USER MOD reduce.3.24.130724 H: found=0, std=0, add=1160, rem=0, adj=52 USER MOD reduce.3.24.130724 removed 1162 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 38 HIS : no HD1:sc= 0.176 X(o=0.036,f=-0.23) USER MOD Set 1.2: A 148 GLN : amide:sc= -0.14 X(o=0.036,f=-0.23) USER MOD Set 2.1: A 15 THR OG1 : rot -88:sc= 0.395 USER MOD Set 2.2: A 117 THR OG1 : rot 180:sc= 0.373 USER MOD Set 3.1: A 106 THR OG1 : rot 180:sc=-0.00176 USER MOD Set 3.2: A 108 ASN : amide:sc= 0 X(o=-0.0018,f=-0.0018) USER MOD Set 4.1: A 91 THR OG1 : rot 180:sc= 0 USER MOD Set 4.2: A 92 SER OG : rot 180:sc= 0 USER MOD Set 5.1: A 66 MET CE :methyl 161:sc= -0.0894 (180deg=-0.533) USER MOD Set 5.2: A 68 SER OG : rot 180:sc= 0 USER MOD Set 6.1: A 47 TYR OH : rot -10:sc= 0.686 USER MOD Set 6.2: A 62 GLN : amide:sc= -1.82! X(o=-1.1!,f=-1.4) USER MOD Set 7.1: A 9 LYS NZ :NH3+ -117:sc= 0.266 (180deg=-0.191) USER MOD Set 7.2: A 123 THR OG1 : rot 76:sc= 0.684 USER MOD Single : A 5 LYS NZ :NH3+ -146:sc= -0.461 (180deg=-2.13!) USER MOD Single : A 6 LYS NZ :NH3+ -110:sc= 0.179 (180deg=-0.136) USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 ASN : amide:sc= -0.45 X(o=-0.45,f=-0.49) USER MOD Single : A 13 THR OG1 : rot 118:sc= 0.414 USER MOD Single : A 17 SER OG : rot 180:sc= -0.312 USER MOD Single : A 21 ASN : amide:sc=-0.00617 X(o=-0.0062,f=-0.13) USER MOD Single : A 22 LYS NZ :NH3+ 173:sc=-0.000606 (180deg=-0.0818) USER MOD Single : A 27 TYR OH : rot 180:sc= 0 USER MOD Single : A 28 THR OG1 : rot 80:sc= 1.1 USER MOD Single : A 29 LYS NZ :NH3+ -178:sc= 0.714 (180deg=0.707) USER MOD Single : A 35 GLN :FLIP amide:sc= 0 F(o=-0.94,f=0) USER MOD Single : A 40 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 45 THR OG1 : rot 180:sc=-0.00165 USER MOD Single : A 50 ASN : amide:sc= -0.22 X(o=-0.22,f=0) USER MOD Single : A 52 THR OG1 : rot 180:sc= -0.174 USER MOD Single : A 53 LYS NZ :NH3+ 162:sc= 0.687 (180deg=0.52) USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 65 GLN : amide:sc= -0.304 X(o=-0.3,f=0) USER MOD Single : A 69 TYR OH : rot 180:sc= 0 USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 TYR OH : rot 68:sc= 0.77 USER MOD Single : A 76 GLN : amide:sc= 0 K(o=0,f=-0.67) USER MOD Single : A 81 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 TYR OH : rot -166:sc= 0.298 USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 88 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 LYS NZ :NH3+ -154:sc= 0.573 (180deg=-0.0735) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 100 MET CE :methyl -161:sc= -0.126 (180deg=-0.572) USER MOD Single : A 103 MET CE :methyl 151:sc= -0.788 (180deg=-2.78!) USER MOD Single : A 104 HIS : no HE2:sc=-0.00363 K(o=-0.0036,f=-2.3!) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 THR OG1 : rot 109:sc= 0.57 USER MOD Single : A 119 THR OG1 : rot 180:sc= 0 USER MOD Single : A 120 SER OG : rot 180:sc= -1.62! USER MOD Single : A 121 THR OG1 : rot 180:sc= 0 USER MOD Single : A 122 SER OG : rot -62:sc= 0.338 USER MOD Single : A 126 THR OG1 : rot 180:sc= 0.0179 USER MOD Single : A 128 SER OG : rot 180:sc= 0 USER MOD Single : A 131 GLN : amide:sc= 0.318 X(o=0.32,f=0) USER MOD Single : A 132 GLN : amide:sc= 0.155 X(o=0.16,f=-0.16) USER MOD Single : A 136 MET CE :methyl 135:sc= -0.036 (180deg=-0.881) USER MOD Single : A 140 THR OG1 : rot -13:sc= 0.0558 USER MOD Single : A 142 MET CE :methyl -122:sc= -1.12 (180deg=-4.39!) USER MOD Single : A 143 ASN : amide:sc= 0.199 K(o=0.2,f=-2.7!) USER MOD Single : A 144 SER OG : rot 76:sc= 0.743 USER MOD Single : A 145 THR OG1 : rot 71:sc= 0.336 USER MOD Single : A 147 ASN :FLIP amide:sc= -0.429 F(o=-3!,f=-0.43) USER MOD Single : A 151 LYS NZ :NH3+ 168:sc= 0.675 (180deg=0.587) USER MOD Single : A 154 ASN : amide:sc= 0.437 X(o=0.44,f=0.039) USER MOD Single : A 155 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 34 N ILE A 3 3.883 -15.667 -3.047 1.00 63.43 N ATOM 35 CA ILE A 3 4.699 -14.491 -3.447 1.00 75.44 C ATOM 36 C ILE A 3 6.114 -14.895 -3.934 1.00 10.23 C ATOM 37 O ILE A 3 6.674 -15.911 -3.507 1.00 24.42 O ATOM 38 CB ILE A 3 4.836 -13.458 -2.264 1.00 33.03 C ATOM 39 CG1 ILE A 3 5.476 -14.120 -1.004 1.00 0.11 C ATOM 40 CG2 ILE A 3 3.470 -12.821 -1.928 1.00 41.35 C ATOM 41 CD1 ILE A 3 5.735 -13.172 0.152 1.00 12.42 C ATOM 0 HA ILE