USER MOD reduce.3.24.130724 H: found=0, std=0, add=1194, rem=0, adj=43 USER MOD reduce.3.24.130724 removed 1190 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 29 HIS : no HD1:sc= -0.729 K(o=-13,f=-13) USER MOD Set 1.2: A 75 CYS SG : rot 109:sc= -6.05! USER MOD Set 1.3: A 129 HIS : no HD1:sc= -7.05! C(o=-13!,f=-13!) USER MOD Set 1.4: A 137 CYS SG : rot 125:sc= 0.474 USER MOD Set 2.1: A 43 TYR OH : rot 180:sc= 0 USER MOD Set 2.2: A 47 ASN : amide:sc= -1.69! K(o=-1.7!,f=-0.47) USER MOD Set 3.1: A 30 ASN : amide:sc= -4.63! C(o=-4.3!,f=-11!) USER MOD Set 3.2: A 31 THR OG1 : rot -71:sc= 0.147 USER MOD Set 3.3: A 94 SER OG : rot -55:sc= 0.142 USER MOD Set 4.1: A 27 THR OG1 : rot 105:sc= 0.157 USER MOD Set 4.2: A 86 SER OG : rot -40:sc= 1.03 USER MOD Set 5.1: A 21 MET CE :methyl -171:sc= 0 (180deg=0) USER MOD Set 5.2: A 85 GLN : amide:sc= -1.08! K(o=-1.1!,f=-0.0021) USER MOD Set 6.1: A 16 LYS NZ :NH3+ -150:sc= 0.789 (180deg=-1.02) USER MOD Set 6.2: A 48 ASN : amide:sc= 0.904 K(o=1.7,f=-6.3!) USER MOD Single : A 4 GLN : amide:sc= -1.77! K(o=-1.8!,f=-0.14) USER MOD Single : A 5 LYS NZ :NH3+ 172:sc=-0.00381 (180deg=-0.0791) USER MOD Single : A 6 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0228) USER MOD Single : A 11 SER OG : rot 82:sc= 1.24 USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 TYR OH : rot 180:sc= 0 USER MOD Single : A 15 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 CYS SG : rot 53:sc= -0.163 USER MOD Single : A 19 TYR OH : rot 180:sc= 0 USER MOD Single : A 20 THR OG1 : rot 31:sc= 0.535 USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 LYS NZ :NH3+ 137:sc= 1.27 (180deg=1.02) USER MOD Single : A 25 TYR OH : rot 180:sc= 0 USER MOD Single : A 32 TYR OH : rot 0:sc= 0.245 USER MOD Single : A 33 ASN : amide:sc= 0.269 X(o=0.27,f=-0.13) USER MOD Single : A 39 ASN : amide:sc= -2.17! C(o=-2.2!,f=-2.7!) USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 44 MET CE :methyl -174:sc= -1.27 (180deg=-1.27) USER MOD Single : A 46 SER OG : rot -25:sc= 0.112 USER MOD Single : A 49 ASN : amide:sc= -1.77! C(o=-1.8!,f=-6.6!) USER MOD Single : A 52 SER OG : rot 100:sc= -0.124 USER MOD Single : A 54 HIS : no HD1:sc= -2.23 K(o=-2.2,f=-11!) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 LYS NZ :NH3+ -167:sc= 1.16 (180deg=0.758) USER MOD Single : A 64 GLN : amide:sc= 0.485 K(o=0.49,f=-1.3) USER MOD Single : A 71 ASN : amide:sc= 0.279 K(o=0.28,f=-2.6!) USER MOD Single : A 79 ASN : amide:sc= -0.0537 X(o=-0.054,f=-0.079) USER MOD Single : A 81 SER OG : rot 180:sc= -0.087 USER MOD Single : A 83 ASN : amide:sc= 0.182 K(o=0.18,f=-13!) USER MOD Single : A 88 SER OG : rot 120:sc= -0.184 USER MOD Single : A 92 CYS SG : rot 100:sc= -2.33! USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 95 LYS NZ :NH3+ -167:sc= 1.25 (180deg=1.2) USER MOD Single : A 96 SER OG : rot -150:sc= -0.683 USER MOD Single : A 101 TYR OH : rot -116:sc= 0.635 USER MOD Single : A 102 TYR OH : rot 180:sc= 0.581 USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 ASN : amide:sc= 1.25 K(o=1.3,f=-0.67) USER MOD Single : A 114 GLN : amide:sc= -1.61! K(o=-1.6!,f=-0.12) USER MOD Single : A 116 MET CE :methyl -175:sc= -2.03 (180deg=-2.19) USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 118 MET CE :methyl -138:sc= -0.342 (180deg=-0.655) USER MOD Single : A 119 TYR OH : rot 180:sc= -0.102 USER MOD Single : A 120 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 125 ASN : amide:sc= 0.575 K(o=0.57,f=-1.7) USER MOD Single : A 128 THR OG1 : rot 180:sc= 0.259 USER MOD Single : A 130 GLN : amide:sc= -1.77! K(o=-1.8!,f=-0.76) USER MOD Single : A 131 SER OG : rot 110:sc= -0.0731 USER MOD Single : A 133 SER OG : rot 180:sc= 0 USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 TYR OH : rot 110:sc= 0 USER MOD Single : A 139 HIS : no HD1:sc= -0.818 K(o=-0.82,f=0.0022) USER MOD Single : A 141 MET CE :methyl -153:sc= -2.3 (180deg=-3.43) USER MOD Single : A 152 GLN : amide:sc= 0 X(o=0,f=-0.46) USER MOD Single : A 153 LYS NZ :NH3+ 164:sc= 0.98 (180deg=0.685) USER MOD Single : A 155 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 156 ASN : amide:sc= 0 X(o=0,f=-0.085) USER MOD ----------------------------------------------------------------- ATOM 35 N ILE A 3 10.080 9.172 -0.172 1.00 1.12 N ATOM 36 CA ILE A 3 8.851 9.092 -0.924 1.00 32.34 C ATOM 37 C ILE A 3 8.823 10.171 -2.003 1.00 35.31 C ATOM 38 O ILE A 3 9.237 11.314 -1.769 1.00 61.21 O ATOM 39 CB ILE A 3 7.545 9.170 -0.014 1.00 75.13 C ATOM 40 CG1 ILE A 3 7.411 7.961 0.956 1.00 51.04 C ATOM 41 CG2 ILE A 3 6.281 9.272 -0.858 1.00 12.20 C ATOM 42 CD1 ILE A 3 8.433 7.887 2.073 1.00 4.33 C ATOM 0 HA ILE A 3 8.834 8.107 -1.391 1.00 32.34 H new ATOM 0 HB ILE A 3 7.660 10.074 0.584 1.00 75.13 H new ATOM 0 HG12 ILE A 3 6.417 7.987 1.402 1.00 51.04 H new ATOM 0 HG13 ILE A 3 7.474 7.043 0.371 1.00 51.04 H new ATOM 0 HG21 ILE A 3 5.410 9.323 -0.204 1.00 12.20 H new ATOM 0 HG22 ILE A 3 6.326 10.170 -1.474 1.00 12.20 H new ATOM 0 HG23 ILE A 3 6.201 8.395 -1.501 1.00 12.20 H new ATOM 0 HD11 ILE A 3 8.241 7.005 2.684 1.00 4.33 H new ATOM 0 HD12 ILE A 3 9.434 7.822 1.647 1.00 4.33 H new ATOM 0 HD13 ILE A 3 8.360 8.781 2.693 1.00 4.33 H new ATOM 54 N GLN A 4 8.383 9.798 -3.171 1.00 15.11 N ATOM 55 CA GLN A 4 8.253 10.698 -4.272 1.00 74.54 C ATOM 56 C GLN A 4 6.864 11.263 -4.205 1.00 2.41 C ATOM 57 O GLN A 4 5.894 10.520 -3.991 1.00 55.24 O ATOM 58 CB GLN A 4 8.331 9.925 -5.553 1.00 1.42 C ATOM 59 CG GLN A 4 8.502 10.752 -6.813 1.00 42.21 C ATOM 60 CD GLN A 4 9.924 11.193 -7.035 1.00 50.41 C ATOM 61 OE1 GLN A 4 10.173 12.259 -7.592 1.00 61.34 O ATOM 62 NE2 GLN A 4 10.869 10.370 -6.625 1.00 5.23 N ATOM 0 H GLN A 4 8.100 8.841 -3.384 1.00 15.11 H new ATOM 0 HA GLN A 4 9.029 11.462 -4.233 1.00 74.54 H new ATOM 0 HB2 GLN A 4 9.165 9.226 -5.484 1.00 1.42 H new ATOM 0 HB3 GLN A 4 7.423 9.330 -5.652 1.00 1.42 H new ATOM 0 HG2 GLN A 4 8.169 10.169 -7.672 1.00 42.21 H new ATOM 0 HG3 GLN A 4 7.859 11.630 -6.755 1.00 42.21 H new ATOM 0 HE21 GLN A 4 10.619 9.494 -6.166 1.00 5.23 H new ATOM 0 HE22 GLN A 4 11.850 10.609 -6.766 1.00 5.23 H new ATOM 71 N LYS A 5 6.749 12.512 -4.387 1.00 74.12 N ATOM 72 CA LYS A 5 5.485 13.143 -4.376 1.00 52.05 C ATOM 73 C LYS A 5 5.114 13.598 -5.752 1.00 15.24 C ATOM 74 O LYS A 5 5.689 14.558 -6.292 1.00 54.32 O ATOM 75 CB LYS A 5 5.454 14.287 -3.363 1.00 54.13 C ATOM 76 CG LYS A 5 5.383 13.826 -1.911 1.00 2.11 C ATOM 77 CD LYS A 5 4.041 13.146 -1.625 1.00 42.21 C ATOM 78 CE LYS A 5 3.942 12.627 -0.199 1.00 33.03 C ATOM 79 NZ LYS A 5 4.138 13.689 0.815 1.00 24.03 N ATOM 0 H LYS A 5 7.535 13.141 -4.551 1.00 74.12 H new ATOM 0 HA LYS A 5 4.735 12.418 -4.059 1.00 52.05 H new ATOM 0 HB2 LYS A 5 6.345 14.901 -3.496 1.00 54.13 H new ATOM 0 HB3 LYS A 5 4.594 14.923 -3.574 1.00 54.13 H new ATOM 0 HG2 LYS A 5 6.199 13.134 -1.704 1.00 2.11 H new ATOM 0 HG3 LYS A 5 5.513 14.680 -1.246 1.00 2.11 H new ATOM 0 HD2 LYS A 5 3.233 13.854 -1.807 1.00 42.21 H new ATOM 0 HD3 LYS A 5 3.902 12.318 -2.320 1.00 42.21 H new ATOM 0 HE2 LYS A 5 2.965 12.167 -0.052 1.00 33.03 H new ATOM 0 HE3 LYS A 5 4.688 11.846 -0.049 1.00 33.03 H new ATOM 0 HZ1 LYS A 5 3.927 13.310 1.760 1.00 24.03 H new ATOM 0 HZ2 LYS A 5 5.124 14.019 0.786 1.00 24.03 H new ATOM 0 HZ3 LYS A 5 3.501 14.485 0.611 1.00 24.03 H new ATOM 93 N LYS A 6 4.193 12.879 -6.342 1.00 14.41 N ATOM 94 CA LYS A 6 3.666 13.217 -7.629 1.00 73.41 C ATOM 95 C LYS A 6 2.217 12.781 -7.669 1.00 35.35 C ATOM 96 O LYS A 6 1.741 12.188 -8.648 1.00 52.40 O ATOM 97 CB LYS A 6 4.507 12.583 -8.765 1.00 0.15 C ATOM 98 CG LYS A 6 4.535 11.063 -8.795 1.00 13.42 C ATOM 99 CD LYS A 6 5.433 10.531 -9.919 1.00 53.30 C ATOM 100 CE LYS A 6 5.041 11.085 -11.292 1.00 3.43 C ATOM 101 NZ LYS A 6 3.627 10.815 -11.642 1.00 41.30 N ATOM 0 H LYS A 6 3.788 12.036 -5.935 1.00 14.41 H new ATOM 0 HA LYS A 6 3.719 14.294 -7.790 1.00 73.41 H new ATOM 0 HB2 LYS A 6 4.121 12.940 -9.720 1.00 0.15 H new ATOM 0 HB3 LYS A 6 5.531 12.945 -8.679 1.00 0.15 H new ATOM 0 HG2 LYS A 6 4.892 10.687 -7.836 1.00 13.42 H new ATOM 0 HG3 LYS A 6 3.522 10.684 -8.929 1.00 13.42 H new ATOM 0 HD2 LYS A 6 6.470 10.793 -9.707 1.00 53.30 H new ATOM 0 HD3 LYS A 6 5.378 9.443 -9.940 1.00 53.30 H new ATOM 0 HE2 LYS A 6 5.214 12.161 -11.307 1.00 3.43 H new ATOM 0 HE3 LYS A 6 5.688 10.648 -12.053 1.00 3.43 H new ATOM 0 HZ1 LYS A 6 3.447 11.121 -12.619 1.00 41.30 H new ATOM 0 HZ2 LYS A 6 3.437 9.796 -11.558 1.00 41.30 H new ATOM 0 HZ3 LYS A 6 3.003 11.338 -10.995 1.00 41.30 H new ATOM 115 N LEU A 7 1.527 13.100 -6.564 1.00 30.45 N ATOM 116 CA LEU A 7 0.115 12.808 -6.356 1.00 33.43 C ATOM 117 C LEU A 7 -0.753 13.212 -7.570 1.00 10.31 C ATOM 118 O LEU A 7 -0.366 14.054 -8.390 1.00 55.11 O ATOM 119 CB LEU A 7 -0.399 13.519 -5.082 1.00 4.13 C ATOM 120 CG LEU A 7 0.340 13.216 -3.750 1.00 11.41 C ATOM 121 CD1 LEU A 7 -0.276 14.002 -2.607 1.00 31.14 C ATOM 122 CD2 LEU A 7 0.334 11.730 -3.423 1.00 34.21 C ATOM 0 H LEU A 7 1.955 13.581 -5.773 1.00 30.45 H new ATOM 0 HA LEU A 7 0.026 11.729 -6.234 1.00 33.43 H new ATOM 0 HB2 LEU A 7 -0.355 14.594 -5.255 1.00 4.13 H new ATOM 0 HB3 LEU A 7 -1.450 13.260 -4.951 1.00 4.13 H new ATOM 0 HG LEU A 7 1.377 13.525 -3.879 1.00 11.41 H new ATOM 0 HD11 LEU A 7 0.255 13.776 -1.682 1.00 31.14 H new ATOM 0 HD12 LEU A 7 -0.201 15.069 -2.817 1.00 31.14 H new ATOM 0 HD13 LEU A 7 -1.325 13.726 -2.499 1.00 31.14 H new ATOM 0 HD21 LEU A 7 0.861 11.562 -2.484 1.00 34.21 H new ATOM 0 HD22 LEU A 7 -0.695 11.382 -3.329 1.00 34.21 H new ATOM 0 HD23 LEU A 7 0.831 11.180 -4.222 1.00 34.21 H new ATOM 134 N VAL A 8 -1.935 12.658 -7.618 1.00 62.31 N ATOM 135 CA VAL A 8 -2.853 12.807 -8.730 1.00 11.42 C ATOM 136 C VAL A 8 -3.405 14.250 -8.808 1.00 34.43 C ATOM 137 O VAL A 8 -3.449 14.967 -7.789 1.00 40.54 O ATOM 138 CB VAL A 8 -4.026 11.802 -8.562 1.00 30.12 C ATOM 139 CG1 VAL A 8 -4.847 12.106 -7.322 1.00 21.34 C ATOM 140 CG2 VAL A 8 -4.894 11.767 -9.775 1.00 3.24 C ATOM 0 H VAL A 8 -2.302 12.073 -6.867 1.00 62.31 H new ATOM 0 HA VAL A 8 -2.316 12.601 -9.656 1.00 11.42 H new ATOM 0 HB VAL A 8 -3.585 10.813 -8.437 1.00 30.12 H new ATOM 0 HG11 VAL A 8 -5.658 11.383 -7.237 1.00 21.34 H new ATOM 0 HG12 VAL A 8 -4.210 12.043 -6.440 1.00 21.34 H new ATOM 0 HG13 VAL A 8 -5.263 13.111 -7.398 1.00 21.34 H new ATOM 0 HG21 VAL A 8 -5.704 11.054 -9.622 1.00 3.24 H new ATOM 0 HG22 VAL A 8 -5.312 12.758 -9.952 1.00 3.24 H new ATOM 0 HG23 VAL A 8 -4.301 11.464 -10.638 1.00 3.24 H new ATOM 150 N ASP A 9 -3.793 14.675 -10.023 1.00 62.12 N ATOM 151 CA ASP A 9 -4.237 16.034 -10.267 1.00 25.31 C ATOM 152 C ASP A 9 -5.535 16.277 -9.523 1.00 22.22 C ATOM 153 O ASP A 9 -6.384 15.378 -9.451 1.00 72.31 O ATOM 154 CB ASP A 9 -4.450 16.253 -11.782 1.00 10.21 C ATOM 155 CG ASP A 9 -4.805 17.682 -12.148 1.00 64.23 C ATOM 156 OD1 ASP A 9 -5.971 18.093 -11.963 1.00 63.54 O ATOM 157 OD2 ASP A 9 -3.906 18.416 -12.617 1.00 33.24 O ATOM 0 H ASP A 9 -3.803 14.080 -10.851 1.00 62.12 H new ATOM 0 HA ASP A 9 -3.479 16.733 -9.913 1.00 25.31 H new ATOM 0 HB2 ASP A 9 -3.542 15.966 -12.313 1.00 10.21 H new ATOM 0 HB3 ASP A 9 -5.244 15.591 -12.128 1.00 10.21 H new ATOM 162 N PRO A 10 -5.708 17.471 -8.927 1.00 42.55 N ATOM 163 CA PRO A 10 -6.932 17.838 -8.212 1.00 20.24 C ATOM 164 C PRO A 10 -8.235 17.603 -9.006 1.00 40.44 C ATOM 165 O PRO A 10 -9.301 17.447 -8.418 1.00 44.31 O ATOM 166 CB PRO A 10 -6.744 19.324 -7.898 1.00 34.22 C ATOM 167 CG PRO A 10 -5.271 19.504 -7.840 1.00 44.31 C ATOM 168 CD PRO A 10 -4.697 18.555 -8.854 1.00 5.31 C ATOM 0 HA PRO A 10 -7.059 17.210 -7.330 1.00 20.24 H new ATOM 0 HB2 PRO A 10 -7.191 19.953 -8.668 1.00 34.22 H new ATOM 0 HB3 PRO A 10 -7.215 19.593 -6.953 1.00 34.22 H new ATOM 0 HG2 PRO A 10 -4.994 20.533 -8.069 1.00 44.31 H new ATOM 0 HG3 PRO A 10 -4.890 19.286 -6.842 1.00 44.31 H new ATOM 0 HD2 PRO A 10 -4.556 19.038 -9.821 1.00 5.31 H new ATOM 0 HD3 PRO A 10 -3.724 18.176 -8.543 1.00 5.31 H new ATOM 176 N SER A 11 -8.142 17.539 -10.310 1.00 44.45 N ATOM 177 CA SER A 11 -9.320 17.347 -11.143 1.00 25.52 C ATOM 178 C SER A 11 -9.756 15.878 -11.101 1.00 22.22 C ATOM 179 O SER A 11 -10.913 15.541 -11.359 1.00 62.23 O ATOM 180 CB SER A 11 -8.987 17.722 -12.582 1.00 74.12 C ATOM 181 OG SER A 11 -8.363 18.992 -12.637 1.00 23.40 O ATOM 0 H SER A 11 -7.265 17.616 -10.826 1.00 44.45 H new ATOM 0 HA SER A 11 -10.127 17.977 -10.769 1.00 25.52 H new ATOM 0 HB2 SER A 11 -8.329 16.969 -13.016 1.00 74.12 H new ATOM 0 HB3 SER A 11 -9.898 17.733 -13.180 1.00 74.12 H new ATOM 0 HG SER A 11 -7.408 18.896 -12.440 1.00 23.40 H new ATOM 187 N LYS A 12 -8.821 15.021 -10.743 1.00 22.22 N ATOM 188 CA LYS A 12 -9.016 13.588 -10.793 1.00 62.14 C ATOM 189 C LYS A 12 -9.305 13.048 -9.427 1.00 34.20 C ATOM 190 O LYS A 12 -9.504 11.827 -9.269 1.00 50.53 O ATOM 191 CB LYS A 12 -7.756 12.917 -11.315 1.00 71.35 C ATOM 192 CG LYS A 12 -7.094 13.654 -12.463 1.00 43.30 C ATOM 193 CD LYS A 12 -8.011 13.854 -13.631 1.00 63.14 C ATOM 194 CE LYS A 12 -8.374 12.556 -14.331 1.00 21.10 C ATOM 195 NZ LYS A 12 -9.325 12.782 -15.443 1.00 62.23 N ATOM 0 H LYS A 12 -7.900 15.302 -10.407 1.00 22.22 H new ATOM 0 HA LYS A 12 -9.859 13.382 -11.453 1.00 62.14 H new ATOM 0 HB2 LYS A 12 -7.042 12.823 -10.497 1.00 71.35 H new ATOM 0 HB3 LYS A 12 -8.003 11.906 -11.640 1.00 71.35 H new ATOM 0 HG2 LYS A 12 -6.744 14.625 -12.112 1.00 43.30 H new ATOM 0 HG3 LYS A 12 -6.215 13.097 -12.788 1.00 43.30 H new ATOM 0 HD2 LYS A 12 -8.923 14.343 -13.290 1.00 63.14 H new ATOM 0 HD3 LYS A 12 -7.537 14.526 -14.347 1.00 63.14 H new ATOM 0 HE2 LYS A 12 -7.470 12.084 -14.716 1.00 21.10 H new ATOM 0 HE3 LYS A 12 -8.813 11.865 -13.612 1.00 21.10 H new ATOM 0 HZ1 LYS A 12 -9.550 11.874 -15.897 1.00 62.23 H new ATOM 0 HZ2 LYS A 12 -10.198 13.209 -15.072 1.00 62.23 H new ATOM 0 HZ3 LYS A 12 -8.896 13.422 -16.142 1.00 62.23 H new ATOM 209 N TYR A 13 -9.325 13.930 -8.421 1.00 43.15 N ATOM 210 CA TYR A 13 -9.505 13.502 -7.072 1.00 4.41 C ATOM 211 C TYR A 13 -10.745 12.702 -6.873 1.00 63.31 C ATOM 212 O TYR A 13 -10.689 11.723 -6.224 1.00 45.32 O ATOM 213 CB TYR A 13 -9.457 14.641 -6.045 1.00 55.23 C ATOM 214 CG TYR A 13 -8.082 15.185 -5.702 1.00 31.04 C ATOM 215 CD1 TYR A 13 -6.969 14.357 -5.669 1.00 44.44 C ATOM 216 CD2 TYR A 13 -7.904 16.524 -5.393 1.00 55.22 C ATOM 217 CE1 TYR A 13 -5.722 14.847 -5.347 1.00 75.02 C ATOM 218 CE2 TYR A 13 -6.652 17.021 -5.066 1.00 53.15 C ATOM 219 CZ TYR A 13 -5.568 16.176 -5.048 1.00 2.11 C ATOM 220 OH TYR A 13 -4.318 16.667 -4.727 1.00 12.13 O ATOM 0 H TYR A 13 -9.217 14.938 -8.538 1.00 43.15 H new ATOM 0 HA TYR A 13 -8.644 12.858 -6.890 1.00 4.41 H new ATOM 0 HB2 TYR A 13 -10.066 15.464 -6.419 1.00 55.23 H new ATOM 0 HB3 TYR A 13 -9.925 14.291 -5.125 1.00 55.23 H new ATOM 0 HD1 TYR A 13 -7.082 13.308 -5.900 1.00 44.44 H new ATOM 0 HD2 TYR A 13 -8.754 17.191 -5.407 1.00 55.22 H new ATOM 0 HE1 TYR A 13 -4.868 14.186 -5.330 1.00 75.02 H new ATOM 0 HE2 TYR A 13 -6.529 18.067 -4.827 1.00 53.15 H new ATOM 0 HH TYR A 13 -4.381 17.627 -4.543 1.00 12.13 H new ATOM 230 N GLY A 14 -11.830 13.046 -7.510 1.00 12.12 N ATOM 231 CA GLY A 14 -13.053 12.306 -7.207 1.00 52.31 C ATOM 232 C GLY A 14 -13.257 11.076 -8.054 1.00 62.11 C ATOM 233 O GLY A 14 -14.321 10.459 -8.030 1.00 54.21 O ATOM 0 H GLY A 14 -11.909 13.788 -8.205 1.00 12.12 H new ATOM 0 HA2 GLY A 14 -13.036 12.012 -6.158 1.00 52.31 H new ATOM 0 HA3 GLY A 14 -13.908 12.970 -7.338 1.00 52.31 H new ATOM 237 N THR A 15 -12.249 10.718 -8.789 1.00 75.12 N ATOM 238 CA THR A 15 -12.261 9.508 -9.558 1.00 43.51 C ATOM 239 C THR A 15 -11.437 8.469 -8.800 1.00 61.22 C ATOM 240 O THR A 15 -11.730 7.281 -8.811 1.00 50.12 O ATOM 241 CB THR A 15 -11.603 9.745 -10.935 1.00 73.22 C ATOM 242 OG1 THR A 15 -12.222 10.867 -11.570 1.00 74.34 O ATOM 243 CG2 THR A 15 -11.737 8.516 -11.834 1.00 43.21 C ATOM 0 H THR A 15 -11.389 11.259 -8.874 1.00 75.12 H new ATOM 0 HA THR A 15 -13.288 9.174 -9.707 1.00 43.51 H new ATOM 0 HB THR A 15 -10.542 9.939 -10.777 1.00 73.22 H new ATOM 0 HG1 THR A 15 -11.805 11.020 -12.443 1.00 74.34 H new ATOM 0 HG21 THR A 15 -11.264 8.715 -12.796 1.00 43.21 H new ATOM 0 HG22 THR A 15 -11.251 7.664 -11.360 1.00 43.21 H new ATOM 0 HG23 THR A 15 -12.792 8.292 -11.989 1.00 43.21 H new ATOM 251 N LYS A 16 -10.420 8.960 -8.124 1.00 24.32 N ATOM 252 CA LYS A 16 -9.470 8.122 -7.405 1.00 34.43 C ATOM 253 C LYS A 16 -9.783 8.120 -5.903 1.00 73.42 C ATOM 254 O LYS A 16 -9.733 7.084 -5.240 1.00 42.43 O ATOM 255 CB LYS A 16 -8.070 8.689 -7.657 1.00 13.45 C ATOM 256 CG LYS A 16 -7.760 8.851 -9.138 1.00 62.54 C ATOM 257 CD LYS A 16 -7.606 7.513 -9.833 1.00 72.35 C ATOM 258 CE LYS A 16 -7.745 7.649 -11.322 1.00 42.04 C ATOM 259 NZ LYS A 16 -6.860 8.693 -11.901 1.00 20.34 N ATOM 0 H LYS A 16 -10.223 9.958 -8.054 1.00 24.32 H new ATOM 0 HA LYS A 16 -9.533 7.092 -7.755 1.00 34.43 H new ATOM 0 HB2 LYS A 16 -7.980 9.657 -7.163 1.00 13.45 H new ATOM 0 HB3 LYS A 16 -7.329 8.030 -7.205 1.00 13.45 H new ATOM 0 HG2 LYS A 16 -8.558 9.419 -9.616 1.00 62.54 H new ATOM 0 HG3 LYS A 16 -6.843 9.429 -9.256 1.00 62.54 H new ATOM 0 HD2 LYS A 16 -6.631 7.088 -9.595 1.00 72.35 H new ATOM 0 HD3 LYS A 16 -8.357 6.818 -9.458 1.00 72.35 H new ATOM 0 HE2 LYS A 16 -7.520 6.691 -11.790 1.00 42.04 H new ATOM 0 HE3 LYS A 16 -8.781 7.886 -11.563 1.00 42.04 H new ATOM 0 HZ1 LYS A 16 -7.309 9.099 -12.747 1.00 20.34 H new ATOM 0 HZ2 LYS A 16 -6.703 9.444 -11.199 1.00 20.34 H new ATOM 0 HZ3 LYS A 16 -5.948 8.268 -12.163 1.00 20.34 H new ATOM 273 N CYS A 17 -10.127 9.283 -5.392 1.00 64.21 N ATOM 274 CA CYS A 17 -10.406 9.465 -3.983 1.00 11.24 C ATOM 275 C CYS A 17 -11.390 10.642 -3.735 