USER MOD reduce.3.24.130724 H: found=0, std=0, add=1093, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1094 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 137 ASN : amide:sc= -1.85 K(o=-2.9,f=-8.9!) USER MOD Set 1.2: A 144 THR OG1 : rot -140:sc= -1.09 USER MOD Set 2.1: A 45 SER OG : rot 92:sc= -0.889! USER MOD Set 2.2: A 143 THR OG1 : rot -170:sc= 1.03 USER MOD Set 3.1: A 81 LYS NZ :NH3+ -170:sc= -0.0181 (180deg=0) USER MOD Set 3.2: A 135 GLN : amide:sc= -1.51 X(o=-1.5,f=-1.9) USER MOD Set 4.1: A 54 THR OG1 : rot 180:sc= 0 USER MOD Set 4.2: A 89 SER OG : rot 57:sc= 0.376 USER MOD Set 4.3: A 131 THR OG1 : rot -170:sc=-0.00219 USER MOD Set 5.1: A 27 SER OG : rot 160:sc= 0.917 USER MOD Set 5.2: A 30 HIS : no HD1:sc= -0.236 K(o=0.68,f=-0.62) USER MOD Set 6.1: A 13 MET CE :methyl -121:sc= -2.85 (180deg=-5.38!) USER MOD Set 6.2: A 150 THR OG1 : rot 124:sc= 0.428 USER MOD Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A 10 MET CE :methyl -158:sc= -2.42 (180deg=-3.07) USER MOD Single : A 17 ASN : amide:sc=-0.00313 X(o=-0.0031,f=-0.48) USER MOD Single : A 18 LYS NZ :NH3+ -150:sc= -0.94 (180deg=-2.72!) USER MOD Single : A 21 CYS SG : rot 60:sc= 0.0143 USER MOD Single : A 23 CYS SG : rot 180:sc= -0.3 USER MOD Single : A 25 ASN :FLIP amide:sc= -0.041 F(o=-0.64,f=-0.041) USER MOD Single : A 34 ASN : amide:sc= -0.0158 K(o=-0.016,f=-0.76) USER MOD Single : A 35 CYS SG : rot -75:sc= 1.14 USER MOD Single : A 47 CYS SG : rot 180:sc= 0 USER MOD Single : A 50 GLN : amide:sc= -0.0803 X(o=-0.08,f=0) USER MOD Single : A 58 ASN : amide:sc= -0.38 X(o=-0.38,f=-0.089) USER MOD Single : A 59 GLN : amide:sc= -4.45! C(o=-4.4!,f=-6.7!) USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 TYR OH : rot 30:sc= -0.989 USER MOD Single : A 65 SER OG : rot 180:sc= -0.475 USER MOD Single : A 66 MET CE :methyl -151:sc= 0 (180deg=-0.46) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 GLN : amide:sc= -0.517 K(o=-0.52,f=-2.3) USER MOD Single : A 73 ASN : amide:sc= -1.94 X(o=-1.9,f=-2.3!) USER MOD Single : A 75 GLN : amide:sc= -2.73! C(o=-2.7!,f=-3.5!) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 ASN :FLIP amide:sc= 0 F(o=-0.99,f=0) USER MOD Single : A 90 MET CE :methyl 141:sc= -3.01! (180deg=-5.48!) USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 101 THR OG1 : rot -110:sc= -0.739 USER MOD Single : A 102 GLN : amide:sc= -4.98 K(o=-5,f=-13!) USER MOD Single : A 107 THR OG1 : rot 41:sc= -0.134 USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 121 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 GLN : amide:sc= 0.297 X(o=0.3,f=-0.0086) USER MOD Single : A 126 ASN : amide:sc= -3.34 X(o=-3.3,f=-3.6!) USER MOD Single : A 128 ASN : amide:sc= -1.39 X(o=-1.4,f=-1.6) USER MOD Single : A 129 SER OG : rot 38:sc= 0.243 USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD Single : A 138 GLN : amide:sc= -2.62 K(o=-2.6,f=-7.7!) USER MOD Single : A 147 SER OG : rot 180:sc= -0.165 USER MOD Single : A 148 TYR OH : rot 180:sc= 0 USER MOD Single : A 154 THR OG1 : rot 180:sc= -0.843 USER MOD Single : A 157 GLN : amide:sc= -0.131 X(o=-0.13,f=-0.28) USER MOD ----------------------------------------------------------------- ATOM 73 N TYR A 9 12.688 9.354 0.920 1.00 0.00 N ATOM 74 CA TYR A 9 11.763 8.670 1.815 1.00 0.00 C ATOM 75 C TYR A 9 12.104 7.186 1.921 1.00 0.00 C ATOM 76 O TYR A 9 13.083 6.721 1.339 1.00 0.00 O ATOM 77 CB TYR A 9 10.324 8.839 1.323 1.00 0.00 C ATOM 78 CG TYR A 9 9.957 10.272 1.007 1.00 0.00 C ATOM 79 CD1 TYR A 9 10.156 10.796 -0.264 1.00 0.00 C ATOM 80 CD2 TYR A 9 9.413 11.101 1.980 1.00 0.00 C ATOM 81 CE1 TYR A 9 9.823 12.104 -0.557 1.00 0.00 C ATOM 82 CE2 TYR A 9 9.075 12.410 1.695 1.00 0.00 C ATOM 83 CZ TYR A 9 9.283 12.907 0.426 1.00 0.00 C ATOM 84 OH TYR A 9 8.949 14.211 0.139 1.00 0.00 O ATOM 0 HA TYR A 9 11.857 9.118 2.804 1.00 0.00 H new ATOM 0 HB2 TYR A 9 10.180 8.230 0.430 1.00 0.00 H new ATOM 0 HB3 TYR A 9 9.642 8.457 2.082 1.00 0.00 H new ATOM 0 HD1 TYR A 9 10.578 10.170 -1.036 1.00 0.00 H new ATOM 0 HD2 TYR A 9 9.252 10.716 2.976 1.00 0.00 H new ATOM 0 HE1 TYR A 9 9.985 12.496 -1.550 1.00 0.00 H new ATOM 0 HE2 TYR A 9 8.650 13.040 2.462 1.00 0.00 H new ATOM 0 HH TYR A 9 8.580 14.638 0.940 1.00 0.00 H new ATOM 94 N MET A 10 11.289 6.450 2.669 1.00 0.00 N ATOM 95 CA MET A 10 11.503 5.019 2.850 1.00 0.00 C ATOM 96 C MET A 10 10.212 4.242 2.611 1.00 0.00 C ATOM 97 O MET A 10 9.118 4.744 2.867 1.00 0.00 O ATOM 98 CB MET A 10 12.029 4.735 4.258 1.00 0.00 C ATOM 99 CG MET A 10 12.724 5.925 4.899 1.00 0.00 C ATOM 100 SD MET A 10 13.753 5.456 6.303 1.00 0.00 S ATOM 101 CE MET A 10 12.603 4.458 7.247 1.00 0.00 C ATOM 0 H MET A 10 10.475 6.820 3.159 1.00 0.00 H new ATOM 0 HA MET A 10 12.244 4.692 2.120 1.00 0.00 H new ATOM 0 HB2 MET A 10 11.198 4.425 4.892 1.00 0.00 H new ATOM 0 HB3 MET A 10 12.726 3.898 4.215 1.00 0.00 H new ATOM 0 HG2 MET A 10 13.341 6.426 4.153 1.00 0.00 H new ATOM 0 HG3 MET A 10 11.974 6.645 5.228 1.00 0.00 H new ATOM 0 HE1 MET A 10 12.924 4.419 8.288 1.00 0.00 H new ATOM 0 HE2 MET A 10 11.608 4.899 7.191 1.00 0.00 H new ATOM 0 HE3 MET A 10 12.576 3.448 6.837 1.00 0.00 H new ATOM 111 N ASP A 11 10.348 3.016 2.118 1.00 0.00 N ATOM 112 CA ASP A 11 9.193 2.169 1.845 1.00 0.00 C ATOM 113 C ASP A 11 8.549 1.693 3.143 1.00 0.00 C ATOM 114 O ASP A 11 7.455 1.126 3.135 1.00 0.00 O ATOM 115 CB ASP A 11 9.604 0.966 0.994 1.00 0.00 C ATOM 116 CG ASP A 11 10.676 1.314 -0.020 1.00 0.00 C ATOM 117 OD1 ASP A 11 10.429 2.203 -0.861 1.00 0.00 O ATOM 118 OD2 ASP A 11 11.761 0.697 0.027 1.00 0.00 O ATOM 0 H ASP A 11 11.247 2.586 1.899 1.00 0.00 H new ATOM 0 HA ASP A 11 8.463 2.761 1.294 1.00 0.00 H new ATOM 0 HB2 ASP A 11 9.968 0.171 1.645 1.00 0.00 H new ATOM 0 HB3 ASP A 11 8.729 0.576 0.474 1.00 0.00 H new ATOM 123 N LEU A 12 9.233 1.926 4.257 1.00 0.00 N ATOM 124 CA LEU A 12 8.729 1.521 5.565 1.00 0.00 C ATOM 125 C LEU A 12 8.468 0.018 5.605 1.00 0.00 C ATOM 126 O LEU A 12 7.693 -0.465 6.431 1.00 0.00 O ATOM 127 CB LEU A 12 7.445 2.282 5.896 1.00 0.00 C ATOM 128 CG LEU A 12 7.429 3.766 5.525 1.00 0.00 C ATOM 129 CD1 LEU A 12 6.010 4.311 5.567 1.00 0.00 C ATOM 130 CD2 LEU A 12 8.335 4.558 6.457 1.00 0.00 C ATOM 0 H LEU A 12 10.139 2.394 4.281 1.00 0.00 H new ATOM 0 HA LEU A 12 9.488 1.760 6.310 1.00 0.00 H new ATOM 0 HB2 LEU A 12 6.615 1.792 5.387 1.00 0.00 H new ATOM 0 HB3 LEU A 12 7.260 2.194 6.967 1.00 0.00 H new ATOM 0 HG LEU A 12 7.806 3.871 4.508 1.00 0.00 H new ATOM 0 HD11 LEU A 12 6.018 5.368 5.300 1.00 0.00 H new ATOM 0 HD12 LEU A 12 5.389 3.763 4.859 1.00 0.00 H new ATOM 0 HD13 LEU A 12 5.605 4.194 6.572 1.00 0.00 H new ATOM 0 HD21 LEU A 12 8.312 5.612 6.179 1.00 0.00 H new ATOM 0 HD22 LEU A 12 7.987 4.446 7.484 1.00 0.00 H new ATOM 0 HD23 LEU A 12 9.356 4.184 6.377 1.00 0.00 H new ATOM 142 N MET A 13 9.121 -0.715 4.710 1.00 0.00 N ATOM 143 CA MET A 13 8.962 -2.163 4.646 1.00 0.00 C ATOM 144 C MET A 13 9.309 -2.808 5.984 1.00 0.00 C ATOM 145 O MET A 13 8.526 -3.566 6.557 1.00 0.00 O ATOM 146 CB MET A 13 9.845 -2.747 3.542 1.00 0.00 C ATOM 147 CG MET A 13 9.159 -3.828 2.722 1.00 0.00 C ATOM 148 SD MET A 13 8.263 -3.162 1.306 1.00 0.00 S ATOM 149 CE MET A 13 6.579 -3.592 1.738 1.00 0.00 C ATOM 0 H MET A 13 9.765 -0.330 4.019 1.00 0.00 H new ATOM 0 HA MET A 13 7.918 -2.378 4.418 1.00 0.00 H new ATOM 0 HB2 MET A 13 10.160 -1.943 2.877 1.00 0.00 H new ATOM 0 HB3 MET A 13 10.748 -3.161 3.991 1.00 0.00 H new ATOM 0 HG2 MET A 13 9.905 -4.542 2.372 1.00 0.00 H new ATOM 0 HG3 MET A 13 8.466 -4.378 3.359 1.00 0.00 H new ATOM 0 HE1 MET A 13 6.154 -4.226 0.960 1.00 0.00 H new ATOM 0 HE2 MET A 13 6.572 -4.129 2.687 1.00 0.00 H new ATOM 0 HE3 MET A 13 5.984 -2.684 1.831 1.00 0.00 H new ATOM 159 N PRO A 14 10.510 -2.501 6.496 1.00 0.00 N ATOM 160 CA PRO A 14 10.987 -3.039 7.774 1.00 0.00 C ATOM 161 C PRO A 14 10.224 -2.469 8.965 1.00 0.00 C ATOM 162 O PRO A 14 10.432 -2.886 10.104 1.00 0.00 O ATOM 163 CB PRO A 14 12.453 -2.601 7.818 1.00 0.00 C ATOM 164 CG PRO A 14 12.512 -1.388 6.955 1.00 0.00 C ATOM 165 CD PRO A 14 11.494 -1.603 5.869 1.00 0.00 C ATOM 0 HA PRO A 14 10.848 -4.118 7.839 1.00 0.00 H new ATOM 0 HB2 PRO A 14 12.769 -2.378 8.837 1.00 0.00 H new ATOM 0 HB3 PRO A 14 13.112 -3.385 7.445 1.00 0.00 H new ATOM 0 HG2 PRO A 14 12.286 -0.489 7.529 1.00 0.00 H new ATOM 0 HG3 PRO A 14 13.509 -1.256 6.535 1.00 0.00 H new ATOM 0 HD2 PRO A 14 11.038 -0.664 5.554 1.00 0.00 H new ATOM 0 HD3 PRO A 14 11.941 -2.053 4.983 1.00 0.00 H new ATOM 173 N PHE A 15 9.340 -1.515 8.693 1.00 0.00 N ATOM 174 CA PHE A 15 8.546 -0.888 9.743 1.00 0.00 C ATOM 175 C PHE A 15 7.153 -1.505 9.814 1.00 0.00 C ATOM 176 O PHE A 15 6.377 -1.209 10.724 1.00 0.00 O ATOM 177 CB PHE A 15 8.437 0.619 9.498 1.00 0.00 C ATOM 178 CG PHE A 15 9.733 1.353 9.688 1.00 0.00 C ATOM 179 CD1 PHE A 15 10.770 1.202 8.781 1.00 0.00 C ATOM 180 CD2 PHE A 15 9.916 2.193 10.775 1.00 0.00 C ATOM 181 CE1 PHE A 15 11.964 1.877 8.953 1.00 0.00 C ATOM 182 CE2 PHE A 15 11.108 2.870 10.952 1.00 0.00 C ATOM 183 CZ PHE A 15 12.133 2.711 10.041 1.00 0.00 C ATOM 0 H PHE A 15 9.155 -1.159 7.755 1.00 0.00 H new ATOM 0 HA PHE A 15 9.048 -1.059 10.695 1.00 0.00 H new ATOM 0 HB2 PHE A 15 8.078 0.789 8.483 1.00 0.00 H new ATOM 0 HB3 PHE A 15 7.690 1.036 10.174 1.00 0.00 H new ATOM 0 HD1 PHE A 15 10.644 0.549 7.930 1.00 0.00 H new ATOM 0 HD2 PHE A 15 9.118 2.320 11.492 1.00 0.00 H new ATOM 0 HE1 PHE A 15 12.764 1.752 8.238 1.00 0.00 H new ATOM 0 HE2 PHE A 15 11.237 3.523 11.802 1.00 0.00 H new ATOM 0 HZ PHE A 15 13.066 3.238 10.179 1.00 0.00 H new ATOM 193 N ILE A 16 6.843 -2.363 8.849 1.00 0.00 N ATOM 194 CA ILE A 16 5.544 -3.023 8.802 1.00 0.00 C ATOM 195 C ILE A 16 5.538 -4.287 9.655 1.00 0.00 C ATOM 196 O ILE A 16 6.451 -5.107 9.574 1.00 0.00 O ATOM 197 CB ILE A 16 5.151 -3.390 7.358 1.00 0.00 C ATOM 198 CG1 ILE A 16 4.986 -2.124 6.514 1.00 0.00 C ATOM 199 CG2 ILE A 16 3.869 -4.209 7.351 1.00 0.00 C ATOM 200 CD1 ILE A 16 5.327 -2.323 5.054 1.00 0.00 C ATOM 0 H ILE A 16 7.473 -2.618 8.089 1.00 0.00 H new ATOM 0 HA ILE A 16 4.816 -2.316 9.200 1.00 0.00 H new ATOM 0 HB ILE A 16 5.947 -3.993 6.922 1.00 0.00 H new ATOM 0 HG12 ILE A 16 3.956 -1.775 6.594 1.00 0.00 H new ATOM 0 HG13 ILE A 16 5.621 -1.339 6.923 1.00 0.00 H new ATOM 0 HG21 ILE A 16 3.604 -4.461 6.324 1.00 0.00 H new ATOM 0 HG22 ILE A 16 4.019 -5.125 7.922 1.00 0.00 H new ATOM 0 HG23 ILE A 16 3.064 -3.629 7.802 1.00 0.00 H new ATOM 0 HD11 ILE A 16 5.187 -1.385 4.517 1.00 0.00 H new ATOM 0 HD12 ILE A 16 6.365 -2.642 4.963 1.00 0.00 H new ATOM 0 HD13 ILE A 16 4.674 -3.085 4.629 1.00 0.00 H new ATOM 212 N ASN A 17 4.501 -4.437 10.472 1.00 0.00 N ATOM 213 CA ASN A 17 4.375 -5.603 11.340 1.00 0.00 C ATOM 214 C ASN A 17 3.519 -6.681 10.683 1.00 0.00 C ATOM 215 O ASN A 17 2.290 -6.601 10.684 1.00 0.00 O ATOM 216 CB ASN A 17 3.763 -5.200 12.684 1.00 0.00 C ATOM 217 CG ASN A 17 3.907 -6.285 13.733 1.00 0.00 C ATOM 218 OD1 ASN A 17 4.971 -6.887 13.878 1.00 0.00 O ATOM 219 ND2 ASN A 17 2.833 -6.541 14.471 1.00 0.00 N ATOM 0 H ASN A 17 3.736 -3.767 10.552 1.00 0.00 H new ATOM 0 HA ASN A 17 5.373 -6.009 11.508 1.00 0.00 H new ATOM 0 HB2 ASN A 17 4.243 -4.288 13.040 1.00 0.00 H new ATOM 0 HB3 ASN A 17 2.706 -4.971 12.545 1.00 0.00 H new ATOM 0 HD21 ASN A 17 2.870 -7.261 15.192 1.00 0.00 H new ATOM 0 HD22 ASN A 17 1.971 -6.017 14.317 1.00 0.00 H new ATOM 226 N LYS A 18 4.177 -7.690 10.121 1.00 0.00 N ATOM 227 CA LYS A 18 3.478 -8.786 9.461 1.00 0.00 C ATOM 228 C LYS A 18 2.710 -9.630 10.473 1.00 0.00 C ATOM 229 O LYS A 18 1.691 -10.236 10.144 1.00 0.00 O ATOM 230 CB LYS A 18 4.472 -9.666 8.699 1.00 0.00 C ATOM 231 CG LYS A 18 4.998 -9.026 7.425 1.00 0.00 C ATOM 232 CD LYS A 18 4.277 -9.556 6.197 1.00 0.00 C ATOM 233 CE LYS A 18 2.790 -9.238 6.242 1.00 0.00 C ATOM 234 NZ LYS A 18 2.015 -10.309 6.928 1.00 0.00 N ATOM 0 H LYS A 18 5.194 -7.771 10.110 1.00 0.00 H new ATOM 0 HA LYS A 18 2.766 -8.357 8.756 1.00 0.00 H new ATOM 0 HB2 LYS A 18 5.313 -9.900 9.352 1.00 0.00 H new ATOM 0 HB3 LYS A 18 3.990 -10.611 8.449 1.00 0.00 H new ATOM 0 HG2 LYS A 18 4.875 -7.945 7.482 1.00 0.00 H new ATOM 0 HG3 LYS A 18 6.067 -9.221 7.333 1.00 0.00 H new ATOM 0 HD2 LYS A 18 4.716 -9.120 5.300 1.00 0.00 H new ATOM 0 HD3 LYS A 18 4.417 -10.635 6.129 1.00 0.00 H new ATOM 0 HE2 LYS A 18 2.637 -8.291 6.759 1.00 0.00 H new ATOM 0 HE3 LYS A 18 2.415 -9.112 5.227 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 1.055 -10.353 6.530 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 2.489 -11.224 6.789 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 1.958 -10.099 7.945 1.00 0.00 H new ATOM 248 N ALA A 19 3.205 -9.663 11.706 1.00 0.00 N ATOM 249 CA ALA A 19 2.563 -10.429 12.767 1.00 0.00 C ATOM 250 C ALA A 19 1.181 -9.869 13.089 1.00 0.00 C ATOM 251 O ALA A 19 0.359 -10.539 13.713 1.00 0.00 O ATOM 252 CB ALA A 19 3.434 -10.438 14.014 1.00 0.00 C ATOM 0 H ALA A 19 4.049 -9.168 11.995 1.00 0.00 H new ATOM 0 HA ALA A 19 2.439 -11.454 12.417 1.00 0.00 H new ATOM 0 HB1 ALA A 19 2.942 -11.014 14.798 1.00 0.00 H new ATOM 0 HB2 ALA A 19 4.398 -10.892 13.782 1.00 0.00 H new ATOM 0 HB3 ALA A 19 3.588 -9.415 14.358 1.00 0.00 H new ATOM 258 N GLY A 20 0.932 -8.636 12.659 1.00 0.00 N ATOM 259 CA GLY A 20 -0.351 -8.007 12.912 1.00 0.00 C ATOM 260 C GLY A 20 -1.135 -7.757 11.639 1.00 0.00 C ATOM 261 O GLY A 20 -2.344 -7.527 11.682 1.00 0.00 O ATOM 0 H GLY A 20 1.596 -8.061 12.140 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -0.938 -8.640 13.578 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -0.193 -7.061 13.429 1.00 0.00 H new ATOM 265 N CYS A 21 -0.447 -7.800 10.504 1.00 0.00 N ATOM 266 CA CYS A 21 -1.086 -7.574 9.213 1.00 0.00 C ATOM 267 C CYS A 21 -2.250 -8.538 9.006 1.00 0.00 C ATOM 268 O CYS A 21 -2.293 -9.611 9.607 1.00 0.00 O ATOM 269 CB CYS A 21 -0.069 -7.733 8.082 1.00 0.00 C ATOM 270 SG CYS A 21 1.027 -6.311 7.868 1.00 0.00 S ATOM 0 H CYS A 21 0.554 -7.989 10.451 1.00 0.00 H new ATOM 0 HA CYS A 21 -1.475 -6.556 9.201 1.00 0.00 H new ATOM 0 HB2 CYS A 21 0.536 -8.619 8.274 1.00 0.00 H new ATOM 0 HB3 CYS A 21 -0.604 -7.909 7.149 1.00 0.00 H new ATOM 0 HG CYS A 21 1.694 -6.108 8.965 1.00 0.00 H new ATOM 276 N GLU A 22 -3.192 -8.146 8.154 1.00 0.00 N ATOM 277 CA GLU A 22 -4.358 -8.975 7.871 1.00 0.00 C ATOM 278 C GLU A 22 -4.784 -8.835 6.413 1.00 0.00 C ATOM 279 O GLU A 22 -4.839 -7.728 5.874 1.00 0.00 O ATOM 280 CB GLU A 22 -5.519 -8.593 8.792 1.00 0.00 C ATOM 281 CG GLU A 22 -6.858 -9.160 8.351 1.00 0.00 C ATOM 282 CD GLU A 22 -7.651 -9.746 9.503 1.00 0.00 C ATOM 283 OE1 GLU A 22 -8.416 -8.991 10.139 1.00 0.00 O ATOM 284 OE2 GLU A 22 -7.506 -10.957 9.769 1.00 0.00 O ATOM 0 H GLU A 22 -3.171 -7.261 7.648 1.00 0.00 H new ATOM 0 HA GLU A 22 -4.086 -10.014 8.054 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -5.301 -8.942 9.801 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -5.592 -7.506 8.839 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -7.443 -8.373 7.875 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -6.692 -9.932 7.599 1.00 0.00 H new ATOM 291 N CYS A 23 -5.084 -9.963 5.779 1.00 0.00 N ATOM 292 CA CYS A 23 -5.503 -9.968 4.382 1.00 0.00 C ATOM 293 C CYS A 23 -6.904 -10.554 4.237 1.00 0.00 C ATOM 294 O CYS A 23 -7.241 -11.551 4.878 1.00 0.00 O ATOM 295 CB CYS A 23 -4.513 -10.765 3.533 1.00 0.00 C ATOM 296 SG CYS A 23 -4.091 -12.385 4.217 1.00 0.00 S ATOM 0 H CYS A 23 -5.045 -10.886 6.210 1.00 0.00 H new ATOM 0 HA CYS A 23 -5.522 -8.936 4.031 1.00 0.00 H new ATOM 0 HB2 CYS A 23 -4.933 -10.901 2.536 1.00 0.00 H new ATOM 0 HB3 CYS A 23 -3.599 -10.182 3.417 1.00 0.00 H new ATOM 0 HG CYS A 23 -3.250 -12.984 3.427 1.00 0.00 H new ATOM 302 N LEU A 24 -7.717 -9.929 3.393 1.00 0.00 N ATOM 303 CA LEU A 24 -9.083 -10.388 3.165 1.00 0.00 C ATOM 304 C LEU A 24 -9.214 -11.048 1.795 1.00 0.00 C ATOM 305 O LEU A 24 -8.718 -10.529 0.796 1.00 0.00 O ATOM 306 CB LEU A 24 -10.060 -9.217 3.275 1.00 0.00 C ATOM 307 CG LEU A 24 -9.928 -8.348 4.526 1.00 0.00 C ATOM 308 CD1 LEU A 24 -11.121 -7.414 4.656 1.00 0.00 C ATOM 309 CD2 LEU A 24 -9.793 -9.218 5.768 1.00 0.00 C ATOM 0 H LEU A 24 -7.454 -9.103 2.855 1.00 0.00 H new ATOM 0 HA LEU A 24 -9.324 -11.127 3.929 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -9.933 -8.580 2.400 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -11.075 -9.612 3.237 1.00 0.00 H new ATOM 0 HG LEU A 24 -9.027 -7.742 4.430 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -11.009 -6.804 5.552 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -11.174 -6.767 3.780 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -12.036 -8.001 4.729 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -9.700 -8.583 6.649 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -10.676 -9.850 5.868 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -8.906 -9.845 5.678 1.00 0.00 H new ATOM 321 N ASN A 25 -9.887 -12.193 1.758 1.00 0.00 N ATOM 322 CA ASN A 25 -10.085 -12.923 0.511 1.00 0.00 C ATOM 323 C ASN A 25 -8.747 -13.322 -0.104 1.00 0.00 C ATOM 324 O ASN A 25 -8.589 -13.322 -1.325 1.00 0.00 O ATOM 325 CB ASN A 25 -10.881 -12.073 -0.481 1.00 0.00 C ATOM 326 CG ASN A 25 -11.739 -12.915 -1.406 1.00 0.00 C ATOM 327 OD1 ASN A 25 -11.487 -12.808 -2.706 1.00 0.00 O flip ATOM 328 ND2 ASN A 25 -12.616 -13.653 -0.957 1.00 0.00 N flip ATOM 0 H ASN A 25 -10.304 -12.635 2.577 1.00 0.00 H new ATOM 0 HA ASN A 25 -10.647 -13.830 0.735 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -11.517 -11.379 0.068 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -10.192 -11.472 -1.075 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -12.774 -13.703 0.049 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -13.184 -14.214 -1.591 1.00 0.00 H new ATOM 335 N GLU A 26 -7.786 -13.661 0.750 1.00 0.00 N ATOM 336 CA GLU A 26 -6.462 -14.062 0.290 1.00 0.00 C ATOM 337 C GLU A 26 -6.502 -15.452 -0.340 1.00 0.00 C ATOM 338 O GLU A 26 -7.089 -16.380 0.216 1.00 0.00 O ATOM 339 CB GLU A 26 -5.467 -14.045 1.452 1.00 0.00 C ATOM 340 CG GLU A 26 -4.076 -14.523 1.070 1.00 0.00 C ATOM 341 CD GLU A 26 -3.575 -15.638 1.968 1.00 0.00 C ATOM 342 OE1 GLU A 26 -4.296 -16.647 2.118 1.00 0.00 O ATOM 343 OE2 GLU A 26 -2.464 -15.501 2.520 1.00 0.00 O ATOM 0 H GLU A 26 -7.900 -13.666 1.764 1.00 0.00 H new ATOM 0 HA GLU A 26 -6.137 -13.348 -0.467 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -5.398 -13.031 1.845 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -5.850 -14.673 2.256 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -4.086 -14.870 0.037 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -3.382 -13.684 1.117 1.00 0.00 H new ATOM 350 N SER A 27 -5.874 -15.586 -1.504 1.00 0.00 N ATOM 351 CA SER A 27 -5.841 -16.860 -2.212 1.00 0.00 C ATOM 352 C SER A 27 -5.311 -17.970 -1.309 1.00 0.00 C ATOM 353 O SER A 27 -4.615 -17.708 -0.328 1.00 0.00 O ATOM 354 CB SER A 27 -4.972 -16.748 -3.466 1.00 0.00 C ATOM 355 OG SER A 27 -4.385 -17.996 -3.792 1.00 0.00 O ATOM 0 H SER A 27 -5.381 -14.828 -1.976 1.00 0.00 H new ATOM 0 HA SER A 27 -6.860 -17.111 -2.506 1.00 0.00 H new ATOM 0 HB2 SER A 27 -5.578 -16.398 -4.302 1.00 0.00 H new ATOM 0 HB3 SER A 27 -4.190 -16.006 -3.306 1.00 0.00 H new ATOM 0 HG SER A 27 -4.111 -17.993 -4.733 1.00 0.00 H new ATOM 361 N ASP A 28 -5.646 -19.210 -1.648 1.00 0.00 N ATOM 362 CA ASP A 28 -5.203 -20.361 -0.870 1.00 0.00 C ATOM 363 C ASP A 28 -3.761 -20.724 -1.208 1.00 0.00 C ATOM 364 O ASP A 28 -2.952 -20.986 -0.319 1.00 0.00 O ATOM 365 CB ASP A 28 -6.118 -21.560 -1.127 1.00 0.00 C ATOM 366 CG ASP A 28 -7.118 -21.776 -0.008 1.00 0.00 C ATOM 367 OD1 ASP A 28 -7.989 -20.902 0.185 1.00 0.00 O ATOM 368 OD2 ASP A 28 -7.029 -22.818 0.674 1.00 0.00 O ATOM 0 H ASP A 28 -6.223 -19.444 -2.456 1.00 0.00 H new ATOM 0 HA ASP A 28 -5.253 -20.095 0.186 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -6.653 -21.410 -2.065 1.00 0.00 H new ATOM 0 HB3 ASP A 28 -5.511 -22.458 -1.246 1.00 0.00 H new ATOM 373 N GLU A 29 -3.447 -20.738 -2.500 1.00 0.00 N ATOM 374 CA GLU A 29 -2.102 -21.071 -2.955 1.00 0.00 C ATOM 375 C GLU A 29 -1.198 -19.842 -2.927 1.00 0.00 C ATOM 376 O GLU A 29 0.013 -19.953 -2.736 1.00 0.00 O ATOM 377 CB GLU A 29 -2.148 -21.651 -4.371 1.00 0.00 C ATOM 378 CG GLU A 29 -3.151 -22.780 -4.533 1.00 0.00 C ATOM 379 CD GLU A 29 -2.990 -23.519 -5.848 1.00 0.00 C ATOM 380 OE1 GLU A 29 -1.870 -23.506 -6.402 1.00 0.00 O ATOM 381 OE2 GLU A 29 -3.982 -24.109 -6.323 1.00 0.00 O ATOM 0 H GLU A 29 -4.105 -20.523 -3.249 1.00 0.00 H new ATOM 0 HA GLU A 29 -1.691 -21.818 -2.276 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -2.394 -20.854 -5.073 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -1.156 -22.016 -4.638 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -3.037 -23.484 -3.709 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -4.161 -22.376 -4.469 1.00 0.00 H new ATOM 388 N HIS A 30 -1.796 -18.670 -3.118 1.00 0.00 N ATOM 389 CA HIS A 30 -1.046 -17.419 -3.114 1.00 0.00 C ATOM 390 C HIS A 30 -1.311 -16.630 -1.835 1.00 0.00 C ATOM 391 O HIS A 30 -2.413 -16.668 -1.288 1.00 0.00 O ATOM 392 CB HIS A 30 -1.415 -16.575 -4.334 1.00 0.00 C ATOM 393 CG HIS A 30 -1.353 -17.330 -5.626 1.00 0.00 C ATOM 394 ND1 HIS A 30 -2.431 -17.454 -6.477 1.00 0.00 N ATOM 395 CD2 HIS A 30 -0.334 -18.001 -6.211 1.00 0.00 C ATOM 396 CE1 HIS A 30 -2.078 -18.171 -7.529 1.00 0.00 C ATOM 397 NE2 HIS A 30 -0.810 -18.515 -7.392 1.00 0.00 N ATOM 0 H HIS A 30 -2.798 -18.561 -3.277 1.00 0.00 H new ATOM 0 HA HIS A 30 0.016 -17.661 -3.157 1.00 0.00 H new ATOM 0 HB2 HIS A 30 -2.422 -16.181 -4.201 1.00 0.00 H new ATOM 0 HB3 HIS A 30 -0.742 -15.719 -4.390 1.00 0.00 H new ATOM 0 HD2 HIS A 30 0.667 -18.112 -5.822 1.00 0.00 H new ATOM 0 HE1 HIS A 30 -2.717 -18.432 -8.360 1.00 0.00 H new ATOM 0 HE2 HIS A 30 -0.272 -19.072 -8.056 1.00 0.00 H new ATOM 405 N GLY A 31 -0.293 -15.917 -1.363 1.00 0.00 N ATOM 406 CA GLY A 31 -0.437 -15.130 -0.152 1.00 0.00 C ATOM 407 C GLY A 31 -0.504 -13.642 -0.432 1.00 0.00 C ATOM 408 O GLY A 31 -0.074 -13.182 -1.490 1.00 0.00 O ATOM 0 H GLY A 31 0.629 -15.870 -1.797 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -1.341 -15.439 0.373 1.00 0.00 H new ATOM 0 HA3 GLY A 31 0.403 -15.334 0.512 1.00 0.00 H new ATOM 412 N PHE A 32 -1.046 -12.886 0.517 1.00 0.00 N ATOM 413 CA PHE A 32 -1.170 -11.441 0.367 1.00 0.00 C ATOM 414 C PHE A 32 0.058 -10.728 0.926 1.00 0.00 C ATOM 415 O PHE A 32 0.166 -9.504 0.853 1.00 0.00 O ATOM 416 CB PHE A 32 -2.430 -10.939 1.074 1.00 0.00 C ATOM 417 CG PHE A 32 -3.388 -10.230 0.160 1.00 0.00 C ATOM 418 CD1 PHE A 32 -2.998 -9.091 -0.525 1.00 0.00 C ATOM 419 CD2 PHE A 32 -4.679 -10.702 -0.013 1.00 0.00 C ATOM 420 CE1 PHE A 32 -3.877 -8.436 -1.366 1.00 0.00 C ATOM 421 CE2 PHE A 32 -5.562 -10.052 -0.854 1.00 0.00 C ATOM 422 CZ PHE A 32 -5.161 -8.917 -1.530 1.00 0.00 C ATOM 0 H PHE A 32 -1.407 -13.251 1.399 1.00 0.00 H new ATOM 0 HA PHE A 32 -1.245 -11.217 -0.697 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -2.939 -11.785 1.536 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -2.141 -10.263 1.879 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -1.995 -8.710 -0.400 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -4.999 -11.588 0.515 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -3.560 -7.549 -1.894 1.00 0.00 H new ATOM 0 HE2 PHE A 32 -6.565 -10.432 -0.982 1.00 0.00 H new ATOM 0 HZ PHE A 32 -5.850 -8.406 -2.186 1.00 0.00 H new ATOM 432 N ASP A 33 0.982 -11.504 1.484 1.00 0.00 N ATOM 433 CA ASP A 33 2.203 -10.948 2.055 1.00 0.00 C ATOM 434 C ASP A 33 3.353 -11.022 1.056 1.00 0.00 C ATOM 435 O ASP A 33 4.351 -10.316 1.190 1.00 0.00 O ATOM 436 CB ASP A 33 2.576 -11.693 3.338 1.00 0.00 C ATOM 437 CG ASP A 33 1.370 -11.989 4.208 1.00 0.00 C ATOM 438 OD1 ASP A 33 0.493 -11.107 4.325 1.00 0.00 O ATOM 439 OD2 ASP A 33 1.303 -13.101 4.770 1.00 0.00 O ATOM 0 H ASP A 33 0.908 -12.519 1.553 1.00 0.00 H new ATOM 0 HA ASP A 33 2.020 -9.900 2.293 1.00 0.00 H new ATOM 0 HB2 ASP A 33 3.072 -12.628 3.080 1.00 0.00 H new ATOM 0 HB3 ASP A 33 3.292 -11.098 3.905 1.00 0.00 H new ATOM 444 N ASN A 34 3.206 -11.884 0.055 1.00 0.00 N ATOM 445 CA ASN A 34 4.233 -12.052 -0.966 1.00 0.00 C ATOM 446 C ASN A 34 4.300 -10.830 -1.877 1.00 0.00 C ATOM 447 O ASN A 34 5.321 -10.575 -2.518 1.00 0.00 O ATOM 448 CB ASN A 34 3.956 -13.306 -1.797 1.00 0.00 C ATOM 449 CG ASN A 34 4.266 -14.582 -1.038 1.00 0.00 C ATOM 450 OD1 ASN A 34 5.246 -14.655 -0.297 1.00 0.00 O ATOM 451 ND2 ASN A 34 3.428 -15.597 -1.221 1.00 0.00 N ATOM 0 H ASN A 34 2.386 -12.477 -0.071 1.00 0.00 H new ATOM 0 HA ASN A 34 5.194 -12.162 -0.464 1.00 0.00 H new ATOM 0 HB2 ASN A 34 2.910 -13.313 -2.102 1.00 0.00 H new ATOM 0 HB3 ASN A 34 4.553 -13.274 -2.708 1.00 0.00 H new ATOM 0 HD21 ASN A 34 3.585 -16.481 -0.737 1.00 0.00 H new ATOM 0 HD22 ASN A 34 2.628 -15.492 -1.845 1.00 0.00 H new ATOM 458 N CYS A 35 3.207 -10.077 -1.929 1.00 0.00 N ATOM 459 CA CYS A 35 3.140 -8.881 -2.762 1.00 0.00 C ATOM 460 C CYS A 35 3.942 -7.742 -2.141 1.00 0.00 C ATOM 461 O CYS A 35 4.298 -6.777 -2.820 1.00 0.00 O ATOM 462 CB CYS A 35 1.686 -8.451 -2.957 1.00 0.00 C ATOM 463 SG CYS A 35 0.946 -7.670 -1.504 1.00 0.00 S ATOM 0 H CYS A 35 2.355 -10.273 -1.404 1.00 0.00 H new ATOM 0 HA CYS A 35 3.573 -9.119 -3.733 1.00 0.00 H new ATOM 0 HB2 CYS A 35 1.633 -7.757 -3.796 1.00 0.00 H new ATOM 0 HB3 CYS A 35 1.093 -9.325 -3.228 1.00 0.00 H new ATOM 0 HG CYS A 35 0.678 -8.578 -0.613 1.00 0.00 H new ATOM 469 N LEU A 36 4.222 -7.858 -0.848 1.00 0.00 N ATOM 470 CA LEU A 36 4.980 -6.837 -0.134 1.00 0.00 C ATOM 471 C LEU A 36 6.393 -6.714 -0.698 1.00 0.00 C ATOM 472 O LEU A 36 7.017 -5.657 -0.609 1.00 0.00 O ATOM 473 CB LEU A 36 5.041 -7.168 1.358 1.00 0.00 C ATOM 474 CG LEU A 36 3.772 -6.881 2.161 1.00 0.00 C ATOM 475 CD1 LEU A 36 3.617 -7.888 3.291 1.00 0.00 C ATOM 476 CD2 LEU A 36 3.798 -5.462 2.710 1.00 0.00 C ATOM 0 H LEU A 36 3.935 -8.650 -0.272 1.00 0.00 H new ATOM 0 HA LEU A 36 4.471 -5.882 -0.267 1.00 0.00 H new ATOM 0 HB2 LEU A 36 5.284 -8.225 1.466 1.00 0.00 H new ATOM 0 HB3 LEU A 36 5.863 -6.605 1.801 1.00 0.00 H new ATOM 0 HG LEU A 36 2.914 -6.976 1.495 1.00 0.00 H new ATOM 0 HD11 LEU A 36 2.709 -7.668 3.852 1.00 0.00 H new ATOM 0 HD12 LEU A 36 3.553 -8.894 2.876 1.00 0.00 H new ATOM 0 HD13 LEU A 36 4.478 -7.824 3.956 1.00 0.00 H new ATOM 0 HD21 LEU A 36 2.887 -5.275 3.279 1.00 0.00 H new ATOM 0 HD22 LEU A 36 4.664 -5.339 3.361 1.00 0.00 H new ATOM 0 HD23 LEU A 36 3.862 -4.753 1.884 1.00 0.00 H new ATOM 594 N LEU A 43 0.377 -12.407 -5.659 1.00 0.00 N ATOM 595 CA LEU A 43 -0.936 -12.520 -5.034 1.00 0.00 C ATOM 596 C LEU A 43 -2.045 -12.443 -6.078 1.00 0.00 C ATOM 597 O LEU A 43 -2.127 -11.479 -6.839 1.00 0.00 O ATOM 598 CB LEU A 43 -1.123 -11.416 -3.992 1.00 0.00 C ATOM 599 CG LEU A 43 -2.461 -11.411 -3.252 1.00 0.00 C ATOM 600 CD1 LEU A 43 -3.524 -10.703 -4.077 1.00 0.00 C ATOM 601 CD2 LEU A 43 -2.895 -12.832 -2.925 1.00 0.00 C ATOM 0 HA LEU A 43 -0.994 -13.490 -4.541 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -0.324 -11.500 -3.256 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -1.001 -10.453 -4.487 1.00 0.00 H new ATOM 0 HG LEU A 43 -2.335 -10.867 -2.316 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -4.469 -10.709 -3.535 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -3.217 -9.673 -4.259 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -3.649 -11.218 -5.029 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -3.849 -12.809 -2.398 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -3.004 -13.401 -3.848 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -2.143 -13.306 -2.293 1.00 0.00 H new ATOM 613 N GLU A 44 -2.896 -13.463 -6.106 1.00 0.00 N ATOM 614 CA GLU A 44 -4.001 -13.509 -7.056 1.00 0.00 C ATOM 615 C GLU A 44 -5.340 -13.613 -6.330 1.00 0.00 C ATOM 616 O GLU A 44 -5.425 -14.182 -5.242 1.00 0.00 O ATOM 617 CB GLU A 44 -3.833 -14.694 -8.011 1.00 0.00 C ATOM 618 CG GLU A 44 -4.837 -14.703 -9.151 1.00 0.00 C ATOM 619 CD GLU A 44 -4.471 -15.690 -10.243 1.00 0.00 C ATOM 620 OE1 GLU A 44 -3.553 -15.385 -11.034 1.00 0.00 O ATOM 621 OE2 GLU A 44 -5.101 -16.766 -10.306 1.00 0.00 O ATOM 0 H GLU A 44 -2.842 -14.268 -5.482 1.00 0.00 H new ATOM 0 HA GLU A 44 -3.990 -12.583 -7.631 1.00 0.00 H new ATOM 0 HB2 GLU A 44 -2.825 -14.676 -8.426 1.00 0.00 H new ATOM 0 HB3 GLU A 44 -3.929 -15.621 -7.446 1.00 0.00 H new ATOM 0 HG2 GLU A 44 -5.824 -14.950 -8.759 1.00 0.00 H new ATOM 0 HG3 GLU A 44 -4.905 -13.703 -9.578 1.00 0.00 H new ATOM 628 N SER A 45 -6.382 -13.059 -6.941 1.00 0.00 N ATOM 629 CA SER A 45 -7.716 -13.085 -6.351 1.00 0.00 C ATOM 630 C SER A 45 -8.531 -14.250 -6.904 1.00 0.00 C ATOM 631 O SER A 45 -8.615 -14.444 -8.117 1.00 0.00 O ATOM 632 CB SER A 45 -8.442 -11.766 -6.622 1.00 0.00 C ATOM 633 OG SER A 45 -7.544 -10.779 -7.100 1.00 0.00 O ATOM 0 H SER A 45 -6.329 -12.587 -7.844 1.00 0.00 H new ATOM 0 HA SER A 45 -7.608 -13.218 -5.274 1.00 0.00 H new ATOM 0 HB2 SER A 45 -9.234 -11.927 -7.354 1.00 0.00 H new ATOM 0 HB3 SER A 45 -8.920 -11.415 -5.707 1.00 0.00 H new ATOM 0 HG SER A 45 -7.530 -10.796 -8.080 1.00 0.00 H new ATOM 639 N ASP A 46 -9.131 -15.023 -6.005 1.00 0.00 N ATOM 640 CA ASP A 46 -9.941 -16.169 -6.401 1.00 0.00 C ATOM 641 C ASP A 46 -11.416 -15.789 -6.483 1.00 0.00 C ATOM 642 O ASP A 46 -12.294 -16.650 -6.411 1.00 0.00 O ATOM 643 CB ASP A 46 -9.753 -17.320 -5.411 1.00 0.00 C ATOM 644 CG ASP A 46 -9.993 -18.675 -6.047 1.00 0.00 C ATOM 645 OD1 ASP A 46 -9.524 -18.889 -7.184 1.00 0.00 O ATOM 646 OD2 ASP A 46 -10.652 -19.523 -5.407 1.00 0.00 O ATOM 0 H ASP A 46 -9.072 -14.877 -4.997 1.00 0.00 H new ATOM 0 HA ASP A 46 -9.611 -16.492 -7.389 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -8.742 -17.286 -5.006 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -10.437 -17.189 -4.572 1.00 0.00 H new ATOM 651 N CYS A 47 -11.681 -14.496 -6.634 1.00 0.00 N ATOM 652 CA CYS A 47 -13.050 -14.002 -6.724 1.00 0.00 C ATOM 653 C CYS A 47 -13.136 -12.811 -7.673 1.00 0.00 C ATOM 654 O CYS A 47 -13.772 -12.887 -8.725 1.00 0.00 O ATOM 655 CB CYS A 47 -13.563 -13.604 -5.340 1.00 0.00 C ATOM 656 SG CYS A 47 -15.307 -13.126 -5.308 1.00 0.00 S ATOM 0 H CYS A 47 -10.966 -13.771 -6.697 1.00 0.00 H new ATOM 0 HA CYS A 47 -13.674 -14.804 -7.118 1.00 0.00 H new ATOM 0 HB2 CYS A 47 -13.414 -14.439 -4.655 1.00 0.00 H new ATOM 0 HB3 CYS A 47 -12.963 -12.774 -4.967 1.00 0.00 H new ATOM 0 HG CYS A 47 -15.648 -12.809 -4.094 1.00 0.00 H new ATOM 662 N ASP A 48 -12.494 -11.711 -7.294 1.00 0.00 N ATOM 663 CA ASP A 48 -12.498 -10.504 -8.111 1.00 0.00 C ATOM 664 C ASP A 48 -11.676 -9.400 -7.454 1.00 0.00 C ATOM 665 O ASP A 48 -10.965 -9.640 -6.478 1.00 0.00 O ATOM 666 CB ASP A 48 -13.932 -10.021 -8.339 1.00 0.00 C ATOM 667 CG ASP A 48 -14.319 -10.027 -9.805 1.00 0.00 C ATOM 668 OD1 ASP A 48 -14.784 -11.079 -10.292 1.00 0.00 O ATOM 669 OD2 ASP A 48 -14.157 -8.979 -10.465 1.00 0.00 O ATOM 0 H ASP A 48 -11.964 -11.631 -6.426 1.00 0.00 H new ATOM 0 HA ASP A 48 -12.046 -10.745 -9.073 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -14.620 -10.658 -7.782 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -14.040 -9.012 -7.942 1.00 0.00 H new ATOM 674 N GLU A 49 -11.777 -8.190 -7.996 1.00 0.00 N ATOM 675 CA GLU A 49 -11.040 -7.051 -7.462 1.00 0.00 C ATOM 676 C GLU A 49 -11.731 -6.488 -6.223 1.00 0.00 C ATOM 677 O GLU A 49 -12.068 -5.306 -6.171 1.00 0.00 O ATOM 678 CB GLU A 49 -10.907 -5.958 -8.525 1.00 0.00 C ATOM 679 CG GLU A 49 -12.217 -5.617 -9.214 1.00 0.00 C ATOM 680 CD GLU A 49 -12.413 -6.384 -10.508 1.00 0.00 C ATOM 681 OE1 GLU A 49 -11.696 -7.385 -10.717 1.00 0.00 O ATOM 682 OE2 GLU A 49 -13.282 -5.984 -11.310 1.00 0.00 O ATOM 0 H GLU A 49 -12.361 -7.974 -8.804 1.00 0.00 H new ATOM 0 HA GLU A 49 -10.046 -7.395 -7.178 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -10.506 -5.058 -8.060 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -10.184 -6.279 -9.275 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -13.045 -5.833 -8.539 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -12.246 -4.547 -9.422 1.00 0.00 H new ATOM 689 N GLN A 50 -11.939 -7.345 -5.228 1.00 0.00 N ATOM 690 CA GLN A 50 -12.590 -6.935 -3.990 1.00 0.00 C ATOM 691 C GLN A 50 -11.814 -7.433 -2.775 1.00 0.00 C ATOM 692 O GLN A 50 -12.403 -7.834 -1.771 1.00 0.00 O ATOM 693 CB GLN A 50 -14.025 -7.462 -3.945 1.00 0.00 C ATOM 694 CG GLN A 50 -14.955 -6.781 -4.936 1.00 0.00 C ATOM 695 CD GLN A 50 -15.916 -5.818 -4.267 1.00 0.00 C ATOM 696 OE1 GLN A 50 -16.851 -6.232 -3.580 1.00 0.00 O ATOM 697 NE2 GLN A 50 -15.692 -4.524 -4.465 1.00 0.00 N ATOM 0 H GLN A 50 -11.666 -8.327 -5.256 1.00 0.00 H new ATOM 0 HA GLN A 50 -12.610 -5.846 -3.963 1.00 0.00 H new ATOM 0 HB2 GLN A 50 -14.016 -8.533 -4.145 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -14.421 -7.329 -2.938 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -14.361 -6.242 -5.674 1.00 0.00 H new ATOM 0 HG3 GLN A 50 -15.523 -7.539 -5.476 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -14.905 -4.225 -5.041 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -16.306 -3.829 -4.041 1.00 0.00 H new ATOM 706 N LEU A 51 -10.490 -7.405 -2.874 1.00 0.00 N ATOM 707 CA LEU A 51 -9.632 -7.855 -1.782 1.00 0.00 C ATOM 708 C LEU A 51 -9.147 -6.673 -0.949 1.00 0.00 C ATOM 709 O LEU A 51 -8.971 -5.567 -1.464 1.00 0.00 O ATOM 710 CB LEU A 51 -8.435 -8.630 -2.335 1.00 0.00 C ATOM 711 CG LEU A 51 -8.733 -9.599 -3.480 1.00 0.00 C ATOM 712 CD1 LEU A 51 -7.996 -9.176 -4.742 1.00 0.00 C ATOM 713 CD2 LEU A 51 -8.353 -11.020 -3.089 1.00 0.00 C ATOM 0 H LEU A 51 -9.987 -7.076 -3.698 1.00 0.00 H new ATOM 0 HA LEU A 51 -10.217 -8.513 -1.139 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -7.690 -7.912 -2.678 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -7.983 -9.193 -1.518 1.00 0.00 H new ATOM 0 HG LEU A 51 -9.804 -9.574 -3.683 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -8.220 -9.877 -5.546 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -8.317 -8.176 -5.033 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -6.923 -9.172 -4.552 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -8.572 -11.696 -3.916 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -7.288 -11.062 -2.859 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -8.926 -11.322 -2.212 1.00 0.00 H new ATOM 725 N LEU A 52 -8.929 -6.913 0.339 1.00 0.00 N ATOM 726 CA LEU A 52 -8.461 -5.869 1.244 1.00 0.00 C ATOM 727 C LEU A 52 -7.068 -6.193 1.774 1.00 0.00 C ATOM 728 O LEU A 52 -6.682 -7.359 1.863 1.00 0.00 O ATOM 729 CB LEU A 52 -9.437 -5.702 2.409 1.00 0.00 C ATOM 730 CG LEU A 52 -10.378 -4.500 2.329 1.00 0.00 C ATOM 731 CD1 LEU A 52 -11.824 -4.942 2.489 1.00 0.00 C ATOM 732 CD2 LEU A 52 -10.015 -3.466 3.385 1.00 0.00 C ATOM 0 H LEU A 52 -9.069 -7.822 0.781 1.00 0.00 H new ATOM 0 HA LEU A 52 -8.409 -4.934 0.686 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -10.041 -6.606 2.483 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -8.861 -5.626 3.331 1.00 0.00 H new ATOM 0 HG LEU A 52 -10.266 -4.041 1.347 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -12.479 -4.073 2.429 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -12.080 -5.644 1.696 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -11.951 -5.426 3.457 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -10.696 -2.618 3.313 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -10.097 -3.913 4.376 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -8.992 -3.125 3.224 1.00 0.00 H new ATOM 744 N ILE A 53 -6.319 -5.154 2.128 1.00 0.00 N ATOM 745 CA ILE A 53 -4.970 -5.329 2.653 1.00 0.00 C ATOM 746 C ILE A 53 -4.752 -4.480 3.901 1.00 0.00 C ATOM 747 O ILE A 53 -4.746 -3.250 3.837 1.00 0.00 O ATOM 748 CB ILE A 53 -3.905 -4.961 1.603 1.00 0.00 C ATOM 749 CG1 ILE A 53 -4.116 -5.774 0.324 1.00 0.00 C ATOM 750 CG2 ILE A 53 -2.509 -5.194 2.161 1.00 0.00 C ATOM 751 CD1 ILE A 53 -4.725 -4.974 -0.806 1.00 0.00 C ATOM 0 H ILE A 53 -6.623 -4.183 2.061 1.00 0.00 H new ATOM 0 HA ILE A 53 -4.866 -6.383 2.910 1.00 0.00 H new ATOM 0 HB ILE A 53 -4.006 -3.903 1.359 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -3.158 -6.178 -0.003 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -4.761 -6.624 0.546 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -1.767 -4.930 1.407 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -2.363 -4.575 3.047 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -2.395 -6.244 2.429 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -4.846 -5.613 -1.680 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -5.698 -4.592 -0.498 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -4.070 -4.139 -1.055 1.00 0.00 H new ATOM 763 N THR A 54 -4.572 -5.145 5.038 1.00 0.00 N ATOM 764 CA THR A 54 -4.352 -4.453 6.302 1.00 0.00 C ATOM 765 C THR A 54 -2.867 -4.367 6.631 1.00 0.00 C ATOM 766 O THR A 54 -2.099 -5.279 6.322 1.00 0.00 O ATOM 767 CB THR A 54 -5.084 -5.154 7.461 1.00 0.00 C ATOM 768 OG1 THR A 54 -6.489 -5.213 7.190 1.00 0.00 O ATOM 769 CG2 THR A 54 -4.846 -4.422 8.774 1.00 0.00 C ATOM 0 H THR A 54 -4.574 -6.163 5.109 1.00 0.00 H new ATOM 0 HA THR A 54 -4.753 -3.446 6.185 1.00 0.00 H new ATOM 0 HB THR A 54 -4.689 -6.166 7.551 1.00 0.00 H new ATOM 0 HG1 THR A 54 -6.947 -5.662 7.931 1.00 0.00 H new ATOM 0 HG21 THR A 54 -5.373 -4.936 9.578 1.00 0.00 H new ATOM 0 HG22 THR A 54 -3.778 -4.405 8.993 1.00 0.00 H new ATOM 0 HG23 THR A 54 -5.216 -3.400 8.693 1.00 0.00 H new ATOM 777 N VAL A 55 -2.467 -3.267 7.261 1.00 0.00 N ATOM 778 CA VAL A 55 -1.072 -3.064 7.635 1.00 0.00 C ATOM 779 C VAL A 55 -0.958 -2.495 9.044 1.00 0.00 C ATOM 780 O VAL A 55 -1.504 -1.433 9.342 1.00 0.00 O ATOM 781 CB VAL A 55 -0.360 -2.116 6.651 1.00 0.00 C ATOM 782 CG1 VAL A 55 1.149 -2.260 6.769 1.00 0.00 C ATOM 783 CG2 VAL A 55 -0.820 -2.385 5.226 1.00 0.00 C ATOM 0 H VAL A 55 -3.089 -2.503 7.523 1.00 0.00 H new ATOM 0 HA VAL A 55 -0.590 -4.041 7.601 1.00 0.00 H new ATOM 0 HB VAL A 55 -0.624 -1.090 6.906 1.00 0.00 H new ATOM 0 HG11 VAL A 55 1.635 -1.583 6.067 1.00 0.00 H new ATOM 0 HG12 VAL A 55 1.460 -2.014 7.784 1.00 0.00 H new ATOM 0 HG13 VAL A 55 1.435 -3.287 6.541 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -0.307 -1.707 4.544 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -0.587 -3.415 4.957 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -1.896 -2.226 5.155 1.00 0.00 H new ATOM 793 N ALA A 56 -0.244 -3.208 9.909 1.00 0.00 N ATOM 794 CA ALA A 56 -0.055 -2.773 11.287 1.00 0.00 C ATOM 795 C ALA A 56 1.360 -2.252 11.509 1.00 0.00 C ATOM 796 O ALA A 56 2.328 -3.010 11.450 1.00 0.00 O ATOM 797 CB ALA A 56 -0.357 -3.915 12.247 1.00 0.00 C ATOM 0 H ALA A 56 0.213 -4.090 9.679 1.00 0.00 H new ATOM 0 HA ALA A 56 -0.749 -1.956 11.483 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -0.212 -3.576 13.273 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -1.389 -4.238 12.114 1.00 0.00 H new ATOM 0 HB3 ALA A 56 0.314 -4.749 12.042 1.00 0.00 H new ATOM 803 N PHE A 57 1.474 -0.953 11.765 1.00 0.00 N ATOM 804 CA PHE A 57 2.773 -0.330 11.995 1.00 0.00 C ATOM 805 C PHE A 57 3.066 -0.220 13.488 1.00 0.00 C ATOM 806 O PHE A 57 2.324 0.419 14.232 1.00 0.00 O ATOM 807 CB PHE A 57 2.817 1.058 11.351 1.00 0.00 C ATOM 808 CG PHE A 57 3.060 1.023 9.870 1.00 0.00 C ATOM 809 CD1 PHE A 57 4.327 0.775 9.367 1.00 0.00 C ATOM 810 CD2 PHE A 57 2.021 1.240 8.979 1.00 0.00 C ATOM 811 CE1 PHE A 57 4.554 0.743 8.004 1.00 0.00 C ATOM 812 CE2 PHE A 57 2.241 1.208 7.615 1.00 0.00 C ATOM 813 CZ PHE A 57 3.509 0.961 7.127 1.00 0.00 C ATOM 0 H PHE A 57 0.683 -0.311 11.818 1.00 0.00 H new ATOM 0 HA PHE A 57 3.537 -0.959 11.538 1.00 0.00 H new ATOM 0 HB2 PHE A 57 1.874 1.570 11.545 1.00 0.00 H new ATOM 0 HB3 PHE A 57 3.602 1.646 11.826 1.00 0.00 H new ATOM 0 HD1 PHE A 57 5.147 0.605 10.048 1.00 0.00 H new ATOM 0 HD2 PHE A 57 1.028 1.436 9.355 1.00 0.00 H new ATOM 0 HE1 PHE A 57 5.546 0.548 7.625 1.00 0.00 H new ATOM 0 HE2 PHE A 57 1.422 1.376 6.931 1.00 0.00 H new ATOM 0 HZ PHE A 57 3.683 0.938 6.061 1.00 0.00 H new ATOM 823 N ASN A 58 4.155 -0.849 13.919 1.00 0.00 N ATOM 824 CA ASN A 58 4.547 -0.824 15.323 1.00 0.00 C ATOM 825 C ASN A 58 4.818 0.605 15.786 1.00 0.00 C ATOM 826 O ASN A 58 4.750 0.904 16.978 1.00 0.00 O ATOM 827 CB ASN A 58 5.791 -1.687 15.543 1.00 0.00 C ATOM 828 CG ASN A 58 5.518 -3.162 15.318 1.00 0.00 C ATOM 829 OD1 ASN A 58 4.631 -3.743 15.944 1.00 0.00 O ATOM 830 ND2 ASN A 58 6.282 -3.776 14.422 1.00 0.00 N ATOM 0 H ASN A 58 4.781 -1.382 13.316 1.00 0.00 H new ATOM 0 HA ASN A 58 3.724 -1.229 15.911 1.00 0.00 H new ATOM 0 HB2 ASN A 58 6.581 -1.359 14.868 1.00 0.00 H new ATOM 0 HB3 ASN A 58 6.158 -1.539 16.559 1.00 0.00 H new ATOM 0 HD21 ASN A 58 6.145 -4.768 14.229 1.00 0.00 H new ATOM 0 HD22 ASN A 58 7.006 -3.255 13.926 1.00 0.00 H new ATOM 837 N GLN A 59 5.125 1.481 14.836 1.00 0.00 N ATOM 838 CA GLN A 59 5.407 2.878 15.146 1.00 0.00 C ATOM 839 C GLN A 59 4.651 3.808 14.203 1.00 0.00 C ATOM 840 O GLN A 59 4.487 3.529 13.015 1.00 0.00 O ATOM 841 CB GLN A 59 6.909 3.150 15.055 1.00 0.00 C ATOM 842 CG GLN A 59 7.463 3.037 13.644 1.00 0.00 C ATOM 843 CD GLN A 59 8.151 4.308 13.184 1.00 0.00 C ATOM 844 OE1 GLN A 59 9.298 4.279 12.738 1.00 0.00 O ATOM 845 NE2 GLN A 59 7.452 5.431 13.290 1.00 0.00 N ATOM 0 H GLN A 59 5.185 1.249 13.845 1.00 0.00 H new ATOM 0 HA GLN A 59 5.072 3.073 16.165 1.00 0.00 H new ATOM 0 HB2 GLN A 59 7.113 4.150 15.437 1.00 0.00 H new ATOM 0 HB3 GLN A 59 7.437 2.448 15.701 1.00 0.00 H new ATOM 0 HG2 GLN A 59 8.171 2.209 13.601 1.00 0.00 H new ATOM 0 HG3 GLN A 59 6.651 2.799 12.957 1.00 0.00 H new ATOM 0 HE21 GLN A 59 6.504 5.408 13.666 1.00 0.00 H new ATOM 0 HE22 GLN A 59 7.863 6.317 12.996 1.00 0.00 H new ATOM 854 N PRO A 60 4.178 4.941 14.743 1.00 0.00 N ATOM 855 CA PRO A 60 3.432 5.936 13.967 1.00 0.00 C ATOM 856 C PRO A 60 4.314 6.667 12.961 1.00 0.00 C ATOM 857 O PRO A 60 5.178 7.459 13.338 1.00 0.00 O ATOM 858 CB PRO A 60 2.919 6.907 15.034 1.00 0.00 C ATOM 859 CG PRO A 60 3.883 6.773 16.161 1.00 0.00 C ATOM 860 CD PRO A 60 4.336 5.339 16.152 1.00 0.00 C ATOM 0 HA PRO A 60 2.641 5.479 13.372 1.00 0.00 H new ATOM 0 HB2 PRO A 60 2.889 7.930 14.658 1.00 0.00 H new ATOM 0 HB3 PRO A 60 1.906 6.653 15.347 1.00 0.00 H new ATOM 0 HG2 PRO A 60 4.728 7.450 16.034 1.00 0.00 H new ATOM 0 HG3 PRO A 60 3.411 7.027 17.110 1.00 0.00 H new ATOM 0 HD2 PRO A 60 5.370 5.242 16.484 1.00 0.00 H new ATOM 0 HD3 PRO A 60 3.729 4.722 16.815 1.00 0.00 H new ATOM 868 N VAL A 61 4.091 6.397 11.678 1.00 0.00 N ATOM 869 CA VAL A 61 4.864 7.031 10.618 1.00 0.00 C ATOM 870 C VAL A 61 3.994 7.966 9.786 1.00 0.00 C ATOM 871 O VAL A 61 2.840 8.227 10.128 1.00 0.00 O ATOM 872 CB VAL A 61 5.507 5.984 9.689 1.00 0.00 C ATOM 873 CG1 VAL A 61 6.335 4.993 10.493 1.00 0.00 C ATOM 874 CG2 VAL A 61 4.438 5.264 8.879 1.00 0.00 C ATOM 0 H VAL A 61 3.381 5.743 11.349 1.00 0.00 H new ATOM 0 HA VAL A 61 5.651 7.608 11.103 1.00 0.00 H new ATOM 0 HB VAL A 61 6.172 6.498 8.996 1.00 0.00 H new ATOM 0 HG11 VAL A 61 6.781 4.261 9.820 1.00 0.00 H new ATOM 0 HG12 VAL A 61 7.124 5.525 11.025 1.00 0.00 H new ATOM 0 HG13 VAL A 61 5.694 4.482 11.211 1.00 0.00 H new ATOM 0 HG21 VAL A 61 4.909 4.528 8.228 1.00 0.00 H new ATOM 0 HG22 VAL A 61 3.747 4.761 9.555 1.00 0.00 H new ATOM 0 HG23 VAL A 61 3.892 5.987 8.273 1.00 0.00 H new ATOM 884 N LYS A 62 4.554 8.469 8.691 1.00 0.00 N ATOM 885 CA LYS A 62 3.829 9.374 7.807 1.00 0.00 C ATOM 886 C LYS A 62 3.762 8.814 6.390 1.00 0.00 C ATOM 887 O LYS A 62 4.792 8.567 5.760 1.00 0.00 O ATOM 888 CB LYS A 62 4.499 10.750 7.792 1.00 0.00 C ATOM 889 CG LYS A 62 4.522 11.430 9.150 1.00 0.00 C ATOM 890 CD LYS A 62 4.193 12.910 9.037 1.00 0.00 C ATOM 891 CE LYS A 62 5.453 13.762 9.039 1.00 0.00 C ATOM 892 NZ LYS A 62 5.801 14.237 10.407 1.00 0.00 N ATOM 0 H LYS A 62 5.508 8.265 8.394 1.00 0.00 H new ATOM 0 HA LYS A 62 2.812 9.475 8.187 1.00 0.00 H new ATOM 0 HB2 LYS A 62 5.522 10.643 7.431 1.00 0.00 H new ATOM 0 HB3 LYS A 62 3.976 11.392 7.083 1.00 0.00 H new ATOM 0 HG2 LYS A 62 3.804 10.946 9.813 1.00 0.00 H new ATOM 0 HG3 LYS A 62 5.506 11.308 9.603 1.00 0.00 H new ATOM 0 HD2 LYS A 62 3.632 13.090 8.120 1.00 0.00 H new ATOM 0 HD3 LYS A 62 3.551 13.206 9.867 1.00 0.00 H new ATOM 0 HE2 LYS A 62 6.283 13.183 8.634 1.00 0.00 H new ATOM 0 HE3 LYS A 62 5.312 14.620 8.382 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 6.665 14.814 10.365 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 5.020 14.811 10.784 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 5.961 13.419 11.028 1.00 0.00 H new ATOM 906 N LEU A 63 2.546 8.617 5.893 1.00 0.00 N ATOM 907 CA LEU A 63 2.346 8.088 4.549 1.00 0.00 C ATOM 908 C LEU A 63 2.378 9.206 3.512 1.00 0.00 C ATOM 909 O LEU A 63 1.345 9.790 3.181 1.00 0.00 O ATOM 910 CB LEU A 63 1.014 7.340 4.467 1.00 0.00 C ATOM 911 CG LEU A 63 0.807 6.224 5.492 1.00 0.00 C ATOM 912 CD1 LEU A 63 -0.477 5.462 5.200 1.00 0.00 C ATOM 913 CD2 LEU A 63 2.000 5.279 5.498 1.00 0.00 C ATOM 0 H LEU A 63 1.684 8.816 6.401 1.00 0.00 H new ATOM 0 HA LEU A 63 3.160 7.395 4.334 1.00 0.00 H new ATOM 0 HB2 LEU A 63 0.206 8.063 4.579 1.00 0.00 H new ATOM 0 HB3 LEU A 63 0.922 6.911 3.469 1.00 0.00 H new ATOM 0 HG LEU A 63 0.720 6.675 6.480 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -0.607 4.672 5.940 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -1.324 6.146 5.246 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -0.420 5.021 4.205 1.00 0.00 H new ATOM 0 HD21 LEU A 63 1.836 4.491 6.233 1.00 0.00 H new ATOM 0 HD22 LEU A 63 2.117 4.835 4.510 1.00 0.00 H new ATOM 0 HD23 LEU A 63 2.902 5.834 5.756 1.00 0.00 H new ATOM 925 N TYR A 64 3.569 9.499 3.002 1.00 0.00 N ATOM 926 CA TYR A 64 3.736 10.548 2.003 1.00 0.00 C ATOM 927 C TYR A 64 3.364 10.040 0.613 1.00 0.00 C ATOM 928 O TYR A 64 2.903 10.803 -0.236 1.00 0.00 O ATOM 929 CB TYR A 64 5.178 11.057 2.004 1.00 0.00 C ATOM 930 CG TYR A 64 5.500 11.963 3.171 1.00 0.00 C ATOM 931 CD1 TYR A 64 5.311 13.336 3.083 1.00 0.00 C ATOM 932 CD2 TYR A 64 5.991 11.444 4.363 1.00 0.00 C ATOM 933 CE1 TYR A 64 5.605 14.167 4.146 1.00 0.00 C ATOM 934 CE2 TYR A 64 6.286 12.267 5.432 1.00 0.00 C ATOM 935 CZ TYR A 64 6.091 13.628 5.319 1.00 0.00 C ATOM 936 OH TYR A 64 6.383 14.453 6.381 1.00 0.00 O ATOM 0 H TYR A 64 4.433 9.025 3.264 1.00 0.00 H new ATOM 0 HA TYR A 64 3.068 11.370 2.260 1.00 0.00 H new ATOM 0 HB2 TYR A 64 5.856 10.203 2.020 1.00 0.00 H new ATOM 0 HB3 TYR A 64 5.365 11.595 1.075 1.00 0.00 H new ATOM 0 HD1 TYR A 64 4.927 13.761 2.167 1.00 0.00 H new ATOM 0 HD2 TYR A 64 6.144 10.379 4.455 1.00 0.00 H new ATOM 0 HE1 TYR A 64 5.455 15.233 4.059 1.00 0.00 H new ATOM 0 HE2 TYR A 64 6.667 11.848 6.351 1.00 0.00 H new ATOM 0 HH TYR A 64 5.794 15.236 6.359 1.00 0.00 H new ATOM 946 N SER A 65 3.570 8.746 0.388 1.00 0.00 N ATOM 947 CA SER A 65 3.260 8.135 -0.899 1.00 0.00 C ATOM 948 C SER A 65 3.058 6.630 -0.752 1.00 0.00 C ATOM 949 O SER A 65 3.326 6.058 0.304 1.00 0.00 O ATOM 950 CB SER A 65 4.381 8.415 -1.903 1.00 0.00 C ATOM 951 OG SER A 65 5.489 9.033 -1.271 1.00 0.00 O ATOM 0 H SER A 65 3.950 8.101 1.080 1.00 0.00 H new ATOM 0 HA SER A 65 2.333 8.574 -1.268 1.00 0.00 H new ATOM 0 HB2 SER A 65 4.698 7.482 -2.369 1.00 0.00 H new ATOM 0 HB3 SER A 65 4.008 9.058 -2.700 1.00 0.00 H new ATOM 0 HG SER A 65 6.192 9.200 -1.933 1.00 0.00 H new ATOM 957 N MET A 66 2.583 5.996 -1.819 1.00 0.00 N ATOM 958 CA MET A 66 2.345 4.557 -1.809 1.00 0.00 C ATOM 959 C MET A 66 2.696 3.939 -3.159 1.00 0.00 C ATOM 960 O MET A 66 2.359 4.485 -4.210 1.00 0.00 O ATOM 961 CB MET A 66 0.884 4.263 -1.465 1.00 0.00 C ATOM 962 CG MET A 66 0.416 2.891 -1.924 1.00 0.00 C ATOM 963 SD MET A 66 -1.272 2.524 -1.407 1.00 0.00 S ATOM 964 CE MET A 66 -2.188 3.028 -2.861 1.00 0.00 C ATOM 0 H MET A 66 2.355 6.455 -2.701 1.00 0.00 H new ATOM 0 HA MET A 66 2.986 4.113 -1.048 1.00 0.00 H new ATOM 0 HB2 MET A 66 0.750 4.341 -0.386 1.00 0.00 H new ATOM 0 HB3 MET A 66 0.252 5.025 -1.921 1.00 0.00 H new ATOM 0 HG2 MET A 66 0.479 2.835 -3.011 1.00 0.00 H new ATOM 0 HG3 MET A 66 1.087 2.130 -1.526 1.00 0.00 H new ATOM 0 HE1 MET A 66 -3.185 3.356 -2.567 1.00 0.00 H new ATOM 0 HE2 MET A 66 -1.667 3.849 -3.353 1.00 0.00 H new ATOM 0 HE3 MET A 66 -2.270 2.187 -3.549 1.00 0.00 H new ATOM 974 N LYS A 67 3.376 2.798 -3.123 1.00 0.00 N ATOM 975 CA LYS A 67 3.773 2.105 -4.343 1.00 0.00 C ATOM 976 C LYS A 67 2.910 0.868 -4.571 1.00 0.00 C ATOM 977 O LYS A 67 3.194 -0.206 -4.038 1.00 0.00 O ATOM 978 CB LYS A 67 5.248 1.705 -4.270 1.00 0.00 C ATOM 979 CG LYS A 67 6.203 2.884 -4.348 1.00 0.00 C ATOM 980 CD LYS A 67 7.590 2.450 -4.792 1.00 0.00 C ATOM 981 CE LYS A 67 8.343 3.589 -5.462 1.00 0.00 C ATOM 982 NZ LYS A 67 9.379 3.089 -6.407 1.00 0.00 N ATOM 0 H LYS A 67 3.664 2.333 -2.262 1.00 0.00 H new ATOM 0 HA LYS A 67 3.629 2.786 -5.182 1.00 0.00 H new ATOM 0 HB2 LYS A 67 5.424 1.167 -3.339 1.00 0.00 H new ATOM 0 HB3 LYS A 67 5.469 1.015 -5.084 1.00 0.00 H new ATOM 0 HG2 LYS A 67 5.812 3.625 -5.046 1.00 0.00 H new ATOM 0 HG3 LYS A 67 6.267 3.367 -3.373 1.00 0.00 H new ATOM 0 HD2 LYS A 67 8.155 2.097 -3.930 1.00 0.00 H new ATOM 0 HD3 LYS A 67 7.506 1.612 -5.483 1.00 0.00 H new ATOM 0 HE2 LYS A 67 7.638 4.224 -5.999 1.00 0.00 H new ATOM 0 HE3 LYS A 67 8.815 4.210 -4.700 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 9.870 3.896 -6.843 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 10.066 2.504 -5.891 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 8.926 2.518 -7.149 1.00 0.00 H new ATOM 996 N PHE A 68 1.857 1.024 -5.365 1.00 0.00 N ATOM 997 CA PHE A 68 0.953 -0.081 -5.663 1.00 0.00 C ATOM 998 C PHE A 68 1.021 -0.455 -7.141 1.00 0.00 C ATOM 999 O PHE A 68 0.774 0.376 -8.014 1.00 0.00 O ATOM 1000 CB