A 3 4.169 -14.024 -4.277 1.00 75.44 H new ATOM 0 HB ILE A 3 5.506 -12.663 -2.591 1.00 33.03 H new ATOM 0 HG12 ILE A 3 4.821 -14.920 -0.659 1.00 0.11 H new ATOM 0 HG13 ILE A 3 6.419 -14.583 -1.294 1.00 0.11 H new ATOM 0 HG21 ILE A 3 3.591 -12.112 -1.109 1.00 41.35 H new ATOM 0 HG22 ILE A 3 3.086 -12.300 -2.805 1.00 41.35 H new ATOM 0 HG23 ILE A 3 2.768 -13.601 -1.633 1.00 41.35 H new ATOM 0 HD11 ILE A 3 6.180 -13.722 0.981 1.00 12.42 H new ATOM 0 HD12 ILE A 3 6.417 -12.385 -0.169 1.00 12.42 H new ATOM 0 HD13 ILE A 3 4.794 -12.727 0.476 1.00 12.42 H new ATOM 53 N GLU A 4 6.685 -14.064 -4.820 1.00 22.14 N ATOM 54 CA GLU A 4 8.071 -14.224 -5.330 1.00 0.33 C ATOM 55 C GLU A 4 9.044 -13.299 -4.555 1.00 24.42 C ATOM 56 O GLU A 4 8.670 -12.199 -4.156 1.00 22.25 O ATOM 57 CB GLU A 4 8.103 -13.908 -6.854 1.00 51.11 C ATOM 58 CG GLU A 4 9.505 -13.818 -7.507 1.00 1.15 C ATOM 59 CD GLU A 4 10.279 -15.152 -7.617 1.00 62.44 C ATOM 60 OE1 GLU A 4 10.788 -15.645 -6.589 1.00 71.44 O ATOM 61 OE2 GLU A 4 10.429 -15.676 -8.741 1.00 71.33 O ATOM 0 H GLU A 4 6.202 -13.255 -5.210 1.00 22.14 H new ATOM 0 HA GLU A 4 8.394 -15.254 -5.176 1.00 0.33 H new ATOM 0 HB2 GLU A 4 7.532 -14.676 -7.375 1.00 51.11 H new ATOM 0 HB3 GLU A 4 7.588 -12.962 -7.018 1.00 51.11 H new ATOM 0 HG2 GLU A 4 9.394 -13.400 -8.507 1.00 1.15 H new ATOM 0 HG3 GLU A 4 10.109 -13.115 -6.933 1.00 1.15 H new ATOM 68 N LYS A 5 10.290 -13.762 -4.321 1.00 13.10 N ATOM 69 CA LYS A 5 11.333 -12.989 -3.586 1.00 43.44 C ATOM 70 C LYS A 5 12.613 -12.799 -4.442 1.00 73.14 C ATOM 71 O LYS A 5 13.114 -13.751 -5.044 1.00 72.23 O ATOM 72 CB LYS A 5 11.697 -13.685 -2.228 1.00 71.24 C ATOM 73 CG LYS A 5 10.776 -13.331 -1.027 1.00 34.41 C ATOM 74 CD LYS A 5 9.311 -13.844 -1.132 1.00 62.14 C ATOM 75 CE LYS A 5 9.138 -15.358 -0.872 1.00 5.51 C ATOM 76 NZ LYS A 5 9.669 -16.215 -1.963 1.00 73.12 N ATOM 0 H LYS A 5 10.608 -14.680 -4.633 1.00 13.10 H new ATOM 0 HA LYS A 5 10.913 -12.005 -3.376 1.00 43.44 H new ATOM 0 HB2 LYS A 5 11.674 -14.765 -2.375 1.00 71.24 H new ATOM 0 HB3 LYS A 5 12.722 -13.421 -1.968 1.00 71.24 H new ATOM 0 HG2 LYS A 5 11.221 -13.738 -0.119 1.00 34.41 H new ATOM 0 HG3 LYS A 5 10.756 -12.247 -0.914 1.00 34.41 H new ATOM 0 HD2 LYS A 5 8.696 -13.294 -0.420 1.00 62.14 H new ATOM 0 HD3 LYS A 5 8.930 -13.614 -2.127 1.00 62.14 H new ATOM 0 HE2 LYS A 5 9.641 -15.618 0.060 1.00 5.51 H new ATOM 0 HE3 LYS A 5 8.079 -15.575 -0.734 1.00 5.51 H new ATOM 0 HZ1 LYS A 5 9.078 -17.066 -2.055 1.00 73.12 H new ATOM 0 HZ2 LYS A 5 9.656 -15.685 -2.858 1.00 73.12 H new ATOM 0 HZ3 LYS A 5 10.646 -16.495 -1.741 1.00 73.12 H new ATOM 90 N LYS A 6 13.130 -11.548 -4.487 1.00 32.40 N ATOM 91 CA LYS A 6 14.453 -11.223 -5.084 1.00 3.20 C ATOM 92 C LYS A 6 15.362 -10.595 -3.990 1.00 41.43 C ATOM 93 O LYS A 6 15.600 -9.377 -3.985 1.00 31.30 O ATOM 94 CB LYS A 6 14.320 -10.252 -6.303 1.00 12.34 C ATOM 95 CG LYS A 6 13.237 -10.609 -7.346 1.00 24.21 C ATOM 96 CD LYS A 6 13.445 -11.976 -8.032 1.00 40.23 C ATOM 97 CE LYS A 6 12.363 -12.238 -9.093 1.00 34.54 C ATOM 98 NZ LYS A 6 12.457 -13.601 -9.668 1.00 72.43 N ATOM 0 H LYS A 6 12.644 -10.734 -4.111 1.00 32.40 H new ATOM 0 HA LYS A 6 14.899 -12.145 -5.456 1.00 3.20 H new ATOM 0 HB2 LYS A 6 14.113 -9.252 -5.923 1.00 12.34 H new ATOM 0 HB3 LYS A 6 15.283 -10.207 -6.811 1.00 12.34 H new ATOM 0 HG2 LYS A 6 12.263 -10.605 -6.857 1.00 24.21 H new ATOM 0 HG3 LYS A 6 13.214 -9.832 -8.110 1.00 24.21 H new ATOM 0 HD2 LYS A 6 14.430 -12.005 -8.498 1.00 40.23 H new ATOM 0 HD3 LYS A 6 13.423 -12.768 -7.284 1.00 40.23 H new ATOM 0 HE2 LYS A 6 11.378 -12.102 -8.646 1.00 34.54 H new ATOM 0 HE3 LYS A 6 12.455 -11.502 -9.892 1.00 34.54 H new ATOM 0 HZ1 LYS A 6 12.781 -13.540 -10.654 1.00 72.43 H new ATOM 0 HZ2 LYS A 6 13.134 -14.165 -9.115 1.00 72.43 H new ATOM 0 HZ3 LYS A 6 11.522 -14.055 -9.638 1.00 72.43 H new ATOM 112 N LYS A 7 15.822 -11.455 -3.051 1.00 43.23 N ATOM 113 CA LYS A 7 16.690 -11.091 -1.890 1.00 12.12 C ATOM 114 C LYS A 7 15.995 -10.045 -0.957 1.00 31.04 C ATOM 115 O LYS A 7 15.403 -10.400 0.073 1.00 14.02 O ATOM 116 CB LYS A 7 18.118 -10.592 -2.323 1.00 40.41 C ATOM 117 CG LYS A 7 19.013 -11.596 -3.122 1.00 13.41 C ATOM 118 CD LYS A 7 18.571 -11.781 -4.598 1.00 55.15 C ATOM 119 CE LYS A 7 19.558 -12.609 -5.442 1.00 70.04 C ATOM 