A 120 12.037 -4.090 -0.462 1.00 0.00 C ATOM 1796 CD LYS A 120 12.973 -2.895 -0.655 1.00 0.00 C ATOM 1797 CE LYS A 120 14.367 -3.357 -1.086 1.00 0.00 C ATOM 1798 NZ LYS A 120 15.387 -2.356 -0.697 1.00 0.00 N ATOM 0 H LYS A 120 8.773 -4.093 0.743 1.00 0.00 H new ATOM 0 HA LYS A 120 9.278 -5.011 -1.898 1.00 0.00 H new ATOM 0 HB2 LYS A 120 10.615 -3.272 -1.863 1.00 0.00 H new ATOM 0 HB3 LYS A 120 10.193 -3.006 -0.183 1.00 0.00 H new ATOM 0 HG2 LYS A 120 12.050 -4.402 0.582 1.00 0.00 H new ATOM 0 HG3 LYS A 120 12.393 -4.935 -1.052 1.00 0.00 H new ATOM 0 HD2 LYS A 120 12.560 -2.222 -1.407 1.00 0.00 H new ATOM 0 HD3 LYS A 120 13.044 -2.330 0.274 1.00 0.00 H new ATOM 0 HE2 LYS A 120 14.597 -4.318 -0.625 1.00 0.00 H new ATOM 0 HE3 LYS A 120 14.389 -3.508 -2.165 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 16.327 -2.684 -0.996 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 15.175 -1.448 -1.157 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 15.376 -2.232 0.336 1.00 0.00 H new ATOM 1812 N GLU A 121 10.491 -6.772 0.518 1.00 0.00 N ATOM 1813 CA GLU A 121 11.184 -8.008 0.839 1.00 0.00 C ATOM 1814 C GLU A 121 10.668 -9.151 -0.038 1.00 0.00 C ATOM 1815 O GLU A 121 11.438 -10.018 -0.450 1.00 0.00 O ATOM 1816 CB GLU A 121 11.037 -8.349 2.324 1.00 0.00 C ATOM 1817 CG GLU A 121 11.518 -7.192 3.202 1.00 0.00 C ATOM 1818 CD GLU A 121 11.416 -7.551 4.687 1.00 0.00 C ATOM 1819 OE1 GLU A 121 11.665 -8.735 5.003 1.00 0.00 O ATOM 1820 OE2 GLU A 121 11.090 -6.633 5.470 1.00 0.00 O ATOM 0 H GLU A 121 10.022 -6.328 1.307 1.00 0.00 H new ATOM 0 HA GLU A 121 12.245 -7.869 0.634 1.00 0.00 H new ATOM 0 HB2 GLU A 121 9.994 -8.571 2.548 1.00 0.00 H new ATOM 0 HB3 GLU A 121 11.611 -9.247 2.553 1.00 0.00 H new ATOM 0 HG2 GLU A 121 12.551 -6.947 2.953 1.00 0.00 H new ATOM 0 HG3 GLU A 121 10.921 -6.303 2.997 1.00 0.00 H new ATOM 1827 N ILE A 122 9.370 -9.113 -0.299 1.00 0.00 N ATOM 1828 CA ILE A 122 8.743 -10.135 -1.121 1.00 0.00 C ATOM 1829 C ILE A 122 9.305 -10.057 -2.541 1.00 0.00 C ATOM 1830 O ILE A 122 9.486 -11.081 -3.198 1.00 0.00 O ATOM 1831 CB ILE A 122 7.219 -10.015 -1.054 1.00 0.00 C ATOM 1832 CG1 ILE A 122 6.760 -9.635 0.355 1.00 0.00 C ATOM 1833 CG2 ILE A 122 6.546 -11.298 -1.550 1.00 0.00 C ATOM 1834 CD1 ILE A 122 7.556 -10.396 1.415 1.00 0.00 C ATOM 0 H ILE A 122 8.735 -8.392 0.044 1.00 0.00 H new ATOM 0 HA ILE A 122 8.978 -11.129 -0.740 1.00 0.00 H new ATOM 0 HB ILE A 122 6.910 -9.210 -1.721 1.00 0.00 H new ATOM 0 HG12 ILE A 122 6.882 -8.562 0.504 1.00 0.00 H new ATOM 0 HG13 ILE A 122 5.698 -9.853 0.466 1.00 0.00 H new ATOM 0 HG21 ILE A 122 5.463 -11.187 -1.492 1.00 0.00 H new ATOM 0 HG22 ILE A 122 6.837 -11.485 -2.584 1.00 0.00 H