PHE A 68 -0.482 0.290 -5.286 1.00 0.00 C ATOM 1001 CG PHE A 68 -1.229 -0.820 -4.604 1.00 0.00 C ATOM 1002 CD1 PHE A 68 -0.668 -1.493 -3.531 1.00 0.00 C ATOM 1003 CD2 PHE A 68 -2.492 -1.191 -5.037 1.00 0.00 C ATOM 1004 CE1 PHE A 68 -1.353 -2.516 -2.901 1.00 0.00 C ATOM 1005 CE2 PHE A 68 -3.181 -2.213 -4.411 1.00 0.00 C ATOM 1006 CZ PHE A 68 -2.611 -2.876 -3.342 1.00 0.00 C ATOM 0 H PHE A 68 1.608 1.905 -5.814 1.00 0.00 H new ATOM 0 HA PHE A 68 1.265 -0.942 -5.073 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -0.463 1.161 -4.631 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -1.022 0.581 -6.187 1.00 0.00 H new ATOM 0 HD1 PHE A 68 0.316 -1.216 -3.182 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -2.943 -0.676 -5.872 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -0.905 -3.033 -2.065 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -4.165 -2.493 -4.758 1.00 0.00 H new ATOM 0 HZ PHE A 68 -3.148 -3.675 -2.852 1.00 0.00 H new ATOM 1016 N GLN A 69 1.360 -1.712 -7.412 1.00 0.00 N ATOM 1017 CA GLN A 69 1.462 -2.197 -8.783 1.00 0.00 C ATOM 1018 C GLN A 69 1.103 -3.677 -8.865 1.00 0.00 C ATOM 1019 O GLN A 69 0.589 -4.255 -7.909 1.00 0.00 O ATOM 1020 CB GLN A 69 2.876 -1.972 -9.322 1.00 0.00 C ATOM 1021 CG GLN A 69 3.753 -1.139 -8.400 1.00 0.00 C ATOM 1022 CD GLN A 69 5.171 -0.997 -8.915 1.00 0.00 C ATOM 1023 OE1 GLN A 69 5.569 -1.670 -9.867 1.00 0.00 O ATOM 1024 NE2 GLN A 69 5.944 -0.118 -8.288 1.00 0.00 N ATOM 0 H GLN A 69 1.568 -2.412 -6.700 1.00 0.00 H new ATOM 0 HA GLN A 69 0.755 -1.636 -9.394 1.00 0.00 H new ATOM 0 HB2 GLN A 69 3.351 -2.939 -9.486 1.00 0.00 H new ATOM 0 HB3 GLN A 69 2.812 -1.479 -10.292 1.00 0.00 H new ATOM 0 HG2 GLN A 69 3.312 -0.149 -8.282 1.00 0.00 H new ATOM 0 HG3 GLN A 69 3.774 -1.598 -7.412 1.00 0.00 H new ATOM 0 HE21 GLN A 69 5.574 0.419 -7.504 1.00 0.00 H new ATOM 0 HE22 GLN A 69 6.908 0.021 -8.591 1.00 0.00 H new ATOM 1033 N GLY A 70 1.378 -4.284 -10.016 1.00 0.00 N ATOM 1034 CA GLY A 70 1.077 -5.691 -10.202 1.00 0.00 C ATOM 1035 C GLY A 70 1.988 -6.350 -11.218 1.00 0.00 C ATOM 1036 O GLY A 70 3.081 -5.864 -11.511 1.00 0.00 O ATOM 0 H GLY A 70 1.804 -3.826 -10.822 1.00 0.00 H new ATOM 0 HA2 GLY A 70 1.169 -6.208 -9.247 1.00 0.00 H new ATOM 0 HA3 GLY A 70 0.041 -5.798 -10.524 1.00 0.00 H new ATOM 1040 N PRO A 71 1.539 -7.485 -11.774 1.00 0.00 N ATOM 1041 CA PRO A 71 2.308 -8.236 -12.771 1.00 0.00 C ATOM 1042 C PRO A 71 2.399 -7.504 -14.105 1.00 0.00 C ATOM 1043 O PRO A 71 2.033 -6.333 -14.207 1.00 0.00 O ATOM 1044 CB PRO A 71 1.513 -9.535 -12.927 1.00 0.00 C ATOM 1045 CG PRO A 71 0.120 -9.175 -12.539 1.00 0.00 C ATOM 1046 CD PRO A 71 0.247 -8.122 -11.473 1.00 0.00 C ATOM 0 HA PRO A 71 3.341 -8.387 -12.459 1.00 0.00 H new ATOM 0 HB2 PRO A 71 1.556 -9.905 -13.951 1.00 0.00 H new ATOM 0 HB3 PRO A 71 1.911 -10.322 -12.287 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -0.439 -8.798 -13.396 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -0.419 -10.046 -12.165 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -0.574 -7.406 -11.516 1.00 0.00 H new ATOM 0 HD3 PRO A 71 0.237 -8.558 -10.474 1.00 0.00 H new ATOM 1054 N ASP A 72 2.888 -8.200 -15.125 1.00 0.00 N ATOM 1055 CA ASP A 72 3.026 -7.616 -16.454 1.00 0.00 C ATOM 1056 C ASP A 72 2.151 -8.351 -17.464 1.00 0.00 C ATOM 1057 O ASP A 72 2.528 -8.514 -18.624 1.00 0.00 O ATOM 1058 CB ASP A 72 4.488 -7.655 -16.903 1.00 0.00 C ATOM 1059 CG ASP A 72 5.343 -6.635 -16.177 1.00 0.00 C ATOM 1060 OD1 ASP A 72 5.238 -6.549 -14.936 1.00 0.00 O ATOM 1061 OD2 ASP A 72 6.118 -5.923 -16.850 1.00 0.00 O ATOM 0 H ASP A 72 3.196 -9.170 -15.057 1.00 0.00 H new ATOM 0 HA ASP A 72 2.698 -6.578 -16.403 1.00 0.00 H new ATOM 0 HB2 ASP A 72 4.892 -8.653 -16.730 1.00 0.00 H new ATOM 0 HB3 ASP A 72 4.541 -7.471 -17.976 1.00 0.00 H new ATOM 1066 N ASN A 73 0.982 -8.795 -17.015 1.00 0.00 N ATOM 1067 CA ASN A 73 0.054 -9.515 -17.879 1.00 0.00 C ATOM 1068 C ASN A 73 -1.107 -8.617 -18.299 1.00 0.00 C ATOM 1069 O ASN A 73 -1.717 -8.823 -19.347 1.00 0.00 O ATOM 1070 CB ASN A 73 -0.481 -10.758 -17.166 1.00 0.00 C ATOM 1071 CG ASN A 73 -1.876 -10.550 -16.609 1.00 0.00 C ATOM 1072 OD1 ASN A 73 -2.859 -10.550 -17.350 1.00 0.00 O ATOM 1073 ND2 ASN A 73 -1.968 -10.372 -15.296 1.00 0.00 N ATOM 0 H ASN A 73 0.655 -8.669 -16.057 1.00 0.00 H new ATOM 0 HA ASN A 73 0.595 -9.823 -18.774 1.00 0.00 H new ATOM 0 HB2 ASN A 73 -0.492 -11.596 -17.863 1.00 0.00 H new ATOM 0 HB3 ASN A 73 0.195 -11.027 -16.354 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -2.880 -10.228 -14.864 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -1.126 -10.380 -14.720 1.00 0.00 H new ATOM 1080 N GLY A 74 -1.406 -7.620 -17.472 1.00 0.00 N ATOM 1081 CA GLY A 74 -2.491 -6.705 -17.774 1.00 0.00 C ATOM 1082 C GLY A 74 -3.529 -6.652 -16.670 1.00 0.00 C ATOM 1083 O GLY A 74 -4.704 -6.394 -16.927 1.00 0.00 O ATOM 0 H GLY A 74 -0.916 -7.430 -16.598 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -2.086 -5.706 -17.936 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -2.970 -7.009 -18.705 1.00 0.00 H new ATOM 1087 N GLN A 75 -3.094 -6.899 -15.439 1.00 0.00 N ATOM 1088 CA GLN A 75 -3.995 -6.881 -14.292 1.00 0.00 C ATOM 1089 C GLN A 75 -3.385 -6.099 -13.133 1.00 0.00 C ATOM 1090 O GLN A 75 -2.482 -6.583 -12.452 1.00 0.00 O ATOM 1091 CB GLN A 75 -4.317 -8.308 -13.847 1.00 0.00 C ATOM 1092 CG GLN A 75 -5.181 -9.074 -14.837 1.00 0.00 C ATOM 1093 CD GLN A 75 -6.025 -10.142 -14.170 1.00 0.00 C ATOM 1094 OE1 GLN A 75 -7.212 -10.286 -14.466 1.00 0.00 O ATOM 1095 NE2 GLN A 75 -5.417 -10.898 -13.263 1.00 0.00 N ATOM 0 H GLN A 75 -2.124 -7.114 -15.210 1.00 0.00 H new ATOM 0 HA GLN A 75 -4.918 -6.386 -14.594 1.00 0.00 H new ATOM 0 HB2 GLN A 75 -3.384 -8.851 -13.695 1.00 0.00 H new ATOM 0 HB3 GLN A 75 -4.826 -8.273 -12.884 1.00 0.00 H new ATOM 0 HG2 GLN A 75 -5.833 -8.375 -15.361 1.00 0.00 H new ATOM 0 HG3 GLN A 75 -4.542 -9.538 -15.588 1.00 0.00 H new ATOM 0 HE21 GLN A 75 -4.432 -10.744 -13.049 1.00 0.00 H new ATOM 0 HE22 GLN A 75 -5.935 -11.632 -12.781 1.00 0.00 H new ATOM 1104 N GLY A 76 -3.886 -4.887 -12.915 1.00 0.00 N ATOM 1105 CA GLY A 76 -3.378 -4.058 -11.838 1.00 0.00 C ATOM 1106 C GLY A 76 -4.468 -3.246 -11.167 1.00 0.00 C ATOM 1107 O GLY A 76 -5.472 -2.887 -11.782 1.00 0.00 O ATOM 0 H GLY A 76 -4.634 -4.465 -13.465 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -2.891 -4.690 -11.096 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -2.617 -3.384 -12.231 1.00 0.00 H new ATOM 1111 N PRO A 77 -4.278 -2.947 -9.873 1.00 0.00 N ATOM 1112 CA PRO A 77 -5.243 -2.170 -9.090 1.00 0.00 C ATOM 1113 C PRO A 77 -5.299 -0.709 -9.522 1.00 0.00 C ATOM 1114 O PRO A 77 -4.266 -0.064 -9.702 1.00 0.00 O ATOM 1115 CB PRO A 77 -4.713 -2.285 -7.659 1.00 0.00 C ATOM 1116 CG PRO A 77 -3.253 -2.537 -7.815 1.00 0.00 C ATOM 1117 CD PRO A 77 -3.104 -3.342 -9.076 1.00 0.00 C ATOM 0 HA PRO A 77 -6.260 -2.541 -9.213 1.00 0.00 H new ATOM 0 HB2 PRO A 77 -4.899 -1.372 -7.093 1.00 0.00 H new ATOM 0 HB3 PRO A 77 -5.200 -3.098 -7.121 1.00 0.00 H new ATOM 0 HG2 PRO A 77 -2.700 -1.600 -7.883 1.00 0.00 H new ATOM 0 HG3 PRO A 77 -2.857 -3.079 -6.957 1.00 0.00 H new ATOM 0 HD2 PRO A 77 -2.172 -3.112 -9.592 1.00 0.00 H new ATOM 0 HD3 PRO A 77 -3.099 -4.413 -8.871 1.00 0.00 H new ATOM 1125 N LYS A 78 -6.511 -0.191 -9.687 1.00 0.00 N ATOM 1126 CA LYS A 78 -6.703 1.195 -10.096 1.00 0.00 C ATOM 1127 C LYS A 78 -7.334 2.012 -8.973 1.00 0.00 C ATOM 1128 O LYS A 78 -6.656 2.786 -8.298 1.00 0.00 O ATOM 1129 CB LYS A 78 -7.582 1.263 -11.347 1.00 0.00 C ATOM 1130 CG LYS A 78 -8.092 2.659 -11.657 1.00 0.00 C ATOM 1131 CD LYS A 78 -8.386 2.829 -13.138 1.00 0.00 C ATOM 1132 CE LYS A 78 -7.192 3.408 -13.882 1.00 0.00 C ATOM 1133 NZ LYS A 78 -7.548 3.816 -15.269 1.00 0.00 N ATOM 0 H LYS A 78 -7.377 -0.711 -9.543 1.00 0.00 H new ATOM 0 HA LYS A 78 -5.725 1.618 -10.324 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -7.013 0.895 -12.201 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -8.433 0.594 -11.219 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -8.997 2.853 -11.081 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -7.351 3.396 -11.345 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -8.652 1.864 -13.570 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -9.248 3.484 -13.266 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -6.808 4.270 -13.337 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -6.391 2.669 -13.915 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -6.708 4.205 -15.743 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -7.891 2.988 -15.797 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -8.294 4.540 -15.237 1.00 0.00 H new ATOM 1147 N TYR A 79 -8.636 1.833 -8.778 1.00 0.00 N ATOM 1148 CA TYR A 79 -9.359 2.554 -7.737 1.00 0.00 C ATOM 1149 C TYR A 79 -9.277 1.815 -6.405 1.00 0.00 C ATOM 1150 O TYR A 79 -9.985 0.833 -6.181 1.00 0.00 O ATOM 1151 CB TYR A 79 -10.823 2.741 -8.140 1.00 0.00 C ATOM 1152 CG TYR A 79 -11.530 3.829 -7.365 1.00 0.00 C ATOM 1153 CD1 TYR A 79 -11.382 5.166 -7.714 1.00 0.00 C ATOM 1154 CD2 TYR A 79 -12.345 3.521 -6.283 1.00 0.00 C ATOM 1155 CE1 TYR A 79 -12.025 6.164 -7.008 1.00 0.00 C ATOM 1156 CE2 TYR A 79 -12.994 4.513 -5.572 1.00 0.00 C ATOM 1157 CZ TYR A 79 -12.830 5.833 -5.938 1.00 0.00 C ATOM 1158 OH TYR A 79 -13.473 6.823 -5.232 1.00 0.00 O ATOM 0 H TYR A 79 -9.212 1.195 -9.327 1.00 0.00 H new ATOM 0 HA TYR A 79 -8.894 3.533 -7.618 1.00 0.00 H new ATOM 0 HB2 TYR A 79 -10.871 2.974 -9.204 1.00 0.00 H new ATOM 0 HB3 TYR A 79 -11.354 1.800 -7.996 1.00 0.00 H new ATOM 0 HD1 TYR A 79 -10.753 5.429 -8.552 1.00 0.00 H new ATOM 0 HD2 TYR A 79 -12.474 2.489 -5.992 1.00 0.00 H new ATOM 0 HE1 TYR A 79 -11.898 7.198 -7.292 1.00 0.00 H new ATOM 0 HE2 TYR A 79 -13.626 4.256 -4.735 1.00 0.00 H new ATOM 0 HH TYR A 79 -14.001 6.421 -4.511 1.00 0.00 H new ATOM 1168 N VAL A 80 -8.407 2.296 -5.522 1.00 0.00 N ATOM 1169 CA VAL A 80 -8.232 1.683 -4.210 1.00 0.00 C ATOM 1170 C VAL A 80 -8.563 2.669 -3.095 1.00 0.00 C ATOM 1171 O VAL A 80 -8.161 3.832 -3.139 1.00 0.00 O ATOM 1172 CB VAL A 80 -6.793 1.172 -4.017 1.00 0.00 C ATOM 1173 CG1 VAL A 80 -6.784 -0.336 -3.817 1.00 0.00 C ATOM 1174 CG2 VAL A 80 -5.924 1.566 -5.203 1.00 0.00 C ATOM 0 H VAL A 80 -7.813 3.108 -5.691 1.00 0.00 H new ATOM 0 HA VAL A 80 -8.919 0.838 -4.161 1.00 0.00 H new ATOM 0 HB VAL A 80 -6.378 1.636 -3.122 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -5.758 -0.679 -3.682 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -7.370 -0.589 -2.934 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -7.217 -0.822 -4.692 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -4.910 1.197 -5.050 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -6.334 1.132 -6.115 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -5.905 2.652 -5.295 1.00 0.00 H new ATOM 1184 N LYS A 81 -9.299 2.197 -2.095 1.00 0.00 N ATOM 1185 CA LYS A 81 -9.684 3.035 -0.965 1.00 0.00 C ATOM 1186 C LYS A 81 -8.705 2.872 0.192 1.00 0.00 C ATOM 1187 O LYS A 81 -8.537 1.774 0.726 1.00 0.00 O ATOM 1188 CB LYS A 81 -11.100 2.684 -0.502 1.00 0.00 C ATOM 1189 CG LYS A 81 -12.142 2.781 -1.604 1.00 0.00 C ATOM 1190 CD LYS A 81 -13.547 2.588 -1.060 1.00 0.00 C ATOM 1191 CE LYS A 81 -14.338 3.887 -1.087 1.00 0.00 C ATOM 1192 NZ LYS A 81 -15.312 3.921 -2.213 1.00 0.00 N ATOM 0 H LYS A 81 -9.641 1.238 -2.044 1.00 0.00 H new ATOM 0 HA LYS A 81 -9.662 4.074 -1.292 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -11.101 1.671 -0.100 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -11.382 3.350 0.313 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -12.069 3.754 -2.090 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -11.939 2.028 -2.366 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -14.066 1.832 -1.650 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -13.494 2.214 -0.038 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -14.870 4.008 -0.143 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -13.651 4.729 -1.176 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -15.708 4.879 -2.301 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -14.829 3.663 -3.097 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -16.080 3.245 -2.028 1.00 0.00 H new ATOM 1206 N ILE A 82 -8.061 3.969 0.576 1.00 0.00 N ATOM 1207 CA ILE A 82 -7.101 3.947 1.672 1.00 0.00 C ATOM 1208 C ILE A 82 -7.767 4.311 2.995 1.00 0.00 C ATOM 1209 O ILE A 82 -8.544 5.263 3.069 1.00 0.00 O ATOM 1210 CB ILE A 82 -5.931 4.915 1.416 1.00 0.00 C ATOM 1211 CG1 ILE A 82 -5.206 4.542 0.121 1.00 0.00 C ATOM 1212 CG2 ILE A 82 -4.966 4.904 2.592 1.00 0.00 C ATOM 1213 CD1 ILE A 82 -4.415 5.684 -0.479 1.00 0.00 C ATOM 0 H ILE A 82 -8.187 4.884 0.144 1.00 0.00 H new ATOM 0 HA ILE A 82 -6.714 2.930 1.731 1.00 0.00 H new ATOM 0 HB ILE A 82 -6.330 5.924 1.309 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -4.532 3.708 0.318 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -5.938 4.195 -0.608 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -4.145 5.593 2.395 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -5.491 5.213 3.496 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -4.570 3.898 2.728 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -3.928 5.348 -1.394 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -5.087 6.511 -0.708 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -3.660 6.017 0.233 1.00 0.00 H new ATOM 1225 N PHE A 83 -7.456 3.549 4.038 1.00 0.00 N ATOM 1226 CA PHE A 83 -8.023 3.792 5.359 1.00 0.00 C ATOM 1227 C PHE A 83 -6.930 3.823 6.423 1.00 0.00 C ATOM 1228 O PHE A 83 -5.940 3.097 6.332 1.00 0.00 O ATOM 1229 CB PHE A 83 -9.053 2.713 5.701 1.00 0.00 C ATOM 1230 CG PHE A 83 -10.284 2.765 4.840 1.00 0.00 C ATOM 1231 CD1 PHE A 83 -10.312 2.128 3.610 1.00 0.00 C ATOM 1232 CD2 PHE A 83 -11.411 3.450 5.262 1.00 0.00 C ATOM 1233 CE1 PHE A 83 -11.443 2.173 2.816 1.00 0.00 C ATOM 1234 CE2 PHE A 83 -12.545 3.498 4.473 1.00 0.00 C ATOM 1235 CZ PHE A 83 -12.560 2.860 3.248 1.00 0.00 C ATOM 0 H PHE A 83 -6.814 2.758 3.994 1.00 0.00 H new ATOM 0 HA PHE A 83 -8.516 4.764 5.342 1.00 0.00 H new ATOM 0 HB2 PHE A 83 -8.588 1.732 5.598 1.00 0.00 H new ATOM 0 HB3 PHE A 83 -9.345 2.819 6.746 1.00 0.00 H new ATOM 0 HD1 PHE A 83 -9.440 1.590 3.267 1.00 0.00 H new ATOM 0 HD2 PHE A 83 -11.404 3.952 6.218 1.00 0.00 H new ATOM 0 HE1 PHE A 83 -11.453 1.672 1.859 1.00 0.00 H new ATOM 0 HE2 PHE A 83 -13.418 4.034 4.814 1.00 0.00 H new ATOM 0 HZ PHE A 83 -13.444 2.898 2.629 1.00 0.00 H new ATOM 1245 N ILE A 84 -7.118 4.669 7.430 1.00 0.00 N ATOM 1246 CA ILE A 84 -6.149 4.794 8.512 1.00 0.00 C ATOM 1247 C ILE A 84 -6.845 5.035 9.848 1.00 0.00 C ATOM 1248 O ILE A 84 -8.042 5.311 9.894 1.00 0.00 O ATOM 1249 CB ILE A 84 -5.157 5.942 8.249 1.00 0.00 C ATOM 1250 CG1 ILE A 84 -5.906 7.268 8.094 1.00 0.00 C ATOM 1251 CG2 ILE A 84 -4.326 5.650 7.008 1.00 0.00 C ATOM 1252 CD1 ILE A 84 -5.083 8.476 8.481 1.00 0.00 C ATOM 0 H ILE A 84 -7.932 5.278 7.519 1.00 0.00 H new ATOM 0 HA ILE A 84 -5.601 3.853 8.555 1.00 0.00 H new ATOM 0 HB ILE A 84 -4.484 6.023 9.103 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -6.228 7.375 7.058 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -6.807 7.241 8.707 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -3.630 6.470 6.835 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -3.768 4.725 7.153 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -4.984 5.545 6.146 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -5.677 9.380 8.346 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -4.782 8.392 9.525 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -4.195 8.528 7.851 1.00 0.00 H new ATOM 1264 N ASN A 85 -6.084 4.930 10.932 1.00 0.00 N ATOM 1265 CA ASN A 85 -6.626 5.137 12.270 1.00 0.00 C ATOM 1266 C ASN A 85 -7.863 4.273 12.495 1.00 0.00 C ATOM 1267 O ASN A 85 -8.859 4.729 13.059 1.00 0.00 O ATOM 1268 CB ASN A 85 -6.976 6.612 12.478 1.00 0.00 C ATOM 1269 CG ASN A 85 -5.758 7.455 12.805 1.00 0.00 C ATOM 1270 OD1 ASN A 85 -4.711 7.317 12.000 1.00 0.00 O flip ATOM 1271 ND2 ASN A 85 -5.760 8.220 13.769 1.00 0.00 N flip ATOM 0 H ASN A 85 -5.090 4.703 10.910 1.00 0.00 H new ATOM 0 HA ASN A 85 -5.864 4.845 12.993 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -7.452 7.000 11.577 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -7.703 6.700 13.286 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -6.588 8.293 14.360 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -4.934 8.781 13.977 1.00 0.00 H