120 NZ LYS A 7 19.073 -12.790 -6.838 1.00 25.33 N ATOM 0 H LYS A 7 15.597 -12.450 -3.074 1.00 43.23 H new ATOM 0 HA LYS A 7 16.836 -12.012 -1.325 1.00 12.12 H new ATOM 0 HB2 LYS A 7 17.993 -9.694 -2.929 1.00 40.41 H new ATOM 0 HB3 LYS A 7 18.660 -10.297 -1.424 1.00 40.41 H new ATOM 0 HG2 LYS A 7 20.045 -11.246 -3.101 1.00 13.41 H new ATOM 0 HG3 LYS A 7 18.995 -12.564 -2.622 1.00 13.41 H new ATOM 0 HD2 LYS A 7 17.595 -12.266 -4.617 1.00 55.15 H new ATOM 0 HD3 LYS A 7 18.449 -10.800 -5.057 1.00 55.15 H new ATOM 0 HE2 LYS A 7 20.529 -12.114 -5.456 1.00 70.04 H new ATOM 0 HE3 LYS A 7 19.704 -13.585 -4.978 1.00 70.04 H new ATOM 0 HZ1 LYS A 7 19.764 -13.352 -7.375 1.00 25.33 H new ATOM 0 HZ2 LYS A 7 18.158 -13.285 -6.826 1.00 25.33 H new ATOM 0 HZ3 LYS A 7 18.958 -11.860 -7.289 1.00 25.33 H new ATOM 134 N ASN A 8 16.063 -8.757 -1.350 1.00 1.03 N ATOM 135 CA ASN A 8 15.457 -7.621 -0.610 1.00 31.15 C ATOM 136 C ASN A 8 14.239 -7.049 -1.389 1.00 42.21 C ATOM 137 O ASN A 8 14.013 -5.840 -1.444 1.00 55.32 O ATOM 138 CB ASN A 8 16.542 -6.546 -0.357 1.00 70.31 C ATOM 139 CG ASN A 8 17.153 -5.967 -1.641 1.00 75.52 C ATOM 140 OD1 ASN A 8 18.102 -6.515 -2.189 1.00 51.40 O ATOM 141 ND2 ASN A 8 16.633 -4.845 -2.109 1.00 74.34 N ATOM 0 H ASN A 8 16.546 -8.468 -2.201 1.00 1.03 H new ATOM 0 HA ASN A 8 15.082 -7.964 0.354 1.00 31.15 H new ATOM 0 HB2 ASN A 8 16.107 -5.734 0.225 1.00 70.31 H new ATOM 0 HB3 ASN A 8 17.337 -6.981 0.248 1.00 70.31 H new ATOM 0 HD21 ASN A 8 17.022 -4.413 -2.947 1.00 74.34 H new ATOM 0 HD22 ASN A 8 15.843 -4.411 -1.632 1.00 74.34 H new ATOM 148 N LYS A 9 13.426 -7.960 -1.937 1.00 33.12 N ATOM 149 CA LYS A 9 12.239 -7.624 -2.752 1.00 12.22 C ATOM 150 C LYS A 9 11.149 -8.692 -2.574 1.00 14.15 C ATOM 151 O LYS A 9 11.421 -9.889 -2.683 1.00 23.43 O ATOM 152 CB LYS A 9 12.666 -7.507 -4.243 1.00 24.43 C ATOM 153 CG LYS A 9 11.517 -7.373 -5.273 1.00 71.30 C ATOM 154 CD LYS A 9 12.029 -7.181 -6.720 1.00 72.30 C ATOM 155 CE LYS A 9 12.852 -5.892 -6.888 1.00 60.15 C ATOM 156 NZ LYS A 9 12.064 -4.674 -6.548 1.00 41.42 N ATOM 0 H LYS A 9 13.570 -8.964 -1.829 1.00 33.12 H new ATOM 0 HA LYS A 9 11.825 -6.671 -2.424 1.00 12.22 H new ATOM 0 HB2 LYS A 9 13.321 -6.642 -4.345 1.00 24.43 H new ATOM 0 HB3 LYS A 9 13.257 -8.386 -4.501 1.00 24.43 H new ATOM 0 HG2 LYS A 9 10.890 -8.264 -5.229 1.00 71.30 H new ATOM 0 HG3 LYS A 9 10.887 -6.526 -5.000 1.00 71.30 H new ATOM 0 HD2 LYS A 9 12.641 -8.038 -7.002 1.00 72.30 H new ATOM 0 HD3 LYS A 9 11.179 -7.157 -7.402 1.00 72.30 H new ATOM 0 HE2 LYS A 9 13.735 -5.941 -6.251 1.00 60.15 H new ATOM 0 HE3 LYS A 9 13.205 -5.819 -7.917 1.00 60.15 H new ATOM 0 HZ1 LYS A 9 11.969 -4.075 -7.393 1.00 41.42 H new ATOM 0 HZ2 LYS A 9 11.120 -4.954 -6.214 1.00 41.42 H new ATOM 0 HZ3 LYS A 9 12.553 -4.142 -5.800 1.00 41.42 H new ATOM 170 N ILE A 10 9.916 -8.244 -2.286 1.00 33.30 N ATOM 171 CA ILE A 10 8.733 -9.118 -2.193 1.00 25.41 C ATOM 172 C ILE A 10 7.709 -8.717 -3.278 1.00 10.23 C ATOM 173 O ILE A 10 7.072 -7.658 -3.201 1.00 3.13 O ATOM 174 CB ILE A 10 8.076 -9.049 -0.762 1.00 20.21 C ATOM 175 CG1 ILE A 10 9.074 -9.571 0.317 1.00 31.33 C ATOM 176 CG2 ILE A 10 6.738 -9.827 -0.715 1.00 1.31 C ATOM 177 CD1 ILE A 10 8.617 -9.414 1.758 1.00 51.45 C ATOM 0 H ILE A 10 9.710 -7.261 -2.110 1.00 33.30 H new ATOM 0 HA ILE A 10 9.051 -10.148 -2.357 1.00 25.41 H new ATOM 0 HB ILE A 10 7.848 -8.006 -0.542 1.00 20.21 H new ATOM 0 HG12 ILE A 10 9.267 -10.627 0.128 1.00 31.33 H new ATOM 0 HG13 ILE A 10 10.022 -9.046 0.195 1.00 31.33 H new ATOM 0 HG21 ILE A 10 6.312 -9.759 0.286 1.00 1.31 H new ATOM 0 HG22 ILE A 10 6.042 -9.397 -1.435 1.00 1.31 H new ATOM 0 HG23 ILE A 10 6.917 -10.873 -0.963 1.00 1.31 H new ATOM 0 HD11 ILE A 10 9.382 -9.808 2.427 1.00 51.45 H new ATOM 0 HD12 ILE A 10 8.453 -8.358 1.975 1.00 51.45 H new ATOM 0 HD13 ILE A 10 7.687 -9.963 1.907 1.00 51.45 H new ATOM 189 N ILE A 11 7.611 -9.555 -4.305 1.00 41.25 N ATOM 190 CA ILE A 11 6.608 -9.431 -5.367 1.00 12.23 C ATOM 191 C ILE A 11 5.283 -10.075 -4.884 1.00 43.30 C ATOM 192 O ILE A 11 5.160 -11.304 -4.817 1.00 0.31 O ATOM 193 CB ILE A 11 7.146 -10.126 -6.673 1.00 24.04 C ATOM 194 CG1 ILE A 11 8.515 -9.499 -7.090 1.00 73.51 C ATOM 195 CG2 ILE A 11 6.128 -10.063 -7.831 1.00 74.22 C ATOM 196 CD1 ILE A 11 9.176 -10.135 -8.299 