new ATOM 0 HG23 ILE A 122 6.858 -12.137 -0.928 1.00 0.00 H new ATOM 0 HD11 ILE A 122 7.210 -10.107 2.407 1.00 0.00 H new ATOM 0 HD12 ILE A 122 7.412 -11.468 1.278 1.00 0.00 H new ATOM 0 HD13 ILE A 122 8.615 -10.157 1.316 1.00 0.00 H new ATOM 1846 N HIS A 123 9.566 -8.831 -2.973 1.00 0.00 N ATOM 1847 CA HIS A 123 10.102 -8.606 -4.305 1.00 0.00 C ATOM 1848 C HIS A 123 11.252 -9.583 -4.566 1.00 0.00 C ATOM 1849 O HIS A 123 11.592 -9.850 -5.718 1.00 0.00 O ATOM 1850 CB HIS A 123 10.517 -7.144 -4.483 1.00 0.00 C ATOM 1851 CG HIS A 123 12.005 -6.912 -4.399 1.00 0.00 C ATOM 1852 ND1 HIS A 123 12.704 -6.176 -5.340 1.00 0.00 N ATOM 1853 CD2 HIS A 123 12.922 -7.325 -3.477 1.00 0.00 C ATOM 1854 CE1 HIS A 123 13.982 -6.154 -4.990 1.00 0.00 C ATOM 1855 NE2 HIS A 123 14.114 -6.868 -3.835 1.00 0.00 N ATOM 0 H HIS A 123 9.416 -7.984 -2.424 1.00 0.00 H new ATOM 0 HA HIS A 123 9.330 -8.798 -5.050 1.00 0.00 H new ATOM 0 HB2 HIS A 123 10.159 -6.791 -5.450 1.00 0.00 H new ATOM 0 HB3 HIS A 123 10.023 -6.542 -3.721 1.00 0.00 H new ATOM 0 HD2 HIS A 123 12.712 -7.923 -2.603 1.00 0.00 H new ATOM 0 HE1 HIS A 123 14.779 -5.658 -5.525 1.00 0.00 H new ATOM 0 HE2 HIS A 123 14.986 -7.025 -3.330 1.00 0.00 H new ATOM 1864 N LYS A 124 11.816 -10.088 -3.479 1.00 0.00 N ATOM 1865 CA LYS A 124 12.918 -11.029 -3.577 1.00 0.00 C ATOM 1866 C LYS A 124 12.381 -12.455 -3.436 1.00 0.00 C ATOM 1867 O LYS A 124 13.088 -13.346 -2.970 1.00 0.00 O ATOM 1868 CB LYS A 124 14.011 -10.682 -2.563 1.00 0.00 C ATOM 1869 CG LYS A 124 13.807 -11.446 -1.254 1.00 0.00 C ATOM 1870 CD LYS A 124 14.422 -10.689 -0.075 1.00 0.00 C ATOM 1871 CE LYS A 124 15.802 -11.245 0.276 1.00 0.00 C ATOM 1872 NZ LYS A 124 16.464 -10.394 1.290 1.00 0.00 N ATOM 0 H LYS A 124 11.530 -9.863 -2.526 1.00 0.00 H new ATOM 0 HA LYS A 124 13.390 -10.961 -4.557 1.00 0.00 H new ATOM 0 HB2 LYS A 124 14.989 -10.923 -2.980 1.00 0.00 H new ATOM 0 HB3 LYS A 124 14.003 -9.610 -2.367 1.00 0.00 H new ATOM 0 HG2 LYS A 124 12.742 -11.596 -1.079 1.00 0.00 H new ATOM 0 HG3 LYS A 124 14.259 -12.435 -1.332 1.00 0.00 H new ATOM 0 HD2 LYS A 124 14.505 -9.631 -0.322 1.00 0.00 H new ATOM 0 HD3 LYS A 124 13.765 -10.764 0.792 1.00 0.00 H new ATOM 0 HE2 LYS A 124 15.705 -12.262 0.655 1.00 0.00 H new ATOM 0 HE3 LYS A 124 16.418 -11.297 -0.622 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 17.400 -10.787 1.516 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 16.575 -9.430 0.916 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 15.883 -10.366 2.152 1.00 0.00 H new ATOM 1886 N LEU A 125 11.134 -12.626 -3.849 1.00 0.00 N ATOM 1887 CA LEU A 125 10.492 -13.927 -3.776 1.00 0.00 C ATOM 1888 C LEU A 125 11.456 -14.996 -4.296 1.00 