USER MOD reduce.3.24.130724 H: found=0, std=0, add=1184, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1180 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 140 MET CE :methyl -139:sc= -0.844 (180deg=-0.0293) USER MOD Set 1.2: B 5 GLN : amide:sc= -0.272 K(o=-1.1,f=-3.9!) USER MOD Set 2.1: A 105 MET CE :methyl -174:sc= -0.0341 (180deg=-0.0525) USER MOD Set 2.2: B 7 THR OG1 : rot 85:sc= 1.19 USER MOD Set 3.1: A 56 ASN : amide:sc= 0.803 K(o=1.3,f=-3.3!) USER MOD Set 3.2: A 58 THR OG1 : rot 15:sc= 0.457 USER MOD Single : A 4 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 SER OG : rot 55:sc= 0.0492 USER MOD Single : A 17 LYS NZ :NH3+ -167:sc= 1.14 (180deg=0.993) USER MOD Single : A 22 THR OG1 : rot -56:sc= 1.28 USER MOD Single : A 24 THR OG1 : rot -76:sc= 0.157 USER MOD Single : A 25 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 THR OG1 : rot 70:sc= 0.872 USER MOD Single : A 32 MET CE :methyl -110:sc= -0.0282 (180deg=-0.327) USER MOD Single : A 34 SER OG : rot 89:sc= 1.25 USER MOD Single : A 37 GLN : amide:sc= -0.112 K(o=-0.11,f=-1.9!) USER MOD Single : A 38 ASN : amide:sc= -0.171 K(o=-0.17,f=-1.6) USER MOD Single : A 40 THR OG1 : rot 134:sc= 1.34 USER MOD Single : A 45 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 47 MET CE :methyl -117:sc= -0.228 (180deg=-1.58!) USER MOD Single : A 49 ASN : amide:sc= -0.191 K(o=-0.19,f=-1.2) USER MOD Single : A 66 THR OG1 : rot 90:sc= 0.517 USER MOD Single : A 67 MET CE :methyl -108:sc= -0.499 (180deg=-3.22!) USER MOD Single : A 68 MET CE :methyl -171:sc= 0 (180deg=-0.0823) USER MOD Single : A 71 LYS NZ :NH3+ -116:sc= 0.24 (180deg=-0.0015) USER MOD Single : A 72 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 73 LYS NZ :NH3+ 152:sc= -0.0265 (180deg=-0.395) USER MOD Single : A 75 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot 68:sc= 1.06 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 ASN : amide:sc= 0.232 K(o=0.23,f=-1.6!) USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 SER OG : rot 180:sc= -0.0931 USER MOD Single : A 103 HIS : no HD1:sc= -0.164 X(o=-0.16,f=-0.019) USER MOD Single : A 106 THR OG1 : rot 76:sc= 0.502 USER MOD Single : A 107 ASN : amide:sc= -0.0465 K(o=-0.046,f=-1.5) USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 THR OG1 : rot 180:sc= 0 USER MOD Single : A 120 MET CE :methyl 148:sc= -0.845 (180deg=-2.78) USER MOD Single : A 131 GLN : amide:sc= 0.032 X(o=0.032,f=-0.22) USER MOD Single : A 133 ASN : amide:sc= -0.145 K(o=-0.15,f=-6.6!) USER MOD Single : A 134 TYR OH : rot -160:sc= 0.192 USER MOD Single : A 139 GLN : amide:sc= 0 K(o=0,f=-0.62) USER MOD Single : A 141 MET CE :methyl -146:sc= -0.614 (180deg=-1.93!) USER MOD Single : A 142 THR OG1 : rot 98:sc= 1.26 USER MOD Single : B 1 ARG N :NH3+ -160:sc= 1.01 (180deg=0.488) USER MOD Single : B 3 LYS NZ :NH3+ -163:sc= 2.14 (180deg=1.06!) USER MOD Single : B 6 LYS NZ :NH3+ -168:sc= 2.43 (180deg=1.79) USER MOD Single : B 9 HIS : no HD1:sc= -1.25 X(o=-1.3,f=-1.3) USER MOD ----------------------------------------------------------------- ATOM 29 N GLU A 3 -0.133 0.350 17.229 1.00 0.00 N ATOM 30 CA GLU A 3 -1.064 -0.237 16.316 1.00 0.00 C ATOM 31 C GLU A 3 -0.761 -0.112 14.863 1.00 0.00 C ATOM 32 O GLU A 3 -0.887 -1.042 14.068 1.00 0.00 O ATOM 33 CB GLU A 3 -2.526 0.130 16.624 1.00 0.00 C ATOM 34 CG GLU A 3 -3.586 -0.650 15.844 1.00 0.00 C ATOM 35 CD GLU A 3 -5.013 -0.327 16.260 1.00 0.00 C ATOM 36 OE1 GLU A 3 -5.515 0.769 15.893 1.00 0.00 O ATOM 37 OE2 GLU A 3 -5.629 -1.078 17.062 1.00 0.00 O ATOM 0 HA GLU A 3 -0.925 -1.300 16.514 1.00 0.00 H new ATOM 0 HB2 GLU A 3 -2.702 -0.020 17.689 1.00 0.00 H new ATOM 0 HB3 GLU A 3 -2.664 1.193 16.425 1.00 0.00 H new ATOM 0 HG2 GLU A 3 -3.470 -0.439 14.781 1.00 0.00 H new ATOM 0 HG3 GLU A 3 -3.411 -1.717 15.978 1.00 0.00 H new ATOM 44 N GLN A 4 -0.258 1.062 14.441 1.00 0.00 N ATOM 45 CA GLN A 4 0.327 1.370 13.173 1.00 0.00 C ATOM 46 C GLN A 4 1.591 0.621 12.926 1.00 0.00 C ATOM 47 O GLN A 4 1.925 0.227 11.810 1.00 0.00 O ATOM 48 CB GLN A 4 0.546 2.883 13.004 1.00 0.00 C ATOM 49 CG GLN A 4 1.353 3.348 11.790 1.00 0.00 C ATOM 50 CD GLN A 4 1.350 4.854 11.567 1.00 0.00 C ATOM 51 OE1 GLN A 4 2.359 5.547 11.691 1.00 0.00 O ATOM 52 NE2 GLN A 4 0.199 5.430 11.130 1.00 0.00 N ATOM 0 H GLN A 4 -0.263 1.878 15.053 1.00 0.00 H new ATOM 0 HA GLN A 4 -0.390 1.043 12.420 1.00 0.00 H new ATOM 0 HB2 GLN A 4 -0.432 3.362 12.961 1.00 0.00 H new ATOM 0 HB3 GLN A 4 1.043 3.253 13.901 1.00 0.00 H new ATOM 0 HG2 GLN A 4 2.384 3.013 11.905 1.00 0.00 H new ATOM 0 HG3 GLN A 4 0.957 2.861 10.899 1.00 0.00 H new ATOM 0 HE21 GLN A 4 -0.645 4.867 11.023 1.00 0.00 H new ATOM 0 HE22 GLN A 4 0.179 6.426 10.909 1.00 0.00 H new ATOM 61 N ILE A 5 2.392 0.399 13.983 1.00 0.00 N ATOM 62 CA ILE A 5 3.597 -0.359 13.847 1.00 0.00 C ATOM 63 C ILE A 5 3.346 -1.811 13.627 1.00 0.00 C ATOM 64 O ILE A 5 3.885 -2.439 12.717 1.00 0.00 O ATOM 65 CB ILE A 5 4.471 -0.135 15.045 1.00 0.00 C ATOM 66 CG1 ILE A 5 4.889 1.345 15.044 1.00 0.00 C ATOM 67 CG2 ILE A 5 5.736 -1.010 15.076 1.00 0.00 C ATOM 68 CD1 ILE A 5 5.570 1.757 16.348 1.00 0.00 C ATOM 0 H ILE A 5 2.208 0.742 14.926 1.00 0.00 H new ATOM 0 HA ILE A 5 4.110 -0.005 12.953 1.00 0.00 H new ATOM 0 HB ILE A 5 3.893 -0.411 15.927 1.00 0.00 H new ATOM 0 HG12 ILE A 5 5.566 1.528 14.210 1.00 0.00 H new ATOM 0 HG13 ILE A 5 4.009 1.968 14.884 1.00 0.00 H new ATOM 0 HG21 ILE A 5 6.312 -0.786 15.974 1.00 0.00 H new ATOM 0 HG22 ILE A 5 5.451 -2.062 15.081 1.00 0.00 H new ATOM 0 HG23 ILE A 5 6.343 -0.803 14.195 1.00 0.00 H new ATOM 0 HD11 ILE A 5 5.846 2.810 16.297 1.00 0.00 H new ATOM 0 HD12 ILE A 5 4.885 1.601 17.181 1.00 0.00 H new ATOM 0 HD13 ILE A 5 6.466 1.154 16.497 1.00 0.00 H new ATOM 80 N ALA A 6 2.421 -2.425 14.386 1.00 0.00 N ATOM 81 CA ALA A 6 2.022 -3.783 14.188 1.00 0.00 C ATOM 82 C ALA A 6 1.528 -4.161 12.833 1.00 0.00 C ATOM 83 O ALA A 6 1.790 -5.247 12.321 1.00 0.00 O ATOM 84 CB ALA A 6 0.856 -4.076 15.147 1.00 0.00 C ATOM 0 H ALA A 6 1.938 -1.965 15.158 1.00 0.00 H new ATOM 0 HA ALA A 6 2.936 -4.354 14.353 1.00 0.00 H new ATOM 0 HB1 ALA A 6 0.529 -5.108 15.018 1.00 0.00 H new ATOM 0 HB2 ALA A 6 1.184 -3.925 16.175 1.00 0.00 H new ATOM 0 HB3 ALA A 6 0.027 -3.403 14.928 1.00 0.00 H new ATOM 90 N GLU A 7 0.756 -3.222 12.257 1.00 0.00 N ATOM 91 CA GLU A 7 0.182 -3.330 10.952 1.00 0.00 C ATOM 92 C GLU A 7 1.212 -3.343 9.876 1.00 0.00 C ATOM 93 O GLU A 7 1.072 -4.070 8.894 1.00 0.00 O ATOM 94 CB GLU A 7 -0.698 -2.071 10.869 1.00 0.00 C ATOM 95 CG GLU A 7 -1.419 -1.789 9.550 1.00 0.00 C ATOM 96 CD GLU A 7 -2.305 -0.558 9.676 1.00 0.00 C ATOM 97 OE1 GLU A 7 -3.349 -0.489 10.377 1.00 0.00 O ATOM 98 OE2 GLU A 7 -1.862 0.416 9.010 1.00 0.00 O ATOM 0 H GLU A 7 0.521 -2.346 12.724 1.00 0.00 H new ATOM 0 HA GLU A 7 -0.366 -4.261 10.808 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -1.451 -2.137 11.655 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -0.072 -1.209 11.099 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -0.689 -1.638 8.755 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -2.023 -2.651 9.268 1.00 0.00 H new ATOM 105 N PHE A 8 2.374 -2.680 10.015 1.00 0.00 N ATOM 106 CA PHE A 8 3.387 -2.670 9.005 1.00 0.00 C ATOM 107 C PHE A 8 4.219 -3.874 9.283 1.00 0.00 C ATOM 108 O PHE A 8 4.682 -4.485 8.321 1.00 0.00 O ATOM 109 CB PHE A 8 4.345 -1.506 9.309 1.00 0.00 C ATOM 110 CG PHE A 8 5.318 -1.343 8.193 1.00 0.00 C ATOM 111 CD1 PHE A 8 4.740 -1.102 6.969 1.00 0.00 C ATOM 112 CD2 PHE A 8 6.682 -1.480 8.310 1.00 0.00 C ATOM 113 CE1 PHE A 8 5.572 -0.882 5.896 1.00 0.00 C ATOM 114 CE2 PHE A 8 7.483 -1.124 7.250 1.00 0.00 C ATOM 115 CZ PHE A 8 6.924 -0.703 6.066 1.00 0.00 C ATOM 0 H PHE A 8 2.615 -2.140 10.846 1.00 0.00 H new ATOM 0 HA PHE A 8 2.953 -2.617 8.006 1.00 0.00 H new ATOM 0 HB2 PHE A 8 3.779 -0.585 9.447 1.00 0.00 H new ATOM 0 HB3 PHE A 8 4.877 -1.696 10.241 1.00 0.00 H new ATOM 0 HD1 PHE A 8 3.666 -1.086 6.854 1.00 0.00 H new ATOM 0 HD2 PHE A 8 7.118 -1.862 9.221 1.00 0.00 H new ATOM 0 HE1 PHE A 8 5.155 -0.849 4.900 1.00 0.00 H new ATOM 0 HE2 PHE A 8 8.557 -1.175 7.348 1.00 0.00 H new ATOM 0 HZ PHE A 8 7.528 -0.247 5.295 1.00 0.00 H new ATOM 125 N LYS A 9 4.478 -4.255 10.547 1.00 0.00 N ATOM 126 CA LYS A 9 5.321 -5.335 10.956 1.00 0.00 C ATOM 127 C LYS A 9 4.843 -6.729 10.737 1.00 0.00 C ATOM 128 O LYS A 9 5.642 -7.566 10.320 1.00 0.00 O ATOM 129 CB LYS A 9 5.785 -5.021 12.388 1.00 0.00 C ATOM 130 CG LYS A 9 7.205 -5.560 12.578 1.00 0.00 C ATOM 131 CD LYS A 9 7.738 -5.017 13.906 1.00 0.00 C ATOM 132 CE LYS A 9 9.165 -5.538 14.089 1.00 0.00 C ATOM 133 NZ LYS A 9 9.611 -4.944 15.369 1.00 0.00 N ATOM 0 H LYS A 9 4.065 -3.769 11.343 1.00 0.00 H new ATOM 0 HA LYS A 9 6.164 -5.368 10.266 1.00 0.00 H new ATOM 0 HB2 LYS A 9 5.763 -3.946 12.564 1.00 0.00 H new ATOM 0 HB3 LYS A 9 5.109 -5.476 13.112 1.00 0.00 H new ATOM 0 HG2 LYS A 9 7.202 -6.650 12.585 1.00 0.00 H new ATOM 0 HG3 LYS A 9 7.846 -5.248 11.753 1.00 0.00 H new ATOM 0 HD2 LYS A 9 7.727 -3.927 13.904 1.00 0.00 H new ATOM 0 HD3 LYS A 9 7.105 -5.341 14.732 1.00 0.00 H new ATOM 0 HE2 LYS A 9 9.189 -6.627 14.126 1.00 0.00 H new ATOM 0 HE3 LYS A 9 9.808 -5.233 13.264 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 10.584 -5.250 15.573 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 9.582 -3.907 15.299 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 8.981 -5.257 16.135 1.00 0.00 H new ATOM 147 N GLU A 10 3.530 -6.951 10.923 1.00 0.00 N ATOM 148 CA GLU A 10 2.838 -8.151 10.568 1.00 0.00 C ATOM 149 C GLU A 10 2.834 -8.421 9.103 1.00 0.00 C ATOM 150 O GLU A 10 3.000 -9.502 8.541 1.00 0.00 O ATOM 151 CB GLU A 10 1.396 -8.162 11.105 1.00 0.00 C ATOM 152 CG GLU A 10 0.778 -9.561 11.131 1.00 0.00 C ATOM 153 CD GLU A 10 -0.680 -9.517 11.564 1.00 0.00 C ATOM 154 OE1 GLU A 10 -0.869 -8.881 12.635 1.00 0.00 O ATOM 155 OE2 GLU A 10 -1.638 -10.041 10.934 1.00 0.00 O ATOM 0 H GLU A 10 2.917 -6.253 11.345 1.00 0.00 H new ATOM 0 HA GLU A 10 3.400 -8.954 11.045 1.00 0.00 H new ATOM 0 HB2 GLU A 10 1.387 -7.748 12.113 1.00 0.00 H new ATOM 0 HB3 GLU A 10 0.779 -7.510 10.487 1.00 0.00 H new ATOM 0 HG2 GLU A 10 0.851 -10.011 10.141 1.00 0.00 H new ATOM 0 HG3 GLU A 10 1.342 -10.197 11.813 1.00 0.00 H new ATOM 162 N ALA A 11 2.689 -7.354 8.297 1.00 0.00 N ATOM 163 CA ALA A 11 2.959 -7.352 6.893 1.00 0.00 C ATOM 164 C ALA A 11 4.365 -7.512 6.426 1.00 0.00 C ATOM 165 O ALA A 11 4.526 -8.183 5.408 1.00 0.00 O ATOM 166 CB ALA A 11 2.439 -6.030 6.302 1.00 0.00 C ATOM 0 H ALA A 11 2.368 -6.449 8.641 1.00 0.00 H new ATOM 0 HA ALA A 11 2.457 -8.257 6.550 1.00 0.00 H new ATOM 0 HB1 ALA A 11 2.636 -6.008 5.230 1.00 0.00 H new ATOM 0 HB2 ALA A 11 1.366 -5.951 6.476 1.00 0.00 H new ATOM 0 HB3 ALA A 11 2.947 -5.193 6.781 1.00 0.00 H new ATOM 172 N PHE A 12 5.413 -7.021 7.111 1.00 0.00 N ATOM 173 CA PHE A 12 6.783 -7.315 6.826 1.00 0.00 C ATOM 174 C PHE A 12 7.007 -8.786 6.920 1.00 0.00 C ATOM 175 O PHE A 12 7.758 -9.350 6.126 1.00 0.00 O ATOM 176 CB PHE A 12 7.618 -6.555 7.871 1.00 0.00 C ATOM 177 CG PHE A 12 9.066 -6.724 7.562 1.00 0.00 C ATOM 178 CD1 PHE A 12 9.605 -5.782 6.718 1.00 0.00 C ATOM 179 CD2 PHE A 12 9.846 -7.697 8.140 1.00 0.00 C ATOM 180 CE1 PHE A 12 10.926 -5.934 6.365 1.00 0.00 C ATOM 181 CE2 PHE A 12 11.193 -7.775 7.877 1.00 0.00 C ATOM 182 CZ PHE A 12 11.718 -6.872 6.983 1.00 0.00 C ATOM 0 H PHE A 12 5.299 -6.388 7.903 1.00 0.00 H new ATOM 0 HA PHE A 12 7.066 -7.008 5.819 1.00 0.00 H new ATOM 0 HB2 PHE A 12 7.354 -5.497 7.865 1.00 0.00 H new ATOM 0 HB3 PHE A 12 7.401 -6.932 8.871 1.00 0.00 H new ATOM 0 HD1 PHE A 12 9.016 -4.956 6.347 1.00 0.00 H new ATOM 0 HD2 PHE A 12 9.393 -8.412 8.811 1.00 0.00 H new ATOM 0 HE1 PHE A 12 11.346 -5.308 5.592 1.00 0.00 H new ATOM 0 HE2 PHE A 12 11.815 -8.517 8.355 1.00 0.00 H new ATOM 0 HZ PHE A 12 12.775 -6.900 6.762 1.00 0.00 H new ATOM 192 N SER A 13 6.357 -9.497 7.858 1.00 0.00 N ATOM 193 CA SER A 13 6.371 -10.909 8.085 1.00 0.00 C ATOM 194 C SER A 13 5.918 -11.690 6.900 1.00 0.00 C ATOM 195 O SER A 13 6.183 -12.889 6.825 1.00 0.00 O ATOM 196 CB SER A 13 5.686 -11.477 9.339 1.00 0.00 C ATOM 197 OG SER A 13 6.111 -10.785 10.504 1.00 0.00 O ATOM 0 H SER A 13 5.754 -9.026 8.532 1.00 0.00 H new ATOM 0 HA SER A 13 7.435 -11.040 8.279 1.00 0.00 H new ATOM 0 HB2 SER A 13 4.604 -11.395 9.236 1.00 0.00 H new ATOM 0 HB3 SER A 13 5.917 -12.538 9.436 1.00 0.00 H new ATOM 0 HG SER A 13 5.963 -9.824 10.386 1.00 0.00 H new ATOM 203 N LEU A 14 5.142 -11.120 5.960 1.00 0.00 N ATOM 204 CA LEU A 14 4.763 -11.629 4.679 1.00 0.00 C ATOM 205 C LEU A 14 5.889 -11.836 3.725 1.00 0.00 C ATOM 206 O LEU A 14 5.931 -12.894 3.099 1.00 0.00 O ATOM 207 CB LEU A 14 3.641 -10.845 3.976 1.00 0.00 C ATOM 208 CG LEU A 14 2.324 -10.658 4.749 1.00 0.00 C ATOM 209 CD1 LEU A 14 1.467 -9.642 3.976 1.00 0.00 C ATOM 210 CD2 LEU A 14 1.574 -11.978 4.989 1.00 0.00 C ATOM 0 H LEU A 14 4.736 -10.198 6.120 1.00 0.00 H new ATOM 0 HA LEU A 14 4.370 -12.609 4.950 1.00 0.00 H new ATOM 0 HB2 LEU A 14 4.027 -9.858 3.722 1.00 0.00 H new ATOM 0 HB3 LEU A 14 3.413 -11.350 3.037 1.00 0.00 H new ATOM 0 HG LEU A 14 2.547 -10.282 5.748 1.00 0.00 H new ATOM 0 HD11 LEU A 14 0.524 -9.488 4.500 1.00 0.00 H new ATOM 0 HD12 LEU A 14 2.002 -8.695 3.905 1.00 0.00 H new ATOM 0 HD13 LEU A 14 1.267 -10.022 2.974 1.00 0.00 H new ATOM 0 HD21 LEU A 14 0.654 -11.779 5.539 1.00 0.00 H new ATOM 0 HD22 LEU A 14 1.332 -12.438 4.031 1.00 0.00 H new ATOM 0 HD23 LEU A 14 2.203 -12.654 5.568 1.00 0.00 H new ATOM 222 N PHE A 15 6.834 -10.879 3.704 1.00 0.00 N ATOM 223 CA PHE A 15 7.951 -11.092 2.837 1.00 0.00 C ATOM 224 C PHE A 15 9.032 -11.862 3.514 1.00 0.00 C ATOM 225 O PHE A 15 9.651 -12.767 2.957 1.00 0.00 O ATOM 226 CB PHE A 15 8.463 -9.682 2.498 1.00 0.00 C ATOM 227 CG PHE A 15 7.454 -8.893 1.737 1.00 0.00 C ATOM 228 CD1 PHE A 15 7.029 -9.311 0.498 1.00 0.00 C ATOM 229 CD2 PHE A 15 6.906 -7.772 2.315 1.00 0.00 C ATOM 230 CE1 PHE A 15 6.235 -8.488 -0.266 1.00 0.00 C ATOM 231 CE2 PHE A 15 6.010 -6.995 1.619 1.00 0.00 C ATOM 232 CZ PHE A 15 5.799 -7.312 0.298 1.00 0.00 C ATOM 0 H PHE A 15 6.833 -10.015 4.246 1.00 0.00 H new ATOM 0 HA PHE A 15 7.661 -11.667 1.957 1.00 0.00 H new ATOM 0 HB2 PHE A 15 8.716 -9.156 3.419 1.00 0.00 H new ATOM 0 HB3 PHE A 15 9.380 -9.759 1.913 1.00 0.00 H new ATOM 0 HD1 PHE A 15 7.318 -10.283 0.126 1.00 0.00 H new ATOM 0 HD2 PHE A 15 7.181 -7.500 3.323 1.00 0.00 H new ATOM 0 HE1 PHE A 15 5.963 -8.757 -1.276 1.00 0.00 H new ATOM 0 HE2 PHE A 15 5.494 -6.171 2.090 1.00 0.00 H new ATOM 0 HZ PHE A 15 5.268 -6.607 -0.324 1.00 0.00 H new ATOM 242 N ASP A 16 9.333 -11.634 4.805 1.00 0.00 N ATOM 243 CA ASP A 16 10.384 -12.344 5.465 1.00 0.00 C ATOM 244 C ASP A 16 9.859 -13.632 6.000 1.00 0.00 C ATOM 245 O ASP A 16 9.180 -13.713 7.023 1.00 0.00 O ATOM 246 CB ASP A 16 11.019 -11.533 6.608 1.00 0.00 C ATOM 247 CG ASP A 16 12.282 -12.233 7.088 1.00 0.00 C ATOM 248 OD1 ASP A 16 12.766 -13.187 6.422 1.00 0.00 O ATOM 249 OD2 ASP A 16 12.698 -11.845 8.212 1.00 0.00 O ATOM 0 H ASP A 16 8.847 -10.956 5.393 1.00 0.00 H new ATOM 0 HA ASP A 16 11.163 -12.528 4.725 1.00 0.00 H new ATOM 0 HB2 ASP A 16 11.257 -10.526 6.265 1.00 0.00 H new ATOM 0 HB3 ASP A 16 10.312 -11.431 7.431 1.00 0.00 H new ATOM 254 N LYS A 17 10.373 -14.665 5.310 1.00 0.00 N ATOM 255 CA LYS A 17 9.944 -15.997 5.606 1.00 0.00 C ATOM 256 C LYS A 17 10.606 -16.646 6.772 1.00 0.00 C ATOM 257 O LYS A 17 10.040 -17.565 7.361 1.00 0.00 O ATOM 258 CB LYS A 17 9.900 -16.937 4.389 1.00 0.00 C ATOM 259 CG LYS A 17 9.207 -16.294 3.186 1.00 0.00 C ATOM 260 CD LYS A 17 7.731 -15.933 3.369 1.00 0.00 C ATOM 261 CE LYS A 17 6.858 -15.826 2.117 1.00 0.00 C ATOM 262 NZ LYS A 17 5.435 -15.547 2.411 1.00 0.00 N ATOM 0 H LYS A 17 11.067 -14.584 4.567 1.00 0.00 H new ATOM 0 HA LYS A 17 8.912 -15.831 5.916 1.00 0.00 H new ATOM 0 HB2 LYS A 17 10.916 -17.219 4.113 1.00 0.00 H new ATOM 0 HB3 LYS A 17 9.377 -17.854 4.660 1.00 0.00 H new ATOM 0 HG2 LYS A 17 9.751 -15.387 2.922 1.00 0.00 H new ATOM 0 HG3 LYS A 17 9.291 -16.974 2.339 1.00 0.00 H new ATOM 0 HD2 LYS A 17 7.283 -16.679 4.026 1.00 0.00 H new ATOM 0 HD3 LYS A 17 7.683 -14.978 3.892 1.00 0.00 H new ATOM 0 HE2 LYS A 17 7.250 -15.036 1.477 1.00 0.00 H new ATOM 0 HE3 LYS A 17 6.929 -16.757 1.554 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 4.866 -15.704 1.554 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 5.106 -16.182 3.166 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 5.331 -14.559 2.719 1.00 0.00 H new ATOM 276 N ASP A 18 11.694 -16.002 7.233 1.00 0.00 N ATOM 277 CA ASP A 18 12.454 -16.513 8.331 1.00 0.00 C ATOM 278 C ASP A 18 11.996 -16.022 9.661 1.00 0.00 C ATOM 279 O ASP A 18 11.479 -16.737 10.517 1.00 0.00 O ATOM 280 CB ASP A 18 13.988 -16.409 8.391 1.00 0.00 C ATOM 281 CG ASP A 18 14.458 -16.935 7.042 1.00 0.00 C ATOM 282 OD1 ASP A 18 14.185 -18.100 6.648 1.00 0.00 O ATOM 283 OD2 ASP A 18 15.074 -16.128 6.295 1.00 0.00 O ATOM 0 H ASP A 18 12.047 -15.127 6.845 1.00 0.00 H new ATOM 0 HA ASP A 18 12.235 -17.557 8.105 1.00 0.00 H new ATOM 0 HB2 ASP A 18 14.310 -15.380 8.550 1.00 0.00 H new ATOM 0 HB3 ASP A 18 14.394 -17.001 9.211 1.00 0.00 H new ATOM 288 N GLY A 19 12.179 -14.708 9.883 1.00 0.00 N ATOM 289 CA GLY A 19 12.070 -14.062 11.154 1.00 0.00 C ATOM 290 C GLY A 19 13.417 -13.590 11.585 1.00 0.00 C ATOM 291 O GLY A 19 13.726 -13.553 12.774 1.00 0.00 O ATOM 0 H GLY A 19 12.417 -14.060 9.132 1.00 0.00 H new ATOM 0 HA2 GLY A 19 11.381 -13.220 11.089 1.00 0.00 H new ATOM 0 HA3 GLY A 19 11.661 -14.752 11.892 1.00 0.00 H new ATOM 295 N ASP A 20 14.247 -13.204 10.600 1.00 0.00 N ATOM 296 CA ASP A 20 15.566 -12.711 10.852 1.00 0.00 C ATOM 297 C ASP A 20 15.616 -11.222 10.834 1.00 0.00 C ATOM 298 O ASP A 20 16.157 -10.637 11.770 