USER MOD reduce.3.24.130724 H: found=0, std=0, add=1475, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1473 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 190 ASN : amide:sc= 0.75 K(o=2,f=-5.1!) USER MOD Set 1.2: A 191 THR OG1 : rot -55:sc= 1.23 USER MOD Set 2.1: A 107 HIS : no HD1:sc= -0.122 X(o=-0.11,f=-0.11) USER MOD Set 2.2: A 163 ASN : amide:sc= 0.0125 K(o=-0.11,f=-5.6!) USER MOD Set 3.1: A 125 CYS SG : rot 150:sc= 0.01 USER MOD Set 3.2: A 126 THR OG1 : rot 180:sc= 0.471 USER MOD Set 4.1: A 98 GLN : amide:sc= -0.363 X(o=-2.6,f=-2.5) USER MOD Set 4.2: A 101 MET CE :methyl 143:sc= -2.19 (180deg=-3.1!) USER MOD Set 5.1: A 74 TYR OH : rot -161:sc= 1.21 USER MOD Set 5.2: A 102 HIS : no HD1:sc= -0.586 X(o=1.4,f=0.94) USER MOD Set 5.3: A 103 GLN : amide:sc= 1.04 K(o=1.4,f=-0.78) USER MOD Set 5.4: A 104 HIS : no HD1:sc= -0.229 X(o=1.4,f=1.5) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 ASN : amide:sc= -1.68 K(o=-1.7,f=-3.8!) USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 18 SER OG : rot 173:sc= 0.0812 USER MOD Single : A 21 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 22 MET CE :methyl -179:sc= -0.452 (180deg=-0.47) USER MOD Single : A 26 THR OG1 : rot 180:sc= 0.00874 USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 SER OG : rot 150:sc= -0.0777 USER MOD Single : A 42 SER OG : rot -162:sc= -0.0674 USER MOD Single : A 45 ASN : amide:sc= -1.22 X(o=-1.2,f=-1.2) USER MOD Single : A 49 ASN : amide:sc= -0.339 K(o=-0.34,f=-8.5!) USER MOD Single : A 52 SER OG : rot -37:sc= 0.0925 USER MOD Single : A 54 LYS NZ :NH3+ -152:sc= 0.633 (180deg=0.38) USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 59 HIS : no HE2:sc= 0.237 K(o=0.24,f=-0.84) USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 73 SER OG : rot 180:sc= 0.00327 USER MOD Single : A 77 THR OG1 : rot 69:sc= 0.816 USER MOD Single : A 82 LYS NZ :NH3+ 172:sc= 0.134 (180deg=0.106) USER MOD Single : A 83 LYS NZ :NH3+ -115:sc= 0.111 (180deg=-0.189) USER MOD Single : A 90 GLN : amide:sc= -0.253 X(o=-0.25,f=0) USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 92 GLN : amide:sc= -0.172 X(o=-0.17,f=0) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 ASN : amide:sc= 0.205 K(o=0.2,f=-10!) USER MOD Single : A 100 TYR OH : rot 173:sc= 1.22 USER MOD Single : A 105 SER OG : rot 99:sc= 0.178 USER MOD Single : A 113 SER OG : rot 24:sc= 0.0105 USER MOD Single : A 114 SER OG : rot -155:sc= 1.46 USER MOD Single : A 118 MET CE :methyl -128:sc= -0.5 (180deg=-6.3!) USER MOD Single : A 119 SER OG : rot 180:sc= 0.0922 USER MOD Single : A 120 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.029) USER MOD Single : A 121 TYR OH : rot 180:sc=-0.00233 USER MOD Single : A 133 ASN : amide:sc= -0.509 K(o=-0.51,f=-9.7!) USER MOD Single : A 141 TYR OH : rot 180:sc= 0 USER MOD Single : A 144 TYR OH : rot 30:sc= 0 USER MOD Single : A 151 ASN : amide:sc= 0.973 K(o=0.97,f=0) USER MOD Single : A 153 GLN : amide:sc= -0.838 K(o=-0.84,f=-2.9!) USER MOD Single : A 157 THR OG1 : rot 180:sc= 0 USER MOD Single : A 159 HIS : no HD1:sc=-0.00893 X(o=-0.0089,f=-0.12) USER MOD Single : A 167 MET CE :methyl 170:sc= 0 (180deg=-0.0442) USER MOD Single : A 170 TYR OH : rot -173:sc= 0.18 USER MOD Single : A 171 GLN : amide:sc= 0 X(o=0,f=-0.28) USER MOD Single : A 172 THR OG1 : rot 92:sc= 0.298 USER MOD Single : A 178 ASN : amide:sc= -0.0167 X(o=-0.017,f=0) USER MOD Single : A 180 GLN : amide:sc= 0 X(o=0,f=-0.088) USER MOD Single : A 182 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 184 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 185 ASN : amide:sc= -0.029 X(o=-0.029,f=-0.0036) USER MOD Single : A 189 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 39 N THR A 4 -10.021 -20.644 -4.050 1.00 72.45 N ATOM 40 CA THR A 4 -8.903 -21.420 -4.593 1.00 50.21 C ATOM 41 C THR A 4 -7.970 -20.523 -5.438 1.00 11.20 C ATOM 42 O THR A 4 -7.827 -20.664 -6.650 1.00 61.02 O ATOM 43 CB THR A 4 -9.484 -22.676 -5.279 1.00 70.13 C ATOM 44 OG1 THR A 4 -8.472 -23.604 -5.613 1.00 42.51 O ATOM 45 CG2 THR A 4 -10.339 -22.383 -6.517 1.00 41.33 C ATOM 0 HA THR A 4 -8.233 -21.791 -3.817 1.00 50.21 H new ATOM 0 HB THR A 4 -10.150 -23.109 -4.532 1.00 70.13 H new ATOM 0 HG1 THR A 4 -8.875 -24.387 -6.044 1.00 42.51 H new ATOM 0 HG21 THR A 4 -10.706 -23.320 -6.936 1.00 41.33 H new ATOM 0 HG22 THR A 4 -11.184 -21.755 -6.235 1.00 41.33 H new ATOM 0 HG23 THR A 4 -9.735 -21.865 -7.262 1.00 41.33 H new ATOM 53 N VAL A 5 -7.345 -19.546 -4.786 1.00 43.55 N ATOM 54 CA VAL A 5 -6.559 -18.484 -5.393 1.00 10.31 C ATOM 55 C VAL A 5 -5.087 -18.760 -5.112 1.00 62.21 C ATOM 56 O VAL A 5 -4.682 -18.898 -3.958 1.00 61.15 O ATOM 57 CB VAL A 5 -6.992 -17.156 -4.744 1.00 2.31 C ATOM 58 CG1 VAL A 5 -6.163 -15.964 -5.230 1.00 44.41 C ATOM 59 CG2 VAL A 5 -8.481 -16.850 -4.956 1.00 4.53 C ATOM 0 H VAL A 5 -7.377 -19.473 -3.769 1.00 43.55 H new ATOM 0 HA VAL A 5 -6.711 -18.432 -6.471 1.00 10.31 H new ATOM 0 HB VAL A 5 -6.813 -17.297 -3.678 1.00 2.31 H new ATOM 0 HG11 VAL A 5 -6.511 -15.055 -4.740 1.00 44.41 H new ATOM 0 HG12 VAL A 5 -5.113 -16.128 -4.987 1.00 44.41 H new ATOM 0 HG13 VAL A 5 -6.274 -15.860 -6.309 1.00 44.41 H new ATOM 0 HG21 VAL A 5 -8.730 -15.903 -4.477 1.00 4.53 H new ATOM 0 HG22 VAL A 5 -8.690 -16.783 -6.024 1.00 4.53 H new ATOM 0 HG23 VAL A 5 -9.082 -17.647 -4.518 1.00 4.53 H new ATOM 69 N LYS A 6 -4.250 -18.733 -6.150 1.00 10.43 N ATOM 70 CA LYS A 6 -2.791 -18.753 -6.012 1.00 62.33 C ATOM 71 C LYS A 6 -2.114 -17.744 -6.940 1.00 63.34 C ATOM 72 O LYS A 6 -0.894 -17.776 -7.113 1.00 33.00 O ATOM 73 CB LYS A 6 -2.299 -20.180 -6.287 1.00 4.52 C ATOM 74 CG LYS A 6 -2.588 -21.211 -5.177 1.00 70.35 C ATOM 75 CD LYS A 6 -1.684 -21.143 -3.930 1.00 74.25 C ATOM 76 CE LYS A 6 -2.338 -20.379 -2.769 1.00 73.44 C ATOM 77 NZ LYS A 6 -1.621 -20.566 -1.486 1.00 25.21 N ATOM 0 H LYS A 6 -4.567 -18.696 -7.119 1.00 10.43 H new ATOM 0 HA LYS A 6 -2.524 -18.457 -4.997 1.00 62.33 H new ATOM 0 HB2 LYS A 6 -2.757 -20.531 -7.212 1.00 4.52 H new ATOM 0 HB3 LYS A 6 -1.223 -20.148 -6.456 1.00 4.52 H new ATOM 0 HG2 LYS A 6 -3.623 -21.088 -4.857 1.00 70.35 H new ATOM 0 HG3 LYS A 6 -2.504 -22.209 -5.607 1.00 70.35 H new ATOM 0 HD2 LYS A 6 -1.443 -22.155 -3.605 1.00 74.25 H new ATOM 0 HD3 LYS A 6 -0.743 -20.660 -4.194 1.00 74.25 H new ATOM 0 HE2 LYS A 6 -2.370 -19.317 -3.011 1.00 73.44 H new ATOM 0 HE3 LYS A 6 -3.370 -20.712 -2.656 1.00 73.44 H new ATOM 0 HZ1 LYS A 6 -2.104 -20.030 -0.737 1.00 25.21 H new ATOM 0 HZ2 LYS A 6 -1.612 -21.576 -1.237 1.00 25.21 H new ATOM 0 HZ3 LYS A 6 -0.643 -20.224 -1.582 1.00 25.21 H new ATOM 91 N ASN A 7 -2.887 -16.869 -7.579 1.00 50.41 N ATOM 92 CA ASN A 7 -2.415 -16.026 -8.675 1.00 45.14 C ATOM 93 C ASN A 7 -3.245 -14.774 -8.765 1.00 43.22 C ATOM 94 O ASN A 7 -4.417 -14.761 -8.399 1.00 31.22 O ATOM 95 CB ASN A 7 -2.495 -16.737 -10.039 1.00 53.21 C ATOM 96 CG ASN A 7 -3.840 -17.432 -10.237 1.00 42.54 C ATOM 97 OD1 ASN A 7 -4.201 -18.341 -9.498 1.00 11.22 O ATOM 98 ND2 ASN A 7 -4.654 -16.998 -11.178 1.00 24.41 N ATOM 0 H ASN A 7 -3.870 -16.724 -7.348 1.00 50.41 H new ATOM 0 HA ASN A 7 -1.373 -15.794 -8.455 1.00 45.14 H new ATOM 0 HB2 ASN A 7 -2.340 -16.011 -10.837 1.00 53.21 H new ATOM 0 HB3 ASN A 7 -1.692 -17.470 -10.115 1.00 53.21 H new ATOM 0 HD21 ASN A 7 -5.577 -17.418 -11.287 1.00 24.41 H new ATOM 0 HD22 ASN A 7 -4.361 -16.242 -11.797 1.00 24.41 H new ATOM 105 N LYS A 8 -2.627 -13.748 -9.348 1.00 72.01 N ATOM 106 CA LYS A 8 -3.179 -12.419 -9.544 1.00 32.32 C ATOM 107 C LYS A 8 -4.605 -12.446 -10.060 1.00 33.24 C ATOM 108 O LYS A 8 -5.437 -11.735 -9.513 1.00 25.23 O ATOM 109 CB LYS A 8 -2.233 -11.662 -10.488 1.00 2.24 C ATOM 110 CG LYS A 8 -2.870 -10.484 -11.239 1.00 62.12 C ATOM 111 CD LYS A 8 -1.886 -9.589 -12.004 1.00 54.32 C ATOM 112 CE LYS A 8 -2.385 -9.240 -13.416 1.00 12.44 C ATOM 113 NZ LYS A 8 -1.730 -8.032 -13.967 1.00 13.33 N ATOM 0 H LYS A 8 -1.678 -13.831 -9.714 1.00 72.01 H new ATOM 0 HA LYS A 8 -3.244 -11.904 -8.585 1.00 32.32 H new ATOM 0 HB2 LYS A 8 -1.388 -11.290 -9.909 1.00 2.24 H new ATOM 0 HB3 LYS A 8 -1.834 -12.366 -11.218 1.00 2.24 H new ATOM 0 HG2 LYS A 8 -3.603 -10.877 -11.944 1.00 62.12 H new ATOM 0 HG3 LYS A 8 -3.415 -9.869 -10.523 1.00 62.12 H new ATOM 0 HD2 LYS A 8 -1.723 -8.669 -11.442 1.00 54.32 H new ATOM 0 HD3 LYS A 8 -0.922 -10.093 -12.077 1.00 54.32 H new ATOM 0 HE2 LYS A 8 -2.202 -10.084 -14.081 1.00 12.44 H new ATOM 0 HE3 LYS A 8 -3.463 -9.084 -13.388 1.00 12.44 H new ATOM 0 HZ1 LYS A 8 -2.101 -7.840 -14.919 1.00 13.33 H new ATOM 0 HZ2 LYS A 8 -1.925 -7.219 -13.349 1.00 13.33 H new ATOM 0 HZ3 LYS A 8 -0.703 -8.188 -14.020 1.00 13.33 H new ATOM 127 N GLN A 9 -4.873 -13.227 -11.109 1.00 51.34 N ATOM 128 CA GLN A 9 -6.164 -13.233 -11.779 1.00 52.52 C ATOM 129 C GLN A 9 -7.272 -13.507 -10.759 1.00 71.35 C ATOM 130 O GLN A 9 -8.210 -12.731 -10.627 1.00 2.20 O ATOM 131 CB GLN A 9 -6.133 -14.292 -12.899 1.00 14.20 C ATOM 132 CG GLN A 9 -6.872 -13.860 -14.174 1.00 12.21 C ATOM 133 CD GLN A 9 -5.892 -13.706 -15.334 1.00 53.32 C ATOM 134 OE1 GLN A 9 -5.746 -14.594 -16.170 1.00 33.12 O ATOM 135 NE2 GLN A 9 -5.147 -12.617 -15.401 1.00 51.21 N ATOM 0 H GLN A 9 -4.195 -13.873 -11.514 1.00 51.34 H new ATOM 0 HA GLN A 9 -6.371 -12.263 -12.230 1.00 52.52 H new ATOM 0 HB2 GLN A 9 -5.096 -14.515 -13.148 1.00 14.20 H new ATOM 0 HB3 GLN A 9 -6.577 -15.215 -12.527 1.00 14.20 H new ATOM 0 HG2 GLN A 9 -7.633 -14.598 -14.428 1.00 12.21 H new ATOM 0 HG3 GLN A 9 -7.389 -12.917 -14.000 1.00 12.21 H new ATOM 0 HE21 GLN A 9 -5.264 -11.876 -14.710 1.00 51.21 H new ATOM 0 HE22 GLN A 9 -4.455 -12.517 -16.144 1.00 51.21 H new ATOM 144 N GLU A 10 -7.095 -14.588 -10.003 1.00 24.34 N ATOM 145 CA GLU A 10 -8.040 -15.119 -9.030 1.00 72.24 C ATOM 146 C GLU A 10 -8.258 -14.125 -7.869 1.00 34.23 C ATOM 147 O GLU A 10 -9.338 -14.094 -7.278 1.00 32.23 O ATOM 148 CB GLU A 10 -7.496 -16.509 -8.615 1.00 4.32 C ATOM 149 CG GLU A 10 -7.521 -17.531 -9.763 1.00 53.35 C ATOM 150 CD GLU A 10 -8.563 -18.638 -9.678 1.00 12.41 C ATOM 151 OE1 GLU A 10 -9.768 -18.370 -9.821 1.00 5.30 O ATOM 152 OE2 GLU A 10 -8.135 -19.818 -9.638 1.00 63.15 O ATOM 0 H GLU A 10 -6.242 -15.145 -10.057 1.00 24.34 H new ATOM 0 HA GLU A 10 -9.041 -15.249 -9.440 1.00 72.24 H new ATOM 0 HB2 GLU A 10 -6.473 -16.400 -8.255 1.00 4.32 H new ATOM 0 HB3 GLU A 10 -8.088 -16.891 -7.783 1.00 4.32 H new ATOM 0 HG2 GLU A 10 -7.677 -16.989 -10.696 1.00 53.35 H new ATOM 0 HG3 GLU A 10 -6.537 -17.996 -9.825 1.00 53.35 H new ATOM 159 N ILE A 11 -7.268 -13.266 -7.587 1.00 2.43 N ATOM 160 CA ILE A 11 -7.343 -12.183 -6.599 1.00 65.15 C ATOM 161 C ILE A 11 -8.111 -10.977 -7.158 1.00 73.22 C ATOM 162 O ILE A 11 -8.958 -10.390 -6.481 1.00 3.44 O ATOM 163 CB ILE A 11 -5.927 -11.735 -6.155 1.00 22.44 C ATOM 164 CG1 ILE A 11 -5.023 -12.882 -5.675 1.00 50.14 C ATOM 165 CG2 ILE A 11 -6.036 -10.705 -5.019 1.00 10.44 C ATOM 166 CD1 ILE A 11 -3.531 -12.532 -5.633 1.00 12.11 C ATOM 0 H ILE A 11 -6.364 -13.308 -8.057 1.00 2.43 H new ATOM 0 HA ILE A 11 -7.879 -12.572 -5.733 1.00 65.15 H new ATOM 0 HB ILE A 11 -5.465 -11.310 -7.046 1.00 22.44 H new ATOM 0 HG12 ILE A 11 -5.341 -13.187 -4.678 1.00 50.14 H new ATOM 0 HG13 ILE A 11 -5.165 -13.740 -6.332 1.00 50.14 H new ATOM 0 HG21 ILE A 11 -5.037 -10.395 -4.712 1.00 10.44 H new ATOM 0 HG22 ILE A 11 -6.595 -9.836 -5.368 1.00 10.44 H new ATOM 0 HG23 ILE A 11 -6.554 -11.153 -4.171 1.00 10.44 H new ATOM 0 HD11 ILE A 11 -2.964 -13.395 -5.284 1.00 12.11 H new ATOM 0 HD12 ILE A 11 -3.194 -12.257 -6.632 1.00 12.11 H new ATOM 0 HD13 ILE A 11 -3.373 -11.695 -4.953 1.00 12.11 H new ATOM 178 N LEU A 12 -7.764 -10.546 -8.371 1.00 33.01 N ATOM 179 CA LEU A 12 -8.308 -9.349 -9.003 1.00 54.34 C ATOM 180 C LEU A 12 -9.802 -9.487 -9.268 1.00 3.34 C ATOM 181 O LEU A 12 -10.525 -8.502 -9.122 1.00 30.24 O ATOM 182 CB LEU A 12 -7.543 -9.060 -10.304 1.00 24.10 C ATOM 183 CG LEU A 12 -6.442 -7.990 -10.177 1.00 3.14 C ATOM 184 CD1 LEU A 12 -5.510 -8.174 -8.974 1.00 25.21 C ATOM 185 CD2 LEU A 12 -5.574 -8.000 -11.440 1.00 4.41 C ATOM 0 H LEU A 12 -7.081 -11.032 -8.953 1.00 33.01 H new ATOM 0 HA LEU A 12 -8.180 -8.509 -8.320 1.00 54.34 H new ATOM 0 HB2 LEU A 12 -7.091 -9.987 -10.658 1.00 24.10 H new ATOM 0 HB3 LEU A 12 -8.255 -8.741 -11.065 1.00 24.10 H new ATOM 0 HG LEU A 12 -6.970 -7.047 -10.037 1.00 3.14 H new ATOM 0 HD11 LEU A 12 -4.767 -7.377 -8.964 1.00 25.21 H new ATOM 0 HD12 LEU A 12 -6.093 -8.139 -8.054 1.00 25.21 H new ATOM 0 HD13 LEU A 12 -5.007 -9.138 -9.048 1.00 25.21 H new ATOM 0 HD21 LEU A 12 -4.794 -7.243 -11.352 1.00 4.41 H new ATOM 0 HD22 LEU A 12 -5.115 -8.982 -11.558 1.00 4.41 H new ATOM 0 HD23 LEU A 12 -6.194 -7.782 -12.309 1.00 4.41 H new ATOM 197 N GLU A 13 -10.273 -10.695 -9.577 1.00 32.22 N ATOM 198 CA GLU A 13 -11.694 -10.953 -9.696 1.00 31.12 C ATOM 199 C GLU A 13 -12.412 -10.651 -8.376 1.00 63.24 C ATOM 200 O GLU A 13 -13.532 -10.135 -8.395 1.00 31.43 O ATOM 201 CB GLU A 13 -11.913 -12.406 -10.146 1.00 24.21 C ATOM 202 CG GLU A 13 -11.542 -12.591 -11.623 1.00 30.12 C ATOM 203 CD GLU A 13 -12.046 -13.881 -12.278 1.00 71.43 C ATOM 204 OE1 GLU A 13 -12.237 -14.927 -11.612 1.00 22.30 O ATOM 205 OE2 GLU A 13 -12.189 -13.885 -13.522 1.00 24.24 O ATOM 0 H GLU A 13 -9.682 -11.509 -9.749 1.00 32.22 H new ATOM 0 HA GLU A 13 -12.122 -10.292 -10.450 1.00 31.12 H new ATOM 0 HB2 GLU A 13 -11.311 -13.075 -9.531 1.00 24.21 H new ATOM 0 HB3 GLU A 13 -12.956 -12.684 -9.993 1.00 24.21 H new ATOM 0 HG2 GLU A 13 -11.932 -11.743 -12.186 1.00 30.12 H new ATOM 0 HG3 GLU A 13 -10.456 -12.560 -11.712 1.00 30.12 H new ATOM 212 N ALA A 14 -11.772 -10.926 -7.230 1.00 44.44 N ATOM 213 CA ALA A 14 -12.430 -10.826 -5.936 1.00 65.53 C ATOM 214 C ALA A 14 -12.515 -9.365 -5.522 1.00 61.25 C ATOM 215 O ALA A 14 -13.503 -8.957 -4.916 1.00 24.42 O ATOM 216 CB ALA A 14 -11.642 -11.623 -4.894 1.00 41.04 C ATOM 0 H ALA A 14 -10.796 -11.220 -7.182 1.00 44.44 H new ATOM 0 HA ALA A 14 -13.437 -11.236 -6.007 1.00 65.53 H new ATOM 0 HB1 ALA A 14 -12.137 -11.546 -3.926 1.00 41.04 H new ATOM 0 HB2 ALA A 14 -11.595 -12.669 -5.195 1.00 41.04 H new ATOM 0 HB3 ALA A 14 -10.631 -11.222 -4.817 1.00 41.04 H new ATOM 222 N PHE A 15 -11.478 -8.590 -5.862 1.00 12.13 N ATOM 223 CA PHE A 15 -11.442 -7.151 -5.667 1.00 4.01 C ATOM 224 C PHE A 15 -12.703 -6.518 -6.244 1.00 24.10 C ATOM 225 O PHE A 15 -13.406 -5.799 -5.539 1.00 52.14 O ATOM 226 CB PHE A 15 -10.190 -6.570 -6.336 1.00 1.42 C ATOM 227 CG PHE A 15 -10.224 -5.065 -6.456 1.00 11.53 C ATOM 228 CD1 PHE A 15 -9.920 -4.257 -5.347 1.00 65.22 C ATOM 229 CD2 PHE A 15 -10.701 -4.484 -7.645 1.00 50.34 C ATOM 230 CE1 PHE A 15 -10.165 -2.876 -5.415 1.00 51.23 C ATOM 231 CE2 PHE A 15 -10.967 -3.108 -7.704 1.00 10.11 C ATOM 232 CZ PHE A 15 -10.728 -2.315 -6.570 1.00 34.30 C ATOM 0 H PHE A 15 -10.629 -8.961 -6.288 1.00 12.13 H new ATOM 0 HA PHE A 15 -11.402 -6.930 -4.600 1.00 4.01 H new ATOM 0 HB2 PHE A 15 -9.310 -6.863 -5.762 1.00 1.42 H new ATOM 0 HB3 PHE A 15 -10.082 -7.005 -7.330 1.00 1.42 H new ATOM 0 HD1 PHE A 15 -9.502 -4.694 -4.452 1.00 65.22 H new ATOM 0 HD2 PHE A 15 -10.863 -5.100 -8.517 1.00 50.34 H new ATOM 0 HE1 PHE A 15 -9.919 -2.244 -4.575 1.00 51.23 H new ATOM 0 HE2 PHE A 15 -11.351 -2.664 -8.611 1.00 10.11 H new ATOM 0 HZ PHE A 15 -10.980 -1.265 -6.588 1.00 34.30 H new ATOM 242 N ARG A 16 -12.961 -6.744 -7.536 1.00 13.40 N ATOM 243 CA ARG A 16 -14.086 -6.087 -8.198 1.00 45.11 C ATOM 244 C ARG A 16 -15.420 -6.662 -7.748 1.00 45.35 C ATOM 245 O ARG A 16 -16.408 -5.930 -7.743 1.00 65.14 O ATOM 246 CB ARG A 16 -13.930 -6.136 -9.714 1.00 10.40 C ATOM 247 CG ARG A 16 -14.956 -5.211 -10.392 1.00 34.52 C ATOM 248 CD ARG A 16 -14.383 -4.361 -11.529 1.00 1.41 C ATOM 249 NE ARG A 16 -14.295 -5.069 -12.818 1.00 22.21 N ATOM 250 CZ ARG A 16 -13.953 -4.514 -13.991 1.00 41.15 C ATOM 251 NH1 ARG A 16 -13.532 -3.253 -14.048 1.00 64.44 N ATOM 252 NH2 ARG A 16 -14.052 -5.229 -15.103 1.00 54.31 N ATOM 0 H ARG A 16 -12.416 -7.366 -8.133 1.00 13.40 H new ATOM 0 HA ARG A 16 -14.080 -5.039 -7.899 1.00 45.11 H new ATOM 0 HB2 ARG A 16 -12.920 -5.834 -9.991 1.00 10.40 H new ATOM 0 HB3 ARG A 16 -14.065 -7.159 -10.066 1.00 10.40 H new ATOM 0 HG2 ARG A 16 -15.772 -5.818 -10.784 1.00 34.52 H new ATOM 0 HG3 ARG A 16 -15.384 -4.549 -9.639 1.00 34.52 H new ATOM 0 HD2 ARG A 16 -15.004 -3.474 -11.655 1.00 1.41 H new ATOM 0 HD3 ARG A 16 -13.388 -4.017 -11.246 1.00 1.41 H new ATOM 0 HE ARG A 16 -14.512 -6.066 -12.819 1.00 22.21 H new ATOM 0 HH11 ARG A 16 -13.467 -2.698 -13.195 1.00 64.44 H new ATOM 0 HH12 ARG A 16 -13.275 -2.841 -14.945 1.00 64.44 H new ATOM 0 HH21 ARG A 16 -14.386 -6.192 -15.062 1.00 54.31 H new ATOM 0 HH22 ARG A 16 -13.794 -4.816 -15.999 1.00 54.31 H new ATOM 266 N GLU A 17 -15.462 -7.935 -7.358 1.00 2.40 N ATOM 267 CA GLU A 17 -16.661 -8.536 -6.793 1.00 74.43 C ATOM 268 C GLU A 17 -17.096 -7.828 -5.504 1.00 4.10 C ATOM 269 O GLU A 17 -18.279 -7.878 -5.165 1.00 21.34 O ATOM 270 CB GLU A 17 -16.394 -10.022 -6.513 1.00 70.25 C ATOM 271 CG GLU A 17 -16.778 -10.914 -7.697 1.00 24.34 C ATOM 272 CD GLU A 17 -18.297 -11.108 -7.770 1.00 41.04 C ATOM 273 OE1 GLU A 17 -18.821 -11.919 -6.982 1.00 1.01 O ATOM 274 OE2 GLU A 17 -18.983 -10.466 -8.608 1.00 12.44 O ATOM 0 H GLU A 17 -14.669 -8.573 -7.426 1.00 2.40 H new ATOM 0 HA GLU A 17 -17.472 -8.430 -7.514 1.00 74.43 H new ATOM 0 HB2 GLU A 17 -15.338 -10.162 -6.283 1.00 70.25 H new ATOM 0 HB3 GLU A 17 -16.956 -10.330 -5.631 1.00 70.25 H new ATOM 0 HG2 GLU A 17 -16.420 -10.467 -8.624 1.00 24.34 H new ATOM 0 HG3 GLU A 17 -16.288 -11.883 -7.600 1.00 24.34 H new ATOM 281 N SER A 18 -16.177 -7.160 -4.796 1.00 72.52 N ATOM 282 CA SER A 18 -16.506 -6.393 -3.616 1.00 25.44 C ATOM 283 C SER A 18 -16.904 -4.977 -4.025 1.00 62.45 C ATOM 284 O SER A 18 -16.162 -4.302 -4.747 1.00 12.22 O ATOM 285 CB SER A 18 -15.308 -6.366 -2.677 1.00 41.42 C ATOM 286 OG SER A 18 -15.666 -5.625 -1.520 1.00 64.25 O ATOM 0 H SER A 18 -15.186 -7.144 -5.036 1.00 72.52 H new ATOM 0 HA SER A 18 -17.345 -6.854 -3.096 1.00 25.44 H new ATOM 0 HB2 SER A 18 -15.017 -7.380 -2.404 1.00 41.42 H new ATOM 0 HB3 SER A 18 -14.449 -5.910 -3.170 1.00 41.42 H new ATOM 0 HG SER A 18 -14.951 -5.695 -0.853 1.00 64.25 H new ATOM 292 N PRO A 19 -18.045 -4.486 -3.522 1.00 61.23 N ATOM 293 CA PRO A 19 -18.461 -3.114 -3.730 1.00 14.03 C ATOM 294 C PRO A 19 -17.555 -2.134 -2.996 1.00 1.10 C ATOM 295 O PRO A 19 -17.253 -1.064 -3.518 1.00 72.33 O ATOM 296 CB PRO A 19 -19.884 -3.060 -3.165 1.00 44.32 C ATOM 297 CG PRO A 19 -19.918 -4.160 -2.103 1.00 42.34 C ATOM 298 CD PRO A 19 -18.970 -5.202 -2.653 1.00 42.21 C ATOM 0 HA PRO A 19 -18.411 -2.830 -4.781 1.00 14.03 H new ATOM 0 HB2 PRO A 19 -20.102 -2.084 -2.732 1.00 44.32 H new ATOM 0 HB3 PRO A 19 -20.627 -3.237 -3.943 1.00 44.32 H new ATOM 0 HG2 PRO A 19 -19.591 -3.791 -1.131 1.00 42.34 H new ATOM 0 HG3 PRO A 19 -20.923 -4.560 -1.970 1.00 42.34 H new ATOM 0 HD2 PRO A 19 -18.437 -5.708 -1.848 1.00 42.21 H new ATOM 0 HD3 PRO A 19 -19.512 -5.968 -3.207 1.00 42.21 H new ATOM 306 N ASP A 20 -17.149 -2.474 -1.776 1.00 64.45 N ATOM 307 CA ASP A 20 -16.505 -1.531 -0.873 1.00 24.10 C ATOM 308 C ASP A 20 -15.050 -1.343 -1.306 1.00 73.51 C ATOM 309 O ASP A 20 -14.560 -0.217 -1.377 1.00 23.20 O ATOM 310 CB ASP A 20 -16.627 -2.014 0.577 1.00 33.54 C ATOM 311 CG ASP A 20 -18.083 -2.189 1.015 1.00 42.03 C ATOM 312 OD1 ASP A 20 -18.834 -1.184 0.995 1.00 2.01 O ATOM 313 OD2 ASP A 20 -18.483 -3.335 1.313 1.00 24.54 O ATOM 0 H ASP A 20 -17.258 -3.411 -1.388 1.00 64.45 H new ATOM 0 HA ASP A 20 -17.001 -0.561 -0.922 1.00 24.10 H new ATOM 0 HB2 ASP A 20 -16.101 -2.963 0.686 1.00 33.54 H new ATOM 0 HB3 ASP A 20 -16.136 -1.299 1.237 1.00 33.54 H new ATOM 318 N MET A 21 -14.363 -2.430 -1.678 1.00 62.14 N ATOM 319 CA MET A 21 -13.005 -2.384 -2.214 1.00 21.51 C ATOM 320 C MET A 21 -12.999 -1.573 -3.517 1.00 14.03 C ATOM 321 O MET A 21 -12.086 -0.771 -3.744 1.00 10.42 O ATOM 322 CB MET A 21 -12.493 -3.831 -2.443 1.00 12.42 C ATOM 323 CG MET A 21 -11.127 -4.163 -1.818 1.00 34.54 C ATOM 324 SD MET A 21 -9.785 -2.963 -2.023 1.00 24.51 S ATOM 325 CE MET A 21 -9.453 -2.569 -0.295 1.00 14.24 C ATOM 0 H MET A 21 -14.742 -3.375 -1.613 1.00 62.14 H new ATOM 0 HA MET A 21 -12.335 -1.895 -1.507 1.00 21.51 H new ATOM 0 HB2 MET A 21 -13.233 -4.526 -2.044 1.00 12.42 H new ATOM 0 HB3 MET A 21 -12.434 -4.010 -3.517 1.00 12.42 H new ATOM 0 HG2 MET A 21 -11.277 -4.317 -0.749 1.00 34.54 H new ATOM 0 HG3 MET A 21 -10.792 -5.113 -2.233 1.00 34.54 H new ATOM 0 HE1 MET A 21 -8.647 -1.838 -0.237 1.00 14.24 H new ATOM 0 HE2 MET A 21 -10.351 -2.155 0.163 1.00 14.24 H new ATOM 0 HE3 MET A 21 -9.160 -3.475 0.235 1.00 14.24 H new ATOM 335 N MET A 22 -14.034 -1.733 -4.354 1.00 21.42 N ATOM 336 CA MET A 22 -14.232 -0.927 -5.554 1.00 10.14 C ATOM 337 C MET A 22 -14.451 0.544 -5.217 1.00 54.31 C ATOM 338 O MET A 22 -13.843 1.398 -5.863 1.00 74.11 O ATOM 339 CB MET A 22 -15.418 -1.449 -6.382 1.00 73.34 C ATOM 340 CG MET A 22 -14.974 -2.490 -7.408 1.00 34.41 C ATOM 341 SD MET A 22 -14.535 -1.858 -9.066 1.00 33.54 S ATOM 342 CE MET A 22 -13.477 -0.421 -8.753 1.00 25.34 C ATOM 0 H MET A 22 -14.761 -2.434 -4.210 1.00 21.42 H new ATOM 0 HA MET A 22 -13.320 -1.012 -6.145 1.00 10.14 H new ATOM 0 HB2 MET A 22 -16.162 -1.888 -5.717 1.00 73.34 H new ATOM 0 HB3 MET A 22 -15.900 -0.616 -6.894 1.00 73.34 H new ATOM 0 HG2 MET A 22 -14.112 -3.021 -7.005 1.00 34.41 H new ATOM 0 HG3 MET A 22 -15.774 -3.221 -7.522 1.00 34.41 H new ATOM 0 HE1 MET A 22 -13.184 0.028 -9.702 1.00 25.34 H new ATOM 0 HE2 MET A 22 -14.024 0.311 -8.158 1.00 25.34 H new ATOM 0 HE3 MET A 22 -12.586 -0.737 -8.210 1.00 25.34 H new ATOM 352 N ALA A 23 -15.301 0.854 -4.234 1.00 33.22 N ATOM 353 CA ALA A 23 -15.690 2.210 -3.875 1.00 25.30 C ATOM 354 C ALA A 23 -14.449 3.037 -3.580 1.00 