0.00 C ATOM 1889 O LEU A 125 12.382 -15.398 -3.592 1.00 0.00 O ATOM 1890 CB LEU A 125 9.147 -13.906 -4.506 1.00 0.00 C ATOM 1891 CG LEU A 125 8.986 -12.829 -5.580 1.00 0.00 C ATOM 1892 CD1 LEU A 125 10.248 -12.716 -6.438 1.00 0.00 C ATOM 1893 CD2 LEU A 125 7.738 -13.083 -6.428 1.00 0.00 C ATOM 0 H LEU A 125 10.551 -11.884 -4.236 1.00 0.00 H new ATOM 0 HA LEU A 125 10.262 -14.179 -2.741 1.00 0.00 H new ATOM 0 HB2 LEU A 125 8.992 -14.880 -4.970 1.00 0.00 H new ATOM 0 HB3 LEU A 125 8.357 -13.776 -3.767 1.00 0.00 H new ATOM 0 HG LEU A 125 8.848 -11.869 -5.082 1.00 0.00 H new ATOM 0 HD11 LEU A 125 10.106 -11.943 -7.193 1.00 0.00 H new ATOM 0 HD12 LEU A 125 11.096 -12.454 -5.805 1.00 0.00 H new ATOM 0 HD13 LEU A 125 10.442 -13.670 -6.927 1.00 0.00 H new ATOM 0 HD21 LEU A 125 7.647 -12.303 -7.184 1.00 0.00 H new ATOM 0 HD22 LEU A 125 7.821 -14.054 -6.916 1.00 0.00 H new ATOM 0 HD23 LEU A 125 6.855 -13.073 -5.788 1.00 0.00 H new ATOM 1905 N ASN A 126 11.206 -15.425 -5.524 1.00 0.00 N ATOM 1906 CA ASN A 126 12.040 -16.440 -6.146 1.00 0.00 C ATOM 1907 C ASN A 126 12.978 -15.774 -7.155 1.00 0.00 C ATOM 1908 O ASN A 126 14.086 -16.255 -7.389 1.00 0.00 O ATOM 1909 CB ASN A 126 11.191 -17.467 -6.897 1.00 0.00 C ATOM 1910 CG ASN A 126 12.060 -18.334 -7.810 1.00 0.00 C ATOM 1911 OD1 ASN A 126 12.842 -19.159 -7.365 1.00 0.00 O ATOM 1912 ND2 ASN A 126 11.878 -18.106 -9.108 1.00 0.00 N ATOM 0 H ASN A 126 10.438 -15.089 -6.105 1.00 0.00 H new ATOM 0 HA ASN A 126 12.602 -16.943 -5.359 1.00 0.00 H new ATOM 0 HB2 ASN A 126 10.663 -18.100 -6.183 1.00 0.00 H new ATOM 0 HB3 ASN A 126 10.433 -16.954 -7.490 1.00 0.00 H new ATOM 0 HD21 ASN A 126 12.409 -18.637 -9.798 1.00 0.00 H new ATOM 0 HD22 ASN A 126 11.207 -17.401 -9.413 1.00 0.00 H new ATOM 1919 N TRP A 127 12.501 -14.678 -7.724 1.00 0.00 N ATOM 1920 CA TRP A 127 13.282 -13.941 -8.702 1.00 0.00 C ATOM 1921 C TRP A 127 13.763 -12.646 -8.044 1.00 0.00 C ATOM 1922 O TRP A 127 12.998 -11.976 -7.352 1.00 0.00 O ATOM 1923 CB TRP A 127 12.475 -13.698 -9.979 1.00 0.00 C ATOM 1924 CG TRP A 127 10.982 -13.476 -9.739 1.00 0.00 C ATOM 1925 CD1 TRP A 127 10.057 -14.382 -9.392 1.00 0.00 C ATOM 1926 CD2 TRP A 127 10.271 -12.223 -9.842 1.00 0.00 C ATOM 1927 NE1 TRP A 127 8.809 -13.808 -9.265 1.00 0.00 N ATOM 1928 CE2 TRP A 127 8.943 -12.453 -9.547 1.00 0.00 C ATOM 1929 CE3 TRP A 127 10.736 -10.938 -10.173 1.00 0.00 C ATOM 1930 CZ2 TRP A 127 7.971 -11.446 -9.553 1.00 0.00 C ATOM 1931 CZ3 TRP A 127 9.752 -9.943 -10.177 1.00 0.00 C ATOM 1932 CH2 TRP A 127 8.410 -10.158 -9.881 1.00 0.00 C ATOM 0 H TRP A 127 11.582 -14.282 -7.526 1.00 0.00 H new ATOM 0 HA TRP A 127 14.153 -14.518 -9.014 1.00 0.00 H new ATOM 0 HB2 TRP A 127 