1.00 0.00 O ATOM 299 CB ASP A 20 16.626 -13.333 9.927 1.00 0.00 C ATOM 300 CG ASP A 20 16.565 -13.129 8.420 1.00 0.00 C ATOM 301 OD1 ASP A 20 15.504 -13.022 7.748 1.00 0.00 O ATOM 302 OD2 ASP A 20 17.718 -13.059 7.916 1.00 0.00 O ATOM 0 H ASP A 20 13.998 -13.235 9.611 1.00 0.00 H new ATOM 0 HA ASP A 20 15.821 -13.031 11.862 1.00 0.00 H new ATOM 0 HB2 ASP A 20 17.597 -12.965 10.260 1.00 0.00 H new ATOM 0 HB3 ASP A 20 16.614 -14.408 10.105 1.00 0.00 H new ATOM 307 N GLY A 21 15.047 -10.669 9.748 1.00 0.00 N ATOM 308 CA GLY A 21 15.020 -9.245 9.613 1.00 0.00 C ATOM 309 C GLY A 21 15.281 -8.836 8.204 1.00 0.00 C ATOM 310 O GLY A 21 14.965 -7.719 7.800 1.00 0.00 O ATOM 0 H GLY A 21 14.617 -11.189 8.983 1.00 0.00 H new ATOM 0 HA2 GLY A 21 14.050 -8.864 9.932 1.00 0.00 H new ATOM 0 HA3 GLY A 21 15.768 -8.800 10.269 1.00 0.00 H new ATOM 314 N THR A 22 15.800 -9.759 7.375 1.00 0.00 N ATOM 315 CA THR A 22 16.329 -9.468 6.079 1.00 0.00 C ATOM 316 C THR A 22 15.639 -10.236 5.005 1.00 0.00 C ATOM 317 O THR A 22 15.675 -11.460 4.894 1.00 0.00 O ATOM 318 CB THR A 22 17.749 -9.923 5.913 1.00 0.00 C ATOM 319 OG1 THR A 22 18.524 -9.387 6.975 1.00 0.00 O ATOM 320 CG2 THR A 22 18.295 -9.348 4.596 1.00 0.00 C ATOM 0 H THR A 22 15.853 -10.748 7.618 1.00 0.00 H new ATOM 0 HA THR A 22 16.209 -8.387 6.000 1.00 0.00 H new ATOM 0 HB THR A 22 17.796 -11.012 5.911 1.00 0.00 H new ATOM 0 HG1 THR A 22 18.430 -8.412 6.989 1.00 0.00 H new ATOM 0 HG21 THR A 22 19.328 -9.669 4.459 1.00 0.00 H new ATOM 0 HG22 THR A 22 17.690 -9.707 3.764 1.00 0.00 H new ATOM 0 HG23 THR A 22 18.255 -8.259 4.630 1.00 0.00 H new ATOM 328 N ILE A 23 14.939 -9.539 4.092 1.00 0.00 N ATOM 329 CA ILE A 23 14.218 -10.069 2.976 1.00 0.00 C ATOM 330 C ILE A 23 15.079 -10.328 1.787 1.00 0.00 C ATOM 331 O ILE A 23 15.756 -9.395 1.358 1.00 0.00 O ATOM 332 CB ILE A 23 13.129 -9.111 2.596 1.00 0.00 C ATOM 333 CG1 ILE A 23 12.259 -8.807 3.828 1.00 0.00 C ATOM 334 CG2 ILE A 23 12.238 -9.731 1.506 1.00 0.00 C ATOM 335 CD1 ILE A 23 11.173 -7.771 3.541 1.00 0.00 C ATOM 0 H ILE A 23 14.873 -8.522 4.140 1.00 0.00 H new ATOM 0 HA ILE A 23 13.809 -11.030 3.288 1.00 0.00 H new ATOM 0 HB ILE A 23 13.583 -8.194 2.221 1.00 0.00 H new ATOM 0 HG12 ILE A 23 11.793 -9.729 4.175 1.00 0.00 H new ATOM 0 HG13 ILE A 23 12.895 -8.447 4.637 1.00 0.00 H new ATOM 0 HG21 ILE A 23 11.450 -9.028 1.237 1.00 0.00 H new ATOM 0 HG22 ILE A 23 12.841 -9.954 0.626 1.00 0.00 H new ATOM 0 HG23 ILE A 23 11.790 -10.651 1.882 1.00 0.00 H new ATOM 0 HD11 ILE A 23 10.590 -7.595 4.445 1.00 0.00 H new ATOM 0 HD12 ILE A 23 11.636 -6.838 3.221 1.00 0.00 H new ATOM 0 HD13 ILE A 23 10.517 -8.140 2.752 1.00 0.00 H new ATOM 347 N THR A 24 15.146 -11.589 1.324 1.00 0.00 N ATOM 348 CA THR A 24 15.960 -11.922 0.197 1.00 0.00 C ATOM 349 C THR A 24 15.194 -11.931 -1.081 1.00 0.00 C ATOM 350 O THR A 24 13.968 -11.843 -1.089 1.00 0.00 O ATOM 351 CB THR A 24 16.543 -13.300 0.313 1.00 0.00 C ATOM 352 OG1 THR A 24 15.545 -14.287 0.529 1.00 0.00 O ATOM 353 CG2 THR A 24 17.545 -13.417 1.473 1.00 0.00 C ATOM 0 H THR A 24 14.638 -12.376 1.729 1.00 0.00 H new ATOM 0 HA THR A 24 16.733 -11.153 0.188 1.00 0.00 H new ATOM 0 HB THR A 24 17.047 -13.469 -0.639 1.00 0.00 H new ATOM 0 HG1 THR A 24 15.242 -14.247 1.460 1.00 0.00 H new ATOM 0 HG21 THR A 24 17.938 -14.433 1.514 1.00 0.00 H new ATOM 0 HG22 THR A 24 18.366 -12.717 1.317 1.00 0.00 H new ATOM 0 HG23 THR A 24 17.043 -13.184 2.412 1.00 0.00 H new ATOM 361 N THR A 25 15.787 -12.050 -2.282 1.00 0.00 N ATOM 362 CA THR A 25 15.019 -11.918 -3.481 1.00 0.00 C ATOM 363 C THR A 25 14.109 -13.057 -3.788 1.00 0.00 C ATOM 364 O THR A 25 13.136 -12.872 -4.518 1.00 0.00 O ATOM 365 CB THR A 25 15.752 -11.690 -4.770 1.00 0.00 C ATOM 366 OG1 THR A 25 16.799 -12.624 -4.986 1.00 0.00 O ATOM 367 CG2 THR A 25 16.456 -10.324 -4.820 1.00 0.00 C ATOM 0 H THR A 25 16.780 -12.234 -2.423 1.00 0.00 H new ATOM 0 HA THR A 25 14.486 -11.013 -3.190 1.00 0.00 H new ATOM 0 HB THR A 25 14.966 -11.777 -5.520 1.00 0.00 H new ATOM 0 HG1 THR A 25 17.240 -12.429 -5.839 1.00 0.00 H new ATOM 0 HG21 THR A 25 16.970 -10.214 -5.775 1.00 0.00 H new ATOM 0 HG22 THR A 25 15.717 -9.530 -4.712 1.00 0.00 H new ATOM 0 HG23 THR A 25 17.181 -10.258 -4.009 1.00 0.00 H new ATOM 375 N LYS A 26 14.293 -14.224 -3.144 1.00 0.00 N ATOM 376 CA LYS A 26 13.453 -15.380 -3.177 1.00 0.00 C ATOM 377 C LYS A 26 12.250 -15.265 -2.305 1.00 0.00 C ATOM 378 O LYS A 26 11.123 -15.632 -2.635 1.00 0.00 O ATOM 379 CB LYS A 26 14.284 -16.587 -2.712 1.00 0.00 C ATOM 380 CG LYS A 26 15.253 -17.087 -3.785 1.00 0.00 C ATOM 381 CD LYS A 26 15.738 -18.532 -3.646 1.00 0.00 C ATOM 382 CE LYS A 26 16.639 -18.957 -2.485 1.00 0.00 C ATOM 383 NZ LYS A 26 17.886 -18.169 -2.369 1.00 0.00 N ATOM 0 H LYS A 26 15.106 -14.369 -2.545 1.00 0.00 H new ATOM 0 HA LYS A 26 13.093 -15.493 -4.199 1.00 0.00 H new ATOM 0 HB2 LYS A 26 14.847 -16.313 -1.820 1.00 0.00 H new ATOM 0 HB3 LYS A 26 13.612 -17.398 -2.429 1.00 0.00 H new ATOM 0 HG2 LYS A 26 14.771 -16.981 -4.757 1.00 0.00 H new ATOM 0 HG3 LYS A 26 16.125 -16.433 -3.789 1.00 0.00 H new ATOM 0 HD2 LYS A 26 14.850 -19.163 -3.608 1.00 0.00 H new ATOM 0 HD3 LYS A 26 16.266 -18.780 -4.566 1.00 0.00 H new ATOM 0 HE2 LYS A 26 16.079 -18.870 -1.554 1.00 0.00 H new ATOM 0 HE3 LYS A 26 16.897 -20.009 -2.605 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 18.442 -18.516 -1.561 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 18.443 -18.270 -3.241 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 17.651 -17.167 -2.223 1.00 0.00 H new ATOM 397 N GLU A 27 12.531 -14.733 -1.102 1.00 0.00 N ATOM 398 CA GLU A 27 11.580 -14.441 -0.075 1.00 0.00 C ATOM 399 C GLU A 27 10.485 -13.547 -0.545 1.00 0.00 C ATOM 400 O GLU A 27 9.288 -13.792 -0.404 1.00 0.00 O ATOM 401 CB GLU A 27 12.342 -14.090 1.214 1.00 0.00 C ATOM 402 CG GLU A 27 12.953 -15.339 1.853 1.00 0.00 C ATOM 403 CD GLU A 27 13.684 -14.789 3.070 1.00 0.00 C ATOM 404 OE1 GLU A 27 14.489 -13.822 3.003 1.00 0.00 O ATOM 405 OE2 GLU A 27 13.233 -15.190 4.176 1.00 0.00 O ATOM 0 H GLU A 27 13.484 -14.492 -0.830 1.00 0.00 H new ATOM 0 HA GLU A 27 10.986 -15.313 0.198 1.00 0.00 H new ATOM 0 HB2 GLU A 27 13.130 -13.371 0.990 1.00 0.00 H new ATOM 0 HB3 GLU A 27 11.665 -13.611 1.921 1.00 0.00 H new ATOM 0 HG2 GLU A 27 12.187 -16.061 2.136 1.00 0.00 H new ATOM 0 HG3 GLU A 27 13.634 -15.848 1.171 1.00 0.00 H new ATOM 412 N LEU A 28 10.959 -12.402 -1.069 1.00 0.00 N ATOM 413 CA LEU A 28 10.219 -11.455 -1.844 1.00 0.00 C ATOM 414 C LEU A 28 9.587 -11.993 -3.081 1.00 0.00 C ATOM 415 O LEU A 28 8.407 -11.766 -3.345 1.00 0.00 O ATOM 416 CB LEU A 28 11.161 -10.281 -2.160 1.00 0.00 C ATOM 417 CG LEU A 28 10.506 -9.046 -2.802 1.00 0.00 C ATOM 418 CD1 LEU A 28 9.302 -8.397 -2.099 1.00 0.00 C ATOM 419 CD2 LEU A 28 11.620 -8.014 -3.051 1.00 0.00 C ATOM 0 H LEU A 28 11.931 -12.119 -0.941 1.00 0.00 H new ATOM 0 HA LEU A 28 9.364 -11.140 -1.246 1.00 0.00 H new ATOM 0 HB2 LEU A 28 11.646 -9.971 -1.234 1.00 0.00 H new ATOM 0 HB3 LEU A 28 11.946 -10.640 -2.826 1.00 0.00 H new ATOM 0 HG LEU A 28 10.037 -9.417 -3.713 1.00 0.00 H new ATOM 0 HD11 LEU A 28 8.960 -7.540 -2.680 1.00 0.00 H new ATOM 0 HD12 LEU A 28 8.494 -9.124 -2.015 1.00 0.00 H new ATOM 0 HD13 LEU A 28 9.597 -8.066 -1.103 1.00 0.00 H new ATOM 0 HD21 LEU A 28 11.193 -7.121 -3.507 1.00 0.00 H new ATOM 0 HD22 LEU A 28 12.089 -7.749 -2.103 1.00 0.00 H new ATOM 0 HD23 LEU A 28 12.368 -8.440 -3.719 1.00 0.00 H new ATOM 431 N GLY A 29 10.364 -12.679 -3.938 1.00 0.00 N ATOM 432 CA GLY A 29 9.893 -13.466 -5.036 1.00 0.00 C ATOM 433 C GLY A 29 8.750 -14.395 -4.811 1.00 0.00 C ATOM 434 O GLY A 29 7.872 -14.387 -5.673 1.00 0.00 O ATOM 0 H GLY A 29 11.381 -12.684 -3.860 1.00 0.00 H new ATOM 0 HA2 GLY A 29 9.610 -12.782 -5.836 1.00 0.00 H new ATOM 0 HA3 GLY A 29 10.732 -14.057 -5.403 1.00 0.00 H new ATOM 438 N THR A 30 8.765 -15.229 -3.756 1.00 0.00 N ATOM 439 CA THR A 30 7.749 -16.153 -3.357 1.00 0.00 C ATOM 440 C THR A 30 6.417 -15.485 -3.353 1.00 0.00 C ATOM 441 O THR A 30 5.508 -16.006 -3.997 1.00 0.00 O ATOM 442 CB THR A 30 8.110 -16.933 -2.127 1.00 0.00 C ATOM 443 OG1 THR A 30 9.238 -17.738 -2.436 1.00 0.00 O ATOM 444 CG2 THR A 30 6.892 -17.838 -1.880 1.00 0.00 C ATOM 0 H THR A 30 9.565 -15.257 -3.124 1.00 0.00 H new ATOM 0 HA THR A 30 7.670 -16.943 -4.104 1.00 0.00 H new ATOM 0 HB THR A 30 8.344 -16.308 -1.265 1.00 0.00 H new ATOM 0 HG1 THR A 30 10.026 -17.167 -2.549 1.00 0.00 H new ATOM 0 HG21 THR A 30 7.066 -18.449 -0.994 1.00 0.00 H new ATOM 0 HG22 THR A 30 6.006 -17.222 -1.727 1.00 0.00 H new ATOM 0 HG23 THR A 30 6.739 -18.486 -2.743 1.00 0.00 H new ATOM 452 N VAL A 31 6.262 -14.300 -2.736 1.00 0.00 N ATOM 453 CA VAL A 31 5.070 -13.512 -2.668 1.00 0.00 C ATOM 454 C VAL A 31 4.545 -13.065 -3.988 1.00 0.00 C ATOM 455 O VAL A 31 3.386 -13.286 -4.338 1.00 0.00 O ATOM 456 CB VAL A 31 5.312 -12.290 -1.833 1.00 0.00 C ATOM 457 CG1 VAL A 31 4.015 -11.499 -1.592 1.00 0.00 C ATOM 458 CG2 VAL A 31 5.802 -12.718 -0.440 1.00 0.00 C ATOM 0 H VAL A 31 7.037 -13.857 -2.243 1.00 0.00 H new ATOM 0 HA VAL A 31 4.321 -14.170 -2.228 1.00 0.00 H new ATOM 0 HB VAL A 31 6.038 -11.678 -2.368 1.00 0.00 H new ATOM 0 HG11 VAL A 31 4.232 -10.621 -0.983 1.00 0.00 H new ATOM 0 HG12 VAL A 31 3.598 -11.183 -2.548 1.00 0.00 H new ATOM 0 HG13 VAL A 31 3.294 -12.131 -1.073 1.00 0.00 H new ATOM 0 HG21 VAL A 31 5.979 -11.833 0.171 1.00 0.00 H new ATOM 0 HG22 VAL A 31 5.046 -13.342 0.036 1.00 0.00 H new ATOM 0 HG23 VAL A 31 6.729 -13.283 -0.538 1.00 0.00 H new ATOM 468 N MET A 32 5.444 -12.501 -4.813 1.00 0.00 N ATOM 469 CA MET A 32 5.207 -12.079 -6.159 1.00 0.00 C ATOM 470 C MET A 32 4.753 -13.195 -7.037 1.00 0.00 C ATOM 471 O MET A 32 3.719 -13.230 -7.702 1.00 0.00 O ATOM 472 CB MET A 32 6.456 -11.394 -6.738 1.00 0.00 C ATOM 473 CG MET A 32 6.869 -10.174 -5.912 1.00 0.00 C ATOM 474 SD MET A 32 8.388 -9.428 -6.576 1.00 0.00 S ATOM 475 CE MET A 32 8.083 -7.857 -5.717 1.00 0.00 C ATOM 0 H MET A 32 6.405 -12.328 -4.518 1.00 0.00 H new ATOM 0 HA MET A 32 4.392 -11.355 -6.129 1.00 0.00 H new ATOM 0 HB2 MET A 32 7.280 -12.107 -6.770 1.00 0.00 H new ATOM 0 HB3 MET A 32 6.259 -11.088 -7.765 1.00 0.00 H new ATOM 0 HG2 MET A 32 6.065 -9.438 -5.916 1.00 0.00 H new ATOM 0 HG3 MET A 32 7.027 -10.468 -4.874 1.00 0.00 H new ATOM 0 HE1 MET A 32 7.825 -7.088 -6.445 1.00 0.00 H new ATOM 0 HE2 MET A 32 7.260 -7.981 -5.013 1.00 0.00 H new ATOM 0 HE3 MET A 32 8.981 -7.558 -5.176 1.00 0.00 H new ATOM 485 N ARG A 33 5.609 -14.221 -7.190 1.00 0.00 N ATOM 486 CA ARG A 33 5.371 -15.427 -7.921 1.00 0.00 C ATOM 487 C ARG A 33 4.122 -16.138 -7.529 1.00 0.00 C ATOM 488 O ARG A 33 3.604 -16.948 -8.296 1.00 0.00 O ATOM 489 CB ARG A 33 6.560 -16.363 -7.652 1.00 0.00 C ATOM 490 CG ARG A 33 6.700 -17.547 -8.611 1.00 0.00 C ATOM 491 CD ARG A 33 7.745 -18.601 -8.241 1.00 0.00 C ATOM 492 NE ARG A 33 7.122 -19.397 -7.147 1.00 0.00 N ATOM 493 CZ ARG A 33 7.855 -20.054 -6.201 1.00 0.00 C ATOM 494 NH1 ARG A 33 9.219 -20.032 -6.168 1.00 0.00 N ATOM 495 NH2 ARG A 33 7.190 -20.731 -5.219 1.00 0.00 N ATOM 0 H ARG A 33 6.538 -14.205 -6.770 1.00 0.00 H new ATOM 0 HA ARG A 33 5.259 -15.158 -8.971 1.00 0.00 H new ATOM 0 HB2 ARG A 33 7.478 -15.776 -7.692 1.00 0.00 H new ATOM 0 HB3 ARG A 33 6.473 -16.749 -6.637 1.00 0.00 H new ATOM 0 HG2 ARG A 33 5.731 -18.040 -8.690 1.00 0.00 H new ATOM 0 HG3 ARG A 33 6.942 -17.159 -9.600 1.00 0.00 H new ATOM 0 HD2 ARG A 33 7.990 -19.231 -9.096 1.00 0.00 H new ATOM 0 HD3 ARG A 33 8.674 -18.136 -7.911 1.00 0.00 H new ATOM 0 HE ARG A 33 6.105 -19.454 -7.103 1.00 0.00 H new ATOM 0 HH11 ARG A 33 9.738 -19.507 -6.872 1.00 0.00 H new ATOM 0 HH12 ARG A 33 9.720 -20.540 -5.439 1.00 0.00 H new ATOM 0 HH21 ARG A 33 6.170 -20.737 -5.205 1.00 0.00 H new ATOM 0 HH22 ARG A 33 7.713 -21.230 -4.500 1.00 0.00 H new ATOM 509 N SER A 34 3.618 -15.960 -6.294 1.00 0.00 N ATOM 510 CA SER A 34 2.446 -16.626 -5.819 1.00 0.00 C ATOM 511 C SER A 34 1.171 -15.940 -6.170 1.00 0.00 C ATOM 512 O SER A 34 0.078 -16.504 -6.201 1.00 0.00 O ATOM 513 CB SER A 34 2.393 -16.857 -4.299 1.00 0.00 C ATOM 514 OG SER A 34 3.478 -17.689 -3.916 1.00 0.00 O ATOM 0 H SER A 34 4.038 -15.335 -5.607 1.00 0.00 H new ATOM 0 HA SER A 34 2.533 -17.582 -6.336 1.00 0.00 H new ATOM 0 HB2 SER A 34 2.446 -15.904 -3.772 1.00 0.00 H new ATOM 0 HB3 SER A 34 1.447 -17.322 -4.022 1.00 0.00 H new ATOM 0 HG SER A 34 4.259 -17.134 -3.709 1.00 0.00 H new ATOM 520 N LEU A 35 1.309 -14.619 -6.388 1.00 0.00 N ATOM 521 CA LEU A 35 0.327 -13.624 -6.689 1.00 0.00 C ATOM 522 C LEU A 35 -0.133 -13.738 -8.101 1.00 0.00 C ATOM 523 O LEU A 35 -1.333 -13.780 -8.367 1.00 0.00 O ATOM 524 CB LEU A 35 0.679 -12.197 -6.236 1.00 0.00 C ATOM 525 CG LEU A 35 -0.492 -11.220 -6.034 1.00 0.00 C ATOM 526 CD1 LEU A 35 -1.239 -11.512 -4.722 1.00 0.00 C ATOM 527 CD2 LEU A 35 0.148 -9.821 -6.011 1.00 0.00 C ATOM 0 H LEU A 35 2.237 -14.198 -6.346 1.00 0.00 H new ATOM 0 HA LEU A 35 -0.535 -13.845 -6.060 1.00 0.00 H new ATOM 0 HB2 LEU A 35 1.229 -12.265 -5.297 1.00 0.00 H new ATOM 0 HB3 LEU A 35 1.357 -11.765 -6.972 1.00 0.00 H new ATOM 0 HG LEU A 35 -1.235 -11.311 -6.826 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -2.061 -10.806 -4.606 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -1.634 -12.528 -4.746 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -0.552 -11.410 -3.882 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -0.628 -9.068 -5.870 1.00 0.00 H new ATOM 0 HD22 LEU A 35 0.864 -9.762 -5.191 1.00 0.00 H new ATOM 0 HD23 LEU A 35 0.661 -9.640 -6.955 1.00 0.00 H new ATOM 539 N GLY A 36 0.797 -13.834 -9.068 1.00 0.00 N ATOM 540 CA GLY A 36 0.487 -14.130 -10.432 1.00 0.00 C ATOM 541 C GLY A 36 1.619 -13.747 -11.323 1.00 0.00 C ATOM 542 O GLY A 36 2.132 -14.480 -12.167 1.00 0.00 O ATOM 0 H GLY A 36 1.794 -13.702 -8.896 1.00 0.00 H new ATOM 0 HA2 GLY A 36 0.276 -15.194 -10.540 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -0.415 -13.595 -10.730 1.00 0.00 H new ATOM 546 N GLN A 37 2.091 -12.509 -11.093 1.00 0.00 N ATOM 547 CA GLN A 37 3.250 -11.948 -11.714 1.00 0.00 C ATOM 548 C GLN A 37 4.529 -12.711 -11.676 1.00 0.00 C ATOM 549 O GLN A 37 4.692 -13.642 -10.889 1.00 0.00 O ATOM 550 CB GLN A 37 3.374 -10.513 -11.174 1.00 0.00 C ATOM 551 CG GLN A 37 3.690 -10.467 -9.677 1.00 0.00 C ATOM 552 CD GLN A 37 3.461 -9.088 -9.075 1.00 0.00 C ATOM 553 OE1 GLN A 37 2.462 -8.811 -8.413 1.00 0.00 O ATOM 554 NE2 GLN A 37 4.349 -8.103 -9.374 1.00 0.00 N ATOM 0 H GLN A 37 1.641 -11.867 -10.441 1.00 0.00 H new ATOM 0 HA GLN A 37 3.080 -11.986 -12.790 1.00 0.00 H new ATOM 0 HB2 GLN A 37 4.158 -9.990 -11.722 1.00 0.00 H new ATOM 0 HB3 GLN A 37 2.443 -9.978 -11.361 1.00 0.00 H new ATOM 0 HG2 GLN A 37 3.069 -11.195 -9.155 1.00 0.00 H new ATOM 0 HG3 GLN A 37 4.728 -10.761 -9.519 1.00 0.00 H new ATOM 0 HE21 GLN A 37 5.182 -8.317 -9.922 1.00 0.00 H new ATOM 0 HE22 GLN A 37 4.182 -7.150 -9.050 1.00 0.00 H new ATOM 563 N ASN A 38 5.516 -12.355 -12.517 1.00 0.00 N ATOM 564 CA ASN A 38 6.823 -12.934 -12.487 1.00 0.00 C ATOM 565 C ASN A 38 7.782 -12.030 -11.792 1.00 0.00 C ATOM 566 O ASN A 38 7.921 -10.914 -12.290 1.00 0.00 O ATOM 567 CB ASN A 38 7.175 -13.284 -13.943 1.00 0.00 C ATOM 568 CG ASN A 38 8.374 -14.214 -14.061 1.00 0.00 C ATOM 569 OD1 ASN A 38 8.726 -15.066 -13.247 1.00 0.00 O ATOM 570 ND2 ASN A 38 9.085 -13.917 -15.182 1.00 0.00 N ATOM 0 H ASN A 38 5.402 -11.644 -13.239 1.00 0.00 H new ATOM 0 HA ASN A 38 6.872 -13.852 -11.901 1.00 0.00 H new ATOM 0 HB2 ASN A 38 6.312 -13.752 -14.417 1.00 0.00 H new ATOM 0 HB3 ASN A 38 7.380 -12.365 -14.492 1.00 0.00 H new ATOM 0 HD21 ASN A 38 9.955 -14.411 -15.380 1.00 0.00 H new ATOM 0 HD22 ASN A 38 8.748 -13.201 -15.825 1.00 0.00 H new ATOM 577 N PRO A 39 8.529 -12.399 -10.794 1.00 0.00 N ATOM 578 CA PRO A 39 9.600 -11.594 -10.285 1.00 0.00 C ATOM 579 C PRO A 39 10.828 -11.659 -11.126 1.00 0.00 C ATOM 580 O PRO A 39 11.557 -12.633 -10.945 1.00 0.00 O ATOM 581 CB PRO A 39 9.957 -12.241 -8.949 1.00 0.00 C ATOM 582 CG PRO A 39 9.481 -13.702 -9.015 1.00 0.00 C ATOM 583 CD PRO A 39 8.458 -13.708 -10.161 1.00 0.00 C ATOM 0 HA PRO A 39 9.285 -10.551 -10.240 1.00 0.00 H new ATOM 0 HB2 PRO A 39 11.032 -12.193 -8.772 1.00 0.00 H new ATOM 0 HB3 PRO A 39 9.475 -11.715 -8.125 1.00 0.00 H new ATOM 0 HG2 PRO A 39 10.308 -14.383 -9.215 1.00 0.00 H new ATOM 0 HG3 PRO A 39 9.029 -14.017 -8.075 1.00 0.00 H new ATOM 0 HD2 PRO A 39 8.685 -14.497 -10.878 1.00 0.00 H new ATOM 0 HD3 PRO A 39 7.454 -13.901 -9.782 1.00 0.00 H new ATOM 591 N THR A 40 11.149 -10.731 -12.045 1.00 0.00 N ATOM 592 CA THR A 40 12.343 -10.774 -12.830 1.00 0.00 C ATOM 593 C THR A 40 13.434 -10.201 -11.993 1.00 0.00 C ATOM 594 O THR A 40 13.428 -9.135 -11.380 1.00 0.00 O ATOM 595 CB THR A 40 12.143 -9.943 -14.063 1.00 0.00 C ATOM 596 OG1 THR A 40 11.405 -8.791 -13.684 1.00 0.00 O ATOM 597 CG2 THR A 40 11.425 -10.764 -15.147 1.00 0.00 C ATOM 0 H THR A 40 10.558 -9.925 -12.248 1.00 0.00 H new ATOM 0 HA THR A 40 12.591 -11.791 -13.134 1.00 0.00 H new ATOM 0 HB THR A 40 13.096 -9.634 -14.492 1.00 0.00 H new ATOM 0 HG1 THR A 40 11.819 -7.994 -14.076 1.00 0.00 H new ATOM 0 HG21 THR A 40 11.286 -10.149 -16.036 1.00 0.00 H new ATOM 0 HG22 THR A 40 12.026 -11.637 -15.400 1.00 0.00 H new ATOM 0 HG23 THR A 40 10.453 -11.088 -14.774 1.00 0.00 H new ATOM 605 N GLU A 41 14.464 -11.049 -11.819 1.00 0.00 N ATOM 606 CA GLU A 41 15.260 -11.125 -10.634 1.00 0.00 C ATOM 607 C GLU A 41 16.267 -10.028 -10.587 1.00 0.00 C ATOM 608 O GLU A 41 16.500 -9.436 -9.534 1.00 0.00 O ATOM 609 CB GLU A 41 16.006 -12.469 -10.603 1.00 0.00 C ATOM 610 CG GLU A 41 15.051 -13.665 -10.618 1.00 0.00 C ATOM 611 CD GLU A 41 15.857 -14.941 -10.812 1.00 0.00 C ATOM 612 OE1 GLU A 41 16.952 -14.999 -10.190 1.00 0.00 O ATOM 613 