24.31 C ATOM 355 O ALA A 23 -14.230 4.081 -4.198 1.00 54.15 O ATOM 356 CB ALA A 23 -16.645 2.184 -2.673 1.00 53.43 C ATOM 0 H ALA A 23 -15.747 0.144 -3.653 1.00 33.22 H new ATOM 0 HA ALA A 23 -16.217 2.672 -4.709 1.00 25.30 H new ATOM 0 HB1 ALA A 23 -16.930 3.203 -2.413 1.00 53.43 H new ATOM 0 HB2 ALA A 23 -17.537 1.612 -2.929 1.00 53.43 H new ATOM 0 HB3 ALA A 23 -16.147 1.718 -1.823 1.00 53.43 H new ATOM 362 N ILE A 24 -13.612 2.523 -2.677 1.00 73.21 N ATOM 363 CA ILE A 24 -12.377 3.155 -2.239 1.00 30.42 C ATOM 364 C ILE A 24 -11.512 3.530 -3.460 1.00 1.32 C ATOM 365 O ILE A 24 -10.848 4.570 -3.474 1.00 30.50 O ATOM 366 CB ILE A 24 -11.663 2.205 -1.242 1.00 23.40 C ATOM 367 CG1 ILE A 24 -12.506 1.903 0.015 1.00 54.12 C ATOM 368 CG2 ILE A 24 -10.294 2.724 -0.759 1.00 73.22 C ATOM 369 CD1 ILE A 24 -12.004 0.677 0.778 1.00 24.34 C ATOM 0 H ILE A 24 -13.785 1.628 -2.219 1.00 73.21 H new ATOM 0 HA ILE A 24 -12.577 4.090 -1.716 1.00 30.42 H new ATOM 0 HB ILE A 24 -11.520 1.296 -1.827 1.00 23.40 H new ATOM 0 HG12 ILE A 24 -12.490 2.770 0.676 1.00 54.12 H new ATOM 0 HG13 ILE A 24 -13.544 1.745 -0.277 1.00 54.12 H new ATOM 0 HG21 ILE A 24 -9.857 2.006 -0.065 1.00 73.22 H new ATOM 0 HG22 ILE A 24 -9.631 2.852 -1.615 1.00 73.22 H new ATOM 0 HG23 ILE A 24 -10.425 3.682 -0.255 1.00 73.22 H new ATOM 0 HD11 ILE A 24 -12.633 0.510 1.653 1.00 24.34 H new ATOM 0 HD12 ILE A 24 -12.046 -0.198 0.129 1.00 24.34 H new ATOM 0 HD13 ILE A 24 -10.975 0.843 1.097 1.00 24.34 H new ATOM 381 N LEU A 25 -11.530 2.708 -4.512 1.00 10.44 N ATOM 382 CA LEU A 25 -10.811 2.944 -5.759 1.00 44.41 C ATOM 383 C LEU A 25 -11.477 4.048 -6.583 1.00 63.15 C ATOM 384 O LEU A 25 -10.813 4.986 -7.024 1.00 42.21 O ATOM 385 CB LEU A 25 -10.713 1.638 -6.566 1.00 65.34 C ATOM 386 CG LEU A 25 -9.285 1.385 -7.085 1.00 70.02 C ATOM 387 CD1 LEU A 25 -8.419 0.711 -6.018 1.00 70.05 C ATOM 388 CD2 LEU A 25 -9.336 0.520 -8.343 1.00 42.44 C ATOM 0 H LEU A 25 -12.061 1.837 -4.517 1.00 10.44 H new ATOM 0 HA LEU A 25 -9.803 3.281 -5.516 1.00 44.41 H new ATOM 0 HB2 LEU A 25 -11.025 0.801 -5.941 1.00 65.34 H new ATOM 0 HB3 LEU A 25 -11.403 1.680 -7.409 1.00 65.34 H new ATOM 0 HG LEU A 25 -8.834 2.348 -7.326 1.00 70.02 H new ATOM 0 HD11 LEU A 25 -7.417 0.545 -6.414 1.00 70.05 H new ATOM 0 HD12 LEU A 25 -8.360 1.352 -5.139 1.00 70.05 H new ATOM 0 HD13 LEU A 25 -8.862 -0.245 -5.741 1.00 70.05 H new ATOM 0 HD21 LEU A 25 -8.323 0.345 -8.705 1.00 42.44 H new ATOM 0 HD22 LEU A 25 -9.808 -0.434 -8.110 1.00 42.44 H new ATOM 0 HD23 LEU A 25 -9.913 1.032 -9.113 1.00 42.44 H new ATOM 400 N THR A 26 -12.762 3.914 -6.907 1.00 10.13 N ATOM 401 CA THR A 26 -13.535 4.884 -7.683 1.00 32.44 C ATOM 402 C THR A 26 -13.422 6.304 -7.110 1.00 3.32 C ATOM 403 O THR A 26 -13.354 7.257 -7.885 1.00 54.43 O ATOM 404 CB THR A 26 -14.981 4.363 -7.768 1.00 65.44 C ATOM 405 OG1 THR A 26 -14.948 3.037 -8.274 1.00 5.21 O ATOM 406 CG2 THR A 26 -15.890 5.176 -8.691 1.00 72.44 C ATOM 0 H THR A 26 -13.312 3.102 -6.628 1.00 10.13 H new ATOM 0 HA THR A 26 -13.134 4.975 -8.692 1.00 32.44 H new ATOM 0 HB THR A 26 -15.391 4.434 -6.761 1.00 65.44 H new ATOM 0 HG1 THR A 26 -15.861 2.687 -8.334 1.00 5.21 H new ATOM 0 HG21 THR A 26 -16.889 4.741 -8.693 1.00 72.44 H new ATOM 0 HG22 THR A 26 -15.943 6.205 -8.336 1.00 72.44 H new ATOM 0 HG23 THR A 26 -15.487 5.162 -9.703 1.00 72.44 H new ATOM 414 N ILE A 27 -13.337 6.466 -5.791 1.00 23.52 N ATOM 415 CA ILE A 27 -13.215 7.785 -5.182 1.00 25.31 C ATOM 416 C ILE A 27 -11.801 8.349 -5.429 1.00 1.01 C ATOM 417 O ILE A 27 -11.688 9.465 -5.933 1.00 62.34 O ATOM 418 CB ILE A 27 -13.655 7.671 -3.705 1.00 73.22 C ATOM 419 CG1 ILE A 27 -15.187 7.399 -3.634 1.00 22.33 C ATOM 420 CG2 ILE A 27 -13.342 8.934 -2.887 1.00 53.21 C ATOM 421 CD1 ILE A 27 -15.602 6.394 -2.551 1.00 30.50 C ATOM 0 H ILE A 27 -13.351 5.695 -5.123 1.00 23.52 H new ATOM 0 HA ILE A 27 -13.876 8.523 -5.637 1.00 25.31 H new ATOM 0 HB ILE A 27 -13.088 6.846 -3.273 1.00 73.22 H new ATOM 0 HG12 ILE A 27 -15.703 8.342 -3.455 1.00 22.33 H new ATOM 0 HG13 ILE A 27 -15.524 7.030 -4.603 1.00 22.33 H new ATOM 0 HG21 ILE A 27 -13.674 8.793 -1.859 1.00 53.21 H new ATOM 0 HG22 ILE A 27 -12.268 9.118 -2.899 1.00 53.21 H new ATOM 0 HG23 ILE A 27 -13.862 9.788 -3.322 1.00 53.21 H new ATOM 0 HD11 ILE A 27 -16.684 6.263 -2.571 1.00 30.50 H new ATOM 0 HD12 ILE A 27 -15.117 5.436 -2.739 1.00 30.50 H new ATOM 0 HD13 ILE A 27 -15.300 6.768 -1.573 1.00 30.50 H new ATOM 433 N ILE A 28 -10.719 7.603 -5.152 1.00 32.31 N ATOM 434 CA ILE A 28 -9.344 8.115 -5.306 1.00 1.21 C ATOM 435 C ILE A 28 -9.045 8.466 -6.775 1.00 25.33 C ATOM 436 O ILE A 28 -8.295 9.394 -7.067 1.00 50.14 O ATOM 437 CB ILE A 28 -8.345 7.110 -4.670 1.00 50.11 C ATOM 438 CG1 ILE A 28 -7.030 7.773 -4.212 1.00 45.24 C ATOM 439 CG2 ILE A 28 -8.060 5.860 -5.511 1.00 51.55 C ATOM 440 CD1 ILE A 28 -5.927 7.836 -5.269 1.00 32.42 C ATOM 0 H ILE A 28 -10.769 6.640 -4.819 1.00 32.31 H new ATOM 0 HA ILE A 28 -9.228 9.055 -4.766 1.00 1.21 H new ATOM 0 HB ILE A 28 -8.875 6.759 -3.784 1.00 50.11 H new ATOM 0 HG12 ILE A 28 -7.250 8.787 -3.880 1.00 45.24 H new ATOM 0 HG13 ILE A 28 -6.651 7.230 -3.347 1.00 45.24 H new ATOM 0 HG21 ILE A 28 -7.352 5.220 -4.984 1.00 51.55 H new ATOM 0 HG22 ILE A 28 -8.989 5.314 -5.677 1.00 51.55 H new ATOM 0 HG23 ILE A 28 -7.636 6.156 -6.471 1.00 51.55 H new ATOM 0 HD11 ILE A 28 -5.046 8.320 -4.847 1.00 32.42 H new ATOM 0 HD12 ILE A 28 -5.669 6.826 -5.587 1.00 32.42 H new ATOM 0 HD13 ILE A 28 -6.278 8.408 -6.128 1.00 32.42 H new ATOM 452 N ARG A 29 -9.670 7.756 -7.714 1.00 51.15 N ATOM 453 CA ARG A 29 -9.646 8.061 -9.142 1.00 1.20 C ATOM 454 C ARG A 29 -10.092 9.503 -9.419 1.00 31.24 C ATOM 455 O ARG A 29 -9.348 10.262 -10.027 1.00 44.53 O ATOM 456 CB ARG A 29 -10.491 6.991 -9.842 1.00 44.41 C ATOM 457 CG ARG A 29 -10.622 7.116 -11.359 1.00 30.31 C ATOM 458 CD ARG A 29 -11.442 5.924 -11.886 1.00 42.34 C ATOM 459 NE ARG A 29 -12.609 6.376 -12.655 1.00 13.53 N ATOM 460 CZ ARG A 29 -13.756 5.727 -12.891 1.00 2.52 C ATOM 461 NH1 ARG A 29 -14.012 4.550 -12.319 1.00 53.35 N ATOM 462 NH2 ARG A 29 -14.627 6.279 -13.722 1.00 74.41 N ATOM 0 H ARG A 29 -10.223 6.928 -7.494 1.00 51.15 H new ATOM 0 HA ARG A 29 -8.633 8.022 -9.544 1.00 1.20 H new ATOM 0 HB2 ARG A 29 -10.063 6.015 -9.615 1.00 44.41 H new ATOM 0 HB3 ARG A 29 -11.491 7.009 -9.410 1.00 44.41 H new ATOM 0 HG2 ARG A 29 -11.111 8.055 -11.620 1.00 30.31 H new ATOM 0 HG3 ARG A 29 -9.636 7.130 -11.823 1.00 30.31 H new ATOM 0 HD2 ARG A 29 -10.811 5.296 -12.515 1.00 42.34 H new ATOM 0 HD3 ARG A 29 -11.772 5.309 -11.049 1.00 42.34 H new ATOM 0 HE ARG A 29 -12.536 7.308 -13.063 1.00 13.53 H new ATOM 0 HH11 ARG A 29 -13.328 4.129 -11.690 1.00 53.35 H new ATOM 0 HH12 ARG A 29 -14.891 4.070 -12.511 1.00 53.35 H new ATOM 0 HH21 ARG A 29 -14.415 7.174 -14.162 1.00 74.41 H new ATOM 0 HH22 ARG A 29 -15.510 5.809 -13.922 1.00 74.41 H new ATOM 476 N ASP A 30 -11.290 9.882 -8.974 1.00 64.05 N ATOM 477 CA ASP A 30 -11.918 11.180 -9.268 1.00 4.43 C ATOM 478 C ASP A 30 -11.287 12.346 -8.512 1.00 50.31 C ATOM 479 O ASP A 30 -11.479 13.513 -8.846 1.00 50.21 O ATOM 480 CB ASP A 30 -13.382 11.074 -8.842 1.00 63.53 C ATOM 481 CG ASP A 30 -14.237 12.312 -9.147 1.00 50.03 C ATOM 482 OD1 ASP A 30 -14.077 12.972 -10.193 1.00 43.42 O ATOM 483 OD2 ASP A 30 -15.153 12.560 -8.324 1.00 62.31 O ATOM 0 H ASP A 30 -11.869 9.284 -8.384 1.00 64.05 H new ATOM 0 HA ASP A 30 -11.790 11.385 -10.331 1.00 4.43 H new ATOM 0 HB2 ASP A 30 -13.828 10.212 -9.338 1.00 63.53 H new ATOM 0 HB3 ASP A 30 -13.420 10.880 -7.770 1.00 63.53 H new ATOM 488 N LEU A 31 -10.526 12.036 -7.467 1.00 30.14 N ATOM 489 CA LEU A 31 -9.882 12.945 -6.540 1.00 54.33 C ATOM 490 C LEU A 31 -9.077 14.049 -7.218 1.00 62.12 C ATOM 491 O LEU A 31 -8.895 15.135 -6.668 1.00 25.22 O ATOM 492 CB LEU A 31 -9.011 12.071 -5.621 1.00 63.23 C ATOM 493 CG LEU A 31 -8.999 12.387 -4.122 1.00 5.12 C ATOM 494 CD1 LEU A 31 -9.839 13.585 -3.705 1.00 3.31 C ATOM 495 CD2 LEU A 31 -9.508 11.208 -3.316 1.00 70.53 C ATOM 0 H LEU A 31 -10.332 11.063 -7.233 1.00 30.14 H new ATOM 0 HA LEU A 31 -10.636 13.492 -5.975 1.00 54.33 H new ATOM 0 HB2 LEU A 31 -9.334 11.037 -5.741 1.00 63.23 H new ATOM 0 HB3 LEU A 31 -7.984 12.128 -5.982 1.00 63.23 H new ATOM 0 HG LEU A 31 -7.953 12.616 -3.920 1.00 5.12 H new ATOM 0 HD11 LEU A 31 -9.764 13.725 -2.627 1.00 3.31 H new ATOM 0 HD12 LEU A 31 -9.476 14.479 -4.213 1.00 3.31 H new ATOM 0 HD13 LEU A 31 -10.880 13.411 -3.977 1.00 3.31 H new ATOM 0 HD21 LEU A 31 -9.490 11.457 -2.255 1.00 70.53 H new ATOM 0 HD22 LEU A 31 -10.530 10.976 -3.617 1.00 70.53 H new ATOM 0 HD23 LEU A 31 -8.871 10.342 -3.496 1.00 70.53 H new ATOM 507 N GLY A 32 -8.595 13.771 -8.425 1.00 44.51 N ATOM 508 CA GLY A 32 -7.911 14.745 -9.251 1.00 54.41 C ATOM 509 C GLY A 32 -6.511 15.034 -8.720 1.00 2.51 C ATOM 510 O GLY A 32 -5.876 15.997 -9.162 1.00 74.31 O ATOM 0 H GLY A 32 -8.672 12.850 -8.857 1.00 44.51 H new ATOM 0 HA2 GLY A 32 -7.845 14.376 -10.274 1.00 54.41 H new ATOM 0 HA3 GLY A 32 -8.489 15.669 -9.282 1.00 54.41 H new ATOM 514 N LEU A 33 -6.050 14.266 -7.727 1.00 24.03 N ATOM 515 CA LEU A 33 -4.693 14.398 -7.218 1.00 61.03 C ATOM 516 C LEU A 33 -3.721 13.967 -8.303 1.00 30.43 C ATOM 517 O LEU A 33 -4.090 13.163 -9.165 1.00 4.31 O ATOM 518 CB LEU A 33 -4.496 13.540 -5.960 1.00 2.32 C ATOM 519 CG LEU A 33 -5.530 13.817 -4.864 1.00 41.35 C ATOM 520 CD1 LEU A 33 -5.296 12.871 -3.685 1.00 53.44 C ATOM 521 CD2 LEU A 33 -5.502 15.272 -4.412 1.00 73.41 C ATOM 0 H LEU A 33 -6.604 13.546 -7.263 1.00 24.03 H new ATOM 0 HA LEU A 33 -4.510 15.437 -6.946 1.00 61.03 H new ATOM 0 HB2 LEU A 33 -4.545 12.487 -6.237 1.00 2.32 H new ATOM 0 HB3 LEU A 33 -3.498 13.719 -5.560 1.00 2.32 H new ATOM 0 HG LEU A 33 -6.522 13.635 -5.277 1.00 41.35 H new ATOM 0 HD11 LEU A 33 -6.033 13.070 -2.907 1.00 53.44 H new ATOM 0 HD12 LEU A 33 -5.394 11.839 -4.022 1.00 53.44 H new ATOM 0 HD13 LEU A 33 -4.294 13.029 -3.285 1.00 53.44 H new ATOM 0 HD21 LEU A 33 -6.250 15.426 -3.634 1.00 73.41 H new ATOM 0 HD22 LEU A 33 -4.514 15.512 -4.018 1.00 73.41 H new ATOM 0 HD23 LEU A 33 -5.721 15.921 -5.260 1.00 73.41 H new ATOM 533 N LYS A 34 -2.480 14.439 -8.258 1.00 21.22 N ATOM 534 CA LYS A 34 -1.492 14.022 -9.238 1.00 34.44 C ATOM 535 C LYS A 34 -0.647 12.936 -8.620 1.00 70.32 C ATOM 536 O LYS A 34 -0.291 12.952 -7.441 1.00 45.31 O ATOM 537 CB LYS A 34 -0.655 15.188 -9.772 1.00 12.20 C ATOM 538 CG LYS A 34 -1.539 16.349 -10.249 1.00 3.12 C ATOM 539 CD LYS A 34 -1.692 17.428 -9.174 1.00 3.13 C ATOM 540 CE LYS A 34 -3.061 18.093 -9.236 1.00 52.11 C ATOM 541 NZ LYS A 34 -3.023 19.320 -10.050 1.00 74.45 N ATOM 0 H LYS A 34 -2.140 15.102 -7.562 1.00 21.22 H new ATOM 0 HA LYS A 34 -2.002 13.629 -10.118 1.00 34.44 H new ATOM 0 HB2 LYS A 34 0.019 15.540 -8.991 1.00 12.20 H new ATOM 0 HB3 LYS A 34 -0.033 14.842 -10.597 1.00 12.20 H new ATOM 0 HG2 LYS A 34 -1.106 16.790 -11.147 1.00 3.12 H new ATOM 0 HG3 LYS A 34 -2.523 15.968 -10.523 1.00 3.12 H new ATOM 0 HD2 LYS A 34 -1.547 16.984 -8.189 1.00 3.13 H new ATOM 0 HD3 LYS A 34 -0.915 18.182 -9.301 1.00 3.13 H new ATOM 0 HE2 LYS A 34 -3.787 17.397 -9.657 1.00 52.11 H new ATOM 0 HE3 LYS A 34 -3.397 18.333 -8.227 1.00 52.11 H new ATOM 0 HZ1 LYS A 34 -3.969 19.750 -10.074 1.00 74.45 H new ATOM 0 HZ2 LYS A 34 -2.347 19.992 -9.634 1.00 74.45 H new ATOM 0 HZ3 LYS A 34 -2.725 19.085 -11.018 1.00 74.45 H new ATOM 555 N ASP A 35 -0.326 11.959 -9.454 1.00 61.43 N ATOM 556 CA ASP A 35 0.637 10.896 -9.222 1.00 3.42 C ATOM 557 C ASP A 35 0.303 9.972 -8.046 1.00 11.53 C ATOM 558 O ASP A 35 1.019 9.001 -7.787 1.00 52.51 O ATOM 559 CB ASP A 35 2.049 11.507 -9.176 1.00 33.13 C ATOM 560 CG ASP A 35 2.700 11.365 -10.544 1.00 10.21 C ATOM 561 OD1 ASP A 35 2.398 12.174 -11.455 1.00 32.00 O ATOM 562 OD2 ASP A 35 3.435 10.366 -10.705 1.00 65.21 O ATOM 0 H ASP A 35 -0.762 11.884 -10.373 1.00 61.43 H new ATOM 0 HA ASP A 35 0.589 10.203 -10.062 1.00 3.42 H new ATOM 0 HB2 ASP A 35 1.994 12.558 -8.893 1.00 33.13 H new ATOM 0 HB3 ASP A 35 2.651 11.004 -8.419 1.00 33.13 H new ATOM 567 N SER A 36 -0.819 10.202 -7.367 1.00 33.20 N ATOM 568 CA SER A 36 -1.333 9.335 -6.327 1.00 30.31 C ATOM 569 C SER A 36 -1.787 8.017 -6.935 1.00 25.30 C ATOM 570 O SER A 36 -2.058 7.950 -8.141 1.00 34.03 O ATOM 571 CB SER A 36 -2.507 10.028 -5.618 1.00 53.11 C ATOM 572 OG SER A 36 -3.570 10.227 -6.526 1.00 14.32 O ATOM 0 H SER A 36 -1.406 11.019 -7.535 1.00 33.20 H new ATOM 0 HA SER A 36 -0.548 9.132 -5.599 1.00 30.31 H new ATOM 0 HB2 SER A 36 -2.844 9.421 -4.778 1.00 53.11 H new ATOM 0 HB3 SER A 36 -2.182 10.985 -5.210 1.00 53.11 H new ATOM 0 HG SER A 36 -4.422 10.202 -6.043 1.00 14.32 H new ATOM 578 N TRP A 37 -1.914 6.996 -6.089 1.00 13.43 N ATOM 579 CA TRP A 37 -2.752 5.826 -6.288 1.00 13.34 C ATOM 580 C TRP A 37 -2.717 4.982 -5.017 1.00 31.42 C ATOM 581 O TRP A 37 -1.922 5.244 -4.109 1.00 50.21 O ATOM 582 CB TRP A 37 -2.381 5.017 -7.533 1.00 31.32 C ATOM 583 CG TRP A 37 -1.004 4.461 -7.704 1.00 34.14 C ATOM 584 CD1 TRP A 37 0.171 5.057 -7.404 1.00 33.13 C ATOM 585 CD2 TRP A 37 -0.664 3.165 -8.271 1.00 52.45 C ATOM 586 NE1 TRP A 37 1.210 4.214 -7.748 1.00 50.22 N ATOM 587 CE2 TRP A 37 0.754 3.037 -8.316 1.00 72.14 C ATOM 588 CE3 TRP A 37 -1.431 2.087 -8.761 1.00 25.31 C ATOM 589 CZ2 TRP A 37 1.375 1.882 -8.831 1.00 10.12 C ATOM 590 CZ3 TRP A 37 -0.828 0.948 -9.313 1.00 43.21 C ATOM 591 CH2 TRP A 37 0.569 0.851 -9.353 1.00 44.23 C ATOM 0 H TRP A 37 -1.408 6.966 -5.204 1.00 13.43 H new ATOM 0 HA TRP A 37 -3.772 6.161 -6.477 1.00 13.34 H new ATOM 0 HB2 TRP A 37 -3.074 4.177 -7.587 1.00 31.32 H new ATOM 0 HB3 TRP A 37 -2.580 5.651 -8.397 1.00 31.32 H new ATOM 0 HD1 TRP A 37 0.281 6.038 -6.965 1.00 33.13 H new ATOM 0 HE1 TRP A 37 2.195 4.433 -7.601 1.00 50.22 H new ATOM 0 HE3 TRP A 37 -2.508 2.140 -8.710 1.00 25.31 H new ATOM 0 HZ2 TRP A 37 2.451 1.788 -8.826 1.00 10.12 H new ATOM 0 HZ3 TRP A 37 -1.438 0.148 -9.706 1.00 43.21 H new ATOM 0 HH2 TRP A 37 1.032 -0.022 -9.788 1.00 44.23 H new ATOM 602 N LEU A 38 -3.599 3.985 -4.940 1.00 33.04 N ATOM 603 CA LEU A 38 -3.642 3.056 -3.827 1.00 22.04 C ATOM 604 C LEU A 38 -2.445 2.118 -3.957 1.00 71.33 C ATOM 605 O LEU A 38 -2.202 1.544 -5.024 1.00 62.12 O ATOM 606 CB LEU A 38 -4.978 2.295 -3.833 1.00 61.45 C ATOM 607 CG LEU A 38 -5.322 1.742 -2.450 1.00 72.42 C ATOM 608 CD1 LEU A 38 -5.787 2.862 -1.509 1.00 72.12 C ATOM 609 CD2 LEU A 38 -6.407 0.661 -2.525 1.00 3.41 C ATOM 0 H LEU A 38 -4.304 3.804 -5.655 1.00 33.04 H new ATOM 0 HA LEU A 38 -3.581 3.579 -2.872 1.00 22.04 H new ATOM 0 HB2 LEU A 38 -5.774 2.961 -4.167 1.00 61.45 H new ATOM 0 HB3 LEU A 38 -4.926 1.475 -4.550 1.00 61.45 H new ATOM 0 HG LEU A 38 -4.411 1.294 -2.055 1.00 72.42 H new ATOM 0 HD11 LEU A 38 -6.025 2.441 -0.532 1.00 72.12 H new ATOM 0 HD12 LEU A 38 -4.992 3.600 -1.402 1.00 72.12 H new ATOM 0 HD13 LEU A 38 -6.674 3.341 -1.924 1.00 72.12 H new ATOM 0 HD21 LEU A 38 -6.624 0.293 -1.522 1.00 3.41 H new ATOM 0 HD22 LEU A 38 -7.313 1.084 -2.960 1.00 3.41 H new ATOM 0 HD23 LEU A 38 -6.057 -0.163 -3.146 1.00 3.41 H new ATOM 621 N ALA A 39 -1.646 2.007 -2.902 1.00 45.22 N ATOM 622 CA ALA A 39 -0.429 1.212 -2.907 1.00 74.31 C ATOM 623 C ALA A 39 -0.083 0.766 -1.508 1.00 52.24 C ATOM 624 O ALA A 39 -0.601 1.346 -0.568 1.00 13.43 O ATOM 625 CB ALA A 39 0.698 2.040 -3.525 1.00 25.20 C ATOM 0 H ALA A 39 -1.829 2.471 -2.012 1.00 45.22 H new ATOM 0 HA ALA A 39 -0.576 0.312 -3.505 1.00 74.31 H new ATOM 0 HB1 ALA A 39 1.617 1.454 -3.534 1.00 25.20 H new ATOM 0 HB2 ALA A 39 0.431 2.313 -4.546 1.00 25.20 H new ATOM 0 HB3 ALA A 39 0.850 2.944 -2.936 1.00 25.20 H new ATOM 631 N ALA A 40 0.830 -0.188 -1.350 1.00 53.11 N ATOM 632 CA ALA A 40 1.115 -0.802 -0.074 1.00 13.50 C ATOM 633 C ALA A 40 -0.126 -1.419 0.582 1.00 51.34 C ATOM 634 O ALA A 40 -1.005 -1.940 -0.114 1.00 13.30 O ATOM 635 CB ALA A 40 1.959 0.128 0.792 1.00 44.12 C ATOM 0 H ALA A 40 1.394 -0.554 -2.117 1.00 53.11 H new ATOM 0 HA ALA A 40 1.744 -1.679 -0.229 1.00 13.50 H new ATOM 0 HB1 ALA A 40 2.163 -0.352 1.749 1.00 44.12 H new ATOM 0 HB2 ALA A 40 2.900 0.343 0.285 1.00 44.12 H new ATOM 0 HB3 ALA A 40 1.418 1.059 0.961 1.00 44.12 H new ATOM 641 N GLY A 41 -0.099 -1.500 1.914 1.00 3.31 N ATOM 642 CA GLY A 41 -0.947 -2.326 2.752 1.00 1.24 C ATOM 643 C GLY A 41 -2.431 -2.271 2.434 1.00 72.11 C ATOM 644 O GLY A 41 -3.123 -3.263 2.661 1.00 33.11 O ATOM 0 H GLY A 41 0.562 -0.951 2.464 1.00 3.31 H new ATOM 0 HA2 GLY A 41 -0.613 -3.360 2.669 1.00 1.24 H new ATOM 0 HA3 GLY A 41 -0.804 -2.027 3.790 1.00 1.24 H new ATOM 648 N SER A 42 -2.911 -1.142 1.927 1.00 1.43 N ATOM 649 CA SER A 42 -4.284 -0.941 1.514 1.00 3.42 C ATOM 650 C SER A 42 -4.702 -1.986 0.485 1.00 73.35 C ATOM 651 O SER A 42 -5.799 -2.546 0.564 1.00 53.24 O ATOM 652 CB SER A 42 -4.394 0.483 0.972 1.00 71.32 C ATOM 653 OG SER A 42 -3.323 0.788 0.105 1.00 12.44 O ATOM 0 H SER A 42 -2.330 -0.315 1.790 1.00 1.43 H new ATOM 0 HA SER A 42 -4.965 -1.063 2.356 1.00 3.42 H new ATOM 0 HB2 SER A 42 -5.339 0.600 0.441 1.00 71.32 H new ATOM 0 HB3 SER A 42 -4.405 1.190 1.802 1.00 71.32 H new ATOM 0 HG SER A 42 -3.258 1.760 -0.005 1.00 12.44 H new ATOM 659 N VAL A 43 -3.857 -2.186 -0.528 1.00 41.14 N ATOM 660 CA VAL A 43 -4.189 -3.016 -1.669 1.00 31.12 C ATOM 661 C VAL A 43 -3.955 -4.434 -1.091 1.00 74.14 C ATOM 662 O VAL A 43 -4.749 -5.350 -1.221 1.00 5.51 O ATOM 663 CB VAL A 43 -3.252 -2.730 -2.849 1.00 45.42 C ATOM 664 CG1 VAL A 43 -3.082 -1.253 -3.215 1.00 3.10 C ATOM 665 CG2 VAL A 43 -2.149 -3.712 -3.217 1.00 3.33 C ATOM 0 H VAL A 43 -2.925 -1.774 -0.573 1.00 41.14 H new ATOM 0 HA VAL A 43 -5.192 -2.858 -2.065 1.00 31.12 H new ATOM 0 HB VAL A 43 -3.882 -3.102 -3.657 1.00 45.42 H new ATOM 0 HG11 VAL A 43 -2.400 -1.164 -4.061 1.00 3.10 H new ATOM 0 HG12 VAL A 43 -4.050 -0.831 -3.483 1.00 3.10 H new ATOM 0 HG13 VAL A 43 -2.674 -0.711 -2.362 1.00 3.10 H new ATOM 0 HG21 VAL A 43 -1.596 -3.333 -4.076 1.00 3.33 H new ATOM 0 HG22 VAL A 43 -1.470 -3.830 -2.372 1.00 3.33 H new ATOM 0 HG23 VAL A 43 -2.590 -4.677 -3.466 1.00 3.33 H new ATOM 675 N ARG A 44 -2.822 -4.637 -0.407 1.00 45.15 N ATOM 676 CA ARG A 44 -2.384 -5.927 0.154 1.00 45.54 C ATOM 677 C ARG A 44 -3.437 -6.577 1.031 1.00 52.21 C ATOM 678 O ARG A 44 -3.549 -7.798 1.056 1.00 32.10 O ATOM 679 CB ARG A 44 -1.132 -5.733 1.007 1.00 44.21 C ATOM 680 CG ARG A 44 -0.464 -7.067 1.384 1.00 3.11 C ATOM 681 CD ARG A 44 0.949 -6.846 1.906 1.00 12.32 C ATOM 682 NE ARG A 44 0.980 -6.062 3.146 1.00 33.10 N ATOM 683 CZ ARG A 44 2.079 -5.489 3.641 1.00 74.43 C ATOM 684 NH1 ARG A 44 3.198 -5.472 2.928 1.00 4.30 N ATOM 685 NH2 ARG A 44 2.054 -4.927 4.835 1.00 30.03 N ATOM 0 H ARG A 44 -2.160 -3.883 -0.221 1.00 45.15 H new ATOM 0 HA ARG A 44 -2.190 -6.576 -0.700 1.00 45.54 H new ATOM 0 HB2 ARG A 44 -0.418 -5.114 0.464 1.00 44.21 H new ATOM 0 HB3 ARG A 44 -1.396 -5.193 1.916 1.00 44.21 H new ATOM 0 HG2 ARG A 44 -1.060 -7.574 2.143 1.00 3.11 H new ATOM 0 HG3 ARG A 44 -0.435 -7.721 0.513 1.00 3.11 H new ATOM 0 HD2 ARG A 44 1.422 -7.812 2.080 1.00 12.32 H new ATOM 0 HD3 ARG A 44 1.538 -6.335 1.144 1.00 12.32 H new ATOM 0 HE ARG A 44 0.107 -5.948 3.662 1.00 33.10 H new ATOM 0 HH11 ARG A 44 3.219 -5.897 2.001 1.00 4.30 H new ATOM 0 HH12 ARG A 44 4.038 -5.034 3.307 1.00 4.30 H new ATOM 0 HH21 ARG A 44 1.193 -4.930 5.382 1.00 30.03 H new ATOM 0 HH22 ARG A 44 2.896 -4.490 5.211 1.00 30.03 H new ATOM 699 N ASN A 45 -4.185 -5.775 1.775 1.00 13.11 N ATOM 700 CA ASN A 45 -5.208 -6.235 2.693 1.00 10.31 C ATOM 701 C ASN A 45 -6.221 -7.144 1.984 1.00 3.42 C ATOM 702 O ASN A 45 -6.497 -8.239 2.479 1.00 31.42 O ATOM 703 CB ASN A 45 -5.877 -5.007 3.309 1.00 45.34 C ATOM 704 CG ASN A 45 -7.005 -5.408 4.239 1.00 50.31 C ATOM 705 OD1 ASN A 45 -6.763 -6.031 5.273 1.00 11.30 O ATOM 706 ND2 ASN A 45 -8.222 -5.006 3.935 1.00 74.13 N ATOM 0 H ASN A 45 -4.092 -4.759 1.754 1.00 13.11 H new ATOM 0 HA ASN A 45 -4.761 -6.838 3.483 1.00 10.31 H new ATOM 0 HB2 ASN A 45 -5.138 -4.424 3.859 1.00 45.34 H new ATOM 0 HB3 ASN A 45 -6.265 -4.365 2.518 1.00 45.34 H new ATOM 0 HD21 ASN A 45 -8.998 -5.209 4.565 1.00 74.13 H new ATOM 0 HD22 ASN A 45 -8.388 -4.492 3.070 1.00 74.13 H new ATOM 713 N PHE A 46 -6.716 -6.747 0.800 1.00 24.32 N ATOM 714 CA PHE A 46 -7.682 -7.560 0.055 1.00 30.22 C ATOM 715 C PHE A 46 -7.058 -8.829 -0.536 1.00 73.42 C ATOM 716 O PHE A 46 -7.780 -9.640 -1.099 1.00 42.25 O ATOM 717 CB PHE A 46 -8.445 -6.755 -1.019 1.00 5.01 C ATOM 718 CG PHE A 46 -7.764 -6.553 -2.363 1.00 32.03 C ATOM 719 CD1 PHE A 46 -7.841 -7.514 -3.393 1.00 71.35 C ATOM 720 CD2 PHE A 46 -7.059 -5.369 -2.603 1.00 25.01 C ATOM 721 CE1 PHE A 46 -7.169 -7.315 -4.616 1.00 3.22 C ATOM 722 CE2 PHE A 46 -6.306 -5.217 -3.768 1.00 5.33 C ATOM 723 CZ PHE A 46 -6.323 -6.193 -4.766 1.00 43.15 C ATOM 0 H PHE A 46 -6.462 -5.871 0.343 1.00 24.32 H new ATOM 0 HA PHE A 46 -8.418 -7.879 0.793 1.00 30.22 H new ATOM 0 HB2 PHE A 46 -9.399 -7.252 -1.197 1.00 5.01 H new ATOM 0 HB3 PHE A 46 -8.670 -5.772 -0.605 1.00 5.01 H new ATOM 0 HD1 PHE A 46 -8.421 -8.412 -3.243 1.00 71.35 H new ATOM 0 HD2 PHE A 46 -7.098 -4.566 -1.881 1.00 25.01 H new ATOM 0 HE1 PHE A 46 -7.299 -8.013 -5.430 1.00 3.22 H new ATOM 0 HE2 PHE A 46 -5.701 -4.332 -3.899 1.00 5.33 H new ATOM 0 HZ PHE A 46 -5.698 -6.092 -5.641 1.00 43.15 H new ATOM 733 N ILE A 47 -5.741 -9.019 -0.425 1.00 45.52 N ATOM 734 CA ILE A 47 -4.954 -10.049 -1.102 1.00 14.24 C ATOM 735 C ILE A 47 -4.462 -11.077 -0.071 1.00 13.41 C ATOM 736 O ILE A 47 -4.617 -12.276 -0.261 1.00 70.41 O ATOM 737 CB ILE A 47 -3.802 -9.354 -1.867 1.00 31.32 C ATOM 738 CG1 ILE A 47 -4.318 -8.335 -2.905 1.00 42.53 C ATOM 739 CG2 ILE A 47 -2.875 -10.390 -2.507 1.00 24.30 C ATOM 740 CD1 ILE A 47 -3.208 -7.487 -3.510 1.00 44.34 C ATOM 0 H ILE A 47 -5.165 -8.426 0.172 1.00 45.52 H new ATOM 0 