12.883 -12.828 -10.494 1.00 0.00 H new ATOM 0 HB3 TRP A 127 12.602 -14.552 -10.645 1.00 0.00 H new ATOM 0 HD1 TRP A 127 10.263 -15.430 -9.232 1.00 0.00 H new ATOM 0 HE1 TRP A 127 7.946 -14.289 -9.011 1.00 0.00 H new ATOM 0 HE3 TRP A 127 11.771 -10.735 -10.406 1.00 0.00 H new ATOM 0 HZ2 TRP A 127 6.937 -11.652 -9.317 1.00 0.00 H new ATOM 0 HZ3 TRP A 127 10.056 -8.937 -10.428 1.00 0.00 H new ATOM 0 HH2 TRP A 127 7.710 -9.336 -9.904 1.00 0.00 H new ATOM 1943 N VAL A 128 15.028 -12.332 -8.284 1.00 0.00 N ATOM 1944 CA VAL A 128 15.620 -11.130 -7.722 1.00 0.00 C ATOM 1945 C VAL A 128 16.133 -10.241 -8.858 1.00 0.00 C ATOM 1946 O VAL A 128 17.287 -10.357 -9.269 1.00 0.00 O ATOM 1947 CB VAL A 128 16.711 -11.502 -6.717 1.00 0.00 C ATOM 1948 CG1 VAL A 128 16.109 -11.812 -5.344 1.00 0.00 C ATOM 1949 CG2 VAL A 128 17.547 -12.678 -7.226 1.00 0.00 C ATOM 0 H VAL A 128 15.659 -12.889 -8.860 1.00 0.00 H new ATOM 0 HA VAL A 128 14.872 -10.559 -7.172 1.00 0.00 H new ATOM 0 HB VAL A 128 17.372 -10.643 -6.607 1.00 0.00 H new ATOM 0 HG11 VAL A 128 16.906 -12.074 -4.648 1.00 0.00 H new ATOM 0 HG12 VAL A 128 15.577 -10.936 -4.974 1.00 0.00 H new ATOM 0 HG13 VAL A 128 15.415 -12.648 -5.431 1.00 0.00 H new ATOM 0 HG21 VAL A 128 18.316 -12.922 -6.493 1.00 0.00 H new ATOM 0 HG22 VAL A 128 16.902 -13.544 -7.378 1.00 0.00 H new ATOM 0 HG23 VAL A 128 18.019 -12.407 -8.170 1.00 0.00 H new ATOM 1959 N PRO A 129 15.227 -9.352 -9.346 1.00 0.00 N ATOM 1960 CA PRO A 129 15.575 -8.444 -10.425 1.00 0.00 C ATOM 1961 C PRO A 129 16.470 -7.310 -9.921 1.00 0.00 C ATOM 1962 O PRO A 129 16.203 -6.139 -10.188 1.00 0.00 O ATOM 1963 CB PRO A 129 14.245 -7.954 -10.971 1.00 0.00 C ATOM 1964 CG PRO A 129 13.219 -8.237 -9.887 1.00 0.00 C ATOM 1965 CD PRO A 129 13.852 -9.187 -8.884 1.00 0.00 C ATOM 0 HA PRO A 129 16.158 -8.927 -11.209 1.00 0.00 H new ATOM 0 HB2 PRO A 129 14.286 -6.889 -11.201 1.00 0.00 H new ATOM 0 HB3 PRO A 129 13.988 -8.471 -11.896 1.00 0.00 H new ATOM 0 HG2 PRO A 129 12.916 -7.312 -9.398 1.00 0.00 H new ATOM 0 HG3 PRO A 129 12.321 -8.679 -10.318 1.00 0.00 H new ATOM 0 HD2 PRO A 129 13.820 -8.776 -7.875 1.00 0.00 H new ATOM 0 HD3 PRO A 129 13.326 -10.141 -8.856 1.00 0.00 H new ATOM 1973 N ASN A 130 17.512 -7.697 -9.201 1.00 0.00 N ATOM 1974 CA ASN A 130 18.448 -6.726 -8.657 1.00 0.00 C ATOM 1975 C ASN A 130 18.846 -5.739 -9.756 1.00 0.00 C ATOM 1976 O ASN A 130 19.159 -4.582 -9.472 1.00 0.00 O ATOM 1977 CB ASN A 130 19.720 -7.411 -8.152 1.00 0.00 C ATOM 1978 CG ASN A 130 20.117 -6.879 -6.775 1.00 0.00 C ATOM 1979 OD1 ASN A 130 19.337 -6.866 -5.836 1.00 0.00 O ATOM 1980 ND2 ASN A 130 21.372 -6.444 -6.704 1.00 0.00 N ATOM 0 H ASN A 130 17.730 -8.669 -8.981 1.00 