OE2 GLU A 41 15.465 -15.898 -11.531 1.00 0.00 O ATOM 0 H GLU A 41 14.755 -11.712 -12.538 1.00 0.00 H new ATOM 0 HA GLU A 41 14.593 -11.032 -9.777 1.00 0.00 H new ATOM 0 HB2 GLU A 41 16.675 -12.530 -11.461 1.00 0.00 H new ATOM 0 HB3 GLU A 41 16.629 -12.516 -9.710 1.00 0.00 H new ATOM 0 HG2 GLU A 41 14.492 -13.712 -9.684 1.00 0.00 H new ATOM 0 HG3 GLU A 41 14.322 -13.555 -11.421 1.00 0.00 H new ATOM 620 N ALA A 42 16.959 -9.782 -11.714 1.00 0.00 N ATOM 621 CA ALA A 42 17.983 -8.786 -11.775 1.00 0.00 C ATOM 622 C ALA A 42 17.347 -7.468 -11.495 1.00 0.00 C ATOM 623 O ALA A 42 17.828 -6.703 -10.661 1.00 0.00 O ATOM 624 CB ALA A 42 18.756 -8.910 -13.099 1.00 0.00 C ATOM 0 H ALA A 42 16.807 -10.279 -12.592 1.00 0.00 H new ATOM 0 HA ALA A 42 18.754 -8.915 -11.016 1.00 0.00 H new ATOM 0 HB1 ALA A 42 19.534 -8.148 -13.139 1.00 0.00 H new ATOM 0 HB2 ALA A 42 19.212 -9.898 -13.163 1.00 0.00 H new ATOM 0 HB3 ALA A 42 18.070 -8.772 -13.935 1.00 0.00 H new ATOM 630 N GLU A 43 16.281 -7.107 -12.233 1.00 0.00 N ATOM 631 CA GLU A 43 15.494 -5.946 -11.954 1.00 0.00 C ATOM 632 C GLU A 43 15.099 -5.810 -10.524 1.00 0.00 C ATOM 633 O GLU A 43 15.168 -4.700 -9.997 1.00 0.00 O ATOM 634 CB GLU A 43 14.204 -5.969 -12.790 1.00 0.00 C ATOM 635 CG GLU A 43 14.325 -5.905 -14.314 1.00 0.00 C ATOM 636 CD GLU A 43 12.946 -5.674 -14.914 1.00 0.00 C ATOM 637 OE1 GLU A 43 12.122 -6.625 -14.980 1.00 0.00 O ATOM 638 OE2 GLU A 43 12.701 -4.497 -15.292 1.00 0.00 O ATOM 0 H GLU A 43 15.959 -7.636 -13.044 1.00 0.00 H new ATOM 0 HA GLU A 43 16.132 -5.099 -12.208 1.00 0.00 H new ATOM 0 HB2 GLU A 43 13.661 -6.880 -12.538 1.00 0.00 H new ATOM 0 HB3 GLU A 43 13.586 -5.130 -12.470 1.00 0.00 H new ATOM 0 HG2 GLU A 43 15.001 -5.100 -14.604 1.00 0.00 H new ATOM 0 HG3 GLU A 43 14.751 -6.833 -14.697 1.00 0.00 H new ATOM 645 N LEU A 44 14.731 -6.955 -9.923 1.00 0.00 N ATOM 646 CA LEU A 44 14.313 -6.962 -8.555 1.00 0.00 C ATOM 647 C LEU A 44 15.327 -6.624 -7.517 1.00 0.00 C ATOM 648 O LEU A 44 15.024 -5.826 -6.631 1.00 0.00 O ATOM 649 CB LEU A 44 13.689 -8.314 -8.170 1.00 0.00 C ATOM 650 CG LEU A 44 12.774 -8.121 -6.949 1.00 0.00 C ATOM 651 CD1 LEU A 44 11.620 -7.111 -7.056 1.00 0.00 C ATOM 652 CD2 LEU A 44 12.236 -9.526 -6.632 1.00 0.00 C ATOM 0 H LEU A 44 14.722 -7.868 -10.378 1.00 0.00 H new ATOM 0 HA LEU A 44 13.595 -6.142 -8.543 1.00 0.00 H new ATOM 0 HB2 LEU A 44 13.118 -8.716 -9.007 1.00 0.00 H new ATOM 0 HB3 LEU A 44 14.472 -9.037 -7.942 1.00 0.00 H new ATOM 0 HG LEU A 44 13.378 -7.665 -6.164 1.00 0.00 H new ATOM 0 HD11 LEU A 44 11.068 -7.089 -6.117 1.00 0.00 H new ATOM 0 HD12 LEU A 44 12.022 -6.120 -7.264 1.00 0.00 H new ATOM 0 HD13 LEU A 44 10.951 -7.408 -7.863 1.00 0.00 H new ATOM 0 HD21 LEU A 44 11.572 -9.475 -5.769 1.00 0.00 H new ATOM 0 HD22 LEU A 44 11.685 -9.907 -7.492 1.00 0.00 H new ATOM 0 HD23 LEU A 44 13.069 -10.193 -6.410 1.00 0.00 H new ATOM 664 N GLN A 45 16.507 -7.232 -7.733 1.00 0.00 N ATOM 665 CA GLN A 45 17.679 -6.818 -7.026 1.00 0.00 C ATOM 666 C GLN A 45 18.123 -5.399 -7.122 1.00 0.00 C ATOM 667 O GLN A 45 18.603 -4.775 -6.178 1.00 0.00 O ATOM 668 CB GLN A 45 18.859 -7.760 -7.317 1.00 0.00 C ATOM 669 CG GLN A 45 19.946 -8.041 -6.278 1.00 0.00 C ATOM 670 CD GLN A 45 20.856 -9.139 -6.811 1.00 0.00 C ATOM 671 OE1 GLN A 45 20.693 -10.305 -6.454 1.00 0.00 O ATOM 672 NE2 GLN A 45 21.829 -8.867 -7.721 1.00 0.00 N ATOM 0 H GLN A 45 16.649 -8.000 -8.388 1.00 0.00 H new ATOM 0 HA GLN A 45 17.339 -6.887 -5.993 1.00 0.00 H new ATOM 0 HB2 GLN A 45 18.431 -8.724 -7.593 1.00 0.00 H new ATOM 0 HB3 GLN A 45 19.363 -7.369 -8.201 1.00 0.00 H new ATOM 0 HG2 GLN A 45 20.521 -7.137 -6.078 1.00 0.00 H new ATOM 0 HG3 GLN A 45 19.496 -8.348 -5.334 1.00 0.00 H new ATOM 0 HE21 GLN A 45 21.983 -7.908 -8.032 1.00 0.00 H new ATOM 0 HE22 GLN A 45 22.405 -9.622 -8.093 1.00 0.00 H new ATOM 681 N ASP A 46 17.815 -4.752 -8.260 1.00 0.00 N ATOM 682 CA ASP A 46 18.275 -3.437 -8.585 1.00 0.00 C ATOM 683 C ASP A 46 17.557 -2.411 -7.778 1.00 0.00 C ATOM 684 O ASP A 46 18.094 -1.430 -7.265 1.00 0.00 O ATOM 685 CB ASP A 46 18.084 -3.180 -10.090 1.00 0.00 C ATOM 686 CG ASP A 46 18.847 -1.984 -10.639 1.00 0.00 C ATOM 687 OD1 ASP A 46 19.970 -1.671 -10.161 1.00 0.00 O ATOM 688 OD2 ASP A 46 18.304 -1.293 -11.542 1.00 0.00 O ATOM 0 H ASP A 46 17.222 -5.161 -8.982 1.00 0.00 H new ATOM 0 HA ASP A 46 19.336 -3.364 -8.346 1.00 0.00 H new ATOM 0 HB2 ASP A 46 18.392 -4.071 -10.637 1.00 0.00 H new ATOM 0 HB3 ASP A 46 17.022 -3.036 -10.287 1.00 0.00 H new ATOM 693 N MET A 47 16.268 -2.650 -7.479 1.00 0.00 N ATOM 694 CA MET A 47 15.517 -1.897 -6.523 1.00 0.00 C ATOM 695 C MET A 47 16.110 -1.951 -5.157 1.00 0.00 C ATOM 696 O MET A 47 16.212 -0.984 -4.404 1.00 0.00 O ATOM 697 CB MET A 47 14.088 -2.462 -6.589 1.00 0.00 C ATOM 698 CG MET A 47 13.033 -1.578 -5.921 1.00 0.00 C ATOM 699 SD MET A 47 12.476 -0.067 -6.766 1.00 0.00 S ATOM 700 CE MET A 47 13.656 1.092 -6.018 1.00 0.00 C ATOM 0 H MET A 47 15.729 -3.395 -7.919 1.00 0.00 H new ATOM 0 HA MET A 47 15.524 -0.833 -6.758 1.00 0.00 H new ATOM 0 HB2 MET A 47 13.815 -2.608 -7.634 1.00 0.00 H new ATOM 0 HB3 MET A 47 14.075 -3.444 -6.116 1.00 0.00 H new ATOM 0 HG2 MET A 47 12.153 -2.196 -5.741 1.00 0.00 H new ATOM 0 HG3 MET A 47 13.421 -1.284 -4.946 1.00 0.00 H new ATOM 0 HE1 MET A 47 13.115 1.836 -5.434 1.00 0.00 H new ATOM 0 HE2 MET A 47 14.339 0.546 -5.367 1.00 0.00 H new ATOM 0 HE3 MET A 47 14.224 1.590 -6.803 1.00 0.00 H new ATOM 710 N ILE A 48 16.526 -3.162 -4.746 1.00 0.00 N ATOM 711 CA ILE A 48 17.006 -3.450 -3.430 1.00 0.00 C ATOM 712 C ILE A 48 18.339 -2.835 -3.176 1.00 0.00 C ATOM 713 O ILE A 48 18.498 -2.071 -2.224 1.00 0.00 O ATOM 714 CB ILE A 48 17.026 -4.935 -3.219 1.00 0.00 C ATOM 715 CG1 ILE A 48 15.563 -5.401 -3.136 1.00 0.00 C ATOM 716 CG2 ILE A 48 17.742 -5.452 -1.960 1.00 0.00 C ATOM 717 CD1 ILE A 48 15.304 -6.856 -3.523 1.00 0.00 C ATOM 0 H ILE A 48 16.528 -3.977 -5.359 1.00 0.00 H new ATOM 0 HA ILE A 48 16.325 -3.003 -2.706 1.00 0.00 H new ATOM 0 HB ILE A 48 17.597 -5.336 -4.056 1.00 0.00 H new ATOM 0 HG12 ILE A 48 15.210 -5.248 -2.116 1.00 0.00 H new ATOM 0 HG13 ILE A 48 14.961 -4.761 -3.781 1.00 0.00 H new ATOM 0 HG21 ILE A 48 17.683 -6.540 -1.929 1.00 0.00 H new ATOM 0 HG22 ILE A 48 18.788 -5.146 -1.985 1.00 0.00 H new ATOM 0 HG23 ILE A 48 17.263 -5.037 -1.073 1.00 0.00 H new ATOM 0 HD11 ILE A 48 14.240 -7.074 -3.427 1.00 0.00 H new ATOM 0 HD12 ILE A 48 15.617 -7.019 -4.554 1.00 0.00 H new ATOM 0 HD13 ILE A 48 15.870 -7.514 -2.864 1.00 0.00 H new ATOM 729 N ASN A 49 19.346 -2.894 -4.066 1.00 0.00 N ATOM 730 CA ASN A 49 20.576 -2.167 -4.116 1.00 0.00 C ATOM 731 C ASN A 49 20.451 -0.683 -4.140 1.00 0.00 C ATOM 732 O ASN A 49 21.258 0.044 -3.563 1.00 0.00 O ATOM 733 CB ASN A 49 21.407 -2.630 -5.324 1.00 0.00 C ATOM 734 CG ASN A 49 21.905 -4.050 -5.093 1.00 0.00 C ATOM 735 OD1 ASN A 49 22.282 -4.511 -4.017 1.00 0.00 O ATOM 736 ND2 ASN A 49 21.989 -4.829 -6.205 1.00 0.00 N ATOM 0 H ASN A 49 19.284 -3.539 -4.853 1.00 0.00 H new ATOM 0 HA ASN A 49 21.073 -2.397 -3.173 1.00 0.00 H new ATOM 0 HB2 ASN A 49 20.802 -2.590 -6.230 1.00 0.00 H new ATOM 0 HB3 ASN A 49 22.252 -1.958 -5.475 1.00 0.00 H new ATOM 0 HD21 ASN A 49 22.359 -5.777 -6.137 1.00 0.00 H new ATOM 0 HD22 ASN A 49 21.682 -4.465 -7.107 1.00 0.00 H new ATOM 743 N GLU A 50 19.395 -0.039 -4.670 1.00 0.00 N ATOM 744 CA GLU A 50 19.155 1.368 -4.584 1.00 0.00 C ATOM 745 C GLU A 50 18.982 1.773 -3.161 1.00 0.00 C ATOM 746 O GLU A 50 19.617 2.707 -2.675 1.00 0.00 O ATOM 747 CB GLU A 50 17.901 1.713 -5.404 1.00 0.00 C ATOM 748 CG GLU A 50 17.608 3.214 -5.364 1.00 0.00 C ATOM 749 CD GLU A 50 16.589 3.818 -6.320 1.00 0.00 C ATOM 750 OE1 GLU A 50 16.898 3.831 -7.541 1.00 0.00 O ATOM 751 OE2 GLU A 50 15.490 4.276 -5.908 1.00 0.00 O ATOM 0 H GLU A 50 18.667 -0.530 -5.189 1.00 0.00 H new ATOM 0 HA GLU A 50 20.008 1.913 -4.988 1.00 0.00 H new ATOM 0 HB2 GLU A 50 18.040 1.395 -6.437 1.00 0.00 H new ATOM 0 HB3 GLU A 50 17.045 1.162 -5.013 1.00 0.00 H new ATOM 0 HG2 GLU A 50 17.284 3.454 -4.351 1.00 0.00 H new ATOM 0 HG3 GLU A 50 18.553 3.733 -5.527 1.00 0.00 H new ATOM 758 N VAL A 51 18.120 1.075 -2.399 1.00 0.00 N ATOM 759 CA VAL A 51 17.745 1.532 -1.097 1.00 0.00 C ATOM 760 C VAL A 51 18.381 0.719 -0.022 1.00 0.00 C ATOM 761 O VAL A 51 18.173 1.044 1.146 1.00 0.00 O ATOM 762 CB VAL A 51 16.249 1.534 -0.997 1.00 0.00 C ATOM 763 CG1 VAL A 51 15.673 2.348 -2.167 1.00 0.00 C ATOM 764 CG2 VAL A 51 15.629 0.126 -0.981 1.00 0.00 C ATOM 0 H VAL A 51 17.684 0.198 -2.683 1.00 0.00 H new ATOM 0 HA VAL A 51 18.109 2.549 -0.953 1.00 0.00 H new ATOM 0 HB VAL A 51 15.991 1.987 -0.040 1.00 0.00 H new ATOM 0 HG11 VAL A 51 14.585 2.356 -2.104 1.00 0.00 H new ATOM 0 HG12 VAL A 51 16.047 3.371 -2.118 1.00 0.00 H new ATOM 0 HG13 VAL A 51 15.978 1.895 -3.110 1.00 0.00 H new ATOM 0 HG21 VAL A 51 14.545 0.207 -0.907 1.00 0.00 H new ATOM 0 HG22 VAL A 51 15.892 -0.398 -1.900 1.00 0.00 H new ATOM 0 HG23 VAL A 51 16.011 -0.430 -0.125 1.00 0.00 H new ATOM 774 N ASP A 52 19.290 -0.178 -0.445 1.00 0.00 N ATOM 775 CA ASP A 52 20.278 -0.834 0.353 1.00 0.00 C ATOM 776 C ASP A 52 21.246 0.110 0.979 1.00 0.00 C ATOM 777 O ASP A 52 22.242 0.531 0.393 1.00 0.00 O ATOM 778 CB ASP A 52 21.006 -1.946 -0.421 1.00 0.00 C ATOM 779 CG ASP A 52 21.858 -2.864 0.444 1.00 0.00 C ATOM 780 OD1 ASP A 52 21.598 -2.942 1.675 1.00 0.00 O ATOM 781 OD2 ASP A 52 22.764 -3.488 -0.170 1.00 0.00 O ATOM 0 H ASP A 52 19.336 -0.466 -1.422 1.00 0.00 H new ATOM 0 HA ASP A 52 19.729 -1.304 1.169 1.00 0.00 H new ATOM 0 HB2 ASP A 52 20.266 -2.548 -0.948 1.00 0.00 H new ATOM 0 HB3 ASP A 52 21.642 -1.488 -1.178 1.00 0.00 H new ATOM 786 N ALA A 53 21.027 0.462 2.259 1.00 0.00 N ATOM 787 CA ALA A 53 21.816 1.418 2.973 1.00 0.00 C ATOM 788 C ALA A 53 23.115 0.877 3.461 1.00 0.00 C ATOM 789 O ALA A 53 24.121 1.578 3.358 1.00 0.00 O ATOM 790 CB ALA A 53 20.888 1.859 4.118 1.00 0.00 C ATOM 0 H ALA A 53 20.271 0.066 2.818 1.00 0.00 H new ATOM 0 HA ALA A 53 22.130 2.245 2.337 1.00 0.00 H new ATOM 0 HB1 ALA A 53 21.398 2.599 4.735 1.00 0.00 H new ATOM 0 HB2 ALA A 53 19.980 2.296 3.703 1.00 0.00 H new ATOM 0 HB3 ALA A 53 20.628 0.995 4.729 1.00 0.00 H new ATOM 796 N ASP A 54 23.198 -0.375 3.944 1.00 0.00 N ATOM 797 CA ASP A 54 24.417 -1.040 4.288 1.00 0.00 C ATOM 798 C ASP A 54 25.290 -1.388 3.132 1.00 0.00 C ATOM 799 O ASP A 54 26.426 -0.917 3.113 1.00 0.00 O ATOM 800 CB ASP A 54 23.967 -2.079 5.328 1.00 0.00 C ATOM 801 CG ASP A 54 23.057 -3.232 4.928 1.00 0.00 C ATOM 802 OD1 ASP A 54 23.239 -3.853 3.846 1.00 0.00 O ATOM 803 OD2 ASP A 54 22.032 -3.483 5.615 1.00 0.00 O ATOM 0 H ASP A 54 22.373 -0.953 4.103 1.00 0.00 H new ATOM 0 HA ASP A 54 25.187 -0.427 4.757 1.00 0.00 H new ATOM 0 HB2 ASP A 54 24.869 -2.516 5.757 1.00 0.00 H new ATOM 0 HB3 ASP A 54 23.464 -1.536 6.128 1.00 0.00 H new ATOM 808 N GLY A 55 24.952 -2.353 2.258 1.00 0.00 N ATOM 809 CA GLY A 55 25.815 -2.918 1.267 1.00 0.00 C ATOM 810 C GLY A 55 25.591 -4.375 1.053 1.00 0.00 C ATOM 811 O GLY A 55 26.191 -4.833 0.082 1.00 0.00 O ATOM 0 H GLY A 55 24.018 -2.764 2.243 1.00 0.00 H new ATOM 0 HA2 GLY A 55 25.667 -2.392 0.324 1.00 0.00 H new ATOM 0 HA3 GLY A 55 26.852 -2.756 1.563 1.00 0.00 H new ATOM 815 N ASN A 56 24.775 -5.084 1.854 1.00 0.00 N ATOM 816 CA ASN A 56 24.664 -6.505 1.744 1.00 0.00 C ATOM 817 C ASN A 56 23.915 -7.062 0.583 1.00 0.00 C ATOM 818 O ASN A 56 23.955 -8.256 0.289 1.00 0.00 O ATOM 819 CB ASN A 56 24.228 -7.211 3.040 1.00 0.00 C ATOM 820 CG ASN A 56 22.776 -6.945 3.408 1.00 0.00 C ATOM 821 OD1 ASN A 56 21.928 -6.360 2.735 1.00 0.00 O ATOM 822 ND2 ASN A 56 22.489 -7.494 4.619 1.00 0.00 N ATOM 0 H ASN A 56 24.190 -4.671 2.580 1.00 0.00 H new ATOM 0 HA ASN A 56 25.708 -6.743 1.538 1.00 0.00 H new ATOM 0 HB2 ASN A 56 24.377 -8.285 2.929 1.00 0.00 H new ATOM 0 HB3 ASN A 56 24.869 -6.883 3.858 1.00 0.00 H new ATOM 0 HD21 ASN A 56 21.544 -7.428 4.998 1.00 0.00 H new ATOM 0 HD22 ASN A 56 23.219 -7.972 5.148 1.00 0.00 H new ATOM 829 N GLY A 57 23.192 -6.191 -0.142 1.00 0.00 N ATOM 830 CA GLY A 57 22.419 -6.374 -1.331 1.00 0.00 C ATOM 831 C GLY A 57 21.158 -7.121 -1.065 1.00 0.00 C ATOM 832 O GLY A 57 20.591 -7.772 -1.941 1.00 0.00 O ATOM 0 H GLY A 57 23.147 -5.216 0.155 1.00 0.00 H new ATOM 0 HA2 GLY A 57 22.181 -5.402 -1.762 1.00 0.00 H new ATOM 0 HA3 GLY A 57 23.012 -6.914 -2.070 1.00 0.00 H new ATOM 836 N THR A 58 20.538 -6.970 0.119 1.00 0.00 N ATOM 837 CA THR A 58 19.272 -7.503 0.516 1.00 0.00 C ATOM 838 C THR A 58 18.552 -6.487 1.334 1.00 0.00 C ATOM 839 O THR A 58 19.203 -5.795 2.114 1.00 0.00 O ATOM 840 CB THR A 58 19.319 -8.733 1.374 1.00 0.00 C ATOM 841 OG1 THR A 58 20.342 -8.671 2.356 1.00 0.00 O ATOM 842 CG2 THR A 58 19.730 -9.989 0.586 1.00 0.00 C ATOM 0 H THR A 58 20.965 -6.423 0.867 1.00 0.00 H new ATOM 0 HA THR A 58 18.788 -7.765 -0.425 1.00 0.00 H new ATOM 0 HB THR A 58 18.312 -8.783 1.787 1.00 0.00 H new ATOM 0 HG1 THR A 58 20.663 -7.749 2.436 1.00 0.00 H new ATOM 0 HG21 THR A 58 19.748 -10.849 1.256 1.00 0.00 H new ATOM 0 HG22 THR A 58 19.012 -10.167 -0.215 1.00 0.00 H new ATOM 0 HG23 THR A 58 20.722 -9.842 0.158 1.00 0.00 H new ATOM 850 N ILE A 59 17.244 -6.204 1.194 1.00 0.00 N ATOM 851 CA ILE A 59 16.521 -5.210 1.926 1.00 0.00 C ATOM 852 C ILE A 59 16.084 -5.680 3.270 1.00 0.00 C ATOM 853 O ILE A 59 15.399 -6.691 3.418 1.00 0.00 O ATOM 854 CB ILE A 59 15.415 -4.817 0.992 1.00 0.00 C ATOM 855 CG1 ILE A 59 14.501 -3.744 1.607 1.00 0.00 C ATOM 856 CG2 ILE A 59 14.674 -5.993 0.334 1.00 0.00 C ATOM 857 CD1 ILE A 59 13.824 -2.900 0.528 1.00 0.00 C ATOM 0 H ILE A 59 16.655 -6.702 0.527 1.00 0.00 H new ATOM 0 HA ILE A 59 17.128 -4.345 2.194 1.00 0.00 H new ATOM 0 HB ILE A 59 15.901 -4.345 0.138 1.00 0.00 H new ATOM 0 HG12 ILE A 59 13.742 -4.222 2.226 1.00 0.00 H new ATOM 0 HG13 ILE A 59 15.086 -3.098 2.262 1.00 0.00 H new ATOM 0 HG21 ILE A 59 13.893 -5.609 -0.323 1.00 0.00 H new ATOM 0 HG22 ILE A 59 15.379 -6.587 -0.248 1.00 0.00 H new ATOM 0 HG23 ILE A 59 14.224 -6.617 1.106 1.00 0.00 H new ATOM 0 HD11 ILE A 59 13.186 -2.152 0.998 1.00 0.00 H new ATOM 0 HD12 ILE A 59 14.584 -2.402 -0.074 1.00 0.00 H new ATOM 0 HD13 ILE A 59 13.219 -3.543 -0.111 1.00 0.00 H new ATOM 869 N ASP A 60 16.519 -4.922 4.293 1.00 0.00 N ATOM 870 CA ASP A 60 16.275 -5.160 5.682 1.00 0.00 C ATOM 871 C ASP A 60 15.045 -4.423 6.086 1.00 0.00 C ATOM 872 O ASP A 60 14.471 -3.571 5.409 1.00 0.00 O ATOM 873 CB ASP A 60 17.497 -4.737 6.515 1.00 0.00 C ATOM 874 CG ASP A 60 18.661 -5.635 6.121 1.00 0.00 C ATOM 875 OD1 ASP A 60 18.624 -6.846 6.466 1.00 0.00 O ATOM 876 OD2 ASP A 60 19.620 -5.128 5.481 1.00 0.00 O ATOM 0 H ASP A 60 17.080 -4.085 4.137 1.00 0.00 H new ATOM 0 HA ASP A 60 16.117 -6.223 5.862 1.00 0.00 H new ATOM 0 HB2 ASP A 60 17.742 -3.691 6.330 1.00 0.00 H new ATOM 0 HB3 ASP A 60 17.285 -4.832 7.580 1.00 0.00 H new ATOM 881 N PHE A 61 14.651 -4.619 7.357 1.00 0.00 N ATOM 882 CA PHE A 61 13.656 -3.771 7.935 1.00 0.00 C ATOM 883 C PHE A 61 13.881 -2.299 7.876 1.00 0.00 C ATOM 884 O PHE A 61 13.067 -1.727 7.153 1.00 0.00 O ATOM 885 CB PHE A 61 13.370 -4.201 9.384 1.00 0.00 C ATOM 886 CG PHE A 61 12.061 -3.667 9.856 1.00 0.00 C ATOM 887 CD1 PHE A 61 10.844 -4.211 9.521 1.00 0.00 C ATOM 888 CD2 PHE A 61 12.026 -2.591 10.712 1.00 0.00 C ATOM 889 CE1 PHE A 61 9.640 -3.877 10.096 1.00 0.00 C ATOM 890 CE2 PHE A 61 10.856 -2.166 11.296 1.00 0.00 C ATOM 891 CZ PHE A 61 9.686 -2.800 10.949 1.00 0.00 C ATOM 0 H PHE A 61 15.012 -5.348 7.973 1.00 0.00 H new ATOM 0 HA PHE A 61 12.794 -3.921 7.285 1.00 0.00 H new ATOM 0 HB2 PHE A 61 13.367 -5.289 9.449 1.00 0.00 H new ATOM 0 HB3 PHE A 61 14.168 -3.845 10.036 1.00 0.00 H new ATOM 0 HD1 PHE A 61 10.832 -4.961 8.744 1.00 0.00 H new ATOM 0 HD2 PHE A 61 12.943 -2.065 10.932 1.00 0.00 H new ATOM 0 HE1 PHE A 61 8.728 -4.419 9.893 1.00 0.00 H new ATOM 0 HE2 PHE A 61 10.856 -1.355 12.009 1.00 0.00 H new ATOM 0 HZ PHE A 61 8.759 -2.434 11.366 1.00 0.00 H new ATOM 901 N PRO A 62 14.808 -1.554 8.401 1.00 0.00 N ATOM 902 CA PRO A 62 14.864 -0.137 8.189 1.00 0.00 C ATOM 903 C PRO A 62 15.107 0.371 6.810 1.00 0.00 C ATOM 904 O PRO A 62 15.156 1.580 6.592 1.00 0.00 O ATOM 905 CB PRO A 62 15.930 0.382 9.151 1.00 0.00 C ATOM 906 CG PRO A 62 16.859 -0.829 9.332 1.00 0.00 C ATOM 907 CD PRO A 62 15.898 -2.026 9.242 1.00 0.00 C ATOM 0 HA PRO A 62 13.857 0.239 8.370 1.00 0.00 H new ATOM 0 HB2 PRO A 62 16.462 1.239 8.738 1.00 0.00 H new ATOM 0 HB3 PRO A 62 15.496 0.702 10.098 1.00 0.00 H new ATOM 0 HG2 PRO A 62 17.625 -0.868 8.557 1.00 0.00 H new ATOM 0 HG3 PRO A 62 17.377 -0.800 10.291 1.00 0.00 H new ATOM 0 HD2 PRO A 62 16.388 -2.897 8.806 1.00 0.00 H new ATOM 0 HD3 PRO A 62 15.539 -2.322 10.228 1.00 0.00 H new ATOM 915 N GLU A 63 15.256 -0.489 5.786 1.00 0.00 N ATOM 916 CA GLU A 63 15.615 -0.076 4.465 1.00 0.00 C ATOM 917 C GLU A 63 14.361 -0.094 3.660 1.00 0.00 C ATOM 918 O GLU A 63 14.127 0.857 2.915 1.00 0.00 O ATOM 919 CB GLU A 63 16.583 -1.117 3.877 1.00 0.00 C ATOM 920 CG GLU A 63 17.983 -0.941 4.469 1.00 0.00 C ATOM 921 CD GLU A 63 18.975 -2.023 4.068 1.00 0.00 C ATOM 922 OE1 GLU A 63 18.589 -3.141 3.633 1.00 0.00 O ATOM 923 OE2 GLU A 63 20.202 -1.803 4.251 1.00 0.00 O ATOM 0 H GLU A 63 15.124 -1.496 5.879 1.00 0.00 H new ATOM 0 HA GLU A 63 16.082 0.909 4.464 1.00 0.00 H new ATOM 0 HB2 GLU A 63 16.217 -2.122 4.087 1.00 0.00 H new ATOM 0 HB3 GLU A 63 16.624 -1.012 2.793 1.00 0.00 H new ATOM 0 HG2 GLU A 63 18.376 0.028 4.160 1.00 0.00 H new ATOM 0 HG3 GLU A 63 17.905 -0.921 5.556 1.00 0.00 H new ATOM 930 N PHE A 64 13.529 -1.107 3.959 1.00 0.00 N ATOM 931 CA PHE A 64 12.144 -1.263 3.640 1.00 0.00 C ATOM 932 C PHE A 64 11.288 -0.196 4.231 1.00 0.00 C ATOM 933 O PHE A 64 10.572 0.477 3.490 1.00 0.00 O ATOM 934 CB PHE A 64 11.632 -2.680 3.950 1.00 0.00 C