HA ILE A 47 -5.552 -10.599 -1.828 1.00 14.24 H new ATOM 0 HB ILE A 47 -3.224 -8.785 -1.138 1.00 31.32 H new ATOM 0 HG12 ILE A 47 -4.836 -8.868 -3.702 1.00 42.53 H new ATOM 0 HG13 ILE A 47 -5.050 -7.681 -2.431 1.00 42.53 H new ATOM 0 HG21 ILE A 47 -2.072 -9.880 -3.040 1.00 24.30 H new ATOM 0 HG22 ILE A 47 -2.449 -11.026 -1.731 1.00 24.30 H new ATOM 0 HG23 ILE A 47 -3.443 -11.003 -3.207 1.00 24.30 H new ATOM 0 HD11 ILE A 47 -3.635 -6.791 -4.232 1.00 44.34 H new ATOM 0 HD12 ILE A 47 -2.705 -6.929 -2.720 1.00 44.34 H new ATOM 0 HD13 ILE A 47 -2.488 -8.134 -4.012 1.00 44.34 H new ATOM 752 N TRP A 48 -3.884 -10.625 1.042 1.00 74.11 N ATOM 753 CA TRP A 48 -3.476 -11.474 2.152 1.00 50.22 C ATOM 754 C TRP A 48 -4.688 -12.135 2.807 1.00 51.55 C ATOM 755 O TRP A 48 -4.719 -13.355 2.914 1.00 13.44 O ATOM 756 CB TRP A 48 -2.640 -10.651 3.145 1.00 2.43 C ATOM 757 CG TRP A 48 -1.155 -10.588 2.896 1.00 5.30 C ATOM 758 CD1 TRP A 48 -0.474 -11.234 1.919 1.00 13.53 C ATOM 759 CD2 TRP A 48 -0.132 -9.913 3.694 1.00 4.41 C ATOM 760 NE1 TRP A 48 0.880 -11.031 2.070 1.00 31.31 N ATOM 761 CE2 TRP A 48 1.154 -10.230 3.157 1.00 70.01 C ATOM 762 CE3 TRP A 48 -0.157 -9.081 4.835 1.00 61.15 C ATOM 763 CZ2 TRP A 48 2.348 -9.753 3.723 1.00 11.43 C ATOM 764 CZ3 TRP A 48 1.032 -8.584 5.403 1.00 13.10 C ATOM 765 CH2 TRP A 48 2.281 -8.916 4.851 1.00 25.22 C ATOM 0 H TRP A 48 -3.684 -9.637 1.196 1.00 74.11 H new ATOM 0 HA TRP A 48 -2.849 -12.286 1.783 1.00 50.22 H new ATOM 0 HB2 TRP A 48 -3.027 -9.632 3.151 1.00 2.43 H new ATOM 0 HB3 TRP A 48 -2.800 -11.059 4.143 1.00 2.43 H new ATOM 0 HD1 TRP A 48 -0.927 -11.823 1.135 1.00 13.53 H new ATOM 0 HE1 TRP A 48 1.591 -11.425 1.454 1.00 31.31 H new ATOM 0 HE3 TRP A 48 -1.106 -8.821 5.280 1.00 61.15 H new ATOM 0 HZ2 TRP A 48 3.303 -10.025 3.298 1.00 11.43 H new ATOM 0 HZ3 TRP A 48 0.984 -7.942 6.270 1.00 13.10 H new ATOM 0 HH2 TRP A 48 3.188 -8.529 5.292 1.00 25.22 H new ATOM 776 N ASN A 49 -5.707 -11.376 3.218 1.00 25.50 N ATOM 777 CA ASN A 49 -6.906 -11.942 3.844 1.00 4.14 C ATOM 778 C ASN A 49 -7.582 -12.997 2.968 1.00 25.33 C ATOM 779 O ASN A 49 -8.023 -14.025 3.483 1.00 44.12 O ATOM 780 CB ASN A 49 -7.917 -10.838 4.187 1.00 3.22 C ATOM 781 CG ASN A 49 -7.567 -10.048 5.435 1.00 12.43 C ATOM 782 OD1 ASN A 49 -6.753 -10.476 6.241 1.00 53.31 O ATOM 783 ND2 ASN A 49 -8.210 -8.930 5.673 1.00 54.22 N ATOM 0 H ASN A 49 -5.726 -10.360 3.128 1.00 25.50 H new ATOM 0 HA ASN A 49 -6.573 -12.431 4.759 1.00 4.14 H new ATOM 0 HB2 ASN A 49 -7.990 -10.152 3.343 1.00 3.22 H new ATOM 0 HB3 ASN A 49 -8.901 -11.288 4.318 1.00 3.22 H new ATOM 0 HD21 ASN A 49 -8.032 -8.413 6.534 1.00 54.22 H new ATOM 0 HD22 ASN A 49 -8.888 -8.578 4.997 1.00 54.22 H new ATOM 790 N LEU A 50 -7.603 -12.748 1.658 1.00 3.12 N ATOM 791 CA LEU A 50 -8.116 -13.600 0.583 1.00 50.12 C ATOM 792 C LEU A 50 -7.582 -15.032 0.704 1.00 74.45 C ATOM 793 O LEU A 50 -8.293 -16.011 0.502 1.00 42.34 O ATOM 794 CB LEU A 50 -7.626 -12.958 -0.739 1.00 34.12 C ATOM 795 CG LEU A 50 -8.544 -12.919 -1.967 1.00 14.23 C ATOM 796 CD1 LEU A 50 -8.591 -14.263 -2.680 1.00 5.23 C ATOM 797 CD2 LEU A 50 -9.943 -12.387 -1.659 1.00 14.12 C ATOM 0 H LEU A 50 -7.231 -11.872 1.291 1.00 3.12 H new ATOM 0 HA LEU A 50 -9.203 -13.667 0.626 1.00 50.12 H new ATOM 0 HB2 LEU A 50 -7.345 -11.929 -0.513 1.00 34.12 H new ATOM 0 HB3 LEU A 50 -6.715 -13.480 -1.033 1.00 34.12 H new ATOM 0 HG LEU A 50 -8.097 -12.199 -2.653 1.00 14.23 H new ATOM 0 HD11 LEU A 50 -9.252 -14.194 -3.544 1.00 5.23 H new ATOM 0 HD12 LEU A 50 -7.589 -14.535 -3.011 1.00 5.23 H new ATOM 0 HD13 LEU A 50 -8.966 -15.025 -1.996 1.00 5.23 H new ATOM 0 HD21 LEU A 50 -10.541 -12.386 -2.571 1.00 14.12 H new ATOM 0 HD22 LEU A 50 -10.419 -13.025 -0.914 1.00 14.12 H new ATOM 0 HD23 LEU A 50 -9.869 -11.371 -1.273 1.00 14.12 H new ATOM 809 N LEU A 51 -6.301 -15.151 1.053 1.00 31.24 N ATOM 810 CA LEU A 51 -5.520 -16.383 1.081 1.00 71.45 C ATOM 811 C LEU A 51 -5.394 -16.949 2.493 1.00 34.42 C ATOM 812 O LEU A 51 -4.569 -17.833 2.725 1.00 33.14 O ATOM 813 CB LEU A 51 -4.123 -16.060 0.543 1.00 73.32 C ATOM 814 CG LEU A 51 -4.098 -15.585 -0.909 1.00 44.14 C ATOM 815 CD1 LEU A 51 -2.673 -15.154 -1.209 1.00 41.21 C ATOM 816 CD2 LEU A 51 -4.530 -16.658 -1.896 1.00 33.42 C ATOM 0 H LEU A 51 -5.751 -14.342 1.340 1.00 31.24 H new ATOM 0 HA LEU A 51 -6.024 -17.134 0.473 1.00 71.45 H new ATOM 0 HB2 LEU A 51 -3.674 -15.291 1.172 1.00 73.32 H new ATOM 0 HB3 LEU A 51 -3.499 -16.949 0.632 1.00 73.32 H new ATOM 0 HG LEU A 51 -4.810 -14.768 -1.025 1.00 44.14 H new ATOM 0 HD11 LEU A 51 -2.608 -14.806 -2.240 1.00 41.21 H new ATOM 0 HD12 LEU A 51 -2.387 -14.347 -0.534 1.00 41.21 H new ATOM 0 HD13 LEU A 51 -2.000 -16.000 -1.068 1.00 41.21 H new ATOM 0 HD21 LEU A 51 -4.490 -16.258 -2.909 1.00 33.42 H new ATOM 0 HD22 LEU A 51 -3.861 -17.515 -1.818 1.00 33.42 H new ATOM 0 HD23 LEU A 51 -5.549 -16.972 -1.669 1.00 33.42 H new ATOM 828 N SER A 52 -6.136 -16.390 3.449 1.00 21.53 N ATOM 829 CA SER A 52 -6.052 -16.701 4.868 1.00 51.14 C ATOM 830 C SER A 52 -7.450 -16.989 5.438 1.00 42.22 C ATOM 831 O SER A 52 -7.574 -17.189 6.644 1.00 1.04 O ATOM 832 CB SER A 52 -5.320 -15.531 5.551 1.00 30.54 C ATOM 833 OG SER A 52 -4.922 -15.812 6.881 1.00 13.40 O ATOM 0 H SER A 52 -6.839 -15.680 3.243 1.00 21.53 H new ATOM 0 HA SER A 52 -5.482 -17.611 5.054 1.00 51.14 H new ATOM 0 HB2 SER A 52 -4.439 -15.272 4.964 1.00 30.54 H new ATOM 0 HB3 SER A 52 -5.971 -14.657 5.552 1.00 30.54 H new ATOM 0 HG SER A 52 -5.609 -16.356 7.320 1.00 13.40 H new ATOM 839 N ASP A 53 -8.481 -17.009 4.585 1.00 54.44 N ATOM 840 CA ASP A 53 -9.902 -17.141 4.928 1.00 42.13 C ATOM 841 C ASP A 53 -10.372 -16.091 5.948 1.00 43.34 C ATOM 842 O ASP A 53 -11.194 -16.343 6.828 1.00 22.32 O ATOM 843 CB ASP A 53 -10.228 -18.592 5.312 1.00 51.15 C ATOM 844 CG ASP A 53 -11.726 -18.915 5.277 1.00 13.04 C ATOM 845 OD1 ASP A 53 -12.507 -18.151 4.655 1.00 33.54 O ATOM 846 OD2 ASP A 53 -12.089 -19.995 5.800 1.00 33.42 O ATOM 0 H ASP A 53 -8.337 -16.929 3.578 1.00 54.44 H new ATOM 0 HA ASP A 53 -10.491 -16.916 4.039 1.00 42.13 H new ATOM 0 HB2 ASP A 53 -9.704 -19.265 4.633 1.00 51.15 H new ATOM 0 HB3 ASP A 53 -9.846 -18.788 6.314 1.00 51.15 H new ATOM 851 N LYS A 54 -9.808 -14.888 5.840 1.00 13.33 N ATOM 852 CA LYS A 54 -10.125 -13.713 6.650 1.00 3.04 C ATOM 853 C LYS A 54 -11.135 -12.852 5.893 1.00 42.11 C ATOM 854 O LYS A 54 -11.780 -13.319 4.960 1.00 54.32 O ATOM 855 CB LYS A 54 -8.840 -12.955 6.992 1.00 63.55 C ATOM 856 CG LYS A 54 -7.756 -13.815 7.651 1.00 3.14 C ATOM 857 CD LYS A 54 -7.422 -13.364 9.054 1.00 2.33 C ATOM 858 CE LYS A 54 -6.664 -12.042 9.032 1.00 24.10 C ATOM 859 NZ LYS A 54 -6.719 -11.411 10.360 1.00 74.53 N ATOM 0 H LYS A 54 -9.081 -14.698 5.150 1.00 13.33 H new ATOM 0 HA LYS A 54 -10.578 -14.005 7.597 1.00 3.04 H new ATOM 0 HB2 LYS A 54 -8.436 -12.519 6.079 1.00 63.55 H new ATOM 0 HB3 LYS A 54 -9.086 -12.128 7.658 1.00 63.55 H new ATOM 0 HG2 LYS A 54 -8.088 -14.853 7.677 1.00 3.14 H new ATOM 0 HG3 LYS A 54 -6.854 -13.785 7.040 1.00 3.14 H new ATOM 0 HD2 LYS A 54 -8.339 -13.253 9.633 1.00 2.33 H new ATOM 0 HD3 LYS A 54 -6.821 -14.125 9.552 1.00 2.33 H new ATOM 0 HE2 LYS A 54 -5.627 -12.212 8.743 1.00 24.10 H new ATOM 0 HE3 LYS A 54 -7.097 -11.377 8.285 1.00 24.10 H new ATOM 0 HZ1 LYS A 54 -6.649 -10.379 10.257 1.00 74.53 H new ATOM 0 HZ2 LYS A 54 -7.619 -11.652 10.822 1.00 74.53 H new ATOM 0 HZ3 LYS A 54 -5.928 -11.755 10.941 1.00 74.53 H new ATOM 873 N SER A 55 -11.269 -11.593 6.306 1.00 12.14 N ATOM 874 CA SER A 55 -12.150 -10.600 5.704 1.00 65.54 C ATOM 875 C SER A 55 -11.364 -9.598 4.857 1.00 50.24 C ATOM 876 O SER A 55 -10.945 -8.548 5.349 1.00 52.15 O ATOM 877 CB SER A 55 -12.973 -9.933 6.806 1.00 5.32 C ATOM 878 OG SER A 55 -13.934 -9.028 6.304 1.00 41.14 O ATOM 0 H SER A 55 -10.746 -11.225 7.100 1.00 12.14 H new ATOM 0 HA SER A 55 -12.839 -11.088 5.015 1.00 65.54 H new ATOM 0 HB2 SER A 55 -13.477 -10.702 7.392 1.00 5.32 H new ATOM 0 HB3 SER A 55 -12.303 -9.404 7.483 1.00 5.32 H new ATOM 0 HG SER A 55 -14.432 -8.632 7.050 1.00 41.14 H new ATOM 884 N PRO A 56 -11.097 -9.904 3.580 1.00 11.00 N ATOM 885 CA PRO A 56 -10.463 -8.966 2.667 1.00 52.42 C ATOM 886 C PRO A 56 -11.288 -7.695 2.454 1.00 53.15 C ATOM 887 O PRO A 56 -10.716 -6.679 2.058 1.00 64.14 O ATOM 888 CB PRO A 56 -10.257 -9.748 1.370 1.00 30.51 C ATOM 889 CG PRO A 56 -11.258 -10.893 1.436 1.00 2.03 C ATOM 890 CD PRO A 56 -11.486 -11.126 2.905 1.00 70.35 C ATOM 0 HA PRO A 56 -9.519 -8.600 3.071 1.00 52.42 H new ATOM 0 HB2 PRO A 56 -10.434 -9.119 0.498 1.00 30.51 H new ATOM 0 HB3 PRO A 56 -9.236 -10.121 1.292 1.00 30.51 H new ATOM 0 HG2 PRO A 56 -12.187 -10.635 0.928 1.00 2.03 H new ATOM 0 HG3 PRO A 56 -10.867 -11.787 0.950 1.00 2.03 H new ATOM 0 HD2 PRO A 56 -12.531 -11.363 3.103 1.00 70.35 H new ATOM 0 HD3 PRO A 56 -10.895 -11.970 3.260 1.00 70.35 H new ATOM 898 N PHE A 57 -12.588 -7.731 2.754 1.00 14.44 N ATOM 899 CA PHE A 57 -13.540 -6.708 2.354 1.00 62.32 C ATOM 900 C PHE A 57 -14.094 -5.875 3.485 1.00 22.51 C ATOM 901 O PHE A 57 -15.094 -5.183 3.307 1.00 54.24 O ATOM 902 CB PHE A 57 -14.582 -7.332 1.414 1.00 61.55 C ATOM 903 CG PHE A 57 -13.940 -7.995 0.207 1.00 41.33 C ATOM 904 CD1 PHE A 57 -12.947 -7.313 -0.530 1.00 73.42 C ATOM 905 CD2 PHE A 57 -14.294 -9.307 -0.155 1.00 3.20 C ATOM 906 CE1 PHE A 57 -12.305 -7.938 -1.607 1.00 45.05 C ATOM 907 CE2 PHE A 57 -13.627 -9.938 -1.218 1.00 72.44 C ATOM 908 CZ PHE A 57 -12.624 -9.264 -1.934 1.00 70.24 C ATOM 0 H PHE A 57 -13.010 -8.488 3.292 1.00 14.44 H new ATOM 0 HA PHE A 57 -13.006 -5.944 1.790 1.00 62.32 H new ATOM 0 HB2 PHE A 57 -15.169 -8.069 1.962 1.00 61.55 H new ATOM 0 HB3 PHE A 57 -15.274 -6.560 1.077 1.00 61.55 H new ATOM 0 HD1 PHE A 57 -12.680 -6.302 -0.261 1.00 73.42 H new ATOM 0 HD2 PHE A 57 -15.074 -9.826 0.381 1.00 3.20 H new ATOM 0 HE1 PHE A 57 -11.567 -7.400 -2.184 1.00 45.05 H new ATOM 0 HE2 PHE A 57 -13.888 -10.951 -1.487 1.00 72.44 H new ATOM 0 HZ PHE A 57 -12.100 -9.765 -2.734 1.00 70.24 H new ATOM 918 N ASP A 58 -13.373 -5.855 4.606 1.00 30.32 N ATOM 919 CA ASP A 58 -13.854 -5.186 5.801 1.00 32.12 C ATOM 920 C ASP A 58 -13.968 -3.666 5.668 1.00 30.20 C ATOM 921 O ASP A 58 -14.681 -3.056 6.442 1.00 2.24 O ATOM 922 CB ASP A 58 -12.938 -5.479 7.003 1.00 73.34 C ATOM 923 CG ASP A 58 -13.663 -5.727 8.331 1.00 70.24 C ATOM 924 OD1 ASP A 58 -14.899 -5.927 8.372 1.00 50.13 O ATOM 925 OD2 ASP A 58 -12.952 -5.847 9.352 1.00 65.22 O ATOM 0 H ASP A 58 -12.458 -6.294 4.705 1.00 30.32 H new ATOM 0 HA ASP A 58 -14.856 -5.588 5.953 1.00 32.12 H new ATOM 0 HB2 ASP A 58 -12.329 -6.353 6.771 1.00 73.34 H new ATOM 0 HB3 ASP A 58 -12.255 -4.640 7.132 1.00 73.34 H new ATOM 930 N HIS A 59 -13.207 -3.046 4.756 1.00 72.44 N ATOM 931 CA HIS A 59 -13.033 -1.594 4.582 1.00 52.11 C ATOM 932 C HIS A 59 -12.634 -0.800 5.835 1.00 22.51 C ATOM 933 O HIS A 59 -12.571 0.424 5.787 1.00 65.34 O ATOM 934 CB HIS A 59 -14.200 -0.974 3.797 1.00 12.44 C ATOM 935 CG HIS A 59 -15.493 -0.710 4.530 1.00 62.21 C ATOM 936 ND1 HIS A 59 -15.779 0.384 5.325 1.00 1.30 N ATOM 937 CD2 HIS A 59 -16.656 -1.409 4.347 1.00 53.01 C ATOM 938 CE1 HIS A 59 -17.094 0.341 5.605 1.00 13.02 C ATOM 939 NE2 HIS A 59 -17.674 -0.709 4.997 1.00 14.02 N ATOM 0 H HIS A 59 -12.662 -3.576 4.077 1.00 72.44 H new ATOM 0 HA HIS A 59 -12.137 -1.499 3.968 1.00 52.11 H new ATOM 0 HB2 HIS A 59 -13.855 -0.028 3.379 1.00 12.44 H new ATOM 0 HB3 HIS A 59 -14.422 -1.631 2.956 1.00 12.44 H new ATOM 0 HD1 HIS A 59 -15.116 1.092 5.641 1.00 1.30 H new ATOM 0 HD2 HIS A 59 -16.766 -2.333 3.800 1.00 53.01 H new ATOM 0 HE1 HIS A 59 -17.612 1.052 6.232 1.00 13.02 H new ATOM 947 N GLU A 60 -12.253 -1.469 6.917 1.00 72.54 N ATOM 948 CA GLU A 60 -12.049 -0.898 8.245 1.00 73.51 C ATOM 949 C GLU A 60 -10.578 -1.016 8.671 1.00 24.43 C ATOM 950 O GLU A 60 -10.234 -1.111 9.850 1.00 11.23 O ATOM 951 CB GLU A 60 -13.002 -1.629 9.187 1.00 30.14 C ATOM 952 CG GLU A 60 -14.478 -1.262 8.938 1.00 4.30 C ATOM 953 CD GLU A 60 -14.993 -0.217 9.916 1.00 73.54 C ATOM 954 OE1 GLU A 60 -14.340 0.844 10.062 1.00 32.54 O ATOM 955 OE2 GLU A 60 -15.999 -0.513 10.598 1.00 33.42 O ATOM 0 H GLU A 60 -12.069 -2.472 6.892 1.00 72.54 H new ATOM 0 HA GLU A 60 -12.267 0.170 8.262 1.00 73.51 H new ATOM 0 HB2 GLU A 60 -12.873 -2.705 9.065 1.00 30.14 H new ATOM 0 HB3 GLU A 60 -12.741 -1.391 10.218 1.00 30.14 H new ATOM 0 HG2 GLU A 60 -14.589 -0.888 7.920 1.00 4.30 H new ATOM 0 HG3 GLU A 60 -15.090 -2.160 9.016 1.00 4.30 H new ATOM 962 N THR A 61 -9.684 -1.006 7.692 1.00 65.14 N ATOM 963 CA THR A 61 -8.243 -0.971 7.885 1.00 32.13 C ATOM 964 C THR A 61 -7.691 0.270 7.178 1.00 3.23 C ATOM 965 O THR A 61 -8.424 0.935 6.447 1.00 2.02 O ATOM 966 CB THR A 61 -7.643 -2.320 7.439 1.00 72.44 C ATOM 967 OG1 THR A 61 -6.436 -2.538 8.141 1.00 41.35 O ATOM 968 CG2 THR A 61 -7.359 -2.391 5.939 1.00 70.21 C ATOM 0 H THR A 61 -9.953 -1.023 6.708 1.00 65.14 H new ATOM 0 HA THR A 61 -7.957 -0.866 8.932 1.00 32.13 H new ATOM 0 HB THR A 61 -8.384 -3.088 7.662 1.00 72.44 H new ATOM 0 HG1 THR A 61 -6.047 -3.394 7.866 1.00 41.35 H new ATOM 0 HG21 THR A 61 -6.938 -3.366 5.694 1.00 70.21 H new ATOM 0 HG22 THR A 61 -8.287 -2.247 5.386 1.00 70.21 H new ATOM 0 HG23 THR A 61 -6.649 -1.611 5.666 1.00 70.21 H new ATOM 976 N ASP A 62 -6.427 0.605 7.419 1.00 51.13 N ATOM 977 CA ASP A 62 -5.789 1.813 6.903 1.00 22.33 C ATOM 978 C ASP A 62 -5.641 1.780 5.379 1.00 21.42 C ATOM 979 O ASP A 62 -5.382 0.731 4.783 1.00 65.33 O ATOM 980 CB ASP A 62 -4.428 2.028 7.559 1.00 63.41 C ATOM 981 CG ASP A 62 -3.416 0.943 7.219 1.00 54.11 C ATOM 982 OD1 ASP A 62 -3.584 -0.228 7.637 1.00 3.23 O ATOM 983 OD2 ASP A 62 -2.351 1.309 6.667 1.00 52.21 O ATOM 0 H ASP A 62 -5.805 0.033 7.990 1.00 51.13 H new ATOM 0 HA ASP A 62 -6.441 2.650 7.153 1.00 22.33 H new ATOM 0 HB2 ASP A 62 -4.032 2.995 7.248 1.00 63.41 H new ATOM 0 HB3 ASP A 62 -4.556 2.069 8.641 1.00 63.41 H new ATOM 988 N ILE A 63 -5.769 2.950 4.750 1.00 13.23 N ATOM 989 CA ILE A 63 -5.834 3.116 3.308 1.00 52.04 C ATOM 990 C ILE A 63 -4.680 4.034 2.901 1.00 1.52 C ATOM 991 O ILE A 63 -4.849 5.248 2.807 1.00 24.22 O ATOM 992 CB ILE A 63 -7.236 3.615 2.868 1.00 72.14 C ATOM 993 CG1 ILE A 63 -8.402 2.777 3.427 1.00 50.44 C ATOM 994 CG2 ILE A 63 -7.383 3.677 1.342 1.00 74.41 C ATOM 995 CD1 ILE A 63 -8.442 1.302 2.991 1.00 10.12 C ATOM 0 H ILE A 63 -5.832 3.835 5.254 1.00 13.23 H new ATOM 0 HA ILE A 63 -5.711 2.166 2.787 1.00 52.04 H new ATOM 0 HB ILE A 63 -7.298 4.618 3.291 1.00 72.14 H new ATOM 0 HG12 ILE A 63 -8.360 2.812 4.516 1.00 50.44 H new ATOM 0 HG13 ILE A 63 -9.338 3.249 3.129 1.00 50.44 H new ATOM 0 HG21 ILE A 63 -8.381 4.032 1.087 1.00 74.41 H new ATOM 0 HG22 ILE A 63 -6.639 4.360 0.932 1.00 74.41 H new ATOM 0 HG23 ILE A 63 -7.233 2.683 0.921 1.00 74.41 H new ATOM 0 HD11 ILE A 63 -9.303 0.812 3.445 1.00 10.12 H new ATOM 0 HD12 ILE A 63 -8.522 1.246 1.905 1.00 10.12 H new ATOM 0 HD13 ILE A 63 -7.529 0.802 3.314 1.00 10.12 H new ATOM 1007 N ASP A 64 -3.508 3.449 2.650 1.00 31.43 N ATOM 1008 CA ASP A 64 -2.358 4.111 2.032 1.00 10.53 C ATOM 1009 C ASP A 64 -2.783 4.796 0.734 1.00 1.22 C ATOM 1010 O ASP A 64 -3.157 4.105 -0.219 1.00 43.25 O ATOM 1011 CB ASP A 64 -1.260 3.095 1.687 1.00 3.41 C ATOM 1012 CG ASP A 64 -0.036 3.145 2.591 1.00 74.05 C ATOM 1013 OD1 ASP A 64 0.492 4.254 2.815 1.00 73.32 O ATOM 1014 OD2 ASP A 64 0.447 2.079 3.038 1.00 42.53 O ATOM 0 H ASP A 64 -3.327 2.471 2.878 1.00 31.43 H new ATOM 0 HA ASP A 64 -1.976 4.840 2.746 1.00 10.53 H new ATOM 0 HB2 ASP A 64 -1.686 2.093 1.731 1.00 3.41 H new ATOM 0 HB3 ASP A 64 -0.941 3.261 0.658 1.00 3.41 H new ATOM 1019 N VAL A 65 -2.696 6.125 0.693 1.00 21.12 N ATOM 1020 CA VAL A 65 -2.875 6.941 -0.501 1.00 30.20 C ATOM 1021 C VAL A 65 -1.694 7.909 -0.571 1.00 42.25 C ATOM 1022 O VAL A 65 -1.792 9.056 -0.114 1.00 24.13 O ATOM 1023 CB VAL A 65 -4.221 7.681 -0.425 1.00 10.10 C ATOM 1024 CG1 VAL A 65 -4.516 8.559 -1.638 1.00 12.51 C ATOM 1025 CG2 VAL A 65 -5.436 6.765 -0.282 1.00 44.51 C ATOM 0 H VAL A 65 -2.491 6.681 1.523 1.00 21.12 H new ATOM 0 HA VAL A 65 -2.897 6.332 -1.405 1.00 30.20 H new ATOM 0 HB VAL A 65 -4.086 8.285 0.472 1.00 10.10 H new ATOM 0 HG11 VAL A 65 -5.482 9.046 -1.508 1.00 12.51 H new ATOM 0 HG12 VAL A 65 -3.738 9.316 -1.737 1.00 12.51 H new ATOM 0 HG13 VAL A 65 -4.539 7.942 -2.537 1.00 12.51 H new ATOM 0 HG21 VAL A 65 -6.343 7.368 -0.236 1.00 44.51 H new ATOM 0 HG22 VAL A 65 -5.489 6.095 -1.140 1.00 44.51 H new ATOM 0 HG23 VAL A 65 -5.344 6.178 0.632 1.00 44.51 H new ATOM 1035 N ILE A 66 -0.565 7.461 -1.122 1.00 22.43 N ATOM 1036 CA ILE A 66 0.544 8.370 -1.293 1.00 43.42 C ATOM 1037 C ILE A 66 0.272 9.278 -2.489 1.00 72.31 C ATOM 1038 O ILE A 66 -0.624 9.002 -3.296 1.00 33.34 O ATOM 1039 CB ILE A 66 1.829 7.573 -1.478 1.00 74.32 C ATOM 1040 CG1 ILE A 66 1.855 6.766 -2.789 1.00 23.43 C ATOM 1041 CG2 ILE A 66 2.061 6.618 -0.308 1.00 33.41 C ATOM 1042 CD1 ILE A 66 3.290 6.799 -3.288 1.00 61.42 C ATOM 0 H ILE A 66 -0.406 6.506 -1.444 1.00 22.43 H new ATOM 0 HA ILE A 66 0.659 8.997 -0.409 1.00 43.42 H new ATOM 0 HB ILE A 66 2.628 8.314 -1.520 1.00 74.32 H new ATOM 0 HG12 ILE A 66 1.527 5.740 -2.620 1.00 23.43 H new ATOM 0 HG13 ILE A 66 1.178 7.200 -3.525 1.00 23.43 H new ATOM 0 HG21 ILE A 66 2.985 6.063 -0.469 1.00 33.41 H new ATOM 0 HG22 ILE A 66 2.136 7.188 0.618 1.00 33.41 H new ATOM 0 HG23 ILE A 66 1.227 5.920 -0.237 1.00 33.41 H new ATOM 0 HD11 ILE A 66 3.364 6.239 -4.220 1.00 61.42 H new ATOM 0 HD12 ILE A 66 3.591 7.832 -3.461 1.00 61.42 H new ATOM 0 HD13 ILE A 66 3.945 6.350 -2.542 1.00 61.42 H new ATOM 1054 N PHE A 67 1.101 10.305 -2.671 1.00 5.31 N ATOM 1055 CA PHE A 67 1.109 11.117 -3.876 1.00 14.53 C ATOM 1056 C PHE A 67 2.442 11.870 -4.007 1.00 1.33 C ATOM 1057 O PHE A 67 3.305 11.762 -3.127 1.00 10.54 O ATOM 1058 CB PHE A 67 -0.118 12.044 -3.850 1.00 74.44 C ATOM 1059 CG PHE A 67 -0.112 13.213 -2.890 1.00 24.41 C ATOM 1060 CD1 PHE A 67 -0.171 12.989 -1.501 1.00 21.24 C ATOM 1061 CD2 PHE A 67 -0.188 14.525 -3.392 1.00 11.51 C ATOM 1062 CE1 PHE A 67 -0.297 14.081 -0.626 1.00 54.23 C ATOM 1063 CE2 PHE A 67 -0.272 15.617 -2.514 1.00 12.43 C ATOM 1064 CZ PHE A 67 -0.335 15.395 -1.132 1.00 12.13 C ATOM 0 H PHE A 67 1.790 10.595 -1.977 1.00 5.31 H new ATOM 0 HA PHE A 67 1.034 10.492 -4.766 1.00 14.53 H new ATOM 0 HB2 PHE A 67 -0.257 12.440 -4.856 1.00 74.44 H new ATOM 0 HB3 PHE A 67 -0.992 11.433 -3.625 1.00 74.44 H new ATOM 0 HD1 PHE A 67 -0.120 11.983 -1.110 1.00 21.24 H new ATOM 0 HD2 PHE A 67 -0.182 14.693 -4.459 1.00 11.51 H new ATOM 0 HE1 PHE A 67 -0.365 13.912 0.439 1.00 54.23 H new ATOM 0 HE2 PHE A 67 -0.288 16.625 -2.902 1.00 12.43 H new ATOM 0 HZ PHE A 67 -0.413 16.232 -0.454 1.00 12.13 H new ATOM 1074 N PHE A 68 2.639 12.607 -5.104 1.00 12.42 N ATOM 1075 CA PHE A 68 3.838 13.397 -5.375 1.00 64.31 C ATOM 1076 C PHE A 68 3.385 14.720 -5.975 1.00 34.13 C ATOM 1077 O PHE A 68 3.063 14.773 -7.159 1.00 54.34 O ATOM 1078 CB PHE A 68 4.780 12.662 -6.348 1.00 3.54 C ATOM 1079 CG PHE A 68 6.056 13.425 -6.675 1.00 14.11 C ATOM 1080 CD1 PHE A 68 7.163 13.357 -5.806 1.00 65.21 C ATOM 1081 CD2 PHE A 68 6.132 14.217 -7.840 1.00 43.41 C ATOM 1082 CE1 PHE A 68 8.336 14.076 -6.100 1.00 43.24 C ATOM 1083 CE2 PHE A 68 7.298 14.952 -8.123 1.00 71.42 C ATOM 1084 CZ PHE A 68 8.399 14.882 -7.251 1.00 44.24 C ATOM 0 H PHE A 68 1.946 12.671 -5.849 1.00 12.42 H new ATOM 0 HA PHE A 68 4.395 13.560 -4.452 1.00 64.31 H new ATOM 0 HB2 PHE A 68 5.047 11.697 -5.918 1.00 3.54 H new ATOM 0 HB3 PHE A 68 4.242 12.461 -7.275 1.00 3.54 H new ATOM 0 HD1 PHE A 68 7.111 12.752 -4.913 1.00 65.21 H new ATOM 0 HD2 PHE A 68 5.292 14.259 -8.517 1.00 43.41 H new ATOM 0 HE1 PHE A 68 9.189 14.009 -5.441 1.00 43.24 H new ATOM 0 HE2 PHE A 68 7.347 15.569 -9.008 1.00 71.42 H new ATOM 0 HZ PHE A 68 9.294 15.448 -7.465 1.00 44.24 H new ATOM 1094 N ASP A 69 3.347 15.780 -5.172 1.00 32.32 N ATOM 1095 CA ASP A 69 2.979 17.117 -5.633 1.00 2.31 C ATOM 1096 C ASP A 69 3.874 18.137 -4.968 1.00 13.51 C ATOM 1097 O ASP A 69 3.557 18.594 -3.866 1.00 63.25 O ATOM 1098 CB ASP A 69 1.522 17.463 -5.389 1.00 34.24 C ATOM 1099 CG ASP A 69 0.718 17.010 -6.581 1.00 5.30 C ATOM 1100 OD1 ASP A 69 0.962 17.568 -7.676 1.00 52.45 O ATOM 1101 OD2 ASP A 69 -0.122 16.110 -6.402 1.00 12.41 O ATOM 0 H ASP A 69 3.572 15.736 -4.178 1.00 32.32 H new ATOM 0 HA ASP A 69 3.116 17.131 -6.714 1.00 2.31 H new ATOM 0 HB2 ASP A 69 1.163 16.975 -4.482 1.00 34.24 H new ATOM 0 HB3 ASP A 69 1.407 18.537 -5.240 1.00 34.24 H new ATOM 1106 N PRO A 70 5.045 18.420 -5.548 1.00 23.00 N ATOM 1107 CA PRO A 70 5.961 19.411 -5.013 1.00 4.23 C ATOM 1108 C PRO A 70 5.378 20.825 -5.089 1.00 72.22 C ATOM 1109 O PRO A 70 5.866 21.712 -4.396 1.00 33.23 O ATOM 1110 CB PRO A 70 7.248 19.251 -5.831 1.00 5.40 C ATOM 1111 CG PRO A 70 6.738 18.693 -7.161 1.00 63.34 C ATOM 1112 CD PRO A 70 5.578 17.813 -6.753 1.00 34.13 C ATOM 0 HA PRO A 70 6.153 19.259 -3.951 1.00 4.23 H new ATOM 0 HB2 PRO A 70 7.764 20.202 -5.963 1.00 5.40 H new ATOM 0 HB3 PRO A 70 7.951 18.571 -5.350 1.00 5.40 H new ATOM 0 HG2 PRO A 70 6.420 19.489 -7.835 1.00 63.34 H new ATOM 0 HG3 PRO A 70 7.510 18.125 -7.680 1.00 63.34 H new ATOM 0 HD2 PRO A 70 4.823 17.768 -7.538 1.00 34.13 H new ATOM 0 HD3 PRO A 70 5.906 16.790 -6.567 1.00 34.13 H new ATOM 1120 N ASP A 71 4.328 21.045 -5.889 1.00 41.42 N ATOM 1121 CA ASP A 71 3.651 22.338 -5.984 1.00 45.44 C ATOM 1122 C ASP A 71 2.544 22.514 -4.935 1.00 10.24 C ATOM 1123 O ASP A 71 2.046 23.631 -4.775 1.00 63.35 O ATOM 1124 CB ASP A 71 3.091 22.522 -7.402 1.00 45.54 C ATOM 1125 CG ASP A 71 2.809 23.992 -7.712 1.00 63.43 C ATOM 1126 OD1 ASP A 71 3.795 24.770 -7.686 1.00 52.44 O ATOM 1127 OD2 ASP A 71 1.636 24.338 -7.974 1.00 4.54 O ATOM 0 H ASP A 71 3.925 20.326 -6.490 1.00 41.42 H new ATOM 0 HA ASP