0.00 H new ATOM 0 HA ASN A 130 17.961 -6.214 -7.827 1.00 0.00 H new ATOM 0 HB2 ASN A 130 19.561 -8.488 -8.098 1.00 0.00 H new ATOM 0 HB3 ASN A 130 20.533 -7.244 -8.859 1.00 0.00 H new ATOM 0 HD21 ASN A 130 21.734 -6.071 -5.826 1.00 0.00 H new ATOM 0 HD22 ASN A 130 21.973 -6.483 -7.527 1.00 0.00 H new ATOM 1987 N MET A 131 18.823 -6.228 -10.986 1.00 0.00 N ATOM 1988 CA MET A 131 19.178 -5.403 -12.128 1.00 0.00 C ATOM 1989 C MET A 131 18.046 -5.374 -13.157 1.00 0.00 C ATOM 1990 O MET A 131 17.866 -6.328 -13.913 1.00 0.00 O ATOM 1991 CB MET A 131 20.449 -5.953 -12.780 1.00 0.00 C ATOM 1992 CG MET A 131 21.700 -5.441 -12.062 1.00 0.00 C ATOM 1993 SD MET A 131 22.921 -6.737 -11.965 1.00 0.00 S ATOM 1994 CE MET A 131 23.658 -6.353 -10.387 1.00 0.00 C ATOM 0 H MET A 131 18.564 -7.187 -11.218 1.00 0.00 H new ATOM 0 HA MET A 131 19.350 -4.385 -11.778 1.00 0.00 H new ATOM 0 HB2 MET A 131 20.432 -7.043 -12.756 1.00 0.00 H new ATOM 0 HB3 MET A 131 20.481 -5.658 -13.829 1.00 0.00 H new ATOM 0 HG2 MET A 131 22.110 -4.583 -12.595 1.00 0.00 H new ATOM 0 HG3 MET A 131 21.440 -5.099 -11.060 1.00 0.00 H new ATOM 0 HE1 MET A 131 24.448 -7.072 -10.170 1.00 0.00 H new ATOM 0 HE2 MET A 131 24.080 -5.349 -10.417 1.00 0.00 H new ATOM 0 HE3 MET A 131 22.897 -6.403 -9.608 1.00 0.00 H new ATOM 2004 N ASP A 132 17.314 -4.269 -13.152 1.00 0.00 N ATOM 2005 CA ASP A 132 16.205 -4.104 -14.076 1.00 0.00 C ATOM 2006 C ASP A 132 16.325 -2.747 -14.773 1.00 0.00 C ATOM 2007 O ASP A 132 15.929 -1.724 -14.219 1.00 0.00 O ATOM 2008 CB ASP A 132 14.864 -4.140 -13.341 1.00 0.00 C ATOM 2009 CG ASP A 132 13.638 -3.876 -14.216 1.00 0.00 C ATOM 2010 OD1 ASP A 132 13.551 -4.525 -15.282 1.00 0.00 O ATOM 2011 OD2 ASP A 132 12.816 -3.031 -13.801 1.00 0.00 O ATOM 0 H ASP A 132 17.467 -3.480 -12.523 1.00 0.00 H new ATOM 0 HA ASP A 132 16.243 -4.921 -14.796 1.00 0.00 H new ATOM 0 HB2 ASP A 132 14.752 -5.116 -12.870 1.00 0.00 H new ATOM 0 HB3 ASP A 132 14.886 -3.401 -12.541 1.00 0.00 H new ATOM 2016 N LEU A 133 16.874 -2.784 -15.979 1.00 0.00 N ATOM 2017 CA LEU A 133 17.052 -1.569 -16.757 1.00 0.00 C ATOM 2018 C LEU A 133 15.683 -0.957 -17.059 1.00 0.00 C ATOM 2019 O LEU A 133 14.899 -1.524 -17.819 1.00 0.00 O ATOM 2020 CB LEU A 133 17.889 -1.851 -18.007 1.00 0.00 C ATOM 2021 CG LEU A 133 17.108 -2.258 -19.257 1.00 0.00 C ATOM 2022 CD1 LEU A 133 16.164 -3.424 -18.959 1.00 0.00 C ATOM 2023 CD2 LEU A 133 16.369 -1.061 -19.857 1.00 0.00 C ATOM 0 H LEU A 133 17.201 -3.635 -16.436 1.00 0.00 H new ATOM 0 HA LEU A 133 17.613 -0.830 -16.186 1.00 0.00 H new ATOM 0 HB2 LEU A 133 18.470 -0.959 -18.240 1.00 0.00 H new ATOM 0 HB3 LEU A 133 18.600 -2.643 -17.773 1.00 0.00 H new ATOM 0 HG LEU A 133 