ATOM 935 CG PHE A 64 10.318 -3.045 3.350 1.00 0.00 C ATOM 936 CD1 PHE A 64 9.154 -2.870 4.061 1.00 0.00 C ATOM 937 CD2 PHE A 64 10.297 -3.702 2.142 1.00 0.00 C ATOM 938 CE1 PHE A 64 7.982 -3.328 3.506 1.00 0.00 C ATOM 939 CE2 PHE A 64 9.095 -4.051 1.574 1.00 0.00 C ATOM 940 CZ PHE A 64 7.926 -3.973 2.293 1.00 0.00 C ATOM 0 H PHE A 64 13.871 -1.910 4.487 1.00 0.00 H new ATOM 0 HA PHE A 64 12.063 -1.137 2.560 1.00 0.00 H new ATOM 0 HB2 PHE A 64 12.378 -3.397 3.607 1.00 0.00 H new ATOM 0 HB3 PHE A 64 11.558 -2.790 5.032 1.00 0.00 H new ATOM 0 HD1 PHE A 64 9.160 -2.387 5.027 1.00 0.00 H new ATOM 0 HD2 PHE A 64 11.223 -3.943 1.641 1.00 0.00 H new ATOM 0 HE1 PHE A 64 7.061 -3.174 4.049 1.00 0.00 H new ATOM 0 HE2 PHE A 64 9.069 -4.391 0.549 1.00 0.00 H new ATOM 0 HZ PHE A 64 7.005 -4.399 1.922 1.00 0.00 H new ATOM 950 N LEU A 65 11.493 0.135 5.518 1.00 0.00 N ATOM 951 CA LEU A 65 10.819 1.189 6.211 1.00 0.00 C ATOM 952 C LEU A 65 10.998 2.512 5.549 1.00 0.00 C ATOM 953 O LEU A 65 10.005 3.233 5.471 1.00 0.00 O ATOM 954 CB LEU A 65 11.309 1.192 7.669 1.00 0.00 C ATOM 955 CG LEU A 65 10.584 2.089 8.686 1.00 0.00 C ATOM 956 CD1 LEU A 65 9.206 1.531 9.082 1.00 0.00 C ATOM 957 CD2 LEU A 65 11.430 2.108 9.971 1.00 0.00 C ATOM 0 H LEU A 65 12.164 -0.359 6.106 1.00 0.00 H new ATOM 0 HA LEU A 65 9.744 1.009 6.188 1.00 0.00 H new ATOM 0 HB2 LEU A 65 11.260 0.167 8.037 1.00 0.00 H new ATOM 0 HB3 LEU A 65 12.361 1.479 7.665 1.00 0.00 H new ATOM 0 HG LEU A 65 10.452 3.071 8.232 1.00 0.00 H new ATOM 0 HD11 LEU A 65 8.735 2.201 9.802 1.00 0.00 H new ATOM 0 HD12 LEU A 65 8.577 1.451 8.195 1.00 0.00 H new ATOM 0 HD13 LEU A 65 9.328 0.545 9.530 1.00 0.00 H new ATOM 0 HD21 LEU A 65 10.944 2.737 10.717 1.00 0.00 H new ATOM 0 HD22 LEU A 65 11.526 1.094 10.358 1.00 0.00 H new ATOM 0 HD23 LEU A 65 12.420 2.507 9.749 1.00 0.00 H new ATOM 969 N THR A 66 12.254 2.919 5.290 1.00 0.00 N ATOM 970 CA THR A 66 12.538 4.173 4.665 1.00 0.00 C ATOM 971 C THR A 66 11.974 4.429 3.310 1.00 0.00 C ATOM 972 O THR A 66 11.316 5.427 3.018 1.00 0.00 O ATOM 973 CB THR A 66 14.016 4.410 4.561 1.00 0.00 C ATOM 974 OG1 THR A 66 14.442 4.398 5.915 1.00 0.00 O ATOM 975 CG2 THR A 66 14.476 5.775 4.021 1.00 0.00 C ATOM 0 H THR A 66 13.083 2.370 5.518 1.00 0.00 H new ATOM 0 HA THR A 66 12.028 4.858 5.343 1.00 0.00 H new ATOM 0 HB THR A 66 14.413 3.668 3.869 1.00 0.00 H new ATOM 0 HG1 THR A 66 14.684 3.484 6.174 1.00 0.00 H new ATOM 0 HG21 THR A 66 15.565 5.809 4.000 1.00 0.00 H new ATOM 0 HG22 THR A 66 14.088 5.917 3.012 1.00 0.00 H new ATOM 0 HG23 THR A 66 14.101 6.568 4.668 1.00 0.00 H new ATOM 983 N MET A 67 11.956 3.311 2.564 1.00 0.00 N ATOM 984 CA MET A 67 11.273 3.294 1.308 1.00 0.00 C ATOM 985 C MET A 67 9.809 3.555 1.391 1.00 0.00 C ATOM 986 O MET A 67 9.251 4.347 0.632 1.00 0.00 O ATOM 987 CB MET A 67 11.428 1.897 0.682 1.00 0.00 C ATOM 988 CG MET A 67 11.257 1.792 -0.835 1.00 0.00 C ATOM 989 SD MET A 67 11.432 0.033 -1.260 1.00 0.00 S ATOM 990 CE MET A 67 9.753 -0.283 -0.643 1.00 0.00 C ATOM 0 H MET A 67 12.406 2.433 2.824 1.00 0.00 H new ATOM 0 HA MET A 67 11.723 4.095 0.722 1.00 0.00 H new ATOM 0 HB2 MET A 67 12.418 1.519 0.938 1.00 0.00 H new ATOM 0 HB3 MET A 67 10.702 1.233 1.151 1.00 0.00 H new ATOM 0 HG2 MET A 67 10.281 2.169 -1.141 1.00 0.00 H new ATOM 0 HG3 MET A 67 12.007 2.391 -1.351 1.00 0.00 H new ATOM 0 HE1 MET A 67 9.808 -0.833 0.297 1.00 0.00 H new ATOM 0 HE2 MET A 67 9.241 0.665 -0.479 1.00 0.00 H new ATOM 0 HE3 MET A 67 9.201 -0.872 -1.376 1.00 0.00 H new ATOM 1000 N MET A 68 9.137 2.886 2.345 1.00 0.00 N ATOM 1001 CA MET A 68 7.725 2.943 2.560 1.00 0.00 C ATOM 1002 C MET A 68 7.118 4.094 3.287 1.00 0.00 C ATOM 1003 O MET A 68 5.923 4.370 3.193 1.00 0.00 O ATOM 1004 CB MET A 68 7.203 1.633 3.174 1.00 0.00 C ATOM 1005 CG MET A 68 7.357 0.447 2.221 1.00 0.00 C ATOM 1006 SD MET A 68 6.355 0.490 0.705 1.00 0.00 S ATOM 1007 CE MET A 68 4.680 0.329 1.389 1.00 0.00 C ATOM 0 H MET A 68 9.609 2.268 3.005 1.00 0.00 H new ATOM 0 HA MET A 68 7.390 3.109 1.536 1.00 0.00 H new ATOM 0 HB2 MET A 68 7.743 1.427 4.098 1.00 0.00 H new ATOM 0 HB3 MET A 68 6.152 1.751 3.438 1.00 0.00 H new ATOM 0 HG2 MET A 68 8.406 0.373 1.935 1.00 0.00 H new ATOM 0 HG3 MET A 68 7.111 -0.464 2.767 1.00 0.00 H new ATOM 0 HE1 MET A 68 3.968 0.179 0.577 1.00 0.00 H new ATOM 0 HE2 MET A 68 4.644 -0.525 2.066 1.00 0.00 H new ATOM 0 HE3 MET A 68 4.421 1.236 1.935 1.00 0.00 H new ATOM 1017 N ALA A 69 7.953 4.756 4.106 1.00 0.00 N ATOM 1018 CA ALA A 69 7.510 5.870 4.886 1.00 0.00 C ATOM 1019 C ALA A 69 7.675 7.129 4.106 1.00 0.00 C ATOM 1020 O ALA A 69 7.281 8.199 4.569 1.00 0.00 O ATOM 1021 CB ALA A 69 8.378 5.968 6.151 1.00 0.00 C ATOM 0 H ALA A 69 8.938 4.520 4.229 1.00 0.00 H new ATOM 0 HA ALA A 69 6.461 5.732 5.148 1.00 0.00 H new ATOM 0 HB1 ALA A 69 8.049 6.815 6.753 1.00 0.00 H new ATOM 0 HB2 ALA A 69 8.281 5.050 6.731 1.00 0.00 H new ATOM 0 HB3 ALA A 69 9.421 6.109 5.867 1.00 0.00 H new ATOM 1027 N ARG A 70 8.200 6.939 2.882 1.00 0.00 N ATOM 1028 CA ARG A 70 8.329 8.003 1.936 1.00 0.00 C ATOM 1029 C ARG A 70 7.002 8.465 1.441 1.00 0.00 C ATOM 1030 O ARG A 70 6.161 7.596 1.216 1.00 0.00 O ATOM 1031 CB ARG A 70 9.155 7.518 0.733 1.00 0.00 C ATOM 1032 CG ARG A 70 9.318 8.484 -0.443 1.00 0.00 C ATOM 1033 CD ARG A 70 10.237 7.885 -1.510 1.00 0.00 C ATOM 1034 NE ARG A 70 10.354 8.978 -2.516 1.00 0.00 N ATOM 1035 CZ ARG A 70 10.822 8.853 -3.792 1.00 0.00 C ATOM 1036 NH1 ARG A 70 11.177 7.644 -4.318 1.00 0.00 N ATOM 1037 NH2 ARG A 70 10.898 9.984 -4.553 1.00 0.00 N ATOM 0 H ARG A 70 8.538 6.038 2.545 1.00 0.00 H new ATOM 0 HA ARG A 70 8.822 8.835 2.439 1.00 0.00 H new ATOM 0 HB2 ARG A 70 10.150 7.253 1.092 1.00 0.00 H new ATOM 0 HB3 ARG A 70 8.697 6.603 0.357 1.00 0.00 H new ATOM 0 HG2 ARG A 70 8.343 8.704 -0.877 1.00 0.00 H new ATOM 0 HG3 ARG A 70 9.730 9.429 -0.090 1.00 0.00 H new ATOM 0 HD2 ARG A 70 11.208 7.613 -1.097 1.00 0.00 H new ATOM 0 HD3 ARG A 70 9.811 6.981 -1.946 1.00 0.00 H new ATOM 0 HE ARG A 70 10.056 9.908 -2.223 1.00 0.00 H new ATOM 0 HH11 ARG A 70 11.096 6.799 -3.753 1.00 0.00 H new ATOM 0 HH12 ARG A 70 11.523 7.586 -5.276 1.00 0.00 H new ATOM 0 HH21 ARG A 70 10.610 10.881 -4.163 1.00 0.00 H new ATOM 0 HH22 ARG A 70 11.243 9.932 -5.512 1.00 0.00 H new ATOM 1051 N LYS A 71 6.748 9.785 1.393 1.00 0.00 N ATOM 1052 CA LYS A 71 5.550 10.310 0.815 1.00 0.00 C ATOM 1053 C LYS A 71 5.586 10.524 -0.660 1.00 0.00 C ATOM 1054 O LYS A 71 6.351 11.367 -1.126 1.00 0.00 O ATOM 1055 CB LYS A 71 5.121 11.555 1.610 1.00 0.00 C ATOM 1056 CG LYS A 71 3.763 12.173 1.272 1.00 0.00 C ATOM 1057 CD LYS A 71 2.495 11.422 1.682 1.00 0.00 C ATOM 1058 CE LYS A 71 1.149 12.042 1.305 1.00 0.00 C ATOM 1059 NZ LYS A 71 0.995 12.170 -0.162 1.00 0.00 N ATOM 0 H LYS A 71 7.381 10.496 1.759 1.00 0.00 H new ATOM 0 HA LYS A 71 4.784 9.540 0.905 1.00 0.00 H new ATOM 0 HB2 LYS A 71 5.118 11.294 2.668 1.00 0.00 H new ATOM 0 HB3 LYS A 71 5.884 12.322 1.472 1.00 0.00 H new ATOM 0 HG2 LYS A 71 3.726 13.161 1.731 1.00 0.00 H new ATOM 0 HG3 LYS A 71 3.726 12.321 0.193 1.00 0.00 H new ATOM 0 HD2 LYS A 71 2.539 10.425 1.244 1.00 0.00 H new ATOM 0 HD3 LYS A 71 2.515 11.296 2.765 1.00 0.00 H new ATOM 0 HE2 LYS A 71 0.341 11.428 1.703 1.00 0.00 H new ATOM 0 HE3 LYS A 71 1.059 13.025 1.767 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 0.930 13.176 -0.418 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 1.817 11.744 -0.636 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 0.129 11.680 -0.464 1.00 0.00 H new ATOM 1073 N MET A 72 4.798 9.828 -1.498 1.00 0.00 N ATOM 1074 CA MET A 72 4.663 9.993 -2.912 1.00 0.00 C ATOM 1075 C MET A 72 3.704 11.084 -3.244 1.00 0.00 C ATOM 1076 O MET A 72 2.752 11.264 -2.486 1.00 0.00 O ATOM 1077 CB MET A 72 4.264 8.664 -3.574 1.00 0.00 C ATOM 1078 CG MET A 72 5.075 7.418 -3.213 1.00 0.00 C ATOM 1079 SD MET A 72 6.892 7.379 -3.278 1.00 0.00 S ATOM 1080 CE MET A 72 7.210 7.962 -4.968 1.00 0.00 C ATOM 0 H MET A 72 4.199 9.079 -1.150 1.00 0.00 H new ATOM 0 HA MET A 72 5.632 10.290 -3.314 1.00 0.00 H new ATOM 0 HB2 MET A 72 3.220 8.467 -3.329 1.00 0.00 H new ATOM 0 HB3 MET A 72 4.318 8.798 -4.654 1.00 0.00 H new ATOM 0 HG2 MET A 72 4.794 7.148 -2.195 1.00 0.00 H new ATOM 0 HG3 MET A 72 4.723 6.618 -3.864 1.00 0.00 H new ATOM 0 HE1 MET A 72 8.285 7.989 -5.148 1.00 0.00 H new ATOM 0 HE2 MET A 72 6.740 7.285 -5.681 1.00 0.00 H new ATOM 0 HE3 MET A 72 6.797 8.963 -5.091 1.00 0.00 H new ATOM 1090 N LYS A 73 3.878 11.939 -4.268 1.00 0.00 N ATOM 1091 CA LYS A 73 2.964 12.962 -4.669 1.00 0.00 C ATOM 1092 C LYS A 73 1.680 12.430 -5.207 1.00 0.00 C ATOM 1093 O LYS A 73 1.337 11.248 -5.201 1.00 0.00 O ATOM 1094 CB LYS A 73 3.549 14.011 -5.631 1.00 0.00 C ATOM 1095 CG LYS A 73 4.544 14.973 -4.979 1.00 0.00 C ATOM 1096 CD LYS A 73 5.727 15.380 -5.860 1.00 0.00 C ATOM 1097 CE LYS A 73 5.385 16.373 -6.972 1.00 0.00 C ATOM 1098 NZ LYS A 73 5.115 17.655 -6.285 1.00 0.00 N ATOM 0 H LYS A 73 4.713 11.913 -4.853 1.00 0.00 H new ATOM 0 HA LYS A 73 2.754 13.481 -3.733 1.00 0.00 H new ATOM 0 HB2 LYS A 73 4.044 13.496 -6.454 1.00 0.00 H new ATOM 0 HB3 LYS A 73 2.731 14.589 -6.062 1.00 0.00 H new ATOM 0 HG2 LYS A 73 4.010 15.874 -4.677 1.00 0.00 H new ATOM 0 HG3 LYS A 73 4.930 14.511 -4.070 1.00 0.00 H new ATOM 0 HD2 LYS A 73 6.500 15.816 -5.227 1.00 0.00 H new ATOM 0 HD3 LYS A 73 6.152 14.483 -6.311 1.00 0.00 H new ATOM 0 HE2 LYS A 73 6.210 16.472 -7.678 1.00 0.00 H new ATOM 0 HE3 LYS A 73 4.516 16.042 -7.541 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 5.339 18.445 -6.923 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 4.111 17.701 -6.017 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 5.705 17.722 -5.431 1.00 0.00 H new ATOM 1112 N ASP A 74 0.711 13.256 -5.638 1.00 0.00 N ATOM 1113 CA ASP A 74 -0.694 13.049 -5.802 1.00 0.00 C ATOM 1114 C ASP A 74 -1.119 12.284 -7.008 1.00 0.00 C ATOM 1115 O ASP A 74 -2.155 11.631 -6.887 1.00 0.00 O ATOM 1116 CB ASP A 74 -1.564 14.317 -5.763 1.00 0.00 C ATOM 1117 CG ASP A 74 -1.277 15.157 -4.527 1.00 0.00 C ATOM 1118 OD1 ASP A 74 -1.657 14.776 -3.388 1.00 0.00 O ATOM 1119 OD2 ASP A 74 -0.653 16.249 -4.596 1.00 0.00 O ATOM 0 H ASP A 74 0.956 14.208 -5.910 1.00 0.00 H new ATOM 0 HA ASP A 74 -0.869 12.444 -4.913 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -1.381 14.912 -6.658 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -2.617 14.037 -5.776 1.00 0.00 H new ATOM 1124 N THR A 75 -0.317 12.300 -8.087 1.00 0.00 N ATOM 1125 CA THR A 75 -0.562 11.685 -9.354 1.00 0.00 C ATOM 1126 C THR A 75 -0.099 10.270 -9.290 1.00 0.00 C ATOM 1127 O THR A 75 -0.816 9.324 -9.611 1.00 0.00 O ATOM 1128 CB THR A 75 -0.062 12.286 -10.634 1.00 0.00 C ATOM 1129 OG1 THR A 75 -0.223 13.695 -10.705 1.00 0.00 O ATOM 1130 CG2 THR A 75 -0.609 11.590 -11.892 1.00 0.00 C ATOM 0 H THR A 75 0.580 12.786 -8.069 1.00 0.00 H new ATOM 0 HA THR A 75 -1.636 11.841 -9.454 1.00 0.00 H new ATOM 0 HB THR A 75 1.012 12.100 -10.615 1.00 0.00 H new ATOM 0 HG1 THR A 75 0.124 14.021 -11.562 1.00 0.00 H new ATOM 0 HG21 THR A 75 -0.206 12.076 -12.781 1.00 0.00 H new ATOM 0 HG22 THR A 75 -0.312 10.541 -11.886 1.00 0.00 H new ATOM 0 HG23 THR A 75 -1.697 11.659 -11.902 1.00 0.00 H new ATOM 1138 N ASP A 76 1.113 10.154 -8.718 1.00 0.00 N ATOM 1139 CA ASP A 76 1.864 9.019 -8.279 1.00 0.00 C ATOM 1140 C ASP A 76 0.970 8.180 -7.431 1.00 0.00 C ATOM 1141 O ASP A 76 0.630 7.022 -7.670 1.00 0.00 O ATOM 1142 CB ASP A 76 3.073 9.395 -7.406 1.00 0.00 C ATOM 1143 CG ASP A 76 4.146 9.966 -8.321 1.00 0.00 C ATOM 1144 OD1 ASP A 76 4.499 9.255 -9.299 1.00 0.00 O ATOM 1145 OD2 ASP A 76 4.692 11.060 -8.017 1.00 0.00 O ATOM 0 H ASP A 76 1.648 11.003 -8.537 1.00 0.00 H new ATOM 0 HA ASP A 76 2.228 8.508 -9.170 1.00 0.00 H new ATOM 0 HB2 ASP A 76 2.786 10.126 -6.650 1.00 0.00 H new ATOM 0 HB3 ASP A 76 3.449 8.520 -6.876 1.00 0.00 H new ATOM 1150 N SER A 77 0.372 8.714 -6.351 1.00 0.00 N ATOM 1151 CA SER A 77 -0.484 8.124 -5.369 1.00 0.00 C ATOM 1152 C SER A 77 -1.692 7.459 -5.932 1.00 0.00 C ATOM 1153 O SER A 77 -2.144 6.448 -5.396 1.00 0.00 O ATOM 1154 CB SER A 77 -0.852 8.999 -4.159 1.00 0.00 C ATOM 1155 OG SER A 77 0.213 9.497 -3.362 1.00 0.00 O ATOM 0 H SER A 77 0.513 9.702 -6.142 1.00 0.00 H new ATOM 0 HA SER A 77 0.170 7.350 -4.967 1.00 0.00 H new ATOM 0 HB2 SER A 77 -1.427 9.851 -4.522 1.00 0.00 H new ATOM 0 HB3 SER A 77 -1.513 8.420 -3.514 1.00 0.00 H new ATOM 0 HG SER A 77 0.729 10.152 -3.877 1.00 0.00 H new ATOM 1161 N GLU A 78 -2.345 8.138 -6.891 1.00 0.00 N ATOM 1162 CA GLU A 78 -3.613 7.624 -7.308 1.00 0.00 C ATOM 1163 C GLU A 78 -3.399 6.434 -8.178 1.00 0.00 C ATOM 1164 O GLU A 78 -4.087 5.419 -8.078 1.00 0.00 O ATOM 1165 CB GLU A 78 -4.460 8.702 -8.005 1.00 0.00 C ATOM 1166 CG GLU A 78 -5.755 8.365 -8.746 1.00 0.00 C ATOM 1167 CD GLU A 78 -6.975 8.038 -7.897 1.00 0.00 C ATOM 1168 OE1 GLU A 78 -6.773 8.186 -6.663 1.00 0.00 O ATOM 1169 OE2 GLU A 78 -8.100 7.752 -8.387 1.00 0.00 O ATOM 0 H GLU A 78 -2.024 8.989 -7.353 1.00 0.00 H new ATOM 0 HA GLU A 78 -4.178 7.316 -6.429 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -4.716 9.440 -7.245 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -3.807 9.198 -8.723 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -6.006 9.209 -9.388 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -5.560 7.514 -9.399 1.00 0.00 H new ATOM 1176 N GLU A 79 -2.298 6.399 -8.949 1.00 0.00 N ATOM 1177 CA GLU A 79 -1.961 5.259 -9.744 1.00 0.00 C ATOM 1178 C GLU A 79 -1.539 4.102 -8.907 1.00 0.00 C ATOM 1179 O GLU A 79 -1.983 2.991 -9.195 1.00 0.00 O ATOM 1180 CB GLU A 79 -0.890 5.564 -10.806 1.00 0.00 C ATOM 1181 CG GLU A 79 -1.261 6.592 -11.877 1.00 0.00 C ATOM 1182 CD GLU A 79 -0.287 6.664 -13.045 1.00 0.00 C ATOM 1183 OE1 GLU A 79 0.965 6.716 -12.919 1.00 0.00 O ATOM 1184 OE2 GLU A 79 -0.900 6.714 -14.145 1.00 0.00 O ATOM 0 H GLU A 79 -1.634 7.170 -9.022 1.00 0.00 H new ATOM 0 HA GLU A 79 -2.877 4.990 -10.271 1.00 0.00 H new ATOM 0 HB2 GLU A 79 0.007 5.913 -10.295 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -0.630 4.631 -11.305 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -2.253 6.356 -12.261 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -1.325 7.576 -11.412 1.00 0.00 H new ATOM 1191 N GLU A 80 -0.833 4.337 -7.786 1.00 0.00 N ATOM 1192 CA GLU A 80 -0.571 3.275 -6.865 1.00 0.00 C ATOM 1193 C GLU A 80 -1.722 2.529 -6.283 1.00 0.00 C ATOM 1194 O GLU A 80 -1.862 1.307 -6.286 1.00 0.00 O ATOM 1195 CB GLU A 80 0.481 3.649 -5.806 1.00 0.00 C ATOM 1196 CG GLU A 80 1.794 4.146 -6.414 1.00 0.00 C ATOM 1197 CD GLU A 80 2.919 4.049 -5.393 1.00 0.00 C ATOM 1198 OE1 GLU A 80 2.833 4.720 -4.330 1.00 0.00 O ATOM 1199 OE2 GLU A 80 3.913 3.312 -5.631 1.00 0.00 O ATOM 0 H GLU A 80 -0.450 5.244 -7.521 1.00 0.00 H new ATOM 0 HA GLU A 80 -0.151 2.526 -7.536 1.00 0.00 H new ATOM 0 HB2 GLU A 80 0.073 4.422 -5.155 1.00 0.00 H new ATOM 0 HB3 GLU A 80 0.683 2.780 -5.181 1.00 0.00 H new ATOM 0 HG2 GLU A 80 2.042 3.554 -7.295 1.00 0.00 H new ATOM 0 HG3 GLU A 80 1.682 5.179 -6.745 1.00 0.00 H new ATOM 1206 N ILE A 81 -2.712 3.335 -5.862 1.00 0.00 N ATOM 1207 CA ILE A 81 -3.911 2.781 -5.315 1.00 0.00 C ATOM 1208 C ILE A 81 -4.831 2.180 -6.321 1.00 0.00 C ATOM 1209 O ILE A 81 -5.590 1.252 -6.045 1.00 0.00 O ATOM 1210 CB ILE A 81 -4.539 3.734 -4.342 1.00 0.00 C ATOM 1211 CG1 ILE A 81 -3.568 4.384 -3.341 1.00 0.00 C ATOM 1212 CG2 ILE A 81 -5.729 3.092 -3.609 1.00 0.00 C ATOM 1213 CD1 ILE A 81 -2.986 3.463 -2.269 1.00 0.00 C ATOM 0 H ILE A 81 -2.685 4.354 -5.899 1.00 0.00 H new ATOM 0 HA ILE A 81 -3.631 1.902 -4.735 1.00 0.00 H new ATOM 0 HB ILE A 81 -4.898 4.554 -4.964 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -2.742 4.823 -3.901 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -4.087 5.203 -2.844 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -6.159 3.812 -2.912 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -6.485 2.794 -4.335 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -5.387 2.215 -3.059 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -2.317 4.033 -1.624 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -3.795 3.043 -1.672 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -2.430 2.656 -2.746 1.00 0.00 H new ATOM 1225 N ARG A 82 -4.774 2.667 -7.574 1.00 0.00 N ATOM 1226 CA ARG A 82 -5.591 2.129 -8.617 1.00 0.00 C ATOM 1227 C ARG A 82 -5.101 0.785 -9.036 1.00 0.00 C ATOM 1228 O ARG A 82 -5.903 -0.142 -9.138 1.00 0.00 O ATOM 1229 CB ARG A 82 -5.711 3.105 -9.799 1.00 0.00 C ATOM 1230 CG ARG A 82 -6.788 4.172 -9.596 1.00 0.00 C ATOM 1231 CD ARG A 82 -7.032 5.234 -10.670 1.00 0.00 C ATOM 1232 NE ARG A 82 -8.304 5.922 -10.312 1.00 0.00 N ATOM 1233 CZ ARG A 82 -9.582 5.488 -10.518 1.00 0.00 C ATOM 1234 NH1 ARG A 82 -9.789 4.417 -11.339 1.00 0.00 N ATOM 1235 NH2 ARG A 82 -10.590 6.184 -9.916 1.00 0.00 N ATOM 0 H ARG A 82 -4.164 3.431 -7.864 1.00 0.00 H new ATOM 0 HA ARG A 82 -6.599 1.995 -8.224 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -4.750 3.594 -9.956 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -5.934 2.542 -10.705 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -7.732 3.652 -9.436 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -6.552 4.697 -8.670 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -6.206 5.944 -10.707 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -7.104 4.777 -11.657 1.00 0.00 H new ATOM 0 HE ARG A 82 -8.208 6.830 -9.857 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -8.996 3.956 -11.786 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -10.736 4.078 -11.506 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -10.374 6.996 -9.337 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -11.559 5.892 -10.045 1.00 0.00 H new ATOM 1249 N