A 71 4.392 23.110 -5.776 1.00 45.44 H new ATOM 0 HB2 ASP A 71 3.802 22.127 -8.128 1.00 45.54 H new ATOM 0 HB3 ASP A 71 2.172 21.945 -7.508 1.00 45.54 H new ATOM 1132 N PHE A 72 2.167 21.444 -4.216 1.00 23.33 N ATOM 1133 CA PHE A 72 1.124 21.492 -3.184 1.00 53.35 C ATOM 1134 C PHE A 72 1.788 21.758 -1.830 1.00 2.41 C ATOM 1135 O PHE A 72 2.842 21.177 -1.519 1.00 70.14 O ATOM 1136 CB PHE A 72 0.383 20.140 -3.164 1.00 32.14 C ATOM 1137 CG PHE A 72 -1.021 20.171 -2.598 1.00 52.53 C ATOM 1138 CD1 PHE A 72 -2.071 20.625 -3.418 1.00 21.23 C ATOM 1139 CD2 PHE A 72 -1.299 19.749 -1.283 1.00 53.35 C ATOM 1140 CE1 PHE A 72 -3.389 20.642 -2.937 1.00 11.11 C ATOM 1141 CE2 PHE A 72 -2.630 19.705 -0.827 1.00 42.14 C ATOM 1142 CZ PHE A 72 -3.675 20.163 -1.647 1.00 3.24 C ATOM 0 H PHE A 72 2.580 20.519 -4.336 1.00 23.33 H new ATOM 0 HA PHE A 72 0.408 22.286 -3.394 1.00 53.35 H new ATOM 0 HB2 PHE A 72 0.336 19.757 -4.183 1.00 32.14 H new ATOM 0 HB3 PHE A 72 0.974 19.431 -2.584 1.00 32.14 H new ATOM 0 HD1 PHE A 72 -1.861 20.962 -4.422 1.00 21.23 H new ATOM 0 HD2 PHE A 72 -0.492 19.460 -0.626 1.00 53.35 H new ATOM 0 HE1 PHE A 72 -4.185 21.024 -3.559 1.00 11.11 H new ATOM 0 HE2 PHE A 72 -2.849 19.318 0.157 1.00 42.14 H new ATOM 0 HZ PHE A 72 -4.693 20.147 -1.288 1.00 3.24 H new ATOM 1152 N SER A 73 1.166 22.628 -1.027 1.00 24.24 N ATOM 1153 CA SER A 73 1.813 23.075 0.200 1.00 33.20 C ATOM 1154 C SER A 73 1.918 21.943 1.226 1.00 5.12 C ATOM 1155 O SER A 73 1.067 21.042 1.267 1.00 14.13 O ATOM 1156 CB SER A 73 1.059 24.277 0.770 1.00 72.34 C ATOM 1157 OG SER A 73 0.619 25.145 -0.262 1.00 21.03 O ATOM 0 H SER A 73 0.242 23.024 -1.201 1.00 24.24 H new ATOM 0 HA SER A 73 2.833 23.380 -0.036 1.00 33.20 H new ATOM 0 HB2 SER A 73 0.202 23.931 1.347 1.00 72.34 H new ATOM 0 HB3 SER A 73 1.706 24.823 1.456 1.00 72.34 H new ATOM 0 HG SER A 73 0.139 25.903 0.131 1.00 21.03 H new ATOM 1163 N TYR A 74 2.947 22.030 2.080 1.00 50.15 N ATOM 1164 CA TYR A 74 3.132 21.114 3.184 1.00 53.53 C ATOM 1165 C TYR A 74 1.865 21.083 4.006 1.00 50.21 C ATOM 1166 O TYR A 74 1.374 19.986 4.237 1.00 63.01 O ATOM 1167 CB TYR A 74 4.342 21.523 4.034 1.00 72.15 C ATOM 1168 CG TYR A 74 4.770 20.488 5.058 1.00 42.13 C ATOM 1169 CD1 TYR A 74 3.989 20.216 6.199 1.00 23.30 C ATOM 1170 CD2 TYR A 74 5.991 19.818 4.885 1.00 42.35 C ATOM 1171 CE1 TYR A 74 4.404 19.248 7.132 1.00 54.25 C ATOM 1172 CE2 TYR A 74 6.430 18.877 5.825 1.00 5.23 C ATOM 1173 CZ TYR A 74 5.638 18.584 6.952 1.00 32.44 C ATOM 1174 OH TYR A 74 6.079 17.686 7.873 1.00 21.01 O ATOM 0 H TYR A 74 3.671 22.746 2.013 1.00 50.15 H new ATOM 0 HA TYR A 74 3.335 20.113 2.803 1.00 53.53 H new ATOM 0 HB2 TYR A 74 5.183 21.729 3.371 1.00 72.15 H new ATOM 0 HB3 TYR A 74 4.109 22.453 4.552 1.00 72.15 H new ATOM 0 HD1 TYR A 74 3.066 20.754 6.358 1.00 23.30 H new ATOM 0 HD2 TYR A 74 6.599 20.030 4.018 1.00 42.35 H new ATOM 0 HE1 TYR A 74 3.781 19.013 7.983 1.00 54.25 H new ATOM 0 HE2 TYR A 74 7.376 18.376 5.685 1.00 5.23 H new ATOM 0 HH TYR A 74 7.045 17.558 7.769 1.00 21.01 H new ATOM 1184 N GLU A 75 1.354 22.239 4.441 1.00 13.43 N ATOM 1185 CA GLU A 75 0.245 22.277 5.371 1.00 45.11 C ATOM 1186 C GLU A 75 -1.020 21.745 4.717 1.00 31.01 C ATOM 1187 O GLU A 75 -1.652 20.868 5.297 1.00 71.31 O ATOM 1188 CB GLU A 75 0.055 23.703 5.893 1.00 13.22 C ATOM 1189 CG GLU A 75 -0.459 23.610 7.318 1.00 73.22 C ATOM 1190 CD GLU A 75 -0.476 24.956 8.025 1.00 65.41 C ATOM 1191 OE1 GLU A 75 -1.292 25.833 7.694 1.00 5.50 O ATOM 1192 OE2 GLU A 75 0.297 25.101 9.004 1.00 32.04 O ATOM 0 H GLU A 75 1.698 23.156 4.158 1.00 13.43 H new ATOM 0 HA GLU A 75 0.466 21.631 6.221 1.00 45.11 H new ATOM 0 HB2 GLU A 75 0.997 24.250 5.862 1.00 13.22 H new ATOM 0 HB3 GLU A 75 -0.651 24.248 5.267 1.00 13.22 H new ATOM 0 HG2 GLU A 75 -1.467 23.196 7.310 1.00 73.22 H new ATOM 0 HG3 GLU A 75 0.166 22.917 7.881 1.00 73.22 H new ATOM 1199 N GLU A 76 -1.347 22.218 3.507 1.00 43.45 N ATOM 1200 CA GLU A 76 -2.537 21.840 2.752 1.00 51.24 C ATOM 1201 C GLU A 76 -2.665 20.334 2.592 1.00 51.11 C ATOM 1202 O GLU A 76 -3.788 19.841 2.497 1.00 2.33 O ATOM 1203 CB GLU A 76 -2.467 22.425 1.343 1.00 3.32 C ATOM 1204 CG GLU A 76 -2.674 23.946 1.332 1.00 24.32 C ATOM 1205 CD GLU A 76 -3.710 24.434 0.322 1.00 24.00 C ATOM 1206 OE1 GLU A 76 -4.198 23.628 -0.503 1.00 50.35 O ATOM 1207 OE2 GLU A 76 -4.023 25.646 0.326 1.00 21.41 O ATOM 0 H GLU A 76 -0.767 22.897 3.015 1.00 43.45 H new ATOM 0 HA GLU A 76 -3.390 22.223 3.312 1.00 51.24 H new ATOM 0 HB2 GLU A 76 -1.498 22.189 0.902 1.00 3.32 H new ATOM 0 HB3 GLU A 76 -3.225 21.953 0.718 1.00 3.32 H new ATOM 0 HG2 GLU A 76 -2.977 24.266 2.329 1.00 24.32 H new ATOM 0 HG3 GLU A 76 -1.720 24.429 1.118 1.00 24.32 H new ATOM 1214 N THR A 77 -1.542 19.615 2.574 1.00 5.31 N ATOM 1215 CA THR A 77 -1.508 18.163 2.586 1.00 4.53 C ATOM 1216 C THR A 77 -2.264 17.639 3.820 1.00 33.11 C ATOM 1217 O THR A 77 -3.162 16.805 3.691 1.00 62.02 O ATOM 1218 CB THR A 77 -0.039 17.704 2.544 1.00 71.25 C ATOM 1219 OG1 THR A 77 0.677 18.218 1.429 1.00 25.34 O ATOM 1220 CG2 THR A 77 0.080 16.183 2.498 1.00 73.25 C ATOM 0 H THR A 77 -0.615 20.040 2.550 1.00 5.31 H new ATOM 0 HA THR A 77 -2.010 17.751 1.711 1.00 4.53 H new ATOM 0 HB THR A 77 0.396 18.097 3.463 1.00 71.25 H new ATOM 0 HG1 THR A 77 0.790 19.186 1.531 1.00 25.34 H new ATOM 0 HG21 THR A 77 1.133 15.901 2.469 1.00 73.25 H new ATOM 0 HG22 THR A 77 -0.386 15.755 3.385 1.00 73.25 H new ATOM 0 HG23 THR A 77 -0.421 15.806 1.607 1.00 73.25 H new ATOM 1228 N LEU A 78 -1.920 18.131 5.014 1.00 25.44 N ATOM 1229 CA LEU A 78 -2.548 17.729 6.271 1.00 24.14 C ATOM 1230 C LEU A 78 -4.000 18.198 6.321 1.00 72.54 C ATOM 1231 O LEU A 78 -4.840 17.519 6.906 1.00 74.55 O ATOM 1232 CB LEU A 78 -1.817 18.302 7.507 1.00 62.42 C ATOM 1233 CG LEU A 78 -0.330 17.935 7.734 1.00 14.52 C ATOM 1234 CD1 LEU A 78 0.115 16.642 7.042 1.00 22.02 C ATOM 1235 CD2 LEU A 78 0.555 19.078 7.259 1.00 12.30 C ATOM 0 H LEU A 78 -1.187 18.830 5.134 1.00 25.44 H new ATOM 0 HA LEU A 78 -2.493 16.641 6.303 1.00 24.14 H new ATOM 0 HB2 LEU A 78 -1.884 19.389 7.455 1.00 62.42 H new ATOM 0 HB3 LEU A 78 -2.372 17.990 8.392 1.00 62.42 H new ATOM 0 HG LEU A 78 -0.226 17.765 8.806 1.00 14.52 H new ATOM 0 HD11 LEU A 78 1.169 16.460 7.253 1.00 22.02 H new ATOM 0 HD12 LEU A 78 -0.479 15.807 7.414 1.00 22.02 H new ATOM 0 HD13 LEU A 78 -0.028 16.738 5.966 1.00 22.02 H new ATOM 0 HD21 LEU A 78 1.602 18.819 7.419 1.00 12.30 H new ATOM 0 HD22 LEU A 78 0.383 19.254 6.197 1.00 12.30 H new ATOM 0 HD23 LEU A 78 0.315 19.981 7.820 1.00 12.30 H new ATOM 1247 N LEU A 79 -4.316 19.356 5.746 1.00 21.33 N ATOM 1248 CA LEU A 79 -5.669 19.870 5.697 1.00 25.52 C ATOM 1249 C LEU A 79 -6.557 18.945 4.870 1.00 14.12 C ATOM 1250 O LEU A 79 -7.621 18.522 5.315 1.00 5.24 O ATOM 1251 CB LEU A 79 -5.635 21.288 5.121 1.00 44.25 C ATOM 1252 CG LEU A 79 -4.670 22.281 5.788 1.00 22.24 C ATOM 1253 CD1 LEU A 79 -4.965 23.701 5.331 1.00 11.03 C ATOM 1254 CD2 LEU A 79 -4.669 22.177 7.308 1.00 14.31 C ATOM 0 H LEU A 79 -3.629 19.964 5.299 1.00 21.33 H new ATOM 0 HA LEU A 79 -6.094 19.910 6.700 1.00 25.52 H new ATOM 0 HB2 LEU A 79 -5.376 21.220 4.064 1.00 44.25 H new ATOM 0 HB3 LEU A 79 -6.642 21.702 5.177 1.00 44.25 H new ATOM 0 HG LEU A 79 -3.664 22.012 5.466 1.00 22.24 H new ATOM 0 HD11 LEU A 79 -4.272 24.390 5.814 1.00 11.03 H new ATOM 0 HD12 LEU A 79 -4.848 23.767 4.249 1.00 11.03 H new ATOM 0 HD13 LEU A 79 -5.987 23.965 5.602 1.00 11.03 H new ATOM 0 HD21 LEU A 79 -3.969 22.902 7.722 1.00 14.31 H new ATOM 0 HD22 LEU A 79 -5.670 22.382 7.687 1.00 14.31 H new ATOM 0 HD23 LEU A 79 -4.367 21.172 7.604 1.00 14.31 H new ATOM 1266 N LEU A 80 -6.084 18.591 3.680 1.00 25.43 N ATOM 1267 CA LEU A 80 -6.780 17.720 2.741 1.00 74.21 C ATOM 1268 C LEU A 80 -7.009 16.328 3.342 1.00 51.31 C ATOM 1269 O LEU A 80 -8.064 15.734 3.128 1.00 65.23 O ATOM 1270 CB LEU A 80 -5.985 17.667 1.427 1.00 62.45 C ATOM 1271 CG LEU A 80 -6.591 16.748 0.350 1.00 4.24 C ATOM 1272 CD1 LEU A 80 -8.032 17.112 -0.011 1.00 73.25 C ATOM 1273 CD2 LEU A 80 -5.732 16.824 -0.913 1.00 10.12 C ATOM 0 H LEU A 80 -5.180 18.911 3.333 1.00 25.43 H new ATOM 0 HA LEU A 80 -7.770 18.124 2.529 1.00 74.21 H new ATOM 0 HB2 LEU A 80 -5.907 18.676 1.023 1.00 62.45 H new ATOM 0 HB3 LEU A 80 -4.971 17.332 1.644 1.00 62.45 H new ATOM 0 HG LEU A 80 -6.606 15.740 0.763 1.00 4.24 H new ATOM 0 HD11 LEU A 80 -8.400 16.427 -0.775 1.00 73.25 H new ATOM 0 HD12 LEU A 80 -8.660 17.037 0.877 1.00 73.25 H new ATOM 0 HD13 LEU A 80 -8.065 18.132 -0.393 1.00 73.25 H new ATOM 0 HD21 LEU A 80 -6.155 16.176 -1.680 1.00 10.12 H new ATOM 0 HD22 LEU A 80 -5.711 17.851 -1.277 1.00 10.12 H new ATOM 0 HD23 LEU A 80 -4.717 16.499 -0.683 1.00 10.12 H new ATOM 1285 N GLU A 81 -6.065 15.817 4.131 1.00 5.00 N ATOM 1286 CA GLU A 81 -6.222 14.568 4.871 1.00 30.13 C ATOM 1287 C GLU A 81 -7.476 14.628 5.747 1.00 41.15 C ATOM 1288 O GLU A 81 -8.307 13.720 5.691 1.00 72.14 O ATOM 1289 CB GLU A 81 -4.972 14.347 5.724 1.00 25.24 C ATOM 1290 CG GLU A 81 -4.969 13.069 6.571 1.00 74.33 C ATOM 1291 CD GLU A 81 -4.239 13.316 7.894 1.00 11.02 C ATOM 1292 OE1 GLU A 81 -4.791 14.056 8.753 1.00 43.01 O ATOM 1293 OE2 GLU A 81 -3.115 12.810 8.077 1.00 34.34 O ATOM 0 H GLU A 81 -5.160 16.264 4.275 1.00 5.00 H new ATOM 0 HA GLU A 81 -6.339 13.735 4.178 1.00 30.13 H new ATOM 0 HB2 GLU A 81 -4.103 14.328 5.066 1.00 25.24 H new ATOM 0 HB3 GLU A 81 -4.851 15.203 6.388 1.00 25.24 H new ATOM 0 HG2 GLU A 81 -5.993 12.750 6.766 1.00 74.33 H new ATOM 0 HG3 GLU A 81 -4.482 12.262 6.023 1.00 74.33 H new ATOM 1300 N LYS A 82 -7.675 15.699 6.533 1.00 30.24 N ATOM 1301 CA LYS A 82 -8.841 15.731 7.407 1.00 12.20 C ATOM 1302 C LYS A 82 -10.106 15.698 6.539 1.00 53.33 C ATOM 1303 O LYS A 82 -11.076 15.042 6.892 1.00 10.01 O ATOM 1304 CB LYS A 82 -8.777 16.959 8.341 1.00 4.01 C ATOM 1305 CG LYS A 82 -9.565 18.190 7.860 1.00 14.01 C ATOM 1306 CD LYS A 82 -8.974 19.517 8.317 1.00 70.21 C ATOM 1307 CE LYS A 82 -10.005 20.631 8.060 1.00 43.12 C ATOM 1308 NZ LYS A 82 -11.088 20.675 9.059 1.00 14.02 N ATOM 0 H LYS A 82 -7.068 16.518 6.577 1.00 30.24 H new ATOM 0 HA LYS A 82 -8.861 14.857 8.058 1.00 12.20 H new ATOM 0 HB2 LYS A 82 -9.151 16.669 9.323 1.00 4.01 H new ATOM 0 HB3 LYS A 82 -7.733 17.244 8.470 1.00 4.01 H new ATOM 0 HG2 LYS A 82 -9.609 18.179 6.771 1.00 14.01 H new ATOM 0 HG3 LYS A 82 -10.591 18.117 8.221 1.00 14.01 H new ATOM 0 HD2 LYS A 82 -8.721 19.473 9.376 1.00 70.21 H new ATOM 0 HD3 LYS A 82 -8.050 19.725 7.777 1.00 70.21 H new ATOM 0 HE2 LYS A 82 -9.493 21.593 8.049 1.00 43.12 H new ATOM 0 HE3 LYS A 82 -10.440 20.490 7.071 1.00 43.12 H new ATOM 0 HZ1 LYS A 82 -11.667 21.525 8.906 1.00 14.02 H new ATOM 0 HZ2 LYS A 82 -11.684 19.828 8.962 1.00 14.02 H new ATOM 0 HZ3 LYS A 82 -10.678 20.703 10.014 1.00 14.02 H new ATOM 1322 N LYS A 83 -10.098 16.362 5.374 1.00 53.01 N ATOM 1323 CA LYS A 83 -11.241 16.469 4.481 1.00 72.33 C ATOM 1324 C LYS A 83 -11.622 15.099 3.953 1.00 74.42 C ATOM 1325 O LYS A 83 -12.813 14.823 3.797 1.00 24.23 O ATOM 1326 CB LYS A 83 -10.902 17.466 3.367 1.00 63.22 C ATOM 1327 CG LYS A 83 -12.072 17.740 2.414 1.00 45.05 C ATOM 1328 CD LYS A 83 -11.822 17.229 0.982 1.00 3.30 C ATOM 1329 CE LYS A 83 -11.938 15.710 0.804 1.00 65.52 C ATOM 1330 NZ LYS A 83 -13.334 15.251 0.952 1.00 1.04 N ATOM 0 H LYS A 83 -9.272 16.849 5.026 1.00 53.01 H new ATOM 0 HA LYS A 83 -12.114 16.846 5.013 1.00 72.33 H new ATOM 0 HB2 LYS A 83 -10.582 18.406 3.817 1.00 63.22 H new ATOM 0 HB3 LYS A 83 -10.058 17.084 2.793 1.00 63.22 H new ATOM 0 HG2 LYS A 83 -12.972 17.268 2.809 1.00 45.05 H new ATOM 0 HG3 LYS A 83 -12.262 18.813 2.382 1.00 45.05 H new ATOM 0 HD2 LYS A 83 -12.532 17.713 0.311 1.00 3.30 H new ATOM 0 HD3 LYS A 83 -10.825 17.541 0.670 1.00 3.30 H new ATOM 0 HE2 LYS A 83 -11.564 15.429 -0.181 1.00 65.52 H new ATOM 0 HE3 LYS A 83 -11.309 15.208 1.539 1.00 65.52 H new ATOM 0 HZ1 LYS A 83 -13.412 14.641 1.791 1.00 1.04 H new ATOM 0 HZ2 LYS A 83 -13.960 16.074 1.063 1.00 1.04 H new ATOM 0 HZ3 LYS A 83 -13.615 14.715 0.106 1.00 1.04 H new ATOM 1344 N LEU A 84 -10.647 14.251 3.627 1.00 43.14 N ATOM 1345 CA LEU A 84 -10.889 12.871 3.239 1.00 4.40 C ATOM 1346 C LEU A 84 -11.665 12.160 4.356 1.00 33.13 C ATOM 1347 O LEU A 84 -12.733 11.605 4.092 1.00 4.14 O ATOM 1348 CB LEU A 84 -9.529 12.211 2.954 1.00 64.13 C ATOM 1349 CG LEU A 84 -8.992 12.236 1.513 1.00 64.15 C ATOM 1350 CD1 LEU A 84 -9.447 10.991 0.747 1.00 3.02 C ATOM 1351 CD2 LEU A 84 -9.344 13.475 0.685 1.00 3.42 C ATOM 0 H LEU A 84 -9.660 14.509 3.626 1.00 43.14 H new ATOM 0 HA LEU A 84 -11.497 12.808 2.336 1.00 4.40 H new ATOM 0 HB2 LEU A 84 -8.787 12.690 3.593 1.00 64.13 H new ATOM 0 HB3 LEU A 84 -9.594 11.169 3.266 1.00 64.13 H new ATOM 0 HG LEU A 84 -7.910 12.261 1.642 1.00 64.15 H new ATOM 0 HD11 LEU A 84 -9.057 11.027 -0.270 1.00 3.02 H new ATOM 0 HD12 LEU A 84 -9.072 10.098 1.248 1.00 3.02 H new ATOM 0 HD13 LEU A 84 -10.536 10.960 0.717 1.00 3.02 H new ATOM 0 HD21 LEU A 84 -8.913 13.381 -0.312 1.00 3.42 H new ATOM 0 HD22 LEU A 84 -10.427 13.563 0.605 1.00 3.42 H new ATOM 0 HD23 LEU A 84 -8.943 14.364 1.172 1.00 3.42 H new ATOM 1363 N ARG A 85 -11.160 12.190 5.595 1.00 23.34 N ATOM 1364 CA ARG A 85 -11.731 11.485 6.730 1.00 54.23 C ATOM 1365 C ARG A 85 -13.051 12.074 7.211 1.00 63.51 C ATOM 1366 O ARG A 85 -13.868 11.339 7.752 1.00 2.10 O ATOM 1367 CB ARG A 85 -10.725 11.529 7.880 1.00 32.11 C ATOM 1368 CG ARG A 85 -9.365 10.900 7.542 1.00 63.15 C ATOM 1369 CD ARG A 85 -8.590 10.633 8.831 1.00 44.25 C ATOM 1370 NE ARG A 85 -9.082 9.400 9.475 1.00 25.20 N ATOM 1371 CZ ARG A 85 -8.429 8.608 10.331 1.00 12.14 C ATOM 1372 NH1 ARG A 85 -7.147 8.788 10.615 1.00 34.44 N ATOM 1373 NH2 ARG A 85 -9.091 7.612 10.901 1.00 21.31 N ATOM 0 H ARG A 85 -10.322 12.721 5.833 1.00 23.34 H new ATOM 0 HA ARG A 85 -11.940 10.466 6.405 1.00 54.23 H new ATOM 0 HB2 ARG A 85 -10.571 12.567 8.175 1.00 32.11 H new ATOM 0 HB3 ARG A 85 -11.149 11.012 8.741 1.00 32.11 H new ATOM 0 HG2 ARG A 85 -9.510 9.969 6.993 1.00 63.15 H new ATOM 0 HG3 ARG A 85 -8.795 11.567 6.895 1.00 63.15 H new ATOM 0 HD2 ARG A 85 -7.527 10.538 8.612 1.00 44.25 H new ATOM 0 HD3 ARG A 85 -8.701 11.477 9.512 1.00 44.25 H new ATOM 0 HE ARG A 85 -10.034 9.119 9.239 1.00 25.20 H new ATOM 0 HH11 ARG A 85 -6.629 9.549 10.176 1.00 34.44 H new ATOM 0 HH12 ARG A 85 -6.678 8.165 11.273 1.00 34.44 H new ATOM 0 HH21 ARG A 85 -10.076 7.464 10.683 1.00 21.31 H new ATOM 0 HH22 ARG A 85 -8.615 6.993 11.558 1.00 21.31 H new ATOM 1387 N GLU A 86 -13.272 13.380 7.097 1.00 61.24 N ATOM 1388 CA GLU A 86 -14.511 14.011 7.485 1.00 71.31 C ATOM 1389 C GLU A 86 -15.603 13.553 6.527 1.00 42.12 C ATOM 1390 O GLU A 86 -16.643 13.060 6.964 1.00 43.13 O ATOM 1391 CB GLU A 86 -14.350 15.536 7.402 1.00 72.32 C ATOM 1392 CG GLU A 86 -13.658 16.170 8.619 1.00 14.33 C ATOM 1393 CD GLU A 86 -13.575 17.701 8.512 1.00 52.25 C ATOM 1394 OE1 GLU A 86 -13.792 18.258 7.411 1.00 53.13 O ATOM 1395 OE2 GLU A 86 -13.252 18.386 9.512 1.00 42.23 O ATOM 0 H GLU A 86 -12.580 14.032 6.726 1.00 61.24 H new ATOM 0 HA GLU A 86 -14.775 13.737 8.506 1.00 71.31 H new ATOM 0 HB2 GLU A 86 -13.778 15.780 6.507 1.00 72.32 H new ATOM 0 HB3 GLU A 86 -15.335 15.987 7.284 1.00 72.32 H new ATOM 0 HG2 GLU A 86 -14.202 15.900 9.524 1.00 14.33 H new ATOM 0 HG3 GLU A 86 -12.653 15.760 8.717 1.00 14.33 H new ATOM 1402 N ASP A 87 -15.376 13.718 5.220 1.00 43.45 N ATOM 1403 CA ASP A 87 -16.406 13.454 4.217 1.00 22.23 C ATOM 1404 C ASP A 87 -16.774 11.973 4.216 1.00 61.14 C ATOM 1405 O ASP A 87 -17.919 11.614 3.964 1.00 73.25 O ATOM 1406 CB ASP A 87 -15.897 13.870 2.830 1.00 70.23 C ATOM 1407 CG ASP A 87 -16.928 14.570 1.949 1.00 22.42 C ATOM 1408 OD1 ASP A 87 -18.152 14.392 2.121 1.00 61.45 O ATOM 1409 OD2 ASP A 87 -16.448 15.358 1.101 1.00 43.31 O ATOM 0 H ASP A 87 -14.486 14.034 4.834 1.00 43.45 H new ATOM 0 HA ASP A 87 -17.296 14.035 4.461 1.00 22.23 H new ATOM 0 HB2 ASP A 87 -15.040 14.532 2.957 1.00 70.23 H new ATOM 0 HB3 ASP A 87 -15.539 12.982 2.309 1.00 70.23 H new ATOM 1414 N PHE A 88 -15.796 11.116 4.530 1.00 72.25 N ATOM 1415 CA PHE A 88 -15.909 9.673 4.465 1.00 25.21 C ATOM 1416 C PHE A 88 -15.230 9.058 5.697 1.00 2.00 C ATOM 1417 O PHE A 88 -14.105 8.567 5.588 1.00 63.32 O ATOM 1418 CB PHE A 88 -15.265 9.204 3.157 1.00 43.44 C ATOM 1419 CG PHE A 88 -15.694 9.959 1.916 1.00 71.52 C ATOM 1420 CD1 PHE A 88 -17.015 9.852 1.442 1.00 51.22 C ATOM 1421 CD2 PHE A 88 -14.739 10.692 1.185 1.00 72.15 C ATOM 1422 CE1 PHE A 88 -17.371 10.451 0.222 1.00 30.10 C ATOM 1423 CE2 PHE A 88 -15.097 11.284 -0.037 1.00 51.34 C ATOM 1424 CZ PHE A 88 -16.411 11.158 -0.523 1.00 10.03 C ATOM 0 H PHE A 88 -14.878 11.428 4.846 1.00 72.25 H new ATOM 0 HA PHE A 88 -16.951 9.353 4.472 1.00 25.21 H new ATOM 0 HB2 PHE A 88 -14.182 9.285 3.255 1.00 43.44 H new ATOM 0 HB3 PHE A 88 -15.494 8.148 3.017 1.00 43.44 H new ATOM 0 HD1 PHE A 88 -17.753 9.311 2.015 1.00 51.22 H new ATOM 0 HD2 PHE A 88 -13.733 10.799 1.564 1.00 72.15 H new ATOM 0 HE1 PHE A 88 -18.384 10.368 -0.144 1.00 30.10 H new ATOM 0 HE2 PHE A 88 -14.363 11.837 -0.604 1.00 51.34 H new ATOM 0 HZ PHE A 88 -16.682 11.604 -1.468 1.00 10.03 H new ATOM 1434 N PRO A 89 -15.892 9.049 6.866 1.00 23.44 N ATOM 1435 CA PRO A 89 -15.311 8.531 8.100 1.00 71.31 C ATOM 1436 C PRO A 89 -15.134 7.009 8.042 1.00 70.45 C ATOM 1437 O PRO A 89 -14.296 6.465 8.753 1.00 73.31 O ATOM 1438 CB PRO A 89 -16.291 8.938 9.205 1.00 61.21 C ATOM 1439 CG PRO A 89 -17.637 8.994 8.486 1.00 41.23 C ATOM 1440 CD PRO A 89 -17.263 9.468 7.085 1.00 50.45 C ATOM 0 HA PRO A 89 -14.313 8.933 8.276 1.00 71.31 H new ATOM 0 HB2 PRO A 89 -16.301 8.213 10.019 1.00 61.21 H new ATOM 0 HB3 PRO A 89 -16.028 9.902 9.640 1.00 61.21 H new ATOM 0 HG2 PRO A 89 -18.123 8.019 8.465 1.00 41.23 H new ATOM 0 HG3 PRO A 89 -18.326 9.683 8.974 1.00 41.23 H new ATOM 0 HD2 PRO A 89 -17.927 9.033 6.337 1.00 50.45 H new ATOM 0 HD3 PRO A 89 -17.356 10.551 7.003 1.00 50.45 H new ATOM 1448 N GLN A 90 -15.911 6.341 7.179 1.00 34.51 N ATOM 1449 CA GLN A 90 -16.030 4.894 7.031 1.00 1.32 C ATOM 1450 C GLN A 90 -14.747 4.241 6.500 1.00 30.41 C ATOM 1451 O GLN A 90 -14.657 3.011 6.462 1.00 13.32 O ATOM 1452 CB GLN A 90 -17.229 4.623 6.097 1.00 10.02 C ATOM 1453 CG GLN A 90 -16.925 4.913 4.620 1.00 11.00 C ATOM 1454 CD GLN A 90 -18.115 5.415 3.806 1.00 45.25 C ATOM 1455 OE1 GLN A 90 -19.233 4.924 3.909 1.00 52.11 O ATOM 1456 NE2 GLN A 90 -17.892 6.400 2.951 1.00 10.01 N ATOM 0 H GLN A 90 -16.513 6.837 6.522 1.00 34.51 H new ATOM 0 HA GLN A 90 -16.193 4.444 8.010 1.00 1.32 H new ATOM 0 HB2 GLN A 90 -17.533 3.581 6.201 1.00 10.02 H new ATOM 0 HB3 GLN A 90 -18.073 5.235 6.414 1.00 10.02 H new ATOM 0 HG2 GLN A 90 -16.128 5.655 4.567 1.00 11.00 H new ATOM 0 HG3 GLN A 90 -16.544 4.003 4.157 1.00 11.00 H new ATOM 0 HE21 GLN A 90 -16.959 6.804 2.871 1.00 10.01 H new ATOM 0 HE22 GLN A 90 -18.653 6.755 2.372 1.00 10.01 H new ATOM 1465 N TYR A 91 -13.771 5.046 6.068 1.00 62.24 N ATOM 1466 CA TYR A 91 -12.498 4.593 5.540 1.00 13.24 C ATOM 1467 C TYR A 91 -11.379 5.378 6.229 1.00 45.41 C ATOM 1468 O TYR A 91 -11.603 6.460 6.784 1.00 73.14 O ATOM 1469 CB TYR A 91 -12.427 4.821 4.024 1.00 42.11 C ATOM 1470 CG TYR A 91 -13.585 4.303 3.194 1.00 72.31 C ATOM 1471 CD1 TYR A 91 -13.950 2.946 3.248 1.00 23.51 C ATOM 1472 CD2 TYR A 91 -14.295 5.184 2.357 1.00 70.35 C ATOM 1473 CE1 TYR A 91 -15.022 2.471 2.471 1.00 63.13 C ATOM 1474 CE2 TYR A 91 -15.337 4.708 1.546 1.00 61.15 C ATOM 1475 CZ TYR A 91 -15.717 3.350 1.613 1.00 2.42 C ATOM 1476 OH TYR A 91 -16.791 2.917 0.902 1.00 31.53 O ATOM 0 H TYR A 91 -13.857 6.062 6.080 1.00 62.24 H new ATOM 0 HA TYR A 91 -12.388 3.525 5.731 1.00 13.24 H new ATOM 0 HB2 TYR A 91 -12.336 5.893 3.847 1.00 42.11 H new ATOM 0 HB3 TYR A 91 -11.512 4.358 3.655 1.00 42.11 H new ATOM 0 HD1 TYR A 91 -13.406 2.267 3.888 1.00 23.51 H new ATOM 0 HD2 TYR A 91 -14.037 6.232 2.339 1.00 70.35 H new ATOM 0 HE1 TYR A 91 -15.313 1.433 2.531 1.00 63.13 H new ATOM 0 HE2 TYR A 91 -15.847 5.380 0.872 1.00 61.15 H new ATOM 0 HH TYR A 91 -17.147 3.655 0.365 1.00 31.53 H new ATOM 1486 N GLN A 92 -10.154 4.870 6.120 1.00 21.52 N ATOM 1487 CA GLN A 92 -8.989 5.338 6.852 1.00 23.32 C ATOM 1488 C GLN A 92 -7.896 5.809 5.895 1.00 1.22 C ATOM 1489 O GLN A 92 -6.748 5.378 5.972 1.00 70.31 O ATOM 1490 CB GLN A 92 -8.509 4.216 7.776 1.00 30.54 C ATOM 1491 CG GLN A 92 -9.527 3.794 8.832 1.00 22.50 C ATOM 1492 CD GLN A 92 -8.824 3.029 9.942 1.00 72.31 C ATOM 1493 OE1 GLN A 92 -8.130 3.615 10.768 1.00 54.43 O ATOM 1494 NE2 GLN A 92 -8.976 1.724 9.986 1.00 13.21 N ATOM 0 H GLN A 92 -9.942 4.092 5.495 1.00 21.52 H new ATOM 0 HA GLN A 92 -9.253 6.202 7.462 1.00 23.32 H new ATOM 0 HB2 GLN A 92 -8.250 3.348 7.170 1.00 30.54 H new ATOM 0 HB3 GLN A 92 -7.596 4.539 8.277 1.00 30.54 H new ATOM 0 HG2 GLN A 92 -10.026 4.672 9.242 1.00 22.50 H new ATOM 0 HG3 GLN A 92 -10.298 3.171 8.379 1.00 22.50 H new ATOM 0 HE21 GLN A 92 -9.557 1.254 9.291 1.00 13.21 H new ATOM 0 HE22 GLN A 92 -8.513 1.181 10.715 1.00 13.21 H new ATOM 1503 N TRP A 93 -8.266 6.727 5.009 1.00 14.10 N ATOM 1504 CA TRP A 93 -7.421 7.481 4.091 1.00 30.14 C ATOM 1505 C TRP A 93 -6.164 8.019 4.799 1.00 5.43 C ATOM 1506 O TRP A 93 -6.262 8.901 5.650 1.00 13.34 O ATOM 1507 CB TRP A 93 -8.315 8.629 3.617 1.00 62.15 C ATOM 1508 CG TRP A 93 -9.630 8.235 3.026 1.00 13.03 C ATOM 1509 CD1 TRP A 93 -10.839 8.512 3.565 1.00 24.52 C ATOM 1510 CD2 TRP A 93 -9.893 7.492 1.798 1.00 43.41 C ATOM 1511 NE1 TRP A 93 -11.825 8.106 2.693 1.00 54.15 N ATOM 1512 CE2 TRP A 93 -11.302 7.456 1.594 1.00 32.11 C ATOM 1513 CE3 TRP A 93 -9.087 6.843 0.834 1.00 13.34 C ATOM 1514 CZ2 TRP A 93 -11.876 6.846 0.470 1.00 64.12 C ATOM 1515 CZ3 TRP A 93 -9.655 6.202 -0.282 1.00 43.21 C ATOM 1516 CH2 TRP A 93 -11.047 