1.00 41.54 C ATOM 276 O CYS A 17 -10.990 11.724 -3.274 1.00 41.14 O ATOM 277 CB CYS A 17 -9.101 9.702 -3.247 1.00 13.42 C ATOM 278 SG CYS A 17 -8.089 11.045 -3.939 1.00 60.55 S ATOM 0 H CYS A 17 -10.222 10.134 -5.946 1.00 64.21 H new ATOM 0 HA CYS A 17 -10.887 8.562 -3.607 1.00 11.24 H new ATOM 0 HB2 CYS A 17 -9.321 9.928 -2.204 1.00 13.42 H new ATOM 0 HB3 CYS A 17 -8.518 8.781 -3.257 1.00 13.42 H new ATOM 0 HG CYS A 17 -8.809 12.123 -4.041 1.00 60.55 H new ATOM 284 N PRO A 18 -12.679 10.483 -4.133 1.00 74.51 N ATOM 285 CA PRO A 18 -13.707 11.530 -3.953 1.00 43.23 C ATOM 286 C PRO A 18 -14.065 11.759 -2.505 1.00 31.22 C ATOM 287 O PRO A 18 -14.613 12.802 -2.139 1.00 60.22 O ATOM 288 CB PRO A 18 -14.924 10.979 -4.697 1.00 55.52 C ATOM 289 CG PRO A 18 -14.698 9.510 -4.793 1.00 21.42 C ATOM 290 CD PRO A 18 -13.215 9.307 -4.831 1.00 12.44 C ATOM 0 HA PRO A 18 -13.352 12.493 -4.322 1.00 43.23 H new ATOM 0 HB2 PRO A 18 -15.846 11.200 -4.160 1.00 55.52 H new ATOM 0 HB3 PRO A 18 -15.016 11.428 -5.686 1.00 55.52 H new ATOM 0 HG2 PRO A 18 -15.138 8.994 -3.940 1.00 21.42 H new ATOM 0 HG3 PRO A 18 -15.168 9.103 -5.689 1.00 21.42 H new ATOM 0 HD2 PRO A 18 -12.926 8.381 -4.334 1.00 12.44 H new ATOM 0 HD3 PRO A 18 -12.846 9.248 -5.855 1.00 12.44 H new ATOM 298 N TYR A 19 -13.760 10.805 -1.700 1.00 24.14 N ATOM 299 CA TYR A 19 -14.095 10.871 -0.292 1.00 53.25 C ATOM 300 C TYR A 19 -12.890 11.242 0.549 1.00 73.05 C ATOM 301 O TYR A 19 -11.743 11.018 0.162 1.00 54.33 O ATOM 302 CB TYR A 19 -14.725 9.555 0.208 1.00 12.24 C ATOM 303 CG TYR A 19 -15.986 9.172 -0.530 1.00 14.44 C ATOM 304 CD1 TYR A 19 -17.219 9.615 -0.100 1.00 62.24 C ATOM 305 CD2 TYR A 19 -15.937 8.378 -1.661 1.00 62.41 C ATOM 306 CE1 TYR A 19 -18.374 9.281 -0.774 1.00 13.31 C ATOM 307 CE2 TYR A 19 -17.084 8.038 -2.345 1.00 21.23 C ATOM 308 CZ TYR A 19 -18.302 8.491 -1.898 1.00 35.20 C ATOM 309 OH TYR A 19 -19.456 8.154 -2.580 1.00 33.52 O ATOM 0 H TYR A 19 -13.274 9.953 -1.980 1.00 24.14 H new ATOM 0 HA TYR A 19 -14.840 11.659 -0.180 1.00 53.25 H new ATOM 0 HB2 TYR A 19 -13.996 8.751 0.107 1.00 12.24 H new ATOM 0 HB3 TYR A 19 -14.950 9.650 1.270 1.00 12.24 H new ATOM 0 HD1 TYR A 19 -17.281 10.236 0.782 1.00 62.24 H new ATOM 0 HD2 TYR A 19 -14.982 8.018 -2.015 1.00 62.41 H new ATOM 0 HE1 TYR A 19 -19.331 9.638 -0.422 1.00 13.31 H new ATOM 0 HE2 TYR A 19 -17.026 7.419 -3.228 1.00 21.23 H new ATOM 0 HH TYR A 19 -19.229 7.593 -3.350 1.00 33.52 H new ATOM 319 N THR A 20 -13.155 11.808 1.682 1.00 35.23 N ATOM 320 CA THR A 20 -12.124 12.226 2.596 1.00 45.43 C ATOM 321 C THR A 20 -12.247 11.439 3.865 1.00 1.12 C ATOM 322 O THR A 20 -13.319 11.440 4.503 1.00 44.11 O ATOM 323 CB THR A 20 -12.224 13.731 2.921 1.00 20.34 C ATOM 324 OG1 THR A 20 -13.528 14.030 3.455 1.00 23.33 O ATOM 325 CG2 THR A 20 -11.971 14.583 1.686 1.00 52.21 C ATOM 0 H THR A 20 -14.102 11.998 2.009 1.00 35.23 H new ATOM 0 HA THR A 20 -11.158 12.047 2.123 1.00 45.43 H new ATOM 0 HB THR A 20 -11.459 13.967 3.661 1.00 20.34 H new ATOM 0 HG1 THR A 20 -13.871 13.249 3.938 1.00 23.33 H new ATOM 0 HG21 THR A 20 -12.049 15.638 1.949 1.00 52.21 H new ATOM 0 HG22 THR A 20 -10.972 14.378 1.301 1.00 52.21 H new ATOM 0 HG23 THR A 20 -12.711 14.344 0.922 1.00 52.21 H new ATOM 333 N MET A 21 -11.203 10.758 4.229 1.00 54.12 N ATOM 334 CA MET A 21 -11.224 9.934 5.415 1.00 34.21 C ATOM 335 C MET A 21 -9.813 9.631 5.847 1.00 20.12 C ATOM 336 O MET A 21 -8.923 9.564 5.010 1.00 52.13 O ATOM 337 CB MET A 21 -11.990 8.627 5.150 1.00 32.12 C ATOM 338 CG MET A 21 -12.169 7.760 6.378 1.00 74.04 C ATOM 339 SD MET A 21 -13.050 8.624 7.684 1.00 1.43 S ATOM 340 CE MET A 21 -13.048 7.392 8.976 1.00 30.42 C ATOM 0 H MET A 21 -10.317 10.752 3.723 1.00 54.12 H new ATOM 0 HA MET A 21 -11.735 10.475 6.211 1.00 34.21 H new ATOM 0 HB2 MET A 21 -12.971 8.869 4.742 1.00 32.12 H new ATOM 0 HB3 MET A 21 -11.460 8.055 4.388 1.00 32.12 H new ATOM 0 HG2 MET A 21 -12.715 6.856 6.108 1.00 74.04 H new ATOM 0 HG3 MET A 21 -11.192 7.445 6.746 1.00 74.04 H new ATOM 0 HE1 MET A 21 -13.694 7.718 9.791 1.00 30.42 H new ATOM 0 HE2 MET A 21 -13.416 6.446 8.578 1.00 30.42 H new ATOM 0 HE3 MET A 21 -12.033 7.258 9.350 1.00 30.42 H new ATOM 350 N LYS A 22 -9.603 9.451 7.129 1.00 62.22 N ATOM 351 CA LYS A 22 -8.294 9.096 7.600 1.00 71.54 C ATOM 352 C LYS A 22 -8.138 7.582 7.641 1.00 72.30 C ATOM 353 O LYS A 22 -9.037 6.852 8.105 1.00 12.35 O ATOM 354 CB LYS A 22 -7.961 9.730 8.953 1.00 14.32 C ATOM 355 CG LYS A 22 -7.874 11.246 8.910 1.00 73.11 C ATOM 356 CD LYS A 22 -7.414 11.811 10.237 1.00 2.22 C ATOM 357 CE LYS A 22 -7.309 13.324 10.182 1.00 73.21 C ATOM 358 NZ LYS A 22 -6.820 13.894 11.458 1.00 13.42 N ATOM 0 H LYS A 22 -10.315 9.544 7.854 1.00 62.22 H new ATOM 0 HA LYS A 22 -7.573 9.502 6.890 1.00 71.54 H new ATOM 0 HB2 LYS A 22 -8.721 9.439 9.678 1.00 14.32 H new ATOM 0 HB3 LYS A 22 -7.011 9.330 9.308 1.00 14.32 H new ATOM 0 HG2 LYS A 22 -7.183 11.550 8.124 1.00 73.11 H new ATOM 0 HG3 LYS A 22 -8.849 11.661 8.655 1.00 73.11 H new ATOM 0 HD2 LYS A 22 -8.113 11.521 11.021 1.00 2.22 H new ATOM 0 HD3 LYS A 22 -6.445 11.386 10.500 1.00 2.22 H new ATOM 0 HE2 LYS A 22 -6.635 13.611 9.375 1.00 73.21 H new ATOM 0 HE3 LYS A 22 -8.286 13.747 9.947 1.00 73.21 H new ATOM 0 HZ1 LYS A 22 -6.763 14.929 11.377 1.00 13.42 H new ATOM 0 HZ2 LYS A 22 -7.476 13.642 12.225 1.00 13.42 H new ATOM 0 HZ3 LYS A 22 -5.877 13.511 11.670 1.00 13.42 H new ATOM 372 N PRO A 23 -7.009 7.093 7.130 1.00 74.10 N ATOM 373 CA PRO A 23 -6.732 5.672 7.013 1.00 51.20 C ATOM 374 C PRO A 23 -6.531 5.008 8.358 1.00 43.02 C ATOM 375 O PRO A 23 -5.732 5.462 9.189 1.00 22.11 O ATOM 376 CB PRO A 23 -5.440 5.624 6.207 1.00 45.34 C ATOM 377 CG PRO A 23 -4.778 6.924 6.477 1.00 53.13 C ATOM 378 CD PRO A 23 -5.885 7.911 6.636 1.00 24.12 C ATOM 0 HA PRO A 23 -7.562 5.138 6.550 1.00 51.20 H new ATOM 0 HB2 PRO A 23 -4.812 4.788 6.516 1.00 45.34 H new ATOM 0 HB3 PRO A 23 -5.641 5.496 5.143 1.00 45.34 H new ATOM 0 HG2 PRO A 23 -4.166 6.873 7.377 1.00 53.13 H new ATOM 0 HG3 PRO A 23 -4.117 7.205 5.657 1.00 53.13 H new ATOM 0 HD2 PRO A 23 -5.622 8.699 7.342 1.00 24.12 H new ATOM 0 HD3 PRO A 23 -6.128 8.397 5.691 1.00 24.12 H new ATOM 386 N LYS A 24 -7.257 3.959 8.580 1.00 4.24 N ATOM 387 CA LYS A 24 -7.150 3.231 9.800 1.00 74.53 C ATOM 388 C LYS A 24 -6.564 1.861 9.511 1.00 41.32 C ATOM 389 O LYS A 24 -6.119 1.152 10.413 1.00 51.10 O ATOM 390 CB LYS A 24 -8.525 3.098 10.439 1.00 53.14 C ATOM 391 CG LYS A 24 -8.586 2.418 11.806 1.00 55.32 C ATOM 392 CD LYS A 24 -8.145 3.308 12.997 1.00 54.12 C ATOM 393 CE LYS A 24 -6.683 3.713 12.989 1.00 14.00 C ATOM 394 NZ LYS A 24 -6.341 4.518 14.177 1.00 72.52 N ATOM 0 H LYS A 24 -7.939 3.585 7.921 1.00 4.24 H new ATOM 0 HA LYS A 24 -6.496 3.760 10.493 1.00 74.53 H new ATOM 0 HB2 LYS A 24 -8.952 4.096 10.537 1.00 53.14 H new ATOM 0 HB3 LYS A 24 -9.166 2.542 9.754 1.00 53.14 H new ATOM 0 HG2 LYS A 24 -9.607 2.080 11.982 1.00 55.32 H new ATOM 0 HG3 LYS A 24 -7.955 1.529 11.782 1.00 55.32 H new ATOM 0 HD2 LYS A 24 -8.756 4.210 13.002 1.00 54.12 H new ATOM 0 HD3 LYS A 24 -8.354 2.776 13.925 1.00 54.12 H new ATOM 0 HE2 LYS A 24 -6.057 2.821 12.959 1.00 14.00 H new ATOM 0 HE3 LYS A 24 -6.467 4.284 12.086 1.00 14.00 H new ATOM 0 HZ1 LYS A 24 -5.427 4.202 14.559 1.00 72.52 H new ATOM 0 HZ2 LYS A 24 -6.276 5.521 13.910 1.00 72.52 H new ATOM 0 HZ3 LYS A 24 -7.079 4.400 14.901 1.00 72.52 H new ATOM 408 N TYR A 25 -6.574 1.494 8.259 1.00 32.43 N ATOM 409 CA TYR A 25 -6.050 0.222 7.840 1.00 24.15 C ATOM 410 C TYR A 25 -5.052 0.435 6.736 1.00 53.24 C ATOM 411 O TYR A 25 -4.903 1.549 6.240 1.00 54.03 O ATOM 412 CB TYR A 25 -7.159 -0.698 7.328 1.00 3.42 C ATOM 413 CG TYR A 25 -8.292 -0.963 8.298 1.00 24.44 C ATOM 414 CD1 TYR A 25 -9.414 -0.139 8.339 1.00 11.14 C ATOM 415 CD2 TYR A 25 -8.239 -2.036 9.168 1.00 12.42 C ATOM 416 CE1 TYR A 25 -10.444 -0.385 9.226 1.00 13.34 C ATOM 417 CE2 TYR A 25 -9.263 -2.291 10.056 1.00 70.21 C ATOM 418 CZ TYR A 25 -10.361 -1.465 10.082 1.00 13.31 C ATOM 419 OH TYR A 25 -11.382 -1.713 10.978 1.00 74.22 O ATOM 0 H TYR A 25 -6.945 2.067 7.501 1.00 32.43 H new ATOM 0 HA TYR A 25 -5.578 -0.249 8.702 1.00 24.15 H new ATOM 0 HB2 TYR A 25 -7.577 -0.263 6.420 1.00 3.42 H new ATOM 0 HB3 TYR A 25 -6.714 -1.653 7.048 1.00 3.42 H new ATOM 0 HD1 TYR A 25 -9.480 0.704 7.668 1.00 11.14 H new ATOM 0 HD2 TYR A 25 -7.378 -2.688 9.152 1.00 12.42 H new ATOM 0 HE1 TYR A 25 -11.308 0.263 9.250 1.00 13.34 H new ATOM 0 HE2 TYR A 25 -9.202 -3.135 10.727 1.00 70.21 H new ATOM 0 HH TYR A 25 -11.168 -2.511 11.506 1.00 74.22 H new ATOM 429 N ILE A 26 -4.383 -0.616 6.343 1.00 63.24 N ATOM 430 CA ILE A 26 -3.433 -0.574 5.253 1.00 43.12 C ATOM 431 C ILE A 26 -3.605 -1.841 4.428 1.00 65.24 C ATOM 432 O ILE A 26 -3.802 -2.903 4.978 1.00 32.20 O ATOM 433 CB ILE A 26 -1.951 -0.438 5.764 1.00 5.54 C ATOM 434 CG1 ILE A 26 -1.801 0.855 6.599 1.00 12.14 C ATOM 435 CG2 ILE A 26 -0.958 -0.442 4.594 1.00 41.22 C ATOM 436 CD1 ILE A 26 -0.416 1.125 7.134 1.00 14.40 C ATOM 0 H ILE A 26 -4.480 -1.536 6.772 1.00 63.24 H new ATOM 0 HA ILE A 26 -3.629 0.308 4.643 1.00 43.12 H new ATOM 0 HB ILE A 26 -1.723 -1.298 6.394 1.00 5.54 H new ATOM 0 HG12 ILE A 26 -2.105 1.702 5.984 1.00 12.14 H new ATOM 0 HG13 ILE A 26 -2.493 0.807 7.439 1.00 12.14 H new ATOM 0 HG21 ILE A 26 0.058 -0.347 4.978 1.00 41.22 H new ATOM 0 HG22 ILE A 26 -1.051 -1.377 4.041 1.00 41.22 H new ATOM 0 HG23 ILE A 26 -1.175 0.395 3.930 1.00 41.22 H new ATOM 0 HD11 ILE A 26 -0.421 2.054 7.704 1.00 14.40 H new ATOM 0 HD12 ILE A 26 -0.110 0.304 7.782 1.00 14.40 H new ATOM 0 HD13 ILE A 26 0.284 1.213 6.303 1.00 14.40 H new ATOM 448 N THR A 27 -3.575 -1.715 3.138 1.00 64.10 N ATOM 449 CA THR A 27 -3.752 -2.840 2.254 1.00 34.01 C ATOM 450 C THR A 27 -2.523 -2.984 1.333 1.00 72.04 C ATOM 451 O THR A 27 -2.222 -2.086 0.534 1.00 4.14 O ATOM 452 CB THR A 27 -5.022 -2.642 1.394 1.00 35.30 C ATOM 453 OG1 THR A 27 -6.136 -2.344 2.245 1.00 74.54 O ATOM 454 CG2 THR A 27 -5.339 -3.902 0.597 1.00 13.32 C ATOM 0 H THR A 27 -3.427 -0.827 2.659 1.00 64.10 H new ATOM 0 HA THR A 27 -3.861 -3.744 2.853 1.00 34.01 H new ATOM 0 HB THR A 27 -4.841 -1.819 0.703 1.00 35.30 H new ATOM 0 HG1 THR A 27 -6.354 -1.391 2.177 1.00 74.54 H new ATOM 0 HG21 THR A 27 -6.236 -3.739 -0.000 1.00 13.32 H new ATOM 0 HG22 THR A 27 -4.502 -4.136 -0.061 1.00 13.32 H new ATOM 0 HG23 THR A 27 -5.505 -4.734 1.282 1.00 13.32 H new ATOM 462 N VAL A 28 -1.832 -4.104 1.442 1.00 20.22 N ATOM 463 CA VAL A 28 -0.630 -4.366 0.652 1.00 31.31 C ATOM 464 C VAL A 28 -0.973 -5.226 -0.584 1.00 53.03 C ATOM 465 O VAL A 28 -1.853 -6.109 -0.522 1.00 4.05 O ATOM 466 CB VAL A 28 0.426 -5.092 1.516 1.00 72.41 C ATOM 467 CG1 VAL A 28 1.701 -5.361 0.728 1.00 20.43 C ATOM 468 CG2 VAL A 28 0.739 -4.263 2.738 1.00 53.14 C ATOM 0 H VAL A 28 -2.083 -4.861 2.078 1.00 20.22 H new ATOM 0 HA VAL A 28 -0.224 -3.412 0.315 1.00 31.31 H new ATOM 0 HB VAL A 28 0.013 -6.054 1.821 1.00 72.41 H new ATOM 0 HG11 VAL A 28 2.422 -5.872 1.366 1.00 20.43 H new ATOM 0 HG12 VAL A 28 1.471 -5.987 -0.134 1.00 20.43 H new ATOM 0 HG13 VAL A 28 2.124 -4.416 0.387 1.00 20.43 H new ATOM 0 HG21 VAL A 28 1.484 -4.777 3.345 1.00 53.14 H new ATOM 0 HG22 VAL A 28 1.129 -3.293 2.430 1.00 53.14 H new ATOM 0 HG23 VAL A 28 -0.170 -4.119 3.323 1.00 53.14 H new ATOM 478 N HIS A 29 -0.328 -4.940 -1.706 1.00 75.24 N ATOM 479 CA HIS A 29 -0.546 -5.672 -2.953 1.00 22.33 C ATOM 480 C HIS A 29 0.849 -5.955 -3.550 1.00 21.20 C ATOM 481 O HIS A 29 1.793 -5.205 -3.280 1.00 51.01 O ATOM 482 CB HIS A 29 -1.359 -4.807 -4.000 1.00 31.50 C ATOM 483 CG HIS A 29 -2.585 -4.056 -3.466 1.00 20.42 C ATOM 484 ND1 HIS A 29 -3.957 -4.242 -3.885 1.00 60.55 N ATOM 485 CD2 HIS A 29 -2.623 -3.051 -2.558 1.00 41.34 C ATOM 486 CE1 HIS A 29 -4.671 -3.345 -3.205 1.00 23.25 C ATOM 487 NE2 HIS A 29 -3.904 -2.643 -2.416 1.00 15.52 N ATOM 0 H HIS A 29 0.363 -4.193 -1.781 1.00 75.24 H new ATOM 0 HA HIS A 29 -1.113 -6.580 -2.747 1.00 22.33 H new ATOM 0 HB2 HIS A 29 -0.679 -4.078 -4.441 1.00 31.50 H new ATOM 0 HB3 HIS A 29 -1.687 -5.465 -4.805 1.00 31.50 H new ATOM 0 HD2 HIS A 29 -1.771 -2.643 -2.034 1.00 41.34 H new ATOM 0 HE1 HIS A 29 -5.740 -3.216 -3.295 1.00 23.25 H new ATOM 0 HE2 HIS A 29 -4.221 -1.903 -1.790 1.00 15.52 H new ATOM 495 N ASN A 30 0.977 -7.018 -4.310 1.00 52.43 N ATOM 496 CA ASN A 30 2.228 -7.334 -5.020 1.00 0.04 C ATOM 497 C ASN A 30 2.000 -7.118 -6.486 1.00 65.22 C ATOM 498 O ASN A 30 0.870 -7.287 -6.977 1.00 45.34 O ATOM 499 CB ASN A 30 2.705 -8.799 -4.824 1.00 23.53 C ATOM 500 CG ASN A 30 3.317 -9.162 -3.474 1.00 72.31 C ATOM 501 OD1 ASN A 30 3.178 -10.305 -3.025 1.00 40.11 O ATOM 502 ND2 ASN A 30 4.058 -8.267 -2.859 1.00 43.41 N ATOM 0 H ASN A 30 0.230 -7.695 -4.463 1.00 52.43 H new ATOM 0 HA ASN A 30 3.000 -6.684 -4.609 1.00 0.04 H new ATOM 0 HB2 ASN A 30 1.853 -9.457 -4.996 1.00 23.53 H new ATOM 0 HB3 ASN A 30 3.440 -9.021 -5.598 1.00 23.53 H new ATOM 0 HD21 ASN A 30 4.534 -8.509 -1.990 1.00 43.41 H new ATOM 0 HD22 ASN A 30 4.156 -7.330 -3.251 1.00 43.41 H new ATOM 509 N THR A 31 3.031 -6.763 -7.191 1.00 51.12 N ATOM 510 CA THR A 31 2.914 -6.524 -8.593 1.00 61.52 C ATOM 511 C THR A 31 3.180 -7.769 -9.419 1.00 41.30 C ATOM 512 O THR A 31 4.205 -8.433 -9.270 1.00 20.55 O ATOM 513 CB THR A 31 3.834 -5.390 -9.056 1.00 14.20 C ATOM 514 OG1 THR A 31 5.134 -5.579 -8.492 1.00 75.33 O ATOM 515 CG2 THR A 31 3.278 -4.030 -8.665 1.00 32.41 C ATOM 0 H THR A 31 3.969 -6.632 -6.812 1.00 51.12 H new ATOM 0 HA THR A 31 1.879 -6.225 -8.757 1.00 61.52 H new ATOM 0 HB THR A 31 3.899 -5.415 -10.144 1.00 14.20 H new ATOM 0 HG1 THR A 31 5.101 -5.404 -7.528 1.00 75.33 H new ATOM 0 HG21 THR A 31 3.955 -3.248 -9.008 1.00 32.41 H new ATOM 0 HG22 THR A 31 2.300 -3.891 -9.125 1.00 32.41 H new ATOM 0 HG23 THR A 31 3.180 -3.975 -7.581 1.00 32.41 H new ATOM 523 N TYR A 32 2.251 -8.061 -10.298 1.00 1.52 N ATOM 524 CA TYR A 32 2.362 -9.151 -11.246 1.00 50.35 C ATOM 525 C TYR A 32 3.368 -8.854 -12.351 1.00 33.32 C ATOM 526 O TYR A 32 3.632 -9.704 -13.214 1.00 33.32 O ATOM 527 CB TYR A 32 1.005 -9.539 -11.823 1.00 74.13 C ATOM 528 CG TYR A 32 0.158 -10.402 -10.912 1.00 42.00 C ATOM 529 CD1 TYR A 32 -0.608 -9.866 -9.878 1.00 24.41 C ATOM 530 CD2 TYR A 32 0.135 -11.774 -11.095 1.00 1.13 C ATOM 531 CE1 TYR A 32 -1.372 -10.693 -9.061 1.00 24.40 C ATOM 532 CE2 TYR A 32 -0.615 -12.595 -10.294 1.00 64.35 C ATOM 533 CZ TYR A 32 -1.367 -12.060 -9.281 1.00 2.15 C ATOM 534 OH TYR A 32 -2.114 -12.903 -8.481 1.00 31.34 O ATOM 0 H TYR A 32 1.378 -7.539 -10.378 1.00 1.52 H new ATOM 0 HA TYR A 32 2.741 -10.008 -10.690 1.00 50.35 H new ATOM 0 HB2 TYR A 32 0.452 -8.630 -12.059 1.00 74.13 H new ATOM 0 HB3 TYR A 32 1.162 -10.070 -12.762 1.00 74.13 H new ATOM 0 HD1 TYR A 32 -0.608 -8.799 -9.710 1.00 24.41 H new ATOM 0 HD2 TYR A 32 0.723 -12.209 -11.890 1.00 1.13 H new ATOM 0 HE1 TYR A 32 -1.964 -10.272 -8.262 1.00 24.40 H new ATOM 0 HE2 TYR A 32 -0.613 -13.662 -10.461 1.00 64.35 H new ATOM 0 HH TYR A 32 -2.591 -12.376 -7.806 1.00 31.34 H new ATOM 544 N ASN A 33 3.897 -7.650 -12.355 1.00 73.22 N ATOM 545 CA ASN A 33 4.879 -7.259 -13.344 1.00 10.34 C ATOM 546 C ASN A 33 6.059 -6.612 -12.644 1.00 33.54 C ATOM 547 O ASN A 33 5.998 -6.317 -11.446 1.00 51.44 O ATOM 548 CB ASN A 33 4.280 -6.270 -14.375 1.00 32.10 C ATOM 549 CG ASN A 33 4.049 -4.864 -13.815 1.00 22.34 C ATOM 550 OD1 ASN A 33 4.930 -4.022 -13.878 1.00 5.34 O ATOM 551 ND2 ASN A 33 2.876 -4.596 -13.295 1.00 22.52 N ATOM 0 H ASN A 33 3.662 -6.921 -11.681 1.00 73.22 H new ATOM 0 HA ASN A 33 5.201 -8.151 -13.882 1.00 10.34 H new ATOM 0 HB2 ASN A 33 4.948 -6.204 -15.234 1.00 32.10 H new ATOM 0 HB3 ASN A 33 3.332 -6.667 -14.738 1.00 32.10 H new ATOM 0 HD21 ASN A 33 2.681 -3.664 -12.930 1.00 22.52 H new ATOM 0 HD22 ASN A 33 2.158 -5.320 -13.256 1.00 22.52 H new ATOM 558 N ASP A 34 7.125 -6.427 -13.366 1.00 4.32 N ATOM 559 CA ASP A 34 8.273 -5.728 -12.855 1.00 31.00 C ATOM 560 C ASP A 34 8.346 -4.363 -13.491 1.00 20.42 C ATOM 561 O ASP A 34 8.322 -4.238 -14.715 1.00 21.12 O ATOM 562 CB ASP A 34 9.592 -6.513 -13.058 1.00 0.25 C ATOM 563 CG ASP A 34 9.971 -6.797 -14.502 1.00 44.45 C ATOM 564 OD1 ASP A 34 9.479 -7.797 -15.071 1.00 25.45 O ATOM 565 OD2 ASP A 34 10.800 -6.056 -15.076 1.00 1.12 O ATOM 0 H ASP A 34 7.226 -6.756 -14.326 1.00 4.32 H new ATOM 0 HA ASP A 34 8.152 -5.624 -11.777 1.00 31.00 H new ATOM 0 HB2 ASP A 34 10.403 -5.953 -12.592 1.00 0.25 H new ATOM 0 HB3 ASP A 34 9.514 -7.462 -12.528 1.00 0.25 H new ATOM 570 N ALA A 35 8.385 -3.354 -12.666 1.00 62.05 N ATOM 571 CA ALA A 35 8.450 -1.982 -13.107 1.00 73.22 C ATOM 572 C ALA A 35 8.818 -1.113 -11.929 1.00 14.32 C ATOM 573 O ALA A 35 8.577 -1.505 -10.789 1.00 22.21 O ATOM 574 CB ALA A 35 7.097 -1.539 -13.667 1.00 13.22 C ATOM 0 H ALA A 35 8.372 -3.460 -11.652 1.00 62.05 H new ATOM 0 HA ALA A 35 9.199 -1.888 -13.893 1.00 73.22 H new ATOM 0 HB1 ALA A 35 7.161 -0.502 -13.996 1.00 13.22 H new ATOM 0 HB2 ALA A 35 6.829 -2.172 -14.513 1.00 13.22 H new ATOM 0 HB3 ALA A 35 6.336 -1.627 -12.892 1.00 13.22 H new ATOM 580 N PRO A 36 9.440 0.051 -12.172 1.00 45.31 N ATOM 581 CA PRO A 36 9.750 1.000 -11.124 1.00 23.40 C ATOM 582 C PRO A 36 8.481 1.592 -10.562 1.00 62.23 C ATOM 583 O PRO A 36 7.497 1.779 -11.298 1.00 54.44 O ATOM 584 CB PRO A 36 10.583 2.077 -11.804 1.00 42.14 C ATOM 585 CG PRO A 36 10.360 1.918 -13.253 1.00 1.44 C ATOM 586 CD PRO A 36 9.886 0.517 -13.487 1.00 33.13 C ATOM 0 HA PRO A 36 10.280 0.537 -10.292 1.00 23.40 H new ATOM 0 HB2 PRO A 36 10.282 3.070 -11.471 1.00 42.14 H new ATOM 0 HB3 PRO A 36 11.639 1.965 -11.558 1.00 42.14 H new ATOM 