new ATOM 1278 N LEU A 86 -7.793 3.023 12.052 1.00 0.00 N ATOM 1279 CA LEU A 86 -8.907 2.093 12.205 1.00 0.00 C ATOM 1280 C LEU A 86 -8.989 1.573 13.637 1.00 0.00 C ATOM 1281 O LEU A 86 -8.000 1.540 14.369 1.00 0.00 O ATOM 1282 CB LEU A 86 -8.757 0.922 11.233 1.00 0.00 C ATOM 1283 CG LEU A 86 -8.892 1.261 9.748 1.00 0.00 C ATOM 1284 CD1 LEU A 86 -8.830 -0.003 8.904 1.00 0.00 C ATOM 1285 CD2 LEU A 86 -10.188 2.015 9.488 1.00 0.00 C ATOM 0 H LEU A 86 -6.977 2.630 11.584 1.00 0.00 H new ATOM 0 HA LEU A 86 -9.829 2.629 11.979 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -7.780 0.465 11.394 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -9.505 0.170 11.483 1.00 0.00 H new ATOM 0 HG LEU A 86 -8.058 1.904 9.465 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -8.928 0.258 7.850 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -7.875 -0.503 9.067 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -9.643 -0.671 9.189 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -10.267 2.248 8.426 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -11.035 1.397 9.788 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -10.192 2.941 10.064 1.00 0.00 H new ATOM 1297 N PRO A 87 -10.196 1.154 14.046 1.00 0.00 N ATOM 1298 CA PRO A 87 -10.435 0.625 15.392 1.00 0.00 C ATOM 1299 C PRO A 87 -9.782 -0.736 15.604 1.00 0.00 C ATOM 1300 O PRO A 87 -9.494 -1.127 16.736 1.00 0.00 O ATOM 1301 CB PRO A 87 -11.960 0.503 15.459 1.00 0.00 C ATOM 1302 CG PRO A 87 -12.391 0.355 14.040 1.00 0.00 C ATOM 1303 CD PRO A 87 -11.419 1.164 13.226 1.00 0.00 C ATOM 0 HA PRO A 87 -10.011 1.267 16.164 1.00 0.00 H new ATOM 0 HB2 PRO A 87 -12.262 -0.357 16.056 1.00 0.00 H new ATOM 0 HB3 PRO A 87 -12.408 1.384 15.919 1.00 0.00 H new ATOM 0 HG2 PRO A 87 -12.379 -0.692 13.736 1.00 0.00 H new ATOM 0 HG3 PRO A 87 -13.410 0.715 13.902 1.00 0.00 H new ATOM 0 HD2 PRO A 87 -11.249 0.720 12.245 1.00 0.00 H new ATOM 0 HD3 PRO A 87 -11.782 2.178 13.058 1.00 0.00 H new ATOM 1311 N ARG A 88 -9.550 -1.454 14.510 1.00 0.00 N ATOM 1312 CA ARG A 88 -8.931 -2.772 14.577 1.00 0.00 C ATOM 1313 C ARG A 88 -8.644 -3.310 13.178 1.00 0.00 C ATOM 1314 O ARG A 88 -7.615 -3.945 12.946 1.00 0.00 O ATOM 1315 CB ARG A 88 -9.837 -3.746 15.333 1.00 0.00 C ATOM 1316 CG ARG A 88 -11.298 -3.663 14.922 1.00 0.00 C ATOM 1317 CD ARG A 88 -12.055 -4.927 15.299 1.00 0.00 C ATOM 1318 NE ARG A 88 -13.460 -4.657 15.591 1.00 0.00 N ATOM 1319 CZ ARG A 88 -13.873 -3.999 16.669 1.00 0.00 C ATOM 1320 NH1 ARG A 88 -12.993 -3.547 17.552 1.00 0.00 N ATOM 1321 NH2 ARG A 88 -15.169 -3.793 16.866 1.00 0.00 N ATOM 0 H ARG A 88 -9.782 -1.145 13.566 1.00 0.00 H new ATOM 0 HA ARG A 88 -7.986 -2.675 15.111 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -9.480 -4.763 15.170 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -9.757 -3.548 16.402 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -11.764 -2.802 15.401 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -11.366 -3.504 13.846 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -11.986 -5.647 14.484 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -11.585 -5.385 16.170 1.00 0.00 H new ATOM 0 HE ARG A 88 -14.163 -4.992 14.932 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -11.996 -3.704 17.405 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -13.313 -3.042 18.379 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -15.849 -4.140 16.190 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -15.485 -3.288 17.694 1.00 0.00 H new ATOM 1335 N SER A 89 -9.560 -3.051 12.250 1.00 0.00 N ATOM 1336 CA SER A 89 -9.407 -3.512 10.876 1.00 0.00 C ATOM 1337 C SER A 89 -10.579 -3.051 10.015 1.00 0.00 C ATOM 1338 O SER A 89 -11.503 -2.401 10.502 1.00 0.00 O ATOM 1339 CB SER A 89 -9.300 -5.038 10.837 1.00 0.00 C ATOM 1340 OG SER A 89 -7.970 -5.449 10.567 1.00 0.00 O ATOM 0 H SER A 89 -10.416 -2.524 12.425 1.00 0.00 H new ATOM 0 HA SER A 89 -8.491 -3.080 10.473 1.00 0.00 H new ATOM 0 HB2 SER A 89 -9.626 -5.453 11.791 1.00 0.00 H new ATOM 0 HB3 SER A 89 -9.969 -5.433 10.072 1.00 0.00 H new ATOM 0 HG SER A 89 -7.367 -5.070 11.241 1.00 0.00 H new ATOM 1346 N MET A 90 -10.533 -3.394 8.731 1.00 0.00 N ATOM 1347 CA MET A 90 -11.591 -3.017 7.802 1.00 0.00 C ATOM 1348 C MET A 90 -12.197 -4.250 7.138 1.00 0.00 C ATOM 1349 O MET A 90 -11.504 -5.236 6.890 1.00 0.00 O ATOM 1350 CB MET A 90 -11.047 -2.065 6.735 1.00 0.00 C ATOM 1351 CG MET A 90 -12.116 -1.530 5.796 1.00 0.00 C ATOM 1352 SD MET A 90 -13.282 -0.433 6.625 1.00 0.00 S ATOM 1353 CE MET A 90 -12.174 0.823 7.260 1.00 0.00 C ATOM 0 H MET A 90 -9.775 -3.932 8.311 1.00 0.00 H new ATOM 0 HA MET A 90 -12.372 -2.509 8.368 1.00 0.00 H new ATOM 0 HB2 MET A 90 -10.553 -1.226 7.226 1.00 0.00 H new ATOM 0 HB3 MET A 90 -10.288 -2.584 6.150 1.00 0.00 H new ATOM 0 HG2 MET A 90 -11.639 -0.994 4.976 1.00 0.00 H new ATOM 0 HG3 MET A 90 -12.660 -2.366 5.356 1.00 0.00 H new ATOM 0 HE1 MET A 90 -12.641 1.803 7.162 1.00 0.00 H new ATOM 0 HE2 MET A 90 -11.964 0.625 8.311 1.00 0.00 H new ATOM 0 HE3 MET A 90 -11.243 0.806 6.694 1.00 0.00 H new ATOM 1363 N ASP A 91 -13.493 -4.187 6.855 1.00 0.00 N ATOM 1364 CA ASP A 91 -14.192 -5.298 6.220 1.00 0.00 C ATOM 1365 C ASP A 91 -14.764 -4.880 4.869 1.00 0.00 C ATOM 1366 O ASP A 91 -14.450 -3.805 4.356 1.00 0.00 O ATOM 1367 CB ASP A 91 -15.313 -5.808 7.126 1.00 0.00 C ATOM 1368 CG ASP A 91 -14.836 -6.086 8.538 1.00 0.00 C ATOM 1369 OD1 ASP A 91 -13.629 -6.354 8.714 1.00 0.00 O ATOM 1370 OD2 ASP A 91 -15.669 -6.034 9.466 1.00 0.00 O ATOM 0 H ASP A 91 -14.081 -3.378 7.055 1.00 0.00 H new ATOM 0 HA ASP A 91 -13.473 -6.101 6.057 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -16.116 -5.071 7.155 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -15.733 -6.720 6.701 1.00 0.00 H new ATOM 1375 N PHE A 92 -15.604 -5.736 4.296 1.00 0.00 N ATOM 1376 CA PHE A 92 -16.218 -5.456 3.004 1.00 0.00 C ATOM 1377 C PHE A 92 -17.361 -4.456 3.150 1.00 0.00 C ATOM 1378 O PHE A 92 -17.564 -3.600 2.289 1.00 0.00 O ATOM 1379 CB PHE A 92 -16.734 -6.749 2.370 1.00 0.00 C ATOM 1380 CG PHE A 92 -15.641 -7.692 1.955 1.00 0.00 C ATOM 1381 CD1 PHE A 92 -14.879 -8.352 2.906 1.00 0.00 C ATOM 1382 CD2 PHE A 92 -15.375 -7.917 0.614 1.00 0.00 C ATOM 1383 CE1 PHE A 92 -13.872 -9.220 2.527 1.00 0.00 C ATOM 1384 CE2 PHE A 92 -14.370 -8.785 0.230 1.00 0.00 C ATOM 1385 CZ PHE A 92 -13.617 -9.436 1.187 1.00 0.00 C ATOM 0 H PHE A 92 -15.875 -6.630 4.707 1.00 0.00 H new ATOM 0 HA PHE A 92 -15.458 -5.020 2.356 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -17.390 -7.255 3.079 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -17.339 -6.500 1.498 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -15.074 -8.186 3.955 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -15.959 -7.409 -0.139 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -13.285 -9.729 3.278 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -14.174 -8.954 -0.818 1.00 0.00 H new ATOM 0 HZ PHE A 92 -12.830 -10.113 0.888 1.00 0.00 H new ATOM 1395 N GLU A 93 -18.104 -4.572 4.246 1.00 0.00 N ATOM 1396 CA GLU A 93 -19.228 -3.679 4.504 1.00 0.00 C ATOM 1397 C GLU A 93 -18.747 -2.354 5.087 1.00 0.00 C ATOM 1398 O GLU A 93 -19.273 -1.291 4.757 1.00 0.00 O ATOM 1399 CB GLU A 93 -20.223 -4.339 5.460 1.00 0.00 C ATOM 1400 CG GLU A 93 -21.216 -5.257 4.768 1.00 0.00 C ATOM 1401 CD GLU A 93 -22.633 -5.074 5.277 1.00 0.00 C ATOM 1402 OE1 GLU A 93 -22.820 -5.041 6.511 1.00 0.00 O ATOM 1403 OE2 GLU A 93 -23.554 -4.965 4.441 1.00 0.00 O ATOM 0 H GLU A 93 -17.948 -5.275 4.969 1.00 0.00 H new ATOM 0 HA GLU A 93 -19.726 -3.479 3.555 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -19.672 -4.911 6.206 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -20.770 -3.562 5.994 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -21.192 -5.068 3.695 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -20.912 -6.293 4.916 1.00 0.00 H new ATOM 1410 N GLU A 94 -17.744 -2.426 5.956 1.00 0.00 N ATOM 1411 CA GLU A 94 -17.193 -1.232 6.587 1.00 0.00 C ATOM 1412 C GLU A 94 -16.401 -0.401 5.581 1.00 0.00 C ATOM 1413 O GLU A 94 -16.238 0.807 5.749 1.00 0.00 O ATOM 1414 CB GLU A 94 -16.295 -1.618 7.764 1.00 0.00 C ATOM 1415 CG GLU A 94 -17.065 -2.056 8.999 1.00 0.00 C ATOM 1416 CD GLU A 94 -16.302 -1.802 10.284 1.00 0.00 C ATOM 1417 OE1 GLU A 94 -16.180 -0.623 10.679 1.00 0.00 O ATOM 1418 OE2 GLU A 94 -15.826 -2.782 10.894 1.00 0.00 O ATOM 0 H GLU A 94 -17.296 -3.298 6.239 1.00 0.00 H new ATOM 0 HA GLU A 94 -18.024 -0.631 6.955 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -15.632 -2.426 7.454 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -15.663 -0.768 8.022 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -18.017 -1.526 9.036 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -17.294 -3.119 8.921 1.00 0.00 H new ATOM 1425 N ALA A 95 -15.911 -1.059 4.535 1.00 0.00 N ATOM 1426 CA ALA A 95 -15.138 -0.382 3.501 1.00 0.00 C ATOM 1427 C ALA A 95 -16.053 0.293 2.485 1.00 0.00 C ATOM 1428 O ALA A 95 -15.593 1.042 1.624 1.00 0.00 O ATOM 1429 CB ALA A 95 -14.210 -1.367 2.806 1.00 0.00 C ATOM 0 H ALA A 95 -16.036 -2.060 4.382 1.00 0.00 H new ATOM 0 HA ALA A 95 -14.537 0.391 3.979 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -13.639 -0.848 2.036 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -13.526 -1.799 3.536 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -14.800 -2.161 2.347 1.00 0.00 H new ATOM 1435 N GLU A 96 -17.350 0.022 2.592 1.00 0.00 N ATOM 1436 CA GLU A 96 -18.329 0.603 1.680 1.00 0.00 C ATOM 1437 C GLU A 96 -19.115 1.718 2.364 1.00 0.00 C ATOM 1438 O GLU A 96 -19.285 2.803 1.809 1.00 0.00 O ATOM 1439 CB GLU A 96 -19.288 -0.475 1.172 1.00 0.00 C ATOM 1440 CG GLU A 96 -19.223 -0.688 -0.332 1.00 0.00 C ATOM 1441 CD GLU A 96 -20.571 -0.512 -1.004 1.00 0.00 C ATOM 1442 OE1 GLU A 96 -21.495 -1.291 -0.691 1.00 0.00 O ATOM 1443 OE2 GLU A 96 -20.701 0.403 -1.844 1.00 0.00 O ATOM 0 H GLU A 96 -17.747 -0.595 3.300 1.00 0.00 H new ATOM 0 HA GLU A 96 -17.791 1.029 0.833 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -19.062 -1.416 1.674 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -20.307 -0.203 1.448 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -18.511 0.015 -0.764 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -18.847 -1.690 -0.538 1.00 0.00 H new ATOM 1450 N ARG A 97 -19.593 1.440 3.573 1.00 0.00 N ATOM 1451 CA ARG A 97 -20.363 2.418 4.333 1.00 0.00 C ATOM 1452 C ARG A 97 -19.499 3.618 4.707 1.00 0.00 C ATOM 1453 O ARG A 97 -19.929 4.766 4.589 1.00 0.00 O ATOM 1454 CB ARG A 97 -20.937 1.775 5.597 1.00 0.00 C ATOM 1455 CG ARG A 97 -19.883 1.148 6.494 1.00 0.00 C ATOM 1456 CD ARG A 97 -20.478 0.067 7.382 1.00 0.00 C ATOM 1457 NE ARG A 97 -20.276 0.350 8.800 1.00 0.00 N ATOM 1458 CZ ARG A 97 -20.656 -0.468 9.775 1.00 0.00 C ATOM 1459 NH1 ARG A 97 -21.255 -1.615 9.486 1.00 0.00 N ATOM 1460 NH2 ARG A 97 -20.437 -0.140 11.042 1.00 0.00 N ATOM 0 H ARG A 97 -19.461 0.546 4.047 1.00 0.00 H new ATOM 0 HA ARG A 97 -21.184 2.765 3.705 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -21.481 2.531 6.164 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -21.659 1.010 5.310 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -19.090 0.721 5.881 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -19.426 1.919 7.114 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -21.545 -0.022 7.179 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -20.025 -0.894 7.136 1.00 0.00 H new ATOM 0 HE ARG A 97 -19.818 1.224 9.056 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -21.425 -1.871 8.513 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -21.546 -2.242 10.236 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -19.976 0.741 11.268 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -20.729 -0.769 11.790 1.00 0.00 H new ATOM 1474 N SER A 98 -18.279 3.345 5.158 1.00 0.00 N ATOM 1475 CA SER A 98 -17.356 4.403 5.554 1.00 0.00 C ATOM 1476 C SER A 98 -16.448 4.794 4.392 1.00 0.00 C ATOM 1477 O SER A 98 -16.019 3.944 3.613 1.00 0.00 O ATOM 1478 CB SER A 98 -16.511 3.951 6.747 1.00 0.00 C ATOM 1479 OG SER A 98 -17.313 3.322 7.731 1.00 0.00 O ATOM 0 H SER A 98 -17.907 2.401 5.258 1.00 0.00 H new ATOM 0 HA SER A 98 -17.943 5.275 5.843 1.00 0.00 H new ATOM 0 HB2 SER A 98 -15.738 3.261 6.408 1.00 0.00 H new ATOM 0 HB3 SER A 98 -16.003 4.811 7.183 1.00 0.00 H new ATOM 0 HG SER A 98 -16.749 3.041 8.482 1.00 0.00 H new ATOM 1485 N GLU A 99 -16.161 6.087 4.283 1.00 0.00 N ATOM 1486 CA GLU A 99 -15.305 6.592 3.216 1.00 0.00 C ATOM 1487 C GLU A 99 -13.838 6.562 3.635 1.00 0.00 C ATOM 1488 O GLU A 99 -13.499 6.709 4.810 1.00 0.00 O ATOM 1489 CB GLU A 99 -15.710 8.018 2.838 1.00 0.00 C ATOM 1490 CG GLU A 99 -15.300 9.060 3.866 1.00 0.00 C ATOM 1491 CD GLU A 99 -16.383 10.091 4.115 1.00 0.00 C ATOM 1492 OE1 GLU A 99 -17.347 9.776 4.845 1.00 0.00 O ATOM 1493 OE2 GLU A 99 -16.267 11.214 3.581 1.00 0.00 O ATOM 0 H GLU A 99 -16.508 6.804 4.920 1.00 0.00 H new ATOM 0 HA GLU A 99 -15.430 5.945 2.348 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -15.262 8.271 1.877 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -16.791 8.057 2.705 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -15.055 8.562 4.804 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -14.395 9.564 3.526 1.00 0.00 H new ATOM 1500 N PRO A 100 -12.946 6.367 2.653 1.00 0.00 N ATOM 1501 CA PRO A 100 -11.501 6.314 2.895 1.00 0.00 C ATOM 1502 C PRO A 100 -10.927 7.673 3.279 1.00 0.00 C ATOM 1503 O PRO A 100 -11.619 8.690 3.222 1.00 0.00 O ATOM 1504 CB PRO A 100 -10.933 5.855 1.549 1.00 0.00 C ATOM 1505 CG PRO A 100 -11.945 6.286 0.544 1.00 0.00 C ATOM 1506 CD PRO A 100 -13.279 6.185 1.230 1.00 0.00 C ATOM 0 HA PRO A 100 -11.251 5.655 3.726 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -9.962 6.310 1.353 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -10.789 4.775 1.528 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -11.754 7.306 0.211 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -11.912 5.650 -0.341 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -13.971 6.950 0.878 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -13.752 5.220 1.048 1.00 0.00 H new ATOM 1514 N THR A 101 -9.656 7.684 3.672 1.00 0.00 N ATOM 1515 CA THR A 101 -8.989 8.918 4.067 1.00 0.00 C ATOM 1516 C THR A 101 -8.493 9.689 2.849 1.00 0.00 C ATOM 1517 O THR A 101 -8.304 10.904 2.907 1.00 0.00 O ATOM 1518 CB THR A 101 -7.799 8.638 5.003 1.00 0.00 C ATOM 1519 OG1 THR A 101 -8.250 7.954 6.177 1.00 0.00 O ATOM 1520 CG2 THR A 101 -7.106 9.933 5.399 1.00 0.00 C ATOM 0 H THR A 101 -9.069 6.852 3.725 1.00 0.00 H new ATOM 0 HA THR A 101 -9.726 9.520 4.599 1.00 0.00 H new ATOM 0 HB THR A 101 -7.085 8.011 4.469 1.00 0.00 H new ATOM 0 HG1 THR A 101 -8.186 8.553 6.950 1.00 0.00 H new ATOM 0 HG21 THR A 101 -6.269 9.710 6.060 1.00 0.00 H new ATOM 0 HG22 THR A 101 -6.738 10.437 4.505 1.00 0.00 H new ATOM 0 HG23 THR A 101 -7.814 10.581 5.916 1.00 0.00 H new ATOM 1528 N GLN A 102 -8.284 8.975 1.747 1.00 0.00 N ATOM 1529 CA GLN A 102 -7.810 9.594 0.515 1.00 0.00 C ATOM 1530 C GLN A 102 -8.489 8.975 -0.702 1.00 0.00 C ATOM 1531 O GLN A 102 -9.370 9.582 -1.309 1.00 0.00 O ATOM 1532 CB GLN A 102 -6.292 9.447 0.397 1.00 0.00 C ATOM 1533 CG GLN A 102 -5.746 9.841 -0.966 1.00 0.00 C ATOM 1534 CD GLN A 102 -4.378 10.488 -0.882 1.00 0.00 C ATOM 1535 OE1 GLN A 102 -3.475 9.974 -0.221 1.00 0.00 O ATOM 1536 NE2 GLN A 102 -4.218 11.623 -1.552 1.00 0.00 N ATOM 0 H GLN A 102 -8.435 7.968 1.683 1.00 0.00 H new ATOM 0 HA GLN A 102 -8.064 10.653 0.550 1.00 0.00 H new ATOM 0 HB2 GLN A 102 -5.816 10.061 1.161 1.00 0.00 H new ATOM 0 HB3 GLN A 102 -6.019 8.412 0.603 1.00 0.00 H new ATOM 0 HG2 GLN A 102 -5.687 8.956 -1.599 1.00 0.00 H new ATOM 0 HG3 GLN A 102 -6.441 10.530 -1.446 1.00 0.00 H new ATOM 0 HE21 GLN A 102 -4.994 12.013 -2.087 1.00 0.00 H new ATOM 0 HE22 GLN A 102 -3.319 12.105 -1.532 1.00 0.00 H new ATOM 1545 N ALA A 103 -8.072 7.763 -1.053 1.00 0.00 N ATOM 1546 CA ALA A 103 -8.641 7.060 -2.196 1.00 0.00 C ATOM 1547 C ALA A 103 -8.319 7.783 -3.500 1.00 0.00 C ATOM 1548 O ALA A 103 -8.737 8.922 -3.710 1.00 0.00 O ATOM 1549 CB ALA A 103 -10.146 6.914 -2.030 1.00 0.00 C ATOM 0 H ALA A 103 -7.342 7.247 -0.562 1.00 0.00 H new ATOM 0 HA ALA A 103 -8.193 6.067 -2.240 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -10.558 6.387 -2.891 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -10.359 6.349 -1.123 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -10.602 7.902 -1.957 1.00 0.00 H new ATOM 1555 N LEU A 104 -7.573 7.114 -4.373 1.00 0.00 N ATOM 1556 CA LEU A 104 -7.194 7.693 -5.657 1.00 0.00 C ATOM 1557 C LEU A 104 -7.342 6.671 -6.780 1.00 0.00 C ATOM 1558 O LEU A 104 -7.464 5.472 -6.528 1.00 0.00 O ATOM 1559 CB LEU A 104 -5.753 8.203 -5.603 1.00 0.00 C ATOM 1560 CG LEU A 104 -5.264 8.688 -4.238 1.00 0.00 C ATOM 1561 CD1 LEU A 104 -4.602 7.551 -3.474 1.00 0.00 C ATOM 1562 CD2 LEU A 104 -4.301 9.855 -4.400 1.00 0.00 C ATOM 0 H LEU A 104 -7.219 6.171 -4.215 1.00 0.00 H new ATOM 0 HA LEU A 104 -7.862 8.530 -5.862 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -5.093 7.404 -5.940 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -5.652 9.022 -6.315 1.00 0.00 H new ATOM 0 HG LEU A 104 -6.126 9.031 -3.665 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -4.260 7.914 -2.505 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -5.321 6.745 -3.326 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -3.750 7.178 -4.043 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -3.963 10.187 -3.418 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -3.442 9.538 -4.991 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -4.807 10.677 -4.907 1.00 0.00 H new ATOM 1574 N GLU A 105 -7.328 7.154 -8.018 1.00 0.00 N ATOM 1575 CA GLU A 105 -7.459 6.281 -9.179 1.00 0.00 C ATOM 1576 C GLU A 105 -6.100 6.030 -9.827 1.00 0.00 C ATOM 1577 O GLU A 105 -5.687 6.757 -10.731 1.00 0.00 O ATOM 1578 CB GLU A 105 -8.418 6.895 -10.201 1.00 0.00 C ATOM 1579 CG GLU A 105 -8.525 6.099 -11.491 1.00 0.00 C ATOM 1580 CD GLU A 105 -9.331 6.818 -12.555 1.00 0.00 C ATOM 1581 OE1 GLU A 105 -10.556 6.973 -12.367 1.00 0.00 O ATOM 1582 OE2 GLU A 105 -8.738 7.225 -13.575 1.00 0.00 O ATOM 0 H GLU A 105 -7.227 8.144 -8.243 1.00 0.00 H new ATOM 0 HA GLU A 105 -7.863 5.327 -8.840 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -9.408 6.979 -9.753 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -8.087 7.907 -10.435 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -7.524 5.897 -11.873 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -8.987 5.134 -11.281 1.00 0.00 H new ATOM 1589 N LEU A 106 -5.411 4.996 -9.358 1.00 0.00 N ATOM 1590 CA LEU A 106 -4.098 4.647 -9.891 1.00 0.00 C ATOM 1591 C LEU A 106 -4.161 4.435 -11.400 1.00 0.00 C ATOM 1592 O LEU A 106 -5.096 3.819 -11.913 1.00 0.00 O ATOM 1593 CB LEU A 106 -3.567 3.385 -9.209 1.00 0.00 C ATOM 1594 CG LEU A 106 -3.613 3.379 -7.680 1.00 0.00 C ATOM 1595 CD1 LEU A 106 -2.941 2.130 -7.131 1.00 0.00 C ATOM 1596 CD2 LEU A 106 -2.952 4.631 -7.122 1.00 0.00 C ATOM 0 H LEU A 106 -5.739 4.385 -8.610 1.00 0.00 H new ATOM 0 HA LEU A 106 -3.419 5.475 -9.687 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -4.139 2.531 -9.573 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -2.534 3.234 -9.522 1.00 0.00 H new ATOM 0 HG LEU A 106 -4.657 3.373 -7.367 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -2.983 2.143 -6.042 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -3.457 1.245 -7.504 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -1.900 2.105 -7.453 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -2.994 4.610 -6.033 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -1.911 4.668 -7.445 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -3.477 5.513 -7.488 1.00 0.00 H new ATOM 1608 N THR A 107 -3.159 4.948 -12.107 1.00 0.00 N ATOM 1609 CA THR A 107 -3.100 4.814 -13.557 1.00 0.00 C ATOM 1610 C THR A 107 -1.967 3.885 -13.978 1.00 0.00 C ATOM 1611 O THR A 107 -1.208 3.399 -13.140 1.00 0.00 O ATOM 1612 CB THR A 107 -2.908 6.181 -14.240 1.00 0.00 C ATOM 1613 OG1 THR A 107 -3.082 6.051 -15.656 1.00 0.00 O ATOM 1614 CG2 THR A 107 -1.526 6.744 -13.945 1.00 0.00 C ATOM 0 H THR A 107 -2.377 5.460 -11.699 1.00 0.00 H new ATOM 0 HA THR A 107 -4.052 4.388 -13.874 1.00 0.00 H new ATOM 0 HB THR A 107 -3.656 6.868 -13.844 1.00 0.00 H new ATOM 0 HG1 THR A 107 -3.836 5.452 -15.839 1.00 0.00 H new ATOM 0 HG21 THR A 107 -1.414 7.710 -14.438 1.00 0.00 H new ATOM 0 HG22 THR A 107 -1.406 6.870 -12.869 1.00 0.00 H new ATOM 0 HG23 THR A 107 -0.766 6.057 -14.317 1.00 0.00 H new ATOM 1622 N GLU A 108 -1.859 3.643 -15.281 1.00 0.00 N ATOM 1623 CA GLU A 108 -0.817 2.771 -15.811 1.00 0.00 C ATOM 1624 C GLU A 108 0.568 3.275 -15.416 1.00 0.00 C ATOM 1625 O GLU A 108 1.512 2.495 -15.291 1.00 0.00 O ATOM 1626 CB GLU A 108 -0.924 2.681 -17.335 1.00 0.00 C ATOM 1627 CG GLU A 108 -0.781 4.022 -18.035 1.00 0.00 C ATOM 1628 CD GLU A 108 -0.666 3.884 -19.541 1.00 0.00 C ATOM 1629 OE1 GLU A 108 -0.798 2.750 -20.045 1.00 0.00 O ATOM 1630 OE2 GLU A 108 -0.446 4.913 -20.215 1.00 0.00 O ATOM 0 H GLU A 108 -2.479 4.038 -15.988 1.00 0.00 H new ATOM 0 HA GLU A 108 -0.958 1.778 -15.384 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -0.155 2.003 -17.705 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -1.887 2.244 -17.598 1.00 0.00 H new ATOM 0 HG2 GLU A 108 -1.642 4.646 -17.796 1.00 0.00 H new ATOM 0 HG3 GLU A 108 0.101 4.535 -17.652 1.00 0.00 H new ATOM 1637 N ASP A 109 0.681 4.585 -15.221 1.00 0.00 N ATOM 1638 CA ASP A 109 1.950 5.194 -14.840 1.00 0.00 C ATOM 1639 C ASP A 109 2.190 5.055 -13.340 1.00 0.00 C ATOM 1640 O ASP A 109 3.304 5.260 -12.858 1.00 0.00 O ATOM 1641 CB ASP A 109 1.970 6.671 -15.237 1.00 0.00 C ATOM 1642 CG ASP A 109 1.495 6.894 -16.660 1.00 0.00 C ATOM 1643 OD1 ASP A 109 2.310 6.723 -17.591 1.00 0.00 O ATOM 1644 OD2 ASP A 109 0.309 7.240 -16.842 1.00 0.00 O ATOM 0 H ASP A 109 -0.091 5.245 -15.321 1.00 0.00 H new ATOM 0 HA ASP A 109 2.749 4.673 -15.368 1.00 0.00 H new ATOM 0 HB2 ASP A 109 1.338 7.237 -14.553 1.00 0.00 H new ATOM 0 HB3 ASP A 109 2.983 7.059 -15.130 1.00 0.00 H new ATOM 1649 N ASP A 110 1.138 4.706 -12.607 1.00 0.00 N ATOM 1650 CA ASP A 110 1.235 4.540 -11.162 1.00 0.00 C ATOM 1651 C ASP A 110 1.423 3.071 -10.796 1.00 0.00 C ATOM 1652 O ASP A 110 1.834 2.747 -9.681 1.00 0.00 O ATOM 1653 CB ASP A 110 -0.017 5.092 -10.478 1.00 0.00 C ATOM 1654 CG ASP A 110 -0.333 6.511 -10.909 1.00 0.00 C ATOM 1655 OD1 ASP A 110 0.613 7.254 -11.246 1.00 0.00 O ATOM 1656 OD2 ASP A 110 -1.526 6.879 -10.910 1.00 0.00 O ATOM 0 H ASP A 110 0.209 4.533 -12.990 1.00 0.00 H new ATOM 0 HA ASP A 110 2.105 5.097 -10.815 1.00 0.00 H new ATOM 0 HB2 ASP A 110 -0.866 4.448 -10.706 1.00 0.00 H new ATOM 0 HB3 ASP A 110 0.121 5.066 -9.397 1.00 0.00 H new ATOM 1661 N ILE A 111 1.118 2.187 -11.740 1.00 0.00 N ATOM 1662 CA ILE A 111 1.254 0.753 -11.516 1.00 0.00 C ATOM 1663 C ILE A 111 2.286 0.145 -12.460 1.00 0.00 C ATOM 1664 O ILE A 111 2.242 -1.048 -12.761 1.00 0.00 O ATOM 1665 CB ILE A 111 -0.090 0.025 -11.704 1.00 0.00 C ATOM 1666 CG1 ILE A 111 -0.541 0.110 -13.164 1.00 0.00 C ATOM 1667 CG2 ILE A 111 -1.146 0.615 -10.782 1.00 0.00 C ATOM 1668 CD1 ILE A 111 -0.722 -1.241 -13.820 1.00 0.00 C ATOM 0 H ILE A 111 0.775 2.439 -12.667 1.00 0.00 H new ATOM 0 HA ILE A 111 1.587 0.624 -10.486 1.00 0.00 H new ATOM 0 HB ILE A 111 0.043 -1.025 -11.445 1.00 0.00 H new ATOM 0 HG12 ILE A 111 -1.482 0.658 -13.214 1.00 0.00 H new ATOM 0 HG13 ILE A 111 0.193 0.684 -13.730 1.00 0.00 H new ATOM 0 HG21 ILE A 111 -2.090 0.090 -10.927 1.00 0.00 H new ATOM 0 HG22 ILE A 111 -0.826 0.507 -9.746 1.00 0.00 H new ATOM 0 HG23 ILE A 111 -1.280 1.672 -11.012 1.00 0.00 H new ATOM 0 HD11 ILE A 111 -1.042 -1.104 -14.853 1.00 0.00 H new ATOM 0 HD12 ILE A 111 0.223 -1.784 -13.802 1.00 0.00 H new ATOM 0 HD13 ILE A 111 -1.477 -1.810 -13.278 1.00 0.00 H new ATOM 1680 N LYS A 112 3.217 0.972 -12.922 1.00 0.00 N ATOM 1681 CA LYS A 112 4.264 0.517 -13.829 1.00 0.00 C ATOM 1682 C LYS A 112 5.505 0.085 -13.055 1.00 0.00 C ATOM 1683 O LYS A 112 5.489 0.019 -11.826 1.00 0.00 O ATOM 1684 CB LYS A 112 4.627 1.626 -14.820 1.00 0.00 C ATOM 1685 CG LYS A 112 5.218 2.860 -14.160 1.00 0.00 C ATOM 1686 CD LYS A 112 6.096 3.640 -15.124 1.00 0.00 C ATOM 1687 CE LYS A 112 5.934 5.141 -14.936 1.00 0.00 C ATOM 1688 NZ LYS A 112 6.989 5.907 -15.655 1.00 0.00 N ATOM 0 H LYS A 112 3.268 1.962 -12.683 1.00 0.00 H new ATOM 0 HA LYS A 112 3.884 -0.343 -14.380 1.00 0.00 H new ATOM 0 HB2 LYS A 112 5.341 1.235 -15.545 1.00 0.00 H new ATOM 0 HB3 LYS A 112 3.734 1.913 -15.375 1.00 0.00 H new ATOM 0 HG2 LYS A 112 4.414 3.501 -13.798 1.00 0.00 H new ATOM 0 HG3 LYS A 112 5.805 2.563 -13.291 1.00 0.00 H new ATOM 0 HD2 LYS A 112 7.139 3.364 -14.972 1.00 0.00 H new ATOM 0 HD3 LYS A 112 5.841 3.371 -16.149 1.00 0.00 H new ATOM 0 HE2 LYS A 112 4.952 5.448 -15.297 1.00 0.00 H new ATOM 0 HE3 LYS A 112 5.972 5.380 -13.873 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 6.844 6.925 -15.502 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 7.925 5.633 -15.293 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 6.937 5.699 -16.673 1.00 0.00 H new ATOM 1702 N GLU A 113 6.579 -0.206 -13.782 1.00 0.00 N ATOM 1703 CA GLU A 113 7.829 -0.630 -13.162 1.00 0.00 C ATOM 1704 C GLU A 113 8.245 0.339 -12.058 1.00 0.00 C ATOM 1705 O GLU A 113 8.740 -0.074 -11.009 1.00 0.00 O ATOM 1706 CB GLU A 113 8.937 -0.730 -14.212 1.00 0.00 C ATOM 1707 CG GLU A 113 9.207 0.577 -14.938 1.00 0.00 C ATOM 1708 CD GLU A 113 9.967 0.377 -16.235 1.00 0.00 C ATOM 1709 OE1 GLU A 113 11.202 0.196 -16.178 1.00 0.00 O ATOM 1710 OE2 GLU A 113 9.327 0.401 -17.307 1.00 0.00 O ATOM 0 H GLU A 113 6.609 -0.156 -14.800 1.00 0.00 H new ATOM 0 HA GLU A 113 7.669 -1.613 -12.718 1.00 0.00 H new ATOM 0 HB2 GLU A 113 9.855 -1.064 -13.728 1.00 0.00 H new ATOM 0 HB3 GLU A 113 8.666 -1.492 -14.942 1.00 0.00 H new ATOM 0 HG2 GLU A 113 8.260 1.074 -15.149 1.00 0.00 H new ATOM 0 HG3 GLU A 113 9.776 1.240 -14.286 1.00 0.00 H new ATOM 1717 N ASP A 114 8.040 1.628 -12.303 1.00 0.00 N ATOM 1718 CA ASP A 114 8.393 2.657 -11.332 1.00 0.00 C ATOM 1719 C ASP A 114 7.172 3.490 -10.955 1.00 0.00 C ATOM 1720 O ASP A 114 7.275 4.695 -10.730 1.00 0.00 O ATOM 1721 CB ASP A 114 9.490 3.563 -11.891 1.00 0.00 C ATOM 1722 CG ASP A 114 10.518 3.943 -10.843 1.00 0.00 C ATOM 1723 OD1 ASP A 114 10.115 4.449 -9.775 1.00 0.00 O ATOM 1724 OD2 ASP A 114 11.724 3.735 -11.091 1.00 0.00 O ATOM 0 H ASP A 114 7.631 1.986 -13.166 1.00 0.00 H new ATOM 0 HA ASP A 114 8.765 2.162 -10.435 1.00 0.00 H new ATOM 0 HB2 ASP A 114 9.988 3.057 -12.718 1.00 0.00 H new ATOM 0 HB3 ASP A 114 9.038 4.468 -12.297 1.00 0.00 H new ATOM 1729 N GLY A 115 6.014 2.838 -10.889 1.00 0.00 N ATOM 1730 CA GLY A 115 4.790 3.535 -10.540 1.00 0.00 C ATOM 1731 C GLY A 115 4.816 4.081 -9.126 1.00 0.00 C ATOM 1732 O GLY A 115 5.314 3.427 -8.210 1.00 0.00 O ATOM 0 H GLY A 115 5.903 1.841 -11.071 1.00 0.00 H new ATOM 0 HA2 GLY A 115 4.631 4.355 -11.240 1.00 0.00 H new ATOM 0 HA3 GLY A 115 3.945 2.855 -10.648 1.00 0.00 H new ATOM 1736 N ILE A 116 4.279 5.284 -8.949 1.00 0.00 N ATOM 1737 CA ILE A 116 4.244 5.918 -7.636 1.00 0.00 C ATOM 1738 C ILE A 116 2.906 6.608 -7.395 1.00 0.00 C ATOM 1739 O ILE A 116 2.362 7.260 -8.287 1.00 0.00 O ATOM 1740 CB ILE A 116 5.377 6.949 -7.479 1.00 0.00 C ATOM 1741 CG1 ILE A 116 5.297 7.621 -6.107 1.00 0.00 C ATOM 1742 CG2 ILE A 116 5.306 7.987 -8.588 1.00 0.00 C ATOM 1743 CD1 ILE A 116 5.431 6.654 -4.951 1.00 0.00 C ATOM 0 H ILE A 116 3.863 5.839 -9.697 1.00 0.00 H new ATOM 0 HA ILE A 116 4.380 5.127 -6.899 1.00 0.00 H new ATOM 0 HB ILE A 116 6.333 6.431 -7.554 1.00 0.00 H new ATOM 0 HG12 ILE A 116 6.082 8.373 -6.034 1.00 0.00 H new ATOM 0 HG13 ILE A 116 4.345 8.145 -6.023 1.00 0.00 H new ATOM 0 HG21 ILE A 116 6.113 8.709 -8.463 1.00 0.00 H new ATOM 0 HG22 ILE A 116 5.406 7.494 -9.555 1.00 0.00 H new ATOM 0 HG23 ILE A 116 4.347 8.504 -8.542 1.00 0.00 H new ATOM 0 HD11 ILE A 116 5.365 7.200 -4.010 1.00 0.00 H new ATOM 0 HD12 ILE A 116 4.630 5.916 -4.999 1.00 0.00 H new ATOM 0 HD13 ILE A 116 6.395 6.148 -5.010 1.00 0.00 H new ATOM 1755 N VAL A 117 2.381 6.462 -6.183 1.00 0.00 N ATOM 1756 CA VAL A 117 1.107 7.074 -5.823 1.00 0.00 C ATOM 1757 C VAL A 117 1.293 8.135 -4.744 1.00 0.00 C ATOM 1758 O VAL A 117 1.435 7.833 -3.559 1.00 0.00 O ATOM 1759 CB VAL A 117 0.100 6.021 -5.323 1.00 0.00 C ATOM 1760 CG1 VAL A 117 -1.297 6.617 -5.238 1.00 0.00 C ATOM 1761 CG2 VAL A 117 0.114 4.799 -6.230 1.00 0.00 C ATOM 0 H VAL A 117 2.818 5.925 -5.434 1.00 0.00 H new ATOM 0 HA VAL A 117 0.714 7.542 -6.726 1.00 0.00 H new ATOM 0 HB VAL A 117 0.396 5.706 -4.322 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -1.995 5.859 -4.883 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -1.292 7.458 -4.545 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -1.606 6.961 -6.225 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -0.603 4.065 -5.863 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -0.157 5.095 -7.243 1.00 0.00 H new ATOM 0 HG23 VAL A 117 1.112 4.361 -6.235 1.00 0.00 H new ATOM 1771 N PRO A 118 1.293 9.410 -5.162 1.00 0.00 N ATOM 1772 CA PRO A 118 1.459 10.543 -4.247 1.00 0.00 C ATOM 1773 C PRO A 118 0.250 10.737 -3.338 1.00 0.00 C ATOM 1774 O PRO A 118 -0.825 11.129 -3.794 1.00 0.00 O ATOM 1775 CB PRO A 118 1.618 11.739 -5.188 1.00 0.00 C ATOM 1776 CG PRO A 118 0.926 11.328 -6.442 1.00 0.00 C ATOM 1777 CD PRO A 118 1.129 9.843 -6.560 1.00 0.00 C ATOM 0 HA PRO A 118 2.302 10.400 -3.571 1.00 0.00 H new ATOM 0 HB2 PRO A 118 1.170 12.638 -4.765 1.00 0.00 H new ATOM 0 HB3 PRO A 118 2.669 11.962 -5.371 1.00 0.00 H new ATOM 0 HG2 PRO A 118 -0.135 11.575 -6.401 1.00 0.00 H new ATOM 0 HG3 PRO A 118 1.341 11.848 -7.305 1.00 0.00 H new ATOM 0 HD2 PRO A 118 0.276 9.357 -7.034 1.00 0.00 H new ATOM 0 HD3 PRO A 118 2.007 9.604 -7.161 1.00 0.00 H new ATOM 1785 N LEU A 119 0.432 10.461 -2.052 1.00 0.00 N ATOM 1786 CA LEU A 119 -0.645 10.606 -1.079 1.00 0.00 C ATOM 1787 C LEU A 119 -0.599 11.980 -0.417 1.00 0.00 C ATOM 1788 O LEU A 119 0.179 12.846 -0.815 1.00 0.00 O ATOM 1789 CB LEU A 119 -0.549 9.511 -0.015 1.00 0.00 C ATOM 1790 CG LEU A 119 -0.528 8.072 -0.532 1.00 0.00 C ATOM 1791 CD1 LEU A 119 0.048 7.136 0.518 1.00 0.00 C ATOM 1792 CD2 LEU A 119 -1.928 7.630 -0.934 1.00 0.00 C ATOM 0 H LEU A 119 1.315 10.136 -1.658 1.00 0.00 H new ATOM 0 HA LEU A 119 -1.594 10.509 -1.607 1.00 0.00 H new ATOM 0 HB2 LEU A 119 0.355 9.679 0.570 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -1.393 9.619 0.666 1.00 0.00 H new ATOM 0 HG LEU A 119 0.111 8.032 -1.414 1.00 0.00 H new ATOM 0 HD11 LEU A 119 0.055 6.117 0.132 1.00 0.00 H new ATOM 0 HD12 LEU A 119 1.067 7.440 0.757 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -0.564 7.179 1.419 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -1.895 6.604 -1.300 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -2.589 7.686 -0.069 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -2.304 8.283 -1.721 1.00 0.00 H new ATOM 1804 N ARG A 120 -1.437 12.170 0.597 1.00 0.00 N ATOM 1805 CA ARG A 120 -1.492 13.438 1.315 1.00 0.00 C ATOM 1806 C ARG A 120 -1.069 13.257 2.770 1.00 0.00 C ATOM 1807 O ARG A 120 -1.878 12.886 3.621 1.00 0.00 O ATOM 1808 CB ARG A 120 -2.903 14.024 1.252 1.00 0.00 C ATOM 1809 CG ARG A 120 -3.998 13.009 1.536 1.00 0.00 C ATOM 1810 CD ARG A 120 -5.377 13.579 1.245 1.00 0.00 C ATOM 1811 NE ARG A 120 -5.554 13.886 -0.172 1.00 0.00 N ATOM 1812 CZ ARG A 120 -6.715 14.250 -0.705 1.00 0.00 C ATOM 1813 NH1 ARG A 120 -7.795 14.352 0.056 1.00 0.00 N ATOM 1814 NH2 ARG A 120 -6.796 14.513 -2.003 1.00 0.00 N ATOM 0 H ARG A 120 -2.087 11.462 0.940 1.00 0.00 H new ATOM 0 HA ARG A 120 -0.798 14.129 0.836 1.00 0.00 H new ATOM 0 HB2 ARG A 120 -2.981 14.840 1.971 1.00 0.00 H new ATOM 0 HB3 ARG A 120 -3.065 14.453 0.263 1.00 0.00 H new ATOM 0 HG2 ARG A 120 -3.836 12.118 0.929 1.00 0.00 H new ATOM 0 HG3 ARG A 120 -3.945 12.698 2.579 1.00 0.00 H new ATOM 0 HD2 ARG A 120 -6.138 12.865 1.559 1.00 0.00 H new ATOM 0 HD3 ARG A 120 -5.527 14.484 1.834 1.00 0.00 H new ATOM 0 HE ARG A 120 -4.742 13.817 -0.786 1.00 0.00 H new ATOM 0 HH11 ARG A 120 -7.736 14.151 1.054 1.00 0.00 H new ATOM 0 HH12 ARG A 120 -8.685 14.632 -0.356 1.00 0.00 H new ATOM 0 HH21 ARG A 120 -5.967 14.436 -2.592 1.00 0.00 H new ATOM 0 HH22 ARG A 120 -7.688 14.792 -2.412 1.00 0.00 H new ATOM 1828 N TYR A 121 0.202 13.522 3.049 1.00 0.00 N ATOM 1829 CA TYR A 121 0.733 13.386 4.400 1.00 0.00 C ATOM 1830 C TYR A 121 -0.062 14.236 5.386 1.00 0.00 C ATOM 1831 O TYR A 121 -0.075 13.967 6.587 1.00 0.00 O ATOM 1832 CB TYR A 121 2.208 13.790 4.434 1.00 0.00 C ATOM 1833 CG TYR A 121 2.425 15.286 4.461 1.00 0.00 C ATOM 1834 CD1 TYR A 121 1.883 16.105 3.478 1.00 0.00 C ATOM 1835 CD2 TYR A 121 3.172 15.881 5.470 1.00 0.00 C ATOM 1836 CE1 TYR A 121 2.079 17.472 3.498 1.00 0.00 C ATOM 1837 CE2 TYR A 121 3.373 17.248 5.499 1.00 0.00 C ATOM 1838 CZ TYR A 121 2.825 