6.221 -0.473 1.00 31.23 C ATOM 0 H TRP A 93 -9.248 6.984 4.906 1.00 14.10 H new ATOM 0 HA TRP A 93 -7.055 6.867 3.269 1.00 30.14 H new ATOM 0 HB2 TRP A 93 -8.503 9.290 4.463 1.00 62.15 H new ATOM 0 HB3 TRP A 93 -7.765 9.209 2.876 1.00 62.15 H new ATOM 0 HD1 TRP A 93 -11.005 8.977 4.525 1.00 24.52 H new ATOM 0 HE1 TRP A 93 -12.821 8.266 2.842 1.00 54.15 H new ATOM 0 HE3 TRP A 93 -8.014 6.839 0.957 1.00 13.34 H new ATOM 0 HZ2 TRP A 93 -12.947 6.857 0.331 1.00 64.12 H new ATOM 0 HZ3 TRP A 93 -9.020 5.694 -0.993 1.00 43.21 H new ATOM 0 HH2 TRP A 93 -11.479 5.754 -1.346 1.00 31.23 H new ATOM 1527 N GLU A 94 -4.980 7.518 4.443 1.00 11.32 N ATOM 1528 CA GLU A 94 -3.674 7.953 4.933 1.00 71.43 C ATOM 1529 C GLU A 94 -3.041 8.787 3.820 1.00 53.34 C ATOM 1530 O GLU A 94 -2.486 8.220 2.878 1.00 3.53 O ATOM 1531 CB GLU A 94 -2.784 6.736 5.256 1.00 24.21 C ATOM 1532 CG GLU A 94 -3.364 5.790 6.315 1.00 14.30 C ATOM 1533 CD GLU A 94 -2.589 5.814 7.634 1.00 61.33 C ATOM 1534 OE1 GLU A 94 -2.507 6.885 8.274 1.00 25.31 O ATOM 1535 OE2 GLU A 94 -2.050 4.758 8.050 1.00 10.21 O ATOM 0 H GLU A 94 -4.904 6.757 3.768 1.00 11.32 H new ATOM 0 HA GLU A 94 -3.779 8.534 5.850 1.00 71.43 H new ATOM 0 HB2 GLU A 94 -2.612 6.173 4.339 1.00 24.21 H new ATOM 0 HB3 GLU A 94 -1.812 7.092 5.598 1.00 24.21 H new ATOM 0 HG2 GLU A 94 -4.402 6.062 6.506 1.00 14.30 H new ATOM 0 HG3 GLU A 94 -3.368 4.773 5.922 1.00 14.30 H new ATOM 1542 N LEU A 95 -3.209 10.115 3.831 1.00 64.32 N ATOM 1543 CA LEU A 95 -2.728 10.967 2.739 1.00 24.02 C ATOM 1544 C LEU A 95 -1.309 11.436 3.033 1.00 11.40 C ATOM 1545 O LEU A 95 -1.128 12.267 3.927 1.00 74.43 O ATOM 1546 CB LEU A 95 -3.621 12.201 2.558 1.00 71.42 C ATOM 1547 CG LEU A 95 -3.425 12.891 1.202 1.00 43.53 C ATOM 1548 CD1 LEU A 95 -3.709 11.957 0.017 1.00 64.25 C ATOM 1549 CD2 LEU A 95 -4.374 14.087 1.155 1.00 24.02 C ATOM 0 H LEU A 95 -3.674 10.622 4.584 1.00 64.32 H new ATOM 0 HA LEU A 95 -2.752 10.374 1.825 1.00 24.02 H new ATOM 0 HB2 LEU A 95 -4.665 11.905 2.661 1.00 71.42 H new ATOM 0 HB3 LEU A 95 -3.412 12.914 3.356 1.00 71.42 H new ATOM 0 HG LEU A 95 -2.383 13.198 1.111 1.00 43.53 H new ATOM 0 HD11 LEU A 95 -3.555 12.497 -0.917 1.00 64.25 H new ATOM 0 HD12 LEU A 95 -3.034 11.102 0.058 1.00 64.25 H new ATOM 0 HD13 LEU A 95 -4.740 11.608 0.068 1.00 64.25 H new ATOM 0 HD21 LEU A 95 -4.262 14.603 0.202 1.00 24.02 H new ATOM 0 HD22 LEU A 95 -5.402 13.740 1.261 1.00 24.02 H new ATOM 0 HD23 LEU A 95 -4.137 14.772 1.969 1.00 24.02 H new ATOM 1561 N LYS A 96 -0.301 10.958 2.306 1.00 44.53 N ATOM 1562 CA LYS A 96 1.087 11.305 2.616 1.00 2.33 C ATOM 1563 C LYS A 96 1.801 11.721 1.330 1.00 42.31 C ATOM 1564 O LYS A 96 1.962 10.947 0.386 1.00 61.35 O ATOM 1565 CB LYS A 96 1.716 10.149 3.420 1.00 73.45 C ATOM 1566 CG LYS A 96 2.450 10.564 4.705 1.00 52.45 C ATOM 1567 CD LYS A 96 3.942 10.803 4.530 1.00 14.12 C ATOM 1568 CE LYS A 96 4.280 12.061 3.742 1.00 34.31 C ATOM 1569 NZ LYS A 96 4.081 13.287 4.533 1.00 50.32 N ATOM 0 H LYS A 96 -0.415 10.336 1.506 1.00 44.53 H new ATOM 0 HA LYS A 96 1.176 12.176 3.265 1.00 2.33 H new ATOM 0 HB2 LYS A 96 0.930 9.442 3.683 1.00 73.45 H new ATOM 0 HB3 LYS A 96 2.418 9.620 2.775 1.00 73.45 H new ATOM 0 HG2 LYS A 96 1.992 11.474 5.092 1.00 52.45 H new ATOM 0 HG3 LYS A 96 2.305 9.789 5.458 1.00 52.45 H new ATOM 0 HD2 LYS A 96 4.407 10.867 5.514 1.00 14.12 H new ATOM 0 HD3 LYS A 96 4.381 9.942 4.026 1.00 14.12 H new ATOM 0 HE2 LYS A 96 5.317 12.011 3.409 1.00 34.31 H new ATOM 0 HE3 LYS A 96 3.659 12.104 2.847 1.00 34.31 H new ATOM 0 HZ1 LYS A 96 4.324 14.117 3.955 1.00 50.32 H new ATOM 0 HZ2 LYS A 96 3.086 13.351 4.830 1.00 50.32 H new ATOM 0 HZ3 LYS A 96 4.692 13.261 5.374 1.00 50.32 H new ATOM 1583 N ASN A 97 2.199 12.994 1.285 1.00 62.01 N ATOM 1584 CA ASN A 97 2.952 13.568 0.163 1.00 31.03 C ATOM 1585 C ASN A 97 4.413 13.146 0.279 1.00 71.42 C ATOM 1586 O ASN A 97 5.073 13.517 1.253 1.00 65.43 O ATOM 1587 CB ASN A 97 2.858 15.102 0.143 1.00 50.55 C ATOM 1588 CG ASN A 97 3.387 15.715 -1.157 1.00 74.13 C ATOM 1589 OD1 ASN A 97 4.199 15.118 -1.859 1.00 62.32 O ATOM 1590 ND2 ASN A 97 2.949 16.924 -1.483 1.00 14.21 N ATOM 0 H ASN A 97 2.007 13.663 2.031 1.00 62.01 H new ATOM 0 HA ASN A 97 2.521 13.197 -0.767 1.00 31.03 H new ATOM 0 HB2 ASN A 97 1.819 15.399 0.282 1.00 50.55 H new ATOM 0 HB3 ASN A 97 3.420 15.506 0.985 1.00 50.55 H new ATOM 0 HD21 ASN A 97 3.287 17.377 -2.332 1.00 14.21 H new ATOM 0 HD22 ASN A 97 2.274 17.401 -0.884 1.00 14.21 H new ATOM 1597 N GLN A 98 4.918 12.366 -0.677 1.00 23.11 N ATOM 1598 CA GLN A 98 6.270 11.809 -0.603 1.00 53.13 C ATOM 1599 C GLN A 98 7.359 12.829 -0.964 1.00 14.50 C ATOM 1600 O GLN A 98 8.536 12.530 -0.792 1.00 3.11 O ATOM 1601 CB GLN A 98 6.374 10.569 -1.504 1.00 70.43 C ATOM 1602 CG GLN A 98 5.308 9.508 -1.193 1.00 34.30 C ATOM 1603 CD GLN A 98 5.246 9.156 0.294 1.00 31.03 C ATOM 1604 OE1 GLN A 98 6.257 8.943 0.954 1.00 30.41 O ATOM 1605 NE2 GLN A 98 4.059 9.158 0.869 1.00 41.41 N ATOM 0 H GLN A 98 4.406 12.103 -1.519 1.00 23.11 H new ATOM 0 HA GLN A 98 6.444 11.526 0.435 1.00 53.13 H new ATOM 0 HB2 GLN A 98 6.280 10.875 -2.546 1.00 70.43 H new ATOM 0 HB3 GLN A 98 7.363 10.126 -1.390 1.00 70.43 H new ATOM 0 HG2 GLN A 98 4.333 9.872 -1.518 1.00 34.30 H new ATOM 0 HG3 GLN A 98 5.519 8.606 -1.768 1.00 34.30 H new ATOM 0 HE21 GLN A 98 3.223 9.336 0.312 1.00 41.41 H new ATOM 0 HE22 GLN A 98 3.977 8.981 1.870 1.00 41.41 H new ATOM 1614 N VAL A 99 7.009 14.034 -1.427 1.00 54.51 N ATOM 1615 CA VAL A 99 7.972 15.108 -1.707 1.00 65.11 C ATOM 1616 C VAL A 99 8.737 15.427 -0.428 1.00 33.31 C ATOM 1617 O VAL A 99 9.963 15.349 -0.370 1.00 13.30 O ATOM 1618 CB VAL A 99 7.229 16.358 -2.215 1.00 65.44 C ATOM 1619 CG1 VAL A 99 8.129 17.600 -2.319 1.00 11.30 C ATOM 1620 CG2 VAL A 99 6.577 16.082 -3.571 1.00 25.41 C ATOM 0 H VAL A 99 6.042 14.295 -1.620 1.00 54.51 H new ATOM 0 HA VAL A 99 8.673 14.788 -2.478 1.00 65.11 H new ATOM 0 HB VAL A 99 6.464 16.578 -1.470 1.00 65.44 H new ATOM 0 HG11 VAL A 99 7.543 18.444 -2.683 1.00 11.30 H new ATOM 0 HG12 VAL A 99 8.536 17.837 -1.336 1.00 11.30 H new ATOM 0 HG13 VAL A 99 8.946 17.400 -3.012 1.00 11.30 H new ATOM 0 HG21 VAL A 99 6.057 16.977 -3.913 1.00 25.41 H new ATOM 0 HG22 VAL A 99 7.345 15.809 -4.295 1.00 25.41 H new ATOM 0 HG23 VAL A 99 5.864 15.263 -3.472 1.00 25.41 H new ATOM 1630 N TYR A 100 7.986 15.767 0.617 1.00 50.41 N ATOM 1631 CA TYR A 100 8.495 16.195 1.908 1.00 62.44 C ATOM 1632 C TYR A 100 9.131 15.040 2.691 1.00 62.04 C ATOM 1633 O TYR A 100 9.543 15.208 3.841 1.00 44.45 O ATOM 1634 CB TYR A 100 7.343 16.871 2.661 1.00 21.22 C ATOM 1635 CG TYR A 100 6.731 18.053 1.910 1.00 64.05 C ATOM 1636 CD1 TYR A 100 7.455 19.258 1.797 1.00 61.13 C ATOM 1637 CD2 TYR A 100 5.474 17.943 1.273 1.00 11.32 C ATOM 1638 CE1 TYR A 100 6.930 20.340 1.064 1.00 44.34 C ATOM 1639 CE2 TYR A 100 4.947 19.028 0.538 1.00 2.43 C ATOM 1640 CZ TYR A 100 5.665 20.242 0.446 1.00 10.32 C ATOM 1641 OH TYR A 100 5.132 21.330 -0.173 1.00 74.41 O ATOM 0 H TYR A 100 6.967 15.750 0.581 1.00 50.41 H new ATOM 0 HA TYR A 100 9.306 16.911 1.775 1.00 62.44 H new ATOM 0 HB2 TYR A 100 6.565 16.133 2.856 1.00 21.22 H new ATOM 0 HB3 TYR A 100 7.706 17.215 3.630 1.00 21.22 H new ATOM 0 HD1 TYR A 100 8.419 19.352 2.276 1.00 61.13 H new ATOM 0 HD2 TYR A 100 4.913 17.023 1.349 1.00 11.32 H new ATOM 0 HE1 TYR A 100 7.500 21.253 0.974 1.00 44.34 H new ATOM 0 HE2 TYR A 100 3.992 18.930 0.044 1.00 2.43 H new ATOM 0 HH TYR A 100 4.312 21.070 -0.643 1.00 74.41 H new ATOM 1651 N MET A 101 9.224 13.843 2.105 1.00 10.24 N ATOM 1652 CA MET A 101 9.764 12.674 2.767 1.00 41.33 C ATOM 1653 C MET A 101 11.292 12.720 2.748 1.00 25.23 C ATOM 1654 O MET A 101 11.953 11.954 2.053 1.00 23.24 O ATOM 1655 CB MET A 101 9.201 11.408 2.084 1.00 53.11 C ATOM 1656 CG MET A 101 9.446 10.115 2.860 1.00 41.22 C ATOM 1657 SD MET A 101 8.899 10.168 4.585 1.00 22.13 S ATOM 1658 CE MET A 101 7.153 10.577 4.303 1.00 34.24 C ATOM 0 H MET A 101 8.921 13.667 1.147 1.00 10.24 H new ATOM 0 HA MET A 101 9.463 12.653 3.814 1.00 41.33 H new ATOM 0 HB2 MET A 101 8.128 11.534 1.939 1.00 53.11 H new ATOM 0 HB3 MET A 101 9.647 11.314 1.094 1.00 53.11 H new ATOM 0 HG2 MET A 101 8.933 9.298 2.353 1.00 41.22 H new ATOM 0 HG3 MET A 101 10.511 9.886 2.836 1.00 41.22 H new ATOM 0 HE1 MET A 101 6.534 10.053 5.031 1.00 34.24 H new ATOM 0 HE2 MET A 101 7.009 11.652 4.411 1.00 34.24 H new ATOM 0 HE3 MET A 101 6.866 10.272 3.297 1.00 34.24 H new ATOM 1668 N HIS A 102 11.853 13.658 3.506 1.00 34.41 N ATOM 1669 CA HIS A 102 13.278 13.797 3.773 1.00 50.21 C ATOM 1670 C HIS A 102 13.562 13.823 5.277 1.00 22.32 C ATOM 1671 O HIS A 102 14.692 13.612 5.696 1.00 2.14 O ATOM 1672 CB HIS A 102 13.795 15.064 3.070 1.00 65.15 C ATOM 1673 CG HIS A 102 13.156 16.363 3.504 1.00 63.45 C ATOM 1674 ND1 HIS A 102 12.358 17.192 2.741 1.00 71.12 N ATOM 1675 CD2 HIS A 102 13.384 16.994 4.694 1.00 64.44 C ATOM 1676 CE1 HIS A 102 12.110 18.298 3.463 1.00 42.52 C ATOM 1677 NE2 HIS A 102 12.692 18.208 4.672 1.00 71.04 N ATOM 0 H HIS A 102 11.298 14.375 3.972 1.00 34.41 H new ATOM 0 HA HIS A 102 13.809 12.932 3.376 1.00 50.21 H new ATOM 0 HB2 HIS A 102 14.870 15.136 3.236 1.00 65.15 H new ATOM 0 HB3 HIS A 102 13.645 14.948 1.997 1.00 65.15 H new ATOM 0 HD2 HIS A 102 13.990 16.621 5.506 1.00 64.44 H new ATOM 0 HE1 HIS A 102 11.526 19.140 3.121 1.00 42.52 H new ATOM 0 HE2 HIS A 102 12.639 18.893 5.426 1.00 71.04 H new ATOM 1685 N GLN A 103 12.538 14.109 6.086 1.00 21.34 N ATOM 1686 CA GLN A 103 12.658 14.442 7.502 1.00 41.14 C ATOM 1687 C GLN A 103 12.169 13.307 8.409 1.00 54.11 C ATOM 1688 O GLN A 103 12.582 13.229 9.566 1.00 71.34 O ATOM 1689 CB GLN A 103 11.877 15.749 7.753 1.00 24.20 C ATOM 1690 CG GLN A 103 10.368 15.599 7.515 1.00 43.42 C ATOM 1691 CD GLN A 103 9.667 16.858 7.015 1.00 62.02 C ATOM 1692 OE1 GLN A 103 8.808 17.417 7.699 1.00 64.25 O ATOM 1693 NE2 GLN A 103 9.975 17.285 5.803 1.00 31.14 N ATOM 0 H GLN A 103 11.572 14.114 5.759 1.00 21.34 H new ATOM 0 HA GLN A 103 13.710 14.583 7.752 1.00 41.14 H new ATOM 0 HB2 GLN A 103 12.047 16.076 8.779 1.00 24.20 H new ATOM 0 HB3 GLN A 103 12.267 16.530 7.100 1.00 24.20 H new ATOM 0 HG2 GLN A 103 10.207 14.800 6.791 1.00 43.42 H new ATOM 0 HG3 GLN A 103 9.898 15.285 8.447 1.00 43.42 H new ATOM 0 HE21 GLN A 103 10.690 16.803 5.259 1.00 31.14 H new ATOM 0 HE22 GLN A 103 9.497 18.097 5.412 1.00 31.14 H new ATOM 1702 N HIS A 104 11.278 12.448 7.899 1.00 41.44 N ATOM 1703 CA HIS A 104 10.598 11.402 8.657 1.00 22.33 C ATOM 1704 C HIS A 104 11.265 10.027 8.470 1.00 74.15 C ATOM 1705 O HIS A 104 10.689 9.011 8.867 1.00 30.32 O ATOM 1706 CB HIS A 104 9.113 11.360 8.271 1.00 32.21 C ATOM 1707 CG HIS A 104 8.380 12.676 8.364 1.00 2.34 C ATOM 1708 ND1 HIS A 104 8.171 13.425 9.501 1.00 5.30 N ATOM 1709 CD2 HIS A 104 7.748 13.309 7.332 1.00 21.02 C ATOM 1710 CE1 HIS A 104 7.404 14.475 9.165 1.00 10.14 C ATOM 1711 NE2 HIS A 104 7.130 14.454 7.849 1.00 74.42 N ATOM 0 H HIS A 104 11.005 12.466 6.916 1.00 41.44 H new ATOM 0 HA HIS A 104 10.679 11.644 9.717 1.00 22.33 H new ATOM 0 HB2 HIS A 104 9.032 10.990 7.249 1.00 32.21 H new ATOM 0 HB3 HIS A 104 8.609 10.637 8.913 1.00 32.21 H new ATOM 0 HD2 HIS A 104 7.728 12.985 6.302 1.00 21.02 H new ATOM 0 HE1 HIS A 104 7.056 15.230 9.855 1.00 10.14 H new ATOM 0 HE2 HIS A 104 6.580 15.138 7.329 1.00 74.42 H new ATOM 1719 N SER A 105 12.432 9.994 7.821 1.00 54.54 N ATOM 1720 CA SER A 105 13.202 8.813 7.461 1.00 61.43 C ATOM 1721 C SER A 105 14.694 9.200 7.516 1.00 73.34 C ATOM 1722 O SER A 105 14.998 10.396 7.531 1.00 32.43 O ATOM 1723 CB SER A 105 12.826 8.399 6.025 1.00 4.44 C ATOM 1724 OG SER A 105 11.432 8.217 5.853 1.00 70.01 O ATOM 0 H SER A 105 12.890 10.853 7.515 1.00 54.54 H new ATOM 0 HA SER A 105 12.999 7.984 8.139 1.00 61.43 H new ATOM 0 HB2 SER A 105 13.177 9.161 5.329 1.00 4.44 H new ATOM 0 HB3 SER A 105 13.343 7.473 5.772 1.00 4.44 H new ATOM 0 HG SER A 105 11.044 9.021 5.449 1.00 70.01 H new ATOM 1730 N PRO A 106 15.632 8.242 7.521 1.00 22.44 N ATOM 1731 CA PRO A 106 17.027 8.442 7.126 1.00 73.44 C ATOM 1732 C PRO A 106 17.120 8.593 5.607 1.00 12.23 C ATOM 1733 O PRO A 106 16.095 8.805 4.963 1.00 25.11 O ATOM 1734 CB PRO A 106 17.759 7.205 7.639 1.00 74.45 C ATOM 1735 CG PRO A 106 16.714 6.122 7.396 1.00 31.22 C ATOM 1736 CD PRO A 106 15.402 6.824 7.743 1.00 13.40 C ATOM 0 HA PRO A 106 17.468 9.349 7.540 1.00 73.44 H new ATOM 0 HB2 PRO A 106 18.682 7.016 7.091 1.00 74.45 H new ATOM 0 HB3 PRO A 106 18.025 7.291 8.692 1.00 74.45 H new ATOM 0 HG2 PRO A 106 16.725 5.776 6.363 1.00 31.22 H new ATOM 0 HG3 PRO A 106 16.883 5.249 8.027 1.00 31.22 H new ATOM 0 HD2 PRO A 106 14.587 6.459 7.118 1.00 13.40 H new ATOM 0 HD3 PRO A 106 15.120 6.632 8.778 1.00 13.40 H new ATOM 1744 N HIS A 107 18.320 8.452 5.040 1.00 65.21 N ATOM 1745 CA HIS A 107 18.754 8.779 3.690 1.00 22.40 C ATOM 1746 C HIS A 107 17.752 8.362 2.606 1.00 65.01 C ATOM 1747 O HIS A 107 17.830 7.293 1.990 1.00 31.14 O ATOM 1748 CB HIS A 107 20.146 8.188 3.453 1.00 70.25 C ATOM 1749 CG HIS A 107 21.199 8.655 4.429 1.00 52.34 C ATOM 1750 ND1 HIS A 107 21.408 9.946 4.873 1.00 52.33 N ATOM 1751 CD2 HIS A 107 22.120 7.854 5.042 1.00 42.31 C ATOM 1752 CE1 HIS A 107 22.466 9.928 5.698 1.00 3.10 C ATOM 1753 NE2 HIS A 107 22.943 8.677 5.814 1.00 50.24 N ATOM 0 H HIS A 107 19.093 8.062 5.580 1.00 65.21 H new ATOM 0 HA HIS A 107 18.806 9.865 3.609 1.00 22.40 H new ATOM 0 HB2 HIS A 107 20.079 7.101 3.503 1.00 70.25 H new ATOM 0 HB3 HIS A 107 20.467 8.441 2.443 1.00 70.25 H new ATOM 0 HD2 HIS A 107 22.198 6.781 4.947 1.00 42.31 H new ATOM 0 HE1 HIS A 107 22.875 10.794 6.197 1.00 3.10 H new ATOM 0 HE2 HIS A 107 23.752 8.384 6.362 1.00 50.24 H new ATOM 1831 N SER A 113 9.106 8.843 -9.214 1.00 42.41 N ATOM 1832 CA SER A 113 7.654 8.695 -9.250 1.00 43.22 C ATOM 1833 C SER A 113 7.139 7.757 -8.146 1.00 71.24 C ATOM 1834 O SER A 113 7.926 7.184 -7.397 1.00 44.31 O ATOM 1835 CB SER A 113 7.208 8.236 -10.650 1.00 70.25 C ATOM 1836 OG SER A 113 7.518 9.194 -11.649 1.00 54.52 O ATOM 0 HA SER A 113 7.208 9.669 -9.049 1.00 43.22 H new ATOM 0 HB2 SER A 113 7.692 7.290 -10.892 1.00 70.25 H new ATOM 0 HB3 SER A 113 6.134 8.052 -10.646 1.00 70.25 H new ATOM 0 HG SER A 113 8.261 9.756 -11.344 1.00 54.52 H new ATOM 1842 N SER A 114 5.821 7.585 -8.041 1.00 44.55 N ATOM 1843 CA SER A 114 5.105 6.743 -7.085 1.00 24.23 C ATOM 1844 C SER A 114 5.600 5.298 -7.129 1.00 52.25 C ATOM 1845 O SER A 114 5.824 4.696 -6.085 1.00 41.14 O ATOM 1846 CB SER A 114 3.587 6.865 -7.312 1.00 34.33 C ATOM 1847 OG SER A 114 3.263 7.690 -8.420 1.00 41.13 O ATOM 0 H SER A 114 5.179 8.067 -8.670 1.00 44.55 H new ATOM 0 HA SER A 114 5.314 7.096 -6.075 1.00 24.23 H new ATOM 0 HB2 SER A 114 3.166 5.872 -7.469 1.00 34.33 H new ATOM 0 HB3 SER A 114 3.121 7.270 -6.414 1.00 34.33 H new ATOM 0 HG SER A 114 2.366 8.065 -8.297 1.00 41.13 H new ATOM 1853 N ARG A 115 5.818 4.746 -8.328 1.00 70.21 N ATOM 1854 CA ARG A 115 6.404 3.413 -8.501 1.00 13.20 C ATOM 1855 C ARG A 115 7.818 3.344 -7.889 1.00 22.24 C ATOM 1856 O ARG A 115 8.134 2.335 -7.268 1.00 33.24 O ATOM 1857 CB ARG A 115 6.391 3.024 -9.995 1.00 65.15 C ATOM 1858 CG ARG A 115 5.179 2.242 -10.528 1.00 61.21 C ATOM 1859 CD ARG A 115 3.892 3.057 -10.598 1.00 42.54 C ATOM 1860 NE ARG A 115 3.910 4.098 -11.630 1.00 45.55 N ATOM 1861 CZ ARG A 115 3.062 5.130 -11.708 1.00 71.44 C ATOM 1862 NH1 ARG A 115 2.150 5.339 -10.756 1.00 44.34 N ATOM 1863 NH2 ARG A 115 3.157 5.959 -12.734 1.00 50.42 N ATOM 0 H ARG A 115 5.593 5.212 -9.207 1.00 70.21 H new ATOM 0 HA ARG A 115 5.799 2.684 -7.962 1.00 13.20 H new ATOM 0 HB2 ARG A 115 6.480 3.940 -10.579 1.00 65.15 H new ATOM 0 HB3 ARG A 115 7.284 2.431 -10.193 1.00 65.15 H new ATOM 0 HG2 ARG A 115 5.413 1.866 -11.524 1.00 61.21 H new ATOM 0 HG3 ARG A 115 5.012 1.374 -9.891 1.00 61.21 H new ATOM 0 HD2 ARG A 115 3.056 2.384 -10.788 1.00 42.54 H new ATOM 0 HD3 ARG A 115 3.713 3.522 -9.628 1.00 42.54 H new ATOM 0 HE ARG A 115 4.630 4.030 -12.349 1.00 45.55 H new ATOM 0 HH11 ARG A 115 2.093 4.708 -9.957 1.00 44.34 H new ATOM 0 HH12 ARG A 115 1.510 6.130 -10.828 1.00 44.34 H new ATOM 0 HH21 ARG A 115 3.868 5.806 -13.449 1.00 50.42 H new ATOM 0 HH22 ARG A 115 2.519 6.751 -12.810 1.00 50.42 H new ATOM 1877 N ASP A 116 8.653 4.385 -8.007 1.00 24.22 N ATOM 1878 CA ASP A 116 9.999 4.433 -7.403 1.00 51.32 C ATOM 1879 C ASP A 116 9.904 4.517 -5.884 1.00 25.10 C ATOM 1880 O ASP A 116 10.544 3.749 -5.171 1.00 70.22 O ATOM 1881 CB ASP A 116 10.792 5.624 -7.954 1.00 21.04 C ATOM 1882 CG ASP A 116 12.114 5.894 -7.222 1.00 1.33 C ATOM 1883 OD1 ASP A 116 12.885 4.950 -6.931 1.00 65.41 O ATOM 1884 OD2 ASP A 116 12.394 7.091 -6.996 1.00 31.44 O ATOM 0 H ASP A 116 8.414 5.228 -8.529 1.00 24.22 H new ATOM 0 HA ASP A 116 10.524 3.514 -7.665 1.00 51.32 H new ATOM 0 HB2 ASP A 116 11.003 5.448 -9.009 1.00 21.04 H new ATOM 0 HB3 ASP A 116 10.170 6.517 -7.898 1.00 21.04 H new ATOM 1889 N ALA A 117 9.029 5.389 -5.376 1.00 62.32 N ATOM 1890 CA ALA A 117 8.715 5.441 -3.956 1.00 3.51 C ATOM 1891 C ALA A 117 8.241 4.082 -3.427 1.00 64.22 C ATOM 1892 O ALA A 117 8.383 3.818 -2.230 1.00 62.05 O ATOM 1893 CB ALA A 117 7.663 6.527 -3.696 1.00 34.44 C ATOM 0 H ALA A 117 8.524 6.073 -5.939 1.00 62.32 H new ATOM 0 HA ALA A 117 9.628 5.692 -3.416 1.00 3.51 H new ATOM 0 HB1 ALA A 117 7.431 6.562 -2.631 1.00 34.44 H new ATOM 0 HB2 ALA A 117 8.052 7.494 -4.015 1.00 34.44 H new ATOM 0 HB3 ALA A 117 6.757 6.298 -4.257 1.00 34.44 H new ATOM 1899 N MET A 118 7.655 3.236 -4.280 1.00 3.31 N ATOM 1900 CA MET A 118 7.166 1.922 -3.928 1.00 10.42 C ATOM 1901 C MET A 118 8.341 0.989 -3.689 1.00 72.03 C ATOM 1902 O MET A 118 8.395 0.371 -2.635 1.00 1.13 O ATOM 1903 CB MET A 118 6.247 1.406 -5.042 1.00 33.23 C ATOM 1904 CG MET A 118 4.983 0.786 -4.462 1.00 71.33 C ATOM 1905 SD MET A 118 3.727 0.467 -5.715 1.00 5.51 S ATOM 1906 CE MET A 118 3.302 2.169 -6.122 1.00 44.43 C ATOM 0 H MET A 118 7.509 3.465 -5.263 1.00 3.31 H new ATOM 0 HA MET A 118 6.585 1.969 -3.007 1.00 10.42 H new ATOM 0 HB2 MET A 118 5.981 2.226 -5.709 1.00 33.23 H new ATOM 0 HB3 MET A 118 6.777 0.666 -5.642 1.00 33.23 H new ATOM 0 HG2 MET A 118 5.238 -0.149 -3.963 1.00 71.33 H new ATOM 0 HG3 MET A 118 4.572 1.451 -3.703 1.00 71.33 H new ATOM 0 HE1 MET A 118 2.222 2.301 -6.053 1.00 44.43 H new ATOM 0 HE2 MET A 118 3.795 2.844 -5.423 1.00 44.43 H new ATOM 0 HE3 MET A 118 3.631 2.393 -7.137 1.00 44.43 H new ATOM 1916 N SER A 119 9.296 0.898 -4.617 1.00 45.43 N ATOM 1917 CA SER A 119 10.491 0.056 -4.522 1.00 3.21 C ATOM 1918 C SER A 119 11.501 0.503 -3.437 1.00 50.21 C ATOM 1919 O SER A 119 12.641 0.031 -3.386 1.00 22.34 O ATOM 1920 CB SER A 119 11.107 -0.069 -5.927 1.00 44.45 C ATOM 1921 OG SER A 119 10.997 1.113 -6.701 1.00 65.04 O ATOM 0 H SER A 119 9.257 1.428 -5.488 1.00 45.43 H new ATOM 0 HA SER A 119 10.192 -0.932 -4.172 1.00 3.21 H new ATOM 0 HB2 SER A 119 12.160 -0.334 -5.831 1.00 44.45 H new ATOM 0 HB3 SER A 119 10.620 -0.887 -6.457 1.00 44.45 H new ATOM 0 HG SER A 119 11.408 0.968 -7.579 1.00 65.04 H new ATOM 1927 N LYS A 120 11.088 1.420 -2.559 1.00 62.21 N ATOM 1928 CA LYS A 120 11.864 2.041 -1.491 1.00 43.13 C ATOM 1929 C LYS A 120 11.002 2.112 -0.212 1.00 64.35 C ATOM 1930 O LYS A 120 11.180 2.997 0.625 1.00 25.41 O ATOM 1931 CB LYS A 120 12.322 3.418 -2.021 1.00 22.32 C ATOM 1932 CG LYS A 120 13.804 3.765 -1.797 1.00 10.54 C ATOM 1933 CD LYS A 120 14.121 4.203 -0.361 1.00 44.21 C ATOM 1934 CE LYS A 120 15.595 4.603 -0.162 1.00 34.34 C ATOM 1935 NZ LYS A 120 16.008 5.768 -0.977 1.00 42.43 N ATOM 0 H LYS A 120 10.131 1.772 -2.580 1.00 62.21 H new ATOM 0 HA LYS A 120 12.750 1.470 -1.215 1.00 43.13 H new ATOM 0 HB2 LYS A 120 12.116 3.461 -3.091 1.00 22.32 H new ATOM 0 HB3 LYS A 120 11.713 4.189 -1.548 1.00 22.32 H new ATOM 0 HG2 LYS A 120 14.414 2.897 -2.046 1.00 10.54 H new ATOM 0 HG3 LYS A 120 14.090 4.563 -2.483 1.00 10.54 H new ATOM 0 HD2 LYS A 120 13.483 5.046 -0.096 1.00 44.21 H new ATOM 0 HD3 LYS A 120 13.876 3.390 0.323 1.00 44.21 H new ATOM 0 HE2 LYS A 120 15.762 4.829 0.891 1.00 34.34 H new ATOM 0 HE3 LYS A 120 16.230 3.753 -0.410 1.00 34.34 H new ATOM 0 HZ1 LYS A 120 16.977 6.045 -0.720 1.00 42.43 H new ATOM 0 HZ2 LYS A 120 15.976 5.515 -1.985 1.00 42.43 H new ATOM 0 HZ3 LYS A 120 15.362 6.563 -0.799 1.00 42.43 H new ATOM 1949 N TYR A 121 9.989 1.254 -0.096 1.00 62.42 N ATOM 1950 CA TYR A 121 9.221 0.959 1.107 1.00 21.24 C ATOM 1951 C TYR A 121 10.033 0.066 2.056 1.00 65.25 C ATOM 1952 O TYR A 121 11.065 -0.490 1.659 1.00 70.14 O ATOM 1953 CB TYR A 121 7.884 0.286 0.720 1.00 25.41 C ATOM 1954 CG TYR A 121 6.695 1.208 0.680 1.00 41.51 C ATOM 1955 CD1 TYR A 121 6.513 2.177 1.684 1.00 62.45 C ATOM 1956 CD2 TYR A 121 5.748 1.080 -0.352 1.00 41.11 C ATOM 1957 CE1 TYR A 121 5.411 3.028 1.648 1.00 63.02 C ATOM 1958 CE2 TYR A 121 4.638 1.930 -0.397 1.00 5.31 C ATOM 1959 CZ TYR A 121 4.466 2.901 0.617 1.00 10.33 C ATOM 1960 OH TYR A 121 3.446 3.784 0.600 1.00 42.42 O ATOM 0 H TYR A 121 9.663 0.711 -0.896 1.00 62.42 H new ATOM 0 HA TYR A 121 9.003 1.890 1.630 1.00 21.24 H new ATOM 0 HB2 TYR A 121 7.998 -0.177 -0.260 1.00 25.41 H new ATOM 0 HB3 TYR A 121 7.679 -0.516 1.430 1.00 25.41 H new ATOM 0 HD1 TYR A 121 7.231 2.261 2.486 1.00 62.45 H new ATOM 0 HD2 TYR A 121 5.878 0.323 -1.112 1.00 41.11 H new ATOM 0 HE1 TYR A 121 5.284 3.783 2.410 1.00 63.02 H new ATOM 0 HE2 TYR A 121 3.919 1.846 -1.198 1.00 5.31 H new ATOM 0 HH TYR A 121 2.860 3.593 -0.162 1.00 42.42 H new ATOM 1970 N PRO A 122 9.612 -0.104 3.319 1.00 70.02 N ATOM 1971 CA PRO A 122 10.361 -0.881 4.290 1.00 24.44 C ATOM 1972 C PRO A 122 10.380 -2.383 3.995 1.00 5.43 C ATOM 1973 O PRO A 122 11.319 -3.046 4.438 1.00 44.55 O ATOM 1974 CB PRO A 122 9.718 -0.568 5.634 1.00 21.01 C ATOM 1975 CG PRO