0 HG2 PRO A 36 9.621 2.637 -13.608 1.00 1.44 H new ATOM 0 HG3 PRO A 36 11.280 2.108 -13.805 1.00 1.44 H new ATOM 0 HD2 PRO A 36 9.074 0.490 -14.213 1.00 33.13 H new ATOM 0 HD3 PRO A 36 10.686 -0.111 -13.880 1.00 33.13 H new ATOM 594 N ALA A 37 8.493 1.902 -9.287 1.00 51.02 N ATOM 595 CA ALA A 37 7.289 2.373 -8.588 1.00 35.54 C ATOM 596 C ALA A 37 6.738 3.642 -9.217 1.00 13.11 C ATOM 597 O ALA A 37 5.525 3.857 -9.268 1.00 14.44 O ATOM 598 CB ALA A 37 7.580 2.585 -7.120 1.00 20.32 C ATOM 0 H ALA A 37 9.323 1.841 -8.697 1.00 51.02 H new ATOM 0 HA ALA A 37 6.525 1.602 -8.684 1.00 35.54 H new ATOM 0 HB1 ALA A 37 6.678 2.934 -6.617 1.00 20.32 H new ATOM 0 HB2 ALA A 37 7.904 1.645 -6.674 1.00 20.32 H new ATOM 0 HB3 ALA A 37 8.368 3.330 -7.009 1.00 20.32 H new ATOM 604 N GLU A 38 7.637 4.457 -9.725 1.00 43.53 N ATOM 605 CA GLU A 38 7.283 5.696 -10.388 1.00 71.14 C ATOM 606 C GLU A 38 6.426 5.421 -11.621 1.00 24.32 C ATOM 607 O GLU A 38 5.447 6.135 -11.890 1.00 54.43 O ATOM 608 CB GLU A 38 8.562 6.497 -10.708 1.00 35.52 C ATOM 609 CG GLU A 38 8.372 7.742 -11.534 1.00 52.40 C ATOM 610 CD GLU A 38 9.669 8.479 -11.683 1.00 64.11 C ATOM 611 OE1 GLU A 38 10.648 7.881 -12.189 1.00 54.24 O ATOM 612 OE2 GLU A 38 9.756 9.629 -11.233 1.00 4.22 O ATOM 0 H GLU A 38 8.641 4.279 -9.690 1.00 43.53 H new ATOM 0 HA GLU A 38 6.674 6.310 -9.725 1.00 71.14 H new ATOM 0 HB2 GLU A 38 9.036 6.778 -9.767 1.00 35.52 H new ATOM 0 HB3 GLU A 38 9.257 5.840 -11.231 1.00 35.52 H new ATOM 0 HG2 GLU A 38 7.983 7.477 -12.517 1.00 52.40 H new ATOM 0 HG3 GLU A 38 7.632 8.389 -11.062 1.00 52.40 H new ATOM 619 N ASN A 39 6.751 4.355 -12.323 1.00 32.13 N ATOM 620 CA ASN A 39 5.990 3.967 -13.489 1.00 63.31 C ATOM 621 C ASN A 39 4.657 3.379 -13.124 1.00 71.51 C ATOM 622 O ASN A 39 3.676 3.581 -13.839 1.00 30.14 O ATOM 623 CB ASN A 39 6.753 3.038 -14.434 1.00 41.10 C ATOM 624 CG ASN A 39 7.856 3.737 -15.193 1.00 41.41 C ATOM 625 OD1 ASN A 39 7.818 4.951 -15.385 1.00 51.15 O ATOM 626 ND2 ASN A 39 8.788 2.982 -15.704 1.00 11.42 N ATOM 0 H ASN A 39 7.537 3.743 -12.105 1.00 32.13 H new ATOM 0 HA ASN A 39 5.815 4.893 -14.036 1.00 63.31 H new ATOM 0 HB2 ASN A 39 7.180 2.217 -13.859 1.00 41.10 H new ATOM 0 HB3 ASN A 39 6.053 2.599 -15.145 1.00 41.10 H new ATOM 0 HD21 ASN A 39 9.518 3.395 -16.285 1.00 11.42 H new ATOM 0 HD22 ASN A 39 8.787 1.978 -15.523 1.00 11.42 H new ATOM 633 N GLU A 40 4.593 2.672 -12.006 1.00 21.41 N ATOM 634 CA GLU A 40 3.326 2.081 -11.587 1.00 63.33 C ATOM 635 C GLU A 40 2.356 3.150 -11.114 1.00 62.42 C ATOM 636 O GLU A 40 1.156 3.062 -11.358 1.00 54.22 O ATOM 637 CB GLU A 40 3.509 0.969 -10.546 1.00 15.40 C ATOM 638 CG GLU A 40 4.173 -0.290 -11.102 1.00 3.40 C ATOM 639 CD GLU A 40 3.354 -0.939 -12.215 1.00 24.00 C ATOM 640 OE1 GLU A 40 3.545 -0.584 -13.398 1.00 64.12 O ATOM 641 OE2 GLU A 40 2.493 -1.813 -11.922 1.00 5.04 O ATOM 0 H GLU A 40 5.381 2.495 -11.384 1.00 21.41 H new ATOM 0 HA GLU A 40 2.891 1.602 -12.464 1.00 63.33 H new ATOM 0 HB2 GLU A 40 4.110 1.351 -9.721 1.00 15.40 H new ATOM 0 HB3 GLU A 40 2.535 0.704 -10.135 1.00 15.40 H new ATOM 0 HG2 GLU A 40 5.162 -0.037 -11.483 1.00 3.40 H new ATOM 0 HG3 GLU A 40 4.317 -1.008 -10.295 1.00 3.40 H new ATOM 648 N VAL A 41 2.882 4.181 -10.481 1.00 1.31 N ATOM 649 CA VAL A 41 2.044 5.297 -10.039 1.00 32.11 C ATOM 650 C VAL A 41 1.524 6.061 -11.243 1.00 52.14 C ATOM 651 O VAL A 41 0.331 6.380 -11.324 1.00 71.23 O ATOM 652 CB VAL A 41 2.792 6.269 -9.084 1.00 62.21 C ATOM 653 CG1 VAL A 41 1.928 7.482 -8.755 1.00 5.10 C ATOM 654 CG2 VAL A 41 3.160 5.559 -7.808 1.00 40.52 C ATOM 0 H VAL A 41 3.873 4.276 -10.260 1.00 1.31 H new ATOM 0 HA VAL A 41 1.214 4.869 -9.477 1.00 32.11 H new ATOM 0 HB VAL A 41 3.696 6.608 -9.589 1.00 62.21 H new ATOM 0 HG11 VAL A 41 2.474 8.147 -8.085 1.00 5.10 H new ATOM 0 HG12 VAL A 41 1.683 8.014 -9.674 1.00 5.10 H new ATOM 0 HG13 VAL A 41 1.009 7.153 -8.270 1.00 5.10 H new ATOM 0 HG21 VAL A 41 3.684 6.249 -7.146 1.00 40.52 H new ATOM 0 HG22 VAL A 41 2.255 5.201 -7.317 1.00 40.52 H new ATOM 0 HG23 VAL A 41 3.808 4.713 -8.036 1.00 40.52 H new ATOM 664 N SER A 42 2.416 6.317 -12.189 1.00 51.33 N ATOM 665 CA SER A 42 2.073 7.034 -13.391 1.00 50.14 C ATOM 666 C SER A 42 1.020 6.243 -14.197 1.00 23.13 C ATOM 667 O SER A 42 0.161 6.827 -14.860 1.00 50.32 O ATOM 668 CB SER A 42 3.338 7.292 -14.222 1.00 2.31 C ATOM 669 OG SER A 42 3.073 8.149 -15.314 1.00 65.33 O ATOM 0 H SER A 42 3.394 6.031 -12.138 1.00 51.33 H new ATOM 0 HA SER A 42 1.638 7.998 -13.129 1.00 50.14 H new ATOM 0 HB2 SER A 42 4.107 7.735 -13.589 1.00 2.31 H new ATOM 0 HB3 SER A 42 3.733 6.345 -14.589 1.00 2.31 H new ATOM 0 HG SER A 42 3.898 8.295 -15.823 1.00 65.33 H new ATOM 675 N TYR A 43 1.090 4.920 -14.114 1.00 60.24 N ATOM 676 CA TYR A 43 0.123 4.057 -14.767 1.00 45.23 C ATOM 677 C TYR A 43 -1.205 4.079 -14.020 1.00 15.53 C ATOM 678 O TYR A 43 -2.249 4.284 -14.622 1.00 45.11 O ATOM 679 CB TYR A 43 0.655 2.616 -14.865 1.00 75.11 C ATOM 680 CG TYR A 43 -0.327 1.628 -15.477 1.00 74.10 C ATOM 681 CD1 TYR A 43 -0.423 1.472 -16.851 1.00 43.40 C ATOM 682 CD2 TYR A 43 -1.166 0.860 -14.671 1.00 20.41 C ATOM 683 CE1 TYR A 43 -1.320 0.582 -17.406 1.00 20.43 C ATOM 684 CE2 TYR A 43 -2.065 -0.030 -15.220 1.00 1.21 C ATOM 685 CZ TYR A 43 -2.140 -0.164 -16.586 1.00 42.42 C ATOM 686 OH TYR A 43 -3.037 -1.048 -17.136 1.00 2.22 O ATOM 0 H TYR A 43 1.814 4.422 -13.596 1.00 60.24 H new ATOM 0 HA TYR A 43 -0.039 4.434 -15.777 1.00 45.23 H new ATOM 0 HB2 TYR A 43 1.569 2.618 -15.459 1.00 75.11 H new ATOM 0 HB3 TYR A 43 0.925 2.272 -13.867 1.00 75.11 H new ATOM 0 HD1 TYR A 43 0.215 2.056 -17.498 1.00 43.40 H new ATOM 0 HD2 TYR A 43 -1.111 0.964 -13.597 1.00 20.41 H new ATOM 0 HE1 TYR A 43 -1.379 0.470 -18.479 1.00 20.43 H new ATOM 0 HE2 TYR A 43 -2.706 -0.618 -14.580 1.00 1.21 H new ATOM 0 HH TYR A 43 -3.537 -1.494 -16.421 1.00 2.22 H new ATOM 696 N MET A 44 -1.148 3.886 -12.706 1.00 53.34 N ATOM 697 CA MET A 44 -2.332 3.813 -11.859 1.00 3.41 C ATOM 698 C MET A 44 -3.245 5.019 -12.023 1.00 13.33 C ATOM 699 O MET A 44 -4.450 4.862 -12.280 1.00 11.44 O ATOM 700 CB MET A 44 -1.929 3.548 -10.395 1.00 14.44 C ATOM 701 CG MET A 44 -3.070 3.527 -9.376 1.00 73.04 C ATOM 702 SD MET A 44 -3.562 5.167 -8.781 1.00 73.03 S ATOM 703 CE MET A 44 -2.066 5.672 -7.907 1.00 61.04 C ATOM 0 H MET A 44 -0.272 3.775 -12.196 1.00 53.34 H new ATOM 0 HA MET A 44 -2.931 2.964 -12.189 1.00 3.41 H new ATOM 0 HB2 MET A 44 -1.411 2.590 -10.350 1.00 14.44 H new ATOM 0 HB3 MET A 44 -1.213 4.312 -10.093 1.00 14.44 H new ATOM 0 HG2 MET A 44 -3.936 3.041 -9.826 1.00 73.04 H new ATOM 0 HG3 MET A 44 -2.770 2.918 -8.523 1.00 73.04 H new ATOM 0 HE1 MET A 44 -2.246 6.616 -7.393 1.00 61.04 H new ATOM 0 HE2 MET A 44 -1.795 4.908 -7.178 1.00 61.04 H new ATOM 0 HE3 MET A 44 -1.252 5.797 -8.621 1.00 61.04 H new ATOM 713 N ILE A 45 -2.682 6.204 -11.945 1.00 50.13 N ATOM 714 CA ILE A 45 -3.461 7.412 -12.106 1.00 61.31 C ATOM 715 C ILE A 45 -3.950 7.575 -13.552 1.00 55.25 C ATOM 716 O ILE A 45 -4.966 8.199 -13.792 1.00 1.13 O ATOM 717 CB ILE A 45 -2.696 8.685 -11.642 1.00 35.34 C ATOM 718 CG1 ILE A 45 -1.381 8.866 -12.424 1.00 74.14 C ATOM 719 CG2 ILE A 45 -2.441 8.634 -10.138 1.00 44.03 C ATOM 720 CD1 ILE A 45 -0.587 10.096 -12.029 1.00 41.13 C ATOM 0 H ILE A 45 -1.689 6.357 -11.771 1.00 50.13 H new ATOM 0 HA ILE A 45 -4.329 7.303 -11.456 1.00 61.31 H new ATOM 0 HB ILE A 45 -3.321 9.552 -11.854 1.00 35.34 H new ATOM 0 HG12 ILE A 45 -0.759 7.983 -12.276 1.00 74.14 H new ATOM 0 HG13 ILE A 45 -1.609 8.921 -13.488 1.00 74.14 H new ATOM 0 HG21 ILE A 45 -1.905 9.531 -9.829 1.00 44.03 H new ATOM 0 HG22 ILE A 45 -3.393 8.580 -9.609 1.00 44.03 H new ATOM 0 HG23 ILE A 45 -1.843 7.754 -9.900 1.00 44.03 H new ATOM 0 HD11 ILE A 45 0.323 10.149 -12.626 1.00 41.13 H new ATOM 0 HD12 ILE A 45 -1.188 10.989 -12.204 1.00 41.13 H new ATOM 0 HD13 ILE A 45 -0.325 10.036 -10.973 1.00 41.13 H new ATOM 732 N SER A 46 -3.260 6.953 -14.483 1.00 10.55 N ATOM 733 CA SER A 46 -3.588 7.069 -15.890 1.00 71.23 C ATOM 734 C SER A 46 -4.762 6.143 -16.274 1.00 63.23 C ATOM 735 O SER A 46 -5.353 6.293 -17.350 1.00 34.12 O ATOM 736 CB SER A 46 -2.340 6.764 -16.745 1.00 45.03 C ATOM 737 OG SER A 46 -2.571 6.966 -18.132 1.00 74.40 O ATOM 0 H SER A 46 -2.458 6.354 -14.288 1.00 10.55 H new ATOM 0 HA SER A 46 -3.908 8.092 -16.086 1.00 71.23 H new ATOM 0 HB2 SER A 46 -1.516 7.400 -16.420 1.00 45.03 H new ATOM 0 HB3 SER A 46 -2.031 5.732 -16.577 1.00 45.03 H new ATOM 0 HG SER A 46 -3.527 6.865 -18.323 1.00 74.40 H new ATOM 743 N ASN A 47 -5.109 5.190 -15.400 1.00 24.50 N ATOM 744 CA ASN A 47 -6.222 4.272 -15.705 1.00 53.22 C ATOM 745 C ASN A 47 -7.530 5.010 -15.744 1.00 45.42 C ATOM 746 O ASN A 47 -8.301 4.886 -16.693 1.00 12.54 O ATOM 747 CB ASN A 47 -6.346 3.098 -14.709 1.00 34.14 C ATOM 748 CG ASN A 47 -5.215 2.101 -14.771 1.00 10.21 C ATOM 749 OD1 ASN A 47 -5.246 1.165 -15.557 1.00 24.50 O ATOM 750 ND2 ASN A 47 -4.248 2.260 -13.918 1.00 25.54 N ATOM 0 H ASN A 47 -4.653 5.033 -14.501 1.00 24.50 H new ATOM 0 HA ASN A 47 -5.989 3.853 -16.684 1.00 53.22 H new ATOM 0 HB2 ASN A 47 -6.403 3.501 -13.698 1.00 34.14 H new ATOM 0 HB3 ASN A 47 -7.284 2.576 -14.898 1.00 34.14 H new ATOM 0 HD21 ASN A 47 -3.479 1.591 -13.888 1.00 25.54 H new ATOM 0 HD22 ASN A 47 -4.258 3.054 -13.278 1.00 25.54 H new ATOM 757 N ASN A 48 -7.775 5.786 -14.688 1.00 32.03 N ATOM 758 CA ASN A 48 -9.021 6.563 -14.521 1.00 62.40 C ATOM 759 C ASN A 48 -10.228 5.661 -14.304 1.00 2.55 C ATOM 760 O ASN A 48 -11.374 6.079 -14.426 1.00 34.51 O ATOM 761 CB ASN A 48 -9.237 7.593 -15.655 1.00 25.44 C ATOM 762 CG ASN A 48 -8.206 8.712 -15.602 1.00 63.12 C ATOM 763 OD1 ASN A 48 -7.721 9.069 -14.519 1.00 4.43 O ATOM 764 ND2 ASN A 48 -7.872 9.274 -16.738 1.00 3.10 N ATOM 0 H ASN A 48 -7.117 5.899 -13.917 1.00 32.03 H new ATOM 0 HA ASN A 48 -8.905 7.149 -13.609 1.00 62.40 H new ATOM 0 HB2 ASN A 48 -9.179 7.090 -16.620 1.00 25.44 H new ATOM 0 HB3 ASN A 48 -10.238 8.016 -15.576 1.00 25.44 H new ATOM 0 HD21 ASN A 48 -7.191 10.033 -16.751 1.00 3.10 H new ATOM 0 HD22 ASN A 48 -8.293 8.952 -17.609 1.00 3.10 H new ATOM 771 N ASN A 49 -9.946 4.431 -13.943 1.00 10.33 N ATOM 772 CA ASN A 49 -10.960 3.462 -13.555 1.00 33.11 C ATOM 773 C ASN A 49 -11.093 3.589 -12.063 1.00 42.24 C ATOM 774 O ASN A 49 -10.331 4.349 -11.448 1.00 60.24 O ATOM 775 CB ASN A 49 -10.511 2.022 -13.882 1.00 50.14 C ATOM 776 CG ASN A 49 -10.218 1.787 -15.348 1.00 74.45 C ATOM 777 OD1 ASN A 49 -9.094 1.967 -15.798 1.00 62.31 O ATOM 778 ND2 ASN A 49 -11.205 1.372 -16.094 1.00 31.11 N ATOM 0 H ASN A 49 -8.995 4.064 -13.908 1.00 10.33 H new ATOM 0 HA ASN A 49 -11.892 3.651 -14.088 1.00 33.11 H new ATOM 0 HB2 ASN A 49 -9.618 1.790 -13.302 1.00 50.14 H new ATOM 0 HB3 ASN A 49 -11.288 1.328 -13.562 1.00 50.14 H new ATOM 0 HD21 ASN A 49 -11.052 1.187 -17.085 1.00 31.11 H new ATOM 0 HD22 ASN A 49 -12.129 1.233 -15.686 1.00 31.11 H new ATOM 785 N GLU A 50 -11.995 2.863 -11.441 1.00 21.53 N ATOM 786 CA GLU A 50 -12.096 2.976 -10.004 1.00 31.50 C ATOM 787 C GLU A 50 -11.144 2.024 -9.278 1.00 21.14 C ATOM 788 O GLU A 50 -11.558 1.095 -8.565 1.00 65.34 O ATOM 789 CB GLU A 50 -13.545 2.953 -9.430 1.00 64.42 C ATOM 790 CG GLU A 50 -14.367 1.686 -9.679 1.00 2.45 C ATOM 791 CD GLU A 50 -14.667 1.438 -11.123 1.00 11.25 C ATOM 792 OE1 GLU A 50 -15.671 1.985 -11.634 1.00 35.02 O ATOM 793 OE2 GLU A 50 -13.908 0.689 -11.773 1.00 55.51 O ATOM 0 H GLU A 50 -12.644 2.214 -11.885 1.00 21.53 H new ATOM 0 HA GLU A 50 -11.760 3.990 -9.789 1.00 31.50 H new ATOM 0 HB2 GLU A 50 -13.486 3.114 -8.353 1.00 64.42 H new ATOM 0 HB3 GLU A 50 -14.090 3.799 -9.849 1.00 64.42 H new ATOM 0 HG2 GLU A 50 -13.827 0.829 -9.277 1.00 2.45 H new ATOM 0 HG3 GLU A 50 -15.305 1.759 -9.129 1.00 2.45 H new ATOM 800 N VAL A 51 -9.878 2.181 -9.578 1.00 31.03 N ATOM 801 CA VAL A 51 -8.836 1.504 -8.880 1.00 12.41 C ATOM 802 C VAL A 51 -7.689 2.492 -8.677 1.00 60.11 C ATOM 803 O VAL A 51 -7.298 3.222 -9.604 1.00 41.52 O ATOM 804 CB VAL A 51 -8.364 0.196 -9.612 1.00 12.33 C ATOM 805 CG1 VAL A 51 -7.776 0.480 -10.993 1.00 21.23 C ATOM 806 CG2 VAL A 51 -7.396 -0.610 -8.744 1.00 62.32 C ATOM 0 H VAL A 51 -9.548 2.792 -10.325 1.00 31.03 H new ATOM 0 HA VAL A 51 -9.212 1.164 -7.915 1.00 12.41 H new ATOM 0 HB VAL A 51 -9.253 -0.413 -9.772 1.00 12.33 H new ATOM 0 HG11 VAL A 51 -7.465 -0.457 -11.456 1.00 21.23 H new ATOM 0 HG12 VAL A 51 -8.529 0.961 -11.617 1.00 21.23 H new ATOM 0 HG13 VAL A 51 -6.913 1.139 -10.893 1.00 21.23 H new ATOM 0 HG21 VAL A 51 -7.089 -1.508 -9.280 1.00 62.32 H new ATOM 0 HG22 VAL A 51 -6.519 -0.004 -8.519 1.00 62.32 H new ATOM 0 HG23 VAL A 51 -7.890 -0.893 -7.815 1.00 62.32 H new ATOM 816 N SER A 52 -7.226 2.567 -7.491 1.00 61.04 N ATOM 817 CA SER A 52 -6.157 3.426 -7.109 1.00 43.31 C ATOM 818 C SER A 52 -5.354 2.779 -5.985 1.00 23.10 C ATOM 819 O SER A 52 -5.713 1.716 -5.478 1.00 23.00 O ATOM 820 CB SER A 52 -6.734 4.763 -6.637 1.00 74.33 C ATOM 821 OG SER A 52 -7.561 5.326 -7.639 1.00 31.41 O ATOM 0 H SER A 52 -7.592 2.010 -6.719 1.00 61.04 H new ATOM 0 HA SER A 52 -5.498 3.595 -7.960 1.00 43.31 H new ATOM 0 HB2 SER A 52 -7.309 4.616 -5.723 1.00 74.33 H new ATOM 0 HB3 SER A 52 -5.924 5.451 -6.396 1.00 74.33 H new ATOM 0 HG SER A 52 -8.501 5.147 -7.426 1.00 31.41 H new ATOM 827 N PHE A 53 -4.281 3.412 -5.619 1.00 71.45 N ATOM 828 CA PHE A 53 -3.511 3.037 -4.475 1.00 25.34 C ATOM 829 C PHE A 53 -2.786 4.274 -4.016 1.00 35.53 C ATOM 830 O PHE A 53 -2.717 5.239 -4.760 1.00 11.40 O ATOM 831 CB PHE A 53 -2.527 1.858 -4.746 1.00 53.23 C ATOM 832 CG PHE A 53 -1.453 2.122 -5.765 1.00 54.05 C ATOM 833 CD1 PHE A 53 -0.431 2.996 -5.481 1.00 24.24 C ATOM 834 CD2 PHE A 53 -1.469 1.494 -6.993 1.00 52.22 C ATOM 835 CE1 PHE A 53 0.547 3.253 -6.377 1.00 44.43 C ATOM 836 CE2 PHE A 53 -0.473 1.741 -7.915 1.00 15.04 C ATOM 837 CZ PHE A 53 0.539 2.627 -7.608 1.00 14.32 C ATOM 0 H PHE A 53 -3.910 4.220 -6.118 1.00 71.45 H new ATOM 0 HA PHE A 53 -4.176 2.657 -3.699 1.00 25.34 H new ATOM 0 HB2 PHE A 53 -2.049 1.585 -3.805 1.00 53.23 H new ATOM 0 HB3 PHE A 53 -3.106 0.994 -5.072 1.00 53.23 H new ATOM 0 HD1 PHE A 53 -0.409 3.488 -4.520 1.00 24.24 H new ATOM 0 HD2 PHE A 53 -2.265 0.805 -7.234 1.00 52.22 H new ATOM 0 HE1 PHE A 53 1.336 3.948 -6.130 1.00 44.43 H new ATOM 0 HE2 PHE A 53 -0.485 1.243 -8.873 1.00 15.04 H new ATOM 0 HZ PHE A 53 1.320 2.830 -8.326 1.00 14.32 H new ATOM 847 N HIS A 54 -2.230 4.255 -2.852 1.00 23.02 N ATOM 848 CA HIS A 54 -1.563 5.431 -2.353 1.00 62.10 C ATOM 849 C HIS A 54 -0.128 5.461 -2.731 1.00 11.10 C ATOM 850 O HIS A 54 0.316 6.371 -3.431 1.00 32.43 O ATOM 851 CB HIS A 54 -1.696 5.566 -0.842 1.00 34.22 C ATOM 852 CG HIS A 54 -3.080 5.794 -0.354 1.00 72.10 C ATOM 853 ND1 HIS A 54 -3.920 4.753 -0.085 1.00 31.15 N ATOM 854 CD2 HIS A 54 -3.707 6.959 -0.077 1.00 24.04 C ATOM 855 CE1 HIS A 54 -5.040 5.314 0.351 1.00 12.22 C ATOM 856 NE2 HIS A 54 -4.952 6.634 0.369 1.00 31.40 N ATOM 0 H HIS A 54 -2.218 3.450 -2.225 1.00 23.02 H new ATOM 0 HA HIS A 54 -2.062 6.279 -2.822 1.00 62.10 H new ATOM 0 HB2 HIS A 54 -1.306 4.661 -0.375 1.00 34.22 H new ATOM 0 HB3 HIS A 54 -1.068 6.392 -0.509 1.00 34.22 H new ATOM 0 HD2 HIS A 54 -3.300 7.953 -0.188 1.00 24.04 H new ATOM 0 HE1 HIS A 54 -5.917 4.761 0.654 1.00 12.22 H new ATOM 0 HE2 HIS A 54 -5.680 7.286 0.662 1.00 31.40 H new ATOM 864 N ILE A 55 0.594 4.472 -2.309 1.00 33.42 N ATOM 865 CA ILE A 55 2.015 4.495 -2.451 1.00 44.12 C ATOM 866 C ILE A 55 2.492 3.234 -3.098 1.00 75.41 C ATOM 867 O ILE A 55 2.091 2.128 -2.716 1.00 13.40 O ATOM 868 CB ILE A 55 2.714 4.621 -1.066 1.00 61.52 C ATOM 869 CG1 ILE A 55 2.145 5.803 -0.269 1.00 31.21 C ATOM 870 CG2 ILE A 55 4.201 4.866 -1.301 1.00 22.41 C ATOM 871 CD1 ILE A 55 2.474 5.786 1.202 1.00 61.03 C ATOM 0 H ILE A 55 0.221 3.635 -1.861 1.00 33.42 H new ATOM 0 HA ILE A 55 2.266 5.358 -3.068 1.00 44.12 H new ATOM 0 HB ILE A 55 2.547 3.705 -0.500 1.00 61.52 H new ATOM 0 HG12 ILE A 55 2.521 6.730 -0.701 1.00 31.21 H new ATOM 0 HG13 ILE A 55 1.061 5.814 -0.385 1.00 31.21 H new ATOM 0 HG21 ILE A 55 4.711 4.958 -0.342 1.00 22.41 H new ATOM 0 HG22 ILE A 55 4.624 4.030 -1.858 1.00 22.41 H new ATOM 0 HG23 ILE A 55 4.333 5.786 -1.871 1.00 22.41 H new ATOM 0 HD11 ILE A 55 2.031 6.658 1.684 1.00 61.03 H new ATOM 0 HD12 ILE A 55 2.073 4.879 1.654 1.00 61.03 H new ATOM 0 HD13 ILE A 55 3.556 5.809 1.333 1.00 61.03 H new ATOM 883 N ALA A 56 3.319 3.392 -4.063 1.00 32.21 N ATOM 884 CA ALA A 56 3.962 2.272 -4.696 1.00 51.25 C ATOM 885 C ALA A 56 5.416 2.315 -4.355 1.00 34.34 C ATOM 886 O ALA A 56 6.037 3.372 -4.429 1.00 31.33 O ATOM 887 CB ALA A 56 3.787 2.308 -6.201 1.00 24.13 C ATOM 0 H ALA A 56 3.579 4.300 -4.448 1.00 32.21 H new ATOM 0 HA ALA A 56 3.506 1.350 -4.336 1.00 51.25 H new ATOM 0 HB1 ALA A 56 4.286 1.447 -6.646 1.00 24.13 H new ATOM 0 HB2 ALA A 56 2.725 2.278 -6.445 1.00 24.13 H new ATOM 0 HB3 ALA A 56 4.224 3.225 -6.596 1.00 24.13 H new ATOM 893 N VAL A 57 5.962 1.220 -3.953 1.00 54.42 N ATOM 894 CA VAL A 57 7.368 1.185 -3.671 1.00 54.52 C ATOM 895 C VAL A 57 8.061 0.087 -4.467 1.00 71.53 C ATOM 896 O VAL A 57 7.570 -1.048 -4.553 1.00 1.01 O ATOM 897 CB VAL A 57 7.686 1.058 -2.153 1.00 4.23 C ATOM 898 CG1 VAL A 57 7.206 -0.239 -1.576 1.00 33.23 C ATOM 899 CG2 VAL A 57 9.153 1.242 -1.902 1.00 63.12 C ATOM 0 H VAL A 57 5.467 0.339 -3.811 1.00 54.42 H new ATOM 0 HA VAL A 57 7.765 2.149 -3.988 1.00 54.52 H new ATOM 0 HB VAL A 57 7.141 1.853 -1.644 1.00 4.23 H new ATOM 0 HG11 VAL A 57 7.452 -0.278 -0.515 1.00 33.23 H new ATOM 0 HG12 VAL A 57 6.126 -0.315 -1.701 1.00 33.23 H new ATOM 0 HG13 VAL A 57 7.690 -1.068 -2.092 1.00 33.23 H new ATOM 0 HG21 VAL A 57 9.354 1.149 -0.835 1.00 63.12 H new ATOM 0 HG22 VAL A 57 9.713 0.480 -2.444 1.00 63.12 H new ATOM 0 HG23 VAL A 57 9.460 2.230 -2.245 1.00 63.12 H new ATOM 909 N ASP A 58 9.167 0.431 -5.066 1.00 62.12 N ATOM 910 CA ASP A 58 9.939 -0.513 -5.816 1.00 22.54 C ATOM 911 C ASP A 58 11.246 -0.763 -5.103 1.00 61.53 C ATOM 912 O ASP A 58 11.455 -0.256 -3.992 1.00 52.51 O ATOM 913 CB ASP A 58 10.154 -0.095 -7.290 1.00 55.42 C ATOM 914 CG ASP A 58 11.111 1.055 -7.525 1.00 61.40 C ATOM 915 OD1 ASP A 58 12.297 0.824 -7.525 1.00 42.22 O ATOM 916 OD2 ASP A 58 10.678 2.181 -7.791 1.00 55.52 O ATOM 0 H ASP A 58 9.556 1.374 -5.047 1.00 62.12 H new ATOM 0 HA ASP A 58 9.373 -1.443 -5.869 1.00 22.54 H new ATOM 0 HB2 ASP A 58 10.517 -0.962 -7.843 1.00 55.42 H new ATOM 0 HB3 ASP A 58 9.186 0.172 -7.715 1.00 55.42 H new ATOM 921 N ASP A 59 12.117 -1.556 -5.713 1.00 52.14 N ATOM 922 CA ASP A 59 13.397 -1.962 -5.084 1.00 22.12 C ATOM 923 C ASP A 59 14.279 -0.733 -4.828 1.00 4.53 C ATOM 924 O ASP A 59 15.161 -0.739 -3.960 1.00 15.40 O ATOM 925 CB ASP A 59 14.168 -2.972 -5.982 1.00 11.34 C ATOM 926 CG ASP A 59 14.993 -2.352 -7.086 1.00 52.22 C ATOM 927 OD1 ASP A 59 14.443 -2.028 -8.150 1.00 4.23 O ATOM 928 OD2 ASP A 59 16.230 -2.231 -6.917 1.00 4.25 O ATOM 0 H ASP A 59 11.972 -1.940 -6.647 1.00 52.14 H new ATOM 0 HA ASP A 59 13.162 -2.446 -4.136 1.00 22.12 H new ATOM 0 HB2 ASP A 59 14.826 -3.567 -5.349 1.00 11.34 H new ATOM 0 HB3 ASP A 59 13.449 -3.658 -6.429 1.00 11.34 H new ATOM 933 N LYS A 60 14.006 0.298 -5.564 1.00 72.33 N ATOM 934 CA LYS A 60 14.735 1.529 -5.529 1.00 13.33 C ATOM 935 C LYS A 60 14.023 2.603 -4.705 1.00 4.40 C ATOM 936 O LYS A 60 14.478 2.957 -3.605 1.00 5.12 O ATOM 937 CB LYS A 60 14.949 1.996 -6.985 1.00 2.40 C ATOM 938 CG LYS A 60 15.439 3.411 -7.181 1.00 73.14 C ATOM 939 CD LYS A 60 16.825 3.623 -6.606 1.00 52.44 C ATOM 940 CE LYS A 60 17.283 5.055 -6.790 1.00 4.33 C ATOM 941 NZ LYS A 60 18.651 5.260 -6.279 1.00 24.23 N ATOM 0 H LYS A 60 13.237 0.306 -6.234 1.00 72.33 H new ATOM 0 HA LYS A 60 15.694 1.363 -5.038 1.00 13.33 H new ATOM 0 HB2 LYS A 60 15.663 1.321 -7.457 1.00 2.40 H new ATOM 0 HB3 LYS A 60 14.005 1.886 -7.519 1.00 2.40 H new ATOM 0 HG2 LYS A 60 15.450 3.646 -8.245 1.00 73.14 H new ATOM 0 HG3 LYS A 60 14.742 4.103 -6.709 1.00 73.14 H new ATOM 0 HD2 LYS A 60 16.823 3.373 -5.545 1.00 52.44 H new ATOM 0 HD3 LYS A 60 17.530 2.948 -7.092 1.00 52.44 H new ATOM 0 HE2 LYS A 60 17.247 5.316 -7.848 1.00 4.33 H new ATOM 0 HE3 LYS A 60 16.597 5.726 -6.273 1.00 4.33 H new ATOM 0 HZ1 LYS A 60 18.930 6.252 -6.422 1.00 24.23 H new ATOM 0 HZ2 LYS A 60 18.680 5.035 -5.264 1.00 24.23 H new ATOM 0 HZ3 LYS A 60 19.309 4.638 -6.790 1.00 24.23 H new ATOM 955 N LYS A 61 12.905 3.082 -5.199 1.00 4.33 N ATOM 956 CA LYS A 61 12.266 4.233 -4.632 1.00 20.11 C ATOM 957 C LYS A 61 10.784 4.022 -4.388 1.00 64.51 C ATOM 958 O LYS A 61 10.182 3.082 -4.900 1.00 1.01 O ATOM 959 CB LYS A 61 12.539 5.476 -5.505 1.00 34.03 C ATOM 960 CG LYS A 61 12.144 5.319 -6.970 1.00 13.43 C ATOM 961 CD LYS A 61 12.494 6.561 -7.786 1.00 72.42 C ATOM 962 CE LYS A 61 12.053 6.423 -9.242 1.00 35.42 C ATOM 963 NZ LYS A 61 12.445 7.596 -10.066 1.00 43.30 N ATOM 0 H LYS A 61 12.419 2.682 -6.002 1.00 4.33 H new ATOM 0 HA LYS A 61 12.702 4.401 -3.647 1.00 20.11 H new ATOM 0 HB2 LYS A 61 11.999 6.325 -5.085 1.00 34.03 H new ATOM 0 HB3 LYS A 61 13.601 5.716 -5.452 1.00 34.03 H new ATOM 0 HG2 LYS A 61 12.651 4.451 -7.392 1.00 13.43 H new ATOM 0 HG3 LYS A 61 11.073 5.128 -7.040 1.00 13.43 H new ATOM 0 HD2 LYS A 61 12.016 7.435 -7.342 1.00 72.42 H new ATOM 0 HD3 LYS A 61 13.570 6.731 -7.746 1.00 72.42 H new ATOM 0 HE2 LYS A 61 12.492 5.520 -9.668 1.00 35.42 H new ATOM 0 HE3 LYS A 61 10.971 6.300 -9.281 1.00 35.42 H new ATOM 0 HZ1 LYS A 61 11.943 7.564 -10.976 1.00 43.30 H new ATOM 0 HZ2 LYS A 61 12.196 8.472 -9.564 1.00 43.30 H new ATOM 0 HZ3 LYS A 61 13.471 7.574 -10.235 1.00 43.30 H new ATOM 977 N ALA A 62 10.222 4.885 -3.580 1.00 44.55 N ATOM 978 CA ALA A 62 8.821 4.830 -3.228 1.00 2.23 C ATOM 979 C ALA A 62 8.147 6.053 -3.764 1.00 5.04 C ATOM 980 O ALA A 62 8.605 7.157 -3.535 1.00 20.14 O ATOM 981 CB ALA A 62 8.652 4.785 -1.714 1.00 53.14 C ATOM 0 H ALA A 62 10.728 5.655 -3.142 1.00 44.55 H new ATOM 0 HA ALA A 62 8.377 3.930 -3.654 1.00 2.23 H new ATOM 0 HB1 ALA A 62 7.591 4.744 -1.467 1.00 53.14 H new ATOM 0 HB2 ALA A 62 9.151 3.900 -1.318 1.00 53.14 H new ATOM 0 HB3 ALA A 62 9.093 5.679 -1.272 1.00 53.14 H new ATOM 987 N ILE A 63 7.079 5.868 -4.469 1.00 45.23 N ATOM 988 CA ILE A 63 6.365 6.969 -5.060 1.00 50.33 C ATOM 989 C ILE A 63 4.944 6.958 -4.582 1.00 11.13 C ATOM 990 O ILE A 63 4.279 5.924 -4.608 1.00 41.14 O ATOM 991 CB ILE A 63 6.371 6.978 -6.646 1.00 65.44 C ATOM 992 CG1 ILE A 63 7.779 7.118 -7.247 1.00 52.22 C ATOM 993 CG2 ILE A 63 5.497 8.097 -7.189 1.00 52.33 C ATOM 994 CD1 ILE A 63 8.667 5.927 -7.108 1.00 53.05 C ATOM 0 H ILE A 63 6.671 4.952 -4.656 1.00 45.23 H new ATOM 0 HA ILE A 63 6.891 7.869 -4.742 1.00 50.33 H new ATOM 0 HB ILE A 63 5.973 6.008 -6.943 1.00 65.44 H new ATOM 0 HG12 ILE A 63 7.679 7.351 -8.307 1.00 52.22 H new ATOM 0 HG13 ILE A 63 8.270 7.970 -6.778 1.00 52.22 H new ATOM 0 HG21 ILE A 63 5.519 8.080 -8.279 1.00 52.33 H new ATOM 0 HG22 ILE A 63 4.472 7.958 -6.845 1.00 52.33 H new ATOM 0 HG23 ILE A 63 5.872 9.057 -6.833 1.00 52.33 H new ATOM 0 HD11 ILE A 63 9.633 6.138 -7.567 1.00 53.05 H new ATOM 0 HD12 ILE A 63 8.809 5.700 -6.051 1.00 53.05 H new ATOM 0 HD13 ILE A 63 8.209 5.072 -7.604 1.00 53.05 H new ATOM 1006 N GLN A 64 4.476 8.078 -4.142 1.00 13.41 N ATOM 1007 CA GLN A 64 3.125 8.166 -3.718 1.00 71.13 C ATOM 1008 C GLN A 64 2.317 8.918 -4.772 1.00 50.44 C ATOM 1009 O GLN A 64 2.804 9.898 -5.365 1.00 30.31 O ATOM 1010 CB GLN A 64 3.022 8.860 -2.383 1.00 13.50 C ATOM 1011 CG GLN A 64 1.645 8.771 -1.796 1.00 35.50 C ATOM 1012 CD GLN A 64 1.491 9.579 -0.535 1.00 72.22 C ATOM 1013 OE1 GLN A 64 2.443 9.780 0.217 1.00 21.00 O ATOM 1014 NE2 GLN A 64 0.305 10.023 -0.282 1.00 41.22 N ATOM 0 H GLN A 64 5.011 8.943 -4.068 1.00 13.41 H new ATOM 0 HA GLN A 64 2.724 7.159 -3.600 1.00 71.13 H new ATOM 0 HB2 GLN A 64 3.738 8.418 -1.691 1.00 13.50 H new ATOM 0 HB3 GLN A 64 3.297 9.908 -2.500 1.00 13.50 H new ATOM 0 HG2 GLN A 64 0.919 9.115 -2.533 1.00 35.50 H new ATOM 0 HG3 GLN A 64 1.413 7.727 -1.583 1.00 35.50 H new ATOM 0 HE21 GLN A 64 -0.459 9.835 -0.931 1.00 41.22 H new ATOM 0 HE22 GLN A 64 0.132 10.562 0.567 1.00 41.22 H new ATOM 1023 N GLY A 65 1.106 8.462 -5.001 1.00 30.20 N ATOM 1024 CA GLY A 65 0.263 9.071 -6.024 1.00 72.12 C ATOM 1025 C GLY A 65 -1.101 9.517 -5.515 1.00 73.42 C ATOM 1026 O GLY A 65 -1.706 10.422 -6.071 1.00 11.42 O ATOM 0 H GLY A 65 0.680 7.681 -4.503 1.00 30.20 H new ATOM 0 HA2 GLY A 65 0.783 9.932 -6.443 1.00 72.12 H new ATOM 0 HA3 GLY A 65 0.121 8.358 -6.836 1.00 72.12 H new ATOM 1030 N ILE A 66 -1.588 8.895 -4.484 1.00 73.43 N ATOM 1031 CA ILE A 66 -2.858 9.298 -3.895 1.00 1.24 C ATOM 1032 C ILE A 66 -2.604 9.743 -2.465 1.00 15.13 C ATOM 1033 O ILE A 66 -1.830 9.099 -1.753 1.00 1.23 O ATOM 1034 CB ILE A 66 -3.919 8.143 -3.956 1.00 23.30 C ATOM 1035 CG1 ILE A 66 -4.257 7.798 -5.417 1.00 4.50 C ATOM 1036 CG2 ILE A 66 -5.192 8.459 -3.167 1.00 32.23 C ATOM 1037 CD1 ILE A 66 -4.910 8.913 -6.191 1.00 50.14 C ATOM 0 H ILE A 66 -1.136 8.105 -4.023 1.00 73.43 H new ATOM 0 HA ILE A 66 -3.276 10.126 -4.468 1.00 1.24 H new ATOM 0 HB ILE A 66 -3.465 7.275 -3.478 1.00 23.30 H new ATOM 0 HG12 ILE A 66 -3.340 7.507 -5.929 1.00 4.50 H new ATOM 0 HG13 ILE A 66 -4.917 6.931 -5.428 1.00 4.50 H new ATOM 0 HG21 ILE A 66 -5.887 7.623 -3.247 1.00 32.23 H new ATOM 0 HG22 ILE A 66 -4.940 8.622 -2.119 1.00 32.23 H new ATOM 0 HG23 ILE A 66 -5.657 9.358 -3.572 1.00 32.23 H new ATOM 0 HD11 ILE A 66 -5.112 8.580 -7.209 1.00 50.14 H new ATOM 0 HD12 ILE A 66 -5.847 9.191 -5.708 1.00 50.14 H new ATOM 0 HD13 ILE A 66 -4.245 9.776 -6.217 1.00 50.14 H new ATOM 1049 N PRO A 67 -3.182 10.888 -2.045 1.00 54.54 N ATOM 1050 CA PRO A 67 -3.000 11.417 -0.692 1.00 54.12 C ATOM 1051 C PRO A 67 -3.537 10.466 0.381 1.00 41.51 C ATOM 1052 O PRO A 67 -4.673 10.007 0.307 1.00 63.34 O ATOM 1053 CB PRO A 67 -3.801 12.728 -0.700 1.00 51.04 C ATOM 1054 CG PRO A 67 -4.758 12.589 -1.828 1.00 23.15 C ATOM 1055 CD PRO A 67 -4.061 11.758 -2.856 1.00 73.34 C ATOM 0 HA PRO A 67 -1.946 11.554 -0.450 1.00 54.12 H new ATOM 0 HB2 PRO A 67 -4.324 12.876 0.245 1.00 51.04 H new ATOM 0 HB3 PRO A 67 -3.147 13.589 -0.841 1.00 51.04 H new ATOM 0 HG2 PRO A 67 -5.681 12.112 -1.500 1.00 23.15 H new ATOM 0 HG3 PRO A 67 -5.029 13.564 -2.232 1.00 23.15 H new ATOM 0 HD2 PRO A 67 -4.766 11.177 -3.450 1.00 73.34 H new ATOM 0 HD3 PRO A 67 -3.489 12.373 -3.551 1.00 73.34 H new ATOM 1063 N LEU A 68 -2.711 10.210 1.382 1.00 20.11 N ATOM 1064 CA LEU A 68 -3.026 9.289 2.482 1.00 31.30 C ATOM 1065 C LEU A 68 -4.193 9.763 3.319 1.00 33.13 C ATOM 1066 O LEU A 68 -4.780 9.000 4.043 1.00 52.24 O ATOM 1067 CB LEU A 68 -1.809 9.104 3.374 1.00 51.33 C ATOM 1068 CG LEU A 68 -0.601 8.423 2.754 1.00 35.02 C ATOM 1069 CD1 LEU A 68 0.555 8.419 3.733 1.00 44.02 C ATOM 1070 CD2 LEU A 68 -0.953 7.004 2.364 1.00 15.11 C ATOM 0 H LEU A 68 -1.788 10.638 1.462 1.00 20.11 H new ATOM 0 HA LEU A 68 -3.308 8.339 2.028 1.00 31.30 H new ATOM 0 HB2 LEU A 68 -1.499 10.085 3.733 1.00 51.33 H new ATOM 0 HB3 LEU A 68 -2.113 8.527 4.247 1.00 51.33 H new ATOM 0 HG LEU A 68 -0.304 8.974 1.862 1.00 35.02 H new ATOM 0 HD11 LEU A 68 1.415 7.928 3.278 1.00 44.02 H new ATOM 0 HD12 LEU A 68 0.817 9.445 3.991 1.00 44.02 H new ATOM 0 HD13 LEU A 68 0.266 7.881 4.635 1.00 44.02 H new ATOM 0 HD21 LEU A 68 -0.082 6.522 1.920 1.00 15.11 H new ATOM 0 HD22 LEU A 68 -1.263 6.449 3.250 1.00 15.11 H new ATOM 0 HD23 LEU A 68 -1.768 7.017 1.641 1.00 15.11 H new ATOM 1082 N GLU A 69 -4.526 11.024 3.204 1.00 1.14 N ATOM 1083 CA GLU A 69 -5.628 11.587 3.956 1.00 63.42 C ATOM 1084 C GLU A 69 -6.937 11.411 3.199 1.00 2.42 C ATOM 1085 O GLU A 69 -7.974 11.996 3.550 1.00 32.00 O ATOM 1086 CB GLU A 69 -5.356 13.035 4.248 1.00 71.12 C ATOM 1087 CG GLU A 69 -4.114 13.240 5.088 1.00 35.43 C ATOM 1088 CD GLU A 69 -3.839 14.683 5.347 1.00 50.11 C ATOM 1089 OE1 GLU A 69 -3.119 15.317 4.540 1.00 51.53 O ATOM 1090 OE2 GLU A 69 -4.343 15.216 6.345 1.00 55.05 O ATOM 0 H GLU A 69 -4.048 11.687 2.594 1.00 1.14 H new ATOM 0 HA GLU A 69 -5.723 11.057 4.904 1.00 63.42 H new ATOM 0 HB2 GLU A 69 -5.247 13.576 3.308 1.00 71.12 H new ATOM 0 HB3 GLU A 69 -6.214 13.464 4.765 1.00 71.12 H new ATOM 0 HG2 GLU A 69 -4.230 12.718 6.038 1.00 35.43 H new ATOM 0 HG3 GLU A 69 -3.258 12.794 4.582 1.00 35.43 H new ATOM 1097 N ARG A 70 -6.875 10.618 2.171 1.00 25.42 N ATOM 1098 CA ARG A 70 -8.000 10.255 1.391 1.00 71.11 C ATOM 1099 C ARG A 70 -8.071 8.821 1.147 1.00 62.01 C ATOM 1100 O ARG A 70 -7.129 8.066 1.411 1.00 54.30 O ATOM 1101 CB ARG A 70 -8.116 11.020 0.109 1.00 11.44 C ATOM 1102 CG ARG A 70 -8.810 12.307 0.296 1.00 51.10 C ATOM 1103 CD ARG A 70 -8.761 13.167 -0.928 1.00 64.55 C ATOM 1104 NE ARG A 70 -9.385 14.472 -0.706 1.00 0.31 N ATOM 1105 CZ ARG A 70 -10.212 15.090 -1.572 1.00 10.05 C ATOM 1106 NH1 ARG A 70 -10.692 14.426 -2.634 1.00 75.01 N ATOM 1107 NH2 ARG A 70 -10.595 16.349 -1.353 1.00 73.24 N ATOM 0 H ARG A 70 -6.004 10.196 1.849 1.00 25.42 H new ATOM 0 HA ARG A 70 -8.860 10.535 2.000 1.00 71.11 H new ATOM 0 HB2 ARG A 70 -7.121 11.200 -0.297 1.00 11.44 H new ATOM 0 HB3 ARG A 70 -8.656 10.420 -0.624 1.00 11.44 H new ATOM 0 HG2 ARG A 70 -9.850 12.120 0.563 1.00 51.10 H new ATOM 0 HG3 ARG A 70 -8.358 12.842 1.131 1.00 51.10 H new ATOM 0 HD2 ARG A 70 -7.723 13.308 -1.231 1.00 64.55 H new ATOM 0 HD3 ARG A 70 -9.266 12.658 -1.749 1.00 64.55 H new ATOM 0 HE ARG A 70 -9.178 14.950 0.171 1.00 0.31 H new ATOM 0 HH11 ARG A 70 -10.431 13.452 -2.787 1.00 75.01 H new ATOM 0 HH12 ARG A 70 -11.318 14.895 -3.289 1.00 75.01 H new ATOM 0 HH21 ARG A 70 -10.262 16.847 -0.528 1.00 73.24 H new ATOM 0 HH22 ARG A 70 -11.221 16.813 -2.011 1.00 73.24 H new ATOM 1121 N ASN A 71 -9.183 8.454 0.652 1.00 32.32 N ATOM 1122 CA ASN A 71 -9.491 7.068 0.373 1.00 60.42 C ATOM 1123 C ASN A 71 -8.774 6.630 -0.913 1.00 33.32 C ATOM 1124 O ASN A 71 -8.173 7.444 -1.597 1.00 13.03 O ATOM 1125 CB ASN A 71 -11.022 6.885 0.207 1.00 41.10 C ATOM 1126 CG ASN A 71 -11.571 7.346 -1.141 1.00 23.22 C ATOM 1127 OD1 ASN A 71 -11.925 8.500 -1.331 1.00 63.43 O ATOM 1128 ND2 ASN A 71 -11.688 6.422 -2.064 1.00 32.55 N ATOM 0 H ASN A 71 -9.935 9.101 0.416 1.00 32.32 H new ATOM 0 HA ASN A 71 -9.150 6.453 1.206 1.00 60.42 H new ATOM 0 HB2 ASN A 71 -11.266 5.832 0.344 1.00 41.10 H new ATOM 0 HB3 ASN A 71 -11.529 7.435 0.999 1.00 41.10 H new ATOM 0 HD21 ASN A 71 -12.085 6.657 -2.974 1.00 32.55 H new ATOM 0 HD22 ASN A 71 -11.382 5.468 -1.872 1.00 32.55 H new ATOM 1135 N ALA A 72 -8.833 5.364 -1.223 1.00 71.22 N ATOM 1136 CA ALA A 72 -8.290 4.859 -2.462 1.00 3.14 C ATOM 1137 C ALA A 72 -9.059 3.646 -2.844 1.00 73.42 C ATOM 1138 O ALA A 72 -9.306 2.785 -2.000 1.00 55.23 O ATOM 1139 CB ALA A 72 -6.817 4.513 -2.335 1.00 33.44 C ATOM 0 H ALA A 72 -9.257 4.652 -0.628 1.00 71.22 H new ATOM 0 HA ALA A 72 -8.375 5.633 -3.225 1.00 3.14 H new ATOM 0 HB1 ALA A 72 -6.448 4.137 -3.289 1.00 33.44 H new ATOM 0 HB2 ALA A 72 -6.257 5.405 -2.055 1.00 33.44 H new ATOM 0 HB3 ALA A 72 -6.688 3.748 -1.569 1.00 33.44 H new ATOM 1145 N TRP A 73 -9.473 3.565 -4.078 1.00 0.24 N ATOM 1146 CA TRP A 73 -10.208 2.407 -4.502 1.00 35.04 C ATOM 1147 C TRP A 73 -9.222 1.297 -4.738 1.00 14.34 C ATOM 1148 O TRP A 73 -8.545 1.293 -5.710 1.00 64.43 O ATOM 1149 CB TRP A 73 -10.946 2.718 -5.801 1.00 50.14 C ATOM 1150 CG TRP A 73 -11.828 3.926 -5.732 1.00 3.34 C ATOM 1151 CD1 TRP A 73 -11.830 4.986 -6.592 1.00 22.21 C ATOM 1152 CD2 TRP A 73 -12.801 4.229 -4.719 1.00 32.04 C ATOM 1153 NE1 TRP A 73 -12.771 5.906 -6.190 1.00 22.30 N ATOM 1154 CE2 TRP A 73 -13.369 5.467 -5.040 1.00 53.34 C ATOM 1155 CE3 TRP A 73 -13.247 3.566 -3.581 1.00 64.54 C ATOM 1156 CZ2 TRP A 73 -14.363 6.054 -4.259 1.00 74.33 C ATOM 1157 CZ3 TRP A 73 -14.224 4.146 -2.801 1.00 2.14 C ATOM 1158 CH2 TRP A 73 -14.773 5.380 -3.143 1.00 22.20 C ATOM 0 H TRP A 73 -9.318 4.273 -4.796 1.00 0.24 H new ATOM 0 HA TRP A 73 -10.936 2.118 -3.744 1.00 35.04 H new ATOM 0 HB2 TRP A 73 -10.214 2.861 -6.596 1.00 50.14 H new ATOM 0 HB3 TRP A 73 -11.552 1.855 -6.077 1.00 50.14 H new ATOM 0 HD1 TRP A 73 -11.190 5.087 -7.456 1.00 22.21 H new ATOM 0 HE1 TRP A 73 -12.989 6.778 -6.673 1.00 22.30 H new ATOM 0 HE3 TRP A 73 -12.832 2.606 -3.311 1.00 64.54 H new ATOM 0 HZ2 TRP A 73 -14.794 7.008 -4.526 1.00 74.33 H new ATOM 0 HZ3 TRP A 73 -14.569 3.637 -1.913 1.00 2.14 H new ATOM 0 HH2 TRP A 73 -15.537 5.812 -2.514 1.00 22.20 H new ATOM 1169 N ALA A 74 -9.156 0.364 -3.865 1.00 1.43 N ATOM 1170 CA ALA A 74 -8.148 -0.641 -4.002 1.00 41.43 C ATOM 1171 C ALA A 74 -8.694 -2.011 -3.928 1.00 13.42 C ATOM 1172 O ALA A 74 -8.417 -2.833 -4.771 1.00 32.42 O ATOM 1173 CB ALA A 74 -7.081 -0.457 -2.964 1.00 15.23 C ATOM 0 H ALA A 74 -9.772 0.266 -3.058 1.00 1.43 H new ATOM 0 HA ALA A 74 -7.717 -0.520 -4.996 1.00 41.43 H new ATOM 0 HB1 ALA A 74 -6.321 -1.230 -3.082 1.00 15.23 H new ATOM 0 HB2 ALA A 74 -6.622 0.524 -3.084 1.00 15.23 H new ATOM 0 HB3 ALA A 74 -7.523 -0.532 -1.971 1.00 15.23 H new ATOM 1179 N CYS A 75 -9.457 -2.267 -2.915 1.00 15.00 N ATOM 1180 CA CYS A 75 -9.928 -3.579 -2.683 1.00 54.34 C ATOM 1181 C CYS A 75 -11.221 -3.852 -3.437 1.00 33.54 C ATOM 1182 O CYS A 75 -11.460 -4.979 -3.901 1.00 41.31 O ATOM 1183 CB CYS A 75 -10.113 -3.833 -1.203 1.00 43.22 C ATOM 1184 SG CYS A 75 -10.585 -5.520 -0.853 1.00 71.32 S ATOM 0 H CYS A 75 -9.765 -1.573 -2.234 1.00 15.00 H new ATOM 0 HA CYS A 75 -9.171 -4.267 -3.060 1.00 54.34 H new ATOM 0 HB2 CYS A 75 -9.185 -3.602 -0.679 1.00 43.22 H new ATOM 0 HB3 CYS A 75 -10.875 -3.158 -0.814 1.00 43.22 H new ATOM 0 HG CYS A 75 -9.591 -6.141 -0.291 1.00 71.32 H new ATOM 1190 N GLY A 76 -12.033 -2.838 -3.571 1.00 61.40 N ATOM 1191 CA GLY A 76 -13.309 -2.995 -4.229 1.00 14.05 C ATOM 1192 C GLY A 76 -14.421 -3.135 -3.227 1.00 51.24 C ATOM 1193 O GLY A 76 -15.509 -3.611 -3.544 1.00 23.03 O ATOM 0 H GLY A 76 -11.837 -1.895 -3.235 1.00 61.40 H new ATOM 0 HA2 GLY A 76 -13.499 -2.134 -4.870 1.00 14.05 H new ATOM 0 HA3 GLY A 76 -13.284 -3.873 -4.874 1.00 14.05 H new ATOM 1197 N ASP A 77 -14.141 -2.720 -2.005 1.00 31.35 N ATOM 1198 CA ASP A 77 -15.105 -2.785 -0.911 1.00 60.32 C ATOM 1199 C ASP A 77 -15.906 -1.489 -0.809 1.00 30.51 C ATOM 1200 O ASP A 77 -16.814 -1.382 0.005 1.00 21.51 O ATOM 1201 CB ASP A 77 -14.384 -3.056 0.415 1.00 62.13 C ATOM 1202 CG ASP A 77 -13.382 -1.978 0.758 1.00 2.34 C ATOM 1203 OD1 ASP A 77 -12.263 -2.027 0.251 1.00 1.14 O ATOM 1204 OD2 ASP A 77 -13.711 -1.066 1.519 1.00 15.41 O ATOM 0 H ASP A 77 -13.238 -2.327 -1.738 1.00 31.35 H new ATOM 0 HA ASP A 77 -15.796 -3.602 -1.118 1.00 60.32 H new ATOM 0 HB2 ASP A 77 -15.119 -3.133 1.216 1.00 62.13 H new ATOM 0 HB3 ASP A 77 -13.874 -4.017 0.358 1.00 62.13 H new ATOM 1209 N GLY A 78 -15.556 -0.522 -1.649 1.00 51.32 N ATOM 1210 CA GLY A 78 -16.240 0.769 -1.717 1.00 22.21 C ATOM 1211 C GLY A 78 -16.262 1.537 -0.404 1.00 23.11 C ATOM 1212 O GLY A 78 -15.321 2.238 -0.063 1.00 55.52 O ATOM 0 H GLY A 78 -14.783 -0.610 -2.309 1.00 51.32 H new ATOM 0 HA2 GLY A 78 -15.756 1.384 -2.476 1.00 22.21 H new ATOM 0 HA3 GLY A 78 -17.266 0.606 -2.046 1.00 22.21 H new ATOM 1216 N ASN A 79 -17.333 1.378 0.320 1.00 32.53 N ATOM 1217 CA ASN A 79 -17.545 2.086 1.585 1.00 72.42 C ATOM 1218 C ASN A 79 -17.212 1.191 2.768 1.00 61.02 C ATOM 1219 O ASN A 