17.820 -2.604 -20.006 1.00 0.00 H new ATOM 0 HD11 LEU A 133 15.621 -3.693 -19.865 1.00 0.00 H new ATOM 0 HD12 LEU A 133 16.742 -4.281 -18.614 1.00 0.00 H new ATOM 0 HD13 LEU A 133 15.455 -3.130 -18.185 1.00 0.00 H new ATOM 0 HD21 LEU A 133 15.822 -1.379 -20.745 1.00 0.00 H new ATOM 0 HD22 LEU A 133 15.669 -0.660 -19.124 1.00 0.00 H new ATOM 0 HD23 LEU A 133 17.088 -0.289 -20.131 1.00 0.00 H new ATOM 2035 N VAL A 134 15.436 0.192 -16.447 1.00 0.00 N ATOM 2036 CA VAL A 134 14.175 0.887 -16.640 1.00 0.00 C ATOM 2037 C VAL A 134 14.438 2.234 -17.315 1.00 0.00 C ATOM 2038 O VAL A 134 13.507 2.899 -17.769 1.00 0.00 O ATOM 2039 CB VAL A 134 13.440 1.021 -15.305 1.00 0.00 C ATOM 2040 CG1 VAL A 134 13.187 -0.351 -14.677 1.00 0.00 C ATOM 2041 CG2 VAL A 134 14.211 1.930 -14.345 1.00 0.00 C ATOM 0 H VAL A 134 16.088 0.659 -15.817 1.00 0.00 H new ATOM 0 HA VAL A 134 13.522 0.315 -17.299 1.00 0.00 H new ATOM 0 HB VAL A 134 12.472 1.483 -15.500 1.00 0.00 H new ATOM 0 HG11 VAL A 134 12.663 -0.226 -13.729 1.00 0.00 H new ATOM 0 HG12 VAL A 134 12.578 -0.953 -15.351 1.00 0.00 H new ATOM 0 HG13 VAL A 134 14.139 -0.852 -14.502 1.00 0.00 H new ATOM 0 HG21 VAL A 134 13.668 2.009 -13.403 1.00 0.00 H new ATOM 0 HG22 VAL A 134 15.199 1.509 -14.160 1.00 0.00 H new ATOM 0 HG23 VAL A 134 14.316 2.921 -14.787 1.00 0.00 H new ATOM 2051 N ILE A 135 15.711 2.599 -17.362 1.00 0.00 N ATOM 2052 CA ILE A 135 16.109 3.855 -17.974 1.00 0.00 C ATOM 2053 C ILE A 135 16.773 3.571 -19.323 1.00 0.00 C ATOM 2054 O ILE A 135 16.856 4.454 -20.176 1.00 0.00 O ATOM 2055 CB ILE A 135 16.983 4.665 -17.015 1.00 0.00 C ATOM 2056 CG1 ILE A 135 17.927 3.751 -16.229 1.00 0.00 C ATOM 2057 CG2 ILE A 135 16.126 5.535 -16.094 1.00 0.00 C ATOM 2058 CD1 ILE A 135 17.249 3.227 -14.962 1.00 0.00 C ATOM 0 H ILE A 135 16.481 2.046 -16.986 1.00 0.00 H new ATOM 0 HA ILE A 135 15.236 4.476 -18.173 1.00 0.00 H new ATOM 0 HB ILE A 135 17.605 5.338 -17.605 1.00 0.00 H new ATOM 0 HG12 ILE A 135 18.234 2.913 -16.855 1.00 0.00 H new ATOM 0 HG13 ILE A 135 18.831 4.298 -15.963 1.00 0.00 H new ATOM 0 HG21 ILE A 135 16.772 6.100 -15.422 1.00 0.00 H new ATOM 0 HG22 ILE A 135 15.533 6.226 -16.694 1.00 0.00 H new ATOM 0 HG23 ILE A 135 15.461 4.900 -15.509 1.00 0.00 H new ATOM 0 HD11 ILE A 135 17.939 2.580 -14.421 1.00 0.00 H new ATOM 0 HD12 ILE A 135 16.965 4.067 -14.327 1.00 0.00 H new ATOM 0 HD13 ILE A 135 16.358 2.660 -15.234 1.00 0.00 H new ATOM 2070 N GLY A 136 17.229 2.337 -19.475 1.00 0.00 N ATOM 2071 CA GLY A 136 17.883 1.926 -20.705 1.00 0.00 C ATOM 2072 C GLY A 136 19.357 2.336 -20.705 1.00 0.00 C ATOM 2073 O GLY A 136 19.922 2.634 -21.755 1.00 0.00 O ATOM 0 H GLY A 136 17.158 1.607 -18.766 1.00 