GLU A 83 -3.777 0.626 -9.212 1.00 0.00 N ATOM 1250 CA GLU A 83 -3.159 -0.652 -9.383 1.00 0.00 C ATOM 1251 C GLU A 83 -3.372 -1.627 -8.278 1.00 0.00 C ATOM 1252 O GLU A 83 -3.532 -2.838 -8.423 1.00 0.00 O ATOM 1253 CB GLU A 83 -1.663 -0.380 -9.620 1.00 0.00 C ATOM 1254 CG GLU A 83 -1.416 0.140 -11.038 1.00 0.00 C ATOM 1255 CD GLU A 83 -1.689 -0.938 -12.076 1.00 0.00 C ATOM 1256 OE1 GLU A 83 -2.867 -1.106 -12.490 1.00 0.00 O ATOM 1257 OE2 GLU A 83 -0.718 -1.561 -12.585 1.00 0.00 O ATOM 0 H GLU A 83 -3.120 1.406 -9.236 1.00 0.00 H new ATOM 0 HA GLU A 83 -3.633 -1.149 -10.229 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -1.303 0.349 -8.894 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -1.094 -1.296 -9.461 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -2.056 1.002 -11.228 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -0.385 0.482 -11.128 1.00 0.00 H new ATOM 1264 N ALA A 84 -3.281 -1.113 -7.038 1.00 0.00 N ATOM 1265 CA ALA A 84 -3.498 -1.897 -5.863 1.00 0.00 C ATOM 1266 C ALA A 84 -4.848 -2.527 -5.900 1.00 0.00 C ATOM 1267 O ALA A 84 -5.073 -3.686 -5.557 1.00 0.00 O ATOM 1268 CB ALA A 84 -3.166 -1.132 -4.570 1.00 0.00 C ATOM 0 H ALA A 84 -3.053 -0.137 -6.849 1.00 0.00 H new ATOM 0 HA ALA A 84 -2.785 -2.722 -5.854 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -3.349 -1.775 -3.709 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -2.118 -0.833 -4.583 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -3.795 -0.245 -4.500 1.00 0.00 H new ATOM 1274 N PHE A 85 -5.832 -1.765 -6.412 1.00 0.00 N ATOM 1275 CA PHE A 85 -7.198 -2.154 -6.573 1.00 0.00 C ATOM 1276 C PHE A 85 -7.287 -3.169 -7.660 1.00 0.00 C ATOM 1277 O PHE A 85 -8.188 -3.999 -7.546 1.00 0.00 O ATOM 1278 CB PHE A 85 -8.032 -0.918 -6.949 1.00 0.00 C ATOM 1279 CG PHE A 85 -9.495 -1.175 -6.834 1.00 0.00 C ATOM 1280 CD1 PHE A 85 -10.123 -1.390 -5.630 1.00 0.00 C ATOM 1281 CD2 PHE A 85 -10.268 -1.225 -7.971 1.00 0.00 C ATOM 1282 CE1 PHE A 85 -11.476 -1.621 -5.542 1.00 0.00 C ATOM 1283 CE2 PHE A 85 -11.640 -1.297 -7.931 1.00 0.00 C ATOM 1284 CZ PHE A 85 -12.205 -1.562 -6.706 1.00 0.00 C ATOM 0 H PHE A 85 -5.660 -0.813 -6.735 1.00 0.00 H new ATOM 0 HA PHE A 85 -7.579 -2.579 -5.645 1.00 0.00 H new ATOM 0 HB2 PHE A 85 -7.758 -0.085 -6.301 1.00 0.00 H new ATOM 0 HB3 PHE A 85 -7.796 -0.618 -7.970 1.00 0.00 H new ATOM 0 HD1 PHE A 85 -9.535 -1.377 -4.724 1.00 0.00 H new ATOM 0 HD2 PHE A 85 -9.777 -1.207 -8.933 1.00 0.00 H new ATOM 0 HE1 PHE A 85 -11.947 -1.840 -4.595 1.00 0.00 H new ATOM 0 HE2 PHE A 85 -12.243 -1.153 -8.816 1.00 0.00 H new ATOM 0 HZ PHE A 85 -13.270 -1.732 -6.656 1.00 0.00 H new ATOM 1294 N ARG A 86 -6.389 -3.129 -8.661 1.00 0.00 N ATOM 1295 CA ARG A 86 -6.463 -4.021 -9.776 1.00 0.00 C ATOM 1296 C ARG A 86 -5.870 -5.306 -9.310 1.00 0.00 C ATOM 1297 O ARG A 86 -6.154 -6.372 -9.854 1.00 0.00 O ATOM 1298 CB ARG A 86 -5.707 -3.406 -10.965 1.00 0.00 C ATOM 1299 CG ARG A 86 -5.810 -4.260 -12.230 1.00 0.00 C ATOM 1300 CD ARG A 86 -5.133 -3.667 -13.467 1.00 0.00 C ATOM 1301 NE ARG A 86 -3.653 -3.508 -13.406 1.00 0.00 N ATOM 1302 CZ ARG A 86 -2.772 -4.264 -14.126 1.00 0.00 C ATOM 1303 NH1 ARG A 86 -2.951 -5.533 -14.594 1.00 0.00 N ATOM 1304 NH2 ARG A 86 -1.505 -3.788 -14.302 1.00 0.00 N ATOM 0 H ARG A 86 -5.607 -2.475 -8.697 1.00 0.00 H new ATOM 0 HA ARG A 86 -7.482 -4.196 -10.121 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -6.104 -2.412 -11.169 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -4.657 -3.282 -10.699 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -5.371 -5.237 -12.027 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -6.864 -4.424 -12.455 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -5.373 -4.299 -14.322 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -5.573 -2.689 -13.660 1.00 0.00 H new ATOM 0 HE ARG A 86 -3.274 -2.790 -12.788 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -3.827 -6.024 -14.415 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -2.209 -5.991 -15.123 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -1.237 -2.889 -13.900 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -0.826 -4.331 -14.835 1.00 0.00 H new ATOM 1318 N VAL A 87 -5.035 -5.425 -8.263 1.00 0.00 N ATOM 1319 CA VAL A 87 -4.639 -6.698 -7.747 1.00 0.00 C ATOM 1320 C VAL A 87 -5.821 -7.514 -7.351 1.00 0.00 C ATOM 1321 O VAL A 87 -5.920 -8.650 -7.814 1.00 0.00 O ATOM 1322 CB VAL A 87 -3.617 -6.664 -6.649 1.00 0.00 C ATOM 1323 CG1 VAL A 87 -3.275 -8.025 -6.020 1.00 0.00 C ATOM 1324 CG2 VAL A 87 -2.336 -5.958 -7.125 1.00 0.00 C ATOM 0 H VAL A 87 -4.630 -4.630 -7.769 1.00 0.00 H new ATOM 0 HA VAL A 87 -4.128 -7.177 -8.582 1.00 0.00 H new ATOM 0 HB VAL A 87 -4.091 -6.096 -5.848 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -2.528 -7.887 -5.239 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -4.175 -8.463 -5.588 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -2.880 -8.691 -6.787 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -1.606 -5.943 -6.315 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -1.920 -6.494 -7.978 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -2.572 -4.935 -7.420 1.00 0.00 H new ATOM 1334 N PHE A 88 -6.774 -6.963 -6.578 1.00 0.00 N ATOM 1335 CA PHE A 88 -8.086 -7.451 -6.288 1.00 0.00 C ATOM 1336 C PHE A 88 -8.989 -7.654 -7.456 1.00 0.00 C ATOM 1337 O PHE A 88 -9.365 -8.780 -7.776 1.00 0.00 O ATOM 1338 CB PHE A 88 -8.975 -6.874 -5.173 1.00 0.00 C ATOM 1339 CG PHE A 88 -8.235 -6.708 -3.891 1.00 0.00 C ATOM 1340 CD1 PHE A 88 -7.412 -5.625 -3.693 1.00 0.00 C ATOM 1341 CD2 PHE A 88 -8.302 -7.660 -2.901 1.00 0.00 C ATOM 1342 CE1 PHE A 88 -6.534 -5.617 -2.635 1.00 0.00 C ATOM 1343 CE2 PHE A 88 -7.595 -7.538 -1.728 1.00 0.00 C ATOM 1344 CZ PHE A 88 -6.755 -6.461 -1.572 1.00 0.00 C ATOM 0 H PHE A 88 -6.602 -6.076 -6.105 1.00 0.00 H new ATOM 0 HA PHE A 88 -7.666 -8.368 -5.874 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -9.371 -5.909 -5.489 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -9.829 -7.532 -5.015 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -7.455 -4.782 -4.367 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -8.928 -8.528 -3.049 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -5.680 -4.955 -2.639 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -7.698 -8.274 -0.944 1.00 0.00 H new ATOM 0 HZ PHE A 88 -6.273 -6.279 -0.623 1.00 0.00 H new ATOM 1354 N ASP A 89 -9.441 -6.592 -8.148 1.00 0.00 N ATOM 1355 CA ASP A 89 -10.318 -6.714 -9.271 1.00 0.00 C ATOM 1356 C ASP A 89 -9.816 -7.490 -10.440 1.00 0.00 C ATOM 1357 O ASP A 89 -8.850 -7.150 -11.120 1.00 0.00 O ATOM 1358 CB ASP A 89 -10.857 -5.337 -9.692 1.00 0.00 C ATOM 1359 CG ASP A 89 -12.123 -5.354 -10.535 1.00 0.00 C ATOM 1360 OD1 ASP A 89 -13.134 -6.023 -10.190 1.00 0.00 O ATOM 1361 OD2 ASP A 89 -12.037 -4.701 -11.610 1.00 0.00 O ATOM 0 H ASP A 89 -9.192 -5.629 -7.922 1.00 0.00 H new ATOM 0 HA ASP A 89 -11.131 -7.338 -8.901 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -11.049 -4.752 -8.793 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -10.078 -4.817 -10.250 1.00 0.00 H new ATOM 1366 N LYS A 90 -10.384 -8.694 -10.635 1.00 0.00 N ATOM 1367 CA LYS A 90 -9.804 -9.720 -11.445 1.00 0.00 C ATOM 1368 C LYS A 90 -10.329 -9.593 -12.833 1.00 0.00 C ATOM 1369 O LYS A 90 -9.510 -9.577 -13.750 1.00 0.00 O ATOM 1370 CB LYS A 90 -10.208 -11.089 -10.872 1.00 0.00 C ATOM 1371 CG LYS A 90 -9.655 -12.317 -11.597 1.00 0.00 C ATOM 1372 CD LYS A 90 -8.140 -12.524 -11.543 1.00 0.00 C ATOM 1373 CE LYS A 90 -7.569 -13.502 -12.571 1.00 0.00 C ATOM 1374 NZ LYS A 90 -6.100 -13.455 -12.399 1.00 0.00 N ATOM 0 H LYS A 90 -11.275 -8.962 -10.216 1.00 0.00 H new ATOM 0 HA LYS A 90 -8.718 -9.627 -11.452 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -9.887 -11.133 -9.831 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -11.296 -11.153 -10.873 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -10.134 -13.203 -11.180 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -9.953 -12.257 -12.644 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -7.654 -11.558 -11.679 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -7.875 -12.877 -10.546 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -7.950 -14.510 -12.406 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -7.854 -13.216 -13.583 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -5.650 -14.104 -13.076 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -5.761 -12.487 -12.571 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -5.855 -13.741 -11.430 1.00 0.00 H new ATOM 1388 N ASP A 91 -11.663 -9.436 -12.913 1.00 0.00 N ATOM 1389 CA ASP A 91 -12.477 -9.507 -14.087 1.00 0.00 C ATOM 1390 C ASP A 91 -12.364 -8.256 -14.888 1.00 0.00 C ATOM 1391 O ASP A 91 -11.650 -8.221 -15.889 1.00 0.00 O ATOM 1392 CB ASP A 91 -13.891 -9.981 -13.711 1.00 0.00 C ATOM 1393 CG ASP A 91 -14.381 -9.307 -12.438 1.00 0.00 C ATOM 1394 OD1 ASP A 91 -14.587 -8.068 -12.340 1.00 0.00 O ATOM 1395 OD2 ASP A 91 -14.521 -10.004 -11.397 1.00 0.00 O ATOM 0 H ASP A 91 -12.219 -9.242 -12.080 1.00 0.00 H new ATOM 0 HA ASP A 91 -12.117 -10.269 -14.779 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -14.579 -9.763 -14.528 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -13.890 -11.062 -13.575 1.00 0.00 H new ATOM 1400 N GLY A 92 -13.127 -7.238 -14.451 1.00 0.00 N ATOM 1401 CA GLY A 92 -12.987 -5.896 -14.926 1.00 0.00 C ATOM 1402 C GLY A 92 -14.237 -5.097 -14.783 1.00 0.00 C ATOM 1403 O GLY A 92 -14.518 -4.112 -15.463 1.00 0.00 O ATOM 0 H GLY A 92 -13.859 -7.350 -13.750 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -12.183 -5.404 -14.379 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -12.693 -5.916 -15.975 1.00 0.00 H new ATOM 1407 N ASN A 93 -14.962 -5.472 -13.714 1.00 0.00 N ATOM 1408 CA ASN A 93 -16.181 -4.800 -13.386 1.00 0.00 C ATOM 1409 C ASN A 93 -16.041 -3.576 -12.549 1.00 0.00 C ATOM 1410 O ASN A 93 -16.906 -2.709 -12.667 1.00 0.00 O ATOM 1411 CB ASN A 93 -17.372 -5.669 -12.948 1.00 0.00 C ATOM 1412 CG ASN A 93 -17.291 -6.202 -11.524 1.00 0.00 C ATOM 1413 OD1 ASN A 93 -16.288 -6.122 -10.817 1.00 0.00 O ATOM 1414 ND2 ASN A 93 -18.452 -6.738 -11.062 1.00 0.00 N ATOM 0 H ASN A 93 -14.708 -6.232 -13.083 1.00 0.00 H new ATOM 0 HA ASN A 93 -16.459 -4.456 -14.382 1.00 0.00 H new ATOM 0 HB2 ASN A 93 -18.286 -5.084 -13.049 1.00 0.00 H new ATOM 0 HB3 ASN A 93 -17.457 -6.514 -13.632 1.00 0.00 H new ATOM 0 HD21 ASN A 93 -18.507 -7.087 -10.105 1.00 0.00 H new ATOM 0 HD22 ASN A 93 -19.268 -6.791 -11.672 1.00 0.00 H new ATOM 1421 N GLY A 94 -14.969 -3.473 -11.743 1.00 0.00 N ATOM 1422 CA GLY A 94 -14.818 -2.343 -10.880 1.00 0.00 C ATOM 1423 C GLY A 94 -15.269 -2.508 -9.469 1.00 0.00 C ATOM 1424 O GLY A 94 -15.089 -1.602 -8.656 1.00 0.00 O ATOM 0 H GLY A 94 -14.218 -4.161 -11.688 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -13.765 -2.063 -10.869 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -15.366 -1.507 -11.316 1.00 0.00 H new ATOM 1428 N TYR A 95 -15.629 -3.734 -9.049 1.00 0.00 N ATOM 1429 CA TYR A 95 -16.264 -4.067 -7.812 1.00 0.00 C ATOM 1430 C TYR A 95 -15.628 -5.330 -7.343 1.00 0.00 C ATOM 1431 O TYR A 95 -15.631 -6.407 -7.938 1.00 0.00 O ATOM 1432 CB TYR A 95 -17.734 -4.503 -7.935 1.00 0.00 C ATOM 1433 CG TYR A 95 -18.624 -3.377 -8.337 1.00 0.00 C ATOM 1434 CD1 TYR A 95 -18.902 -2.497 -7.318 1.00 0.00 C ATOM 1435 CD2 TYR A 95 -19.276 -3.196 -9.534 1.00 0.00 C ATOM 1436 CE1 TYR A 95 -19.816 -1.485 -7.495 1.00 0.00 C ATOM 1437 CE2 TYR A 95 -20.195 -2.195 -9.741 1.00 0.00 C ATOM 1438 CZ TYR A 95 -20.408 -1.297 -8.722 1.00 0.00 C ATOM 1439 OH TYR A 95 -21.050 -0.055 -8.910 1.00 0.00 O ATOM 0 H TYR A 95 -15.461 -4.560 -9.624 1.00 0.00 H new ATOM 0 HA TYR A 95 -16.180 -3.177 -7.188 1.00 0.00 H new ATOM 0 HB2 TYR A 95 -17.813 -5.306 -8.668 1.00 0.00 H new ATOM 0 HB3 TYR A 95 -18.072 -4.908 -6.981 1.00 0.00 H new ATOM 0 HD1 TYR A 95 -18.397 -2.602 -6.369 1.00 0.00 H new ATOM 0 HD2 TYR A 95 -19.056 -3.871 -10.348 1.00 0.00 H new ATOM 0 HE1 TYR A 95 -20.069 -0.837 -6.669 1.00 0.00 H new ATOM 0 HE2 TYR A 95 -20.733 -2.116 -10.674 1.00 0.00 H new ATOM 0 HH TYR A 95 -21.436 -0.019 -9.810 1.00 0.00 H new ATOM 1449 N ILE A 96 -15.070 -5.305 -6.120 1.00 0.00 N ATOM 1450 CA ILE A 96 -14.446 -6.410 -5.461 1.00 0.00 C ATOM 1451 C ILE A 96 -15.463 -7.312 -4.850 1.00 0.00 C ATOM 1452 O ILE A 96 -16.231 -6.889 -3.987 1.00 0.00 O ATOM 1453 CB ILE A 96 -13.457 -6.003 -4.409 1.00 0.00 C ATOM 1454 CG1 ILE A 96 -12.386 -5.102 -5.047 1.00 0.00 C ATOM 1455 CG2 ILE A 96 -12.867 -7.238 -3.707 1.00 0.00 C ATOM 1456 CD1 ILE A 96 -11.311 -4.623 -4.073 1.00 0.00 C ATOM 0 H ILE A 96 -15.054 -4.456 -5.555 1.00 0.00 H new ATOM 0 HA ILE A 96 -13.895 -6.936 -6.241 1.00 0.00 H new ATOM 0 HB ILE A 96 -13.954 -5.426 -3.629 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -11.907 -5.646 -5.861 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -12.874 -4.233 -5.488 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -12.153 -6.919 -2.948 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -13.669 -7.806 -3.234 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -12.361 -7.866 -4.440 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -10.595 -3.994 -4.602 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -11.776 -4.049 -3.271 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -10.794 -5.484 -3.650 1.00 0.00 H new ATOM 1468 N SER A 97 -15.431 -8.592 -5.262 1.00 0.00 N ATOM 1469 CA SER A 97 -16.287 -9.607 -4.731 1.00 0.00 C ATOM 1470 C SER A 97 -15.592 -10.347 -3.641 1.00 0.00 C ATOM 1471 O SER A 97 -14.394 -10.227 -3.391 1.00 0.00 O ATOM 1472 CB SER A 97 -16.840 -10.561 -5.803 1.00 0.00 C ATOM 1473 OG SER A 97 -17.859 -11.417 -5.310 1.00 0.00 O ATOM 0 H SER A 97 -14.794 -8.930 -5.983 1.00 0.00 H new ATOM 0 HA SER A 97 -17.159 -9.103 -4.315 1.00 0.00 H new ATOM 0 HB2 SER A 97 -17.235 -9.976 -6.634 1.00 0.00 H new ATOM 0 HB3 SER A 97 -16.024 -11.166 -6.199 1.00 0.00 H new ATOM 0 HG SER A 97 -18.175 -11.999 -6.032 1.00 0.00 H new ATOM 1479 N ALA A 98 -16.410 -11.095 -2.878 1.00 0.00 N ATOM 1480 CA ALA A 98 -16.068 -12.088 -1.907 1.00 0.00 C ATOM 1481 C ALA A 98 -15.111 -13.168 -2.278 1.00 0.00 C ATOM 1482 O ALA A 98 -14.141 -13.482 -1.590 1.00 0.00 O ATOM 1483 CB ALA A 98 -17.386 -12.635 -1.334 1.00 0.00 C ATOM 0 H ALA A 98 -17.422 -10.989 -2.953 1.00 0.00 H new ATOM 0 HA ALA A 98 -15.461 -11.571 -1.164 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -17.169 -13.398 -0.587 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -17.946 -11.823 -0.871 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -17.978 -13.072 -2.138 1.00 0.00 H new ATOM 1489 N ALA A 99 -15.332 -13.612 -3.528 1.00 0.00 N ATOM 1490 CA ALA A 99 -14.427 -14.385 -4.319 1.00 0.00 C ATOM 1491 C ALA A 99 -13.040 -13.842 -4.382 1.00 0.00 C ATOM 1492 O ALA A 99 -11.999 -14.385 -4.015 1.00 0.00 O ATOM 1493 CB ALA A 99 -14.938 -14.577 -5.757 1.00 0.00 C ATOM 0 H ALA A 99 -16.204 -13.416 -4.019 1.00 0.00 H new ATOM 0 HA ALA A 99 -14.384 -15.342 -3.799 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -14.219 -15.170 -6.322 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -15.898 -15.093 -5.736 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -15.060 -13.604 -6.233 1.00 0.00 H new ATOM 1499 N GLU A 100 -12.976 -12.627 -4.954 1.00 0.00 N ATOM 1500 CA GLU A 100 -11.773 -11.909 -5.241 1.00 0.00 C ATOM 1501 C GLU A 100 -10.973 -11.547 -4.038 1.00 0.00 C ATOM 1502 O GLU A 100 -9.753 -11.419 -4.137 1.00 0.00 O ATOM 1503 CB GLU A 100 -12.210 -10.636 -5.987 1.00 0.00 C ATOM 1504 CG GLU A 100 -12.560 -10.785 -7.469 1.00 0.00 C ATOM 1505 CD GLU A 100 -13.082 -9.545 -8.180 1.00 0.00 C ATOM 1506 OE1 GLU A 100 -14.137 -9.017 -7.735 1.00 0.00 O ATOM 1507 OE2 GLU A 100 -12.519 -9.084 -9.208 1.00 0.00 O ATOM 0 H GLU A 100 -13.814 -12.116 -5.232 1.00 0.00 H new ATOM 0 HA GLU A 100 -11.113 -12.547 -5.829 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -13.079 -10.224 -5.474 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -11.410 -9.901 -5.900 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -11.669 -11.128 -7.995 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -13.309 -11.571 -7.564 1.00 0.00 H new ATOM 1514 N LEU A 101 -11.657 -11.412 -2.888 1.00 0.00 N ATOM 1515 CA LEU A 101 -11.070 -11.108 -1.620 1.00 0.00 C ATOM 1516 C LEU A 101 -10.251 -12.255 -1.137 1.00 0.00 C ATOM 1517 O LEU A 101 -9.057 -12.115 -0.879 1.00 0.00 O ATOM 1518 CB LEU A 101 -12.121 -10.663 -0.588 1.00 0.00 C ATOM 1519 CG LEU A 101 -11.557 -9.866 0.601 1.00 0.00 C ATOM 1520 CD1 LEU A 101 -10.598 -8.778 0.089 1.00 0.00 C ATOM 1521 CD2 LEU A 101 -12.649 -9.134 1.399 1.00 0.00 C ATOM 0 H LEU A 101 -12.670 -11.520 -2.840 1.00 0.00 H new ATOM 0 HA LEU A 101 -10.402 -10.257 -1.753 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -12.871 -10.054 -1.093 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -12.632 -11.547 -0.206 1.00 0.00 H new ATOM 0 HG LEU A 101 -11.061 -10.594 1.243 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -10.201 -8.216 0.934 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -9.776 -9.244 -0.455 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -11.136 -8.102 -0.576 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -12.192 -8.589 2.225 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -13.169 -8.434 0.746 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -13.360 -9.860 1.793 1.00 0.00 H new ATOM 1533 N ARG A 102 -10.910 -13.426 -1.068 1.00 0.00 N ATOM 1534 CA ARG A 102 -10.342 -14.705 -0.775 1.00 0.00 C ATOM 1535 C ARG A 102 -9.165 -15.091 -1.603 1.00 0.00 C ATOM 1536 O ARG A 102 -8.161 -15.512 -1.030 1.00 0.00 O ATOM 1537 