79 -17.369 1.595 3.923 1.00 61.51 O ATOM 1220 CB ASN A 79 -19.014 2.559 1.711 1.00 3.52 C ATOM 1221 CG ASN A 79 -20.026 1.408 1.655 1.00 32.23 C ATOM 1222 OD1 ASN A 79 -20.354 0.791 2.673 1.00 73.03 O ATOM 1223 ND2 ASN A 79 -20.545 1.137 0.479 1.00 51.01 N ATOM 0 H ASN A 79 -18.098 0.754 0.062 1.00 32.53 H new ATOM 0 HA ASN A 79 -16.884 2.952 1.589 1.00 72.42 H new ATOM 0 HB2 ASN A 79 -19.136 3.097 2.651 1.00 3.52 H new ATOM 0 HB3 ASN A 79 -19.232 3.265 0.910 1.00 3.52 H new ATOM 0 HD21 ASN A 79 -21.241 0.397 0.387 1.00 51.01 H new ATOM 0 HD22 ASN A 79 -20.252 1.666 -0.342 1.00 51.01 H new ATOM 1230 N GLY A 80 -16.738 -0.003 2.471 1.00 52.03 N ATOM 1231 CA GLY A 80 -16.483 -1.002 3.484 1.00 52.41 C ATOM 1232 C GLY A 80 -15.395 -0.636 4.477 1.00 24.13 C ATOM 1233 O GLY A 80 -15.683 -0.274 5.631 1.00 24.42 O ATOM 0 H GLY A 80 -16.520 -0.305 1.522 1.00 52.03 H new ATOM 0 HA2 GLY A 80 -17.407 -1.189 4.031 1.00 52.41 H new ATOM 0 HA3 GLY A 80 -16.209 -1.936 2.993 1.00 52.41 H new ATOM 1237 N SER A 81 -14.155 -0.728 4.061 1.00 50.03 N ATOM 1238 CA SER A 81 -13.043 -0.498 4.953 1.00 32.52 C ATOM 1239 C SER A 81 -11.790 0.010 4.233 1.00 65.12 C ATOM 1240 O SER A 81 -11.314 1.102 4.538 1.00 63.22 O ATOM 1241 CB SER A 81 -12.728 -1.765 5.756 1.00 33.22 C ATOM 1242 OG SER A 81 -13.846 -2.136 6.568 1.00 34.01 O ATOM 0 H SER A 81 -13.889 -0.962 3.104 1.00 50.03 H new ATOM 0 HA SER A 81 -13.350 0.294 5.636 1.00 32.52 H new ATOM 0 HB2 SER A 81 -12.478 -2.580 5.077 1.00 33.22 H new ATOM 0 HB3 SER A 81 -11.854 -1.596 6.385 1.00 33.22 H new ATOM 0 HG SER A 81 -13.629 -2.947 7.073 1.00 34.01 H new ATOM 1248 N GLY A 82 -11.258 -0.755 3.283 1.00 61.22 N ATOM 1249 CA GLY A 82 -10.023 -0.327 2.662 1.00 11.41 C ATOM 1250 C GLY A 82 -10.221 0.758 1.644 1.00 3.14 C ATOM 1251 O GLY A 82 -9.499 1.764 1.665 1.00 61.22 O ATOM 0 H GLY A 82 -11.646 -1.635 2.943 1.00 61.22 H new ATOM 0 HA2 GLY A 82 -9.339 0.027 3.433 1.00 11.41 H new ATOM 0 HA3 GLY A 82 -9.548 -1.184 2.184 1.00 11.41 H new ATOM 1255 N ASN A 83 -11.189 0.586 0.770 1.00 54.10 N ATOM 1256 CA ASN A 83 -11.523 1.616 -0.211 1.00 1.20 C ATOM 1257 C ASN A 83 -11.907 2.918 0.438 1.00 21.55 C ATOM 1258 O ASN A 83 -11.726 3.982 -0.144 1.00 31.14 O ATOM 1259 CB ASN A 83 -12.646 1.178 -1.129 1.00 5.11 C ATOM 1260 CG ASN A 83 -12.226 0.295 -2.265 1.00 75.23 C ATOM 1261 OD1 ASN A 83 -11.277 -0.451 -2.179 1.00 35.51 O ATOM 1262 ND2 ASN A 83 -12.952 0.377 -3.351 1.00 12.43 N ATOM 0 H ASN A 83 -11.763 -0.255 0.712 1.00 54.10 H new ATOM 0 HA ASN A 83 -10.617 1.768 -0.797 1.00 1.20 H new ATOM 0 HB2 ASN A 83 -13.395 0.652 -0.537 1.00 5.11 H new ATOM 0 HB3 ASN A 83 -13.129 2.066 -1.538 1.00 5.11 H new ATOM 0 HD21 ASN A 83 -12.725 -0.200 -4.161 1.00 12.43 H new ATOM 0 HD22 ASN A 83 -13.745 1.017 -3.387 1.00 12.43 H new ATOM 1269 N ARG A 84 -12.435 2.831 1.637 1.00 74.43 N ATOM 1270 CA ARG A 84 -12.879 4.004 2.347 1.00 55.12 C ATOM 1271 C ARG A 84 -11.777 4.601 3.248 1.00 32.31 C ATOM 1272 O ARG A 84 -11.607 5.817 3.284 1.00 41.13 O ATOM 1273 CB ARG A 84 -14.132 3.703 3.177 1.00 52.32 C ATOM 1274 CG ARG A 84 -14.729 4.929 3.865 1.00 71.33 C ATOM 1275 CD ARG A 84 -15.244 5.950 2.848 1.00 32.41 C ATOM 1276 NE ARG A 84 -15.750 7.174 3.495 1.00 11.23 N ATOM 1277 CZ ARG A 84 -16.913 7.780 3.201 1.00 20.51 C ATOM 1278 NH1 ARG A 84 -17.716 7.271 2.280 1.00 2.25 N ATOM 1279 NH2 ARG A 84 -17.260 8.901 3.837 1.00 42.53 N ATOM 0 H ARG A 84 -12.567 1.955 2.142 1.00 74.43 H new ATOM 0 HA ARG A 84 -13.124 4.750 1.591 1.00 55.12 H new ATOM 0 HB2 ARG A 84 -14.887 3.259 2.528 1.00 52.32 H new ATOM 0 HB3 ARG A 84 -13.884 2.959 3.934 1.00 52.32 H new ATOM 0 HG2 ARG A 84 -15.546 4.620 4.517 1.00 71.33 H new ATOM 0 HG3 ARG A 84 -13.975 5.395 4.499 1.00 71.33 H new ATOM 0 HD2 ARG A 84 -14.441 6.211 2.159 1.00 32.41 H new ATOM 0 HD3 ARG A 84 -16.039 5.499 2.254 1.00 32.41 H new ATOM 0 HE ARG A 84 -15.172 7.594 4.223 1.00 11.23 H new ATOM 0 HH11 ARG A 84 -17.453 6.416 1.790 1.00 2.25 H new ATOM 0 HH12 ARG A 84 -18.598 7.734 2.060 1.00 2.25 H new ATOM 0 HH21 ARG A 84 -16.643 9.297 4.546 1.00 42.53 H new ATOM 0 HH22 ARG A 84 -18.143 9.361 3.614 1.00 42.53 H new ATOM 1293 N GLN A 85 -11.040 3.760 3.984 1.00 45.14 N ATOM 1294 CA GLN A 85 -10.031 4.288 4.902 1.00 65.04 C ATOM 1295 C GLN A 85 -8.807 3.374 5.093 1.00 11.53 C ATOM 1296 O GLN A 85 -8.463 2.985 6.231 1.00 34.40 O ATOM 1297 CB GLN A 85 -10.639 4.638 6.270 1.00 51.30 C ATOM 1298 CG GLN A 85 -11.279 3.463 7.004 1.00 33.41 C ATOM 1299 CD GLN A 85 -11.727 3.806 8.413 1.00 20.31 C ATOM 1300 OE1 GLN A 85 -12.685 3.228 8.923 1.00 63.52 O ATOM 1301 NE2 GLN A 85 -11.051 4.739 9.052 1.00 3.53 N ATOM 0 H GLN A 85 -11.120 2.743 3.963 1.00 45.14 H new ATOM 0 HA GLN A 85 -9.669 5.196 4.420 1.00 65.04 H new ATOM 0 HB2 GLN A 85 -9.858 5.061 6.902 1.00 51.30 H new ATOM 0 HB3 GLN A 85 -11.391 5.414 6.130 1.00 51.30 H new ATOM 0 HG2 GLN A 85 -12.138 3.111 6.433 1.00 33.41 H new ATOM 0 HG3 GLN A 85 -10.566 2.639 7.047 1.00 33.41 H new ATOM 0 HE21 GLN A 85 -10.261 5.198 8.598 1.00 3.53 H new ATOM 0 HE22 GLN A 85 -11.317 5.002 10.001 1.00 3.53 H new ATOM 1310 N SER A 86 -8.151 3.032 4.041 1.00 21.55 N ATOM 1311 CA SER A 86 -6.929 2.306 4.189 1.00 14.32 C ATOM 1312 C SER A 86 -5.894 2.939 3.344 1.00 53.43 C ATOM 1313 O SER A 86 -6.179 3.859 2.607 1.00 61.23 O ATOM 1314 CB SER A 86 -7.043 0.816 3.822 1.00 63.04 C ATOM 1315 OG SER A 86 -7.222 0.620 2.429 1.00 0.13 O ATOM 0 H SER A 86 -8.429 3.236 3.081 1.00 21.55 H new ATOM 0 HA SER A 86 -6.664 2.343 5.246 1.00 14.32 H new ATOM 0 HB2 SER A 86 -6.144 0.293 4.148 1.00 63.04 H new ATOM 0 HB3 SER A 86 -7.882 0.374 4.360 1.00 63.04 H new ATOM 0 HG SER A 86 -7.834 1.301 2.079 1.00 0.13 H new ATOM 1321 N ILE A 87 -4.724 2.441 3.452 1.00 3.52 N ATOM 1322 CA ILE A 87 -3.620 2.882 2.664 1.00 21.33 C ATOM 1323 C ILE A 87 -3.236 1.768 1.765 1.00 33.35 C ATOM 1324 O ILE A 87 -2.947 0.681 2.221 1.00 51.24 O ATOM 1325 CB ILE A 87 -2.409 3.268 3.526 1.00 14.51 C ATOM 1326 CG1 ILE A 87 -2.779 4.429 4.434 1.00 70.05 C ATOM 1327 CG2 ILE A 87 -1.243 3.635 2.618 1.00 24.03 C ATOM 1328 CD1 ILE A 87 -1.735 4.798 5.456 1.00 51.31 C ATOM 0 H ILE A 87 -4.491 1.694 4.106 1.00 3.52 H new ATOM 0 HA ILE A 87 -3.920 3.770 2.108 1.00 21.33 H new ATOM 0 HB ILE A 87 -2.112 2.426 4.151 1.00 14.51 H new ATOM 0 HG12 ILE A 87 -2.985 5.303 3.816 1.00 70.05 H new ATOM 0 HG13 ILE A 87 -3.704 4.182 4.955 1.00 70.05 H new ATOM 0 HG21 ILE A 87 -0.381 3.910 3.226 1.00 24.03 H new ATOM 0 HG22 ILE A 87 -0.987 2.781 1.991 1.00 24.03 H new ATOM 0 HG23 ILE A 87 -1.525 4.477 1.986 1.00 24.03 H new ATOM 0 HD11 ILE A 87 -2.092 5.636 6.055 1.00 51.31 H new ATOM 0 HD12 ILE A 87 -1.544 3.944 6.105 1.00 51.31 H new ATOM 0 HD13 ILE A 87 -0.813 5.082 4.948 1.00 51.31 H new ATOM 1340 N SER A 88 -3.248 2.005 0.521 1.00 13.24 N ATOM 1341 CA SER A 88 -2.919 0.987 -0.392 1.00 4.24 C ATOM 1342 C SER A 88 -1.472 1.090 -0.796 1.00 64.04 C ATOM 1343 O SER A 88 -1.037 2.106 -1.356 1.00 74.20 O ATOM 1344 CB SER A 88 -3.829 1.074 -1.568 1.00 3.32 C ATOM 1345 OG SER A 88 -5.162 0.956 -1.137 1.00 75.51 O ATOM 0 H SER A 88 -3.484 2.904 0.102 1.00 13.24 H new ATOM 0 HA SER A 88 -3.052 0.012 0.076 1.00 4.24 H new ATOM 0 HB2 SER A 88 -3.685 2.023 -2.084 1.00 3.32 H new ATOM 0 HB3 SER A 88 -3.595 0.284 -2.282 1.00 3.32 H new ATOM 0 HG SER A 88 -5.658 1.765 -1.381 1.00 75.51 H new ATOM 1351 N VAL A 89 -0.739 0.053 -0.499 1.00 64.54 N ATOM 1352 CA VAL A 89 0.665 -0.014 -0.809 1.00 2.44 C ATOM 1353 C VAL A 89 0.888 -1.068 -1.872 1.00 42.21 C ATOM 1354 O VAL A 89 0.434 -2.210 -1.735 1.00 51.50 O ATOM 1355 CB VAL A 89 1.518 -0.325 0.453 1.00 63.11 C ATOM 1356 CG1 VAL A 89 3.007 -0.383 0.115 1.00 74.52 C ATOM 1357 CG2 VAL A 89 1.263 0.720 1.532 1.00 44.31 C ATOM 0 H VAL A 89 -1.101 -0.778 -0.031 1.00 64.54 H new ATOM 0 HA VAL A 89 0.985 0.959 -1.181 1.00 2.44 H new ATOM 0 HB VAL A 89 1.220 -1.304 0.828 1.00 63.11 H new ATOM 0 HG11 VAL A 89 3.577 -0.602 1.018 1.00 74.52 H new ATOM 0 HG12 VAL A 89 3.182 -1.165 -0.624 1.00 74.52 H new ATOM 0 HG13 VAL A 89 3.326 0.577 -0.291 1.00 74.52 H new ATOM 0 HG21 VAL A 89 1.866 0.491 2.410 1.00 44.31 H new ATOM 0 HG22 VAL A 89 1.532 1.706 1.154 1.00 44.31 H new ATOM 0 HG23 VAL A 89 0.208 0.712 1.804 1.00 44.31 H new ATOM 1367 N GLU A 90 1.543 -0.679 -2.914 1.00 60.42 N ATOM 1368 CA GLU A 90 1.805 -1.541 -4.036 1.00 73.02 C ATOM 1369 C GLU A 90 3.306 -1.862 -4.062 1.00 51.53 C ATOM 1370 O GLU A 90 4.137 -0.945 -4.152 1.00 41.15 O ATOM 1371 CB GLU A 90 1.403 -0.788 -5.315 1.00 11.30 C ATOM 1372 CG GLU A 90 1.406 -1.612 -6.587 1.00 22.15 C ATOM 1373 CD GLU A 90 0.352 -2.695 -6.578 1.00 12.32 C ATOM 1374 OE1 GLU A 90 -0.827 -2.391 -6.851 1.00 3.04 O ATOM 1375 OE2 GLU A 90 0.680 -3.854 -6.316 1.00 63.42 O ATOM 0 H GLU A 90 1.921 0.262 -3.020 1.00 60.42 H new ATOM 0 HA GLU A 90 1.240 -2.471 -3.963 1.00 73.02 H new ATOM 0 HB2 GLU A 90 0.404 -0.375 -5.173 1.00 11.30 H new ATOM 0 HB3 GLU A 90 2.081 0.055 -5.448 1.00 11.30 H new ATOM 0 HG2 GLU A 90 1.241 -0.956 -7.441 1.00 22.15 H new ATOM 0 HG3 GLU A 90 2.388 -2.066 -6.719 1.00 22.15 H new ATOM 1382 N ILE A 91 3.659 -3.132 -3.961 1.00 72.01 N ATOM 1383 CA ILE A 91 5.062 -3.523 -3.992 1.00 75.31 C ATOM 1384 C ILE A 91 5.438 -3.828 -5.419 1.00 25.41 C ATOM 1385 O ILE A 91 4.880 -4.729 -6.022 1.00 4.22 O ATOM 1386 CB ILE A 91 5.371 -4.785 -3.112 1.00 14.14 C ATOM 1387 CG1 ILE A 91 4.943 -4.558 -1.653 1.00 14.32 C ATOM 1388 CG2 ILE A 91 6.859 -5.135 -3.185 1.00 21.14 C ATOM 1389 CD1 ILE A 91 5.260 -5.718 -0.723 1.00 60.55 C ATOM 0 H ILE A 91 3.002 -3.905 -3.858 1.00 72.01 H new ATOM 0 HA ILE A 91 5.641 -2.695 -3.583 1.00 75.31 H new ATOM 0 HB ILE A 91 4.795 -5.622 -3.506 1.00 14.14 H new ATOM 0 HG12 ILE A 91 5.435 -3.661 -1.277 1.00 14.32 H new ATOM 0 HG13 ILE A 91 3.870 -4.368 -1.626 1.00 14.32 H new ATOM 0 HG21 ILE A 91 7.057 -6.012 -2.569 1.00 21.14 H new ATOM 0 HG22 ILE A 91 7.132 -5.348 -4.218 1.00 21.14 H new ATOM 0 HG23 ILE A 91 7.449 -4.295 -2.819 1.00 21.14 H new ATOM 0 HD11 ILE A 91 4.926 -5.477 0.286 1.00 60.55 H new ATOM 0 HD12 ILE A 91 4.746 -6.614 -1.071 1.00 60.55 H new ATOM 0 HD13 ILE A 91 6.335 -5.896 -0.717 1.00 60.55 H new ATOM 1401 N CYS A 92 6.355 -3.084 -5.961 1.00 2.10 N ATOM 1402 CA CYS A 92 6.774 -3.277 -7.326 1.00 65.32 C ATOM 1403 C CYS A 92 7.840 -4.365 -7.413 1.00 65.34 C ATOM 1404 O CYS A 92 8.463 -4.702 -6.412 1.00 70.20 O ATOM 1405 CB CYS A 92 7.269 -1.969 -7.903 1.00 43.43 C ATOM 1406 SG CYS A 92 6.042 -0.650 -7.809 1.00 61.42 S ATOM 0 H CYS A 92 6.836 -2.327 -5.475 1.00 2.10 H new ATOM 0 HA CYS A 92 5.920 -3.608 -7.917 1.00 65.32 H new ATOM 0 HB2 CYS A 92 8.168 -1.660 -7.370 1.00 43.43 H new ATOM 0 HB3 CYS A 92 7.552 -2.121 -8.945 1.00 43.43 H new ATOM 0 HG CYS A 92 6.307 0.118 -6.794 1.00 61.42 H new ATOM 1412 N TYR A 93 7.993 -4.951 -8.610 1.00 71.04 N ATOM 1413 CA TYR A 93 8.985 -6.008 -8.873 1.00 51.13 C ATOM 1414 C TYR A 93 8.667 -7.302 -8.134 1.00 73.41 C ATOM 1415 O TYR A 93 9.532 -8.168 -8.005 1.00 33.45 O ATOM 1416 CB TYR A 93 10.416 -5.568 -8.527 1.00 20.11 C ATOM 1417 CG TYR A 93 10.995 -4.467 -9.383 1.00 12.25 C ATOM 1418 CD1 TYR A 93 11.554 -4.747 -10.622 1.00 33.43 C ATOM 1419 CD2 TYR A 93 11.014 -3.165 -8.943 1.00 61.30 C ATOM 1420 CE1 TYR A 93 12.112 -3.749 -11.396 1.00 72.52 C ATOM 1421 CE2 TYR A 93 11.566 -2.163 -9.712 1.00 14.40 C ATOM 1422 CZ TYR A 93 12.112 -2.458 -10.928 1.00 70.01 C ATOM 1423 OH TYR A 93 12.671 -1.449 -11.675 1.00 21.33 O ATOM 0 H TYR A 93 7.432 -4.706 -9.426 1.00 71.04 H new ATOM 0 HA TYR A 93 8.926 -6.194 -9.945 1.00 51.13 H new ATOM 0 HB2 TYR A 93 10.433 -5.240 -7.488 1.00 20.11 H new ATOM 0 HB3 TYR A 93 11.069 -6.438 -8.597 1.00 20.11 H new ATOM 0 HD1 TYR A 93 11.553 -5.763 -10.987 1.00 33.43 H new ATOM 0 HD2 TYR A 93 10.590 -2.923 -7.980 1.00 61.30 H new ATOM 0 HE1 TYR A 93 12.544 -3.981 -12.358 1.00 72.52 H new ATOM 0 HE2 TYR A 93 11.567 -1.145 -9.353 1.00 14.40 H new ATOM 0 HH TYR A 93 12.583 -0.599 -11.195 1.00 21.33 H new ATOM 1433 N SER A 94 7.427 -7.471 -7.689 1.00 15.45 N ATOM 1434 CA SER A 94 7.057 -8.683 -6.977 1.00 41.45 C ATOM 1435 C SER A 94 7.143 -9.888 -7.892 1.00 63.33 C ATOM 1436 O SER A 94 7.489 -10.989 -7.459 1.00 75.13 O ATOM 1437 CB SER A 94 5.684 -8.544 -6.405 1.00 31.02 C ATOM 1438 OG SER A 94 5.611 -7.393 -5.585 1.00 45.10 O ATOM 0 H SER A 94 6.673 -6.794 -7.807 1.00 15.45 H new ATOM 0 HA SER A 94 7.759 -8.835 -6.157 1.00 41.45 H new ATOM 0 HB2 SER A 94 4.952 -8.473 -7.210 1.00 31.02 H new ATOM 0 HB3 SER A 94 5.433 -9.431 -5.823 1.00 31.02 H new ATOM 0 HG SER A 94 6.306 -7.438 -4.896 1.00 45.10 H new ATOM 1444 N LYS A 95 6.847 -9.661 -9.156 1.00 10.15 N ATOM 1445 CA LYS A 95 6.969 -10.654 -10.177 1.00 14.10 C ATOM 1446 C LYS A 95 8.408 -11.147 -10.324 1.00 22.42 C ATOM 1447 O LYS A 95 8.651 -12.322 -10.607 1.00 32.23 O ATOM 1448 CB LYS A 95 6.384 -10.091 -11.489 1.00 20.34 C ATOM 1449 CG LYS A 95 6.866 -10.743 -12.768 1.00 23.50 C ATOM 1450 CD LYS A 95 8.191 -10.127 -13.197 1.00 11.31 C ATOM 1451 CE LYS A 95 8.894 -10.978 -14.185 1.00 60.23 C ATOM 1452 NZ LYS A 95 10.149 -10.351 -14.644 1.00 45.41 N ATOM 0 H LYS A 95 6.510 -8.761 -9.497 1.00 10.15 H new ATOM 0 HA LYS A 95 6.396 -11.539 -9.898 1.00 14.10 H new ATOM 0 HB2 LYS A 95 5.298 -10.180 -11.447 1.00 20.34 H new ATOM 0 HB3 LYS A 95 6.615 -9.027 -11.539 1.00 20.34 H new ATOM 0 HG2 LYS A 95 6.986 -11.816 -12.617 1.00 23.50 H new ATOM 0 HG3 LYS A 95 6.123 -10.613 -13.555 1.00 23.50 H new ATOM 0 HD2 LYS A 95 8.012 -9.141 -13.627 1.00 11.31 H new ATOM 0 HD3 LYS A 95 8.826 -9.983 -12.323 1.00 11.31 H new ATOM 0 HE2 LYS A 95 9.113 -11.949 -13.740 1.00 60.23 H new ATOM 0 HE3 LYS A 95 8.242 -11.159 -15.040 1.00 60.23 H new ATOM 0 HZ1 LYS A 95 10.502 -10.854 -15.483 1.00 45.41 H new ATOM 0 HZ2 LYS A 95 9.971 -9.355 -14.886 1.00 45.41 H new ATOM 0 HZ3 LYS A 95 10.860 -10.401 -13.886 1.00 45.41 H new ATOM 1466 N SER A 96 9.344 -10.249 -10.130 1.00 71.41 N ATOM 1467 CA SER A 96 10.765 -10.569 -10.268 1.00 45.32 C ATOM 1468 C SER A 96 11.229 -11.540 -9.174 1.00 4.32 C ATOM 1469 O SER A 96 12.213 -12.247 -9.351 1.00 1.31 O ATOM 1470 CB SER A 96 11.578 -9.288 -10.196 1.00 61.12 C ATOM 1471 OG SER A 96 11.104 -8.353 -11.138 1.00 64.13 O ATOM 0 H SER A 96 9.156 -9.280 -9.874 1.00 71.41 H new ATOM 0 HA SER A 96 10.916 -11.054 -11.233 1.00 45.32 H new ATOM 0 HB2 SER A 96 11.517 -8.866 -9.193 1.00 61.12 H new ATOM 0 HB3 SER A 96 12.629 -9.505 -10.387 1.00 61.12 H new ATOM 0 HG SER A 96 11.843 -7.780 -11.431 1.00 64.13 H new ATOM 1477 N GLY A 97 10.495 -11.572 -8.067 1.00 15.53 N ATOM 1478 CA GLY A 97 10.744 -12.511 -6.948 1.00 44.42 C ATOM 1479 C GLY A 97 12.073 -12.357 -6.169 1.00 22.40 C ATOM 1480 O GLY A 97 12.113 -12.609 -4.966 1.00 11.34 O ATOM 0 H GLY A 97 9.703 -10.949 -7.907 1.00 15.53 H new ATOM 0 HA2 GLY A 97 9.924 -12.412 -6.237 1.00 44.42 H new ATOM 0 HA3 GLY A 97 10.702 -13.526 -7.344 1.00 44.42 H new ATOM 1484 N GLY A 98 13.125 -11.970 -6.846 1.00 61.11 N ATOM 1485 CA GLY A 98 14.438 -11.894 -6.266 1.00 72.20 C ATOM 1486 C GLY A 98 14.767 -10.554 -5.668 1.00 3.42 C ATOM 1487 O GLY A 98 13.903 -9.898 -5.093 1.00 70.23 O ATOM 0 H GLY A 98 13.091 -11.696 -7.828 1.00 61.11 H new ATOM 0 HA2 GLY A 98 14.527 -12.657 -5.493 1.00 72.20 H new ATOM 0 HA3 GLY A 98 15.177 -12.129 -7.032 1.00 72.20 H new ATOM 1491 N ASP A 99 16.023 -10.147 -5.834 1.00 50.25 N ATOM 1492 CA ASP A 99 16.606 -8.919 -5.233 1.00 73.44 C ATOM 1493 C ASP A 99 15.745 -7.690 -5.414 1.00 44.20 C ATOM 1494 O ASP A 99 15.664 -6.843 -4.512 1.00 14.45 O ATOM 1495 CB ASP A 99 17.998 -8.653 -5.796 1.00 4.51 C ATOM 1496 CG ASP A 99 18.963 -9.759 -5.486 1.00 52.31 C ATOM 1497 OD1 ASP A 99 19.550 -9.760 -4.394 1.00 13.44 O ATOM 1498 OD2 ASP A 99 19.137 -10.663 -6.327 1.00 51.22 O ATOM 0 H ASP A 99 16.692 -10.666 -6.403 1.00 50.25 H new ATOM 0 HA ASP A 99 16.665 -9.112 -4.162 1.00 73.44 H new ATOM 0 HB2 ASP A 99 17.931 -8.525 -6.876 1.00 4.51 H new ATOM 0 HB3 ASP A 99 18.379 -7.717 -5.387 1.00 4.51 H new ATOM 1503 N ARG A 100 15.104 -7.581 -6.558 1.00 62.34 N ATOM 1504 CA ARG A 100 14.210 -6.470 -6.820 1.00 34.11 C ATOM 1505 C ARG A 100 13.028 -6.507 -5.850 1.00 12.31 C ATOM 1506 O ARG A 100 12.705 -5.513 -5.213 1.00 53.42 O ATOM 1507 CB ARG A 100 13.710 -6.510 -8.252 1.00 20.14 C ATOM 1508 CG ARG A 100 14.765 -6.286 -9.332 1.00 72.21 C ATOM 1509 CD ARG A 100 15.299 -4.866 -9.296 1.00 64.32 C ATOM 1510 NE ARG A 100 16.250 -4.596 -10.380 1.00 12.15 N ATOM 1511 CZ ARG A 100 16.608 -3.377 -10.801 1.00 74.42 C ATOM 1512 NH1 ARG A 100 16.097 -2.293 -10.229 1.00 30.34 N ATOM 1513 NH2 ARG A 100 17.489 -3.243 -11.786 1.00 74.43 N ATOM 0 H ARG A 100 15.185 -8.249 -7.324 1.00 62.34 H new ATOM 0 HA ARG A 100 14.762 -5.542 -6.674 1.00 34.11 H new ATOM 0 HB2 ARG A 100 13.240 -7.478 -8.426 1.00 20.14 H new ATOM 0 HB3 ARG A 100 12.934 -5.753 -8.367 1.00 20.14 H new ATOM 0 HG2 ARG A 100 15.586 -6.989 -9.192 1.00 72.21 H new ATOM 0 HG3 ARG A 100 14.334 -6.490 -10.312 1.00 72.21 H new ATOM 0 HD2 ARG A 100 14.466 -4.166 -9.365 1.00 64.32 H new ATOM 0 HD3 ARG A 100 15.786 -4.689 -8.337 1.00 64.32 H new ATOM 0 HE ARG A 100 16.670 -5.399 -10.849 1.00 12.15 H new ATOM 0 HH11 ARG A 100 15.428 -2.387 -9.465 1.00 30.34 H new ATOM 0 HH12 ARG A 100 16.373 -1.366 -10.554 1.00 30.34 H new ATOM 0 HH21 ARG A 100 17.895 -4.070 -12.224 1.00 74.43 H new ATOM 0 HH22 ARG A 100 17.760 -2.313 -12.105 1.00 74.43 H new ATOM 1527 N TYR A 101 12.416 -7.665 -5.719 1.00 21.44 N ATOM 1528 CA TYR A 101 11.306 -7.835 -4.809 1.00 1.41 C ATOM 1529 C TYR A 101 11.735 -7.664 -3.350 1.00 62.23 C ATOM 1530 O TYR A 101 11.060 -6.974 -2.584 1.00 1.13 O ATOM 1531 CB TYR A 101 10.610 -9.188 -5.015 1.00 24.34 C ATOM 1532 CG TYR A 101 9.656 -9.517 -3.898 1.00 34.51 C ATOM 1533 CD1 TYR A 101 8.463 -8.830 -3.741 1.00 31.14 C ATOM 1534 CD2 TYR A 101 9.981 -10.493 -2.971 1.00 61.34 C ATOM 1535 CE1 TYR A 101 7.622 -9.099 -2.689 1.00 43.23 C ATOM 1536 CE2 TYR A 101 9.140 -10.777 -1.918 1.00 54.22 C ATOM 1537 CZ TYR A 101 7.961 -10.072 -1.783 1.00 72.02 C ATOM 1538 OH TYR A 101 7.139 -10.323 -0.727 1.00 31.32 O ATOM 0 H TYR A 101 12.671 -8.507 -6.235 1.00 21.44 H new ATOM 0 HA TYR A 101 10.588 -7.048 -5.038 1.00 1.41 H new ATOM 0 HB2 TYR A 101 10.068 -9.175 -5.960 1.00 24.34 H new ATOM 0 HB3 TYR A 101 11.362 -9.973 -5.090 1.00 24.34 H new ATOM 0 HD1 TYR A 101 8.190 -8.070 -4.458 1.00 31.14 H new ATOM 0 HD2 TYR A 101 10.907 -11.039 -3.075 1.00 61.34 H new ATOM 0 HE1 TYR A 101 6.700 -8.548 -2.576 1.00 43.23 H new ATOM 0 HE2 TYR A 101 9.401 -11.544 -1.204 1.00 54.22 H new ATOM 0 HH TYR A 101 7.606 -10.113 0.108 1.00 31.32 H new ATOM 1548 N TYR A 102 12.851 -8.289 -2.975 1.00 73.31 N ATOM 1549 CA TYR A 102 13.333 -8.219 -1.593 1.00 41.12 C ATOM 1550 C TYR A 102 13.566 -6.805 -1.139 1.00 43.21 C ATOM 1551 O TYR A 102 13.196 -6.445 -0.023 1.00 40.41 O ATOM 1552 CB TYR A 102 14.557 -9.099 -1.346 1.00 3.54 C ATOM 1553 CG TYR A 102 14.230 -10.558 -1.439 1.00 65.52 C ATOM 1554 CD1 TYR A 102 13.603 -11.202 -0.398 1.00 61.20 C ATOM 1555 CD2 TYR A 102 14.523 -11.280 -2.566 1.00 63.41 C ATOM 1556 CE1 TYR A 102 13.277 -12.529 -0.482 1.00 74.32 C ATOM 1557 CE2 TYR A 102 14.207 -12.610 -2.669 1.00 23.31 C ATOM 1558 CZ TYR A 102 13.578 -13.234 -1.622 1.00 33.21 C ATOM 1559 OH TYR A 102 13.240 -14.575 -1.708 1.00 11.41 O ATOM 0 H TYR A 102 13.434 -8.845 -3.601 1.00 73.31 H new ATOM 0 HA TYR A 102 12.529 -8.625 -0.979 1.00 41.12 H new ATOM 0 HB2 TYR A 102 15.331 -8.854 -2.073 1.00 3.54 H new ATOM 0 HB3 TYR A 102 14.966 -8.882 -0.359 1.00 3.54 H new ATOM 0 HD1 TYR A 102 13.364 -10.652 0.500 1.00 61.20 H new ATOM 0 HD2 TYR A 102 15.015 -10.790 -3.393 1.00 63.41 H new ATOM 0 HE1 TYR A 102 12.785 -13.020 0.345 1.00 74.32 H new ATOM 0 HE2 TYR A 102 14.451 -13.161 -3.565 1.00 23.31 H new ATOM 0 HH TYR A 102 13.520 -14.928 -2.578 1.00 11.41 H new ATOM 1569 N LYS A 103 14.151 -5.997 -2.001 1.00 32.05 N ATOM 1570 CA LYS A 103 14.341 -4.593 -1.695 1.00 11.32 C ATOM 1571 C LYS A 103 13.033 -3.859 -1.646 1.00 61.54 C ATOM 1572 O LYS A 103 12.808 -3.087 -0.748 1.00 61.41 O ATOM 1573 CB LYS A 103 15.285 -3.912 -2.669 1.00 13.31 C ATOM 1574 CG LYS A 103 16.736 -4.277 -2.510 1.00 52.12 C ATOM 1575 CD LYS A 103 17.229 -3.893 -1.129 1.00 51.10 C ATOM 1576 CE LYS A 103 18.711 -4.159 -0.969 1.00 74.12 C ATOM 1577 NZ LYS A 103 19.195 -3.785 0.370 1.00 42.14 N ATOM 0 H LYS A 103 14.501 -6.286 -2.914 1.00 32.05 H new ATOM 0 HA LYS A 103 14.800 -4.556 -0.707 1.00 11.32 H new ATOM 0 HB2 LYS A 103 14.974 -4.157 -3.684 1.00 13.31 H new ATOM 0 HB3 LYS A 103 15.183 -2.833 -2.556 1.00 13.31 H new ATOM 0 HG2 LYS A 103 16.867 -5.348 -2.665 1.00 52.12 H new ATOM 0 HG3 LYS A 103 17.331 -3.769 -3.270 1.00 52.12 H new ATOM 0 HD2 LYS A 103 17.028 -2.837 -0.952 1.00 51.10 H new ATOM 0 HD3 LYS A 103 16.675 -4.454 -0.376 1.00 51.10 H new ATOM 0 HE2 LYS A 103 18.911 -5.216 -1.145 1.00 74.12 H new ATOM 0 HE3 LYS A 103 19.264 -3.600 -1.724 1.00 74.12 H new ATOM 0 HZ1 LYS A 103 20.214 -3.983 0.439 1.00 42.14 H new ATOM 0 HZ2 LYS A 103 19.028 -2.771 0.529 1.00 42.14 H new ATOM 0 HZ3 LYS A 103 18.686 -4.337 1.090 1.00 42.14 H new ATOM 1591 N ALA A 104 12.174 -4.120 -2.604 1.00 52.14 N ATOM 1592 CA ALA A 104 10.866 -3.469 -2.672 1.00 4.03 C ATOM 1593 C ALA A 104 10.070 -3.705 -1.387 1.00 11.23 C ATOM 1594 O ALA A 104 9.514 -2.771 -0.801 1.00 51.10 O ATOM 1595 CB ALA A 104 10.099 -3.964 -3.872 1.00 64.41 C ATOM 0 H ALA A 104 12.351 -4.784 -3.358 1.00 52.14 H new ATOM 0 HA ALA A 104 11.022 -2.395 -2.777 1.00 4.03 H new ATOM 0 HB1 ALA A 104 9.127 -3.472 -3.911 1.00 64.41 H new ATOM 0 HB2 ALA A 104 10.658 -3.737 -4.780 1.00 64.41 H new ATOM 0 HB3 ALA A 104 9.957 -5.042 -3.794 1.00 64.41 H new ATOM 1601 N GLU A 105 10.043 -4.950 -0.949 1.00 62.24 N ATOM 1602 CA GLU A 105 9.398 -5.335 0.288 1.00 65.32 C ATOM 1603 C GLU A 105 10.101 -4.662 1.493 1.00 14.05 C ATOM 1604 O GLU A 105 9.449 -4.158 2.410 1.00 2.13 O ATOM 1605 CB GLU A 105 9.464 -6.848 0.422 1.00 70.24 C ATOM 1606 CG GLU A 105 8.909 -7.378 1.714 1.00 10.14 C ATOM 1607 CD GLU A 105 9.274 -8.813 1.939 1.00 25.42 C ATOM 1608 OE1 GLU A 105 8.544 -9.704 1.499 1.00 2.33 O ATOM 1609 OE2 GLU A 105 10.333 -9.055 2.584 1.00 60.11 O ATOM 0 H GLU A 105 10.473 -5.728 -1.448 1.00 62.24 H new ATOM 0 HA GLU A 105 8.358 -5.010 0.275 1.00 65.32 H new ATOM 0 HB2 GLU A 105 8.918 -7.299 -0.407 1.00 70.24 H new ATOM 0 HB3 GLU A 105 10.503 -7.165 0.329 1.00 70.24 H new ATOM 0 HG2 GLU A 105 9.282 -6.776 2.542 1.00 10.14 H new ATOM 0 HG3 GLU A 105 7.824 -7.277 1.710 1.00 10.14 H new ATOM 1616 N ASP A 106 11.433 -4.650 1.457 1.00 2.12 N ATOM 1617 CA ASP A 106 12.274 -4.028 2.512 1.00 62.10 C ATOM 1618 C ASP A 106 12.024 -2.534 2.584 1.00 4.24 C ATOM 1619 O ASP A 106 12.142 -1.913 3.633 1.00 24.40 O ATOM 1620 CB ASP A 106 13.761 -4.290 2.222 1.00 15.11 C ATOM 1621 CG ASP A 106 14.701 -3.611 3.199 1.00 3.44 C ATOM 1622 OD1 ASP A 106 14.921 -4.149 4.304 1.00 33.02 O ATOM 1623 OD2 ASP A 106 15.233 -2.532 2.883 1.00 3.21 O ATOM 0 H ASP A 106 11.973 -5.069 0.699 1.00 2.12 H new ATOM 0 HA ASP A 106 12.008 -4.474 3.470 1.00 62.10 H new ATOM 0 HB2 ASP A 106 13.943 -5.365 2.244 1.00 15.11 H new ATOM 0 HB3 ASP A 106 13.991 -3.948 1.213 1.00 15.11 H new ATOM 1628 N ASN A 107 11.690 -1.978 1.474 1.00 11.23 N ATOM 1629 CA ASN A 107 11.371 -0.580 1.393 1.00 33.13 C ATOM 1630 C ASN A 107 9.964 -0.321 1.898 1.00 24.22 C ATOM 1631 O ASN A 107 9.733 0.645 2.638 1.00 73.53 O ATOM 1632 CB ASN A 107 11.554 -0.051 -0.030 1.00 10.42 C ATOM 1633 CG ASN A 107 12.996 -0.055 -0.515 1.00 4.20 C ATOM 1634 OD1 ASN A 107 13.922 0.122 0.261 1.00 73.32 O ATOM 1635 ND2 ASN A 107 13.198 -0.252 -1.797 1.00 35.14 N ATOM 0 H ASN A 107 11.627 -2.475 0.586 1.00 11.23 H new ATOM 0 HA ASN A 107 12.066 -0.038 2.035 1.00 33.13 H new ATOM 0 HB2 ASN A 107 10.952 -0.654 -0.710 1.00 10.42 H new ATOM 0 HB3 ASN A 107 11.168 0.967 -0.080 1.00 10.42 H new ATOM 0 HD21 ASN A 107 14.148 -0.260 -2.168 1.00 35.14 H new ATOM 0 HD22 ASN A 107 12.405 -0.397 -2.422 1.00 35.14 H new ATOM 1642 N ALA A 108 9.025 -1.187 1.511 1.00 25.42 N ATOM 1643 CA ALA A 108 7.649 -1.077 1.950 1.00 10.12 C ATOM 1644 C ALA A 108 7.519 -1.122 3.471 1.00 53.13 C ATOM 1645 O ALA A 108 6.722 -0.392 4.024 1.00 60.12 O ATOM 1646 CB ALA A 108 6.787 -2.158 1.310 1.00 11.33 C ATOM 0 H ALA A 108 9.204 -1.976 0.889 1.00 25.42 H new ATOM 0 HA ALA A 108 7.291 -0.101 1.623 1.00 10.12 H new ATOM 0 HB1 ALA A 108 5.758 -2.055 1.655 1.00 11.33 H new ATOM 0 HB2 ALA A 108 6.818 -2.054 0.225 1.00 11.33 H new ATOM 0 HB3 ALA A 108 7.167 -3.140 1.591 1.00 11.33 H new ATOM 1652 N VAL A 109 8.334 -1.955 4.152 1.00 53.24 N ATOM 1653 CA VAL A 109 8.237 -2.078 5.621 1.00 61.23 C ATOM 1654 C VAL A 109 8.414 -0.724 6.315 1.00 32.22 C ATOM 1655 O VAL A 109 7.695 -0.393 7.265 1.00 42.31 O ATOM 1656 CB VAL A 109 9.240 -3.113 6.232 1.00 51.02 C ATOM 1657 CG1 VAL A 109 9.064 -4.475 5.640 1.00 13.31 C ATOM 1658 CG2 VAL A 109 10.677 -2.672 6.128 1.00 34.14 C ATOM 0 H VAL A 109 9.050 -2.539 3.721 1.00 53.24 H new ATOM 0 HA VAL A 109 7.230 -2.453 5.806 1.00 61.23 H new ATOM 0 HB VAL A 109 8.998 -3.167 7.293 1.00 51.02 H new ATOM 0 HG11 VAL A 109 9.779 -5.163 6.091 1.00 13.31 H new ATOM 0 HG12 VAL A 109 8.051 -4.827 5.832 1.00 13.31 H new ATOM 0 HG13 VAL A 109 9.234 -4.429 4.564 1.00 13.31 H new ATOM 0 HG21 VAL A 109 11.323 -3.431 6.569 1.00 34.14 H new ATOM 0 HG22 VAL A 109 10.941 -2.535 5.079 1.00 34.14 H new ATOM 0 HG23 VAL A 109 10.808 -1.730 6.661 1.00 34.14 H new ATOM 1668 N ASP A 110 9.345 0.052 5.809 1.00 2.41 N ATOM 1669 CA ASP A 110 9.658 1.344 6.362 1.00 53.44 C ATOM 1670 C ASP A 110 8.554 2.319 6.086 1.00 5.44 C ATOM 1671 O ASP A 110 8.117 3.038 6.974 1.00 74.33 O ATOM 1672 CB ASP A 110 10.955 1.849 5.800 1.00 10.30 C ATOM 1673 CG ASP A 110 11.389 3.161 6.418 1.00 11.21 C ATOM 1674 OD1 ASP A 110 11.892 3.161 7.567 1.00 31.02 O ATOM 1675 OD2 ASP A 110 11.275 4.188 5.776 1.00 32.11 O ATOM 0 H ASP A 110 9.908 -0.200 4.997 1.00 2.41 H new ATOM 0 HA ASP A 110 9.761 1.241 7.442 1.00 53.44 H new ATOM 0 HB2 ASP A 110 11.732 1.102 5.962 1.00 10.30 H new ATOM 0 HB3 ASP A 110 10.854 1.976 4.722 1.00 10.30 H new ATOM 1680 N VAL A 111 8.081 2.314 4.854 1.00 22.21 N ATOM 1681 CA VAL A 111 7.001 3.191 4.445 1.00 41.22 C ATOM 1682 C VAL A 111 5.757 2.902 5.275 1.00 13.54 C ATOM 1683 O VAL A 111 5.119 3.810 5.792 1.00 65.43 O ATOM 1684 CB VAL A 111 6.659 3.026 2.931 1.00 63.21 C ATOM 1685 CG1 VAL A 111 5.519 3.950 2.524 1.00 71.53 C ATOM 1686 CG2 VAL A 111 7.878 3.301 2.072 1.00 12.12 C ATOM 0 H VAL A 111 8.432 1.706 4.114 1.00 22.21 H new ATOM 0 HA VAL A 111 7.333 4.216 4.608 1.00 41.22 H new ATOM 0 HB VAL A 111 6.342 1.995 2.774 1.00 63.21 H new ATOM 0 HG11 VAL A 111 5.301 3.815 1.465 1.00 71.53 H new ATOM 0 HG12 VAL A 111 4.631 3.712 3.110 1.00 71.53 H new ATOM 0 HG13 VAL A 111 5.807 4.985 2.706 1.00 71.53 H new ATOM 0 HG21 VAL A 111 7.617 3.180 1.021 1.00 12.12 H new ATOM 0 HG22 VAL A 111 8.223 4.320 2.246 1.00 12.12 H new ATOM 0 HG23 VAL A 111 8.672 2.600 2.332 1.00 12.12 H new ATOM 1696 N VAL A 112 5.464 1.635 5.453 1.00 4.25 N ATOM 1697 CA VAL A 112 4.248 1.246 6.142 1.00 34.54 C ATOM 1698 C VAL A 112 4.324 1.567 7.643 1.00 11.12 C ATOM 1699 O VAL A 112 3.346 2.049 8.230 1.00 51.23 O ATOM 1700 CB VAL A 112 3.866 -0.250 5.901 1.00 22.32 C ATOM 1701 CG1 VAL A 112 2.566 -0.597 6.603 1.00 3.25 C ATOM 1702 CG2 VAL A 112 3.719 -0.538 4.421 1.00 62.32 C ATOM 0 H VAL A 112 6.044 0.859 5.134 1.00 4.25 H new ATOM 0 HA VAL A 112 3.447 1.845 5.709 1.00 34.54 H new ATOM 0 HB VAL A 112 4.671 -0.861 6.310 1.00 22.32 H new ATOM 0 HG11 VAL A 112 2.322 -1.643 6.420 1.00 3.25 H new ATOM 0 HG12 VAL A 112 2.676 -0.432 7.675 1.00 3.25 H new ATOM 0 HG13 VAL A 112 1.765 0.035 6.219 1.00 3.25 H new ATOM 0 HG21 VAL A 112 3.453 -1.585 4.279 1.00 62.32 H new ATOM 0 HG22 VAL A 112 2.936 0.095 4.003 1.00 62.32 H new ATOM 0 HG23 VAL A 112 4.662 -0.331 3.915 1.00 62.32 H new ATOM 1712 N ARG A 113 5.490 1.353 8.263 1.00 41.12 N ATOM 1713 CA ARG A 113 5.626 1.626 9.699 1.00 3.14 C ATOM 1714 C ARG A 113 5.448 3.113 10.007 1.00 24.44 C ATOM 1715 O ARG A 113 4.856 3.473 11.019 1.00 42.23 O ATOM 1716 CB ARG A 113 6.948 1.113 10.279 1.00 42.24 C ATOM 1717 CG ARG A 113 8.186 1.801 9.770 1.00 30.11 C ATOM 1718 CD ARG A 113 9.425 1.208 10.386 1.00 61.33 C ATOM 1719 NE ARG A 113 10.646 1.878 9.928 1.00 1.10 N ATOM 1720 CZ ARG A 113 11.810 1.887 10.579 1.00 33.22 C ATOM 1721 NH1 ARG A 113 11.939 1.275 11.762 1.00 44.41 N ATOM 1722 NH2 ARG A 113 12.844 2.504 10.037 1.00 23.23 N ATOM 0 H ARG A 113 6.333 1.001 7.808 1.00 41.12 H new ATOM 0 HA ARG A 113 4.824 1.072 10.187 1.00 3.14 H new ATOM 0 HB2 ARG A 113 6.914 1.218 11.363 1.00 42.24 H new ATOM 0 HB3 ARG A 113 7.030 0.048 10.064 1.00 42.24 H new ATOM 0 HG2 ARG A 113 8.236 1.711 8.685 1.00 30.11 H new ATOM 0 HG3 ARG A 113 8.135 2.865 9.999 1.00 30.11 H new ATOM 0 HD2 ARG A 113 9.359 1.279 11.472 1.00 61.33 H new ATOM 0 HD3 ARG A 113 9.480 0.148 10.139 1.00 61.33 H new ATOM 0 HE ARG A 113 10.602 2.378 9.040 1.00 1.10 H new ATOM 0 HH11 ARG A 113 11.141 0.794 12.177 1.00 44.41 H new ATOM 0 HH12 ARG A 113 12.835 1.290 12.249 1.00 44.41 H new ATOM 0 HH21 ARG A 113 12.746 2.965 9.133 1.00 23.23 H new ATOM 0 HH22 ARG A 113 13.741 2.519 10.523 1.00 23.23 H new ATOM 1736 N GLN A 114 5.945 3.972 9.116 1.00 61.11 N ATOM 1737 CA GLN A 114 5.799 5.418 9.274 1.00 55.20 C ATOM 1738 C GLN A 114 4.335 5.796 9.305 1.00 51.42 C ATOM 1739 O GLN A 114 3.906 6.600 10.116 1.00 5.22 O ATOM 1740 CB GLN A 114 6.503 6.147 8.134 1.00 75.04 C ATOM 1741 CG GLN A 114 7.972 5.861 8.078 1.00 70.40 C ATOM 1742 CD GLN A 114 8.676 6.371 9.285 1.00 43.22 C ATOM 1743 OE1 GLN A 114 9.665 5.797 9.731 1.00 72.41 O ATOM 1744 NE2 GLN A 114 8.209 7.469 9.805 1.00 73.34 N ATOM 0 H GLN A 114 6.452 3.690 8.277 1.00 61.11 H new ATOM 0 HA GLN A 114 6.258 5.713 10.217 1.00 55.20 H new ATOM 0 HB2 GLN A 114 6.046 5.858 7.188 1.00 75.04 H new ATOM 0 HB3 GLN A 114 6.351 7.220 8.247 1.00 75.04 H new ATOM 0 HG2 GLN A 114 8.131 4.786 7.991 1.00 70.40 H new ATOM 0 HG3 GLN A 114 8.399 6.320 7.186 1.00 70.40 H new ATOM 0 HE21 GLN A 114 7.384 7.913 9.402 1.00 73.34 H new ATOM 0 HE22 GLN A 114 8.668 7.885 10.615 1.00 73.34 H new ATOM 1753 N LEU A 115 3.584 5.174 8.444 1.00 43.32 N ATOM 1754 CA LEU A 115 2.163 5.375 8.330 1.00 25.24 C ATOM 1755 C LEU A 115 1.450 4.895 9.582 1.00 75.41 C ATOM 1756 O LEU A 115 0.550 5.555 10.071 1.00 35.41 O ATOM 1757 CB LEU A 115 1.650 4.659 7.078 1.00 20.44 C ATOM 1758 CG LEU A 115 1.816 5.372 5.701 1.00 63.25 C ATOM 1759 CD1 LEU A 115 3.160 6.069 5.547 1.00 73.33 C ATOM 1760 CD2 LEU A 115 1.677 4.344 4.605 1.00 2.11 C ATOM 0 H LEU A 115 3.951 4.492 7.780 1.00 43.32 H new ATOM 0 HA LEU A 115 1.953 6.440 8.231 1.00 25.24 H new ATOM 0 HB2 LEU A 115 2.154 3.694 7.016 1.00 20.44 H new ATOM 0 HB3 LEU A 115 0.589 4.456 7.222 1.00 20.44 H new ATOM 0 HG LEU A 115 1.044 6.139 5.638 1.00 63.25 H new ATOM 0 HD11 LEU A 115 3.213 6.545 4.568 1.00 73.33 H new ATOM 0 HD12 LEU A 115 3.269 6.825 6.325 1.00 73.33 H new ATOM 0 HD13 LEU A 115 3.962 5.337 5.638 1.00 73.33 H new ATOM 0 HD21 LEU A 115 1.791 4.828 3.635 1.00 2.11 H new ATOM 0 HD22 LEU A 115 2.447 3.581 4.722 1.00 2.11 H new ATOM 0 HD23 LEU A 115 0.693 3.879 4.665 1.00 2.11 H new ATOM 1772 N MET A 116 1.895 3.774 10.127 1.00 12.54 N ATOM 1773 CA MET A 116 1.303 3.243 11.343 1.00 15.54 C ATOM 1774 C MET A 116 1.671 4.102 12.538 1.00 52.34 C ATOM 1775 O MET A 116 0.933 4.175 13.504 1.00 3.21 O ATOM 1776 CB MET A 116 1.696 1.788 11.619 1.00 10.33 C ATOM 1777 CG MET A 116 1.351 0.795 10.523 1.00 62.12 C ATOM 1778 SD MET A 116 1.498 -0.926 11.072 1.00 34.34 S ATOM 1779 CE MET A 116 3.153 -0.946 11.756 1.00 23.02 C ATOM 0 H MET A 116 2.661 3.217 9.748 1.00 12.54 H new ATOM 0 HA MET A 116 0.224 3.264 11.187 1.00 15.54 H new ATOM 0 HB2 MET A 116 2.771 1.748 11.795 1.00 10.33 H new ATOM 0 HB3 MET A 116 1.210 1.468 12.541 1.00 10.33 H new ATOM 0 HG2 MET A 116 0.333 0.977 10.180 1.00 62.12 H new ATOM 0 HG3 MET A 116 2.009 0.958 9.670 1.00 62.12 H new ATOM 0 HE1 MET A 116 3.413 -1.963 12.051 1.00 23.02 H new ATOM 0 HE2 MET A 116 3.861 -0.594 11.006 1.00 23.02 H new ATOM 0 HE3 MET A 116 3.194 -0.294 12.628 1.00 23.02 H new ATOM 1789 N SER A 117 2.813 4.734 12.469 1.00 43.25 N ATOM 1790 CA SER A 117 3.254 5.606 13.523 1.00 52.30 C ATOM 1791 C SER A 117 2.502 6.948 13.449 1.00 21.54 C ATOM 1792 O SER A 117 1.973 7.429 14.450 1.00 70.03 O ATOM 1793 CB SER A 117 4.780 5.814 13.420 1.00 74.02 C ATOM 1794 OG SER A 117 5.279 6.642 14.455 1.00 50.22 O ATOM 0 H SER A 117 3.460 4.659 11.684 1.00 43.25 H new ATOM 0 HA SER A 117 3.034 5.151 14.489 1.00 52.30 H new ATOM 0 HB2 SER A 117 5.280 4.846 13.458 1.00 74.02 H new ATOM 0 HB3 SER A 117 5.020 6.259 12.454 1.00 74.02 H new ATOM 0 HG SER A 117 6.248 6.746 14.352 1.00 50.22 H new ATOM 1800 N MET A 118 2.414 7.511 12.250 1.00 74.44 N ATOM 1801 CA MET A 118 1.773 8.811 12.052 1.00 14.00 C ATOM 1802 C MET A 118 0.258 8.723 12.150 1.00 44.53 C ATOM 1803 O MET A 118 -0.371 9.531 12.822 1.00 4.44 O ATOM 1804 CB MET A 118 2.172 9.435 10.705 1.00 61.02 C ATOM 1805 CG MET A 118 3.660 9.715 10.559 1.00 55.04 C ATOM 1806 SD MET A 118 4.098 10.456 8.960 1.00 4.25 S ATOM 1807 CE MET A 118 3.529 9.199 7.812 1.00 32.53 C ATOM 0 H MET A 118 2.779 7.089 11.396 1.00 74.44 H new ATOM 0 HA MET A 118 2.128 9.454 12.857 1.00 14.00 H new ATOM 0 HB2 MET A 118 1.860 8.767 9.902 1.00 61.02 H new ATOM 0 HB3 MET A 118 1.624 10.368 10.574 1.00 61.02 H new ATOM 0 HG2 MET A 118 3.977 10.383 11.360 1.00 55.04 H new ATOM 0 HG3 MET A 118 4.212 8.783 10.683 1.00 55.04 H new ATOM 0 HE1 MET A 118 4.267 9.068 7.021 1.00 32.53 H new ATOM 0 HE2 MET A 118 3.394 8.256 8.342 1.00 32.53 H new ATOM 0 HE3 MET A 118 2.580 9.509 7.375 1.00 32.53 H new ATOM 1817 N TYR A 119 -0.327 7.744 11.492 1.00 51.42 N ATOM 1818 CA TYR A 119 -1.787 7.623 11.476 1.00 31.12 C ATOM 1819 C TYR A 119 -2.300 6.720 12.577 1.00 31.32 C ATOM 1820 O TYR A 119 -3.511 6.529 12.715 1.00 21.44 O ATOM 1821 CB TYR A 119 -2.280 7.153 10.106 1.00 11.14 C ATOM 1822 CG TYR A 119 -1.989 8.146 9.005 1.00 63.32 C ATOM 1823 CD1 TYR A 119 -2.878 9.174 8.721 1.00 61.43 C ATOM 1824 CD2 TYR A 119 -0.817 8.069 8.259 1.00 14.00 C ATOM 1825 CE1 TYR A 119 -2.611 10.095 7.731 1.00 10.42 C ATOM 1826 CE2 TYR A 119 -0.545 8.984 7.264 1.00 23.23 C ATOM 1827 CZ TYR A 119 -1.446 9.997 7.006 1.00 62.41 C ATOM 1828 OH TYR A 119 -1.172 10.923 6.026 1.00 52.54 O ATOM 0 H TYR A 119 0.169 7.025 10.965 1.00 51.42 H new ATOM 0 HA TYR A 119 -2.193 8.617 11.666 1.00 31.12 H new ATOM 0 HB2 TYR A 119 -1.809 6.200 9.863 1.00 11.14 H new ATOM 0 HB3 TYR A 119 -3.354 6.975 10.153 1.00 11.14 H new ATOM 0 HD1 TYR A 119 -3.795 9.253 9.286 1.00 61.43 H new ATOM 0 HD2 TYR A 119 -0.109 7.280 8.463 1.00 14.00 H new ATOM 0 HE1 TYR A 119 -3.313 10.890 7.525 1.00 10.42 H new ATOM 0 HE2 TYR A 119 0.367 8.908 6.690 1.00 23.23 H new ATOM 0 HH TYR A 119 -0.310 10.713 5.609 1.00 52.54 H new ATOM 1838 N ASN A 120 -1.370 6.176 13.351 1.00 44.14 N ATOM 1839 CA ASN A 120 -1.673 5.281 14.474 1.00 74.25 C ATOM 1840 C ASN A 120 -2.487 4.094 14.019 1.00 24.43 C ATOM 1841 O ASN A 120 -3.689 3.993 14.277 1.00 4.15 O ATOM 1842 