18.039 4.511 1.00 0.00 C ATOM 1839 OH TYR A 121 3.022 19.401 4.536 1.00 0.00 O ATOM 0 H TYR A 121 0.884 13.832 2.357 1.00 0.00 H new ATOM 0 HA TYR A 121 0.643 12.341 4.695 1.00 0.00 H new ATOM 0 HB2 TYR A 121 2.677 13.347 5.313 1.00 0.00 H new ATOM 0 HB3 TYR A 121 2.710 13.374 3.561 1.00 0.00 H new ATOM 0 HD1 TYR A 121 1.298 15.665 2.684 1.00 0.00 H new ATOM 0 HD2 TYR A 121 3.603 15.265 6.245 1.00 0.00 H new ATOM 0 HE1 TYR A 121 1.651 18.093 2.725 1.00 0.00 H new ATOM 0 HE2 TYR A 121 3.956 17.694 6.291 1.00 0.00 H new ATOM 0 HH TYR A 121 3.568 19.638 5.315 1.00 0.00 H new ATOM 1849 N VAL A 122 -0.725 15.265 4.868 1.00 0.00 N ATOM 1850 CA VAL A 122 -1.525 16.156 5.701 1.00 0.00 C ATOM 1851 C VAL A 122 -2.589 15.381 6.471 1.00 0.00 C ATOM 1852 O VAL A 122 -3.092 15.844 7.494 1.00 0.00 O ATOM 1853 CB VAL A 122 -2.211 17.247 4.858 1.00 0.00 C ATOM 1854 CG1 VAL A 122 -3.134 16.622 3.823 1.00 0.00 C ATOM 1855 CG2 VAL A 122 -2.975 18.210 5.754 1.00 0.00 C ATOM 0 H VAL A 122 -0.724 15.502 3.876 1.00 0.00 H new ATOM 0 HA VAL A 122 -0.841 16.628 6.406 1.00 0.00 H new ATOM 0 HB VAL A 122 -1.442 17.810 4.330 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -3.610 17.409 3.237 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -2.555 15.977 3.162 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -3.899 16.032 4.327 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -3.454 18.974 5.142 1.00 0.00 H new ATOM 0 HG22 VAL A 122 -3.735 17.663 6.311 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -2.284 18.684 6.452 1.00 0.00 H new ATOM 1865 N LYS A 123 -2.927 14.197 5.972 1.00 0.00 N ATOM 1866 CA LYS A 123 -3.929 13.354 6.613 1.00 0.00 C ATOM 1867 C LYS A 123 -3.271 12.212 7.379 1.00 0.00 C ATOM 1868 O LYS A 123 -3.790 11.753 8.397 1.00 0.00 O ATOM 1869 CB LYS A 123 -4.895 12.791 5.568 1.00 0.00 C ATOM 1870 CG LYS A 123 -5.617 13.861 4.768 1.00 0.00 C ATOM 1871 CD LYS A 123 -6.914 14.280 5.440 1.00 0.00 C ATOM 1872 CE LYS A 123 -6.727 15.537 6.276 1.00 0.00 C ATOM 1873 NZ LYS A 123 -7.999 16.297 6.425 1.00 0.00 N ATOM 0 H LYS A 123 -2.521 13.799 5.125 1.00 0.00 H new ATOM 0 HA LYS A 123 -4.485 13.969 7.320 1.00 0.00 H new ATOM 0 HB2 LYS A 123 -4.342 12.148 4.883 1.00 0.00 H new ATOM 0 HB3 LYS A 123 -5.633 12.163 6.068 1.00 0.00 H new ATOM 0 HG2 LYS A 123 -4.969 14.730 4.653 1.00 0.00 H new ATOM 0 HG3 LYS A 123 -5.829 13.487 3.767 1.00 0.00 H new ATOM 0 HD2 LYS A 123 -7.678 14.456 4.682 1.00 0.00 H new ATOM 0 HD3 LYS A 123 -7.275 13.470 6.074 1.00 0.00 H new ATOM 0 HE2 LYS A 123 -6.349 15.265 7.261 1.00 0.00 H new ATOM 0 HE3 LYS A 123 -5.975 16.174 5.811 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 -7.830 17.146 7.001 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 -8.347 16.578 5.486 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 -8.709 15.697 6.892 1.00 0.00 H new ATOM 1887 N PHE A 124 -2.124 11.757 6.885 1.00 0.00 N ATOM 1888 CA PHE A 124 -1.394 10.669 7.525 1.00 0.00 C ATOM 1889 C PHE A 124 -0.231 11.207 8.354 1.00 0.00 C ATOM 1890 O PHE A 124 0.834 10.594 8.418 1.00 0.00 O ATOM 1891 CB PHE A 124 -0.873 9.688 6.472 1.00 0.00 C ATOM 1892 CG PHE A 124 -1.875 9.373 5.398 1.00 0.00 C ATOM 1893 CD1 PHE A 124 -2.929 8.509 5.647 1.00 0.00 C ATOM 1894 CD2 PHE A 124 -1.764 9.942 4.140 1.00 0.00 C ATOM 1895 CE1 PHE A 124 -3.852 8.218 4.661 1.00 0.00 C ATOM 1896 CE2 PHE A 124 -2.684 9.655 3.149 1.00 0.00 C ATOM 1897 CZ PHE A 124 -3.730 8.792 3.411 1.00 0.00 C ATOM 0 H PHE A 124 -1.680 12.125 6.044 1.00 0.00 H new ATOM 0 HA PHE A 124 -2.081 10.147 8.191 1.00 0.00 H new ATOM 0 HB2 PHE A 124 0.023 10.104 6.011 1.00 0.00 H new ATOM 0 HB3 PHE A 124 -0.577 8.762 6.965 1.00 0.00 H new ATOM 0 HD1 PHE A 124 -3.030 8.058 6.623 1.00 0.00 H new ATOM 0 HD2 PHE A 124 -0.948 10.618 3.931 1.00 0.00 H new ATOM 0 HE1 PHE A 124 -4.668 7.542 4.868 1.00 0.00 H new ATOM 0 HE2 PHE A 124 -2.585 10.105 2.172 1.00 0.00 H new ATOM 0 HZ PHE A 124 -4.451 8.566 2.640 1.00 0.00 H new ATOM 1907 N GLN A 125 -0.445 12.356 8.986 1.00 0.00 N ATOM 1908 CA GLN A 125 0.585 12.977 9.810 1.00 0.00 C ATOM 1909 C GLN A 125 1.079 12.013 10.883 1.00 0.00 C ATOM 1910 O GLN A 125 2.206 12.126 11.362 1.00 0.00 O ATOM 1911 CB GLN A 125 0.047 14.252 10.461 1.00 0.00 C ATOM 1912 CG GLN A 125 -0.457 15.280 9.461 1.00 0.00 C ATOM 1913 CD GLN A 125 0.631 16.230 9.001 1.00 0.00 C ATOM 1914 OE1 GLN A 125 0.712 17.369 9.462 1.00 0.00 O ATOM 1915 NE2 GLN A 125 1.475 15.766 8.088 1.00 0.00 N ATOM 0 H GLN A 125 -1.322 12.876 8.943 1.00 0.00 H new ATOM 0 HA GLN A 125 1.425 13.234 9.165 1.00 0.00 H new ATOM 0 HB2 GLN A 125 -0.765 13.989 11.139 1.00 0.00 H new ATOM 0 HB3 GLN A 125 0.835 14.701 11.066 1.00 0.00 H new ATOM 0 HG2 GLN A 125 -0.874 14.765 8.596 1.00 0.00 H new ATOM 0 HG3 GLN A 125 -1.267 15.853 9.912 1.00 0.00 H new ATOM 0 HE21 GLN A 125 1.371 14.815 7.734 1.00 0.00 H new ATOM 0 HE22 GLN A 125 2.228 16.360 7.741 1.00 0.00 H new ATOM 1924 N ASN A 126 0.226 11.065 11.257 1.00 0.00 N ATOM 1925 CA ASN A 126 0.575 10.081 12.276 1.00 0.00 C ATOM 1926 C ASN A 126 -0.403 8.910 12.259 1.00 0.00 C ATOM 1927 O ASN A 126 -1.457 8.958 12.894 1.00 0.00 O ATOM 1928 CB ASN A 126 0.586 10.731 13.660 1.00 0.00 C ATOM 1929 CG ASN A 126 1.203 9.834 14.716 1.00 0.00 C ATOM 1930 OD1 ASN A 126 2.320 10.074 15.174 1.00 0.00 O ATOM 1931 ND2 ASN A 126 0.476 8.793 15.106 1.00 0.00 N ATOM 0 H ASN A 126 -0.712 10.957 10.870 1.00 0.00 H new ATOM 0 HA ASN A 126 1.572 9.702 12.053 1.00 0.00 H new ATOM 0 HB2 ASN A 126 1.141 11.668 13.614 1.00 0.00 H new ATOM 0 HB3 ASN A 126 -0.435 10.979 13.950 1.00 0.00 H new ATOM 0 HD21 ASN A 126 0.839 8.154 15.813 1.00 0.00 H new ATOM 0 HD22 ASN A 126 -0.445 8.633 14.699 1.00 0.00 H new ATOM 1938 N VAL A 127 -0.047 7.858 11.528 1.00 0.00 N ATOM 1939 CA VAL A 127 -0.891 6.674 11.430 1.00 0.00 C ATOM 1940 C VAL A 127 -0.178 5.443 11.978 1.00 0.00 C ATOM 1941 O VAL A 127 1.025 5.274 11.788 1.00 0.00 O ATOM 1942 CB VAL A 127 -1.311 6.404 9.973 1.00 0.00 C ATOM 1943 CG1 VAL A 127 -1.791 7.685 9.309 1.00 0.00 C ATOM 1944 CG2 VAL A 127 -0.160 5.788 9.192 1.00 0.00 C ATOM 0 H VAL A 127 0.821 7.802 10.995 1.00 0.00 H new ATOM 0 HA VAL A 127 -1.781 6.870 12.027 1.00 0.00 H new ATOM 0 HB VAL A 127 -2.138 5.694 9.978 1.00 0.00 H new ATOM 0 HG11 VAL A 127 -2.083 7.474 8.280 1.00 0.00 H new ATOM 0 HG12 VAL A 127 -2.647 8.080 9.856 1.00 0.00 H new ATOM 0 HG13 VAL A 127 -0.987 8.421 9.314 1.00 0.00 H new ATOM 0 HG21 VAL A 127 -0.475 5.604 8.165 1.00 0.00 H new ATOM 0 HG22 VAL A 127 0.689 6.472 9.195 1.00 0.00 H new ATOM 0 HG23 VAL A 127 0.132 4.846 9.656 1.00 0.00 H new ATOM 1954 N ASN A 128 -0.930 4.586 12.661 1.00 0.00 N ATOM 1955 CA ASN A 128 -0.370 3.369 13.237 1.00 0.00 C ATOM 1956 C ASN A 128 -0.931 2.130 12.546 1.00 0.00 C ATOM 1957 O ASN A 128 -0.392 1.032 12.683 1.00 0.00 O ATOM 1958 CB ASN A 128 -0.666 3.308 14.737 1.00 0.00 C ATOM 1959 CG ASN A 128 -0.360 1.946 15.332 1.00 0.00 C ATOM 1960 OD1 ASN A 128 0.735 1.711 15.842 1.00 0.00 O ATOM 1961 ND2 ASN A 128 -1.330 1.042 15.268 1.00 0.00 N ATOM 0 H ASN A 128 -1.928 4.712 12.829 1.00 0.00 H new ATOM 0 HA ASN A 128 0.709 3.389 13.086 1.00 0.00 H new ATOM 0 HB2 ASN A 128 -0.077 4.067 15.252 1.00 0.00 H new ATOM 0 HB3 ASN A 128 -1.715 3.549 14.908 1.00 0.00 H new ATOM 0 HD21 ASN A 128 -1.183 0.108 15.651 1.00 0.00 H new ATOM 0 HD22 ASN A 128 -2.222 1.281 14.836 1.00 0.00 H new ATOM 1968 N SER A 129 -2.016 2.316 11.801 1.00 0.00 N ATOM 1969 CA SER A 129 -2.653 1.213 11.090 1.00 0.00 C ATOM 1970 C SER A 129 -3.317 1.705 9.807 1.00 0.00 C ATOM 1971 O SER A 129 -4.211 2.550 9.842 1.00 0.00 O ATOM 1972 CB SER A 129 -3.690 0.532 11.985 1.00 0.00 C ATOM 1973 OG SER A 129 -4.614 1.474 12.503 1.00 0.00 O ATOM 0 H SER A 129 -2.472 3.219 11.674 1.00 0.00 H new ATOM 0 HA SER A 129 -1.881 0.490 10.825 1.00 0.00 H new ATOM 0 HB2 SER A 129 -4.223 -0.229 11.415 1.00 0.00 H new ATOM 0 HB3 SER A 129 -3.187 0.022 12.806 1.00 0.00 H new ATOM 0 HG SER A 129 -4.817 2.144 11.817 1.00 0.00 H new ATOM 1979 N VAL A 130 -2.871 1.169 8.675 1.00 0.00 N ATOM 1980 CA VAL A 130 -3.421 1.552 7.380 1.00 0.00 C ATOM 1981 C VAL A 130 -3.959 0.338 6.631 1.00 0.00 C ATOM 1982 O VAL A 130 -3.386 -0.750 6.696 1.00 0.00 O ATOM 1983 CB VAL A 130 -2.364 2.253 6.507 1.00 0.00 C ATOM 1984 CG1 VAL A 130 -1.110 1.400 6.398 1.00 0.00 C ATOM 1985 CG2 VAL A 130 -2.931 2.561 5.129 1.00 0.00 C ATOM 0 H VAL A 130 -2.131 0.469 8.629 1.00 0.00 H new ATOM 0 HA VAL A 130 -4.238 2.246 7.576 1.00 0.00 H new ATOM 0 HB VAL A 130 -2.093 3.196 6.982 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -0.375 1.912 5.777 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -0.694 1.236 7.392 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -1.361 0.440 5.946 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -2.171 3.056 4.525 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -3.232 1.633 4.644 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -3.797 3.215 5.230 1.00 0.00 H new ATOM 1995 N THR A 131 -5.065 0.531 5.919 1.00 0.00 N ATOM 1996 CA THR A 131 -5.682 -0.548 5.158 1.00 0.00 C ATOM 1997 C THR A 131 -6.049 -0.088 3.752 1.00 0.00 C ATOM 1998 O THR A 131 -6.442 1.061 3.547 1.00 0.00 O ATOM 1999 CB THR A 131 -6.946 -1.079 5.859 1.00 0.00 C ATOM 2000 OG1 THR A 131 -6.606 -1.613 7.143 1.00 0.00 O ATOM 2001 CG2 THR A 131 -7.620 -2.154 5.019 1.00 0.00 C ATOM 0 H THR A 131 -5.552 1.425 5.854 1.00 0.00 H new ATOM 0 HA THR A 131 -4.947 -1.351 5.095 1.00 0.00 H new ATOM 0 HB THR A 131 -7.641 -0.249 5.984 1.00 0.00 H new ATOM 0 HG1 THR A 131 -7.378 -2.088 7.515 1.00 0.00 H new ATOM 0 HG21 THR A 131 -8.510 -2.514 5.535 1.00 0.00 H new ATOM 0 HG22 THR A 131 -7.904 -1.736 4.053 1.00 0.00 H new ATOM 0 HG23 THR A 131 -6.929 -2.983 4.867 1.00 0.00 H new ATOM 2009 N ILE A 132 -5.921 -0.992 2.786 1.00 0.00 N ATOM 2010 CA ILE A 132 -6.241 -0.678 1.399 1.00 0.00 C ATOM 2011 C ILE A 132 -7.232 -1.684 0.823 1.00 0.00 C ATOM 2012 O ILE A 132 -6.970 -2.887 0.802 1.00 0.00 O ATOM 2013 CB ILE A 132 -4.977 -0.658 0.520 1.00 0.00 C ATOM 2014 CG1 ILE A 132 -4.013 0.429 0.999 1.00 0.00 C ATOM 2015 CG2 ILE A 132 -5.350 -0.437 -0.939 1.00 0.00 C ATOM 2016 CD1 ILE A 132 -2.578 -0.037 1.099 1.00 0.00 C ATOM 0 H ILE A 132 -5.598 -1.947 2.939 1.00 0.00 H new ATOM 0 HA ILE A 132 -6.691 0.315 1.396 1.00 0.00 H new ATOM 0 HB ILE A 132 -4.478 -1.623 0.605 1.00 0.00 H new ATOM 0 HG12 ILE A 132 -4.065 1.276 0.315 1.00 0.00 H new ATOM 0 HG13 ILE A 132 -4.339 0.788 1.975 1.00 0.00 H new ATOM 0 HG21 ILE A 132 -4.446 -0.425 -1.548 1.00 0.00 H new ATOM 0 HG22 ILE A 132 -6.003 -1.243 -1.274 1.00 0.00 H new ATOM 0 HG23 ILE A 132 -5.869 0.516 -1.042 1.00 0.00 H new ATOM 0 HD11 ILE A 132 -1.952 0.785 1.444 1.00 0.00 H new ATOM 0 HD12 ILE A 132 -2.513 -0.864 1.805 1.00 0.00 H new ATOM 0 HD13 ILE A 132 -2.234 -0.368 0.119 1.00 0.00 H new ATOM 2028 N PHE A 133 -8.370 -1.184 0.354 1.00 0.00 N ATOM 2029 CA PHE A 133 -9.400 -2.039 -0.224 1.00 0.00 C ATOM 2030 C PHE A 133 -9.435 -1.898 -1.743 1.00 0.00 C ATOM 2031 O PHE A 133 -9.607 -0.800 -2.272 1.00 0.00 O ATOM 2032 CB PHE A 133 -10.770 -1.691 0.363 1.00 0.00 C ATOM 2033 CG PHE A 133 -11.914 -2.342 -0.360 1.00 0.00 C ATOM 2034 CD1 PHE A 133 -11.841 -3.671 -0.746 1.00 0.00 C ATOM 2035 CD2 PHE A 133 -13.064 -1.626 -0.652 1.00 0.00 C ATOM 2036 CE1 PHE A 133 -12.892 -4.272 -1.411 1.00 0.00 C ATOM 2037 CE2 PHE A 133 -14.119 -2.223 -1.316 1.00 0.00 C ATOM 2038 CZ PHE A 133 -14.033 -3.548 -1.696 1.00 0.00 C ATOM 0 H PHE A 133 -8.602 -0.191 0.363 1.00 0.00 H new ATOM 0 HA PHE A 133 -9.158 -3.073 0.022 1.00 0.00 H new ATOM 0 HB2 PHE A 133 -10.795 -1.991 1.411 1.00 0.00 H new ATOM 0 HB3 PHE A 133 -10.903 -0.609 0.338 1.00 0.00 H new ATOM 0 HD1 PHE A 133 -10.952 -4.243 -0.524 1.00 0.00 H new ATOM 0 HD2 PHE A 133 -13.137 -0.590 -0.357 1.00 0.00 H new ATOM 0 HE1 PHE A 133 -12.821 -5.308 -1.708 1.00 0.00 H new ATOM 0 HE2 PHE A 133 -15.010 -1.654 -1.537 1.00 0.00 H new ATOM 0 HZ PHE A 133 -14.856 -4.017 -2.215 1.00 0.00 H new ATOM 2048 N VAL A 134 -9.268 -3.018 -2.439 1.00 0.00 N ATOM 2049 CA VAL A 134 -9.280 -3.021 -3.897 1.00 0.00 C ATOM 2050 C VAL A 134 -10.707 -2.999 -4.435 1.00 0.00 C ATOM 2051 O VAL A 134 -11.523 -3.854 -4.091 1.00 0.00 O ATOM 2052 CB VAL A 134 -8.549 -4.253 -4.462 1.00 0.00 C ATOM 2053 CG1 VAL A 134 -8.588 -4.246 -5.983 1.00 0.00 C ATOM 2054 CG2 VAL A 134 -7.115 -4.299 -3.958 1.00 0.00 C ATOM 0 H VAL A 134 -9.123 -3.935 -2.017 1.00 0.00 H new ATOM 0 HA VAL A 134 -8.759 -2.119 -4.220 1.00 0.00 H new ATOM 0 HB VAL A 134 -9.061 -5.150 -4.113 1.00 0.00 H new ATOM 0 HG11 VAL A 134 -8.067 -5.124 -6.364 1.00 0.00 H new ATOM 0 HG12 VAL A 134 -9.624 -4.264 -6.320 1.00 0.00 H new ATOM 0 HG13 VAL A 134 -8.101 -3.345 -6.355 1.00 0.00 H new ATOM 0 HG21 VAL A 134 -6.613 -5.176 -4.367 1.00 0.00 H new ATOM 0 HG22 VAL A 134 -6.589 -3.399 -4.276 1.00 0.00 H new ATOM 0 HG23 VAL A 134 -7.114 -4.355 -2.869 1.00 0.00 H new ATOM 2064 N GLN A 135 -10.999 -2.017 -5.281 1.00 0.00 N ATOM 2065 CA GLN A 135 -12.328 -1.884 -5.867 1.00 0.00 C ATOM 2066 C GLN A 135 -12.308 -2.240 -7.350 1.00 0.00 C ATOM 2067 O GLN A 135 -12.955 -3.195 -7.778 1.00 0.00 O ATOM 2068 CB GLN A 135 -12.851 -0.459 -5.679 1.00 0.00 C ATOM 2069 CG GLN A 135 -14.345 -0.391 -5.406 1.00 0.00 C ATOM 2070 CD GLN A 135 -14.747 0.876 -4.677 1.00 0.00 C ATOM 2071 OE1 GLN A 135 -14.572 1.983 -5.188 1.00 0.00 O ATOM 2072 NE2 GLN A 135 -15.291 0.721 -3.475 1.00 0.00 N ATOM 0 H GLN A 135 -10.334 -1.302 -5.576 1.00 0.00 H new ATOM 0 HA GLN A 135 -12.994 -2.578 -5.355 1.00 0.00 H new ATOM 0 HB2 GLN A 135 -12.317 0.009 -4.852 1.00 0.00 H new ATOM 0 HB3 GLN A 135 -12.626 0.123 -6.573 1.00 0.00 H new ATOM 0 HG2 GLN A 135 -14.886 -0.450 -6.350 1.00 0.00 H new ATOM 0 HG3 GLN A 135 -14.642 -1.256 -4.814 1.00 0.00 H new ATOM 0 HE21 GLN A 135 -15.418 -0.215 -3.089 1.00 0.00 H new ATOM 0 HE22 GLN A 135 -15.582 1.538 -2.938 1.00 0.00 H new ATOM 2081 N SER A 136 -11.560 -1.465 -8.129 1.00 0.00 N ATOM 2082 CA SER A 136 -11.459 -1.696 -9.565 1.00 0.00 C ATOM 2083 C SER A 136 -9.999 -1.779 -10.000 1.00 0.00 C ATOM 2084 O SER A 136 -9.093 -1.441 -9.240 1.00 0.00 O ATOM 2085 CB SER A 136 -12.169 -0.580 -10.334 1.00 0.00 C ATOM 2086 OG SER A 136 -13.007 -1.111 -11.346 1.00 0.00 O ATOM 0 H SER A 136 -11.015 -0.672 -7.790 1.00 0.00 H new ATOM 0 HA SER A 136 -11.942 -2.647 -9.790 1.00 0.00 H new ATOM 0 HB2 SER A 136 -12.762 0.021 -9.644 1.00 0.00 H new ATOM 0 HB3 SER A 136 -11.430 0.085 -10.781 1.00 0.00 H new ATOM 0 HG SER A 136 -13.450 -0.378 -11.822 1.00 0.00 H new ATOM 2092 N ASN A 137 -9.779 -2.232 -11.230 1.00 0.00 N ATOM 2093 CA ASN A 137 -8.430 -2.361 -11.768 1.00 0.00 C ATOM 2094 C ASN A 137 -8.187 -1.343 -12.877 1.00 0.00 C ATOM 2095 O ASN A 137 -9.029 -0.485 -13.141 1.00 0.00 O ATOM 2096 CB ASN A 137 -8.204 -3.777 -12.302 1.00 0.00 C ATOM 2097 CG ASN A 137 -9.452 -4.634 -12.212 1.00 0.00 C ATOM 2098 OD1 ASN A 137 -10.485 -4.309 -12.797 1.00 0.00 O ATOM 2099 ND2 ASN A 137 -9.361 -5.737 -11.477 1.00 0.00 N ATOM 0 H ASN A 137 -10.518 -2.516 -11.873 1.00 0.00 H new ATOM 0 HA ASN A 137 -7.724 -2.168 -10.960 1.00 0.00 H new ATOM 0 HB2 ASN A 137 -7.878 -3.723 -13.341 1.00 0.00 H new ATOM 0 HB3 ASN A 137 -7.400 -4.251 -11.739 1.00 0.00 H new ATOM 0 HD21 ASN A 137 -10.168 -6.353 -11.380 1.00 0.00 H new ATOM 0 HD22 ASN A 137 -8.484 -5.967 -11.009 1.00 0.00 H new ATOM 2106 N GLN A 138 -7.030 -1.445 -13.524 1.00 0.00 N ATOM 2107 CA GLN A 138 -6.676 -0.533 -14.605 1.00 0.00 C ATOM 2108 C GLN A 138 -7.594 -0.731 -15.807 1.00 0.00 C ATOM 2109 O GLN A 138 -8.286 0.193 -16.231 1.00 0.00 O ATOM 2110 CB GLN A 138 -5.219 -0.742 -15.021 1.00 0.00 C ATOM 2111 CG GLN A 138 -4.233 -0.610 -13.872 1.00 0.00 C ATOM 2112 CD GLN A 138 -4.008 0.831 -13.459 1.00 0.00 C ATOM 2113 OE1 GLN A 138 -3.658 1.678 -14.282 1.00 0.00 O ATOM 2114 NE2 GLN A 138 -4.208 1.118 -12.178 1.00 0.00 N ATOM 0 H GLN A 138 -6.322 -2.150 -13.318 1.00 0.00 H new ATOM 0 HA GLN A 138 -6.799 0.487 -14.241 1.00 0.00 H new ATOM 0 HB2 GLN A 138 -5.115 -1.732 -15.466 1.00 0.00 H new ATOM 0 HB3 GLN A 138 -4.963 -0.017 -15.794 1.00 0.00 H new ATOM 0 HG2 GLN A 138 -4.600 -1.176 -13.016 1.00 0.00 H new ATOM 0 HG3 GLN A 138 -3.281 -1.054 -14.163 1.00 0.00 H new ATOM 0 HE21 GLN A 138 -4.498 0.385 -11.530 1.00 0.00 H new ATOM 0 HE22 GLN A 138 -4.072 2.071 -11.842 1.00 0.00 H new ATOM 2123 N GLY A 139 -7.594 -1.944 -16.352 1.00 0.00 N ATOM 2124 CA GLY A 139 -8.431 -2.241 -17.500 1.00 0.00 C ATOM 2125 C GLY A 139 -9.723 -2.931 -17.112 1.00 0.00 C ATOM 2126 O GLY A 139 -10.279 -3.705 -17.892 1.00 0.00 O ATOM 