CB ARG A 102 -11.458 -15.756 -0.904 1.00 0.00 C ATOM 1538 CG ARG A 102 -11.150 -17.168 -0.404 1.00 0.00 C ATOM 1539 CD ARG A 102 -12.311 -18.164 -0.372 1.00 0.00 C ATOM 1540 NE ARG A 102 -13.494 -17.774 0.445 1.00 0.00 N ATOM 1541 CZ ARG A 102 -14.618 -17.219 -0.095 1.00 0.00 C ATOM 1542 NH1 ARG A 102 -14.802 -16.962 -1.423 1.00 0.00 N ATOM 1543 NH2 ARG A 102 -15.677 -17.186 0.766 1.00 0.00 N ATOM 0 H ARG A 102 -11.916 -13.481 -1.230 1.00 0.00 H new ATOM 0 HA ARG A 102 -9.943 -14.648 0.238 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -12.331 -15.390 -0.364 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -11.738 -15.824 -1.955 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -10.363 -17.585 -1.032 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -10.744 -17.089 0.605 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -12.644 -18.334 -1.396 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -11.935 -19.116 0.003 1.00 0.00 H new ATOM 0 HE ARG A 102 -13.463 -17.929 1.453 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -14.067 -17.188 -2.093 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -15.675 -16.544 -1.745 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -15.577 -17.556 1.711 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -16.568 -16.791 0.464 1.00 0.00 H new ATOM 1557 N HIS A 103 -9.270 -14.983 -2.939 1.00 0.00 N ATOM 1558 CA HIS A 103 -8.219 -15.310 -3.853 1.00 0.00 C ATOM 1559 C HIS A 103 -6.884 -14.679 -3.657 1.00 0.00 C ATOM 1560 O HIS A 103 -5.877 -15.384 -3.673 1.00 0.00 O ATOM 1561 CB HIS A 103 -8.712 -15.075 -5.290 1.00 0.00 C ATOM 1562 CG HIS A 103 -9.684 -16.132 -5.725 1.00 0.00 C ATOM 1563 ND1 HIS A 103 -9.510 -17.500 -5.680 1.00 0.00 N ATOM 1564 CD2 HIS A 103 -10.902 -15.952 -6.301 1.00 0.00 C ATOM 1565 CE1 HIS A 103 -10.619 -18.096 -6.196 1.00 0.00 C ATOM 1566 NE2 HIS A 103 -11.490 -17.174 -6.561 1.00 0.00 N ATOM 0 H HIS A 103 -10.119 -14.656 -3.401 1.00 0.00 H new ATOM 0 HA HIS A 103 -8.012 -16.359 -3.639 1.00 0.00 H new ATOM 0 HB2 HIS A 103 -9.186 -14.096 -5.356 1.00 0.00 H new ATOM 0 HB3 HIS A 103 -7.860 -15.063 -5.969 1.00 0.00 H new ATOM 0 HD2 HIS A 103 -11.345 -14.993 -6.523 1.00 0.00 H new ATOM 0 HE1 HIS A 103 -10.764 -19.162 -6.292 1.00 0.00 H new ATOM 0 HE2 HIS A 103 -12.416 -17.333 -6.958 1.00 0.00 H new ATOM 1574 N VAL A 104 -6.944 -13.366 -3.370 1.00 0.00 N ATOM 1575 CA VAL A 104 -5.780 -12.537 -3.320 1.00 0.00 C ATOM 1576 C VAL A 104 -5.171 -12.765 -1.979 1.00 0.00 C ATOM 1577 O VAL A 104 -3.951 -12.901 -1.900 1.00 0.00 O ATOM 1578 CB VAL A 104 -6.157 -11.122 -3.643 1.00 0.00 C ATOM 1579 CG1 VAL A 104 -5.363 -10.057 -2.869 1.00 0.00 C ATOM 1580 CG2 VAL A 104 -5.937 -10.898 -5.149 1.00 0.00 C ATOM 0 H VAL A 104 -7.814 -12.873 -3.170 1.00 0.00 H new ATOM 0 HA VAL A 104 -5.024 -12.780 -4.067 1.00 0.00 H new ATOM 0 HB VAL A 104 -7.199 -11.002 -3.346 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -5.701 -9.064 -3.165 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -5.523 -10.190 -1.799 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -4.301 -10.160 -3.093 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -6.205 -9.874 -5.407 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -4.889 -11.071 -5.393 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -6.561 -11.590 -5.715 1.00 0.00 H new ATOM 1590 N MET A 105 -5.908 -12.935 -0.866 1.00 0.00 N ATOM 1591 CA MET A 105 -5.287 -13.497 0.292 1.00 0.00 C ATOM 1592 C MET A 105 -4.581 -14.805 0.195 1.00 0.00 C ATOM 1593 O MET A 105 -3.425 -14.808 0.614 1.00 0.00 O ATOM 1594 CB MET A 105 -6.410 -13.731 1.317 1.00 0.00 C ATOM 1595 CG MET A 105 -7.160 -12.502 1.835 1.00 0.00 C ATOM 1596 SD MET A 105 -6.006 -11.419 2.729 1.00 0.00 S ATOM 1597 CE MET A 105 -7.130 -10.030 3.051 1.00 0.00 C ATOM 0 H MET A 105 -6.894 -12.694 -0.768 1.00 0.00 H new ATOM 0 HA MET A 105 -4.505 -12.776 0.529 1.00 0.00 H new ATOM 0 HB2 MET A 105 -7.139 -14.406 0.869 1.00 0.00 H new ATOM 0 HB3 MET A 105 -5.980 -14.249 2.174 1.00 0.00 H new ATOM 0 HG2 MET A 105 -7.612 -11.962 1.003 1.00 0.00 H new ATOM 0 HG3 MET A 105 -7.972 -12.809 2.494 1.00 0.00 H new ATOM 0 HE1 MET A 105 -6.574 -9.209 3.503 1.00 0.00 H new ATOM 0 HE2 MET A 105 -7.572 -9.695 2.113 1.00 0.00 H new ATOM 0 HE3 MET A 105 -7.920 -10.351 3.730 1.00 0.00 H new ATOM 1607 N THR A 106 -5.186 -15.881 -0.339 1.00 0.00 N ATOM 1608 CA THR A 106 -4.621 -17.190 -0.451 1.00 0.00 C ATOM 1609 C THR A 106 -3.443 -17.098 -1.359 1.00 0.00 C ATOM 1610 O THR A 106 -2.540 -17.892 -1.100 1.00 0.00 O ATOM 1611 CB THR A 106 -5.576 -18.162 -1.079 1.00 0.00 C ATOM 1612 OG1 THR A 106 -6.868 -18.117 -0.490 1.00 0.00 O ATOM 1613 CG2 THR A 106 -5.040 -19.603 -1.107 1.00 0.00 C ATOM 0 H THR A 106 -6.132 -15.832 -0.717 1.00 0.00 H new ATOM 0 HA THR A 106 -4.367 -17.537 0.550 1.00 0.00 H new ATOM 0 HB THR A 106 -5.672 -17.835 -2.114 1.00 0.00 H new ATOM 0 HG1 THR A 106 -7.344 -17.321 -0.806 1.00 0.00 H new ATOM 0 HG21 THR A 106 -5.777 -20.256 -1.573 1.00 0.00 H new ATOM 0 HG22 THR A 106 -4.113 -19.635 -1.679 1.00 0.00 H new ATOM 0 HG23 THR A 106 -4.849 -19.940 -0.088 1.00 0.00 H new ATOM 1621 N ASN A 107 -3.479 -16.339 -2.469 1.00 0.00 N ATOM 1622 CA ASN A 107 -2.358 -16.118 -3.328 1.00 0.00 C ATOM 1623 C ASN A 107 -1.211 -15.435 -2.666 1.00 0.00 C ATOM 1624 O ASN A 107 -0.079 -15.912 -2.722 1.00 0.00 O ATOM 1625 CB ASN A 107 -2.738 -15.331 -4.594 1.00 0.00 C ATOM 1626 CG ASN A 107 -3.597 -16.168 -5.530 1.00 0.00 C ATOM 1627 OD1 ASN A 107 -3.883 -17.334 -5.264 1.00 0.00 O ATOM 1628 ND2 ASN A 107 -4.183 -15.475 -6.543 1.00 0.00 N ATOM 0 H ASN A 107 -4.324 -15.860 -2.780 1.00 0.00 H new ATOM 0 HA ASN A 107 -2.036 -17.123 -3.602 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -3.278 -14.426 -4.314 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -1.833 -15.015 -5.113 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -4.894 -15.922 -7.122 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -3.911 -14.509 -6.724 1.00 0.00 H new ATOM 1635 N LEU A 108 -1.434 -14.357 -1.893 1.00 0.00 N ATOM 1636 CA LEU A 108 -0.443 -13.512 -1.304 1.00 0.00 C ATOM 1637 C LEU A 108 0.209 -14.208 -0.159 1.00 0.00 C ATOM 1638 O LEU A 108 1.390 -14.057 0.150 1.00 0.00 O ATOM 1639 CB LEU A 108 -1.155 -12.265 -0.753 1.00 0.00 C ATOM 1640 CG LEU A 108 -0.145 -11.226 -0.236 1.00 0.00 C ATOM 1641 CD1 LEU A 108 0.586 -10.286 -1.209 1.00 0.00 C ATOM 1642 CD2 LEU A 108 -0.967 -10.413 0.778 1.00 0.00 C ATOM 0 H LEU A 108 -2.381 -14.055 -1.663 1.00 0.00 H new ATOM 0 HA LEU A 108 0.308 -13.253 -2.051 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -1.770 -11.820 -1.535 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -1.827 -12.555 0.055 1.00 0.00 H new ATOM 0 HG LEU A 108 0.714 -11.784 0.136 1.00 0.00 H new ATOM 0 HD11 LEU A 108 1.253 -9.630 -0.649 1.00 0.00 H new ATOM 0 HD12 LEU A 108 1.167 -10.876 -1.917 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -0.144 -9.684 -1.751 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -0.340 -9.635 1.214 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -1.817 -9.954 0.273 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -1.327 -11.073 1.567 1.00 0.00 H new ATOM 1654 N GLY A 109 -0.556 -15.105 0.487 1.00 0.00 N ATOM 1655 CA GLY A 109 0.004 -15.984 1.467 1.00 0.00 C ATOM 1656 C GLY A 109 -0.575 -15.693 2.809 1.00 0.00 C ATOM 1657 O GLY A 109 0.083 -15.822 3.840 1.00 0.00 O ATOM 0 H GLY A 109 -1.557 -15.222 0.333 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -0.196 -17.020 1.193 1.00 0.00 H new ATOM 0 HA3 GLY A 109 1.087 -15.865 1.496 1.00 0.00 H new ATOM 1661 N GLU A 110 -1.839 -15.233 2.802 1.00 0.00 N ATOM 1662 CA GLU A 110 -2.654 -15.083 3.968 1.00 0.00 C ATOM 1663 C GLU A 110 -3.745 -16.097 4.012 1.00 0.00 C ATOM 1664 O GLU A 110 -4.009 -16.908 3.126 1.00 0.00 O ATOM 1665 CB GLU A 110 -3.296 -13.686 3.998 1.00 0.00 C ATOM 1666 CG GLU A 110 -2.896 -12.646 5.046 1.00 0.00 C ATOM 1667 CD GLU A 110 -3.442 -12.922 6.440 1.00 0.00 C ATOM 1668 OE1 GLU A 110 -3.450 -14.091 6.910 1.00 0.00 O ATOM 1669 OE2 GLU A 110 -3.879 -11.932 7.086 1.00 0.00 O ATOM 0 H GLU A 110 -2.315 -14.953 1.944 1.00 0.00 H new ATOM 0 HA GLU A 110 -2.001 -15.222 4.830 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -3.120 -13.235 3.021 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -4.372 -13.833 4.092 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -1.808 -12.598 5.097 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -3.243 -11.666 4.720 1.00 0.00 H new ATOM 1676 N LYS A 111 -4.393 -16.277 5.177 1.00 0.00 N ATOM 1677 CA LYS A 111 -5.385 -17.285 5.385 1.00 0.00 C ATOM 1678 C LYS A 111 -6.544 -16.442 5.791 1.00 0.00 C ATOM 1679 O LYS A 111 -6.394 -15.394 6.417 1.00 0.00 O ATOM 1680 CB LYS A 111 -5.144 -18.395 6.423 1.00 0.00 C ATOM 1681 CG LYS A 111 -6.245 -19.452 6.535 1.00 0.00 C ATOM 1682 CD LYS A 111 -6.324 -20.358 5.305 1.00 0.00 C ATOM 1683 CE LYS A 111 -7.387 -21.447 5.454 1.00 0.00 C ATOM 1684 NZ LYS A 111 -7.402 -22.339 4.273 1.00 0.00 N ATOM 0 H LYS A 111 -4.220 -15.702 6.001 1.00 0.00 H new ATOM 0 HA LYS A 111 -5.466 -17.900 4.489 1.00 0.00 H new ATOM 0 HB2 LYS A 111 -4.208 -18.897 6.179 1.00 0.00 H new ATOM 0 HB3 LYS A 111 -5.012 -17.930 7.400 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -6.067 -20.063 7.420 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -7.205 -18.956 6.678 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -6.547 -19.754 4.425 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -5.353 -20.822 5.135 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -7.191 -22.031 6.353 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -8.368 -20.988 5.580 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 -8.132 -23.069 4.399 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 -7.613 -21.782 3.420 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 -6.472 -22.793 4.169 1.00 0.00 H new ATOM 1698 N LEU A 112 -7.762 -16.871 5.414 1.00 0.00 N ATOM 1699 CA LEU A 112 -8.917 -16.262 5.998 1.00 0.00 C ATOM 1700 C LEU A 112 -10.145 -17.099 5.888 1.00 0.00 C ATOM 1701 O LEU A 112 -10.307 -17.846 4.925 1.00 0.00 O ATOM 1702 CB LEU A 112 -9.060 -14.810 5.511 1.00 0.00 C ATOM 1703 CG LEU A 112 -10.035 -14.399 4.395 1.00 0.00 C ATOM 1704 CD1 LEU A 112 -10.034 -12.864 4.310 1.00 0.00 C ATOM 1705 CD2 LEU A 112 -9.833 -15.146 3.065 1.00 0.00 C ATOM 0 H LEU A 112 -7.945 -17.608 4.734 1.00 0.00 H new ATOM 0 HA LEU A 112 -8.769 -16.203 7.076 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -9.319 -14.213 6.385 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -8.068 -14.491 5.190 1.00 0.00 H new ATOM 0 HG LEU A 112 -11.044 -14.723 4.650 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -10.718 -12.543 3.525 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -10.355 -12.447 5.264 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -9.028 -12.513 4.080 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -10.562 -14.794 2.336 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -8.826 -14.958 2.691 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -9.967 -16.216 3.225 1.00 0.00 H new ATOM 1717 N THR A 113 -11.101 -17.036 6.832 1.00 0.00 N ATOM 1718 CA THR A 113 -12.275 -17.853 6.839 1.00 0.00 C ATOM 1719 C THR A 113 -13.415 -17.131 6.208 1.00 0.00 C ATOM 1720 O THR A 113 -13.312 -15.946 5.895 1.00 0.00 O ATOM 1721 CB THR A 113 -12.613 -18.329 8.221 1.00 0.00 C ATOM 1722 OG1 THR A 113 -12.790 -17.238 9.112 1.00 0.00 O ATOM 1723 CG2 THR A 113 -11.517 -19.281 8.730 1.00 0.00 C ATOM 0 H THR A 113 -11.055 -16.391 7.621 1.00 0.00 H new ATOM 0 HA THR A 113 -12.070 -18.744 6.245 1.00 0.00 H new ATOM 0 HB THR A 113 -13.557 -18.871 8.178 1.00 0.00 H new ATOM 0 HG1 THR A 113 -13.011 -17.577 10.005 1.00 0.00 H new ATOM 0 HG21 THR A 113 -11.769 -19.623 9.734 1.00 0.00 H new ATOM 0 HG22 THR A 113 -11.442 -20.140 8.063 1.00 0.00 H new ATOM 0 HG23 THR A 113 -10.562 -18.756 8.755 1.00 0.00 H new ATOM 1731 N ASP A 114 -14.593 -17.737 5.978 1.00 0.00 N ATOM 1732 CA ASP A 114 -15.739 -17.166 5.341 1.00 0.00 C ATOM 1733 C ASP A 114 -16.434 -16.165 6.198 1.00 0.00 C ATOM 1734 O ASP A 114 -17.015 -15.199 5.706 1.00 0.00 O ATOM 1735 CB ASP A 114 -16.672 -18.265 4.804 1.00 0.00 C ATOM 1736 CG ASP A 114 -15.865 -19.179 3.894 1.00 0.00 C ATOM 1737 OD1 ASP A 114 -15.199 -18.656 2.961 1.00 0.00 O ATOM 1738 OD2 ASP A 114 -15.918 -20.427 4.061 1.00 0.00 O ATOM 0 H ASP A 114 -14.756 -18.703 6.261 1.00 0.00 H new ATOM 0 HA ASP A 114 -15.390 -16.599 4.478 1.00 0.00 H new ATOM 0 HB2 ASP A 114 -17.101 -18.834 5.629 1.00 0.00 H new ATOM 0 HB3 ASP A 114 -17.503 -17.822 4.256 1.00 0.00 H new ATOM 1743 N GLU A 115 -16.321 -16.466 7.505 1.00 0.00 N ATOM 1744 CA GLU A 115 -16.688 -15.633 8.607 1.00 0.00 C ATOM 1745 C GLU A 115 -15.927 -14.357 8.495 1.00 0.00 C ATOM 1746 O GLU A 115 -16.461 -13.268 8.704 1.00 0.00 O ATOM 1747 CB GLU A 115 -16.296 -16.247 9.962 1.00 0.00 C ATOM 1748 CG GLU A 115 -16.836 -15.552 11.213 1.00 0.00 C ATOM 1749 CD GLU A 115 -16.676 -16.372 12.485 1.00 0.00 C ATOM 1750 OE1 GLU A 115 -15.501 -16.750 12.739 1.00 0.00 O ATOM 1751 OE2 GLU A 115 -17.660 -16.489 13.264 1.00 0.00 O ATOM 0 H GLU A 115 -15.943 -17.362 7.812 1.00 0.00 H new ATOM 0 HA GLU A 115 -17.769 -15.500 8.570 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -16.633 -17.283 9.976 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -15.208 -16.265 10.025 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -16.322 -14.599 11.339 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -17.893 -15.328 11.066 1.00 0.00 H new ATOM 1758 N GLU A 116 -14.630 -14.485 8.161 1.00 0.00 N ATOM 1759 CA GLU A 116 -13.707 -13.401 8.026 1.00 0.00 C ATOM 1760 C GLU A 116 -13.977 -12.596 6.802 1.00 0.00 C ATOM 1761 O GLU A 116 -14.060 -11.369 6.796 1.00 0.00 O ATOM 1762 CB GLU A 116 -12.256 -13.854 8.261 1.00 0.00 C ATOM 1763 CG GLU A 116 -11.375 -12.617 8.441 1.00 0.00 C ATOM 1764 CD GLU A 116 -10.143 -12.875 9.297 1.00 0.00 C ATOM 1765 OE1 GLU A 116 -9.461 -13.875 8.947 1.00 0.00 O ATOM 1766 OE2 GLU A 116 -9.830 -12.216 10.324 1.00 0.00 O ATOM 0 H GLU A 116 -14.203 -15.393 7.976 1.00 0.00 H new ATOM 0 HA GLU A 116 -13.870 -12.684 8.830 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -12.198 -14.490 9.144 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -11.905 -14.448 7.417 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -11.060 -12.258 7.461 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -11.965 -11.822 8.896 1.00 0.00 H new ATOM 1773 N VAL A 117 -14.325 -13.193 5.648 1.00 0.00 N ATOM 1774 CA VAL A 117 -14.680 -12.563 4.415 1.00 0.00 C ATOM 1775 C VAL A 117 -15.934 -11.769 4.539 1.00 0.00 C ATOM 1776 O VAL A 117 -15.997 -10.629 4.081 1.00 0.00 O ATOM 1777 CB VAL A 117 -14.715 -13.600 3.332 1.00 0.00 C ATOM 1778 CG1 VAL A 117 -15.552 -13.201 2.105 1.00 0.00 C ATOM 1779 CG2 VAL A 117 -13.312 -14.085 2.930 1.00 0.00 C ATOM 0 H VAL A 117 -14.360 -14.210 5.574 1.00 0.00 H new ATOM 0 HA VAL A 117 -13.923 -11.828 4.141 1.00 0.00 H new ATOM 0 HB VAL A 117 -15.236 -14.446 3.781 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -15.525 -14.005 1.369 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -16.583 -13.023 2.410 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -15.142 -12.292 1.664 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -13.398 -14.834 2.143 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -12.726 -13.241 2.566 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -12.817 -14.524 3.796 1.00 0.00 H new ATOM 1789 N ASP A 118 -16.956 -12.355 5.188 1.00 0.00 N ATOM 1790 CA ASP A 118 -18.127 -11.649 5.605 1.00 0.00 C ATOM 1791 C ASP A 118 -17.778 -10.452 6.422 1.00 0.00 C ATOM 1792 O ASP A 118 -18.407 -9.415 6.220 1.00 0.00 O ATOM 1793 CB ASP A 118 -19.011 -12.707 6.287 1.00 0.00 C ATOM 1794 CG ASP A 118 -20.299 -12.077 6.799 1.00 0.00 C ATOM 1795 OD1 ASP A 118 -21.148 -11.654 5.969 1.00 0.00 O ATOM 1796 OD2 ASP A 118 -20.418 -12.107 8.053 1.00 0.00 O ATOM 0 H ASP A 118 -16.968 -13.346 5.429 1.00 0.00 H new ATOM 0 HA ASP A 118 -18.689 -11.204 4.784 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -19.245 -13.504 5.581 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -18.469 -13.164 7.115 1.00 0.00 H new ATOM 1801 N GLU A 119 -16.893 -10.550 7.430 1.00 0.00 N ATOM 1802 CA GLU A 119 -16.581 -9.539 8.392 1.00 0.00 C ATOM 1803 C GLU A 119 -15.961 -8.333 7.775 1.00 0.00 C ATOM 1804 O GLU A 119 -16.213 -7.152 8.008 1.00 0.00 O ATOM 1805 CB GLU A 119 -15.686 -10.122 9.498 1.00 0.00 C ATOM 1806 CG GLU A 119 -15.018 -9.198 10.519 1.00 0.00 C ATOM 1807 CD GLU A 119 -14.409 -9.940 11.699 1.00 0.00 C ATOM 1808 OE1 GLU A 119 -13.546 -10.802 11.383 1.00 0.00 O ATOM 1809 OE2 GLU A 119 -14.827 -9.813 12.881 1.00 0.00 O ATOM 0 H GLU A 119 -16.355 -11.403 7.583 1.00 0.00 H new ATOM 0 HA GLU A 119 -17.520 -9.206 8.834 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -16.289 -10.838 10.057 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -14.893 -10.687 9.007 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -14.239 -8.622 10.021 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -15.755 -8.485 10.889 1.00 0.00 H new ATOM 1816 N MET A 120 -15.020 -8.625 6.859 1.00 0.00 N ATOM 1817 CA MET A 120 -14.080 -7.810 6.154 1.00 0.00 C ATOM 1818 C MET A 120 -14.686 -6.936 5.111 1.00 0.00 C ATOM 1819 O MET A 120 -14.293 -5.791 4.895 1.00 0.00 O ATOM 1820 CB MET A 120 -12.937 -8.693 5.624 1.00 0.00 C ATOM 1821 CG MET A 120 -11.760 -7.938 5.004 1.00 0.00 C ATOM 1822 SD MET A 120 -10.429 -9.039 4.435 1.00 0.00 S ATOM 1823 CE MET A 120 -9.482 -7.528 4.096 1.00 0.00 C ATOM 0 H MET A 120 -14.907 -9.597 6.571 1.00 0.00 H new ATOM 0 