CB ASN A 120 -2.339 5.995 15.670 1.00 43.25 C ATOM 1843 CG ASN A 120 -1.472 7.081 16.279 1.00 42.41 C ATOM 1844 OD1 ASN A 120 -1.536 8.251 15.876 1.00 73.22 O ATOM 1845 ND2 ASN A 120 -0.669 6.722 17.248 1.00 44.35 N ATOM 0 H ASN A 120 -0.372 6.342 13.220 1.00 44.14 H new ATOM 0 HA ASN A 120 -0.712 4.921 14.841 1.00 74.25 H new ATOM 0 HB2 ASN A 120 -3.282 6.433 15.343 1.00 43.25 H new ATOM 0 HB3 ASN A 120 -2.578 5.258 16.437 1.00 43.25 H new ATOM 0 HD21 ASN A 120 -0.070 7.415 17.697 1.00 44.35 H new ATOM 0 HD22 ASN A 120 -0.642 5.749 17.554 1.00 44.35 H new ATOM 1852 N ILE A 121 -1.852 3.257 13.274 1.00 54.03 N ATOM 1853 CA ILE A 121 -2.464 2.080 12.732 1.00 41.43 C ATOM 1854 C ILE A 121 -1.791 0.851 13.340 1.00 32.14 C ATOM 1855 O ILE A 121 -0.570 0.790 13.406 1.00 55.23 O ATOM 1856 CB ILE A 121 -2.309 2.066 11.176 1.00 4.32 C ATOM 1857 CG1 ILE A 121 -2.982 3.312 10.567 1.00 70.52 C ATOM 1858 CG2 ILE A 121 -2.892 0.792 10.575 1.00 41.40 C ATOM 1859 CD1 ILE A 121 -2.805 3.450 9.069 1.00 40.13 C ATOM 0 H ILE A 121 -0.872 3.368 13.015 1.00 54.03 H new ATOM 0 HA ILE A 121 -3.527 2.071 12.973 1.00 41.43 H new ATOM 0 HB ILE A 121 -1.246 2.087 10.938 1.00 4.32 H new ATOM 0 HG12 ILE A 121 -4.048 3.281 10.793 1.00 70.52 H new ATOM 0 HG13 ILE A 121 -2.579 4.201 11.052 1.00 70.52 H new ATOM 0 HG21 ILE A 121 -2.769 0.811 9.492 1.00 41.40 H new ATOM 0 HG22 ILE A 121 -2.372 -0.074 10.984 1.00 41.40 H new ATOM 0 HG23 ILE A 121 -3.952 0.727 10.819 1.00 41.40 H new ATOM 0 HD11 ILE A 121 -3.310 4.353 8.725 1.00 40.13 H new ATOM 0 HD12 ILE A 121 -1.743 3.515 8.833 1.00 40.13 H new ATOM 0 HD13 ILE A 121 -3.235 2.581 8.570 1.00 40.13 H new ATOM 1871 N PRO A 122 -2.565 -0.105 13.853 1.00 11.13 N ATOM 1872 CA PRO A 122 -2.008 -1.335 14.385 1.00 4.40 C ATOM 1873 C PRO A 122 -1.559 -2.273 13.272 1.00 50.34 C ATOM 1874 O PRO A 122 -2.097 -2.242 12.160 1.00 23.23 O ATOM 1875 CB PRO A 122 -3.136 -1.966 15.196 1.00 35.54 C ATOM 1876 CG PRO A 122 -4.360 -1.130 14.971 1.00 33.31 C ATOM 1877 CD PRO A 122 -4.023 -0.057 13.968 1.00 72.51 C ATOM 0 HA PRO A 122 -1.122 -1.141 14.990 1.00 4.40 H new ATOM 0 HB2 PRO A 122 -3.309 -2.995 14.880 1.00 35.54 H new ATOM 0 HB3 PRO A 122 -2.879 -1.996 16.255 1.00 35.54 H new ATOM 0 HG2 PRO A 122 -5.180 -1.748 14.605 1.00 33.31 H new ATOM 0 HG3 PRO A 122 -4.692 -0.683 15.908 1.00 33.31 H new ATOM 0 HD2 PRO A 122 -4.503 -0.247 13.008 1.00 72.51 H new ATOM 0 HD3 PRO A 122 -4.362 0.922 14.306 1.00 72.51 H new ATOM 1885 N ILE A 123 -0.598 -3.116 13.582 1.00 40.41 N ATOM 1886 CA ILE A 123 0.000 -4.016 12.615 1.00 62.02 C ATOM 1887 C ILE A 123 -1.011 -5.048 12.078 1.00 64.24 C ATOM 1888 O ILE A 123 -0.859 -5.561 10.997 1.00 3.33 O ATOM 1889 CB ILE A 123 1.267 -4.722 13.193 1.00 23.40 C ATOM 1890 CG1 ILE A 123 1.963 -5.572 12.129 1.00 25.21 C ATOM 1891 CG2 ILE A 123 0.924 -5.568 14.414 1.00 61.01 C ATOM 1892 CD1 ILE A 123 2.455 -4.777 10.934 1.00 75.52 C ATOM 0 H ILE A 123 -0.205 -3.198 14.520 1.00 40.41 H new ATOM 0 HA ILE A 123 0.315 -3.402 11.771 1.00 62.02 H new ATOM 0 HB ILE A 123 1.958 -3.940 13.508 1.00 23.40 H new ATOM 0 HG12 ILE A 123 2.809 -6.086 12.585 1.00 25.21 H new ATOM 0 HG13 ILE A 123 1.272 -6.341 11.782 1.00 25.21 H new ATOM 0 HG21 ILE A 123 1.828 -6.046 14.791 1.00 61.01 H new ATOM 0 HG22 ILE A 123 0.499 -4.931 15.190 1.00 61.01 H new ATOM 0 HG23 ILE A 123 0.199 -6.333 14.135 1.00 61.01 H new ATOM 0 HD11 ILE A 123 2.937 -5.449 10.224 1.00 75.52 H new ATOM 0 HD12 ILE A 123 1.611 -4.284 10.452 1.00 75.52 H new ATOM 0 HD13 ILE A 123 3.172 -4.026 11.267 1.00 75.52 H new ATOM 1904 N GLU A 124 -2.050 -5.334 12.819 1.00 45.02 N ATOM 1905 CA GLU A 124 -3.043 -6.262 12.310 1.00 43.53 C ATOM 1906 C GLU A 124 -4.079 -5.563 11.438 1.00 10.04 C ATOM 1907 O GLU A 124 -5.003 -6.188 10.909 1.00 71.12 O ATOM 1908 CB GLU A 124 -3.677 -7.101 13.403 1.00 25.53 C ATOM 1909 CG GLU A 124 -2.695 -8.041 14.075 1.00 43.53 C ATOM 1910 CD GLU A 124 -3.361 -8.950 15.058 1.00 32.25 C ATOM 1911 OE1 GLU A 124 -3.940 -9.966 14.637 1.00 13.53 O ATOM 1912 OE2 GLU A 124 -3.316 -8.671 16.270 1.00 64.21 O ATOM 0 H GLU A 124 -2.234 -4.955 13.748 1.00 45.02 H new ATOM 0 HA GLU A 124 -2.511 -6.963 11.668 1.00 43.53 H new ATOM 0 HB2 GLU A 124 -4.111 -6.441 14.154 1.00 25.53 H new ATOM 0 HB3 GLU A 124 -4.495 -7.683 12.978 1.00 25.53 H new ATOM 0 HG2 GLU A 124 -2.190 -8.638 13.316 1.00 43.53 H new ATOM 0 HG3 GLU A 124 -1.928 -7.458 14.585 1.00 43.53 H new ATOM 1919 N ASN A 125 -3.905 -4.269 11.267 1.00 52.32 N ATOM 1920 CA ASN A 125 -4.755 -3.502 10.386 1.00 4.55 C ATOM 1921 C ASN A 125 -4.207 -3.456 8.995 1.00 3.11 C ATOM 1922 O ASN A 125 -4.846 -2.921 8.083 1.00 41.24 O ATOM 1923 CB ASN A 125 -5.047 -2.105 10.898 1.00 20.44 C ATOM 1924 CG ASN A 125 -6.101 -2.076 11.970 1.00 32.33 C ATOM 1925 OD1 ASN A 125 -6.266 -3.020 12.744 1.00 34.31 O ATOM 1926 ND2 ASN A 125 -6.828 -0.993 12.024 1.00 11.11 N ATOM 0 H ASN A 125 -3.177 -3.725 11.731 1.00 52.32 H new ATOM 0 HA ASN A 125 -5.709 -4.029 10.364 1.00 4.55 H new ATOM 0 HB2 ASN A 125 -4.128 -1.669 11.289 1.00 20.44 H new ATOM 0 HB3 ASN A 125 -5.368 -1.479 10.065 1.00 20.44 H new ATOM 0 HD21 ASN A 125 -7.564 -0.907 12.725 1.00 11.11 H new ATOM 0 HD22 ASN A 125 -6.660 -0.233 11.365 1.00 11.11 H new ATOM 1933 N VAL A 126 -3.020 -3.987 8.811 1.00 10.22 N ATOM 1934 CA VAL A 126 -2.526 -4.136 7.483 1.00 1.05 C ATOM 1935 C VAL A 126 -3.043 -5.470 6.958 1.00 62.42 C ATOM 1936 O VAL A 126 -2.762 -6.535 7.513 1.00 51.53 O ATOM 1937 CB VAL A 126 -0.965 -4.001 7.356 1.00 45.31 C ATOM 1938 CG1 VAL A 126 -0.222 -5.015 8.168 1.00 45.35 C ATOM 1939 CG2 VAL A 126 -0.537 -4.063 5.911 1.00 41.14 C ATOM 0 H VAL A 126 -2.399 -4.313 9.552 1.00 10.22 H new ATOM 0 HA VAL A 126 -2.896 -3.312 6.873 1.00 1.05 H new ATOM 0 HB VAL A 126 -0.706 -3.023 7.763 1.00 45.31 H new ATOM 0 HG11 VAL A 126 0.850 -4.870 8.038 1.00 45.35 H new ATOM 0 HG12 VAL A 126 -0.479 -4.898 9.221 1.00 45.35 H new ATOM 0 HG13 VAL A 126 -0.495 -6.017 7.837 1.00 45.35 H new ATOM 0 HG21 VAL A 126 0.547 -3.967 5.848 1.00 41.14 H new ATOM 0 HG22 VAL A 126 -0.843 -5.017 5.482 1.00 41.14 H new ATOM 0 HG23 VAL A 126 -1.006 -3.249 5.357 1.00 41.14 H new ATOM 1949 N ARG A 127 -3.841 -5.402 5.943 1.00 4.21 N ATOM 1950 CA ARG A 127 -4.490 -6.562 5.402 1.00 73.12 C ATOM 1951 C ARG A 127 -4.195 -6.707 3.934 1.00 42.33 C ATOM 1952 O ARG A 127 -3.679 -5.778 3.287 1.00 60.23 O ATOM 1953 CB ARG A 127 -6.003 -6.473 5.631 1.00 5.44 C ATOM 1954 CG ARG A 127 -6.429 -6.483 7.096 1.00 21.03 C ATOM 1955 CD ARG A 127 -6.079 -7.803 7.757 1.00 64.32 C ATOM 1956 NE ARG A 127 -6.500 -7.856 9.160 1.00 32.44 N ATOM 1957 CZ ARG A 127 -7.161 -8.875 9.714 1.00 13.33 C ATOM 1958 NH1 ARG A 127 -7.491 -9.940 8.982 1.00 25.43 N ATOM 1959 NH2 ARG A 127 -7.492 -8.828 10.997 1.00 52.22 N ATOM 0 H ARG A 127 -4.066 -4.533 5.458 1.00 4.21 H new ATOM 0 HA ARG A 127 -4.103 -7.442 5.916 1.00 73.12 H new ATOM 0 HB2 ARG A 127 -6.374 -5.560 5.165 1.00 5.44 H new ATOM 0 HB3 ARG A 127 -6.483 -7.308 5.122 1.00 5.44 H new ATOM 0 HG2 ARG A 127 -5.939 -5.666 7.626 1.00 21.03 H new ATOM 0 HG3 ARG A 127 -7.503 -6.311 7.167 1.00 21.03 H new ATOM 0 HD2 ARG A 127 -6.552 -8.617 7.208 1.00 64.32 H new ATOM 0 HD3 ARG A 127 -5.002 -7.961 7.698 1.00 64.32 H new ATOM 0 HE ARG A 127 -6.272 -7.059 9.754 1.00 32.44 H new ATOM 0 HH11 ARG A 127 -7.238 -9.978 7.995 1.00 25.43 H new ATOM 0 HH12 ARG A 127 -7.996 -10.716 9.410 1.00 25.43 H new ATOM 0 HH21 ARG A 127 -7.242 -8.014 11.559 1.00 52.22 H new ATOM 0 HH22 ARG A 127 -7.997 -9.606 11.422 1.00 52.22 H new ATOM 1973 N THR A 128 -4.487 -7.860 3.409 1.00 14.12 N ATOM 1974 CA THR A 128 -4.291 -8.107 2.022 1.00 25.42 C ATOM 1975 C THR A 128 -5.538 -7.674 1.264 1.00 5.55 C ATOM 1976 O THR A 128 -6.599 -7.462 1.856 1.00 65.43 O ATOM 1977 CB THR A 128 -4.070 -9.618 1.742 1.00 64.31 C ATOM 1978 OG1 THR A 128 -5.257 -10.334 2.009 1.00 23.53 O ATOM 1979 CG2 THR A 128 -2.989 -10.186 2.607 1.00 63.14 C ATOM 0 H THR A 128 -4.866 -8.649 3.932 1.00 14.12 H new ATOM 0 HA THR A 128 -3.411 -7.550 1.701 1.00 25.42 H new ATOM 0 HB THR A 128 -3.782 -9.714 0.695 1.00 64.31 H new ATOM 0 HG1 THR A 128 -5.112 -11.286 1.829 1.00 23.53 H new ATOM 0 HG21 THR A 128 -2.863 -11.245 2.383 1.00 63.14 H new ATOM 0 HG22 THR A 128 -2.054 -9.660 2.413 1.00 63.14 H new ATOM 0 HG23 THR A 128 -3.262 -10.067 3.656 1.00 63.14 H new ATOM 1987 N HIS A 129 -5.420 -7.575 -0.041 1.00 74.22 N ATOM 1988 CA HIS A 129 -6.569 -7.279 -0.890 1.00 41.15 C ATOM 1989 C HIS A 129 -7.530 -8.489 -0.835 1.00 25.40 C ATOM 1990 O HIS A 129 -8.744 -8.372 -1.064 1.00 55.15 O ATOM 1991 CB HIS A 129 -6.070 -7.028 -2.338 1.00 24.32 C ATOM 1992 CG HIS A 129 -7.105 -6.522 -3.352 1.00 40.31 C ATOM 1993 ND1 HIS A 129 -6.767 -5.887 -4.531 1.00 43.23 N ATOM 1994 CD2 HIS A 129 -8.460 -6.605 -3.384 1.00 33.21 C ATOM 1995 CE1 HIS A 129 -7.840 -5.606 -5.228 1.00 74.31 C ATOM 1996 NE2 HIS A 129 -8.882 -6.034 -4.558 1.00 43.11 N ATOM 0 H HIS A 129 -4.541 -7.694 -0.545 1.00 74.22 H new ATOM 0 HA HIS A 129 -7.096 -6.388 -0.549 1.00 41.15 H new ATOM 0 HB2 HIS A 129 -5.255 -6.305 -2.295 1.00 24.32 H new ATOM 0 HB3 HIS A 129 -5.650 -7.959 -2.718 1.00 24.32 H new ATOM 0 HD2 HIS A 129 -9.091 -7.041 -2.624 1.00 33.21 H new ATOM 0 HE1 HIS A 129 -7.862 -5.109 -6.187 1.00 74.31 H new ATOM 0 HE2 HIS A 129 -9.853 -5.955 -4.861 1.00 43.11 H new ATOM 2004 N GLN A 130 -6.977 -9.650 -0.520 1.00 1.42 N ATOM 2005 CA GLN A 130 -7.766 -10.842 -0.459 1.00 75.12 C ATOM 2006 C GLN A 130 -8.544 -10.876 0.856 1.00 40.51 C ATOM 2007 O GLN A 130 -9.624 -11.429 0.936 1.00 43.10 O ATOM 2008 CB GLN A 130 -6.916 -12.094 -0.549 1.00 21.21 C ATOM 2009 CG GLN A 130 -7.541 -13.204 -1.420 1.00 4.24 C ATOM 2010 CD GLN A 130 -7.035 -14.578 -1.098 1.00 23.05 C ATOM 2011 OE1 GLN A 130 -6.897 -15.433 -1.975 1.00 12.41 O ATOM 2012 NE2 GLN A 130 -6.900 -14.834 0.152 1.00 22.44 N ATOM 0 H GLN A 130 -5.988 -9.779 -0.306 1.00 1.42 H new ATOM 0 HA GLN A 130 -8.444 -10.825 -1.312 1.00 75.12 H new ATOM 0 HB2 GLN A 130 -5.939 -11.831 -0.956 1.00 21.21 H new ATOM 0 HB3 GLN A 130 -6.749 -12.483 0.456 1.00 21.21 H new ATOM 0 HG2 GLN A 130 -8.624 -13.186 -1.294 1.00 4.24 H new ATOM 0 HG3 GLN A 130 -7.338 -12.988 -2.469 1.00 4.24 H new ATOM 0 HE21 GLN A 130 -7.024 -14.092 0.841 1.00 22.44 H new ATOM 0 HE22 GLN A 130 -6.668 -15.779 0.457 1.00 22.44 H new ATOM 2021 N SER A 131 -7.969 -10.272 1.870 1.00 62.22 N ATOM 2022 CA SER A 131 -8.535 -10.289 3.216 1.00 2.32 C ATOM 2023 C SER A 131 -9.883 -9.551 3.289 1.00 13.23 C ATOM 2024 O SER A 131 -10.751 -9.897 4.106 1.00 1.11 O ATOM 2025 CB SER A 131 -7.526 -9.696 4.220 1.00 54.21 C ATOM 2026 OG SER A 131 -7.972 -9.818 5.565 1.00 3.24 O ATOM 0 H SER A 131 -7.095 -9.752 1.794 1.00 62.22 H new ATOM 0 HA SER A 131 -8.732 -11.328 3.481 1.00 2.32 H new ATOM 0 HB2 SER A 131 -6.567 -10.201 4.110 1.00 54.21 H new ATOM 0 HB3 SER A 131 -7.361 -8.644 3.988 1.00 54.21 H new ATOM 0 HG SER A 131 -7.419 -10.476 6.035 1.00 3.24 H new ATOM 2032 N TRP A 132 -10.070 -8.557 2.439 1.00 60.24 N ATOM 2033 CA TRP A 132 -11.317 -7.811 2.466 1.00 12.41 C ATOM 2034 C TRP A 132 -12.317 -8.419 1.480 1.00 74.31 C ATOM 2035 O TRP A 132 -13.344 -8.965 1.874 1.00 43.21 O ATOM 2036 CB TRP A 132 -11.123 -6.340 2.105 1.00 3.44 C ATOM 2037 CG TRP A 132 -10.083 -5.588 2.871 1.00 43.31 C ATOM 2038 CD1 TRP A 132 -8.870 -5.174 2.398 1.00 74.45 C ATOM 2039 CD2 TRP A 132 -10.157 -5.147 4.227 1.00 70.01 C ATOM 2040 NE1 TRP A 132 -8.189 -4.494 3.373 1.00 12.00 N ATOM 2041 CE2 TRP A 132 -8.955 -4.469 4.510 1.00 14.25 C ATOM 2042 CE3 TRP A 132 -11.119 -5.259 5.230 1.00 31.32 C ATOM 2043 CZ2 TRP A 132 -8.696 -3.905 5.752 1.00 42.25 C ATOM 2044 CZ3 TRP A 132 -10.859 -4.700 6.463 1.00 53.21 C ATOM 2045 CH2 TRP A 132 -9.660 -4.032 6.714 1.00 34.44 C ATOM 0 H TRP A 132 -9.394 -8.252 1.738 1.00 60.24 H new ATOM 0 HA TRP A 132 -11.694 -7.871 3.487 1.00 12.41 H new ATOM 0 HB2 TRP A 132 -10.873 -6.281 1.046 1.00 3.44 H new ATOM 0 HB3 TRP A 132 -12.077 -5.830 2.237 1.00 3.44 H new ATOM 0 HD1 TRP A 132 -8.501 -5.356 1.399 1.00 74.45 H new ATOM 0 HE1 TRP A 132 -7.265 -4.075 3.270 1.00 12.00 H new ATOM 0 HE3 TRP A 132 -12.050 -5.774 5.044 1.00 31.32 H new ATOM 0 HZ2 TRP A 132 -7.770 -3.386 5.951 1.00 42.25 H new ATOM 0 HZ3 TRP A 132 -11.596 -4.781 7.248 1.00 53.21 H new ATOM 0 HH2 TRP A 132 -9.489 -3.605 7.691 1.00 34.44 H new ATOM 2056 N SER A 133 -11.983 -8.349 0.197 1.00 21.34 N ATOM 2057 CA SER A 133 -12.866 -8.795 -0.852 1.00 65.41 C ATOM 2058 C SER A 133 -12.438 -10.179 -1.277 1.00 55.55 C ATOM 2059 O SER A 133 -13.249 -11.108 -1.352 1.00 31.13 O ATOM 2060 CB SER A 133 -12.805 -7.802 -2.036 1.00 14.23 C ATOM 2061 OG SER A 133 -13.675 -8.160 -3.093 1.00 12.54 O ATOM 0 H SER A 133 -11.092 -7.981 -0.136 1.00 21.34 H new ATOM 0 HA SER A 133 -13.897 -8.833 -0.500 1.00 65.41 H new ATOM 0 HB2 SER A 133 -13.062 -6.804 -1.682 1.00 14.23 H new ATOM 0 HB3 SER A 133 -11.783 -7.754 -2.412 1.00 14.23 H new ATOM 0 HG SER A 133 -13.601 -7.501 -3.815 1.00 12.54 H new ATOM 2067 N GLY A 134 -11.162 -10.318 -1.528 1.00 54.14 N ATOM 2068 CA GLY A 134 -10.632 -11.594 -1.860 1.00 32.24 C ATOM 2069 C GLY A 134 -9.918 -11.651 -3.190 1.00 62.41 C ATOM 2070 O GLY A 134 -9.970 -12.668 -3.880 1.00 70.42 O ATOM 0 H GLY A 134 -10.481 -9.559 -1.506 1.00 54.14 H new ATOM 0 HA2 GLY A 134 -9.939 -11.900 -1.077 1.00 32.24 H new ATOM 0 HA3 GLY A 134 -11.445 -12.320 -1.867 1.00 32.24 H new ATOM 2074 N LYS A 135 -9.256 -10.562 -3.561 1.00 43.03 N ATOM 2075 CA LYS A 135 -8.397 -10.573 -4.733 1.00 14.04 C ATOM 2076 C LYS A 135 -6.969 -10.784 -4.285 1.00 51.40 C ATOM 2077 O LYS A 135 -6.440 -10.022 -3.454 1.00 4.31 O ATOM 2078 CB LYS A 135 -8.526 -9.304 -5.586 1.00 51.04 C ATOM 2079 CG LYS A 135 -7.533 -9.260 -6.746 1.00 24.42 C ATOM 2080 CD LYS A 135 -7.738 -8.062 -7.664 1.00 10.14 C ATOM 2081 CE LYS A 135 -9.072 -8.105 -8.396 1.00 34.34 C ATOM 2082 NZ LYS A 135 -9.242 -6.946 -9.305 1.00 54.23 N ATOM 0 H LYS A 135 -9.298 -9.669 -3.071 1.00 43.03 H new ATOM 0 HA LYS A 135 -8.715 -11.392 -5.378 1.00 14.04 H new ATOM 0 HB2 LYS A 135 -9.540 -9.240 -5.981 1.00 51.04 H new ATOM 0 HB3 LYS A 135 -8.375 -8.430 -4.952 1.00 51.04 H new ATOM 0 HG2 LYS A 135 -6.519 -9.235 -6.347 1.00 24.42 H new ATOM 0 HG3 LYS A 135 -7.624 -10.176 -7.329 1.00 24.42 H new ATOM 0 HD2 LYS A 135 -7.680 -7.145 -7.077 1.00 10.14 H new ATOM 0 HD3 LYS A 135 -6.929 -8.026 -8.393 1.00 10.14 H new ATOM 0 HE2 LYS A 135 -9.142 -9.029 -8.969 1.00 34.34 H new ATOM 0 HE3 LYS A 135 -9.884 -8.119 -7.669 1.00 34.34 H new ATOM 0 HZ1 LYS A 135 -10.163 -7.013 -9.784 1.00 54.23 H new ATOM 0 HZ2 LYS A 135 -9.201 -6.064 -8.755 1.00 54.23 H new ATOM 0 HZ3 LYS A 135 -8.482 -6.947 -10.014 1.00 54.23 H new ATOM 2096 N TYR A 136 -6.358 -11.800 -4.809 1.00 75.43 N ATOM 2097 CA TYR A 136 -5.046 -12.198 -4.413 1.00 71.22 C ATOM 2098 C TYR A 136 -4.020 -11.284 -5.091 1.00 31.41 C ATOM 2099 O TYR A 136 -3.715 -11.433 -6.268 1.00 61.32 O ATOM 2100 CB TYR A 136 -4.865 -13.653 -4.852 1.00 74.41 C ATOM 2101 CG TYR A 136 -3.759 -14.459 -4.208 1.00 75.23 C ATOM 2102 CD1 TYR A 136 -3.885 -14.931 -2.907 1.00 53.33 C ATOM 2103 CD2 TYR A 136 -2.625 -14.807 -4.917 1.00 41.21 C ATOM 2104 CE1 TYR A 136 -2.904 -15.723 -2.343 1.00 3.22 C ATOM 2105 CE2 TYR A 136 -1.642 -15.590 -4.348 1.00 51.01 C ATOM 2106 CZ TYR A 136 -1.788 -16.046 -3.067 1.00 3.31 C ATOM 2107 OH TYR A 136 -0.815 -16.837 -2.512 1.00 72.42 O ATOM 0 H TYR A 136 -6.766 -12.386 -5.537 1.00 75.43 H new ATOM 0 HA TYR A 136 -4.905 -12.117 -3.335 1.00 71.22 H new ATOM 0 HB2 TYR A 136 -5.805 -14.175 -4.673 1.00 74.41 H new ATOM 0 HB3 TYR A 136 -4.697 -13.658 -5.929 1.00 74.41 H new ATOM 0 HD1 TYR A 136 -4.761 -14.675 -2.330 1.00 53.33 H new ATOM 0 HD2 TYR A 136 -2.506 -14.460 -5.933 1.00 41.21 H new ATOM 0 HE1 TYR A 136 -3.017 -16.087 -1.332 1.00 3.22 H new ATOM 0 HE2 TYR A 136 -0.758 -15.843 -4.914 1.00 51.01 H new ATOM 0 HH TYR A 136 -0.817 -17.714 -2.950 1.00 72.42 H new ATOM 2117 N CYS A 137 -3.571 -10.304 -4.348 1.00 72.01 N ATOM 2118 CA CYS A 137 -2.526 -9.390 -4.801 1.00 13.45 C ATOM 2119 C CYS A 137 -1.183 -9.685 -4.216 1.00 42.11 C ATOM 2120 O CYS A 137 -0.235 -9.790 -4.952 1.00 2.11 O ATOM 2121 CB CYS A 137 -2.877 -7.914 -4.658 1.00 65.30 C ATOM 2122 SG CYS A 137 -3.934 -7.332 -5.945 1.00 70.32 S ATOM 0 H CYS A 137 -3.914 -10.108 -3.408 1.00 72.01 H new ATOM 0 HA CYS A 137 -2.463 -9.585 -5.871 1.00 13.45 H new ATOM 0 HB2 CYS A 137 -3.362 -7.753 -3.695 1.00 65.30 H new ATOM 0 HB3 CYS A 137 -1.959 -7.326 -4.655 1.00 65.30 H new ATOM 0 HG CYS A 137 -4.996 -6.793 -5.424 1.00 70.32 H new ATOM 2127 N PRO A 138 -1.036 -9.799 -2.872 1.00 60.03 N ATOM 2128 CA PRO A 138 0.249 -10.174 -2.281 1.00 43.00 C ATOM 2129 C PRO A 138 0.550 -11.672 -2.512 1.00 75.22 C ATOM 2130 O PRO A 138 0.851 -12.403 -1.585 1.00 4.20 O ATOM 2131 CB PRO A 138 0.045 -9.873 -0.796 1.00 12.02 C ATOM 2132 CG PRO A 138 -1.402 -10.017 -0.579 1.00 15.31 C ATOM 2133 CD PRO A 138 -2.057 -9.535 -1.825 1.00 34.23 C ATOM 0 HA PRO A 138 1.095 -9.640 -2.714 1.00 43.00 H new ATOM 0 HB2 PRO A 138 0.610 -10.565 -0.171 1.00 12.02 H new ATOM 0 HB3 PRO A 138 0.384 -8.868 -0.546 1.00 12.02 H new ATOM 0 HG2 PRO A 138 -1.664 -11.056 -0.378 1.00 15.31 H new ATOM 0 HG3 PRO A 138 -1.727 -9.434 0.283 1.00 15.31 H new ATOM 0 HD2 PRO A 138 -2.985 -10.070 -2.024 1.00 34.23 H new ATOM 0 HD3 PRO A 138 -2.307 -8.476 -1.764 1.00 34.23 H new ATOM 2141 N HIS A 139 0.497 -12.079 -3.779 1.00 42.21 N ATOM 2142 CA HIS A 139 0.731 -13.445 -4.228 1.00 30.20 C ATOM 2143 C HIS A 139 2.026 -14.047 -3.696 1.00 3.45 C ATOM 2144 O HIS A 139 2.028 -15.147 -3.170 1.00 