0 H GLY A 139 -7.030 -2.726 -16.019 1.00 0.00 H new ATOM 0 HA2 GLY A 139 -8.661 -1.315 -18.027 1.00 0.00 H new ATOM 0 HA3 GLY A 139 -7.879 -2.874 -18.194 1.00 0.00 H new ATOM 2130 N GLU A 140 -10.202 -2.653 -15.904 1.00 0.00 N ATOM 2131 CA GLU A 140 -11.436 -3.255 -15.414 1.00 0.00 C ATOM 2132 C GLU A 140 -11.400 -4.773 -15.569 1.00 0.00 C ATOM 2133 O GLU A 140 -12.403 -5.396 -15.914 1.00 0.00 O ATOM 2134 CB GLU A 140 -12.641 -2.684 -16.164 1.00 0.00 C ATOM 2135 CG GLU A 140 -13.036 -1.289 -15.709 1.00 0.00 C ATOM 2136 CD GLU A 140 -14.487 -0.965 -16.012 1.00 0.00 C ATOM 2137 OE1 GLU A 140 -15.200 -1.858 -16.515 1.00 0.00 O ATOM 2138 OE2 GLU A 140 -14.907 0.180 -15.746 1.00 0.00 O ATOM 0 H GLU A 140 -9.754 -2.015 -15.247 1.00 0.00 H new ATOM 0 HA GLU A 140 -11.530 -3.017 -14.354 1.00 0.00 H new ATOM 0 HB2 GLU A 140 -12.416 -2.659 -17.230 1.00 0.00 H new ATOM 0 HB3 GLU A 140 -13.491 -3.354 -16.033 1.00 0.00 H new ATOM 0 HG2 GLU A 140 -12.864 -1.198 -14.637 1.00 0.00 H new ATOM 0 HG3 GLU A 140 -12.394 -0.556 -16.198 1.00 0.00 H new ATOM 2145 N GLU A 141 -10.235 -5.360 -15.312 1.00 0.00 N ATOM 2146 CA GLU A 141 -10.067 -6.804 -15.424 1.00 0.00 C ATOM 2147 C GLU A 141 -11.032 -7.538 -14.497 1.00 0.00 C ATOM 2148 O GLU A 141 -11.881 -6.921 -13.854 1.00 0.00 O ATOM 2149 CB GLU A 141 -8.626 -7.200 -15.096 1.00 0.00 C ATOM 2150 CG GLU A 141 -7.601 -6.610 -16.050 1.00 0.00 C ATOM 2151 CD GLU A 141 -7.301 -7.525 -17.222 1.00 0.00 C ATOM 2152 OE1 GLU A 141 -7.339 -8.759 -17.035 1.00 0.00 O ATOM 2153 OE2 GLU A 141 -7.028 -7.006 -18.325 1.00 0.00 O ATOM 0 H GLU A 141 -9.395 -4.858 -15.025 1.00 0.00 H new ATOM 0 HA GLU A 141 -10.289 -7.091 -16.452 1.00 0.00 H new ATOM 0 HB2 GLU A 141 -8.392 -6.879 -14.081 1.00 0.00 H new ATOM 0 HB3 GLU A 141 -8.544 -8.287 -15.114 1.00 0.00 H new ATOM 0 HG2 GLU A 141 -7.967 -5.654 -16.425 1.00 0.00 H new ATOM 0 HG3 GLU A 141 -6.678 -6.408 -15.506 1.00 0.00 H new ATOM 2160 N GLU A 142 -10.894 -8.859 -14.434 1.00 0.00 N ATOM 2161 CA GLU A 142 -11.754 -9.676 -13.586 1.00 0.00 C ATOM 2162 C GLU A 142 -11.162 -9.818 -12.187 1.00 0.00 C ATOM 2163 O GLU A 142 -11.889 -9.976 -11.205 1.00 0.00 O ATOM 2164 CB GLU A 142 -11.955 -11.059 -14.209 1.00 0.00 C ATOM 2165 CG GLU A 142 -10.655 -11.760 -14.569 1.00 0.00 C ATOM 2166 CD GLU A 142 -10.765 -13.270 -14.488 1.00 0.00 C ATOM 2167 OE1 GLU A 142 -11.899 -13.775 -14.351 1.00 0.00 O ATOM 2168 OE2 GLU A 142 -9.718 -13.946 -14.563 1.00 0.00 O ATOM 0 H GLU A 142 -10.196 -9.385 -14.959 1.00 0.00 H new ATOM 0 HA GLU A 142 -12.720 -9.178 -13.504 1.00 0.00 H new ATOM 0 HB2 GLU A 142 -12.514 -11.684 -13.513 1.00 0.00 H new ATOM 0 HB3 GLU A 142 -12.564 -10.958 -15.107 1.00 0.00 H new ATOM 0 HG2 GLU A 142 -10.360 -11.475 -15.579 1.00 0.00 H new ATOM 0 HG3 GLU A 142 -9.866 -11.420 -13.898 1.00 0.00 H new ATOM 2175 N THR A 143 -9.836 -9.760 -12.102 1.00 0.00 N ATOM 2176 CA THR A 143 -9.146 -9.884 -10.825 1.00 0.00 C ATOM 2177 C THR A 143 -7.910 -8.992 -10.779 1.00 0.00 C ATOM 2178 O THR A 143 -7.302 -8.703 -11.810 1.00 0.00 O ATOM 2179 CB THR A 143 -8.725 -11.340 -10.552 1.00 0.00 C ATOM 2180 OG1 THR A 143 -7.645 -11.370 -9.611 1.00 0.00 O ATOM 2181 CG2 THR A 143 -8.301 -12.031 -11.840 1.00 0.00 C ATOM 0 H THR A 143 -9.219 -9.628 -12.903 1.00 0.00 H new ATOM 0 HA THR A 143 -9.849 -9.567 -10.054 1.00 0.00 H new ATOM 0 HB THR A 143 -9.582 -11.871 -10.138 1.00 0.00 H new ATOM 0 HG1 THR A 143 -7.279 -12.278 -9.562 1.00 0.00 H new ATOM 0 HG21 THR A 143 -8.008 -13.058 -11.622 1.00 0.00 H new ATOM 0 HG22 THR A 143 -9.134 -12.032 -12.543 1.00 0.00 H new ATOM 0 HG23 THR A 143 -7.457 -11.498 -12.278 1.00 0.00 H new ATOM 2189 N THR A 144 -7.543 -8.559 -9.577 1.00 0.00 N ATOM 2190 CA THR A 144 -6.380 -7.699 -9.397 1.00 0.00 C ATOM 2191 C THR A 144 -5.197 -8.484 -8.840 1.00 0.00 C ATOM 2192 O THR A 144 -5.258 -9.010 -7.728 1.00 0.00 O ATOM 2193 CB THR A 144 -6.691 -6.522 -8.454 1.00 0.00 C ATOM 2194 OG1 THR A 144 -8.012 -6.029 -8.705 1.00 0.00 O ATOM 2195 CG2 THR A 144 -5.681 -5.400 -8.638 1.00 0.00 C ATOM 0 H THR A 144 -8.035 -8.790 -8.714 1.00 0.00 H new ATOM 0 HA THR A 144 -6.122 -7.307 -10.381 1.00 0.00 H new ATOM 0 HB THR A 144 -6.627 -6.881 -7.427 1.00 0.00 H new ATOM 0 HG1 THR A 144 -8.011 -5.050 -8.656 1.00 0.00 H new ATOM 0 HG21 THR A 144 -5.921 -4.580 -7.961 1.00 0.00 H new ATOM 0 HG22 THR A 144 -4.680 -5.771 -8.417 1.00 0.00 H new ATOM 0 HG23 THR A 144 -5.717 -5.044 -9.667 1.00 0.00 H new ATOM 2203 N ARG A 145 -4.122 -8.557 -9.617 1.00 0.00 N ATOM 2204 CA ARG A 145 -2.926 -9.278 -9.201 1.00 0.00 C ATOM 2205 C ARG A 145 -1.912 -8.330 -8.567 1.00 0.00 C ATOM 2206 O ARG A 145 -1.431 -7.398 -9.212 1.00 0.00 O ATOM 2207 CB ARG A 145 -2.293 -9.993 -10.396 1.00 0.00 C ATOM 2208 CG ARG A 145 -2.675 -11.460 -10.501 1.00 0.00 C ATOM 2209 CD ARG A 145 -1.590 -12.271 -11.191 1.00 0.00 C ATOM 2210 NE ARG A 145 -1.828 -12.394 -12.627 1.00 0.00 N ATOM 2211 CZ ARG A 145 -1.266 -13.326 -13.388 1.00 0.00 C ATOM 2212 NH1 ARG A 145 -0.438 -14.213 -12.853 1.00 0.00 N ATOM 2213 NH2 ARG A 145 -1.532 -13.373 -14.687 1.00 0.00 N ATOM 0 H ARG A 145 -4.055 -8.125 -10.539 1.00 0.00 H new ATOM 0 HA ARG A 145 -3.220 -10.019 -8.457 1.00 0.00 H new ATOM 0 HB2 ARG A 145 -2.589 -9.483 -11.312 1.00 0.00 H new ATOM 0 HB3 ARG A 145 -1.208 -9.913 -10.323 1.00 0.00 H new ATOM 0 HG2 ARG A 145 -2.853 -11.863 -9.504 1.00 0.00 H new ATOM 0 HG3 ARG A 145 -3.609 -11.555 -11.055 1.00 0.00 H new ATOM 0 HD2 ARG A 145 -0.622 -11.798 -11.023 1.00 0.00 H new ATOM 0 HD3 ARG A 145 -1.541 -13.264 -10.745 1.00 0.00 H new ATOM 0 HE ARG A 145 -2.461 -11.727 -13.070 1.00 0.00 H new ATOM 0 HH11 ARG A 145 -0.231 -14.180 -11.855 1.00 0.00 H new ATOM 0 HH12 ARG A 145 -0.008 -14.928 -13.440 1.00 0.00 H new ATOM 0 HH21 ARG A 145 -2.169 -12.693 -15.102 1.00 0.00 H new ATOM 0 HH22 ARG A 145 -1.100 -14.089 -15.271 1.00 0.00 H new ATOM 2227 N ILE A 146 -1.594 -8.573 -7.300 1.00 0.00 N ATOM 2228 CA ILE A 146 -0.638 -7.741 -6.580 1.00 0.00 C ATOM 2229 C ILE A 146 0.751 -8.370 -6.583 1.00 0.00 C ATOM 2230 O ILE A 146 0.897 -9.577 -6.390 1.00 0.00 O ATOM 2231 CB ILE A 146 -1.080 -7.508 -5.123 1.00 0.00 C ATOM 2232 CG1 ILE A 146 -2.599 -7.340 -5.048 1.00 0.00 C ATOM 2233 CG2 ILE A 146 -0.378 -6.289 -4.544 1.00 0.00 C ATOM 2234 CD1 ILE A 146 -3.128 -6.225 -5.923 1.00 0.00 C ATOM 0 H ILE A 146 -1.984 -9.339 -6.751 1.00 0.00 H new ATOM 0 HA ILE A 146 -0.601 -6.783 -7.098 1.00 0.00 H new ATOM 0 HB ILE A 146 -0.800 -8.379 -4.531 1.00 0.00 H new ATOM 0 HG12 ILE A 146 -3.075 -8.276 -5.340 1.00 0.00 H new ATOM 0 HG13 ILE A 146 -2.884 -7.146 -4.014 1.00 0.00 H new ATOM 0 HG21 ILE A 146 -0.701 -6.138 -3.514 1.00 0.00 H new ATOM 0 HG22 ILE A 146 0.701 -6.445 -4.567 1.00 0.00 H new ATOM 0 HG23 ILE A 146 -0.630 -5.409 -5.136 1.00 0.00 H new ATOM 0 HD11 ILE A 146 -4.211 -6.164 -5.819 1.00 0.00 H new ATOM 0 HD12 ILE A 146 -2.680 -5.279 -5.618 1.00 0.00 H new ATOM 0 HD13 ILE A 146 -2.874 -6.427 -6.963 1.00 0.00 H new ATOM 2246 N SER A 147 1.768 -7.543 -6.803 1.00 0.00 N ATOM 2247 CA SER A 147 3.146 -8.019 -6.834 1.00 0.00 C ATOM 2248 C SER A 147 4.032 -7.175 -5.922 1.00 0.00 C ATOM 2249 O SER A 147 4.851 -7.705 -5.170 1.00 0.00 O ATOM 2250 CB SER A 147 3.688 -7.984 -8.264 1.00 0.00 C ATOM 2251 OG SER A 147 4.198 -6.702 -8.586 1.00 0.00 O ATOM 0 H SER A 147 1.664 -6.541 -6.962 1.00 0.00 H new ATOM 0 HA SER A 147 3.158 -9.048 -6.474 1.00 0.00 H new ATOM 0 HB2 SER A 147 4.475 -8.730 -8.376 1.00 0.00 H new ATOM 0 HB3 SER A 147 2.895 -8.249 -8.963 1.00 0.00 H new ATOM 0 HG SER A 147 4.539 -6.707 -9.505 1.00 0.00 H new ATOM 2257 N TYR A 148 3.862 -5.860 -5.994 1.00 0.00 N ATOM 2258 CA TYR A 148 4.648 -4.942 -5.178 1.00 0.00 C ATOM 2259 C TYR A 148 3.741 -4.001 -4.390 1.00 0.00 C ATOM 2260 O TYR A 148 2.942 -3.262 -4.967 1.00 0.00 O ATOM 2261 CB TYR A 148 5.600 -4.131 -6.058 1.00 0.00 C ATOM 2262 CG TYR A 148 6.671 -3.401 -5.279 1.00 0.00 C ATOM 2263 CD1 TYR A 148 7.360 -4.031 -4.250 1.00 0.00 C ATOM 2264 CD2 TYR A 148 6.995 -2.082 -5.572 1.00 0.00 C ATOM 2265 CE1 TYR A 148 8.339 -3.369 -3.535 1.00 0.00 C ATOM 2266 CE2 TYR A 148 7.973 -1.412 -4.863 1.00 0.00 C ATOM 2267 CZ TYR A 148 8.642 -2.060 -3.846 1.00 0.00 C ATOM 2268 OH TYR A 148 9.616 -1.395 -3.136 1.00 0.00 O ATOM 0 H TYR A 148 3.187 -5.405 -6.609 1.00 0.00 H new ATOM 0 HA TYR A 148 5.231 -5.533 -4.472 1.00 0.00 H new ATOM 0 HB2 TYR A 148 6.076 -4.799 -6.775 1.00 0.00 H new ATOM 0 HB3 TYR A 148 5.022 -3.406 -6.632 1.00 0.00 H new ATOM 0 HD1 TYR A 148 7.126 -5.056 -4.005 1.00 0.00 H new ATOM 0 HD2 TYR A 148 6.473 -1.572 -6.368 1.00 0.00 H new ATOM 0 HE1 TYR A 148 8.864 -3.873 -2.737 1.00 0.00 H new ATOM 0 HE2 TYR A 148 8.212 -0.387 -5.104 1.00 0.00 H new ATOM 0 HH TYR A 148 9.707 -0.482 -3.482 1.00 0.00 H new ATOM 2278 N PHE A 149 3.871 -4.034 -3.068 1.00 0.00 N ATOM 2279 CA PHE A 149 3.063 -3.186 -2.199 1.00 0.00 C ATOM 2280 C PHE A 149 3.888 -2.671 -1.023 1.00 0.00 C ATOM 2281 O PHE A 149 4.569 -3.439 -0.343 1.00 0.00 O ATOM 2282 CB PHE A 149 1.847 -3.958 -1.684 1.00 0.00 C ATOM 2283 CG PHE A 149 1.196 -3.323 -0.489 1.00 0.00 C ATOM 2284 CD1 PHE A 149 0.876 -1.975 -0.492 1.00 0.00 C ATOM 2285 CD2 PHE A 149 0.904 -4.074 0.638 1.00 0.00 C ATOM 2286 CE1 PHE A 149 0.278 -1.388 0.607 1.00 0.00 C ATOM 2287 CE2 PHE A 149 0.305 -3.493 1.740 1.00 0.00 C ATOM 2288 CZ PHE A 149 -0.009 -2.148 1.724 1.00 0.00 C ATOM 0 H PHE A 149 4.528 -4.639 -2.575 1.00 0.00 H new ATOM 0 HA PHE A 149 2.721 -2.331 -2.783 1.00 0.00 H new ATOM 0 HB2 PHE A 149 1.113 -4.041 -2.486 1.00 0.00 H new ATOM 0 HB3 PHE A 149 2.153 -4.972 -1.425 1.00 0.00 H new ATOM 0 HD1 PHE A 149 1.096 -1.376 -1.363 1.00 0.00 H new ATOM 0 HD2 PHE A 149 1.147 -5.126 0.656 1.00 0.00 H new ATOM 0 HE1 PHE A 149 0.035 -0.336 0.592 1.00 0.00 H new ATOM 0 HE2 PHE A 149 0.083 -4.090 2.612 1.00 0.00 H new ATOM 0 HZ PHE A 149 -0.478 -1.692 2.583 1.00 0.00 H new ATOM 2298 N THR A 150 3.822 -1.364 -0.790 1.00 0.00 N ATOM 2299 CA THR A 150 4.563 -0.744 0.302 1.00 0.00 C ATOM 2300 C THR A 150 4.031 0.652 0.605 1.00 0.00 C ATOM 2301 O THR A 150 2.996 1.061 0.077 1.00 0.00 O ATOM 2302 CB THR A 150 6.066 -0.648 -0.023 1.00 0.00 C ATOM 2303 OG1 THR A 150 6.814 -0.437 1.180 1.00 0.00 O ATOM 2304 CG2 THR A 150 6.338 0.485 -1.000 1.00 0.00 C ATOM 0 H THR A 150 3.263 -0.714 -1.343 1.00 0.00 H new ATOM 0 HA THR A 150 4.427 -1.380 1.177 1.00 0.00 H new ATOM 0 HB THR A 150 6.376 -1.586 -0.484 1.00 0.00 H new ATOM 0 HG1 THR A 150 7.487 -1.143 1.275 1.00 0.00 H new ATOM 0 HG21 THR A 150 7.406 0.533 -1.214 1.00 0.00 H new ATOM 0 HG22 THR A 150 5.790 0.307 -1.925 1.00 0.00 H new ATOM 0 HG23 THR A 150 6.013 1.429 -0.562 1.00 0.00 H new ATOM 2312 N PHE A 151 4.744 1.380 1.458 1.00 0.00 N ATOM 2313 CA PHE A 151 4.342 2.731 1.832 1.00 0.00 C ATOM 2314 C PHE A 151 5.551 3.661 1.891 1.00 0.00 C ATOM 2315 O PHE A 151 6.441 3.486 2.724 1.00 0.00 O ATOM 2316 CB PHE A 151 3.628 2.717 3.185 1.00 0.00 C ATOM 2317 CG PHE A 151 2.137 2.862 3.077 1.00 0.00 C ATOM 2318 CD1 PHE A 151 1.577 3.987 2.494 1.00 0.00 C ATOM 2319 CD2 PHE A 151 1.296 1.872 3.559 1.00 0.00 C ATOM 2320 CE1 PHE A 151 0.205 4.122 2.393 1.00 0.00 C ATOM 2321 CE2 PHE A 151 -0.077 2.002 3.461 1.00 0.00 C ATOM 2322 CZ PHE A 151 -0.623 3.129 2.878 1.00 0.00 C ATOM 0 H PHE A 151 5.603 1.057 1.903 1.00 0.00 H new ATOM 0 HA PHE A 151 3.656 3.103 1.071 1.00 0.00 H new ATOM 0 HB2 PHE A 151 3.858 1.784 3.699 1.00 0.00 H new ATOM 0 HB3 PHE A 151 4.020 3.525 3.802 1.00 0.00 H new ATOM 0 HD1 PHE A 151 2.220 4.767 2.114 1.00 0.00 H new ATOM 0 HD2 PHE A 151 1.718 0.989 4.016 1.00 0.00 H new ATOM 0 HE1 PHE A 151 -0.219 5.003 1.935 1.00 0.00 H new ATOM 0 HE2 PHE A 151 -0.722 1.223 3.840 1.00 0.00 H new ATOM 0 HZ PHE A 151 -1.695 3.233 2.802 1.00 0.00 H new ATOM 2332 N ILE A 152 5.574 4.648 1.002 1.00 0.00 N ATOM 2333 CA ILE A 152 6.672 5.605 0.953 1.00 0.00 C ATOM 2334 C ILE A 152 6.443 6.755 1.929 1.00 0.00 C ATOM 2335 O ILE A 152 5.362 7.340 1.972 1.00 0.00 O ATOM 2336 CB ILE A 152 6.857 6.179 -0.464 1.00 0.00 C ATOM 2337 CG1 ILE A 152 6.828 5.054 -1.501 1.00 0.00 C ATOM 2338 CG2 ILE A 152 8.160 6.957 -0.555 1.00 0.00 C ATOM 2339 CD1 ILE A 152 7.891 4.001 -1.279 1.00 0.00 C ATOM 0 H ILE A 152 4.845 4.806 0.306 1.00 0.00 H new ATOM 0 HA ILE A 152 7.574 5.064 1.237 1.00 0.00 H new ATOM 0 HB ILE A 152 6.034 6.862 -0.673 1.00 0.00 H new ATOM 0 HG12 ILE A 152 5.847 4.579 -1.482 1.00 0.00 H new ATOM 0 HG13 ILE A 152 6.955 5.483 -2.495 1.00 0.00 H new ATOM 0 HG21 ILE A 152 8.276 7.356 -1.563 1.00 0.00 H new ATOM 0 HG22 ILE A 152 8.144 7.779 0.161 1.00 0.00 H new ATOM 0 HG23 ILE A 152 8.996 6.295 -0.329 1.00 0.00 H new ATOM 0 HD11 ILE A 152 7.811 3.235 -2.051 1.00 0.00 H new ATOM 0 HD12 ILE A 152 8.877 4.463 -1.327 1.00 0.00 H new ATOM 0 HD13 ILE A 152 7.752 3.545 -0.299 1.00 0.00 H new ATOM 2351 N GLY A 153 7.471 7.074 2.711 1.00 0.00 N ATOM 2352 CA GLY A 153 7.362 8.153 3.674 1.00 0.00 C ATOM 2353 C GLY A 153 8.489 8.141 4.688 1.00 0.00 C ATOM 2354 O GLY A 153 9.635 7.843 4.351 1.00 0.00 O ATOM 0 H GLY A 153 8.376 6.604 2.694 1.00 0.00 H new ATOM 0 HA2 GLY A 153 7.361 9.107 3.147 1.00 0.00 H new ATOM 0 HA3 GLY A 153 6.408 8.076 4.195 1.00 0.00 H new ATOM 2358 N THR A 154 8.165 8.468 5.935 1.00 0.00 N ATOM 2359 CA THR A 154 9.158 8.497 7.001 1.00 0.00 C ATOM 2360 C THR A 154 8.493 8.524 8.372 1.00 0.00 C ATOM 2361 O THR A 154 7.341 8.931 8.522 1.00 0.00 O ATOM 2362 CB THR A 154 10.088 9.718 6.869 1.00 0.00 C ATOM 2363 OG1 THR A 154 10.344 10.280 8.161 1.00 0.00 O ATOM 2364 CG2 THR A 154 9.470 10.774 5.965 1.00 0.00 C ATOM 0 H THR A 154 7.221 8.717 6.231 1.00 0.00 H new ATOM 0 HA THR A 154 9.750 7.587 6.906 1.00 0.00 H new ATOM 0 HB THR A 154 11.026 9.386 6.425 1.00 0.00 H new ATOM 0 HG1 THR A 154 10.937 11.055 8.069 1.00 0.00 H new ATOM 0 HG21 THR A 154 10.145 11.626 5.887 1.00 0.00 H new ATOM 0 HG22 THR A 154 9.303 10.352 4.974 1.00 0.00 H new ATOM 0 HG23 THR A 154 8.519 11.101 6.385 1.00 0.00 H new ATOM 2372 N PRO A 155 9.234 8.081 9.399 1.00 0.00 N ATOM 2373 CA PRO A 155 8.737 8.046 10.777 1.00 0.00 C ATOM 2374 C PRO A 155 8.572 9.442 11.370 1.00 0.00 C ATOM 2375 O PRO A 155 9.435 10.304 11.203 1.00 0.00 O ATOM 2376 CB PRO A 155 9.823 7.271 11.527 1.00 0.00 C ATOM 2377 CG PRO A 155 11.061 7.484 10.726 1.00 0.00 C ATOM 2378 CD PRO A 155 10.616 7.582 9.293 1.00 0.00 C ATOM 0 HA PRO A 155 7.748 7.591 10.842 1.00 0.00 H new ATOM 0 HB2 PRO A 155 9.942 7.641 12.545 1.00 0.00 H new ATOM 0 HB3 PRO A 155 9.575 6.212 11.599 1.00 0.00 H new ATOM 0 HG2 PRO A 155 11.576 8.393 11.038 1.00 0.00 H new ATOM 0 HG3 PRO A 155 11.760 6.659 10.862 1.00 0.00 H new ATOM 0 HD2 PRO A 155 11.247 8.263 8.722 1.00 0.00 H new ATOM 0 HD3 PRO A 155 10.657 6.615 8.792 1.00 0.00 H new ATOM 2386 N VAL A 156 7.459 9.658 12.063 1.00 0.00 N ATOM 2387 CA VAL A 156 7.182 10.948 12.682 1.00 0.00 C ATOM 2388 C VAL A 156 8.362 11.417 13.527 1.00 0.00 C ATOM 2389 O VAL A 156 8.598 12.616 13.668 1.00 0.00 O ATOM 2390 CB VAL A 156 5.923 10.888 13.567 1.00 0.00 C ATOM 2391 CG1 VAL A 156 4.710 10.482 12.744 1.00 0.00 C ATOM 2392 CG2 VAL A 156 6.134 9.929 14.729 1.00 0.00 C ATOM 0 H VAL A 156 6.734 8.956 12.210 1.00 0.00 H new ATOM 0 HA VAL A 156 7.014 11.658 11.872 1.00 0.00 H new ATOM 0 HB VAL A 156 5.739 11.882 13.975 1.00 0.00 H new ATOM 0 HG11 VAL A 156 3.830 10.445 13.386 1.00 0.00 H new ATOM 0 HG12 VAL A 156 4.549 11.211 11.950 1.00 0.00 H new ATOM 0 HG13 VAL A 156 4.880 9.499 12.305 1.00 0.00 H new ATOM 0 HG21 VAL A 156 5.235 9.899 15.344 1.00 0.00 H new ATOM 0 HG22 VAL A 156 6.344 8.931 14.344 1.00 0.00 H new ATOM 0 HG23 VAL A 156 6.975 10.269 15.333 1.00 0.00 H new ATOM 2402 N GLN A 157 9.099 10.462 14.085 1.00 0.00 N ATOM 2403 CA GLN A 157 10.254 10.778 14.916 1.00 0.00 C ATOM 2404 C GLN A 157 11.384 9.780 14.680 1.00 0.00 C ATOM 2405 O GLN A 157 11.140 8.613 14.376 1.00 0.00 O ATOM 2406 CB GLN A 157 9.861 10.780 16.395 1.00 0.00 C ATOM 2407 CG GLN A 157 9.647 9.389 16.969 1.00 0.00 C ATOM 2408 CD GLN A 157 10.839 8.897 17.765 1.00 0.00 C ATOM 2409 OE1 GLN A 157 11.282 9.551 18.710 1.00 0.00 O ATOM 2410 NE2 GLN A 157 11.366 7.738 17.388 1.00 0.00 N ATOM 0 H GLN A 157 8.917 9.464 13.977 1.00 0.00 H new ATOM 0 HA GLN A 157 10.607 11.772 14.640 1.00 0.00 H new ATOM 0 HB2 GLN A 157 10.638 11.285 16.968 1.00 0.00 H new ATOM 0 HB3 GLN A 157 8.946 11.360 16.519 1.00 0.00 H new ATOM 0 HG2 GLN A 157 8.765 9.396 17.609 1.00 0.00 H new ATOM 0 HG3 GLN A 157 9.445 8.692 16.156 1.00 0.00 H new ATOM 0 HE21 GLN A 157 10.967 7.229 16.599 1.00 0.00 H new ATOM 0 HE22 GLN A 157 12.170 7.357 17.887 1.00 0.00 H new