HA MET A 120 -13.667 -7.093 6.864 1.00 0.00 H new ATOM 0 HB2 MET A 120 -12.563 -9.305 6.445 1.00 0.00 H new ATOM 0 HB3 MET A 120 -13.343 -9.375 4.877 1.00 0.00 H new ATOM 0 HG2 MET A 120 -12.119 -7.346 4.162 1.00 0.00 H new ATOM 0 HG3 MET A 120 -11.357 -7.239 5.737 1.00 0.00 H new ATOM 0 HE1 MET A 120 -8.420 -7.722 4.249 1.00 0.00 H new ATOM 0 HE2 MET A 120 -9.649 -7.218 3.065 1.00 0.00 H new ATOM 0 HE3 MET A 120 -9.807 -6.736 4.770 1.00 0.00 H new ATOM 1833 N ILE A 121 -15.666 -7.439 4.338 1.00 0.00 N ATOM 1834 CA ILE A 121 -16.417 -6.677 3.389 1.00 0.00 C ATOM 1835 C ILE A 121 -17.353 -5.717 4.038 1.00 0.00 C ATOM 1836 O ILE A 121 -17.461 -4.554 3.652 1.00 0.00 O ATOM 1837 CB ILE A 121 -17.047 -7.462 2.277 1.00 0.00 C ATOM 1838 CG1 ILE A 121 -16.037 -8.359 1.541 1.00 0.00 C ATOM 1839 CG2 ILE A 121 -17.743 -6.460 1.341 1.00 0.00 C ATOM 1840 CD1 ILE A 121 -16.658 -9.380 0.588 1.00 0.00 C ATOM 0 H ILE A 121 -15.947 -8.419 4.376 1.00 0.00 H new ATOM 0 HA ILE A 121 -15.662 -6.083 2.873 1.00 0.00 H new ATOM 0 HB ILE A 121 -17.781 -8.158 2.684 1.00 0.00 H new ATOM 0 HG12 ILE A 121 -15.354 -7.725 0.976 1.00 0.00 H new ATOM 0 HG13 ILE A 121 -15.439 -8.891 2.281 1.00 0.00 H new ATOM 0 HG21 ILE A 121 -18.214 -6.998 0.518 1.00 0.00 H new ATOM 0 HG22 ILE A 121 -18.503 -5.910 1.897 1.00 0.00 H new ATOM 0 HG23 ILE A 121 -17.007 -5.761 0.944 1.00 0.00 H new ATOM 0 HD11 ILE A 121 -15.868 -9.965 0.117 1.00 0.00 H new ATOM 0 HD12 ILE A 121 -17.318 -10.044 1.146 1.00 0.00 H new ATOM 0 HD13 ILE A 121 -17.231 -8.860 -0.179 1.00 0.00 H new ATOM 1852 N ARG A 122 -18.043 -6.126 5.118 1.00 0.00 N ATOM 1853 CA ARG A 122 -18.898 -5.295 5.907 1.00 0.00 C ATOM 1854 C ARG A 122 -18.209 -4.115 6.500 1.00 0.00 C ATOM 1855 O ARG A 122 -18.749 -3.014 6.587 1.00 0.00 O ATOM 1856 CB ARG A 122 -19.439 -6.120 7.088 1.00 0.00 C ATOM 1857 CG ARG A 122 -20.517 -5.343 7.847 1.00 0.00 C ATOM 1858 CD ARG A 122 -20.963 -6.083 9.109 1.00 0.00 C ATOM 1859 NE ARG A 122 -19.923 -5.817 10.142 1.00 0.00 N ATOM 1860 CZ ARG A 122 -19.181 -6.717 10.851 1.00 0.00 C ATOM 1861 NH1 ARG A 122 -19.459 -8.042 10.678 1.00 0.00 N ATOM 1862 NH2 ARG A 122 -18.238 -6.296 11.743 1.00 0.00 N ATOM 0 H ARG A 122 -18.002 -7.087 5.458 1.00 0.00 H new ATOM 0 HA ARG A 122 -19.677 -4.938 5.233 1.00 0.00 H new ATOM 0 HB2 ARG A 122 -19.852 -7.060 6.722 1.00 0.00 H new ATOM 0 HB3 ARG A 122 -18.623 -6.373 7.765 1.00 0.00 H new ATOM 0 HG2 ARG A 122 -20.134 -4.359 8.118 1.00 0.00 H new ATOM 0 HG3 ARG A 122 -21.376 -5.182 7.196 1.00 0.00 H new ATOM 0 HD2 ARG A 122 -21.939 -5.731 9.441 1.00 0.00 H new ATOM 0 HD3 ARG A 122 -21.058 -7.152 8.919 1.00 0.00 H new ATOM 0 HE ARG A 122 -19.742 -4.834 10.346 1.00 0.00 H new ATOM 0 HH11 ARG A 122 -20.199 -8.328 10.037 1.00 0.00 H new ATOM 0 HH12 ARG A 122 -18.927 -8.746 11.190 1.00 0.00 H new ATOM 0 HH21 ARG A 122 -18.081 -5.298 11.886 1.00 0.00 H new ATOM 0 HH22 ARG A 122 -17.690 -6.979 12.266 1.00 0.00 H new ATOM 1876 N GLU A 123 -16.955 -4.222 6.975 1.00 0.00 N ATOM 1877 CA GLU A 123 -16.148 -3.232 7.618 1.00 0.00 C ATOM 1878 C GLU A 123 -15.945 -2.095 6.677 1.00 0.00 C ATOM 1879 O GLU A 123 -16.131 -0.944 7.070 1.00 0.00 O ATOM 1880 CB GLU A 123 -14.792 -3.772 8.102 1.00 0.00 C ATOM 1881 CG GLU A 123 -13.872 -2.753 8.779 1.00 0.00 C ATOM 1882 CD GLU A 123 -12.644 -3.390 9.412 1.00 0.00 C ATOM 1883 OE1 GLU A 123 -11.760 -3.900 8.674 1.00 0.00 O ATOM 1884 OE2 GLU A 123 -12.621 -3.434 10.671 1.00 0.00 O ATOM 0 H GLU A 123 -16.452 -5.106 6.897 1.00 0.00 H new ATOM 0 HA GLU A 123 -16.678 -2.905 8.513 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -14.976 -4.588 8.801 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -14.266 -4.197 7.247 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -13.553 -2.015 8.043 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -14.433 -2.218 9.545 1.00 0.00 H new ATOM 1891 N ALA A 124 -15.580 -2.348 5.407 1.00 0.00 N ATOM 1892 CA ALA A 124 -15.394 -1.362 4.389 1.00 0.00 C ATOM 1893 C ALA A 124 -16.669 -0.734 3.940 1.00 0.00 C ATOM 1894 O ALA A 124 -16.858 0.481 3.971 1.00 0.00 O ATOM 1895 CB ALA A 124 -14.686 -2.057 3.214 1.00 0.00 C ATOM 0 H ALA A 124 -15.405 -3.296 5.073 1.00 0.00 H new ATOM 0 HA ALA A 124 -14.797 -0.543 4.790 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -14.523 -1.338 2.411 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -13.726 -2.450 3.549 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -15.306 -2.876 2.848 1.00 0.00 H new ATOM 1901 N ASP A 125 -17.666 -1.536 3.524 1.00 0.00 N ATOM 1902 CA ASP A 125 -18.785 -1.172 2.711 1.00 0.00 C ATOM 1903 C ASP A 125 -19.724 -0.181 3.308 1.00 0.00 C ATOM 1904 O ASP A 125 -20.252 -0.312 4.412 1.00 0.00 O ATOM 1905 CB ASP A 125 -19.505 -2.467 2.301 1.00 0.00 C ATOM 1906 CG ASP A 125 -20.280 -2.317 1.000 1.00 0.00 C ATOM 1907 OD1 ASP A 125 -21.109 -1.388 0.804 1.00 0.00 O ATOM 1908 OD2 ASP A 125 -19.994 -3.059 0.023 1.00 0.00 O ATOM 0 H ASP A 125 -17.689 -2.523 3.779 1.00 0.00 H new ATOM 0 HA ASP A 125 -18.395 -0.639 1.844 1.00 0.00 H new ATOM 0 HB2 ASP A 125 -18.773 -3.267 2.194 1.00 0.00 H new ATOM 0 HB3 ASP A 125 -20.189 -2.765 3.095 1.00 0.00 H new ATOM 1913 N ILE A 126 -19.962 0.847 2.475 1.00 0.00 N ATOM 1914 CA ILE A 126 -20.612 2.054 2.883 1.00 0.00 C ATOM 1915 C ILE A 126 -22.049 2.015 2.492 1.00 0.00 C ATOM 1916 O ILE A 126 -22.941 2.616 3.088 1.00 0.00 O ATOM 1917 CB ILE A 126 -19.906 3.278 2.378 1.00 0.00 C ATOM 1918 CG1 ILE A 126 -18.424 3.231 2.788 1.00 0.00 C ATOM 1919 CG2 ILE A 126 -20.634 4.547 2.852 1.00 0.00 C ATOM 1920 CD1 ILE A 126 -17.663 4.532 2.532 1.00 0.00 C ATOM 0 H ILE A 126 -19.695 0.839 1.491 1.00 0.00 H new ATOM 0 HA ILE A 126 -20.563 2.121 3.970 1.00 0.00 H new ATOM 0 HB ILE A 126 -19.929 3.303 1.289 1.00 0.00 H new ATOM 0 HG12 ILE A 126 -18.359 2.988 3.849 1.00 0.00 H new ATOM 0 HG13 ILE A 126 -17.934 2.423 2.245 1.00 0.00 H new ATOM 0 HG21 ILE A 126 -20.111 5.427 2.478 1.00 0.00 H new ATOM 0 HG22 ILE A 126 -21.656 4.544 2.472 1.00 0.00 H new ATOM 0 HG23 ILE A 126 -20.652 4.571 3.942 1.00 0.00 H new ATOM 0 HD11 ILE A 126 -16.626 4.415 2.848 1.00 0.00 H new ATOM 0 HD12 ILE A 126 -17.694 4.768 1.468 1.00 0.00 H new ATOM 0 HD13 ILE A 126 -18.126 5.341 3.097 1.00 0.00 H new ATOM 1932 N ASP A 127 -22.320 1.202 1.455 1.00 0.00 N ATOM 1933 CA ASP A 127 -23.650 0.966 0.987 1.00 0.00 C ATOM 1934 C ASP A 127 -24.276 -0.136 1.769 1.00 0.00 C ATOM 1935 O ASP A 127 -25.382 -0.084 2.306 1.00 0.00 O ATOM 1936 CB ASP A 127 -23.639 0.458 -0.465 1.00 0.00 C ATOM 1937 CG ASP A 127 -22.784 1.286 -1.413 1.00 0.00 C ATOM 1938 OD1 ASP A 127 -23.105 2.494 -1.569 1.00 0.00 O ATOM 1939 OD2 ASP A 127 -21.681 0.881 -1.868 1.00 0.00 O ATOM 0 H ASP A 127 -21.602 0.700 0.932 1.00 0.00 H new ATOM 0 HA ASP A 127 -24.189 1.909 1.082 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -23.279 -0.571 -0.475 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -24.663 0.441 -0.839 1.00 0.00 H new ATOM 1944 N GLY A 128 -23.579 -1.285 1.821 1.00 0.00 N ATOM 1945 CA GLY A 128 -23.938 -2.489 2.504 1.00 0.00 C ATOM 1946 C GLY A 128 -24.242 -3.583 1.540 1.00 0.00 C ATOM 1947 O GLY A 128 -25.102 -4.439 1.739 1.00 0.00 O ATOM 0 H GLY A 128 -22.684 -1.378 1.341 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -23.123 -2.795 3.161 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -24.806 -2.306 3.137 1.00 0.00 H new ATOM 1951 N ASP A 129 -23.663 -3.508 0.328 1.00 0.00 N ATOM 1952 CA ASP A 129 -24.216 -4.322 -0.709 1.00 0.00 C ATOM 1953 C ASP A 129 -23.401 -5.532 -1.012 1.00 0.00 C ATOM 1954 O ASP A 129 -23.802 -6.440 -1.739 1.00 0.00 O ATOM 1955 CB ASP A 129 -24.473 -3.350 -1.873 1.00 0.00 C ATOM 1956 CG ASP A 129 -23.235 -2.886 -2.626 1.00 0.00 C ATOM 1957 OD1 ASP A 129 -22.250 -2.368 -2.036 1.00 0.00 O ATOM 1958 OD2 ASP A 129 -23.224 -3.018 -3.879 1.00 0.00 O ATOM 0 H ASP A 129 -22.865 -2.925 0.075 1.00 0.00 H new ATOM 0 HA ASP A 129 -25.154 -4.798 -0.422 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -25.149 -3.830 -2.581 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -24.990 -2.473 -1.483 1.00 0.00 H new ATOM 1963 N GLY A 130 -22.191 -5.657 -0.439 1.00 0.00 N ATOM 1964 CA GLY A 130 -21.360 -6.821 -0.471 1.00 0.00 C ATOM 1965 C GLY A 130 -20.234 -6.676 -1.436 1.00 0.00 C ATOM 1966 O GLY A 130 -19.705 -7.716 -1.825 1.00 0.00 O ATOM 0 H GLY A 130 -21.764 -4.891 0.083 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -20.961 -7.009 0.526 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -21.961 -7.688 -0.743 1.00 0.00 H new ATOM 1970 N GLN A 131 -19.807 -5.528 -1.992 1.00 0.00 N ATOM 1971 CA GLN A 131 -18.758 -5.456 -2.962 1.00 0.00 C ATOM 1972 C GLN A 131 -18.197 -4.092 -2.754 1.00 0.00 C ATOM 1973 O GLN A 131 -18.919 -3.101 -2.657 1.00 0.00 O ATOM 1974 CB GLN A 131 -19.227 -5.648 -4.414 1.00 0.00 C ATOM 1975 CG GLN A 131 -20.410 -4.752 -4.785 1.00 0.00 C ATOM 1976 CD GLN A 131 -20.965 -4.936 -6.191 1.00 0.00 C ATOM 1977 OE1 GLN A 131 -20.576 -5.780 -6.998 1.00 0.00 O ATOM 1978 NE2 GLN A 131 -21.895 -4.007 -6.538 1.00 0.00 N ATOM 0 H GLN A 131 -20.206 -4.619 -1.758 1.00 0.00 H new ATOM 0 HA GLN A 131 -18.038 -6.262 -2.824 1.00 0.00 H new ATOM 0 HB2 GLN A 131 -18.396 -5.441 -5.088 1.00 0.00 H new ATOM 0 HB3 GLN A 131 -19.507 -6.691 -4.564 1.00 0.00 H new ATOM 0 HG2 GLN A 131 -21.214 -4.930 -4.071 1.00 0.00 H new ATOM 0 HG3 GLN A 131 -20.105 -3.712 -4.668 1.00 0.00 H new ATOM 0 HE21 GLN A 131 -22.205 -3.316 -5.855 1.00 0.00 H new ATOM 0 HE22 GLN A 131 -22.283 -4.001 -7.481 1.00 0.00 H new ATOM 1987 N VAL A 132 -16.855 -3.996 -2.719 1.00 0.00 N ATOM 1988 CA VAL A 132 -16.117 -2.807 -2.425 1.00 0.00 C ATOM 1989 C VAL A 132 -15.640 -2.322 -3.751 1.00 0.00 C ATOM 1990 O VAL A 132 -14.969 -2.940 -4.576 1.00 0.00 O ATOM 1991 CB VAL A 132 -15.009 -3.144 -1.472 1.00 0.00 C ATOM 1992 CG1 VAL A 132 -14.060 -1.968 -1.184 1.00 0.00 C ATOM 1993 CG2 VAL A 132 -15.541 -3.659 -0.124 1.00 0.00 C ATOM 0 H VAL A 132 -16.251 -4.796 -2.907 1.00 0.00 H new ATOM 0 HA VAL A 132 -16.697 -2.026 -1.933 1.00 0.00 H new ATOM 0 HB VAL A 132 -14.449 -3.927 -1.984 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -13.285 -2.288 -0.487 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -13.598 -1.637 -2.114 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -14.624 -1.144 -0.746 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -14.703 -3.890 0.534 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -16.164 -2.893 0.338 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -16.134 -4.559 -0.287 1.00 0.00 H new ATOM 2003 N ASN A 133 -15.973 -1.059 -4.073 1.00 0.00 N ATOM 2004 CA ASN A 133 -15.491 -0.310 -5.192 1.00 0.00 C ATOM 2005 C ASN A 133 -14.275 0.478 -4.845 1.00 0.00 C ATOM 2006 O ASN A 133 -13.775 0.487 -3.722 1.00 0.00 O ATOM 2007 CB ASN A 133 -16.610 0.509 -5.857 1.00 0.00 C ATOM 2008 CG ASN A 133 -17.140 1.654 -5.006 1.00 0.00 C ATOM 2009 OD1 ASN A 133 -16.543 2.013 -3.992 1.00 0.00 O ATOM 2010 ND2 ASN A 133 -18.298 2.304 -5.299 1.00 0.00 N ATOM 0 H ASN A 133 -16.630 -0.522 -3.507 1.00 0.00 H new ATOM 0 HA ASN A 133 -15.165 -1.015 -5.957 1.00 0.00 H new ATOM 0 HB2 ASN A 133 -16.238 0.914 -6.798 1.00 0.00 H new ATOM 0 HB3 ASN A 133 -17.436 -0.159 -6.102 1.00 0.00 H new ATOM 0 HD21 ASN A 133 -18.632 3.050 -4.689 1.00 0.00 H new ATOM 0 HD22 ASN A 133 -18.832 2.045 -6.129 1.00 0.00 H new ATOM 2017 N TYR A 134 -13.721 1.241 -5.804 1.00 0.00 N ATOM 2018 CA TYR A 134 -12.610 2.099 -5.530 1.00 0.00 C ATOM 2019 C TYR A 134 -12.692 3.104 -4.433 1.00 0.00 C ATOM 2020 O TYR A 134 -11.792 3.276 -3.612 1.00 0.00 O ATOM 2021 CB TYR A 134 -12.186 2.828 -6.816 1.00 0.00 C ATOM 2022 CG TYR A 134 -10.855 3.498 -6.787 1.00 0.00 C ATOM 2023 CD1 TYR A 134 -9.777 2.700 -6.485 1.00 0.00 C ATOM 2024 CD2 TYR A 134 -10.726 4.867 -6.804 1.00 0.00 C ATOM 2025 CE1 TYR A 134 -8.520 3.248 -6.386 1.00 0.00 C ATOM 2026 CE2 TYR A 134 -9.496 5.432 -6.566 1.00 0.00 C ATOM 2027 CZ TYR A 134 -8.396 4.616 -6.444 1.00 0.00 C ATOM 2028 OH TYR A 134 -7.154 5.265 -6.285 1.00 0.00 O ATOM 0 H TYR A 134 -14.043 1.264 -6.771 1.00 0.00 H new ATOM 0 HA TYR A 134 -11.883 1.382 -5.149 1.00 0.00 H new ATOM 0 HB2 TYR A 134 -12.189 2.108 -7.634 1.00 0.00 H new ATOM 0 HB3 TYR A 134 -12.942 3.578 -7.049 1.00 0.00 H new ATOM 0 HD1 TYR A 134 -9.918 1.641 -6.325 1.00 0.00 H new ATOM 0 HD2 TYR A 134 -11.584 5.493 -7.003 1.00 0.00 H new ATOM 0 HE1 TYR A 134 -7.651 2.619 -6.266 1.00 0.00 H new ATOM 0 HE2 TYR A 134 -9.395 6.503 -6.476 1.00 0.00 H new ATOM 0 HH TYR A 134 -7.303 6.201 -6.035 1.00 0.00 H new ATOM 2038 N GLU A 135 -13.838 3.802 -4.344 1.00 0.00 N ATOM 2039 CA GLU A 135 -13.992 4.819 -3.350 1.00 0.00 C ATOM 2040 C GLU A 135 -14.119 4.300 -1.959 1.00 0.00 C ATOM 2041 O GLU A 135 -13.637 4.939 -1.025 1.00 0.00 O ATOM 2042 CB GLU A 135 -15.304 5.506 -3.766 1.00 0.00 C ATOM 2043 CG GLU A 135 -15.249 6.209 -5.123 1.00 0.00 C ATOM 2044 CD GLU A 135 -16.529 6.909 -5.560 1.00 0.00 C ATOM 2045 OE1 GLU A 135 -17.090 7.792 -4.858 1.00 0.00 O ATOM 2046 OE2 GLU A 135 -16.996 6.482 -6.649 1.00 0.00 O ATOM 0 H GLU A 135 -14.647 3.666 -4.950 1.00 0.00 H new ATOM 0 HA GLU A 135 -13.115 5.466 -3.316 1.00 0.00 H new ATOM 0 HB2 GLU A 135 -16.098 4.760 -3.789 1.00 0.00 H new ATOM 0 HB3 GLU A 135 -15.575 6.236 -3.003 1.00 0.00 H new ATOM 0 HG2 GLU A 135 -14.446 6.945 -5.097 1.00 0.00 H new ATOM 0 HG3 GLU A 135 -14.983 5.473 -5.882 1.00 0.00 H new ATOM 2053 N GLU A 136 -14.706 3.103 -1.785 1.00 0.00 N ATOM 2054 CA GLU A 136 -14.793 2.444 -0.519 1.00 0.00 C ATOM 2055 C GLU A 136 -13.486 1.909 -0.044 1.00 0.00 C ATOM 2056 O GLU A 136 -13.114 1.811 1.125 1.00 0.00 O ATOM 2057 CB GLU A 136 -15.893 1.389 -0.722 1.00 0.00 C ATOM 2058 CG GLU A 136 -17.315 1.930 -0.884 1.00 0.00 C ATOM 2059 CD GLU A 136 -18.288 0.778 -1.093 1.00 0.00 C ATOM 2060 OE1 GLU A 136 -18.191 0.010 -2.087 1.00 0.00 O ATOM 2061 OE2 GLU A 136 -19.158 0.599 -0.200 1.00 0.00 O ATOM 0 H GLU A 136 -15.133 2.578 -2.548 1.00 0.00 H new ATOM 0 HA GLU A 136 -15.052 3.123 0.293 1.00 0.00 H new ATOM 0 HB2 GLU A 136 -15.646 0.800 -1.605 1.00 0.00 H new ATOM 0 HB3 GLU A 136 -15.879 0.708 0.129 1.00 0.00 H new ATOM 0 HG2 GLU A 136 -17.599 2.501 -0.000 1.00 0.00 H new ATOM 0 HG3 GLU A 136 -17.359 2.613 -1.732 1.00 0.00 H new ATOM 2068 N PHE A 137 -12.715 1.414 -1.029 1.00 0.00 N ATOM 2069 CA PHE A 137 -11.396 0.946 -0.734 1.00 0.00 C ATOM 2070 C PHE A 137 -10.507 2.005 -0.177 1.00 0.00 C ATOM 2071 O PHE A 137 -9.915 1.810 0.883 1.00 0.00 O ATOM 2072 CB PHE A 137 -10.849 0.347 -2.041 1.00 0.00 C ATOM 2073 CG PHE A 137 -9.499 -0.277 -1.941 1.00 0.00 C ATOM 2074 CD1 PHE A 137 -9.453 -1.612 -1.618 1.00 0.00 C ATOM 2075 CD2 PHE A 137 -8.364 0.294 -2.467 1.00 0.00 C ATOM 2076 CE1 PHE A 137 -8.282 -2.333 -1.659 1.00 0.00 C ATOM 2077 CE2 PHE A 137 -7.197 -0.419 -2.608 1.00 0.00 C ATOM 2078 CZ PHE A 137 -7.150 -1.703 -2.119 1.00 0.00 C ATOM 0 H PHE A 137 -12.995 1.338 -2.007 1.00 0.00 H new ATOM 0 HA PHE A 137 -11.431 0.196 0.056 1.00 0.00 H new ATOM 0 HB2 PHE A 137 -11.553 -0.405 -2.399 1.00 0.00 H new ATOM 0 HB3 PHE A 137 -10.812 1.134 -2.794 1.00 0.00 H new ATOM 0 HD1 PHE A 137 -10.364 -2.111 -1.323 1.00 0.00 H new ATOM 0 HD2 PHE A 137 -8.390 1.328 -2.777 1.00 0.00 H new ATOM 0 HE1 PHE A 137 -8.253 -3.364 -1.339 1.00 0.00 H new ATOM 0 HE2 PHE A 137 -6.337 0.020 -3.092 1.00 0.00 H new ATOM 0 HZ PHE A 137 -6.206 -2.227 -2.096 1.00 0.00 H new ATOM 2088 N VAL A 138 -10.295 3.135 -0.874 1.00 0.00 N ATOM 2089 CA VAL A 138 -9.368 4.196 -0.630 1.00 0.00 C ATOM 2090 C VAL A 138 -9.822 5.036 0.514 1.00 0.00 C ATOM 2091 O VAL A 138 -9.057 5.808 1.091 1.00 0.00 O ATOM 2092 CB VAL A 138 -9.059 4.932 -1.900 1.00 0.00 C ATOM 2093 CG1 VAL A 138 -10.324 5.746 -2.219 1.00 0.00 C ATOM 2094 CG2 VAL A 138 -7.833 5.860 -1.874 1.00 0.00 C ATOM 0 H VAL A 138 -10.844 3.324 -1.712 1.00 0.00 H new ATOM 0 HA VAL A 138 -8.407 3.794 -0.309 1.00 0.00 H new ATOM 0 HB VAL A 138 -8.793 4.193 -2.655 1.00 0.00 H new ATOM 0 HG11 VAL A 138 -10.171 6.312 -3.138 1.00 0.00 H new ATOM 0 HG12 VAL A 138 -11.169 5.070 -2.346 1.00 0.00 H new ATOM 0 HG13 VAL A 138 -10.530 6.434 -1.399 1.00 0.00 H new ATOM 0 HG21 VAL A 138 -7.715 6.334 -2.848 1.00 0.00 H new ATOM 0 HG22 VAL A 138 -7.973 6.627 -1.112 1.00 0.00 H new ATOM 0 HG23 VAL A 138 -6.941 5.278 -1.643 1.00 0.00 H new ATOM 2104 N GLN A 139 -11.105 5.001 0.916 1.00 0.00 N ATOM 2105 CA GLN A 139 -11.576 5.579 2.137 1.00 0.00 C ATOM 2106 C GLN A 139 -11.140 4.808 3.336 1.00 0.00 C ATOM 2107 O GLN A 139 -10.502 5.367 4.227 1.00 0.00 O ATOM 2108 CB GLN A 139 -13.111 5.605 2.052 1.00 0.00 C ATOM 2109 CG GLN A 139 -13.766 6.296 3.250 1.00 0.00 C ATOM 2110 CD GLN A 139 -13.440 7.751 3.554 1.00 0.00 C ATOM 2111 OE1 GLN A 139 -12.816 8.459 2.764 1.00 0.00 O ATOM 2112 NE2 GLN A 139 -13.944 8.269 4.706 1.00 0.00 N ATOM 0 H GLN A 139 -11.842 4.554 0.371 1.00 0.00 H new ATOM 0 HA GLN A 139 -11.159 6.580 2.253 1.00 0.00 H new ATOM 0 HB2 GLN A 139 -13.410 6.116 1.137 1.00 0.00 H new ATOM 0 HB3 GLN A 139 -13.483 4.583 1.982 1.00 0.00 H new ATOM 0 HG2 GLN A 139 -14.845 6.226 3.116 1.00 0.00 H new ATOM 0 HG3 GLN A 139 -13.516 5.714 4.137 1.00 0.00 H new ATOM 0 HE21 GLN A 139 -14.459 7.671 5.352 1.00 0.00 H new ATOM 0 HE22 GLN A 139 -13.807 9.256 4.924 1.00 0.00 H new ATOM 2121 N MET A 140 -11.350 3.481 3.381 1.00 0.00 N ATOM 2122 CA MET A 140 -10.910 2.604 4.422 1.00 0.00 C ATOM 2123 C MET A 140 -9.447 2.341 4.534 1.00 0.00 C ATOM 2124 O MET A 140 -8.892 2.201 5.623 1.00 0.00 O ATOM 2125 CB MET A 140 -11.744 1.324 4.251 1.00 0.00 C ATOM 2126 CG MET A 140 -11.354 0.209 5.224 1.00 0.00 C ATOM 2127 SD MET A 140 -11.633 0.653 6.965 1.00 0.00 S ATOM 2128 CE MET A 140 -10.876 -0.881 7.576 1.00 0.00 C ATOM 0 H MET A 140 -11.858 2.990 2.645 1.00 0.00 H