A 122 8.260 -0.329 5.258 1.00 71.41 C ATOM 1976 CD PRO A 122 8.395 0.405 3.930 1.00 65.05 C ATOM 0 HA PRO A 122 11.416 -0.607 4.266 1.00 24.44 H new ATOM 0 HB2 PRO A 122 9.825 -1.394 6.337 1.00 21.01 H new ATOM 0 HB3 PRO A 122 10.165 0.309 6.103 1.00 21.01 H new ATOM 0 HG2 PRO A 122 7.707 -1.262 5.155 1.00 71.41 H new ATOM 0 HG3 PRO A 122 7.738 0.270 6.005 1.00 71.41 H new ATOM 0 HD2 PRO A 122 7.531 0.221 3.292 1.00 65.05 H new ATOM 0 HD3 PRO A 122 8.455 1.483 4.083 1.00 65.05 H new ATOM 1984 N GLU A 123 9.445 -2.918 3.200 1.00 65.02 N ATOM 1985 CA GLU A 123 9.408 -4.346 2.859 1.00 2.22 C ATOM 1986 C GLU A 123 9.089 -4.521 1.373 1.00 11.52 C ATOM 1987 O GLU A 123 8.512 -3.624 0.752 1.00 12.42 O ATOM 1988 CB GLU A 123 8.352 -5.082 3.703 1.00 23.01 C ATOM 1989 CG GLU A 123 8.563 -5.001 5.223 1.00 61.31 C ATOM 1990 CD GLU A 123 7.332 -4.542 6.016 1.00 3.33 C ATOM 1991 OE1 GLU A 123 6.216 -5.057 5.778 1.00 11.34 O ATOM 1992 OE2 GLU A 123 7.467 -3.636 6.870 1.00 23.03 O ATOM 0 H GLU A 123 8.694 -2.374 2.775 1.00 65.02 H new ATOM 0 HA GLU A 123 10.387 -4.774 3.074 1.00 2.22 H new ATOM 0 HB2 GLU A 123 7.370 -4.673 3.466 1.00 23.01 H new ATOM 0 HB3 GLU A 123 8.340 -6.131 3.408 1.00 23.01 H new ATOM 0 HG2 GLU A 123 8.868 -5.982 5.587 1.00 61.31 H new ATOM 0 HG3 GLU A 123 9.386 -4.316 5.426 1.00 61.31 H new ATOM 1999 N ARG A 124 9.436 -5.679 0.807 1.00 23.40 N ATOM 2000 CA ARG A 124 9.195 -6.051 -0.589 1.00 52.52 C ATOM 2001 C ARG A 124 7.705 -6.258 -0.805 1.00 41.32 C ATOM 2002 O ARG A 124 7.140 -5.708 -1.744 1.00 73.31 O ATOM 2003 CB ARG A 124 9.949 -7.337 -0.963 1.00 45.13 C ATOM 2004 CG ARG A 124 11.468 -7.299 -0.710 1.00 24.32 C ATOM 2005 CD ARG A 124 12.230 -7.490 -2.017 1.00 52.14 C ATOM 2006 NE ARG A 124 13.642 -7.867 -1.852 1.00 11.10 N ATOM 2007 CZ ARG A 124 14.367 -8.463 -2.811 1.00 52.15 C ATOM 2008 NH1 ARG A 124 13.790 -9.107 -3.821 1.00 12.53 N ATOM 2009 NH2 ARG A 124 15.685 -8.406 -2.775 1.00 30.31 N ATOM 0 H ARG A 124 9.912 -6.414 1.330 1.00 23.40 H new ATOM 0 HA ARG A 124 9.560 -5.245 -1.226 1.00 52.52 H new ATOM 0 HB2 ARG A 124 9.523 -8.167 -0.399 1.00 45.13 H new ATOM 0 HB3 ARG A 124 9.777 -7.547 -2.019 1.00 45.13 H new ATOM 0 HG2 ARG A 124 11.744 -6.347 -0.257 1.00 24.32 H new ATOM 0 HG3 ARG A 124 11.745 -8.081 -0.003 1.00 24.32 H new ATOM 0 HD2 ARG A 124 11.729 -8.258 -2.606 1.00 52.14 H new ATOM 0 HD3 ARG A 124 12.179 -6.565 -2.591 1.00 52.14 H new ATOM 0 HE ARG A 124 14.095 -7.665 -0.961 1.00 11.10 H new ATOM 0 HH11 ARG A 124 12.773 -9.156 -3.880 1.00 12.53 H new ATOM 0 HH12 ARG A 124 14.364 -9.552 -4.537 1.00 12.53 H new ATOM 0 HH21 ARG A 124 16.153 -7.909 -2.018 1.00 30.31 H new ATOM 0 HH22 ARG A 124 16.235 -8.859 -3.504 1.00 30.31 H new ATOM 2023 N CYS A 125 7.044 -7.011 0.076 1.00 52.14 N ATOM 2024 CA CYS A 125 5.601 -7.209 0.018 1.00 54.22 C ATOM 2025 C CYS A 125 4.825 -5.895 0.144 1.00 64.22 C ATOM 2026 O CYS A 125 3.651 -5.881 -0.205 1.00 32.11 O ATOM 2027 CB CYS A 125 5.158 -8.167 1.131 1.00 50.35 C ATOM 2028 SG CYS A 125 5.754 -7.572 2.744 1.00 5.22 S ATOM 0 H CYS A 125 7.497 -7.499 0.848 1.00 52.14 H new ATOM 0 HA CYS A 125 5.377 -7.635 -0.960 1.00 54.22 H new ATOM 0 HB2 CYS A 125 4.071 -8.245 1.143 1.00 50.35 H new ATOM 0 HB3 CYS A 125 5.547 -9.167 0.937 1.00 50.35 H new ATOM 0 HG CYS A 125 4.925 -7.939 3.675 1.00 5.22 H new ATOM 2034 N THR A 126 5.415 -4.825 0.688 1.00 41.21 N ATOM 2035 CA THR A 126 4.776 -3.513 0.796 1.00 33.24 C ATOM 2036 C THR A 126 4.895 -2.747 -0.522 1.00 14.44 C ATOM 2037 O THR A 126 4.038 -1.929 -0.845 1.00 72.42 O ATOM 2038 CB THR A 126 5.385 -2.746 1.981 1.00 51.54 C ATOM 2039 OG1 THR A 126 5.254 -3.574 3.113 1.00 25.00 O ATOM 2040 CG2 THR A 126 4.698 -1.420 2.287 1.00 34.32 C ATOM 0 H THR A 126 6.361 -4.848 1.070 1.00 41.21 H new ATOM 0 HA THR A 126 3.710 -3.634 0.989 1.00 33.24 H new ATOM 0 HB THR A 126 6.417 -2.508 1.724 1.00 51.54 H new ATOM 0 HG1 THR A 126 5.633 -3.121 3.895 1.00 25.00 H new ATOM 0 HG21 THR A 126 5.189 -0.943 3.136 1.00 34.32 H new ATOM 0 HG22 THR A 126 4.763 -0.767 1.417 1.00 34.32 H new ATOM 0 HG23 THR A 126 3.650 -1.600 2.528 1.00 34.32 H new ATOM 2048 N ALA A 127 5.931 -3.008 -1.312 1.00 10.20 N ATOM 2049 CA ALA A 127 6.186 -2.307 -2.551 1.00 45.34 C ATOM 2050 C ALA A 127 5.260 -2.816 -3.653 1.00 13.40 C ATOM 2051 O ALA A 127 5.692 -3.565 -4.519 1.00 25.04 O ATOM 2052 CB ALA A 127 7.649 -2.528 -2.918 1.00 34.43 C ATOM 0 H ALA A 127 6.624 -3.725 -1.100 1.00 10.20 H new ATOM 0 HA ALA A 127 5.990 -1.241 -2.434 1.00 45.34 H new ATOM 0 HB1 ALA A 127 7.872 -2.010 -3.851 1.00 34.43 H new ATOM 0 HB2 ALA A 127 8.286 -2.138 -2.124 1.00 34.43 H new ATOM 0 HB3 ALA A 127 7.836 -3.595 -3.042 1.00 34.43 H new ATOM 2058 N VAL A 128 3.986 -2.439 -3.625 1.00 52.14 N ATOM 2059 CA VAL A 128 2.967 -2.974 -4.526 1.00 21.11 C ATOM 2060 C VAL A 128 1.877 -1.914 -4.741 1.00 30.12 C ATOM 2061 O VAL A 128 1.617 -1.126 -3.835 1.00 14.33 O ATOM 2062 CB VAL A 128 2.373 -4.237 -3.868 1.00 63.15 C ATOM 2063 CG1 VAL A 128 1.276 -4.875 -4.733 1.00 50.23 C ATOM 2064 CG2 VAL A 128 3.396 -5.319 -3.486 1.00 21.03 C ATOM 0 H VAL A 128 3.626 -1.746 -2.969 1.00 52.14 H new ATOM 0 HA VAL A 128 3.394 -3.229 -5.496 1.00 21.11 H new ATOM 0 HB VAL A 128 1.951 -3.859 -2.937 1.00 63.15 H new ATOM 0 HG11 VAL A 128 0.886 -5.761 -4.231 1.00 50.23 H new ATOM 0 HG12 VAL A 128 0.469 -4.158 -4.884 1.00 50.23 H new ATOM 0 HG13 VAL A 128 1.694 -5.159 -5.699 1.00 50.23 H new ATOM 0 HG21 VAL A 128 2.879 -6.164 -3.031 1.00 21.03 H new ATOM 0 HG22 VAL A 128 3.923 -5.654 -4.380 1.00 21.03 H new ATOM 0 HG23 VAL A 128 4.113 -4.907 -2.775 1.00 21.03 H new ATOM 2074 N GLY A 129 1.195 -1.906 -5.891 1.00 70.33 N ATOM 2075 CA GLY A 129 0.117 -0.960 -6.191 1.00 63.42 C ATOM 2076 C GLY A 129 -1.140 -1.646 -6.722 1.00 12.44 C ATOM 2077 O GLY A 129 -1.061 -2.781 -7.210 1.00 13.24 O ATOM 0 H GLY A 129 1.379 -2.564 -6.648 1.00 70.33 H new ATOM 0 HA2 GLY A 129 -0.133 -0.402 -5.288 1.00 63.42 H new ATOM 0 HA3 GLY A 129 0.469 -0.236 -6.926 1.00 63.42 H new ATOM 2081 N LEU A 130 -2.293 -0.966 -6.643 1.00 14.33 N ATOM 2082 CA LEU A 130 -3.535 -1.312 -7.326 1.00 41.14 C ATOM 2083 C LEU A 130 -4.297 -0.007 -7.628 1.00 31.40 C ATOM 2084 O LEU A 130 -4.605 0.738 -6.706 1.00 32.03 O ATOM 2085 CB LEU A 130 -4.406 -2.287 -6.484 1.00 22.21 C ATOM 2086 CG LEU A 130 -5.677 -2.634 -7.306 1.00 70.41 C ATOM 2087 CD1 LEU A 130 -5.407 -3.792 -8.275 1.00 70.34 C ATOM 2088 CD2 LEU A 130 -6.869 -2.953 -6.416 1.00 10.41 C ATOM 0 H LEU A 130 -2.383 -0.124 -6.075 1.00 14.33 H new ATOM 0 HA LEU A 130 -3.303 -1.834 -8.255 1.00 41.14 H new ATOM 0 HB2 LEU A 130 -3.846 -3.192 -6.250 1.00 22.21 H new ATOM 0 HB3 LEU A 130 -4.681 -1.828 -5.534 1.00 22.21 H new ATOM 0 HG LEU A 130 -5.930 -1.745 -7.885 1.00 70.41 H new ATOM 0 HD11 LEU A 130 -6.314 -4.014 -8.838 1.00 70.34 H new ATOM 0 HD12 LEU A 130 -4.611 -3.511 -8.965 1.00 70.34 H new ATOM 0 HD13 LEU A 130 -5.104 -4.675 -7.712 1.00 70.34 H new ATOM 0 HD21 LEU A 130 -7.733 -3.189 -7.036 1.00 10.41 H new ATOM 0 HD22 LEU A 130 -6.632 -3.808 -5.783 1.00 10.41 H new ATOM 0 HD23 LEU A 130 -7.097 -2.090 -5.790 1.00 10.41 H new ATOM 2100 N ARG A 131 -4.690 0.277 -8.876 1.00 72.41 N ATOM 2101 CA ARG A 131 -5.793 1.224 -9.132 1.00 12.20 C ATOM 2102 C ARG A 131 -6.469 0.894 -10.465 1.00 25.30 C ATOM 2103 O ARG A 131 -6.068 -0.058 -11.131 1.00 44.32 O ATOM 2104 CB ARG A 131 -5.320 2.688 -9.082 1.00 54.55 C ATOM 2105 CG ARG A 131 -6.435 3.671 -8.664 1.00 22.40 C ATOM 2106 CD ARG A 131 -6.001 5.135 -8.668 1.00 22.01 C ATOM 2107 NE ARG A 131 -5.218 5.509 -9.860 1.00 22.24 N ATOM 2108 CZ ARG A 131 -5.666 6.033 -11.006 1.00 70.33 C ATOM 2109 NH1 ARG A 131 -6.942 6.361 -11.167 1.00 22.01 N ATOM 2110 NH2 ARG A 131 -4.814 6.213 -12.000 1.00 53.25 N ATOM 0 H ARG A 131 -4.272 -0.125 -9.715 1.00 72.41 H new ATOM 0 HA ARG A 131 -6.528 1.111 -8.335 1.00 12.20 H new ATOM 0 HB2 ARG A 131 -4.489 2.771 -8.382 1.00 54.55 H new ATOM 0 HB3 ARG A 131 -4.940 2.975 -10.063 1.00 54.55 H new ATOM 0 HG2 ARG A 131 -7.283 3.552 -9.338 1.00 22.40 H new ATOM 0 HG3 ARG A 131 -6.783 3.408 -7.665 1.00 22.40 H new ATOM 0 HD2 ARG A 131 -6.886 5.769 -8.610 1.00 22.01 H new ATOM 0 HD3 ARG A 131 -5.408 5.333 -7.775 1.00 22.01 H new ATOM 0 HE ARG A 131 -4.212 5.349 -9.804 1.00 22.24 H new ATOM 0 HH11 ARG A 131 -7.606 6.215 -10.407 1.00 22.01 H new ATOM 0 HH12 ARG A 131 -7.259 6.759 -12.051 1.00 22.01 H new ATOM 0 HH21 ARG A 131 -3.834 5.954 -11.885 1.00 53.25 H new ATOM 0 HH22 ARG A 131 -5.136 6.611 -12.882 1.00 53.25 H new ATOM 2124 N LEU A 132 -7.499 1.653 -10.844 1.00 71.41 N ATOM 2125 CA LEU A 132 -8.050 1.645 -12.190 1.00 51.41 C ATOM 2126 C LEU A 132 -7.111 2.415 -13.105 1.00 52.44 C ATOM 2127 O LEU A 132 -6.234 3.160 -12.656 1.00 24.24 O ATOM 2128 CB LEU A 132 -9.490 2.215 -12.149 1.00 62.12 C ATOM 2129 CG LEU A 132 -10.626 1.167 -12.240 1.00 4.34 C ATOM 2130 CD1 LEU A 132 -10.486 -0.130 -11.449 1.00 1.21 C ATOM 2131 CD2 LEU A 132 -11.994 1.779 -11.906 1.00 65.23 C ATOM 0 H LEU A 132 -7.976 2.297 -10.213 1.00 71.41 H new ATOM 0 HA LEU A 132 -8.127 0.635 -12.592 1.00 51.41 H new ATOM 0 HB2 LEU A 132 -9.613 2.778 -11.224 1.00 62.12 H new ATOM 0 HB3 LEU A 132 -9.605 2.922 -12.970 1.00 62.12 H new ATOM 0 HG LEU A 132 -10.540 0.871 -13.285 1.00 4.34 H new ATOM 0 HD11 LEU A 132 -11.362 -0.756 -11.619 1.00 1.21 H new ATOM 0 HD12 LEU A 132 -9.592 -0.661 -11.776 1.00 1.21 H new ATOM 0 HD13 LEU A 132 -10.404 0.099 -10.386 1.00 1.21 H new ATOM 0 HD21 LEU A 132 -12.764 1.011 -11.981 1.00 65.23 H new ATOM 0 HD22 LEU A 132 -11.977 2.177 -10.892 1.00 65.23 H new ATOM 0 HD23 LEU A 132 -12.214 2.583 -12.608 1.00 65.23 H new ATOM 2143 N ASN A 133 -7.287 2.202 -14.402 1.00 63.21 N ATOM 2144 CA ASN A 133 -6.659 2.983 -15.467 1.00 30.43 C ATOM 2145 C ASN A 133 -7.736 3.646 -16.306 1.00 24.12 C ATOM 2146 O ASN A 133 -8.902 3.668 -15.913 1.00 65.15 O ATOM 2147 CB ASN A 133 -5.738 2.115 -16.338 1.00 33.02 C ATOM 2148 CG ASN A 133 -6.490 1.175 -17.275 1.00 65.45 C ATOM 2149 OD1 ASN A 133 -7.611 0.787 -16.987 1.00 12.14 O ATOM 2150 ND2 ASN A 133 -5.945 0.833 -18.426 1.00 63.42 N ATOM 0 H ASN A 133 -7.889 1.459 -14.756 1.00 63.21 H new ATOM 0 HA ASN A 133 -6.033 3.751 -15.013 1.00 30.43 H new ATOM 0 HB2 ASN A 133 -5.093 2.765 -16.930 1.00 33.02 H new ATOM 0 HB3 ASN A 133 -5.089 1.526 -15.690 1.00 33.02 H new ATOM 0 HD21 ASN A 133 -6.460 0.243 -19.079 1.00 63.42 H new ATOM 0 HD22 ASN A 133 -5.008 1.159 -18.664 1.00 63.42 H new ATOM 2157 N GLU A 134 -7.336 4.198 -17.445 1.00 62.35 N ATOM 2158 CA GLU A 134 -8.242 4.876 -18.379 1.00 63.23 C ATOM 2159 C GLU A 134 -9.269 3.911 -18.990 1.00 44.25 C ATOM 2160 O GLU A 134 -10.320 4.346 -19.459 1.00 71.43 O ATOM 2161 CB GLU A 134 -7.406 5.584 -19.463 1.00 72.44 C ATOM 2162 CG GLU A 134 -6.764 6.844 -18.857 1.00 30.33 C ATOM 2163 CD GLU A 134 -5.650 7.525 -19.659 1.00 10.24 C ATOM 2164 OE1 GLU A 134 -5.649 7.515 -20.908 1.00 30.40 O ATOM 2165 OE2 GLU A 134 -4.814 8.191 -18.992 1.00 64.11 O ATOM 0 H GLU A 134 -6.364 4.190 -17.754 1.00 62.35 H new ATOM 0 HA GLU A 134 -8.821 5.620 -17.831 1.00 63.23 H new ATOM 0 HB2 GLU A 134 -6.635 4.913 -19.841 1.00 72.44 H new ATOM 0 HB3 GLU A 134 -8.038 5.853 -20.310 1.00 72.44 H new ATOM 0 HG2 GLU A 134 -7.554 7.576 -18.689 1.00 30.33 H new ATOM 0 HG3 GLU A 134 -6.361 6.579 -17.879 1.00 30.33 H new ATOM 2172 N GLU A 135 -8.999 2.606 -18.949 1.00 5.40 N ATOM 2173 CA GLU A 135 -9.863 1.555 -19.474 1.00 24.33 C ATOM 2174 C GLU A 135 -10.749 0.932 -18.391 1.00 31.22 C ATOM 2175 O GLU A 135 -11.635 0.131 -18.698 1.00 71.21 O ATOM 2176 CB GLU A 135 -8.993 0.469 -20.102 1.00 72.32 C ATOM 2177 CG GLU A 135 -8.106 1.058 -21.200 1.00 62.31 C ATOM 2178 CD GLU A 135 -7.431 -0.057 -21.978 1.00 1.24 C ATOM 2179 OE1 GLU A 135 -6.412 -0.590 -21.486 1.00 41.31 O ATOM 2180 OE2 GLU A 135 -7.944 -0.382 -23.073 1.00 45.42 O ATOM 0 H GLU A 135 -8.141 2.242 -18.534 1.00 5.40 H new ATOM 0 HA GLU A 135 -10.523 2.004 -20.216 1.00 24.33 H new ATOM 0 HB2 GLU A 135 -8.372 0.004 -19.336 1.00 72.32 H new ATOM 0 HB3 GLU A 135 -9.625 -0.315 -20.519 1.00 72.32 H new ATOM 0 HG2 GLU A 135 -8.706 1.671 -21.873 1.00 62.31 H new ATOM 0 HG3 GLU A 135 -7.354 1.712 -20.759 1.00 62.31 H new ATOM 2187 N LEU A 136 -10.532 1.335 -17.137 1.00 2.53 N ATOM 2188 CA LEU A 136 -11.178 0.868 -15.922 1.00 3.32 C ATOM 2189 C LEU A 136 -10.788 -0.572 -15.541 1.00 11.13 C ATOM 2190 O LEU A 136 -11.595 -1.310 -14.966 1.00 31.12 O ATOM 2191 CB LEU A 136 -12.692 1.105 -15.948 1.00 42.53 C ATOM 2192 CG LEU A 136 -13.143 2.522 -16.365 1.00 62.41 C ATOM 2193 CD1 LEU A 136 -14.660 2.646 -16.223 1.00 62.03 C ATOM 2194 CD2 LEU A 136 -12.474 3.633 -15.549 1.00 31.32 C ATOM 0 H LEU A 136 -9.841 2.057 -16.936 1.00 2.53 H new ATOM 0 HA LEU A 136 -10.789 1.483 -15.110 1.00 3.32 H new ATOM 0 HB2 LEU A 136 -13.142 0.385 -16.632 1.00 42.53 H new ATOM 0 HB3 LEU A 136 -13.091 0.894 -14.956 1.00 42.53 H new ATOM 0 HG LEU A 136 -12.837 2.651 -17.403 1.00 62.41 H new ATOM 0 HD11 LEU A 136 -14.972 3.648 -16.518 1.00 62.03 H new ATOM 0 HD12 LEU A 136 -15.147 1.910 -16.863 1.00 62.03 H new ATOM 0 HD13 LEU A 136 -14.944 2.469 -15.186 1.00 62.03 H new ATOM 0 HD21 LEU A 136 -12.834 4.603 -15.892 1.00 31.32 H new ATOM 0 HD22 LEU A 136 -12.718 3.507 -14.494 1.00 31.32 H new ATOM 0 HD23 LEU A 136 -11.393 3.580 -15.680 1.00 31.32 H new ATOM 2206 N ASP A 137 -9.544 -0.940 -15.849 1.00 70.04 N ATOM 2207 CA ASP A 137 -8.867 -2.204 -15.564 1.00 53.25 C ATOM 2208 C ASP A 137 -8.300 -2.255 -14.142 1.00 63.11 C ATOM 2209 O ASP A 137 -8.557 -1.371 -13.336 1.00 63.24 O ATOM 2210 CB ASP A 137 -7.699 -2.348 -16.559 1.00 42.31 C ATOM 2211 CG ASP A 137 -7.103 -3.770 -16.631 1.00 51.13 C ATOM 2212 OD1 ASP A 137 -7.800 -4.781 -16.354 1.00 70.44 O ATOM 2213 OD2 ASP A 137 -5.864 -3.865 -16.764 1.00 10.50 O ATOM 0 H ASP A 137 -8.928 -0.300 -16.351 1.00 70.04 H new ATOM 0 HA ASP A 137 -9.594 -3.011 -15.660 1.00 53.25 H new ATOM 0 HB2 ASP A 137 -8.044 -2.060 -17.552 1.00 42.31 H new ATOM 0 HB3 ASP A 137 -6.910 -1.649 -16.280 1.00 42.31 H new ATOM 2218 N PHE A 138 -7.479 -3.256 -13.828 1.00 54.45 N ATOM 2219 CA PHE A 138 -6.657 -3.320 -12.631 1.00 64.03 C ATOM 2220 C PHE A 138 -5.198 -3.057 -13.022 1.00 70.31 C ATOM 2221 O PHE A 138 -4.497 -3.971 -13.458 1.00 44.42 O ATOM 2222 CB PHE A 138 -6.827 -4.697 -11.986 1.00 33.22 C ATOM 2223 CG PHE A 138 -8.266 -5.172 -11.890 1.00 23.02 C ATOM 2224 CD1 PHE A 138 -9.220 -4.408 -11.193 1.00 12.21 C ATOM 2225 CD2 PHE A 138 -8.663 -6.351 -12.551 1.00 62.42 C ATOM 2226 CE1 PHE A 138 -10.557 -4.834 -11.148 1.00 52.45 C ATOM 2227 CE2 PHE A 138 -9.988 -6.802 -12.462 1.00 45.22 C ATOM 2228 CZ PHE A 138 -10.933 -6.039 -11.766 1.00 31.30 C ATOM 0 H PHE A 138 -7.367 -4.074 -14.427 1.00 54.45 H new ATOM 0 HA PHE A 138 -6.960 -2.565 -11.906 1.00 64.03 H new ATOM 0 HB2 PHE A 138 -6.254 -5.426 -12.559 1.00 33.22 H new ATOM 0 HB3 PHE A 138 -6.398 -4.671 -10.984 1.00 33.22 H new ATOM 0 HD1 PHE A 138 -8.925 -3.497 -10.694 1.00 12.21 H new ATOM 0 HD2 PHE A 138 -7.943 -6.911 -13.130 1.00 62.42 H new ATOM 0 HE1 PHE A 138 -11.297 -4.235 -10.638 1.00 52.45 H new ATOM 0 HE2 PHE A 138 -10.278 -7.732 -12.928 1.00 45.22 H new ATOM 0 HZ PHE A 138 -11.956 -6.378 -11.704 1.00 31.30 H new ATOM 2238 N GLU A 139 -4.721 -1.826 -12.871 1.00 5.12 N ATOM 2239 CA GLU A 139 -3.288 -1.551 -12.923 1.00 41.35 C ATOM 2240 C GLU A 139 -2.646 -2.205 -11.698 1.00 22.22 C ATOM 2241 O GLU A 139 -3.076 -1.942 -10.569 1.00 43.35 O ATOM 2242 CB GLU A 139 -3.045 -0.037 -12.910 1.00 10.24 C ATOM 2243 CG GLU A 139 -1.557 0.343 -12.968 1.00 3.10 C ATOM 2244 CD GLU A 139 -0.939 0.050 -14.334 1.00 43.44 C ATOM 2245 OE1 GLU A 139 -1.278 0.797 -15.276 1.00 30.42 O ATOM 2246 OE2 GLU A 139 -0.122 -0.889 -14.446 1.00 62.21 O ATOM 0 H GLU A 139 -5.303 -1.004 -12.712 1.00 5.12 H new ATOM 0 HA GLU A 139 -2.851 -1.953 -13.837 1.00 41.35 H new ATOM 0 HB2 GLU A 139 -3.561 0.414 -13.758 1.00 10.24 H new ATOM 0 HB3 GLU A 139 -3.486 0.386 -12.007 1.00 10.24 H new ATOM 0 HG2 GLU A 139 -1.445 1.403 -12.741 1.00 3.10 H new ATOM 0 HG3 GLU A 139 -1.013 -0.207 -12.200 1.00 3.10 H new ATOM 2253 N LEU A 140 -1.613 -3.023 -11.903 1.00 51.54 N ATOM 2254 CA LEU A 140 -0.864 -3.692 -10.847 1.00 30.14 C ATOM 2255 C LEU A 140 0.613 -3.311 -10.974 1.00 73.44 C ATOM 2256 O LEU A 140 1.089 -2.990 -12.061 1.00 1.50 O ATOM 2257 CB LEU A 140 -1.095 -5.205 -10.984 1.00 73.04 C ATOM 2258 CG LEU A 140 -0.432 -6.031 -9.862 1.00 3.42 C ATOM 2259 CD1 LEU A 140 -1.472 -6.744 -9.012 1.00 72.02 C ATOM 2260 CD2 LEU A 140 0.582 -7.019 -10.430 1.00 32.43 C ATOM 0 H LEU A 140 -1.267 -3.243 -12.837 1.00 51.54 H new ATOM 0 HA LEU A 140 -1.197 -3.386 -9.855 1.00 30.14 H new ATOM 0 HB2 LEU A 140 -2.167 -5.403 -10.985 1.00 73.04 H new ATOM 0 HB3 LEU A 140 -0.708 -5.538 -11.947 1.00 73.04 H new ATOM 0 HG LEU A 140 0.105 -5.336 -9.216 1.00 3.42 H new ATOM 0 HD11 LEU A 140 -0.973 -7.317 -8.231 1.00 72.02 H new ATOM 0 HD12 LEU A 140 -2.135 -6.009 -8.555 1.00 72.02 H new ATOM 0 HD13 LEU A 140 -2.055 -7.418 -9.640 1.00 72.02 H new ATOM 0 HD21 LEU A 140 1.033 -7.587 -9.616 1.00 32.43 H new ATOM 0 HD22 LEU A 140 0.080 -7.703 -11.114 1.00 32.43 H new ATOM 0 HD23 LEU A 140 1.359 -6.475 -10.966 1.00 32.43 H new ATOM 2272 N TYR A 141 1.359 -3.340 -9.871 1.00 73.24 N ATOM 2273 CA TYR A 141 2.807 -3.147 -9.854 1.00 54.33 C ATOM 2274 C TYR A 141 3.367 -4.053 -8.767 1.00 52.12 C ATOM 2275 O TYR A 141 2.864 -3.984 -7.647 1.00 3.44 O ATOM 2276 CB TYR A 141 3.147 -1.674 -9.615 1.00 71.03 C ATOM 2277 CG TYR A 141 4.604 -1.311 -9.791 1.00 44.31 C ATOM 2278 CD1 TYR A 141 5.160 -1.363 -11.081 1.00 5.53 C ATOM 2279 CD2 TYR A 141 5.376 -0.830 -8.713 1.00 44.51 C ATOM 2280 CE1 TYR A 141 6.507 -1.024 -11.273 1.00 74.42 C ATOM 2281 CE2 TYR A 141 6.711 -0.418 -8.912 1.00 51.44 C ATOM 2282 CZ TYR A 141 7.296 -0.570 -10.195 1.00 30.32 C ATOM 2283 OH TYR A 141 8.606 -0.300 -10.441 1.00 5.52 O ATOM 0 H TYR A 141 0.964 -3.502 -8.944 1.00 73.24 H new ATOM 0 HA TYR A 141 3.255 -3.409 -10.813 1.00 54.33 H new ATOM 0 HB2 TYR A 141 2.553 -1.066 -10.297 1.00 71.03 H new ATOM 0 HB3 TYR A 141 2.843 -1.407 -8.603 1.00 71.03 H new ATOM 0 HD1 TYR A 141 4.552 -1.663 -11.921 1.00 5.53 H new ATOM 0 HD2 TYR A 141 4.941 -0.776 -7.726 1.00 44.51 H new ATOM 0 HE1 TYR A 141 6.945 -1.111 -12.256 1.00 74.42 H new ATOM 0 HE2 TYR A 141 7.280 0.007 -8.098 1.00 51.44 H new ATOM 0 HH TYR A 141 9.038 0.005 -9.616 1.00 5.52 H new ATOM 2293 N VAL A 142 4.326 -4.919 -9.101 1.00 43.42 N ATOM 2294 CA VAL A 142 4.969 -5.890 -8.213 1.00 32.41 C ATOM 2295 C VAL A 142 6.478 -5.921 -8.511 1.00 61.02 C ATOM 2296 O VAL A 142 6.977 -6.865 -9.131 1.00 10.53 O ATOM 2297 CB VAL A 142 4.309 -7.284 -8.307 1.00 4.20 C ATOM 2298 CG1 VAL A 142 2.997 -7.311 -7.512 1.00 50.21 C ATOM 2299 CG2 VAL A 142 4.062 -7.723 -9.760 1.00 51.22 C ATOM 0 H VAL A 142 4.695 -4.964 -10.051 1.00 43.42 H new ATOM 0 HA VAL A 142 4.831 -5.578 -7.178 1.00 32.41 H new ATOM 0 HB VAL A 142 5.009 -7.997 -7.872 1.00 4.20 H new ATOM 0 HG11 VAL A 142 2.545 -8.300 -7.589 1.00 50.21 H new ATOM 0 HG12 VAL A 142 3.201 -7.086 -6.465 1.00 50.21 H new ATOM 0 HG13 VAL A 142 2.311 -6.567 -7.916 1.00 50.21 H new ATOM 0 HG21 VAL A 142 3.597 -8.709 -9.768 1.00 51.22 H new ATOM 0 HG22 VAL A 142 3.402 -7.006 -10.249 1.00 51.22 H new ATOM 0 HG23 VAL A 142 5.011 -7.765 -10.294 1.00 51.22 H new ATOM 2309 N PRO A 143 7.238 -4.897 -8.093 1.00 63.02 N ATOM 2310 CA PRO A 143 8.661 -4.750 -8.413 1.00 12.52 C ATOM 2311 C PRO A 143 9.547 -5.924 -7.975 1.00 45.45 C ATOM 2312 O PRO A 143 10.666 -6.067 -8.479 1.00 42.24 O ATOM 2313 CB PRO A 143 9.097 -3.428 -7.757 1.00 63.22 C ATOM 2314 CG PRO A 143 7.972 -3.094 -6.776 1.00 25.22 C ATOM 2315 CD PRO A 143 6.746 -3.696 -7.450 1.00 63.32 C ATOM 0 HA PRO A 143 8.789 -4.743 -9.495 1.00 12.52 H new ATOM 0 HB2 PRO A 143 10.052 -3.537 -7.243 1.00 63.22 H new ATOM 0 HB3 PRO A 143 9.223 -2.640 -8.499 1.00 63.22 H new ATOM 0 HG2 PRO A 143 8.149 -3.532 -5.794 1.00 25.22 H new ATOM 0 HG3 PRO A 143 7.867 -2.019 -6.632 1.00 25.22 H new ATOM 0 HD2 PRO A 143 5.966 -3.926 -6.724 1.00 63.32 H new ATOM 0 HD3 PRO A 143 6.313 -3.007 -8.175 1.00 63.32 H new ATOM 2323 N TYR A 144 9.075 -6.791 -7.078 1.00 34.13 N ATOM 2324 CA TYR A 144 9.837 -7.934 -6.587 1.00 25.00 C ATOM 2325 C TYR A 144 9.224 -9.250 -7.058 1.00 25.04 C ATOM 2326 O TYR A 144 9.923 -10.262 -7.093 1.00 50.24 O ATOM 2327 CB TYR A 144 9.992 -7.800 -5.068 1.00 54.52 C ATOM 2328 CG TYR A 144 10.635 -6.467 -4.737 1.00 25.23 C ATOM 2329 CD1 TYR A 144 11.993 -6.245 -5.058 1.00 21.43 C ATOM 2330 CD2 TYR A 144 9.843 -5.407 -4.257 1.00 23.42 C ATOM 2331 CE1 TYR A 144 12.553 -4.960 -4.951 1.00 32.12 C ATOM 2332 CE2 TYR A 144 10.404 -4.125 -4.160 1.00 14.12 C ATOM 2333 CZ TYR A 144 11.731 -3.898 -4.543 1.00 3.21 C ATOM 2334 OH TYR A 144 12.200 -2.637 -4.515 1.00 1.54 O ATOM 0 H TYR A 144 8.143 -6.716 -6.670 1.00 34.13 H new ATOM 0 HA TYR A 144 10.842 -7.945 -7.009 1.00 25.00 H new ATOM 0 HB2 TYR A 144 9.018 -7.875 -4.585 1.00 54.52 H new ATOM 0 HB3 TYR A 144 10.603 -8.616 -4.681 1.00 54.52 H new ATOM 0 HD1 TYR A 144 12.606 -7.070 -5.389 1.00 21.43 H new ATOM 0 HD2 TYR A 144 8.817 -5.578 -3.967 1.00 23.42 H new ATOM 0 HE1 TYR A 144 13.596 -4.793 -5.178 1.00 32.12 H new ATOM 0 HE2 TYR A 144 9.807 -3.306 -3.787 1.00 14.12 H new ATOM 0 HH TYR A 144 12.888 -2.528 -5.205 1.00 1.54 H new ATOM 2344 N GLY A 145 7.993 -9.225 -7.565 1.00 71.14 N ATOM 2345 CA GLY A 145 7.252 -10.383 -8.038 1.00 61.41 C ATOM 2346 C GLY A 145 6.017 -10.585 -7.176 1.00 54.35 C ATOM 2347 O GLY A 145 5.935 -10.088 -6.051 1.00 23.10 O ATOM 0 H GLY A 145 7.466 -8.357 -7.660 1.00 71.14 H new ATOM 0 HA2 GLY A 145 6.962 -10.241 -9.079 1.00 61.41 H new ATOM 0 HA3 GLY A 145 7.883 -11.271 -8.001 1.00 61.41 H new ATOM 2351 N LEU A 146 5.036 -11.316 -7.704 1.00 3.33 N ATOM 2352 CA LEU A 146 3.784 -11.543 -6.994 1.00 65.21 C ATOM 2353 C LEU A 146 4.027 -12.465 -5.810 1.00 3.40 C ATOM 2354 O LEU A 146 3.403 -12.299 -4.766 1.00 33.01 O ATOM 2355 CB LEU A 146 2.733 -12.136 -7.953 1.00 42.33 C ATOM 2356 CG LEU A 146 1.857 -11.031 -8.559 1.00 70.34 C ATOM 2357 CD1 LEU A 146 1.145 -11.511 -9.820 1.00 50.45 C ATOM 2358 CD2 LEU A 146 0.812 -10.517 -7.561 1.00 33.11 C ATOM 0 H LEU A 146 5.087 -11.760 -8.621 1.00 3.33 H new ATOM 0 HA LEU A 146 3.401 -10.594 -6.619 1.00 65.21 H new ATOM 0 HB2 LEU A 146 3.232 -12.687 -8.750 1.00 42.33 H new ATOM 0 HB3 LEU A 146 2.107 -12.849 -7.416 1.00 42.33 H new ATOM 0 HG LEU A 146 2.531 -10.214 -8.815 1.00 70.34 H new ATOM 0 HD11 LEU A 146 0.534 -10.703 -10.222 1.00 50.45 H new ATOM 0 HD12 LEU A 146 1.884 -11.812 -10.563 1.00 50.45 H new ATOM 0 HD13 LEU A 146 0.508 -12.361 -9.577 1.00 50.45 H new ATOM 0 HD21 LEU A 146 0.214 -9.736 -8.031 1.00 33.11 H new ATOM 0 HD22 LEU A 146 0.163 -11.339 -7.258 1.00 33.11 H new ATOM 0 HD23 LEU A 146 1.316 -10.110 -6.684 1.00 33.11 H new ATOM 2370 N GLU A 147 4.957 -13.408 -5.954 1.00 22.40 N ATOM 2371 CA GLU A 147 5.170 -14.497 -5.024 1.00 24.12 C ATOM 2372 C GLU A 147 5.474 -14.026 -3.598 1.00 70.42 C ATOM 2373 O GLU A 147 5.095 -14.715 -2.650 1.00 11.23 O ATOM 2374 CB GLU A 147 6.287 -15.395 -5.571 1.00 22.23 C ATOM 2375 CG GLU A 147 5.754 -16.620 -6.338 1.00 52.23 C ATOM 2376 CD GLU A 147 6.297 -17.912 -5.728 1.00 44.32 C ATOM 2377 OE1 GLU A 147 7.534 -18.069 -5.655 1.00 41.52 O ATOM 2378 OE2 GLU A 147 5.496 -18.728 -5.202 1.00 24.04 O ATOM 0 H GLU A 147 5.598 -13.429 -6.747 1.00 22.40 H new ATOM 0 HA GLU A 147 4.241 -15.062 -4.943 1.00 24.12 H new ATOM 0 HB2 GLU A 147 6.926 -14.809 -6.232 1.00 22.23 H new ATOM 0 HB3 GLU A 147 6.911 -15.734 -4.744 1.00 22.23 H new ATOM 0 HG2 GLU A 147 4.664 -16.628 -6.310 1.00 52.23 H new ATOM 0 HG3 GLU A 147 6.046 -16.555 -7.386 1.00 52.23 H new ATOM 2385 N ASP A 148 6.072 -12.842 -3.431 1.00 62.02 N ATOM 2386 CA ASP A 148 6.322 -12.242 -2.119 1.00 13.13 C ATOM 2387 C ASP A 148 5.026 -12.072 -1.335 1.00 63.34 C ATOM 2388 O ASP A 148 5.036 -12.153 -0.108 1.00 53.32 O ATOM 2389 CB ASP A 148 6.971 -10.856 -2.254 1.00 63.44 C ATOM 2390 CG ASP A 148 8.482 -10.958 -2.386 1.00 2.24 C ATOM 2391 OD1 ASP A 148 8.961 -11.229 -3.514 1.00 3.12 O ATOM 2392 OD2 ASP A 148 9.191 -10.762 -1.374 1.00 74.21 O ATOM 0 H ASP A 148 6.398 -12.270 -4.210 1.00 62.02 H new ATOM 0 HA ASP A 148 6.994 -12.920 -1.592 1.00 13.13 H new ATOM 0 HB2 ASP A 148 6.562 -10.345 -3.126 1.00 63.44 H new ATOM 0 HB3 ASP A 148 6.721 -10.250 -1.383 1.00 63.44 H new ATOM 2397 N ILE A 149 3.900 -11.842 -2.018 1.00 25.44 N ATOM 2398 CA ILE A 149 2.628 -11.628 -1.368 1.00 44.14 C ATOM 2399 C ILE A 149 1.973 -13.000 -1.195 1.00 44.52 C ATOM 2400 O ILE A 149 1.421 -13.264 -0.127 1.00 51.14 O ATOM 2401 CB ILE A 149 1.743 -10.647 -2.174 1.00 11.52 C ATOM 2402 CG1 ILE A 149 2.503 -9.439 -2.775 1.00 32.43 C ATOM 2403 CG2 ILE A 149 0.657 -10.082 -1.244 1.00 32.12 C ATOM 2404 CD1 ILE A 149 1.601 -8.617 -3.703 1.00 3.54 C ATOM 0 H ILE A 149 3.858 -11.801 -3.036 1.00 25.44 H new ATOM 0 HA ILE A 149 2.764 -11.161 -0.393 1.00 44.14 H new ATOM 0 HB ILE A 149 1.341 -11.226 -3.006 1.00 11.52 H new ATOM 0 HG12 ILE A 149 2.875 -8.804 -1.971 1.00 32.43 H new ATOM 0 HG13 ILE A 149 3.372 -9.793 -3.330 1.00 32.43 H new ATOM 0 HG21 ILE A 149 0.026 -9.389 -1.800 1.00 32.12 H new ATOM 0 HG22 ILE A 149 0.047 -10.899 -0.859 1.00 32.12 H new ATOM 0 HG23 ILE A 149 1.127 -9.557 -0.412 1.00 32.12 H new ATOM 0 HD11 ILE A 149 2.165 -7.777 -4.108 1.00 3.54 H new ATOM 0 HD12 ILE A 149 1.250 -9.247 -4.521 1.00 3.54 H new ATOM 0 HD13 ILE A 149 0.746 -8.242 -3.141 1.00 3.54 H new ATOM 2416 N LEU A 150 2.014 -13.878 -2.211 1.00 24.44 N ATOM 2417 CA LEU A 150 1.328 -15.176 -2.173 1.00 23.01 C ATOM 2418 C LEU A 150 1.885 -16.072 -1.077 1.00 3.14 C ATOM 2419 O LEU A 150 1.137 -16.826 -0.453 1.00 33.02 O ATOM 2420 CB LEU A 150 1.422 -15.951 -3.507 1.00 30.34 C ATOM 2421 CG LEU A 150 0.557 -15.476 -4.687 1.00 73.13 C ATOM 2422 CD1 LEU A 150 -0.829 -15.010 -4.259 1.00 70.14 C ATOM 2423 CD2 LEU A 150 1.179 -14.320 -5.452 1.00 64.05 C ATOM 0 H LEU A 150 2.523 -13.707 -3.078 1.00 24.44 H new ATOM 0 HA LEU A 150 0.283 -14.935 -1.976 1.00 23.01 H new ATOM 0 HB2 LEU A 150 2.463 -15.934 -3.829 1.00 30.34 H new ATOM 0 HB3 LEU A 150 1.168 -16.992 -3.306 1.00 30.34 H new ATOM 0 HG LEU A 150 0.485 -16.359 -5.322 1.00 73.13 H new ATOM 0 HD11 LEU A 150 -1.391 -14.687 -5.135 1.00 70.14 H new ATOM 0 HD12 LEU A 150 -1.355 -15.832 -3.773 1.00 70.14 H new ATOM 0 HD13 LEU A 150 -0.734 -14.177 -3.562 1.00 70.14 H new ATOM 0 HD21 LEU A 150 0.522 -14.031 -6.272 1.00 64.05 H new ATOM 0 HD22 LEU A 150 1.317 -13.472 -4.781 1.00 64.05 H new ATOM 0 HD23 LEU A 150 2.145 -14.627 -5.853 1.00 64.05 H new ATOM 2435 N ASN A 151 3.196 -16.020 -0.855 1.00 1.44 N ATOM 2436 CA ASN A 151 3.873 -16.782 0.177 1.00 72.34 C ATOM 2437 C ASN A 151 3.951 -15.996 1.481 1.00 51.45 C ATOM 2438 O ASN A 151 4.618 -16.454 2.399 1.00 32.21 O ATOM 2439 CB ASN A 151 5.259 -17.210 -0.303 1.00 12.12 C ATOM 2440 CG ASN A 151 5.154 -18.095 -1.529 1.00 12.50 C ATOM 2441 OD1 ASN A 151 4.675 -19.225 -1.477 1.00 72.15 O ATOM 2442 ND2 ASN A 151 5.519 -17.547 -2.669 1.00 5.20 N ATOM 0 H ASN A 151 3.826 -15.433 -1.402 1.00 1.44 H new ATOM 0 HA ASN A 151 3.292 -17.682 0.378 1.00 72.34 H new ATOM 0 HB2 ASN A 151 5.857 -16.329 -0.535 1.00 12.12 H new ATOM 0 HB3 ASN A 151 5.776 -17.745 0.494 1.00 12.12 H new ATOM 0 HD21 ASN A 151 5.407 -18.063 -3.542 1.00 5.20 H new ATOM 0 HD22 ASN A 151 5.914 -16.607 -2.679 1.00 5.20 H new ATOM 2449 N PHE A 152 3.287 -14.834 1.583 1.00 32.10 N ATOM 2450 CA PHE A 152 3.224 -14.010 2.779 1.00 30.32 C ATOM 2451 C PHE A 152 4.627 -13.739 3.324 1.00 45.25 C ATOM 2452 O PHE A 152 4.920 -14.006 4.485 1.00 64.42 O ATOM 2453 CB PHE A 152 2.321 -14.698 3.805 1.00 30.32 C ATOM 2454 CG PHE A 152 0.849 -14.765 3.485 1.00 62.14 C ATOM 2455 CD1 PHE A 152 0.023 -13.724 3.938 1.00 61.05 C ATOM 2456 CD2 PHE A 152 0.284 -15.913 2.896 1.00 71.12 C ATOM 2457 CE1 PHE A 152 -1.371 -13.854 3.860 1.00 65.12 C ATOM 2458 CE2 PHE A 152 -1.115 -16.023 2.790 1.00 71.02 C ATOM 2459 CZ PHE A 152 -1.939 -14.998 3.285 1.00 21.23 C ATOM 0 H PHE A 152 2.764 -14.437 0.802 1.00 32.10 H new ATOM 0 HA PHE A 152 2.794 -13.037 2.542 1.00 30.32 H new ATOM 0 HB2 PHE A 152 2.684 -15.716 3.947 1.00 30.32 H new ATOM 0 HB3 PHE A 152 2.437 -14.183 4.758 1.00 30.32 H new ATOM 0 HD1 PHE A 152 0.460 -12.825 4.346 1.00 61.05 H new ATOM 0 HD2 PHE A 152 0.921 -16.704 2.528 1.00 71.12 H new ATOM 0 HE1 PHE A 152 -2.008 -13.071 4.244 1.00 65.12 H new ATOM 0 HE2 PHE A 152 -1.555 -16.895 2.329 1.00 71.02 H new ATOM 0 HZ PHE A 152 -3.013 -15.093 3.222 1.00 21.23 H new ATOM 2469 N GLN A 153 5.530 -13.249 2.481 1.00 3.13 N ATOM 2470 CA GLN A 153 6.891 -12.980 2.906 1.00 52.32 C ATOM 2471 C GLN A 153 6.988 -11.534 3.367 1.00 22.24 C ATOM 2472 O GLN A 153 6.436 -10.662 2.700 1.00 24.02 O ATOM 2473 CB GLN A 153 7.848 -13.204 1.733 1.00 54.21 C ATOM 2474 CG GLN A 153 7.698 -14.596 1.112 1.00 74.44 C ATOM 2475 CD GLN A 153 9.065 -15.164 0.793 1.00 70.24 C ATOM 2476 OE1 GLN A 153 9.741 -14.687 -0.113 1.00 30.31 O ATOM 2477 NE2 GLN A 153 9.560 -16.110 1.572 1.00 44.53 N ATOM 0 H GLN A 153 5.341 -13.032 1.503 1.00 3.13 H new ATOM 0 HA GLN A 153 7.160 -13.649 3.723 1.00 52.32 H new ATOM 0 HB2 GLN A 153 7.666 -12.448 0.970 1.00 54.21 H new ATOM 0 HB3 GLN A 153 8.874 -13.071 2.075 1.00 54.21 H new ATOM 0 HG2 GLN A 153 7.171 -15.257 1.800 1.00 74.44 H new ATOM 0 HG3 GLN A 153 7.098 -14.537 0.204 1.00 74.44 H new ATOM 0 HE21 GLN A 153 8.992 -16.501 2.323 1.00 44.53 H new ATOM 0 HE22 GLN A 153 10.510 -16.449 1.422 1.00 44.53 H new ATOM 2486 N VAL A 154 7.790 -11.264 4.394 1.00 70.42 N ATOM 2487 CA VAL A 154 8.140 -9.930 4.867 1.00 54.43 C ATOM 2488 C VAL A 154 9.667 -9.866 4.851 1.00 41.15 C ATOM 2489 O VAL A 154 10.303 -10.222 5.839 1.00 21.41 O ATOM 2490 CB VAL A 154 7.502 -9.683 6.259 1.00 34.14 C ATOM 2491 CG1 VAL A 154 7.801 -8.302 6.852 1.00 64.33 C ATOM 2492 CG2 VAL A 154 5.975 -9.794 6.203 1.00 64.33 C ATOM 0 H VAL A 154 8.232 -12.002 4.942 1.00 70.42 H new ATOM 0 HA VAL A 154 7.751 -9.130 4.237 1.00 54.43 H new ATOM 0 HB VAL A 154 7.950 -10.452 6.888 1.00 34.14 H new ATOM 0 HG11 VAL A 154 7.318 -8.212 7.825 1.00 64.33 H new ATOM 0 HG12 VAL A 154 8.878 -8.182 6.969 1.00 64.33 H new ATOM 0 HG13 VAL A 154 7.420 -7.529 6.185 1.00 64.33 H new ATOM 0 HG21 VAL A 154 5.561 -9.615 7.195 1.00 64.33 H new ATOM 0 HG22 VAL A 154 5.582 -9.053 5.507 1.00 64.33 H new ATOM 0 HG23 VAL A 154 5.695 -10.792 5.867 1.00 64.33 H new ATOM 2502 N ARG A 155 10.268 -9.475 3.718 1.00 71.14 N ATOM 2503 CA ARG A 155 11.702 -9.163 3.611 1.00 45.44 C ATOM 2504 C ARG A 155 11.881 -7.695 3.232 1.00 41.32 C ATOM 2505 O ARG A 155 11.023 -7.150 2.537 1.00 24.14 O ATOM 2506 CB ARG A 155 12.465 -10.068 2.610 1.00 73.45 C ATOM 2507 CG ARG A 155 11.727 -10.544 1.340 1.00 24.40 C ATOM 2508 CD ARG A 155 11.590 -12.071 1.306 1.00 13.40 C ATOM 2509 NE ARG A 155 12.915 -12.678 1.129 1.00 31.23 N ATOM 2510 CZ ARG A 155 13.265 -13.959 1.056 1.00 32.14 C ATOM 2511 NH1 ARG A 155 12.366 -14.931 1.114 1.00 50.34 N ATOM 2512 NH2 ARG A 155 14.548 -14.241 0.929 1.00 44.33 N ATOM 0 H ARG A 155 9.765 -9.365 2.837 1.00 71.14 H new ATOM 0 HA ARG A 155 12.137 -9.361 4.590 1.00 45.44 H new ATOM 0 HB2 ARG A 155 13.359 -9.532 2.293 1.00 73.45 H new ATOM 0 HB3 ARG A 155 12.799 -10.953 3.151 1.00 73.45 H new ATOM 0 HG2 ARG A 155 10.738 -10.088 1.301 1.00 24.40 H new ATOM 0 HG3 ARG A 155 12.268 -10.207 0.456 1.00 24.40 H new ATOM 0 HD2 ARG A 155 11.136 -12.427 2.231 1.00 13.40 H new ATOM 0 HD3 ARG A 155 10.930 -12.369 0.492 1.00 13.40 H new ATOM 0 HE ARG A 155 13.686 -12.015 1.050 1.00 31.23 H new ATOM 0 HH11 ARG A 155 11.377 -14.705 1.217 1.00 50.34 H new ATOM 0 HH12 ARG A 155 12.663 -15.905 1.055 1.00 50.34 H new ATOM 0 HH21 ARG A 155 15.234 -13.487 0.890 1.00 44.33 H new ATOM 0 HH22 ARG A 155 14.853 -15.212 0.870 1.00 44.33 H new ATOM 2526 N PRO A 156 13.001 -7.054 3.599 1.00 4.23 N ATOM 2527 CA PRO A 156 13.353 -5.726 3.113 1.00 43.33 C ATOM 2528 C PRO A 156 13.729 -5.788 1.631 1.00 22.10 C ATOM 2529 O PRO A 156 14.168 -6.822 1.116 1.00 13.43 O ATOM 2530 CB PRO A 156 14.520 -5.286 3.988 1.00 42.41 C ATOM 2531 CG PRO A 156 15.224 -6.596 4.310 1.00 74.25 C ATOM 2532 CD PRO A 156 14.071 -7.588 4.429 1.00 31.30 C ATOM 0 HA PRO A 156 12.528 -5.016 3.178 1.00 43.33 H new ATOM 0 HB2 PRO A 156 15.178 -4.593 3.464 1.00 42.41 H new ATOM 0 HB3 PRO A 156 14.178 -4.780 4.891 1.00 42.41 H new ATOM 0 HG2 PRO A 156 15.922 -6.882 3.524 1.00 74.25 H new ATOM 0 HG3 PRO A 156 15.796 -6.530 5.236 1.00 74.25 H new ATOM 0 HD2 PRO A 156 14.371 -8.579 4.090 1.00 31.30 H new ATOM 0 HD3 PRO A 156 13.748 -7.690 5.465 1.00 31.30 H new ATOM 2540 N THR A 157 13.558 -4.676 0.926 1.00 30.24 N ATOM 2541 CA THR A 157 14.064 -4.463 -0.418 1.00 45.11 C ATOM 2542 C THR A 157 15.583 -4.342 -0.446 1.00 33.20 C ATOM 2543 O THR A 157 16.196 -3.992 0.569 1.00 45.43 O ATOM 2544 CB THR A 157 13.415 -3.205 -1.007 1.00 24.43 C ATOM 2545 OG1 THR A 157 13.537 -2.057 -0.187 1.00 3.14 O ATOM 2546 CG2 THR A 157 11.965 -3.546 -1.298 1.00 73.05 C ATOM 0 H THR A 157 13.045 -3.873 1.290 1.00 30.24 H new ATOM 0 HA THR A 157 13.804 -5.332 -1.022 1.00 45.11 H new ATOM 0 HB THR A 157 13.943 -2.928 -1.920 1.00 24.43 H new ATOM 0 HG1 THR A 157 13.103 -1.295 -0.625 1.00 3.14 H new ATOM 0 HG21 THR A 157 11.464 -2.675 -1.720 1.00 73.05 H new ATOM 0 HG22 THR A 157 11.921 -4.370 -2.010 1.00 73.05 H new ATOM 0 HG23 THR A 157 11.467 -3.838 -0.373 1.00 73.05 H new ATOM 2554 N PRO A 158 16.200 -4.538 -1.624 1.00 34.34 N ATOM 2555 CA PRO A 158 17.622 -4.340 -1.756 1.00 65.42 C ATOM 2556 C PRO A 158 17.991 -2.879 -1.494 1.00 70.02 C ATOM 2557 O PRO A 158 19.065 -2.662 -0.942 1.00 12.13 O ATOM 2558 CB PRO A 158 18.002 -4.843 -3.151 1.00 54.51 C ATOM 2559 CG PRO A 158 16.702 -4.772 -3.949 1.00 22.22 C ATOM 2560 CD PRO A 158 15.608 -4.927 -2.896 1.00 45.54 C ATOM 0 HA PRO A 158 18.191 -4.900 -1.014 1.00 65.42 H new ATOM 0 HB2 PRO A 158 18.778 -4.222 -3.599 1.00 54.51 H new ATOM 0 HB3 PRO A 158 18.390 -5.861 -3.114 1.00 54.51 H new ATOM 0 HG2 PRO A 158 16.612 -3.825 -4.480 1.00 22.22 H new ATOM 0 HG3 PRO A 158 16.650 -5.563 -4.697 1.00 22.22 H new ATOM 0 HD2 PRO A 158 14.750 -4.298 -3.133 1.00 45.54 H new ATOM 0 HD3 PRO A 158 15.249 -5.955 -2.858 1.00 45.54 H new ATOM 2568 N HIS A 159 17.102 -1.901 -1.750 1.00 25.33 N ATOM 2569 CA HIS A 159 17.311 -0.478 -1.502 1.00 70.31 C ATOM 2570 C HIS A 159 17.488 -0.166 -0.014 1.00 63.23 C ATOM 2571 O HIS A 159 17.838 0.971 0.314 1.00 33.31 O ATOM 2572 CB HIS A 159 16.113 0.334 -2.053 1.00 24.21 C ATOM 2573 CG HIS A 159 16.421 1.135 -3.300 1.00 34.32 C ATOM 2574 ND1 HIS A 159 17.532 1.925 -3.512 1.00 73.25 N ATOM 2575 CD2 HIS A 159 15.613 1.261 -4.399 1.00 72.31 C ATOM 2576 CE1 HIS A 159 17.399 2.492 -4.723 1.00 65.34 C ATOM 2577 NE2 HIS A 159 16.247 2.116 -5.307 1.00 53.15 N ATOM 0 H HIS A 159 16.185 -2.097 -2.151 1.00 25.33 H new ATOM 0 HA HIS A 159 18.230 -0.195 -2.014 1.00 70.31 H new ATOM 0 HB2 HIS A 159 15.294 -0.352 -2.269 1.00 24.21 H new ATOM 0 HB3 HIS A 159 15.763 1.014 -1.276 1.00 24.21 H new ATOM 0 HD2 HIS A 159 14.654 0.784 -4.540 1.00 72.31 H new ATOM 0 HE1 HIS A 159 18.121 3.161 -5.168 1.00 65.34 H new ATOM 0 HE2 HIS A 159 15.905 2.397 -6.226 1.00 53.15 H new ATOM 2585 N PHE A 160 17.215 -1.120 0.881 1.00 54.32 N ATOM 2586 CA PHE A 160 17.360 -0.922 2.309 1.00 21.33 C ATOM 2587 C PHE A 160 18.693 -1.463 2.813 1.00 31.42 C ATOM 2588 O PHE A 160 19.377 -0.774 3.559 1.00 24.21 O ATOM 2589 CB PHE A 160 16.168 -1.527 3.059 1.00 3.43 C ATOM 2590 CG PHE A 160 15.070 -0.521 3.351 1.00 10.31 C ATOM 2591 CD1 PHE A 160 14.462 0.203 2.305 1.00 31.22 C ATOM 2592 CD2 PHE A 160 14.647 -0.307 4.676 1.00 12.50 C ATOM 2593 CE1 PHE A 160 13.466 1.151 2.596 1.00 1.20 C ATOM 2594 CE2 PHE A 160 13.615 0.597 4.955 1.00 10.50 C ATOM 2595 CZ PHE A 160 13.032 1.339 3.918 1.00 3.44 C ATOM 0 H PHE A 160 16.887 -2.051 0.625 1.00 54.32 H new ATOM 0 HA PHE A 160 17.364 0.149 2.509 1.00 21.33 H new ATOM 0 HB2 PHE A 160 15.754 -2.345 2.470 1.00 3.43 H new ATOM 0 HB3 PHE A 160 16.518 -1.955 3.998 1.00 3.43 H new ATOM 0 HD1 PHE A 160 14.761 0.029 1.282 1.00 31.22 H new ATOM 0 HD2 PHE A 160 15.122 -0.844 5.484 1.00 12.50 H new ATOM 0 HE1 PHE A 160 13.033 1.737 1.799 1.00 1.20 H new ATOM 0 HE2 PHE A 160 13.268 0.723 5.970 1.00 10.50 H new ATOM 0 HZ PHE A 160 12.251 2.053 4.135 1.00 3.44 H new ATOM 2605 N LEU A 161 19.064 -2.683 2.411 1.00 30.00 N ATOM 2606 CA LEU A 161 20.258 -3.372 2.905 1.00 24.40 C ATOM 2607 C LEU A 161 21.540 -2.611 2.534 1.00 30.34 C ATOM 2608 O LEU A 161 22.560 -2.756 3.205 1.00 53.13 O ATOM 2609 CB LEU A 161 20.282 -4.803 2.341 1.00 1.22 C ATOM 2610 CG LEU A 161 19.186 -5.712 2.946 1.00 11.24 C ATOM 2611 CD1 LEU A 161 18.478 -6.523 1.861 1.00 62.41 C ATOM 2612 CD2 LEU A 161 19.758 -6.700 3.954 1.00 45.55 C ATOM 0 H LEU A 161 18.537 -3.225 1.726 1.00 30.00 H new ATOM 0 HA LEU A 161 20.218 -3.413 3.993 1.00 24.40 H new ATOM 0 HB2 LEU A 161 20.156 -4.763 1.259 1.00 1.22 H new ATOM 0 HB3 LEU A 161 21.259 -5.246 2.532 1.00 1.22 H new ATOM 0 HG LEU A 161 18.484 -5.043 3.443 1.00 11.24 H new ATOM 0 HD11 LEU A 161 17.714 -7.152 2.317 1.00 62.41 H new ATOM 0 HD12 LEU A 161 18.011 -5.845 1.146 1.00 62.41 H new ATOM 0 HD13 LEU A 161 19.204 -7.151 1.344 1.00 62.41 H new ATOM 0 HD21 LEU A 161 18.954 -7.318 4.354 1.00 45.55 H new ATOM 0 HD22 LEU A 161 20.495 -7.336 3.463 1.00 45.55 H new ATOM 0 HD23 LEU A 161 20.235 -6.154 4.768 1.00 45.55 H new ATOM 2624 N GLU A 162 21.481 -1.766 1.503 1.00 72.25 N ATOM 2625 CA GLU A 162 22.589 -0.905 1.063 1.00 14.22 C ATOM 2626 C GLU A 162 22.988 0.167 2.085 1.00 61.35 C ATOM 2627 O GLU A 162 23.965 0.883 1.848 1.00 64.12 O ATOM 2628 CB GLU A 162 22.240 -0.130 -0.220 1.00 33.42 C ATOM 2629 CG GLU A 162 21.429 -0.883 -1.256 1.00 1.41 C ATOM 2630 CD GLU A 162 21.648 -0.349 -2.664 1.00 30.42 C ATOM 2631 OE1 GLU A 162 20.951 0.607 -3.068 1.00 44.11 O ATOM 2632 OE2 GLU A 162 22.527 -0.894 -3.376 1.00 45.21 O ATOM 0 H GLU A 162 20.642 -1.656 0.934 1.00 72.25 H new ATOM 0 HA GLU A 162 23.409 -1.607 0.913 1.00 14.22 H new ATOM 0 HB2 GLU A 162 21.689 0.767 0.061 1.00 33.42 H new ATOM 0 HB3 GLU A 162 23.169 0.199 -0.685 1.00 33.42 H new ATOM 0 HG2 GLU A 162 21.696 -1.939 -1.225 1.00 1.41 H new ATOM 0 HG3 GLU A 162 20.371 -0.815 -1.005 1.00 1.41 H new ATOM 2639 N ASN A 163 22.187 0.387 3.130 1.00 10.11 N ATOM 2640 CA ASN A 163 22.371 1.501 4.047 1.00 74.25 C ATOM 2641 C ASN A 163 21.841 1.137 5.418 1.00 31.23 C ATOM 2642 O ASN A 163 20.634 1.029 5.610 1.00 33.02 O ATOM 2643 CB ASN A 163 21.670 2.743 3.500 1.00 73.34 C ATOM 2644 CG ASN A 163 21.788 3.951 4.414 1.00 34.14 C ATOM 2645 OD1 ASN A 163 20.850 4.738 4.506 1.00 21.01 O ATOM 2646 ND2 ASN A 163 22.939 4.172 5.028 1.00 52.43 N ATOM 0 H ASN A 163 21.391 -0.208 3.360 1.00 10.11 H new ATOM 0 HA ASN A 163 23.434 1.721 4.142 1.00 74.25 H new ATOM 0 HB2 ASN A 163 22.092 2.990 2.526 1.00 73.34 H new ATOM 0 HB3 ASN A 163 20.615 2.517 3.342 1.00 73.34 H new ATOM 0 HD21 ASN A 163 23.062 5.012 5.594 1.00 52.43 H new ATOM 0 HD22 ASN A 163 23.703 3.503 4.936 1.00 52.43 H new ATOM 2653 N GLU A 164 22.750 0.965 6.373 1.00 53.43 N ATOM 2654 CA GLU A 164 22.428 0.481 7.710 1.00 44.42 C ATOM 2655 C GLU A 164 21.355 1.322 8.396 1.00 4.40 C ATOM 2656 O GLU A 164 20.499 0.774 9.084 1.00 4.53 O ATOM 2657 CB GLU A 164 23.694 0.482 8.564 1.00 53.21 C ATOM 2658 CG GLU A 164 24.714 -0.547 8.078 1.00 73.44 C ATOM 2659 CD GLU A 164 25.842 -0.679 9.094 1.00 52.34 C ATOM 2660 OE1 GLU A 164 25.629 -1.368 10.125 1.00 3.20 O ATOM 2661 OE2 GLU A 164 26.892 -0.045 8.881 1.00 41.41 O ATOM 0 H GLU A 164 23.742 1.160 6.238 1.00 53.43 H new ATOM 0 HA GLU A 164 22.032 -0.529 7.605 1.00 44.42 H new ATOM 0 HB2 GLU A 164 24.143 1.475 8.545 1.00 53.21 H new ATOM 0 HB3 GLU A 164 23.432 0.271 9.601 1.00 53.21 H new ATOM 0 HG2 GLU A 164 24.229 -1.512 7.933 1.00 73.44 H new ATOM 0 HG3 GLU A 164 25.117 -0.244 7.112 1.00 73.44 H new ATOM 2668 N ASP A 165 21.361 2.637 8.170 1.00 52.21 N ATOM 2669 CA ASP A 165 20.390 3.540 8.775 1.00 12.52 C ATOM 2670 C ASP A 165 18.983 3.198 8.299 1.00 42.43 C ATOM 2671 O ASP A 165 18.017 3.246 9.063 1.00 54.25 O ATOM 2672 CB ASP A 165 20.730 4.993 8.421 1.00 52.35 C ATOM 2673 CG ASP A 165 20.793 5.852 9.676 1.00 33.14 C ATOM 2674 OD1 ASP A 165 19.726 6.198 10.236 1.00 53.54 O ATOM 2675 OD2 ASP A 165 21.920 6.129 10.128 1.00 45.22 O ATOM 0 H ASP A 165 22.038 3.101 7.564 1.00 52.21 H new ATOM 0 HA ASP A 165 20.430 3.423 9.858 1.00 12.52 H new ATOM 0 HB2 ASP A 165 21.687 5.031 7.900 1.00 52.35 H new ATOM 0 HB3 ASP A 165 19.979 5.392 7.739 1.00 52.35 H new ATOM 2680 N ARG A 166 18.845 2.816 7.025 1.00 4.22 N ATOM 2681 CA ARG A 166 17.558 2.367 6.515 1.00 14.50 C ATOM 2682 C ARG A 166 17.168 1.033 7.132 1.00 30.41 C ATOM 2683 O ARG A 166 15.984 0.823 7.377 1.00 33.21 O ATOM 2684 CB ARG A 166 17.558 2.282 4.983 1.00 22.10 C ATOM 2685 CG ARG A 166 17.472 3.674 4.341 1.00 73.13 C ATOM 2686 CD ARG A 166 17.694 3.617 2.822 1.00 23.01 C ATOM 2687 NE ARG A 166 18.908 4.344 2.418 1.00 44.55 N ATOM 2688 CZ ARG A 166 19.506 4.305 1.221 1.00 3.43 C ATOM 2689 NH1 ARG A 166 19.110 3.436 0.300 1.00 21.31 N ATOM 2690 NH2 ARG A 166 20.513 5.130 0.951 1.00 50.21 N ATOM 0 H ARG A 166 19.601 2.810 6.341 1.00 4.22 H new ATOM 0 HA ARG A 166 16.812 3.108 6.803 1.00 14.50 H new ATOM 0 HB2 ARG A 166 18.465 1.780 4.646 1.00 22.10 H new ATOM 0 HB3 ARG A 166 16.716 1.675 4.651 1.00 22.10 H new ATOM 0 HG2 ARG A 166 16.495 4.111 4.549 1.00 73.13 H new ATOM 0 HG3 ARG A 166 18.217 4.329 4.793 1.00 73.13 H new ATOM 0 HD2 ARG A 166 17.771 2.577 2.505 1.00 23.01 H new ATOM 0 HD3 ARG A 166 16.829 4.042 2.312 1.00 23.01 H new ATOM 0 HE ARG A 166 19.339 4.940 3.124 1.00 44.55 H new ATOM 0 HH11 ARG A 166 18.345 2.792 0.502 1.00 21.31 H new ATOM 0 HH12 ARG A 166 19.570 3.412 -0.610 1.00 21.31 H new ATOM 0 HH21 ARG A 166 20.831 5.794 1.657 1.00 50.21 H new ATOM 0 HH22 ARG A 166 20.967 5.099 0.038 1.00 50.21 H new ATOM 2704 N MET A 167 18.111 0.139 7.422 1.00 5.42 N ATOM 2705 CA MET A 167 17.762 -1.089 8.121 1.00 1.51 C ATOM 2706 C MET A 167 17.256 -0.797 9.537 1.00 43.54 C ATOM 2707 O MET A 167 16.286 -1.419 9.967 1.00 33.12 O ATOM 2708 CB MET A 167 18.934 -2.069 8.150 1.00 72.03 C ATOM 2709 CG MET A 167 19.155 -2.736 6.787 1.00 2.11 C ATOM 2710 SD MET A 167 19.439 -4.520 6.922 1.00 31.21 S ATOM 2711 CE MET A 167 17.785 -5.099 7.397 1.00 31.31 C ATOM 0 H MET A 167 19.099 0.240 7.189 1.00 5.42 H new ATOM 0 HA MET A 167 16.951 -1.560 7.566 1.00 1.51 H new ATOM 0 HB2 MET A 167 19.841 -1.542 8.448 1.00 72.03 H new ATOM 0 HB3 MET A 167 18.748 -2.835 8.903 1.00 72.03 H new ATOM 0 HG2 MET A 167 18.286 -2.557 6.154 1.00 2.11 H new ATOM 0 HG3 MET A 167 20.009 -2.272 6.294 1.00 2.11 H new ATOM 0 HE1 MET A 167 17.752 -6.187 7.345 1.00 31.31 H new ATOM 0 HE2 MET A 167 17.565 -4.777 8.415 1.00 31.31 H new ATOM 0 HE3 MET A 167 17.044 -4.681 6.716 1.00 31.31 H new ATOM 2721 N GLU A 168 17.842 0.169 10.247 1.00 33.22 N ATOM 2722 CA GLU A 168 17.410 0.525 11.598 1.00 34.20 C ATOM 2723 C GLU A 168 15.956 1.019 11.595 1.00 23.31 C ATOM 2724 O GLU A 168 15.201 0.698 12.518 1.00 4.23 O ATOM 2725 CB GLU A 168 18.363 1.575 12.205 1.00 25.13 C ATOM 2726 CG GLU A 168 19.751 0.989 12.546 1.00 73.13 C ATOM 2727 CD GLU A 168 20.808 2.039 12.941 1.00 73.45 C ATOM 2728 OE1 GLU A 168 20.650 3.238 12.614 1.00 71.42 O ATOM 2729 OE2 GLU A 168 21.853 1.647 13.515 1.00 71.24 O ATOM 0 H GLU A 168 18.626 0.724 9.903 1.00 33.22 H new ATOM 0 HA GLU A 168 17.449 -0.367 12.223 1.00 34.20 H new ATOM 0 HB2 GLU A 168 18.483 2.400 11.503 1.00 25.13 H new ATOM 0 HB3 GLU A 168 17.915 1.988 13.109 1.00 25.13 H new ATOM 0 HG2 GLU A 168 19.640 0.278 13.364 1.00 73.13 H new ATOM 0 HG3 GLU A 168 20.117 0.430 11.685 1.00 73.13 H new ATOM 2736 N LEU A 169 15.510 1.744 10.558 1.00 51.22 N ATOM 2737 CA LEU A 169 14.105 2.146 10.450 1.00 61.34 C ATOM 2738 C LEU A 169 13.185 0.932 10.272 1.00 14.33 C ATOM 2739 O LEU A 169 12.046 0.957 10.753 1.00 61.21 O ATOM 2740 CB LEU A 169 13.911 3.226 9.360 1.00 3.13 C ATOM 2741 CG LEU A 169 13.401 2.787 7.966 1.00 74.02 C ATOM 2742 CD1 LEU A 169 11.882 2.598 7.858 1.00 12.41 C ATOM 2743 CD2 LEU A 169 13.761 3.837 6.912 1.00 44.35 C ATOM 0 H LEU A 169 16.100 2.061 9.788 1.00 51.22 H new ATOM 0 HA LEU A 169 13.811 2.609 11.392 1.00 61.34 H new ATOM 0 HB2 LEU A 169 13.214 3.968 9.749 1.00 3.13 H new ATOM 0 HB3 LEU A 169 14.867 3.730 9.219 1.00 3.13 H new ATOM 0 HG LEU A 169 13.885 1.824 7.805 1.00 74.02 H new ATOM 0 HD11 LEU A 169 11.625 2.291 6.844 1.00 12.41 H new ATOM 0 HD12 LEU A 169 11.560 1.831 8.562 1.00 12.41 H new ATOM 0 HD13 LEU A 169 11.381 3.538 8.090 1.00 12.41 H new ATOM 0 HD21 LEU A 169 13.396 3.514 5.937 1.00 44.35 H new ATOM 0 HD22 LEU A 169 13.300 4.789 7.175 1.00 44.35 H new ATOM 0 HD23 LEU A 169 14.844 3.956 6.872 1.00 44.35 H new ATOM 2755 N TYR A 170 13.641 -0.114 9.571 1.00 5.30 N ATOM 2756 CA TYR A 170 12.845 -1.302 9.308 1.00 51.45 C ATOM 2757 C TYR A 170 12.660 -2.084 10.602 1.00 31.00 C ATOM 2758 O TYR A 170 11.527 -2.370 10.981 1.00 72.05 O ATOM 2759 CB TYR A 170 13.514 -2.167 8.224 1.00 54.11 C ATOM 2760 CG TYR A 170 12.924 -3.553 8.001 1.00 43.23 C ATOM 2761 CD1 TYR A 170 11.538 -3.733 7.829 1.00 43.54 C ATOM 2762 CD2 TYR A 170 13.777 -4.673 7.936 1.00 3.24 C ATOM 2763 CE1 TYR A 170 11.015 -5.018 7.595 1.00 34.12 C ATOM 2764 CE2 TYR A 170 13.263 -5.948 7.645 1.00 2.20 C ATOM 2765 CZ TYR A 170 11.876 -6.130 7.464 1.00 64.33 C ATOM 2766 OH TYR A 170 11.367 -7.364 7.183 1.00 51.32 O ATOM 0 H TYR A 170 14.579 -0.152 9.172 1.00 5.30 H new ATOM 0 HA TYR A 170 11.864 -1.008 8.936 1.00 51.45 H new ATOM 0 HB2 TYR A 170 13.473 -1.623 7.280 1.00 54.11 H new ATOM 0 HB3 TYR A 170 14.567 -2.282 8.481 1.00 54.11 H new ATOM 0 HD1 TYR A 170 10.875 -2.882 7.877 1.00 43.54 H new ATOM 0 HD2 TYR A 170 14.836 -4.550 8.111 1.00 3.24 H new ATOM 0 HE1 TYR A 170 9.947 -5.155 7.515 1.00 34.12 H new ATOM 0 HE2 TYR A 170 13.932 -6.791 7.560 1.00 2.20 H new ATOM 0 HH TYR A 170 12.083 -8.032 7.230 1.00 51.32 H new ATOM 2776 N GLN A 171 13.761 -2.415 11.276 1.00 14.54 N ATOM 2777 CA GLN A 171 13.803 -3.282 12.449 1.00 54.51 C ATOM 2778 C GLN A 171 12.961 -2.708 13.580 1.00 10.31 C ATOM 2779 O GLN A 171 12.152 -3.414 14.187 1.00 43.54 O ATOM 2780 CB GLN A 171 15.252 -3.397 12.905 1.00 23.02 C ATOM 2781 CG GLN A 171 16.148 -4.073 11.865 1.00 44.14 C ATOM 2782 CD GLN A 171 16.234 -5.598 11.971 1.00 51.52 C ATOM 2783 OE1 GLN A 171 15.404 -6.267 12.592 1.00 73.11 O ATOM 2784 NE2 GLN A 171 17.203 -6.186 11.290 1.00 71.22 N ATOM 0 H GLN A 171 14.683 -2.072 11.008 1.00 14.54 H new ATOM 0 HA GLN A 171 13.400 -4.261 12.189 1.00 54.51 H new ATOM 0 HB2 GLN A 171 15.640 -2.402 13.121 1.00 23.02 H new ATOM 0 HB3 GLN A 171 15.292 -3.963 13.835 1.00 23.02 H new ATOM 0 HG2 GLN A 171 15.783 -3.814 10.871 1.00 44.14 H new ATOM 0 HG3 GLN A 171 17.154 -3.661 11.953 1.00 44.14 H new ATOM 0 HE21 GLN A 171 17.883 -5.622 10.781 1.00 71.22 H new ATOM 0 HE22 GLN A 171 17.270 -7.204 11.274 1.00 71.22 H new ATOM 2793 N THR A 172 13.138 -1.420 13.852 1.00 30.34 N ATOM 2794 CA THR A 172 12.358 -0.704 14.859 1.00 1.11 C ATOM 2795 C THR A 172 10.868 -0.788 14.530 1.00 74.15 C ATOM 2796 O THR A 172 10.047 -1.050 15.416 1.00 21.00 O ATOM 2797 CB THR A 172 12.850 0.745 14.933 1.00 62.05 C ATOM 2798 OG1 THR A 172 14.194 0.716 15.359 1.00 54.32 O ATOM 2799 CG2 THR A 172 12.053 1.619 15.904 1.00 14.14 C ATOM 0 H THR A 172 13.830 -0.839 13.379 1.00 30.34 H new ATOM 0 HA THR A 172 12.495 -1.162 15.838 1.00 1.11 H new ATOM 0 HB THR A 172 12.726 1.185 13.944 1.00 62.05 H new ATOM 0 HG1 THR A 172 14.784 0.687 14.577 1.00 54.32 H new ATOM 0 HG21 THR A 172 12.460 2.630 15.902 1.00 14.14 H new ATOM 0 HG22 THR A 172 11.008 1.648 15.594 1.00 14.14 H new ATOM 0 HG23 THR A 172 12.122 1.203 16.909 1.00 14.14 H new ATOM 2807 N ARG A 173 10.506 -0.606 13.257 1.00 53.44 N ATOM 2808 CA ARG A 173 9.118 -0.648 12.824 1.00 24.40 C ATOM 2809 C ARG A 173 8.660 -2.080 12.511 1.00 13.33 C ATOM 2810 O ARG A 173 7.559 -2.246 11.988 1.00 72.05 O ATOM 2811 CB ARG A 173 8.929 0.359 11.680 1.00 10.10 C ATOM 2812 CG ARG A 173 7.452 0.630 11.334 1.00 13.30 C ATOM 2813 CD ARG A 173 7.248 1.949 10.583 1.00 64.23 C ATOM 2814 NE ARG A 173 7.207 3.103 11.488 1.00 32.10 N ATOM 2815 CZ ARG A 173 6.115 3.781 11.856 1.00 42.43 C ATOM 2816 NH1 ARG A 173 4.916 3.504 11.351 1.00 4.10 N ATOM 2817 NH2 ARG A 173 6.220 4.751 12.751 1.00 51.44 N ATOM 0 H ARG A 173 11.170 -0.426 12.504 1.00 53.44 H new ATOM 0 HA ARG A 173 8.456 -0.340 13.633 1.00 24.40 H new ATOM 0 HB2 ARG A 173 9.408 1.299 11.952 1.00 10.10 H new ATOM 0 HB3 ARG A 173 9.439 -0.013 10.792 1.00 10.10 H new ATOM 0 HG2 ARG A 173 7.070 -0.191 10.727 1.00 13.30 H new ATOM 0 HG3 ARG A 173 6.866 0.647 12.253 1.00 13.30 H new ATOM 0 HD2 ARG A 173 8.055 2.083 9.863 1.00 64.23 H new ATOM 0 HD3 ARG A 173 6.319 1.902 10.015 1.00 64.23 H new ATOM 0 HE ARG A 173 8.097 3.418 11.873 1.00 32.10 H new ATOM 0 HH11 ARG A 173 4.812 2.757 10.664 1.00 4.10 H new ATOM 0 HH12 ARG A 173 4.101 4.038 11.651 1.00 4.10 H new ATOM 0 HH21 ARG A 173 7.129 4.976 13.155 1.00 51.44 H new ATOM 0 HH22 ARG A 173 5.392 5.273 13.037 1.00 51.44 H new ATOM 2831 N LEU A 174 9.425 -3.124 12.841 1.00 3.31 N ATOM 2832 CA LEU A 174 8.961 -4.501 12.710 1.00 42.45 C ATOM 2833 C LEU A 174 8.169 -4.894 13.948 1.00 1.13 C ATOM 2834 O LEU A 174 6.991 -5.200 13.821 1.00 52.14 O ATOM 2835 CB LEU A 174 10.117 -5.486 12.448 1.00 3.41 C ATOM 2836 CG LEU A 174 10.212 -5.982 10.995 1.00 11.51 C ATOM 2837 CD1 LEU A 174 11.420 -6.923 10.891 1.00 34.42 C ATOM 2838 CD2 LEU A 174 8.936 -6.693 10.512 1.00 42.53 C ATOM 0 H LEU A 174 10.375 -3.037 13.203 1.00 3.31 H new ATOM 0 HA LEU A 174 8.310 -4.556 11.838 1.00 42.45 H new ATOM 0 HB2 LEU A 174 11.057 -5.004 12.717 1.00 3.41 H new ATOM 0 HB3 LEU A 174 10.001 -6.347 13.106 1.00 3.41 H new ATOM 0 HG LEU A 174 10.332 -5.114 10.346 1.00 11.51 H new ATOM 0 HD11 LEU A 174 11.509 -7.289 9.868 1.00 34.42 H new ATOM 0 HD12 LEU A 174 12.327 -6.383 11.163 1.00 34.42 H new ATOM 0 HD13 LEU A 174 11.283 -7.767 11.568 1.00 34.42 H new ATOM 0 HD21 LEU A 174 9.069 -7.018 9.480 1.00 42.53 H new ATOM 0 HD22 LEU A 174 8.742 -7.560 11.143 1.00 42.53 H new ATOM 0 HD23 LEU A 174 8.092 -6.005 10.570 1.00 42.53 H new ATOM 2905 N ASN A 178 1.572 -6.000 14.342 1.00 71.31 N ATOM 2906 CA ASN A 178 0.753 -7.196 14.501 1.00 41.41 C ATOM 2907 C ASN A 178 0.584 -7.971 13.175 1.00 33.50 C ATOM 2908 O ASN A 178 -0.540 -8.296 12.781 1.00 43.02 O ATOM 2909 CB ASN A 178 -0.584 -6.782 15.167 1.00 1.10 C ATOM 2910 CG ASN A 178 -1.337 -5.689 14.413 1.00 52.21 C ATOM 2911 OD1 ASN A 178 -1.188 -4.500 14.695 1.00 61.31 O ATOM 2912 ND2 ASN A 178 -2.112 -6.052 13.410 1.00 73.42 N ATOM 0 HA ASN A 178 1.253 -7.910 15.156 1.00 41.41 H new ATOM 0 HB2 ASN A 178 -1.225 -7.660 15.250 1.00 1.10 H new ATOM 0 HB3 ASN A 178 -0.382 -6.437 16.181 1.00 1.10 H new ATOM 0 HD21 ASN A 178 -2.596 -5.344 12.858 1.00 73.42 H new ATOM 0 HD22 ASN A 178 -2.227 -7.040 13.186 1.00 73.42 H new ATOM 2919 N TRP A 179 1.686 -8.309 12.485 1.00 34.24 N ATOM 2920 CA TRP A 179 1.693 -9.116 11.264 1.00 31.00 C ATOM 2921 C TRP A 179 1.222 -10.546 11.541 1.00 41.35 C ATOM 2922 O TRP A 179 0.066 -10.879 11.290 1.00 54.32 O ATOM 2923 CB TRP A 179 3.089 -9.098 10.622 1.00 32.23 C ATOM 2924 CG TRP A 179 3.581 -7.796 10.073 1.00 34.20 C ATOM 2925 CD1 TRP A 179 4.816 -7.290 10.276 1.00 25.14 C ATOM 2926 CD2 TRP A 179 2.875 -6.801 9.272 1.00 10.21 C ATOM 2927 NE1 TRP A 179 4.931 -6.067 9.648 1.00 62.44 N ATOM 2928 CE2 TRP A 179 3.733 -5.680 9.095 1.00 45.22 C ATOM 2929 CE3 TRP A 179 1.579 -6.699 8.727 1.00 1.54 C ATOM 2930 CZ2 TRP A 179 3.292 -4.487 8.514 1.00 64.01 C ATOM 2931 CZ3 TRP A 179 1.118 -5.504 8.144 1.00 62.31 C ATOM 2932 CH2 TRP A 179 1.968 -4.389 8.064 1.00 23.14 C ATOM 0 H TRP A 179 2.620 -8.018 12.773 1.00 34.24 H new ATOM 0 HA TRP A 179 0.988 -8.677 10.558 1.00 31.00 H new ATOM 0 HB2 TRP A 179 3.806 -9.441 11.368 1.00 32.23 H new ATOM 0 HB3 TRP A 179 3.096 -9.828 9.813 1.00 32.23 H new ATOM 0 HD1 TRP A 179 5.598 -7.771 10.845 1.00 25.14 H new ATOM 0 HE1 TRP A 179 5.792 -5.522 9.600 1.00 62.44 H new ATOM 0 HE3 TRP A 179 0.925 -7.558 8.758 1.00 1.54 H new ATOM 0 HZ2 TRP A 179 3.965 -3.649 8.413 1.00 64.01 H new ATOM 0 HZ3 TRP A 179 0.111 -5.444 7.758 1.00 62.31 H new ATOM 0 HH2 TRP A 179 1.602 -3.458 7.657 1.00 23.14 H new ATOM 2943 N GLN A 180 2.102 -11.397 12.075 1.00 63.23 N ATOM 2944 CA GLN A 180 1.810 -12.802 12.377 1.00 74.35 C ATOM 2945 C GLN A 180 0.605 -12.960 13.329 1.00 33.53 C ATOM 2946 O GLN A 180 -0.033 -14.007 13.402 1.00 23.21 O ATOM 2947 CB GLN A 180 3.062 -13.480 12.968 1.00 21.01 C ATOM 2948 CG GLN A 180 3.776 -12.627 14.040 1.00 70.41 C ATOM 2949 CD GLN A 180 4.485 -13.449 15.099 1.00 32.42 C ATOM 2950 OE1 GLN A 180 5.031 -14.518 14.840 1.00 53.24 O ATOM 2951 NE2 GLN A 180 4.542 -12.916 16.304 1.00 71.22 N ATOM 0 H GLN A 180 3.055 -11.124 12.314 1.00 63.23 H new ATOM 0 HA GLN A 180 1.538 -13.292 11.442 1.00 74.35 H new ATOM 0 HB2 GLN A 180 2.775 -14.435 13.407 1.00 21.01 H new ATOM 0 HB3 GLN A 180 3.763 -13.697 12.162 1.00 21.01 H new ATOM 0 HG2 GLN A 180 4.502 -11.977 13.551 1.00 70.41 H new ATOM 0 HG3 GLN A 180 3.044 -11.980 14.524 1.00 70.41 H new ATOM 0 HE21 GLN A 180 4.079 -12.027 16.491 1.00 71.22 H new ATOM 0 HE22 GLN A 180 5.049 -13.393 17.049 1.00 71.22 H new ATOM 2960 N GLU A 181 0.279 -11.898 14.062 1.00 12.13 N ATOM 2961 CA GLU A 181 -0.823 -11.816 15.005 1.00 51.44 C ATOM 2962 C GLU A 181 -2.175 -11.801 14.283 1.00 14.11 C ATOM 2963 O GLU A 181 -3.155 -12.361 14.775 1.00 65.43 O ATOM 2964 CB GLU A 181 -0.627 -10.521 15.798 1.00 34.43 C ATOM 2965 CG GLU A 181 0.546 -10.627 16.776 1.00 3.42 C ATOM 2966 CD GLU A 181 0.897 -9.269 17.382 1.00 25.50 C ATOM 2967 OE1 GLU A 181 0.017 -8.629 18.004 1.00 52.02 O ATOM 2968 OE2 GLU A 181 2.039 -8.799 17.182 1.00 33.24 O ATOM 0 H GLU A 181 0.808 -11.027 14.008 1.00 12.13 H new ATOM 0 HA GLU A 181 -0.828 -12.686 15.661 1.00 51.44 H new ATOM 0 HB2 GLU A 181 -0.452 -9.695 15.108 1.00 34.43 H new ATOM 0 HB3 GLU A 181 -1.539 -10.290 16.348 1.00 34.43 H new ATOM 0 HG2 GLU A 181 0.294 -11.327 17.572 1.00 3.42 H new ATOM 0 HG3 GLU A 181 1.416 -11.031 16.259 1.00 3.42 H new ATOM 2975 N LYS A 182 -2.256 -11.153 13.116 1.00 70.53 N ATOM 2976 CA LYS A 182 -3.440 -11.205 12.263 1.00 52.33 C ATOM 2977 C LYS A 182 -3.418 -12.434 11.369 1.00 41.12 C ATOM 2978 O LYS A 182 -4.490 -12.959 11.081 1.00 65.43 O ATOM 2979 CB LYS A 182 -3.527 -9.942 11.401 1.00 63.43 C ATOM 2980 CG LYS A 182 -4.237 -8.814 12.151 1.00 42.34 C ATOM 2981 CD LYS A 182 -4.485 -7.617 11.226 1.00 62.42 C ATOM 2982 CE LYS A 182 -5.660 -7.836 10.253 1.00 11.10 C ATOM 2983 NZ LYS A 182 -6.294 -6.567 9.819 1.00 43.35 N ATOM 0 H LYS A 182 -1.501 -10.579 12.740 1.00 70.53 H new ATOM 0 HA LYS A 182 -4.316 -11.264 12.909 1.00 52.33 H new ATOM 0 HB2 LYS A 182 -2.525 -9.621 11.118 1.00 63.43 H new ATOM 0 HB3 LYS A 182 -4.063 -10.164 10.478 1.00 63.43 H new ATOM 0 HG2 LYS A 182 -5.186 -9.176 12.547 1.00 42.34 H new ATOM 0 HG3 LYS A 182 -3.634 -8.502 13.003 1.00 42.34 H new ATOM 0 HD2 LYS A 182 -4.683 -6.733 11.832 1.00 62.42 H new ATOM 0 HD3 LYS A 182 -3.580 -7.415 10.653 1.00 62.42 H new ATOM 0 HE2 LYS A 182 -5.303 -8.377 9.376 1.00 11.10 H new ATOM 0 HE3 LYS A 182 -6.410 -8.466 10.732 1.00 11.10 H new ATOM 0 HZ1 LYS A 182 -7.077 -6.775 9.167 1.00 43.35 H new ATOM 0 HZ2 LYS A 182 -6.661 -6.060 10.650 1.00 43.35 H new ATOM 0 HZ3 LYS A 182 -5.589 -5.974 9.336 1.00 43.35 H new ATOM 2997 N TRP A 183 -2.252 -12.837 10.869 1.00 72.11 N ATOM 2998 CA TRP A 183 -2.142 -13.912 9.883 1.00 4.32 C ATOM 2999 C TRP A 183 -1.203 -15.021 10.364 1.00 32.14 C ATOM 3000 O TRP A 183 0.005 -14.846 10.460 1.00 4.10 O ATOM 3001 CB TRP A 183 -1.700 -13.337 8.541 1.00 72.43 C ATOM 3002 CG TRP A 183 -2.574 -12.286 7.917 1.00 24.34 C ATOM 3003 CD1 TRP A 183 -3.634 -12.532 7.118 1.00 74.23 C ATOM 3004 CD2 TRP A 183 -2.483 -10.829 8.004 1.00 63.24 C ATOM 3005 NE1 TRP A 183 -4.244 -11.347 6.787 1.00 2.34 N ATOM 3006 CE2 TRP A 183 -3.577 -10.261 7.293 1.00 42.44 C ATOM 3007 CE3 TRP A 183 -1.601 -9.920 8.617 1.00 23.40 C ATOM 3008 CZ2 TRP A 183 -3.806 -8.878 7.219 1.00 21.12 C ATOM 3009 CZ3 TRP A 183 -1.818 -8.532 8.561 1.00 72.12 C ATOM 3010 CH2 TRP A 183 -2.914 -8.004 7.860 1.00 71.54 C ATOM 0 H TRP A 183 -1.356 -12.428 11.135 1.00 72.11 H new ATOM 0 HA TRP A 183 -3.122 -14.371 9.755 1.00 4.32 H new ATOM 0 HB2 TRP A 183 -0.703 -12.914 8.668 1.00 72.43 H new ATOM 0 HB3 TRP A 183 -1.609 -14.162 7.835 1.00 72.43 H new ATOM 0 HD1 TRP A 183 -3.953 -13.510 6.790 1.00 74.23 H new ATOM 0 HE1 TRP A 183 -5.095 -11.282 6.229 1.00 2.34 H new ATOM 0 HE3 TRP A 183 -0.737 -10.298 9.143 1.00 23.40 H new ATOM 0 HZ2 TRP A 183 -4.656 -8.492 6.677 1.00 21.12 H new ATOM 0 HZ3 TRP A 183 -1.134 -7.864 9.063 1.00 72.12 H new ATOM 0 HH2 TRP A 183 -3.069 -6.936 7.814 1.00 71.54 H new ATOM 3021 N LYS A 184 -1.768 -16.201 10.614 1.00 23.40 N ATOM 3022 CA LYS A 184 -1.130 -17.417 11.131 1.00 4.00 C ATOM 3023 C LYS A 184 -0.180 -18.104 10.136 1.00 54.03 C ATOM 3024 O LYS A 184 0.212 -19.249 10.361 1.00 12.51 O ATOM 3025 CB LYS A 184 -2.263 -18.370 11.557 1.00 13.13 C ATOM 3026 CG LYS A 184 -2.838 -18.011 12.941 1.00 2.40 C ATOM 3027 CD LYS A 184 -2.172 -18.784 14.089 1.00 12.41 C ATOM 3028 CE LYS A 184 -2.646 -20.240 14.113 1.00 51.42 C ATOM 3029 NZ LYS A 184 -2.146 -20.983 15.286 1.00 12.33 N ATOM 0 H LYS A 184 -2.764 -16.346 10.448 1.00 23.40 H new ATOM 0 HA LYS A 184 -0.489 -17.143 11.969 1.00 4.00 H new ATOM 0 HB2 LYS A 184 -3.061 -18.338 10.815 1.00 13.13 H new ATOM 0 HB3 LYS A 184 -1.887 -19.393 11.576 1.00 13.13 H new ATOM 0 HG2 LYS A 184 -2.716 -16.941 13.112 1.00 2.40 H new ATOM 0 HG3 LYS A 184 -3.909 -18.215 12.947 1.00 2.40 H new ATOM 0 HD2 LYS A 184 -1.089 -18.752 13.974 1.00 12.41 H new ATOM 0 HD3 LYS A 184 -2.406 -18.305 15.040 1.00 12.41 H new ATOM 0 HE2 LYS A 184 -3.736 -20.263 14.111 1.00 51.42 H new ATOM 0 HE3 LYS A 184 -2.315 -20.741 13.203 1.00 51.42 H new ATOM 0 HZ1 LYS A 184 -2.496 -21.962 15.252 1.00 12.33 H new ATOM 0 HZ2 LYS A 184 -1.106 -20.987 15.277 1.00 12.33 H new ATOM 0 HZ3 LYS A 184 -2.483 -20.525 16.157 1.00 12.33 H new ATOM 3043 N ASN A 185 0.097 -17.496 8.987 1.00 74.04 N ATOM 3044 CA ASN A 185 1.019 -18.004 7.966 1.00 21.41 C ATOM 3045 C ASN A 185 1.837 -16.837 7.406 1.00 33.40 C ATOM 3046 O ASN A 185 1.947 -16.704 6.188 1.00 24.41 O ATOM 3047 CB ASN A 185 0.247 -18.785 6.884 1.00 12.23 C ATOM 3048 CG ASN A 185 1.122 -19.659 5.985 1.00 44.42 C ATOM 3049 OD1 ASN A 185 1.301 -20.841 6.263 1.00 12.43 O ATOM 3050 ND2 ASN A 185 1.615 -19.161 4.865 1.00 1.32 N ATOM 0 H ASN A 185 -0.327 -16.605 8.728 1.00 74.04 H new ATOM 0 HA ASN A 185 1.721 -18.714 8.404 1.00 21.41 H new ATOM 0 HB2 ASN A 185 -0.496 -19.417 7.371 1.00 12.23 H new ATOM 0 HB3 ASN A 185 -0.297 -18.075 6.261 1.00 12.23 H new ATOM 0 HD21 ASN A 185 2.145 -19.759 4.231 1.00 1.32 H new ATOM 0 HD22 ASN A 185 1.466 -18.179 4.635 1.00 1.32 H new ATOM 3057 N LEU A 186 2.265 -15.892 8.252 1.00 51.45 N ATOM 3058 CA LEU A 186 3.025 -14.705 7.833 1.00 64.01 C ATOM 3059 C LEU A 186 4.531 -14.911 8.074 1.00 34.00 C ATOM 3060 O LEU A 186 4.974 -14.926 9.224 1.00 64.22 O ATOM 3061 CB LEU A 186 2.495 -13.448 8.555 1.00 11.20 C ATOM 3062 CG LEU A 186 2.418 -12.171 7.699 1.00 34.12 C ATOM 3063 CD1 LEU A 186 3.554 -11.985 6.707 1.00 4.51 C ATOM 3064 CD2 LEU A 186 1.109 -12.044 6.916 1.00 32.14 C ATOM 0 H LEU A 186 2.092 -15.929 9.257 1.00 51.45 H new ATOM 0 HA LEU A 186 2.886 -14.556 6.762 1.00 64.01 H new ATOM 0 HB2 LEU A 186 1.499 -13.666 8.941 1.00 11.20 H new ATOM 0 HB3 LEU A 186 3.134 -13.249 9.415 1.00 11.20 H new ATOM 0 HG LEU A 186 2.490 -11.392 8.458 1.00 34.12 H new ATOM 0 HD11 LEU A 186 3.406 -11.057 6.154 1.00 4.51 H new ATOM 0 HD12 LEU A 186 4.502 -11.941 7.243 1.00 4.51 H new ATOM 0 HD13 LEU A 186 3.570 -12.823 6.011 1.00 4.51 H new ATOM 0 HD21 LEU A 186 1.121 -11.122 6.334 1.00 32.14 H new ATOM 0 HD22 LEU A 186 1.003 -12.896 6.244 1.00 32.14 H new ATOM 0 HD23 LEU A 186 0.270 -12.023 7.611 1.00 32.14 H new ATOM 3076 N ILE A 187 5.332 -15.073 7.018 1.00 14.52 N ATOM 3077 CA ILE A 187 6.776 -15.317 7.096 1.00 44.22 C ATOM 3078 C ILE A 187 7.513 -13.996 7.321 1.00 34.11 C ATOM 3079 O ILE A 187 7.238 -13.001 6.654 1.00 51.35 O ATOM 3080 CB ILE A 187 7.341 -16.001 5.818 1.00 23.34 C ATOM 3081 CG1 ILE A 187 6.404 -17.062 5.215 1.00 12.31 C ATOM 3082 CG2 ILE A 187 8.694 -16.652 6.150 1.00 44.52 C ATOM 3083 CD1 ILE A 187 6.931 -17.718 3.930 1.00 43.13 C ATOM 0 H ILE A 187 4.986 -15.037 6.059 1.00 14.52 H new ATOM 0 HA ILE A 187 6.937 -15.996 7.933 1.00 44.22 H new ATOM 0 HB ILE A 187 7.448 -15.218 5.067 1.00 23.34 H new ATOM 0 HG12 ILE A 187 6.228 -17.839 5.959 1.00 12.31 H new ATOM 0 HG13 ILE A 187 5.440 -16.599 5.003 1.00 12.31 H new ATOM 0 HG21 ILE A 187 9.095 -17.133 5.258 1.00 44.52 H new ATOM 0 HG22 ILE A 187 9.391 -15.888 6.494 1.00 44.52 H new ATOM 0 HG23 ILE A 187 8.557 -17.397 6.933 1.00 44.52 H new ATOM 0 HD11 ILE A 187 6.209 -18.452 3.574 1.00 43.13 H new ATOM 0 HD12 ILE A 187 7.079 -16.955 3.166 1.00 43.13 H new ATOM 0 HD13 ILE A 187 7.880 -18.213 4.137 1.00 43.13 H new ATOM 3095 N PHE A 188 8.498 -14.008 8.216 1.00 11.23 N ATOM 3096 CA PHE A 188 9.422 -12.903 8.461 1.00 22.40 C ATOM 3097 C PHE A 188 10.792 -13.264 7.886 1.00 11.10 C ATOM 3098 O PHE A 188 11.182 -14.433 7.902 1.00 64.14 O ATOM 3099 CB PHE A 188 9.542 -12.647 9.967 1.00 21.12 C ATOM 3100 CG PHE A 188 8.494 -11.729 10.570 1.00 5.34 C ATOM 3101 CD1 PHE A 188 7.132 -11.824 10.220 1.00 33.20 C ATOM 3102 CD2 PHE A 188 8.895 -10.792 11.540 1.00 72.03 C ATOM 3103 CE1 PHE A 188 6.178 -11.017 10.863 1.00 11.43 C ATOM 3104 CE2 PHE A 188 7.944 -9.976 12.172 1.00 3.30 C ATOM 3105 CZ PHE A 188 6.583 -10.103 11.854 1.00 64.13 C ATOM 0 H PHE A 188 8.681 -14.816 8.811 1.00 11.23 H new ATOM 0 HA PHE A 188 9.048 -11.999 7.980 1.00 22.40 H new ATOM 0 HB2 PHE A 188 9.497 -13.606 10.483 1.00 21.12 H new ATOM 0 HB3 PHE A 188 10.526 -12.223 10.166 1.00 21.12 H new ATOM 0 HD1 PHE A 188 6.820 -12.520 9.455 1.00 33.20 H new ATOM 0 HD2 PHE A 188 9.939 -10.700 11.799 1.00 72.03 H new ATOM 0 HE1 PHE A 188 5.134 -11.098 10.597 1.00 11.43 H new ATOM 0 HE2 PHE A 188 8.260 -9.249 12.905 1.00 3.30 H new ATOM 0 HZ PHE A 188 5.848 -9.501 12.368 1.00 64.13 H new ATOM 3115 N LYS A 189 11.526 -12.265 7.391 1.00 1.10 N ATOM 3116 CA LYS A 189 12.855 -12.385 6.803 1.00 52.43 C ATOM 3117 C LYS A 189 13.601 -11.063 7.013 1.00 2.11 C ATOM 3118 O LYS A 189 12.993 -10.001 7.177 1.00 45.53 O ATOM 3119 CB LYS A 189 12.719 -12.663 5.291 1.00 42.42 C ATOM 3120 CG LYS A 189 12.095 -14.004 4.877 1.00 52.35 C ATOM 3121 CD LYS A 189 12.967 -15.231 5.172 1.00 53.42 C ATOM 3122 CE LYS A 189 12.092 -16.480 5.333 1.00 71.33 C ATOM 3123 NZ LYS A 189 12.886 -17.722 5.441 1.00 2.23 N ATOM 0 H LYS A 189 11.189 -11.302 7.391 1.00 1.10 H new ATOM 0 HA LYS A 189 13.403 -13.202 7.272 1.00 52.43 H new ATOM 0 HB2 LYS A 189 12.122 -11.863 4.853 1.00 42.42 H new ATOM 0 HB3 LYS A 189 13.712 -12.601 4.845 1.00 42.42 H new ATOM 0 HG2 LYS A 189 11.141 -14.120 5.391 1.00 52.35 H new ATOM 0 HG3 LYS A 189 11.880 -13.976 3.809 1.00 52.35 H new ATOM 0 HD2 LYS A 189 13.681 -15.381 4.362 1.00 53.42 H new ATOM 0 HD3 LYS A 189 13.546 -15.064 6.081 1.00 53.42 H new ATOM 0 HE2 LYS A 189 11.471 -16.372 6.223 1.00 71.33 H new ATOM 0 HE3 LYS A 189 11.417 -16.558 4.481 1.00 71.33 H new ATOM 0 HZ1 LYS A 189 12.246 -18.535 5.548 1.00 2.23 H new ATOM 0 HZ2 LYS A 189 13.459 -17.843 4.582 1.00 2.23 H new ATOM 0 HZ3 LYS A 189 13.512 -17.663 6.269 1.00 2.23 H new ATOM 3137 N ASN A 190 14.929 -11.114 6.940 1.00 65.44 N ATOM 3138 CA ASN A 190 15.832 -9.967 6.924 1.00 41.13 C ATOM 3139 C ASN A 190 16.486 -9.777 5.554 1.00 72.35 C ATOM 3140 O ASN A 190 17.075 -8.740 5.289 1.00 2.20 O ATOM 3141 CB ASN A 190 16.927 -10.138 7.987 1.00 10.54 C ATOM 3142 CG ASN A 190 17.698 -11.455 7.913 1.00 53.25 C ATOM 3143 OD1 ASN A 190 17.899 -12.025 6.842 1.00 63.41 O ATOM 3144 ND2 ASN A 190 18.086 -12.003 9.047 1.00 14.13 N ATOM 0 H ASN A 190 15.429 -12.001 6.888 1.00 65.44 H new ATOM 0 HA ASN A 190 15.234 -9.082 7.144 1.00 41.13 H new ATOM 0 HB2 ASN A 190 17.635 -9.314 7.894 1.00 10.54 H new ATOM 0 HB3 ASN A 190 16.471 -10.056 8.974 1.00 10.54 H new ATOM 0 HD21 ASN A 190 18.557 -12.907 9.041 1.00 14.13 H new ATOM 0 HD22 ASN A 190 17.915 -11.523 9.930 1.00 14.13 H new ATOM 3151 N THR A 191 16.367 -10.762 4.671 1.00 65.02 N ATOM 3152 CA THR A 191 16.919 -10.882 3.337 1.00 73.25 C ATOM 3153 C THR A 191 16.044 -11.930 2.656 1.00 72.25 C ATOM 3154 O THR A 191 15.803 -12.994 3.276 1.00 61.01 O ATOM 3155 CB THR A 191 18.396 -11.336 3.350 1.00 34.00 C ATOM 3156 OG1 THR A 191 18.683 -12.386 4.261 1.00 41.43 O ATOM 3157 CG2 THR A 191 19.324 -10.175 3.669 1.00 73.23 C ATOM 0 H THR A 191 15.817 -11.588 4.906 1.00 65.02 H new ATOM 0 HA THR A 191 16.918 -9.922 2.821 1.00 73.25 H new ATOM 0 HB THR A 191 18.567 -11.716 2.343 1.00 34.00 H new ATOM 0 HG1 THR A 191 18.401 -12.124 5.162 1.00 41.43 H new ATOM 0 HG21 THR A 191 20.356 -10.524 3.671 1.00 73.23 H new ATOM 0 HG22 THR A 191 19.206 -9.397 2.915 1.00 73.23 H new ATOM 0 HG23 THR A 191 19.076 -9.770 4.650 1.00 73.23 H new