0.00 H new ATOM 0 HA2 GLY A 136 17.802 0.845 -20.820 1.00 0.00 H new ATOM 0 HA3 GLY A 136 17.376 2.376 -21.559 1.00 0.00 H new ATOM 2077 N GLU A 137 19.938 2.335 -19.514 1.00 0.00 N ATOM 2078 CA GLU A 137 21.336 2.704 -19.363 1.00 0.00 C ATOM 2079 C GLU A 137 22.159 1.492 -18.920 1.00 0.00 C ATOM 2080 O GLU A 137 21.601 0.457 -18.557 1.00 0.00 O ATOM 2081 CB GLU A 137 21.495 3.864 -18.378 1.00 0.00 C ATOM 2082 CG GLU A 137 21.887 5.151 -19.106 1.00 0.00 C ATOM 2083 CD GLU A 137 22.820 6.005 -18.243 1.00 0.00 C ATOM 2084 OE1 GLU A 137 23.850 5.452 -17.803 1.00 0.00 O ATOM 2085 OE2 GLU A 137 22.481 7.191 -18.045 1.00 0.00 O ATOM 0 H GLU A 137 19.467 2.085 -18.645 1.00 0.00 H new ATOM 0 HA GLU A 137 21.709 3.039 -20.331 1.00 0.00 H new ATOM 0 HB2 GLU A 137 20.561 4.018 -17.838 1.00 0.00 H new ATOM 0 HB3 GLU A 137 22.255 3.615 -17.637 1.00 0.00 H new ATOM 0 HG2 GLU A 137 22.379 4.906 -20.047 1.00 0.00 H new ATOM 0 HG3 GLU A 137 20.991 5.721 -19.354 1.00 0.00 H new ATOM 2092 N VAL A 138 23.473 1.661 -18.963 1.00 0.00 N ATOM 2093 CA VAL A 138 24.376 0.594 -18.571 1.00 0.00 C ATOM 2094 C VAL A 138 24.394 0.480 -17.045 1.00 0.00 C ATOM 2095 O VAL A 138 25.020 1.292 -16.366 1.00 0.00 O ATOM 2096 CB VAL A 138 25.764 0.838 -19.169 1.00 0.00 C ATOM 2097 CG1 VAL A 138 25.680 1.054 -20.681 1.00 0.00 C ATOM 2098 CG2 VAL A 138 26.456 2.020 -18.484 1.00 0.00 C ATOM 0 H VAL A 138 23.933 2.521 -19.263 1.00 0.00 H new ATOM 0 HA VAL A 138 24.030 -0.362 -18.964 1.00 0.00 H new ATOM 0 HB VAL A 138 26.366 -0.053 -18.991 1.00 0.00 H new ATOM 0 HG11 VAL A 138 26.680 1.225 -21.080 1.00 0.00 H new ATOM 0 HG12 VAL A 138 25.248 0.171 -21.151 1.00 0.00 H new ATOM 0 HG13 VAL A 138 25.053 1.920 -20.890 1.00 0.00 H new ATOM 0 HG21 VAL A 138 27.440 2.172 -18.927 1.00 0.00 H new ATOM 0 HG22 VAL A 138 25.855 2.920 -18.616 1.00 0.00 H new ATOM 0 HG23 VAL A 138 26.566 1.810 -17.420 1.00 0.00 H new ATOM 2108 N LEU A 139 23.700 -0.535 -16.552 1.00 0.00 N ATOM 2109 CA LEU A 139 23.627 -0.764 -15.118 1.00 0.00 C ATOM 2110 C LEU A 139 22.865 -2.063 -14.853 1.00 0.00 C ATOM 2111 O LEU A 139 23.264 -2.859 -14.003 1.00 0.00 O ATOM 2112 CB LEU A 139 23.031 0.455 -14.410 1.00 0.00 C ATOM 2113 CG LEU A 139 23.514 0.700 -12.979 1.00 0.00 C ATOM 2114 CD1 LEU A 139 23.593 2.197 -12.677 1.00 0.00 C ATOM 2115 CD2 LEU A 139 22.637 -0.044 -11.969 1.00 0.00 C ATOM 0 H LEU A 139 23.184 -1.208 -17.119 1.00 0.00 H new ATOM 0 HA LEU A 139 24.626 -0.889 -14.700 1.00 0.00 H new ATOM 0 HB2 LEU A 139 23.254 1.341 -15.005 1.00 0.00 H new ATOM 0 HB3 LEU A 139 21.947 0.347 -14.393 1.00 0.00 H new ATOM 0 HG LEU A 139 24.523 0.299 -12.885 1.00 0.00 H new ATOM 0 HD11 LEU A 139 23.939 2.344 -11.654 1.00 