new ATOM 0 HA MET A 140 -11.074 3.100 5.379 1.00 0.00 H new ATOM 0 HB2 MET A 140 -12.798 1.565 4.390 1.00 0.00 H new ATOM 0 HB3 MET A 140 -11.632 0.960 3.230 1.00 0.00 H new ATOM 0 HG2 MET A 140 -11.926 -0.688 4.988 1.00 0.00 H new ATOM 0 HG3 MET A 140 -10.302 -0.038 5.082 1.00 0.00 H new ATOM 0 HE1 MET A 140 -11.462 -1.269 8.409 1.00 0.00 H new ATOM 0 HE2 MET A 140 -10.852 -1.619 6.775 1.00 0.00 H new ATOM 0 HE3 MET A 140 -9.859 -0.677 7.911 1.00 0.00 H new ATOM 2138 N MET A 141 -8.731 2.301 3.397 1.00 0.00 N ATOM 2139 CA MET A 141 -7.302 2.311 3.347 1.00 0.00 C ATOM 2140 C MET A 141 -6.691 3.613 3.734 1.00 0.00 C ATOM 2141 O MET A 141 -5.508 3.601 4.070 1.00 0.00 O ATOM 2142 CB MET A 141 -6.619 1.925 2.024 1.00 0.00 C ATOM 2143 CG MET A 141 -6.892 0.481 1.598 1.00 0.00 C ATOM 2144 SD MET A 141 -6.361 -0.776 2.799 1.00 0.00 S ATOM 2145 CE MET A 141 -6.430 -2.117 1.576 1.00 0.00 C ATOM 0 H MET A 141 -9.165 2.260 2.475 1.00 0.00 H new ATOM 0 HA MET A 141 -7.116 1.520 4.073 1.00 0.00 H new ATOM 0 HB2 MET A 141 -6.960 2.599 1.238 1.00 0.00 H new ATOM 0 HB3 MET A 141 -5.543 2.069 2.123 1.00 0.00 H new ATOM 0 HG2 MET A 141 -7.961 0.365 1.419 1.00 0.00 H new ATOM 0 HG3 MET A 141 -6.388 0.294 0.650 1.00 0.00 H new ATOM 0 HE1 MET A 141 -6.742 -3.040 2.065 1.00 0.00 H new ATOM 0 HE2 MET A 141 -7.146 -1.861 0.795 1.00 0.00 H new ATOM 0 HE3 MET A 141 -5.444 -2.256 1.133 1.00 0.00 H new ATOM 2155 N THR A 142 -7.449 4.705 3.940 1.00 0.00 N ATOM 2156 CA THR A 142 -6.895 5.942 4.397 1.00 0.00 C ATOM 2157 C THR A 142 -6.789 5.942 5.915 1.00 0.00 C ATOM 2158 O THR A 142 -5.642 5.858 6.430 1.00 0.00 O ATOM 2159 CB THR A 142 -7.551 7.147 3.790 1.00 0.00 C ATOM 2160 OG1 THR A 142 -7.375 7.247 2.384 1.00 0.00 O ATOM 2161 CG2 THR A 142 -6.915 8.441 4.324 1.00 0.00 C ATOM 0 H THR A 142 -8.457 4.730 3.788 1.00 0.00 H new ATOM 0 HA THR A 142 -5.873 6.025 4.027 1.00 0.00 H new ATOM 0 HB THR A 142 -8.604 7.029 4.047 1.00 0.00 H new ATOM 0 HG1 THR A 142 -8.171 6.900 1.929 1.00 0.00 H new ATOM 0 HG21 THR A 142 -7.406 9.302 3.870 1.00 0.00 H new ATOM 0 HG22 THR A 142 -7.033 8.485 5.407 1.00 0.00 H new ATOM 0 HG23 THR A 142 -5.854 8.455 4.074 1.00 0.00 H new ATOM 2170 N ARG B 1 -10.005 -4.411 11.174 1.00 0.00 N ATOM 2171 CA ARG B 1 -9.203 -3.321 10.574 1.00 0.00 C ATOM 2172 C ARG B 1 -7.876 -3.696 10.010 1.00 0.00 C ATOM 2173 O ARG B 1 -7.579 -3.188 8.930 1.00 0.00 O ATOM 2174 CB ARG B 1 -9.041 -2.161 11.571 1.00 0.00 C ATOM 2175 CG ARG B 1 -10.274 -1.311 11.885 1.00 0.00 C ATOM 2176 CD ARG B 1 -10.067 0.029 12.595 1.00 0.00 C ATOM 2177 NE ARG B 1 -9.689 -0.314 13.995 1.00 0.00 N ATOM 2178 CZ ARG B 1 -8.431 -0.397 14.519 1.00 0.00 C ATOM 2179 NH1 ARG B 1 -7.283 -0.042 13.872 1.00 0.00 N ATOM 2180 NH2 ARG B 1 -8.237 -1.065 15.693 1.00 0.00 N ATOM 0 H1 ARG B 1 -11.003 -4.123 11.219 1.00 0.00 H new ATOM 0 H2 ARG B 1 -9.918 -5.268 10.591 1.00 0.00 H new ATOM 0 H3 ARG B 1 -9.658 -4.609 12.134 1.00 0.00 H new ATOM 0 HA ARG B 1 -9.788 -3.020 9.705 1.00 0.00 H new ATOM 0 HB2 ARG B 1 -8.672 -2.575 12.509 1.00 0.00 H new ATOM 0 HB3 ARG B 1 -8.265 -1.497 11.189 1.00 0.00 H new ATOM 0 HG2 ARG B 1 -10.790 -1.114 10.946 1.00 0.00 H new ATOM 0 HG3 ARG B 1 -10.946 -1.912 12.498 1.00 0.00 H new ATOM 0 HD2 ARG B 1 -9.285 0.613 12.110 1.00 0.00 H new ATOM 0 HD3 ARG B 1 -10.976 0.630 12.570 1.00 0.00 H new ATOM 0 HE ARG B 1 -10.459 -0.509 14.635 1.00 0.00 H new ATOM 0 HH11 ARG B 1 -7.325 0.319 12.919 1.00 0.00 H new ATOM 0 HH12 ARG B 1 -6.383 -0.138 14.342 1.00 0.00 H new ATOM 0 HH21 ARG B 1 -9.028 -1.497 16.171 1.00 0.00 H new ATOM 0 HH22 ARG B 1 -7.301 -1.133 16.093 1.00 0.00 H new ATOM 2193 N ARG B 2 -7.018 -4.499 10.663 1.00 0.00 N ATOM 2194 CA ARG B 2 -5.724 -4.771 10.119 1.00 0.00 C ATOM 2195 C ARG B 2 -5.632 -5.393 8.768 1.00 0.00 C ATOM 2196 O ARG B 2 -4.751 -4.995 8.007 1.00 0.00 O ATOM 2197 CB ARG B 2 -5.018 -5.601 11.204 1.00 0.00 C ATOM 2198 CG ARG B 2 -3.525 -5.760 10.911 1.00 0.00 C ATOM 2199 CD ARG B 2 -2.672 -6.315 12.054 1.00 0.00 C ATOM 2200 NE ARG B 2 -2.636 -5.333 13.173 1.00 0.00 N ATOM 2201 CZ ARG B 2 -2.091 -5.604 14.395 1.00 0.00 C ATOM 2202 NH1 ARG B 2 -1.633 -6.878 14.569 1.00 0.00 N ATOM 2203 NH2 ARG B 2 -2.169 -4.788 15.487 1.00 0.00 N ATOM 0 H ARG B 2 -7.215 -4.954 11.554 1.00 0.00 H new ATOM 0 HA ARG B 2 -5.246 -3.817 9.896 1.00 0.00 H new ATOM 0 HB2 ARG B 2 -5.150 -5.120 12.173 1.00 0.00 H new ATOM 0 HB3 ARG B 2 -5.483 -6.585 11.270 1.00 0.00 H new ATOM 0 HG2 ARG B 2 -3.412 -6.417 10.048 1.00 0.00 H new ATOM 0 HG3 ARG B 2 -3.125 -4.787 10.625 1.00 0.00 H new ATOM 0 HD2 ARG B 2 -3.084 -7.263 12.401 1.00 0.00 H new ATOM 0 HD3 ARG B 2 -1.661 -6.517 11.701 1.00 0.00 H new ATOM 0 HE ARG B 2 -3.040 -4.409 13.018 1.00 0.00 H new ATOM 0 HH11 ARG B 2 -1.711 -7.556 13.811 1.00 0.00 H new ATOM 0 HH12 ARG B 2 -1.213 -7.152 15.457 1.00 0.00 H new ATOM 0 HH21 ARG B 2 -2.664 -3.899 15.425 1.00 0.00 H new ATOM 0 HH22 ARG B 2 -1.732 -5.068 16.365 1.00 0.00 H new ATOM 2217 N LYS B 3 -6.522 -6.348 8.445 1.00 0.00 N ATOM 2218 CA LYS B 3 -6.524 -7.216 7.308 1.00 0.00 C ATOM 2219 C LYS B 3 -6.512 -6.580 5.961 1.00 0.00 C ATOM 2220 O LYS B 3 -5.796 -6.955 5.034 1.00 0.00 O ATOM 2221 CB LYS B 3 -7.751 -8.127 7.483 1.00 0.00 C ATOM 2222 CG LYS B 3 -7.790 -9.510 6.830 1.00 0.00 C ATOM 2223 CD LYS B 3 -6.997 -10.584 7.579 1.00 0.00 C ATOM 2224 CE LYS B 3 -7.155 -12.006 7.037 1.00 0.00 C ATOM 2225 NZ LYS B 3 -6.270 -12.938 7.771 1.00 0.00 N ATOM 0 H LYS B 3 -7.325 -6.529 9.047 1.00 0.00 H new ATOM 0 HA LYS B 3 -5.573 -7.749 7.303 1.00 0.00 H new ATOM 0 HB2 LYS B 3 -7.894 -8.273 8.554 1.00 0.00 H new ATOM 0 HB3 LYS B 3 -8.617 -7.574 7.118 1.00 0.00 H new ATOM 0 HG2 LYS B 3 -8.828 -9.832 6.750 1.00 0.00 H new ATOM 0 HG3 LYS B 3 -7.402 -9.430 5.815 1.00 0.00 H new ATOM 0 HD2 LYS B 3 -5.940 -10.317 7.553 1.00 0.00 H new ATOM 0 HD3 LYS B 3 -7.302 -10.575 8.625 1.00 0.00 H new ATOM 0 HE2 LYS B 3 -8.192 -12.326 7.135 1.00 0.00 H new ATOM 0 HE3 LYS B 3 -6.914 -12.026 5.974 1.00 0.00 H new ATOM 0 HZ1 LYS B 3 -6.164 -13.818 7.227 1.00 0.00 H new ATOM 0 HZ2 LYS B 3 -5.337 -12.499 7.903 1.00 0.00 H new ATOM 0 HZ3 LYS B 3 -6.686 -13.153 8.699 1.00 0.00 H new ATOM 2239 N TRP B 4 -7.283 -5.493 5.780 1.00 0.00 N ATOM 2240 CA TRP B 4 -7.116 -4.510 4.756 1.00 0.00 C ATOM 2241 C TRP B 4 -5.811 -3.791 4.782 1.00 0.00 C ATOM 2242 O TRP B 4 -5.115 -3.680 3.774 1.00 0.00 O ATOM 2243 CB TRP B 4 -8.279 -3.507 4.677 1.00 0.00 C ATOM 2244 CG TRP B 4 -9.633 -4.049 4.287 1.00 0.00 C ATOM 2245 CD1 TRP B 4 -10.778 -4.009 5.028 1.00 0.00 C ATOM 2246 CD2 TRP B 4 -10.038 -4.430 2.959 1.00 0.00 C ATOM 2247 NE1 TRP B 4 -11.790 -4.594 4.313 1.00 0.00 N ATOM 2248 CE2 TRP B 4 -11.396 -4.766 3.007 1.00 0.00 C ATOM 2249 CE3 TRP B 4 -9.414 -4.513 1.744 1.00 0.00 C ATOM 2250 CZ2 TRP B 4 -12.115 -5.085 1.888 1.00 0.00 C ATOM 2251 CZ3 TRP B 4 -10.091 -4.910 0.616 1.00 0.00 C ATOM 2252 CH2 TRP B 4 -11.442 -5.158 0.691 1.00 0.00 C ATOM 0 H TRP B 4 -8.075 -5.289 6.390 1.00 0.00 H new ATOM 0 HA TRP B 4 -7.119 -5.107 3.844 1.00 0.00 H new ATOM 0 HB2 TRP B 4 -8.376 -3.025 5.650 1.00 0.00 H new ATOM 0 HB3 TRP B 4 -8.007 -2.731 3.962 1.00 0.00 H new ATOM 0 HD1 TRP B 4 -10.871 -3.585 6.017 1.00 0.00 H new ATOM 0 HE1 TRP B 4 -12.698 -4.861 4.692 1.00 0.00 H new ATOM 0 HE3 TRP B 4 -8.366 -4.261 1.670 1.00 0.00 H new ATOM 0 HZ2 TRP B 4 -13.177 -5.273 1.943 1.00 0.00 H new ATOM 0 HZ3 TRP B 4 -9.567 -5.026 -0.321 1.00 0.00 H new ATOM 0 HH2 TRP B 4 -11.984 -5.415 -0.207 1.00 0.00 H new ATOM 2263 N GLN B 5 -5.375 -3.217 5.918 1.00 0.00 N ATOM 2264 CA GLN B 5 -4.276 -2.302 5.920 1.00 0.00 C ATOM 2265 C GLN B 5 -2.968 -2.981 5.699 1.00 0.00 C ATOM 2266 O GLN B 5 -2.086 -2.548 4.960 1.00 0.00 O ATOM 2267 CB GLN B 5 -4.286 -1.435 7.190 1.00 0.00 C ATOM 2268 CG GLN B 5 -5.632 -0.797 7.540 1.00 0.00 C ATOM 2269 CD GLN B 5 -6.226 0.110 6.472 1.00 0.00 C ATOM 2270 OE1 GLN B 5 -5.552 0.818 5.726 1.00 0.00 O ATOM 2271 NE2 GLN B 5 -7.562 -0.130 6.385 1.00 0.00 N ATOM 0 H GLN B 5 -5.785 -3.387 6.837 1.00 0.00 H new ATOM 0 HA GLN B 5 -4.405 -1.633 5.069 1.00 0.00 H new ATOM 0 HB2 GLN B 5 -3.965 -2.049 8.031 1.00 0.00 H new ATOM 0 HB3 GLN B 5 -3.547 -0.642 7.074 1.00 0.00 H new ATOM 0 HG2 GLN B 5 -6.346 -1.592 7.755 1.00 0.00 H new ATOM 0 HG3 GLN B 5 -5.513 -0.220 8.457 1.00 0.00 H new ATOM 0 HE21 GLN B 5 -8.016 -0.739 7.065 1.00 0.00 H new ATOM 0 HE22 GLN B 5 -8.110 0.299 5.639 1.00 0.00 H new ATOM 2280 N LYS B 6 -2.856 -4.178 6.304 1.00 0.00 N ATOM 2281 CA LYS B 6 -1.865 -5.180 6.064 1.00 0.00 C ATOM 2282 C LYS B 6 -1.644 -5.621 4.658 1.00 0.00 C ATOM 2283 O LYS B 6 -0.514 -5.738 4.186 1.00 0.00 O ATOM 2284 CB LYS B 6 -2.200 -6.360 6.992 1.00 0.00 C ATOM 2285 CG LYS B 6 -1.288 -7.575 6.815 1.00 0.00 C ATOM 2286 CD LYS B 6 -1.672 -8.780 7.676 1.00 0.00 C ATOM 2287 CE LYS B 6 -1.072 -10.173 7.474 1.00 0.00 C ATOM 2288 NZ LYS B 6 -1.694 -11.063 8.481 1.00 0.00 N ATOM 0 H LYS B 6 -3.518 -4.467 7.024 1.00 0.00 H new ATOM 0 HA LYS B 6 -0.900 -4.722 6.282 1.00 0.00 H new ATOM 0 HB2 LYS B 6 -2.140 -6.022 8.027 1.00 0.00 H new ATOM 0 HB3 LYS B 6 -3.231 -6.665 6.815 1.00 0.00 H new ATOM 0 HG2 LYS B 6 -1.299 -7.874 5.767 1.00 0.00 H new ATOM 0 HG3 LYS B 6 -0.265 -7.284 7.053 1.00 0.00 H new ATOM 0 HD2 LYS B 6 -1.465 -8.501 8.709 1.00 0.00 H new ATOM 0 HD3 LYS B 6 -2.752 -8.892 7.587 1.00 0.00 H new ATOM 0 HE2 LYS B 6 -1.269 -10.535 6.465 1.00 0.00 H new ATOM 0 HE3 LYS B 6 0.011 -10.148 7.598 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 -1.174 -11.963 8.517 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 -1.661 -10.607 9.415 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 -2.684 -11.245 8.219 1.00 0.00 H new ATOM 2302 N THR B 7 -2.740 -5.850 3.912 1.00 0.00 N ATOM 2303 CA THR B 7 -2.657 -6.179 2.523 1.00 0.00 C ATOM 2304 C THR B 7 -2.236 -5.039 1.662 1.00 0.00 C ATOM 2305 O THR B 7 -1.575 -5.254 0.647 1.00 0.00 O ATOM 2306 CB THR B 7 -3.960 -6.795 2.107 1.00 0.00 C ATOM 2307 OG1 THR B 7 -4.432 -7.924 2.827 1.00 0.00 O ATOM 2308 CG2 THR B 7 -3.891 -7.246 0.638 1.00 0.00 C ATOM 0 H THR B 7 -3.692 -5.807 4.276 1.00 0.00 H new ATOM 0 HA THR B 7 -1.857 -6.905 2.379 1.00 0.00 H new ATOM 0 HB THR B 7 -4.657 -5.982 2.312 1.00 0.00 H new ATOM 0 HG1 THR B 7 -4.922 -7.624 3.621 1.00 0.00 H new ATOM 0 HG21 THR B 7 -4.843 -7.691 0.349 1.00 0.00 H new ATOM 0 HG22 THR B 7 -3.685 -6.385 0.002 1.00 0.00 H new ATOM 0 HG23 THR B 7 -3.096 -7.982 0.520 1.00 0.00 H new ATOM 2316 N GLY B 8 -2.731 -3.844 2.030 1.00 0.00 N ATOM 2317 CA GLY B 8 -2.434 -2.575 1.441 1.00 0.00 C ATOM 2318 C GLY B 8 -0.979 -2.315 1.630 1.00 0.00 C ATOM 2319 O GLY B 8 -0.326 -1.817 0.714 1.00 0.00 O ATOM 0 H GLY B 8 -3.392 -3.760 2.802 1.00 0.00 H new ATOM 0 HA2 GLY B 8 -2.687 -2.577 0.381 1.00 0.00 H new ATOM 0 HA3 GLY B 8 -3.027 -1.789 1.909 1.00 0.00 H new ATOM 2323 N HIS B 9 -0.345 -2.717 2.746 1.00 0.00 N ATOM 2324 CA HIS B 9 1.045 -2.645 3.076 1.00 0.00 C ATOM 2325 C HIS B 9 1.781 -3.530 2.130 1.00 0.00 C ATOM 2326 O HIS B 9 2.645 -3.047 1.400 1.00 0.00 O ATOM 2327 CB HIS B 9 1.361 -2.899 4.559 1.00 0.00 C ATOM 2328 CG HIS B 9 1.175 -1.653 5.373 1.00 0.00 C ATOM 2329 ND1 HIS B 9 0.237 -1.438 6.362 1.00 0.00 N ATOM 2330 CD2 HIS B 9 1.788 -0.456 5.173 1.00 0.00 C ATOM 2331 CE1 HIS B 9 0.410 -0.160 6.792 1.00 0.00 C ATOM 2332 NE2 HIS B 9 1.339 0.467 6.095 1.00 0.00 N ATOM 0 H HIS B 9 -0.874 -3.144 3.506 1.00 0.00 H new ATOM 0 HA HIS B 9 1.390 -1.619 2.951 1.00 0.00 H new ATOM 0 HB2 HIS B 9 0.713 -3.687 4.942 1.00 0.00 H new ATOM 0 HB3 HIS B 9 2.387 -3.253 4.660 1.00 0.00 H new ATOM 0 HD2 HIS B 9 2.520 -0.257 4.404 1.00 0.00 H new ATOM 0 HE1 HIS B 9 -0.144 0.287 7.604 1.00 0.00 H new ATOM 0 HE2 HIS B 9 1.657 1.429 6.213 1.00 0.00 H new ATOM 2340 N ALA B 10 1.436 -4.826 2.020 1.00 0.00 N ATOM 2341 CA ALA B 10 2.009 -5.703 1.047 1.00 0.00 C ATOM 2342 C ALA B 10 1.924 -5.279 -0.379 1.00 0.00 C ATOM 2343 O ALA B 10 2.911 -5.082 -1.086 1.00 0.00 O ATOM 2344 CB ALA B 10 1.229 -7.024 1.153 1.00 0.00 C ATOM 0 H ALA B 10 0.744 -5.274 2.621 1.00 0.00 H new ATOM 0 HA ALA B 10 3.074 -5.746 1.276 1.00 0.00 H new ATOM 0 HB1 ALA B 10 1.623 -7.738 0.430 1.00 0.00 H new ATOM 0 HB2 ALA B 10 1.336 -7.430 2.159 1.00 0.00 H new ATOM 0 HB3 ALA B 10 0.175 -6.842 0.945 1.00 0.00 H new ATOM 2350 N VAL B 11 0.691 -5.084 -0.881 1.00 0.00 N ATOM 2351 CA VAL B 11 0.435 -4.778 -2.254 1.00 0.00 C ATOM 2352 C VAL B 11 1.170 -3.646 -2.887 1.00 0.00 C ATOM 2353 O VAL B 11 1.822 -3.697 -3.928 1.00 0.00 O ATOM 2354 CB VAL B 11 -1.015 -4.874 -2.624 1.00 0.00 C ATOM 2355 CG1 VAL B 11 -1.901 -3.710 -2.149 1.00 0.00 C ATOM 2356 CG2 VAL B 11 -1.071 -4.967 -4.158 1.00 0.00 C ATOM 0 H VAL B 11 -0.154 -5.141 -0.313 1.00 0.00 H new ATOM 0 HA VAL B 11 0.942 -5.605 -2.751 1.00 0.00 H new ATOM 0 HB VAL B 11 -1.422 -5.748 -2.116 1.00 0.00 H new ATOM 0 HG11 VAL B 11 -2.929 -3.880 -2.470 1.00 0.00 H new ATOM 0 HG12 VAL B 11 -1.866 -3.647 -1.061 1.00 0.00 H new ATOM 0 HG13 VAL B 11 -1.537 -2.777 -2.579 1.00 0.00 H new ATOM 0 HG21 VAL B 11 -2.110 -5.039 -4.480 1.00 0.00 H new ATOM 0 HG22 VAL B 11 -0.617 -4.077 -4.593 1.00 0.00 H new ATOM 0 HG23 VAL B 11 -0.526 -5.851 -4.489 1.00 0.00 H new ATOM 2366 N ARG B 12 1.131 -2.531 -2.137 1.00 0.00 N ATOM 2367 CA ARG B 12 1.761 -1.296 -2.490 1.00 0.00 C ATOM 2368 C ARG B 12 3.246 -1.324 -2.602 1.00 0.00 C ATOM 2369 O ARG B 12 3.956 -0.703 -3.391 1.00 0.00 O ATOM 2370 CB ARG B 12 1.315 -0.147 -1.570 1.00 0.00 C ATOM 2371 CG ARG B 12 1.663 1.252 -2.083 1.00 0.00 C ATOM 2372 CD ARG B 12 1.017 2.425 -1.344 1.00 0.00 C ATOM 2373 NE ARG B 12 1.402 3.650 -2.100 1.00 0.00 N ATOM 2374 CZ ARG B 12 0.758 4.849 -1.994 1.00 0.00 C ATOM 2375 NH1 ARG B 12 -0.173 5.011 -1.009 1.00 0.00 N ATOM 2376 NH2 ARG B 12 0.988 5.899 -2.835 1.00 0.00 N ATOM 0 H ARG B 12 0.639 -2.488 -1.245 1.00 0.00 H new ATOM 0 HA ARG B 12 1.409 -1.118 -3.506 1.00 0.00 H new ATOM 0 HB2 ARG B 12 0.236 -0.210 -1.429 1.00 0.00 H new ATOM 0 HB3 ARG B 12 1.773 -0.285 -0.591 1.00 0.00 H new ATOM 0 HG2 ARG B 12 2.745 1.374 -2.038 1.00 0.00 H new ATOM 0 HG3 ARG B 12 1.379 1.312 -3.134 1.00 0.00 H new ATOM 0 HD2 ARG B 12 -0.067 2.314 -1.307 1.00 0.00 H new ATOM 0 HD3 ARG B 12 1.367 2.477 -0.313 1.00 0.00 H new ATOM 0 HE ARG B 12 2.197 3.589 -2.737 1.00 0.00 H new ATOM 0 HH11 ARG B 12 -0.377 4.244 -0.369 1.00 0.00 H new ATOM 0 HH12 ARG B 12 -0.665 5.899 -0.913 1.00 0.00 H new ATOM 0 HH21 ARG B 12 1.670 5.809 -3.588 1.00 0.00 H new ATOM 0 HH22 ARG B 12 0.478 6.773 -2.710 1.00 0.00 H new ATOM 2390 N ALA B 13 3.829 -2.225 -1.791 1.00 0.00 N ATOM 2391 CA ALA B 13 5.217 -2.571 -1.774 1.00 0.00 C ATOM 2392 C ALA B 13 5.524 -3.532 -2.871 1.00 0.00 C ATOM 2393 O ALA B 13 6.593 -3.480 -3.477 1.00 0.00 O ATOM 2394 CB ALA B 13 5.679 -3.059 -0.391 1.00 0.00 C ATOM 0 H ALA B 13 3.292 -2.748 -1.099 1.00 0.00 H new ATOM 0 HA ALA B 13 5.798 -1.669 -1.964 1.00 0.00 H new ATOM 0 HB1 ALA B 13 6.739 -3.309 -0.429 1.00 0.00 H new ATOM 0 HB2 ALA B 13 5.518 -2.271 0.345 1.00 0.00 H new ATOM 0 HB3 ALA B 13 5.107 -3.943 -0.107 1.00 0.00 H new ATOM 2400 N ILE B 14 4.577 -4.407 -3.254 1.00 0.00 N ATOM 2401 CA ILE B 14 4.705 -5.217 -4.425 1.00 0.00 C ATOM 2402 C ILE B 14 4.728 -4.344 -5.632 1.00 0.00 C ATOM 2403 O ILE B 14 5.571 -4.481 -6.518 1.00 0.00 O ATOM 2404 CB ILE B 14 3.638 -6.272 -4.386 1.00 0.00 C ATOM 2405 CG1 ILE B 14 4.152 -7.437 -3.524 1.00 0.00 C ATOM 2406 CG2 ILE B 14 2.979 -6.748 -5.691 1.00 0.00 C ATOM 2407 CD1 ILE B 14 3.037 -8.070 -2.693 1.00 0.00 C ATOM 0 H ILE B 14 3.707 -4.554 -2.742 1.00 0.00 H new ATOM 0 HA ILE B 14 5.650 -5.758 -4.467 1.00 0.00 H new ATOM 0 HB ILE B 14 2.779 -5.764 -3.948 1.00 0.00 H new ATOM 0 HG12 ILE B 14 4.599 -8.195 -4.168 1.00 0.00 H new ATOM 0 HG13 ILE B 14 4.939 -7.078 -2.861 1.00 0.00 H new ATOM 0 HG21 ILE B 14 2.234 -7.511 -5.465 1.00 0.00 H new ATOM 0 HG22 ILE B 14 2.496 -5.904 -6.184 1.00 0.00 H new ATOM 0 HG23 ILE B 14 3.739 -7.167 -6.351 1.00 0.00 H new ATOM 0 HD11 ILE B 14 3.445 -8.888 -2.100 1.00 0.00 H new ATOM 0 HD12 ILE B 14 2.607 -7.320 -2.029 1.00 0.00 H new ATOM 0 HD13 ILE B 14 2.262 -8.454 -3.356 1.00 0.00 H new ATOM 2419 N GLY B 15 3.924 -3.267 -5.666 1.00 0.00 N ATOM 2420 CA GLY B 15 3.800 -2.360 -6.765 1.00 0.00 C ATOM 2421 C GLY B 15 5.047 -1.561 -6.926 1.00 0.00 C ATOM 2422 O GLY B 15 5.635 -1.473 -8.002 1.00 0.00 O ATOM 0 H GLY B 15 3.325 -3.015 -4.880 1.00 0.00 H new ATOM 0 HA2 GLY B 15 3.596 -2.915 -7.681 1.00 0.00 H new ATOM 0 HA3 GLY B 15 2.953 -1.694 -6.601 1.00 0.00 H new ATOM 2426 N ARG B 16 5.512 -0.922 -5.838 1.00 0.00 N ATOM 2427 CA ARG B 16 6.699 -0.143 -5.665 1.00 0.00 C ATOM 2428 C ARG B 16 7.970 -0.852 -5.987 1.00 0.00 C ATOM 2429 O ARG B 16 8.781 -0.491 -6.837 1.00 0.00 O ATOM 2430 CB ARG B 16 6.836 0.367 -4.221 1.00 0.00 C ATOM 2431 CG ARG B 16 7.903 1.443 -4.008 1.00 0.00 C ATOM 2432 CD ARG B 16 7.506 2.782 -4.631 1.00 0.00 C ATOM 2433 NE ARG B 16 6.254 3.355 -4.061 1.00 0.00 N ATOM 2434 CZ ARG B 16 5.996 3.716 -2.770 1.00 0.00 C ATOM 2435 NH1 ARG B 16 6.917 3.852 -1.771 1.00 0.00 N ATOM 2436 NH2 ARG B 16 4.685 3.981 -2.499 1.00 0.00 N ATOM 0 H ARG B 16 4.982 -0.960 -4.967 1.00 0.00 H new ATOM 0 HA ARG B 16 6.567 0.671 -6.377 1.00 0.00 H new ATOM 0 HB2 ARG B 16 5.873 0.764 -3.900 1.00 0.00 H new ATOM 0 HB3 ARG B 16 7.063 -0.480 -3.574 1.00 0.00 H new ATOM 0 HG2 ARG B 16 8.073 1.577 -2.940 1.00 0.00 H new ATOM 0 HG3 ARG B 16 8.846 1.108 -4.441 1.00 0.00 H new ATOM 0 HD2 ARG B 16 8.319 3.494 -4.490 1.00 0.00 H new ATOM 0 HD3 ARG B 16 7.380 2.650 -5.706 1.00 0.00 H new ATOM 0 HE ARG B 16 5.490 3.496 -4.722 1.00 0.00 H new ATOM 0 HH11 ARG B 16 7.904 3.678 -1.960 1.00 0.00 H new ATOM 0 HH12 ARG B 16 6.618 4.128 -0.836 1.00 0.00 H new ATOM 0 HH21 ARG B 16 3.986 3.902 -3.237 1.00 0.00 H new ATOM 0 HH22 ARG B 16 4.405 4.258 -1.558 1.00 0.00 H new