1.00 1.33 C ATOM 0 H ILE A 11 8.234 -10.353 -4.428 1.00 41.25 H new ATOM 0 HA ILE A 11 6.417 -8.383 -5.597 1.00 12.23 H new ATOM 0 HB ILE A 11 7.296 -11.182 -6.449 1.00 24.04 H new ATOM 0 HG12 ILE A 11 8.364 -8.439 -7.294 1.00 73.51 H new ATOM 0 HG13 ILE A 11 9.200 -9.566 -6.244 1.00 73.51 H new ATOM 0 HG21 ILE A 11 6.545 -10.556 -8.709 1.00 74.22 H new ATOM 0 HG22 ILE A 11 5.208 -10.567 -7.535 1.00 74.22 H new ATOM 0 HG23 ILE A 11 5.911 -9.022 -8.068 1.00 74.22 H new ATOM 0 HD11 ILE A 11 10.119 -9.629 -8.506 1.00 1.33 H new ATOM 0 HD12 ILE A 11 9.367 -11.189 -8.097 1.00 1.33 H new ATOM 0 HD13 ILE A 11 8.518 -10.045 -9.163 1.00 1.33 H new ATOM 208 N PHE A 12 4.313 -9.220 -4.531 1.00 13.44 N ATOM 209 CA PHE A 12 3.027 -9.628 -3.926 1.00 34.34 C ATOM 210 C PHE A 12 1.908 -9.609 -4.981 1.00 64.53 C ATOM 211 O PHE A 12 1.665 -8.574 -5.581 1.00 1.33 O ATOM 212 CB PHE A 12 2.654 -8.655 -2.767 1.00 55.05 C ATOM 213 CG PHE A 12 1.511 -9.155 -1.875 1.00 23.53 C ATOM 214 CD1 PHE A 12 1.759 -10.051 -0.834 1.00 54.52 C ATOM 215 CD2 PHE A 12 0.193 -8.752 -2.088 1.00 73.21 C ATOM 216 CE1 PHE A 12 0.731 -10.523 -0.042 1.00 71.11 C ATOM 217 CE2 PHE A 12 -0.829 -9.230 -1.295 1.00 13.44 C ATOM 218 CZ PHE A 12 -0.561 -10.113 -0.275 1.00 51.22 C ATOM 0 H PHE A 12 4.396 -8.211 -4.657 1.00 13.44 H new ATOM 0 HA PHE A 12 3.135 -10.640 -3.536 1.00 34.34 H new ATOM 0 HB2 PHE A 12 3.536 -8.487 -2.149 1.00 55.05 H new ATOM 0 HB3 PHE A 12 2.374 -7.691 -3.192 1.00 55.05 H new ATOM 0 HD1 PHE A 12 2.770 -10.380 -0.645 1.00 54.52 H new ATOM 0 HD2 PHE A 12 -0.030 -8.057 -2.884 1.00 73.21 H new ATOM 0 HE1 PHE A 12 0.942 -11.214 0.761 1.00 71.11 H new ATOM 0 HE2 PHE A 12 -1.844 -8.910 -1.476 1.00 13.44 H new ATOM 0 HZ PHE A 12 -1.365 -10.484 0.343 1.00 51.22 H new ATOM 228 N THR A 13 1.213 -10.735 -5.183 1.00 43.14 N ATOM 229 CA THR A 13 0.050 -10.796 -6.102 1.00 1.13 C ATOM 230 C THR A 13 -1.273 -10.939 -5.314 1.00 33.02 C ATOM 231 O THR A 13 -1.374 -11.746 -4.380 1.00 25.24 O ATOM 232 CB THR A 13 0.200 -11.942 -7.160 1.00 21.13 C ATOM 233 OG1 THR A 13 -1.013 -12.084 -7.922 1.00 51.41 O ATOM 234 CG2 THR A 13 0.591 -13.295 -6.533 1.00 14.34 C ATOM 0 H THR A 13 1.429 -11.621 -4.726 1.00 43.14 H new ATOM 0 HA THR A 13 0.021 -9.853 -6.648 1.00 1.13 H new ATOM 0 HB THR A 13 1.017 -11.650 -7.819 1.00 21.13 H new ATOM 0 HG1 THR A 13 -0.831 -11.893 -8.866 1.00 51.41 H new ATOM 0 HG21 THR A 13 0.679 -14.047 -7.317 1.00 14.34 H new ATOM 0 HG22 THR A 13 1.546 -13.195 -6.017 1.00 14.34 H new ATOM 0 HG23 THR A 13 -0.175 -13.601 -5.821 1.00 14.34 H new ATOM 242 N ARG A 14 -2.284 -10.133 -5.698 1.00 64.34 N ATOM 243 CA ARG A 14 -3.601 -10.094 -5.021 1.00 14.21 C ATOM 244 C ARG A 14 -4.739 -9.824 -6.037 1.00 33.41 C ATOM 245 O ARG A 14 -4.542 -9.114 -7.032 1.00 2.43 O ATOM 246 CB ARG A 14 -3.592 -8.999 -3.913 1.00 10.33 C ATOM 247 CG ARG A 14 -4.934 -8.814 -3.161 1.00 22.21 C ATOM 248 CD ARG A 14 -5.329 -10.007 -2.266 1.00 2.54 C ATOM 249 NE ARG A 14 -6.766 -9.975 -1.919 1.00 20.25 N ATOM 250 CZ ARG A 14 -7.282 -10.131 -0.716 1.00 33.24 C ATOM 251 NH1 ARG A 14 -6.532 -10.302 0.337 1.00 1.01 N ATOM 252 NH2 ARG A 14 -8.574 -10.124 -0.588 1.00 13.04 N ATOM 0 H ARG A 14 -2.212 -9.490 -6.486 1.00 64.34 H new ATOM 0 HA ARG A 14 -3.784 -11.066 -4.562 1.00 14.21 H new ATOM 0 HB2 ARG A 14 -2.817 -9.245 -3.187 1.00 10.33 H new ATOM 0 HB3 ARG A 14 -3.313 -8.048 -4.366 1.00 10.33 H new ATOM 0 HG2 ARG A 14 -4.871 -7.917 -2.544 1.00 22.21 H new ATOM 0 HG3 ARG A 14 -5.726 -8.644 -3.891 1.00 22.21 H new ATOM 0 HD2 ARG A 14 -5.099 -10.940 -2.780 1.00 2.54 H new ATOM 0 HD3 ARG A 14 -4.733 -9.991 -1.353 1.00 2.54 H new ATOM 0 HE ARG A 14 -7.421 -9.817 -2.684 1.00 20.25 H new ATOM 0 HH11 ARG A 14 -5.516 -10.318 0.243 1.00 1.01 H new ATOM 0 HH12 ARG A 14 -6.961 -10.420 1.255 1.00 1.01 H new ATOM 0 HH21 ARG A 14 -9.167 -10.000 -1.408 1.00 13.04 H new ATOM 0 HH22 ARG A 14 -8.996 -10.243 0.333 1.00 13.04 H new ATOM 266 N THR A 15 -5.931 -10.389 -5.760 1.00 34.31 N ATOM 267 CA THR A 15 -7.147 -10.194 -6.584 1.00 52.33 C ATOM 268 C THR A 15 -8.337 -9.723 -5.704 1.00 61.04 C ATOM 269 O THR A 15 -8.465 -10.133 -4.544 1.00 73.20 O ATOM 270 CB THR A 15 -7.522 -11.518 -7.341 1.00 54.45 C ATOM 271 OG1 THR A 15 -6.374 -11.999 -8.065 1.00 54.31 O ATOM 272 CG2 THR A 15 -8.684 -11.334 -8.335 1.00 32.03 C ATOM 0 H THR A 15 -6.081 -10.997 -4.955 1.00 34.31 H new ATOM 0 HA THR A 15 -6.935 -9.421 -7.322 1.00 52.33 H new ATOM 0 HB THR A 15 -7.842 -12.233 -6.583 1.00 54.45 H new ATOM 0 HG1 THR A 15 -6.352 -11.588 -8.954 1.00 54.31 H new ATOM 0 HG21 THR A 15 -8.896 -12.283 -8.827 1.00 32.03 H new ATOM 0 HG22 THR A 15 -9.571 -10.997 -7.799 1.00 32.03 H new ATOM 0 HG23 THR A 15 -8.408 -10.592 -9.084 1.00 32.03 H new ATOM 280 N PHE A 16 -9.187 -8.835 -6.260 1.00 3.02 N ATOM 281 CA PHE A 16 -10.410 -8.323 -5.590 1.00 13.41 C ATOM 282 C PHE A 16 -11.642 -8.485 -6.505 1.00 45.21 C ATOM 283 O PHE A 16 -11.564 -8.220 -7.713 1.00 52.11 O ATOM 284 CB PHE A 16 -10.249 -6.817 -5.215 1.00 25.24 C ATOM 285 CG PHE A 16 -9.156 -6.533 -4.184 1.00 11.31 C ATOM 286 CD1 PHE A 16 -9.343 -6.869 -2.843 1.00 31.34 C ATOM 287 CD2 PHE A 16 -7.941 -5.948 -4.554 1.00 75.44 C ATOM 288 CE1 PHE A 16 -8.358 -6.627 -1.909 1.00 73.35 C ATOM 289 CE2 PHE A 16 -6.956 -5.708 -3.615 1.00 21.23 C ATOM 290 CZ PHE A 16 -7.166 -6.049 -2.294 1.00 52.53 C ATOM 0 H PHE A 16 -9.047 -8.448 -7.193 1.00 3.02 H new ATOM 0 HA PHE A 16 -10.555 -8.906 -4.681 1.00 13.41 H new ATOM 0 HB2 PHE A 16 -10.032 -6.251 -6.121 1.00 25.24 H new ATOM 0 HB3 PHE A 16 -11.199 -6.448 -4.829 1.00 25.24 H new ATOM 0 HD1 PHE A 16 -10.272 -7.325 -2.532 1.00 31.34 H new ATOM 0 HD2 PHE A 16 -7.770 -5.680 -5.586 1.00 75.44 H new ATOM 0 HE1 PHE A 16 -8.520 -6.890 -0.874 1.00 73.35 H new ATOM 0 HE2 PHE A 16 -6.023 -5.254 -3.914 1.00 21.23 H new ATOM 0 HZ PHE A 16 -6.396 -5.863 -1.560 1.00 52.53 H new ATOM 300 N SER A 17 -12.771 -8.933 -5.923 1.00 43.45 N ATOM 301 CA SER A 17 -14.078 -8.932 -6.614 1.00 11.22 C ATOM 302 C SER A 17 -14.751 -7.555 -6.432 1.00 33.40 C ATOM 303 O SER A 17 -15.436 -7.313 -5.437 1.00 62.12 O ATOM 304 CB SER A 17 -14.976 -10.068 -6.062 1.00 4.04 C ATOM 305 OG SER A 17 -14.396 -11.343 -6.301 1.00 42.30 O ATOM 0 H SER A 17 -12.805 -9.302 -4.973 1.00 43.45 H new ATOM 0 HA SER A 17 -13.929 -9.111 -7.679 1.00 11.22 H new ATOM 0 HB2 SER A 17 -15.126 -9.929 -4.991 1.00 4.04 H new ATOM 0 HB3 SER A 17 -15.959 -10.019 -6.531 1.00 4.04 H new ATOM 0 HG SER A 17 -14.982 -12.041 -5.941 1.00 42.30 H new ATOM 311 N ALA A 18 -14.516 -6.668 -7.418 1.00 20.13 N ATOM 312 CA ALA A 18 -14.965 -5.251 -7.428 1.00 62.40 C ATOM 313 C ALA A 18 -14.350 -4.547 -8.660 1.00 73.23 C ATOM 314 O ALA A 18 -13.237 -4.914 -9.068 1.00 23.51 O ATOM 315 CB ALA A 18 -14.542 -4.498 -6.140 1.00 14.33 C ATOM 0 H ALA A 18 -13.993 -6.919 -8.257 1.00 20.13 H new ATOM 0 HA ALA A 18 -16.054 -5.237 -7.474 1.00 62.40 H new ATOM 0 HB1 ALA A 18 -14.891 -3.467 -6.190 1.00 14.33 H new ATOM 0 HB2 ALA A 18 -14.982 -4.988 -5.271 1.00 14.33 H new ATOM 0 HB3 ALA A 18 -13.456 -4.510 -6.052 1.00 14.33 H new ATOM 321 N PRO A 19 -15.042 -3.540 -9.289 1.00 62.04 N ATOM 322 CA PRO A 19 -14.454 -2.746 -10.405 1.00 61.03 C ATOM 323 C PRO A 19 -13.101 -2.083 -10.017 1.00 2.23 C ATOM 324 O PRO A 19 -12.929 -1.621 -8.879 1.00 62.14 O ATOM 325 CB PRO A 19 -15.549 -1.677 -10.725 1.00 51.15 C ATOM 326 CG PRO A 19 -16.472 -1.694 -9.535 1.00 63.45 C ATOM 327 CD PRO A 19 -16.439 -3.113 -9.004 1.00 3.20 C ATOM 0 HA PRO A 19 -14.210 -3.371 -11.264 1.00 61.03 H new ATOM 0 HB2 PRO A 19 -15.108 -0.691 -10.868 1.00 51.15 H new ATOM 0 HB3 PRO A 19 -16.084 -1.923 -11.642 1.00 51.15 H new ATOM 0 HG2 PRO A 19 -16.143 -0.985 -8.775 1.00 63.45 H new ATOM 0 HG3 PRO A 19 -17.484 -1.408 -9.821 1.00 63.45 H new ATOM 0 HD2 PRO A 19 -16.664 -3.151 -7.938 1.00 3.20 H new ATOM 0 HD3 PRO A 19 -17.167 -3.750 -9.507 1.00 3.20 H new ATOM 335 N ILE A 20 -12.152 -2.041 -10.980 1.00 34.42 N ATOM 336 CA ILE A 20 -10.792 -1.462 -10.785 1.00 61.22 C ATOM 337 C ILE A 20 -10.853 0.037 -10.353 1.00 61.12 C ATOM 338 O ILE A 20 -9.917 0.569 -9.764 1.00 52.44 O ATOM 339 CB ILE A 20 -9.910 -1.641 -12.082 1.00 24.33 C ATOM 340 CG1 ILE A 20 -8.402 -1.311 -11.800 1.00 52.35 C ATOM 341 CG2 ILE A 20 -10.463 -0.801 -13.261 1.00 11.01 C ATOM 342 CD1 ILE A 20 -7.447 -1.662 -12.933 1.00 54.22 C ATOM 0 H ILE A 20 -12.303 -2.408 -11.920 1.00 34.42 H new ATOM 0 HA ILE A 20 -10.320 -2.014 -9.972 1.00 61.22 H new ATOM 0 HB ILE A 20 -9.965 -2.690 -12.373 1.00 24.33 H new ATOM 0 HG12 ILE A 20 -8.312 -0.246 -11.585 1.00 52.35 H new ATOM 0 HG13 