0.00 H new ATOM 0 HD12 LEU A 139 24.291 2.671 -13.367 1.00 0.00 H new ATOM 0 HD13 LEU A 139 22.606 2.644 -12.794 1.00 0.00 H new ATOM 0 HD21 LEU A 139 23.002 0.147 -10.960 1.00 0.00 H new ATOM 0 HD22 LEU A 139 21.608 0.304 -12.055 1.00 0.00 H new ATOM 0 HD23 LEU A 139 22.676 -1.114 -12.172 1.00 0.00 H new ATOM 2127 N ALA A 140 21.781 -2.239 -15.596 1.00 0.00 N ATOM 2128 CA ALA A 140 20.960 -3.429 -15.452 1.00 0.00 C ATOM 2129 C ALA A 140 21.100 -4.296 -16.704 1.00 0.00 C ATOM 2130 O ALA A 140 21.594 -3.833 -17.732 1.00 0.00 O ATOM 2131 CB ALA A 140 19.511 -3.019 -15.184 1.00 0.00 C ATOM 0 H ALA A 140 21.453 -1.577 -16.299 1.00 0.00 H new ATOM 0 HA ALA A 140 21.293 -4.025 -14.602 1.00 0.00 H new ATOM 0 HB1 ALA A 140 18.894 -3.911 -15.076 1.00 0.00 H new ATOM 0 HB2 ALA A 140 19.463 -2.431 -14.267 1.00 0.00 H new ATOM 0 HB3 ALA A 140 19.142 -2.422 -16.018 1.00 0.00 H new ATOM 2137 N GLU A 141 20.657 -5.538 -16.578 1.00 0.00 N ATOM 2138 CA GLU A 141 20.726 -6.473 -17.688 1.00 0.00 C ATOM 2139 C GLU A 141 19.718 -6.086 -18.773 1.00 0.00 C ATOM 2140 O GLU A 141 18.558 -6.492 -18.722 1.00 0.00 O ATOM 2141 CB GLU A 141 20.493 -7.908 -17.212 1.00 0.00 C ATOM 2142 CG GLU A 141 21.431 -8.882 -17.927 1.00 0.00 C ATOM 2143 CD GLU A 141 21.152 -8.909 -19.431 1.00 0.00 C ATOM 2144 OE1 GLU A 141 20.003 -9.245 -19.789 1.00 0.00 O ATOM 2145 OE2 GLU A 141 22.094 -8.590 -20.188 1.00 0.00 O ATOM 0 H GLU A 141 20.249 -5.919 -15.724 1.00 0.00 H new ATOM 0 HA GLU A 141 21.728 -6.424 -18.115 1.00 0.00 H new ATOM 0 HB2 GLU A 141 20.652 -7.968 -16.135 1.00 0.00 H new ATOM 0 HB3 GLU A 141 19.457 -8.193 -17.397 1.00 0.00 H new ATOM 0 HG2 GLU A 141 22.466 -8.590 -17.751 1.00 0.00 H new ATOM 0 HG3 GLU A 141 21.307 -9.882 -17.513 1.00 0.00 H new ATOM 2152 N VAL A 142 20.197 -5.304 -19.729 1.00 0.00 N ATOM 2153 CA VAL A 142 19.352 -4.856 -20.823 1.00 0.00 C ATOM 2154 C VAL A 142 19.410 -5.882 -21.958 1.00 0.00 C ATOM 2155 O VAL A 142 19.495 -7.084 -21.709 1.00 0.00 O ATOM 2156 CB VAL A 142 19.769 -3.453 -21.267 1.00 0.00 C ATOM 2157 CG1 VAL A 142 21.155 -3.471 -21.915 1.00 0.00 C ATOM 2158 CG2 VAL A 142 18.730 -2.844 -22.210 1.00 0.00 C ATOM 0 H VAL A 142 21.160 -4.969 -19.769 1.00 0.00 H new ATOM 0 HA VAL A 142 18.314 -4.785 -20.499 1.00 0.00 H new ATOM 0 HB VAL A 142 19.824 -2.824 -20.379 1.00 0.00 H new ATOM 0 HG11 VAL A 142 21.427 -2.461 -22.221 1.00 0.00 H new ATOM 0 HG12 VAL A 142 21.887 -3.842 -21.198 1.00 0.00 H new ATOM 0 HG13 VAL A 142 21.140 -4.123 -22.788 1.00 0.00 H new ATOM 0 HG21 VAL A 142 19.051 -1.847 -22.510 1.00 0.00 H new ATOM 0 HG22 VAL A 142 18.627 -3.474 -23.094 1.00 0.00 H new ATOM 0 HG23 VAL A 142 17.770 -2.777 -21.699 1.00 0.00 H new