32.53 O ATOM 2145 CB HIS A 139 0.676 -13.544 -5.784 1.00 1.43 C ATOM 2146 CG HIS A 139 1.666 -12.668 -6.535 1.00 24.23 C ATOM 2147 ND1 HIS A 139 2.884 -13.105 -7.010 1.00 11.14 N ATOM 2148 CD2 HIS A 139 1.588 -11.363 -6.877 1.00 24.44 C ATOM 2149 CE1 HIS A 139 3.491 -12.071 -7.604 1.00 0.20 C ATOM 2150 NE2 HIS A 139 2.744 -10.991 -7.548 1.00 62.41 N ATOM 0 H HIS A 139 0.282 -11.442 -4.546 1.00 42.21 H new ATOM 0 HA HIS A 139 -0.080 -14.039 -3.806 1.00 30.20 H new ATOM 0 HB2 HIS A 139 0.847 -14.582 -6.070 1.00 1.43 H new ATOM 0 HB3 HIS A 139 -0.331 -13.285 -6.111 1.00 1.43 H new ATOM 0 HD2 HIS A 139 0.755 -10.711 -6.661 1.00 24.44 H new ATOM 0 HE1 HIS A 139 4.465 -12.118 -8.068 1.00 0.20 H new ATOM 0 HE2 HIS A 139 2.968 -10.069 -7.921 1.00 62.41 H new ATOM 2158 N ARG A 140 3.103 -13.305 -3.794 1.00 63.10 N ATOM 2159 CA ARG A 140 4.388 -13.778 -3.402 1.00 14.11 C ATOM 2160 C ARG A 140 4.420 -13.911 -1.882 1.00 43.22 C ATOM 2161 O ARG A 140 4.963 -14.848 -1.332 1.00 74.01 O ATOM 2162 CB ARG A 140 5.464 -12.778 -3.867 1.00 35.34 C ATOM 2163 CG ARG A 140 6.872 -13.288 -3.700 1.00 44.14 C ATOM 2164 CD ARG A 140 7.158 -14.419 -4.673 1.00 3.12 C ATOM 2165 NE ARG A 140 8.361 -15.127 -4.311 1.00 24.24 N ATOM 2166 CZ ARG A 140 9.188 -15.771 -5.128 1.00 43.35 C ATOM 2167 NH1 ARG A 140 9.062 -15.670 -6.453 1.00 61.24 N ATOM 2168 NH2 ARG A 140 10.140 -16.523 -4.603 1.00 23.32 N ATOM 0 H ARG A 140 3.101 -12.350 -4.152 1.00 63.10 H new ATOM 0 HA ARG A 140 4.587 -14.748 -3.857 1.00 14.11 H new ATOM 0 HB2 ARG A 140 5.295 -12.537 -4.917 1.00 35.34 H new ATOM 0 HB3 ARG A 140 5.353 -11.850 -3.306 1.00 35.34 H new ATOM 0 HG2 ARG A 140 7.579 -12.475 -3.863 1.00 44.14 H new ATOM 0 HG3 ARG A 140 7.018 -13.637 -2.678 1.00 44.14 H new ATOM 0 HD2 ARG A 140 6.316 -15.111 -4.688 1.00 3.12 H new ATOM 0 HD3 ARG A 140 7.259 -14.018 -5.682 1.00 3.12 H new ATOM 0 HE ARG A 140 8.604 -15.134 -3.320 1.00 24.24 H new ATOM 0 HH11 ARG A 140 8.323 -15.092 -6.852 1.00 61.24 H new ATOM 0 HH12 ARG A 140 9.705 -16.171 -7.066 1.00 61.24 H new ATOM 0 HH21 ARG A 140 10.229 -16.600 -3.590 1.00 23.32 H new ATOM 0 HH22 ARG A 140 10.786 -17.026 -5.211 1.00 23.32 H new ATOM 2182 N MET A 141 3.773 -12.992 -1.237 1.00 2.30 N ATOM 2183 CA MET A 141 3.760 -12.916 0.192 1.00 71.44 C ATOM 2184 C MET A 141 2.872 -14.001 0.791 1.00 62.45 C ATOM 2185 O MET A 141 3.250 -14.657 1.757 1.00 61.33 O ATOM 2186 CB MET A 141 3.290 -11.532 0.594 1.00 53.04 C ATOM 2187 CG MET A 141 4.150 -10.445 -0.019 1.00 35.43 C ATOM 2188 SD MET A 141 3.476 -8.796 0.149 1.00 2.51 S ATOM 2189 CE MET A 141 3.601 -8.579 1.883 1.00 64.12 C ATOM 0 H MET A 141 3.229 -12.261 -1.695 1.00 2.30 H new ATOM 0 HA MET A 141 4.765 -13.085 0.579 1.00 71.44 H new ATOM 0 HB2 MET A 141 2.254 -11.395 0.282 1.00 53.04 H new ATOM 0 HB3 MET A 141 3.311 -11.442 1.680 1.00 53.04 H new ATOM 0 HG2 MET A 141 5.136 -10.472 0.445 1.00 35.43 H new ATOM 0 HG3 MET A 141 4.291 -10.662 -1.078 1.00 35.43 H new ATOM 0 HE1 MET A 141 2.837 -7.877 2.218 1.00 64.12 H new ATOM 0 HE2 MET A 141 3.456 -9.538 2.381 1.00 64.12 H new ATOM 0 HE3 MET A 141 4.588 -8.187 2.130 1.00 64.12 H new ATOM 2199 N LEU A 142 1.715 -14.213 0.204 1.00 64.15 N ATOM 2200 CA LEU A 142 0.780 -15.187 0.717 1.00 20.10 C ATOM 2201 C LEU A 142 1.198 -16.613 0.399 1.00 73.12 C ATOM 2202 O LEU A 142 1.060 -17.504 1.243 1.00 12.44 O ATOM 2203 CB LEU A 142 -0.640 -14.898 0.224 1.00 33.34 C ATOM 2204 CG LEU A 142 -1.273 -13.586 0.726 1.00 31.32 C ATOM 2205 CD1 LEU A 142 -2.641 -13.351 0.082 1.00 72.34 C ATOM 2206 CD2 LEU A 142 -1.412 -13.624 2.240 1.00 43.34 C ATOM 0 H LEU A 142 1.399 -13.721 -0.632 1.00 64.15 H new ATOM 0 HA LEU A 142 0.786 -15.095 1.803 1.00 20.10 H new ATOM 0 HB2 LEU A 142 -0.629 -14.880 -0.866 1.00 33.34 H new ATOM 0 HB3 LEU A 142 -1.283 -15.726 0.522 1.00 33.34 H new ATOM 0 HG LEU A 142 -0.618 -12.762 0.442 1.00 31.32 H new ATOM 0 HD11 LEU A 142 -3.063 -12.418 0.455 1.00 72.34 H new ATOM 0 HD12 LEU A 142 -2.528 -13.291 -1.000 1.00 72.34 H new ATOM 0 HD13 LEU A 142 -3.307 -14.177 0.332 1.00 72.34 H new ATOM 0 HD21 LEU A 142 -1.860 -12.693 2.588 1.00 43.34 H new ATOM 0 HD22 LEU A 142 -2.048 -14.462 2.526 1.00 43.34 H new ATOM 0 HD23 LEU A 142 -0.428 -13.744 2.693 1.00 43.34 H new ATOM 2218 N ALA A 143 1.730 -16.834 -0.793 1.00 64.00 N ATOM 2219 CA ALA A 143 2.112 -18.168 -1.214 1.00 51.32 C ATOM 2220 C ALA A 143 3.345 -18.662 -0.489 1.00 2.44 C ATOM 2221 O ALA A 143 3.500 -19.867 -0.257 1.00 20.23 O ATOM 2222 CB ALA A 143 2.316 -18.229 -2.716 1.00 75.15 C ATOM 0 H ALA A 143 1.906 -16.105 -1.484 1.00 64.00 H new ATOM 0 HA ALA A 143 1.289 -18.832 -0.949 1.00 51.32 H new ATOM 0 HB1 ALA A 143 2.602 -19.241 -3.004 1.00 75.15 H new ATOM 0 HB2 ALA A 143 1.389 -17.957 -3.220 1.00 75.15 H new ATOM 0 HB3 ALA A 143 3.104 -17.534 -3.005 1.00 75.15 H new ATOM 2228 N GLU A 144 4.229 -17.753 -0.127 1.00 12.55 N ATOM 2229 CA GLU A 144 5.456 -18.153 0.533 1.00 1.44 C ATOM 2230 C GLU A 144 5.343 -18.061 2.038 1.00 1.24 C ATOM 2231 O GLU A 144 6.276 -18.420 2.751 1.00 21.33 O ATOM 2232 CB GLU A 144 6.634 -17.310 0.089 1.00 2.02 C ATOM 2233 CG GLU A 144 6.833 -17.241 -1.401 1.00 51.13 C ATOM 2234 CD GLU A 144 8.180 -16.663 -1.737 1.00 35.42 C ATOM 2235 OE1 GLU A 144 8.323 -15.441 -1.715 1.00 61.24 O ATOM 2236 OE2 GLU A 144 9.113 -17.438 -2.064 1.00 54.12 O ATOM 0 H GLU A 144 4.124 -16.749 -0.275 1.00 12.55 H new ATOM 0 HA GLU A 144 5.623 -19.191 0.246 1.00 1.44 H new ATOM 0 HB2 GLU A 144 6.503 -16.298 0.471 1.00 2.02 H new ATOM 0 HB3 GLU A 144 7.540 -17.708 0.545 1.00 2.02 H new ATOM 0 HG2 GLU A 144 6.744 -18.239 -1.830 1.00 51.13 H new ATOM 0 HG3 GLU A 144 6.049 -16.630 -1.849 1.00 51.13 H new ATOM 2243 N GLY A 145 4.210 -17.578 2.527 1.00 51.32 N ATOM 2244 CA GLY A 145 4.062 -17.378 3.961 1.00 25.44 C ATOM 2245 C GLY A 145 4.948 -16.240 4.424 1.00 21.12 C ATOM 2246 O GLY A 145 5.396 -16.187 5.571 1.00 62.41 O ATOM 0 H GLY A 145 3.397 -17.322 1.967 1.00 51.32 H new ATOM 0 HA2 GLY A 145 3.021 -17.159 4.200 1.00 25.44 H new ATOM 0 HA3 GLY A 145 4.325 -18.293 4.492 1.00 25.44 H new ATOM 2250 N ARG A 146 5.174 -15.326 3.515 1.00 35.13 N ATOM 2251 CA ARG A 146 6.047 -14.224 3.708 1.00 24.04 C ATOM 2252 C ARG A 146 5.272 -13.003 4.152 1.00 21.04 C ATOM 2253 O ARG A 146 5.844 -12.012 4.590 1.00 72.50 O ATOM 2254 CB ARG A 146 6.794 -14.009 2.415 1.00 52.14 C ATOM 2255 CG ARG A 146 7.729 -12.842 2.379 1.00 40.21 C ATOM 2256 CD ARG A 146 8.675 -13.018 1.237 1.00 65.30 C ATOM 2257 NE ARG A 146 9.394 -14.266 1.443 1.00 74.11 N ATOM 2258 CZ ARG A 146 10.349 -14.776 0.663 1.00 54.22 C ATOM 2259 NH1 ARG A 146 10.659 -14.197 -0.488 1.00 73.52 N ATOM 2260 NH2 ARG A 146 10.963 -15.892 1.035 1.00 33.31 N ATOM 0 H ARG A 146 4.735 -15.340 2.594 1.00 35.13 H new ATOM 0 HA ARG A 146 6.766 -14.421 4.503 1.00 24.04 H new ATOM 0 HB2 ARG A 146 7.364 -14.912 2.194 1.00 52.14 H new ATOM 0 HB3 ARG A 146 6.065 -13.889 1.614 1.00 52.14 H new ATOM 0 HG2 ARG A 146 7.169 -11.913 2.266 1.00 40.21 H new ATOM 0 HG3 ARG A 146 8.279 -12.770 3.317 1.00 40.21 H new ATOM 0 HD2 ARG A 146 8.133 -13.041 0.292 1.00 65.30 H new ATOM 0 HD3 ARG A 146 9.371 -12.181 1.185 1.00 65.30 H new ATOM 0 HE ARG A 146 9.142 -14.807 2.270 1.00 74.11 H new ATOM 0 HH11 ARG A 146 10.166 -13.354 -0.784 1.00 73.52 H new ATOM 0 HH12 ARG A 146 11.390 -14.594 -1.078 1.00 73.52 H new ATOM 0 HH21 ARG A 146 10.703 -16.350 1.909 1.00 33.31 H new ATOM 0 HH22 ARG A 146 11.695 -16.292 0.447 1.00 33.31 H new ATOM 2274 N TRP A 147 3.970 -13.101 4.051 1.00 24.42 N ATOM 2275 CA TRP A 147 3.078 -12.046 4.529 1.00 53.01 C ATOM 2276 C TRP A 147 3.311 -11.804 6.014 1.00 30.31 C ATOM 2277 O TRP A 147 3.540 -10.672 6.438 1.00 62.51 O ATOM 2278 CB TRP A 147 1.588 -12.380 4.277 1.00 14.14 C ATOM 2279 CG TRP A 147 0.671 -11.339 4.850 1.00 21.15 C ATOM 2280 CD1 TRP A 147 0.077 -11.363 6.072 1.00 41.23 C ATOM 2281 CD2 TRP A 147 0.268 -10.119 4.237 1.00 54.04 C ATOM 2282 NE1 TRP A 147 -0.646 -10.226 6.268 1.00 51.11 N ATOM 2283 CE2 TRP A 147 -0.558 -9.446 5.154 1.00 53.43 C ATOM 2284 CE3 TRP A 147 0.524 -9.529 3.008 1.00 33.10 C ATOM 2285 CZ2 TRP A 147 -1.123 -8.209 4.878 1.00 13.21 C ATOM 2286 CZ3 TRP A 147 -0.035 -8.311 2.731 1.00 12.51 C ATOM 2287 CH2 TRP A 147 -0.850 -7.656 3.661 1.00 45.43 C ATOM 0 H TRP A 147 3.491 -13.902 3.641 1.00 24.42 H new ATOM 0 HA TRP A 147 3.310 -11.142 3.965 1.00 53.01 H new ATOM 0 HB2 TRP A 147 1.413 -12.466 3.205 1.00 14.14 H new ATOM 0 HB3 TRP A 147 1.355 -13.350 4.717 1.00 14.14 H new ATOM 0 HD1 TRP A 147 0.166 -12.169 6.786 1.00 41.23 H new ATOM 0 HE1 TRP A 147 -1.169 -9.995 7.113 1.00 51.11 H new ATOM 0 HE3 TRP A 147 1.154 -10.022 2.282 1.00 33.10 H new ATOM 0 HZ2 TRP A 147 -1.752 -7.705 5.596 1.00 13.21 H new ATOM 0 HZ3 TRP A 147 0.157 -7.846 1.775 1.00 12.51 H new ATOM 0 HH2 TRP A 147 -1.271 -6.694 3.410 1.00 45.43 H new ATOM 2298 N GLY A 148 3.260 -12.882 6.794 1.00 51.23 N ATOM 2299 CA GLY A 148 3.494 -12.791 8.223 1.00 71.11 C ATOM 2300 C GLY A 148 4.852 -12.230 8.522 1.00 2.41 C ATOM 2301 O GLY A 148 5.004 -11.421 9.422 1.00 11.15 O ATOM 0 H GLY A 148 3.059 -13.823 6.456 1.00 51.23 H new ATOM 0 HA2 GLY A 148 2.730 -12.161 8.679 1.00 71.11 H new ATOM 0 HA3 GLY A 148 3.401 -13.780 8.672 1.00 71.11 H new ATOM 2305 N ALA A 149 5.839 -12.656 7.746 1.00 52.43 N ATOM 2306 CA ALA A 149 7.195 -12.161 7.876 1.00 53.00 C ATOM 2307 C ALA A 149 7.223 -10.656 7.631 1.00 74.42 C ATOM 2308 O ALA A 149 7.801 -9.913 8.409 1.00 62.33 O ATOM 2309 CB ALA A 149 8.121 -12.881 6.903 1.00 44.04 C ATOM 0 H ALA A 149 5.719 -13.353 7.011 1.00 52.43 H new ATOM 0 HA ALA A 149 7.548 -12.358 8.888 1.00 53.00 H new ATOM 0 HB1 ALA A 149 9.135 -12.497 7.014 1.00 44.04 H new ATOM 0 HB2 ALA A 149 8.112 -13.950 7.116 1.00 44.04 H new ATOM 0 HB3 ALA A 149 7.779 -12.712 5.882 1.00 44.04 H new ATOM 2315 N PHE A 150 6.559 -10.218 6.553 1.00 14.21 N ATOM 2316 CA PHE A 150 6.462 -8.805 6.213 1.00 41.41 C ATOM 2317 C PHE A 150 5.820 -8.035 7.345 1.00 72.43 C ATOM 2318 O PHE A 150 6.318 -7.001 7.741 1.00 52.10 O ATOM 2319 CB PHE A 150 5.675 -8.618 4.913 1.00 5.42 C ATOM 2320 CG PHE A 150 5.514 -7.185 4.456 1.00 2.22 C ATOM 2321 CD1 PHE A 150 6.618 -6.430 4.127 1.00 50.34 C ATOM 2322 CD2 PHE A 150 4.250 -6.605 4.335 1.00 43.13 C ATOM 2323 CE1 PHE A 150 6.471 -5.126 3.690 1.00 62.33 C ATOM 2324 CE2 PHE A 150 4.103 -5.300 3.889 1.00 23.34 C ATOM 2325 CZ PHE A 150 5.217 -4.564 3.569 1.00 62.43 C ATOM 0 H PHE A 150 6.078 -10.836 5.899 1.00 14.21 H new ATOM 0 HA PHE A 150 7.468 -8.414 6.060 1.00 41.41 H new ATOM 0 HB2 PHE A 150 6.172 -9.181 4.123 1.00 5.42 H new ATOM 0 HB3 PHE A 150 4.685 -9.055 5.041 1.00 5.42 H new ATOM 0 HD1 PHE A 150 7.605 -6.859 4.211 1.00 50.34 H new ATOM 0 HD2 PHE A 150 3.374 -7.181 4.593 1.00 43.13 H new ATOM 0 HE1 PHE A 150 7.345 -4.543 3.441 1.00 62.33 H new ATOM 0 HE2 PHE A 150 3.119 -4.866 3.794 1.00 23.34 H new ATOM 0 HZ PHE A 150 5.112 -3.546 3.223 1.00 62.43 H new ATOM 2335 N ILE A 151 4.731 -8.565 7.866 1.00 43.22 N ATOM 2336 CA ILE A 151 4.031 -7.983 8.980 1.00 54.42 C ATOM 2337 C ILE A 151 4.920 -7.858 10.222 1.00 3.34 C ATOM 2338 O ILE A 151 4.884 -6.842 10.914 1.00 13.42 O ATOM 2339 CB ILE A 151 2.681 -8.735 9.228 1.00 72.12 C ATOM 2340 CG1 ILE A 151 1.524 -8.014 8.526 1.00 72.43 C ATOM 2341 CG2 ILE A 151 2.380 -8.978 10.688 1.00 75.43 C ATOM 2342 CD1 ILE A 151 1.734 -7.756 7.050 1.00 71.41 C ATOM 0 H ILE A 151 4.306 -9.425 7.518 1.00 43.22 H new ATOM 0 HA ILE A 151 3.770 -6.955 8.731 1.00 54.42 H new ATOM 0 HB ILE A 151 2.795 -9.726 8.788 1.00 72.12 H new ATOM 0 HG12 ILE A 151 0.617 -8.606 8.651 1.00 72.43 H new ATOM 0 HG13 ILE A 151 1.353 -7.060 9.026 1.00 72.43 H new ATOM 0 HG21 ILE A 151 1.429 -9.503 10.781 1.00 75.43 H new ATOM 0 HG22 ILE A 151 3.173 -9.583 11.127 1.00 75.43 H new ATOM 0 HG23 ILE A 151 2.320 -8.023 11.211 1.00 75.43 H new ATOM 0 HD11 ILE A 151 0.863 -7.243 6.643 1.00 71.41 H new ATOM 0 HD12 ILE A 151 2.619 -7.135 6.912 1.00 71.41 H new ATOM 0 HD13 ILE A 151 1.872 -8.704 6.531 1.00 71.41 H new ATOM 2354 N GLN A 152 5.734 -8.865 10.478 1.00 52.12 N ATOM 2355 CA GLN A 152 6.693 -8.790 11.576 1.00 71.11 C ATOM 2356 C GLN A 152 7.687 -7.645 11.335 1.00 75.43 C ATOM 2357 O GLN A 152 7.994 -6.877 12.237 1.00 32.41 O ATOM 2358 CB GLN A 152 7.439 -10.111 11.748 1.00 54.04 C ATOM 2359 CG GLN A 152 6.539 -11.280 12.097 1.00 23.01 C ATOM 2360 CD GLN A 152 7.288 -12.587 12.212 1.00 30.43 C ATOM 2361 OE1 GLN A 152 8.462 -12.623 12.584 1.00 25.13 O ATOM 2362 NE2 GLN A 152 6.629 -13.662 11.885 1.00 1.12 N ATOM 0 H GLN A 152 5.755 -9.737 9.950 1.00 52.12 H new ATOM 0 HA GLN A 152 6.140 -8.593 12.495 1.00 71.11 H new ATOM 0 HB2 GLN A 152 7.974 -10.339 10.826 1.00 54.04 H new ATOM 0 HB3 GLN A 152 8.189 -9.995 12.531 1.00 54.04 H new ATOM 0 HG2 GLN A 152 6.033 -11.073 13.040 1.00 23.01 H new ATOM 0 HG3 GLN A 152 5.766 -11.376 11.335 1.00 23.01 H new ATOM 0 HE21 GLN A 152 5.658 -13.592 11.582 1.00 1.12 H new ATOM 0 HE22 GLN A 152 7.084 -14.574 11.932 1.00 1.12 H new ATOM 2371 N LYS A 153 8.162 -7.527 10.107 1.00 63.22 N ATOM 2372 CA LYS A 153 9.104 -6.486 9.739 1.00 35.52 C ATOM 2373 C LYS A 153 8.452 -5.105 9.817 1.00 34.30 C ATOM 2374 O LYS A 153 8.986 -4.239 10.451 1.00 13.43 O ATOM 2375 CB LYS A 153 9.613 -6.765 8.341 1.00 51.35 C ATOM 2376 CG LYS A 153 10.263 -8.130 8.210 1.00 4.42 C ATOM 2377 CD LYS A 153 10.454 -8.522 6.762 1.00 12.44 C ATOM 2378 CE LYS A 153 11.435 -7.628 6.036 1.00 35.23 C ATOM 2379 NZ LYS A 153 11.708 -8.103 4.665 1.00 31.13 N ATOM 0 H LYS A 153 7.906 -8.148 9.340 1.00 63.22 H new ATOM 0 HA LYS A 153 9.940 -6.488 10.439 1.00 35.52 H new ATOM 0 HB2 LYS A 153 8.784 -6.694 7.637 1.00 51.35 H new ATOM 0 HB3 LYS A 153 10.334 -5.997 8.062 1.00 51.35 H new ATOM 0 HG2 LYS A 153 11.229 -8.123 8.716 1.00 4.42 H new ATOM 0 HG3 LYS A 153 9.646 -8.876 8.711 1.00 4.42 H new ATOM 0 HD2 LYS A 153 10.804 -9.553 6.713 1.00 12.44 H new ATOM 0 HD3 LYS A 153 9.492 -8.488 6.251 1.00 12.44 H new ATOM 0 HE2 LYS A 153 11.039 -6.613 5.996 1.00 35.23 H new ATOM 0 HE3 LYS A 153 12.369 -7.584 6.597 1.00 35.23 H new ATOM 0 HZ1 LYS A 153 12.156 -7.341 4.116 1.00 31.13 H new ATOM 0 HZ2 LYS A 153 12.346 -8.924 4.702 1.00 31.13 H new ATOM 0 HZ3 LYS A 153 10.815 -8.379 4.209 1.00 31.13 H new ATOM 2393 N VAL A 154 7.276 -4.939 9.218 1.00 21.31 N ATOM 2394 CA VAL A 154 6.561 -3.650 9.208 1.00 4.34 C ATOM 2395 C VAL A 154 6.288 -3.133 10.622 1.00 71.41 C ATOM 2396 O VAL A 154 6.394 -1.932 10.882 1.00 64.33 O ATOM 2397 CB VAL A 154 5.205 -3.788 8.486 1.00 15.25 C ATOM 2398 CG1 VAL A 154 4.419 -2.518 8.575 1.00 42.44 C ATOM 2399 CG2 VAL A 154 5.393 -4.163 7.056 1.00 34.13 C ATOM 0 H VAL A 154 6.787 -5.686 8.725 1.00 21.31 H new ATOM 0 HA VAL A 154 7.207 -2.944 8.686 1.00 4.34 H new ATOM 0 HB VAL A 154 4.650 -4.582 8.986 1.00 15.25 H new ATOM 0 HG11 VAL A 154 3.467 -2.642 8.058 1.00 42.44 H new ATOM 0 HG12 VAL A 154 4.235 -2.277 9.622 1.00 42.44 H new ATOM 0 HG13 VAL A 154 4.982 -1.709 8.110 1.00 42.44 H new ATOM 0 HG21 VAL A 154 4.420 -4.253 6.573 1.00 34.13 H new ATOM 0 HG22 VAL A 154 5.979 -3.394 6.552 1.00 34.13 H new ATOM 0 HG23 VAL A 154 5.918 -5.116 6.996 1.00 34.13 H new ATOM 2409 N LYS A 155 5.971 -4.050 11.514 1.00 54.20 N ATOM 2410 CA LYS A 155 5.619 -3.768 12.864 1.00 73.13 C ATOM 2411 C LYS A 155 6.660 -2.860 13.542 1.00 24.00 C ATOM 2412 O LYS A 155 6.310 -1.862 14.188 1.00 35.33 O ATOM 2413 CB LYS A 155 5.551 -5.108 13.542 1.00 64.01 C ATOM 2414 CG LYS A 155 5.011 -5.120 14.911 1.00 1.44 C ATOM 2415 CD LYS A 155 4.962 -6.533 15.396 1.00 34.04 C ATOM 2416 CE LYS A 155 4.331 -6.598 16.728 1.00 5.21 C ATOM 2417 NZ LYS A 155 4.273 -7.980 17.248 1.00 21.43 N ATOM 0 H LYS A 155 5.955 -5.046 11.295 1.00 54.20 H new ATOM 0 HA LYS A 155 4.673 -3.230 12.925 1.00 73.13 H new ATOM 0 HB2 LYS A 155 4.942 -5.771 12.928 1.00 64.01 H new ATOM 0 HB3 LYS A 155 6.556 -5.530 13.567 1.00 64.01 H new ATOM 0 HG2 LYS A 155 5.636 -4.516 15.569 1.00 1.44 H new ATOM 0 HG3 LYS A 155 4.014 -4.680 14.927 1.00 1.44 H new ATOM 0 HD2 LYS A 155 4.402 -7.147 14.691 1.00 34.04 H new ATOM 0 HD3 LYS A 155 5.971 -6.943 15.444 1.00 34.04 H new ATOM 0 HE2 LYS A 155 4.889 -5.972 17.424 1.00 5.21 H new ATOM 0 HE3 LYS A 155 3.322 -6.190 16.671 1.00 5.21 H new ATOM 0 HZ1 LYS A 155 3.823 -7.980 18.185 1.00 21.43 H new ATOM 0 HZ2 LYS A 155 3.719 -8.573 16.598 1.00 21.43 H new ATOM 0 HZ3 LYS A 155 5.237 -8.362 17.327 1.00 21.43 H new ATOM 2431 N ASN A 156 7.920 -3.197 13.377 1.00 13.12 N ATOM 2432 CA ASN A 156 8.998 -2.418 13.973 1.00 31.35 C ATOM 2433 C ASN A 156 9.787 -1.658 12.918 1.00 13.05 C ATOM 2434 O ASN A 156 10.067 -0.463 13.055 1.00 14.31 O ATOM 2435 CB ASN A 156 9.928 -3.348 14.705 1.00 61.20 C ATOM 2436 CG ASN A 156 11.073 -2.650 15.389 1.00 63.32 C ATOM 2437 OD1 ASN A 156 12.129 -2.454 14.800 1.00 23.04 O ATOM 2438 ND2 ASN A 156 10.877 -2.306 16.626 1.00 42.04 N ATOM 0 H ASN A 156 8.230 -4.004 12.836 1.00 13.12 H new ATOM 0 HA ASN A 156 8.557 -1.693 14.657 1.00 31.35 H new ATOM 0 HB2 ASN A 156 9.358 -3.905 15.449 1.00 61.20 H new ATOM 0 HB3 ASN A 156 10.328 -4.076 13.999 1.00 61.20 H new ATOM 0 HD21 ASN A 156 11.622 -1.850 17.153 1.00 42.04 H new ATOM 0 HD22 ASN A 156 9.978 -2.492 17.071 1.00 42.04 H new ATOM 2445 N GLY A 157 10.096 -2.355 11.866 1.00 1.51 N ATOM 2446 CA GLY A 157 10.958 -1.876 10.831 1.00 31.23 C ATOM 2447 C GLY A 157 11.739 -3.021 10.259 1.00 53.11 C ATOM 2448 O GLY A 157 11.908 -3.124 9.053 1.00 72.25 O ATOM 0 H GLY A 157 9.745 -3.298 11.701 1.00 1.51 H new ATOM 0 HA2 GLY A 157 10.371 -1.395 10.048 1.00 31.23 H new ATOM 0 HA3 GLY A 157 11.637 -1.122 11.229 1.00 31.23 H new