ILE A 20 -8.090 -1.845 -10.902 1.00 52.35 H new ATOM 0 HG21 ILE A 20 -9.833 -0.947 -14.139 1.00 11.01 H new ATOM 0 HG22 ILE A 20 -11.481 -1.119 -13.488 1.00 11.01 H new ATOM 0 HG23 ILE A 20 -10.465 0.254 -12.987 1.00 11.01 H new ATOM 0 HD11 ILE A 20 -6.429 -1.398 -12.646 1.00 54.22 H new ATOM 0 HD12 ILE A 20 -7.501 -2.732 -13.136 1.00 54.22 H new ATOM 0 HD13 ILE A 20 -7.726 -1.108 -13.829 1.00 54.22 H new ATOM 354 N ASN A 21 -11.986 0.690 -10.660 1.00 53.44 N ATOM 355 CA ASN A 21 -12.280 2.086 -10.253 1.00 52.40 C ATOM 356 C ASN A 21 -12.315 2.260 -8.716 1.00 22.04 C ATOM 357 O ASN A 21 -12.011 3.328 -8.210 1.00 64.33 O ATOM 358 CB ASN A 21 -13.615 2.544 -10.877 1.00 4.24 C ATOM 359 CG ASN A 21 -13.599 2.429 -12.396 1.00 33.34 C ATOM 360 OD1 ASN A 21 -13.970 1.403 -12.952 1.00 31.34 O ATOM 361 ND2 ASN A 21 -13.130 3.459 -13.074 1.00 43.24 N ATOM 0 H ASN A 21 -12.736 0.264 -11.204 1.00 53.44 H new ATOM 0 HA ASN A 21 -11.468 2.712 -10.623 1.00 52.40 H new ATOM 0 HB2 ASN A 21 -14.430 1.941 -10.476 1.00 4.24 H new ATOM 0 HB3 ASN A 21 -13.813 3.577 -10.593 1.00 4.24 H new ATOM 0 HD21 ASN A 21 -13.068 3.415 -14.091 1.00 43.24 H new ATOM 0 HD22 ASN A 21 -12.829 4.300 -12.581 1.00 43.24 H new ATOM 368 N LYS A 22 -12.731 1.214 -7.988 1.00 33.12 N ATOM 369 CA LYS A 22 -12.670 1.198 -6.503 1.00 71.01 C ATOM 370 C LYS A 22 -11.242 0.823 -6.035 1.00 23.20 C ATOM 371 O LYS A 22 -10.666 1.459 -5.148 1.00 65.24 O ATOM 372 CB LYS A 22 -13.694 0.183 -5.914 1.00 33.45 C ATOM 373 CG LYS A 22 -15.067 0.172 -6.609 1.00 23.02 C ATOM 374 CD LYS A 22 -16.148 -0.605 -5.817 1.00 51.21 C ATOM 375 CE LYS A 22 -16.491 0.052 -4.461 1.00 73.51 C ATOM 376 NZ LYS A 22 -17.007 1.439 -4.610 1.00 53.24 N ATOM 0 H LYS A 22 -13.116 0.362 -8.396 1.00 33.12 H new ATOM 0 HA LYS A 22 -12.922 2.195 -6.143 1.00 71.01 H new ATOM 0 HB2 LYS A 22 -13.266 -0.818 -5.971 1.00 33.45 H new ATOM 0 HB3 LYS A 22 -13.839 0.407 -4.857 1.00 33.45 H new ATOM 0 HG2 LYS A 22 -15.401 1.199 -6.754 1.00 23.02 H new ATOM 0 HG3 LYS A 22 -14.962 -0.272 -7.599 1.00 23.02 H new ATOM 0 HD2 LYS A 22 -17.053 -0.674 -6.420 1.00 51.21 H new ATOM 0 HD3 LYS A 22 -15.802 -1.624 -5.644 1.00 51.21 H new ATOM 0 HE2 LYS A 22 -17.235 -0.555 -3.946 1.00 73.51 H new ATOM 0 HE3 LYS A 22 -15.600 0.065 -3.833 1.00 73.51 H new ATOM 0 HZ1 LYS A 22 -17.332 1.790 -3.686 1.00 53.24 H new ATOM 0 HZ2 LYS A 22 -16.249 2.055 -4.967 1.00 53.24 H new ATOM 0 HZ3 LYS A 22 -17.802 1.444 -5.281 1.00 53.24 H new ATOM 390 N VAL A 23 -10.706 -0.228 -6.685 1.00 2.54 N ATOM 391 CA VAL A 23 -9.436 -0.902 -6.320 1.00 73.31 C ATOM 392 C VAL A 23 -8.203 0.044 -6.421 1.00 50.12 C ATOM 393 O VAL A 23 -7.458 0.208 -5.454 1.00 23.40 O ATOM 394 CB VAL A 23 -9.234 -2.167 -7.242 1.00 64.44 C ATOM 395 CG1 VAL A 23 -7.874 -2.870 -6.970 1.00 34.44 C ATOM 396 CG2 VAL A 23 -10.412 -3.171 -7.089 1.00 64.21 C ATOM 0 H VAL A 23 -11.153 -0.646 -7.501 1.00 2.54 H new ATOM 0 HA VAL A 23 -9.510 -1.206 -5.276 1.00 73.31 H new ATOM 0 HB VAL A 23 -9.221 -1.811 -8.272 1.00 64.44 H new ATOM 0 HG11 VAL A 23 -7.774 -3.736 -7.625 1.00 34.44 H new ATOM 0 HG12 VAL A 23 -7.059 -2.173 -7.164 1.00 34.44 H new ATOM 0 HG13 VAL A 23 -7.834 -3.195 -5.930 1.00 34.44 H new ATOM 0 HG21 VAL A 23 -10.243 -4.031 -7.737 1.00 64.21 H new ATOM 0 HG22 VAL A 23 -10.474 -3.504 -6.053 1.00 64.21 H new ATOM 0 HG23 VAL A 23 -11.345 -2.683 -7.370 1.00 64.21 H new ATOM 406 N PHE A 24 -8.007 0.637 -7.609 1.00 73.21 N ATOM 407 CA PHE A 24 -6.935 1.626 -7.875 1.00 73.33 C ATOM 408 C PHE A 24 -7.058 2.853 -6.941 1.00 63.45 C ATOM 409 O PHE A 24 -6.104 3.214 -6.246 1.00 75.10 O ATOM 410 CB PHE A 24 -6.989 2.062 -9.370 1.00 44.10 C ATOM 411 CG PHE A 24 -6.075 3.235 -9.744 1.00 10.31 C ATOM 412 CD1 PHE A 24 -4.690 3.084 -9.761 1.00 20.34 C ATOM 413 CD2 PHE A 24 -6.603 4.486 -10.084 1.00 21.23 C ATOM 414 CE1 PHE A 24 -3.869 4.143 -10.107 1.00 41.42 C ATOM 415 CE2 PHE A 24 -5.779 5.539 -10.427 1.00 11.31 C ATOM 416 CZ PHE A 24 -4.414 5.367 -10.439 1.00 5.53 C ATOM 0 H PHE A 24 -8.590 0.446 -8.424 1.00 73.21 H new ATOM 0 HA PHE A 24 -5.971 1.159 -7.672 1.00 73.33 H new ATOM 0 HB2 PHE A 24 -6.726 1.206 -9.991 1.00 44.10 H new ATOM 0 HB3 PHE A 24 -8.016 2.331 -9.616 1.00 44.10 H new ATOM 0 HD1 PHE A 24 -4.253 2.131 -9.502 1.00 20.34 H new ATOM 0 HD2 PHE A 24 -7.673 4.630 -10.078 1.00 21.23 H new ATOM 0 HE1 PHE A 24 -2.797 4.011 -10.117 1.00 41.42 H new ATOM 0 HE2 PHE A 24 -6.205 6.497 -10.686 1.00 11.31 H new ATOM 0 HZ PHE A 24 -3.769 6.190 -10.708 1.00 5.53 H new ATOM 426 N ASP A 25 -8.255 3.462 -6.927 1.00 21.50 N ATOM 427 CA ASP A 25 -8.554 4.671 -6.123 1.00 2.50 C ATOM 428 C ASP A 25 -8.388 4.440 -4.597 1.00 3.33 C ATOM 429 O ASP A 25 -8.243 5.394 -3.841 1.00 70.15 O ATOM 430 CB ASP A 25 -9.989 5.163 -6.446 1.00 22.32 C ATOM 431 CG ASP A 25 -10.165 5.695 -7.886 1.00 1.54 C ATOM 432 OD1 ASP A 25 -9.646 5.070 -8.834 1.00 44.34 O ATOM 433 OD2 ASP A 25 -10.868 6.713 -8.081 1.00 24.10 O ATOM 0 H ASP A 25 -9.050 3.132 -7.474 1.00 21.50 H new ATOM 0 HA ASP A 25 -7.826 5.435 -6.397 1.00 2.50 H new ATOM 0 HB2 ASP A 25 -10.688 4.342 -6.286 1.00 22.32 H new ATOM 0 HB3 ASP A 25 -10.258 5.952 -5.743 1.00 22.32 H new ATOM 438 N ALA A 26 -8.410 3.171 -4.158 1.00 71.15 N ATOM 439 CA ALA A 26 -8.133 2.795 -2.753 1.00 74.23 C ATOM 440 C ALA A 26 -6.677 3.138 -2.334 1.00 14.25 C ATOM 441 O ALA A 26 -6.416 3.481 -1.178 1.00 11.10 O ATOM 442 CB ALA A 26 -8.419 1.309 -2.556 1.00 24.30 C ATOM 0 H ALA A 26 -8.619 2.376 -4.761 1.00 71.15 H new ATOM 0 HA ALA A 26 -8.791 3.379 -2.110 1.00 74.23 H new ATOM 0 HB1 ALA A 26 -8.215 1.033 -1.521 1.00 24.30 H new ATOM 0 HB2 ALA A 26 -9.465 1.106 -2.786 1.00 24.30 H new ATOM 0 HB3 ALA A 26 -7.782 0.725 -3.220 1.00 24.30 H new ATOM 448 N TYR A 27 -5.745 3.052 -3.299 1.00 61.03 N ATOM 449 CA TYR A 27 -4.320 3.412 -3.104 1.00 11.11 C ATOM 450 C TYR A 27 -4.080 4.904 -3.431 1.00 4.42 C ATOM 451 O TYR A 27 -3.101 5.506 -2.980 1.00 2.24 O ATOM 452 CB TYR A 27 -3.432 2.549 -4.040 1.00 31.24 C ATOM 453 CG TYR A 27 -3.556 1.028 -3.820 1.00 12.52 C ATOM 454 CD1 TYR A 27 -2.854 0.378 -2.797 1.00 34.41 C ATOM 455 CD2 TYR A 27 -4.373 0.241 -4.642 1.00 12.45 C ATOM 456 CE1 TYR A 27 -2.971 -0.993 -2.600 1.00 13.32 C ATOM 457 CE2 TYR A 27 -4.492 -1.126 -4.448 1.00 74.24 C ATOM 458 CZ TYR A 27 -3.785 -1.741 -3.431 1.00 41.33 C ATOM 459 OH TYR A 27 -3.902 -3.107 -3.240 1.00 43.44 O ATOM 0 H TYR A 27 -5.955 2.729 -4.244 1.00 61.03 H new ATOM 0 HA TYR A 27 -4.062 3.229 -2.061 1.00 11.11 H new ATOM 0 HB2 TYR A 27 -3.690 2.775 -5.074 1.00 31.24 H new ATOM 0 HB3 TYR A 27 -2.391 2.839 -3.901 1.00 31.24 H new ATOM 0 HD1 TYR A 27 -2.209 0.953 -2.149 1.00 34.41 H new ATOM 0 HD2 TYR A 27 -4.922 0.710 -5.445 1.00 12.45 H new ATOM 0 HE1 TYR A 27 -2.427 -1.473 -1.800 1.00 13.32 H new ATOM 0 HE2 TYR A 27 -5.135 -1.710 -5.090 1.00 74.24 H new ATOM 0 HH TYR A 27 -4.513 -3.480 -3.909 1.00 43.44 H new ATOM 469 N THR A 28 -4.998 5.477 -4.231 1.00 22.11 N ATOM 470 CA THR A 28 -4.798 6.771 -4.917 1.00 74.33 C ATOM 471 C THR A 28 -5.697 7.905 -4.336 1.00 25.13 C ATOM 472 O THR A 28 -5.585 9.066 -4.734 1.00 31.44 O ATOM 473 CB THR A 28 -5.063 6.585 -6.461 1.00 0.12 C ATOM 474 OG1 THR A 28 -4.446 5.367 -6.925 1.00 14.14 O ATOM 475 CG2 THR A 28 -4.487 7.722 -7.312 1.00 1.24 C ATOM 0 H THR A 28 -5.906 5.054 -4.422 1.00 22.11 H new ATOM 0 HA THR A 28 -3.767 7.083 -4.751 1.00 74.33 H new ATOM 0 HB THR A 28 -6.147 6.568 -6.574 1.00 0.12 H new ATOM 0 HG1 THR A 28 -5.015 4.603 -6.693 1.00 14.14 H new ATOM 0 HG21 THR A 28 -4.703 7.535 -8.364 1.00 1.24 H new ATOM 0 HG22 THR A 28 -4.940 8.667 -7.011 1.00 1.24 H new ATOM 0 HG23 THR A 28 -3.408 7.774 -7.167 1.00 1.24 H new ATOM 483 N LYS A 29 -6.603 7.569 -3.397 1.00 63.55 N ATOM 484 CA LYS A 29 -7.488 8.558 -2.714 1.00 24.34 C ATOM 485 C LYS A 29 -7.449 8.376 -1.178 1.00 73.20 C ATOM 486 O LYS A 29 -7.431 7.244 -0.681 1.00 52.25 O ATOM 487 CB LYS A 29 -8.936 8.451 -3.263 1.00 51.54 C ATOM 488 CG LYS A 29 -9.124 9.081 -4.661 1.00 24.11 C ATOM 489 CD LYS A 29 -10.543 8.871 -5.230 1.00 54.44 C ATOM 490 CE LYS A 29 -10.806 9.727 -6.482 1.00 43.10 C ATOM 491 NZ LYS A 29 -9.861 9.411 -7.583 1.00 54.25 N ATOM 0 H LYS A 29 -6.749 6.609 -3.085 1.00 63.55 H new ATOM 0 HA LYS A 29 -7.117 9.560 -2.928 1.00 24.34 H new ATOM 0 HB2 LYS A 29 -9.220 7.400 -3.308 1.00 51.54 H new ATOM 0 HB3 LYS A 29 -9.616 8.935 -2.563 1.00 51.54 H new ATOM 0 HG2 LYS A 29 -8.916 10.149 -4.603 1.00 24.11 H new ATOM 0 HG3 LYS A 29 -8.395 8.651 -5.348 1.00 24.11 H new ATOM 0 HD2 LYS A 29 -10.680 7.818 -5.478 1.00 54.44 H new ATOM 0 HD3 LYS A 29 -11.279 9.117 -4.464 1.00 54.44 H new ATOM 0 HE2 LYS A 29 -11.828 9.564 -6.824 1.00 43.10 H new ATOM 0 HE3 LYS A 29 -10.721 10.782 -6.223 1.00 43.10 H new ATOM 0 HZ1 LYS A 29 -10.052 10.034 -8.394 1.00 54.25 H new ATOM 0 HZ2 LYS A 29 -8.885 9.558 -7.256 1.00 54.25 H new ATOM 0 HZ3 LYS A 29 -9.983 8.419 -7.872 1.00 54.25 H new ATOM 505 N ARG A 30 -7.475 9.512 -0.440 1.00 43.01 N ATOM 506 CA ARG A 30 -7.213 9.543 1.022 1.00 13.34 C ATOM 507 C ARG A 30 -8.299 8.806 1.833 1.00 63.22 C ATOM 508 O ARG A 30 -7.976 7.931 2.640 1.00 44.34 O ATOM 509 CB ARG A 30 -6.995 11.035 1.522 1.00 1.02 C ATOM 510 CG ARG A 30 -8.031 11.636 2.522 1.00 42.44 C ATOM 511 CD ARG A 30 -7.776 11.253 3.990 1.00 51.33 C ATOM 512 NE ARG A 30 -8.903 11.596 4.870 1.00 12.44 N ATOM 513 CZ ARG A 30 -8.961 12.633 5.672 1.00 21.13 C ATOM 514 NH1 ARG A 30 -8.019 13.521 5.709 1.00 72.13 N ATOM 515 NH2 ARG A 30 -9.981 12.765 6.454 1.00 30.44 N ATOM 0 H ARG A 30 -7.677 10.429 -0.838 1.00 43.01 H new ATOM 0 HA ARG A 30 -6.288 8.995 1.201 1.00 13.34 H new ATOM 0 HB2 ARG A 30 -6.011 11.089 1.989 1.00 1.02 H new ATOM 0 HB3 ARG A 30 -6.967 11.680 0.644 1.00 1.02 H new ATOM 0 HG2 ARG A 30 -8.019 12.722 2.433 1.00 42.44 H new ATOM 0 HG3 ARG A 30 -9.030 11.304 2.238 1.00 42.44 H new ATOM 0 HD2 ARG A 30 -7.584 10.182 4.054 1.00 51.33 H new ATOM 0 HD3 ARG A 30 -6.878 11.760 4.343 1.00 51.33 H new ATOM 0 HE ARG A 30 -9.711 10.973 4.856 1.00 12.44 H new ATOM 0 HH11 ARG A 30 -7.204 13.425 5.104 1.00 72.13 H new ATOM 0 HH12 ARG A 30 -8.093 14.316 6.343 1.00 72.13 H new ATOM 0 HH21 ARG A 30 -10.726 12.069 6.442 1.00 30.44 H new ATOM 0 HH22 ARG A 30 -10.041 13.565 7.083 1.00 30.44 H new ATOM 529 N GLU A 31 -9.578 9.178 1.605 1.00 14.23 N ATOM 530 CA GLU A 31 -10.726 8.666 2.389 1.00 61.21 C ATOM 531 C GLU A 31 -10.826 7.129 2.323 1.00 4.24 C ATOM 532 O GLU A 31 -11.260 6.495 3.276 1.00 11.45 O ATOM 533 CB GLU A 31 -12.076 9.312 1.935 1.00 31.32 C ATOM 534 CG GLU A 31 -12.464 9.107 0.441 1.00 22.20 C ATOM 535 CD GLU A 31 -11.876 10.173 -0.511 1.00 42.04 C ATOM 536 OE1 GLU A 31 -10.716 10.032 -0.942 1.00 71.43 O ATOM 537 OE2 GLU A 31 -12.578 11.163 -0.818 1.00 4.41 O ATOM 0 H GLU A 31 -9.844 9.839 0.875 1.00 14.23 H new ATOM 0 HA GLU A 31 -10.542 8.952 3.425 1.00 61.21 H new ATOM 0 HB2 GLU A 31 -12.876 8.908 2.556 1.00 31.32 H new ATOM 0 HB3 GLU A 31 -12.028 10.383 2.133 1.00 31.32 H new ATOM 0 HG2 GLU A 31 -12.126 8.122 0.120 1.00 22.20 H new ATOM 0 HG3 GLU A 31 -13.550 9.116 0.354 1.00 22.20 H new ATOM 544 N LEU A 32 -10.369 6.555 1.198 1.00 32.53 N ATOM 545 CA LEU A 32 -10.346 5.101 0.978 1.00 62.32 C ATOM 546 C LEU A 32 -9.093 4.474 1.628 1.00 33.03 C ATOM 547 O LEU A 32 -9.187 3.429 2.270 1.00 34.22 O ATOM 548 CB LEU A 32 -10.369 4.824 -0.538 1.00 73.01 C ATOM 549 CG LEU A 32 -11.595 5.405 -1.311 1.00 1.54 C ATOM 550 CD1 LEU A 32 -11.439 5.195 -2.826 1.00 4.43 C ATOM 551 CD2 LEU A 32 -12.922 4.804 -0.791 1.00 14.32 C ATOM 0 H LEU A 32 -10.003 7.091 0.411 1.00 32.53 H new ATOM 0 HA LEU A 32 -11.222 4.649 1.442 1.00 62.32 H new ATOM 0 HB2 LEU A 32 -9.459 5.231 -0.978 1.00 73.01 H new ATOM 0 HB3 LEU A 32 -10.343 3.745 -0.693 1.00 73.01 H new ATOM 0 HG LEU A 32 -11.629 6.479 -1.126 1.00 1.54 H new ATOM 0 HD11 LEU A 32 -12.306 5.608 -3.342 1.00 4.43 H new ATOM 0 HD12 LEU A 32 -10.536 5.699 -3.172 1.00 4.43 H new ATOM 0 HD13 LEU A 32 -11.364 4.129 -3.040 1.00 4.43 H new ATOM 0 HD21 LEU A 32 -13.757 5.228 -1.349 1.00 14.32 H new ATOM 0 HD22 LEU A 32 -12.909 3.722 -0.925 1.00 14.32 H new ATOM 0 HD23 LEU A 32 -13.037 5.037 0.267 1.00 14.32 H new ATOM 563 N PHE A 33 -7.936 5.158 1.475 1.00 42.41 N ATOM 564 CA PHE A 33 -6.624 4.691 1.987 1.00 23.13 C ATOM 565 C PHE A 33 -6.665 4.421 3.515 1.00 12.12 C ATOM 566 O PHE A 33 -6.276 3.341 3.979 1.00 45.41 O ATOM 567 CB PHE A 33 -5.524 5.729 1.636 1.00 62.33 C ATOM 568 CG PHE A 33 -4.099 5.280 1.971 1.00 42.41 C ATOM 569 CD1 PHE A 33 -3.400 4.426 1.112 1.00 2.13 C ATOM 570 CD2 PHE A 33 -3.459 5.710 3.138 1.00 12.01 C ATOM 571 CE1 PHE A 33 -2.113 4.017 1.412 1.00 10.04 C ATOM 572 CE2 PHE A 33 -2.175 5.299 3.434 1.00 32.44 C ATOM 573 CZ PHE A 33 -1.501 4.454 2.571 1.00 0.33 C ATOM 0 H PHE A 33 -7.885 6.054 0.991 1.00 42.41 H new ATOM 0 HA PHE A 33 -6.387 3.743 1.503 1.00 23.13 H new ATOM 0 HB2 PHE A 33 -5.580 5.953 0.571 1.00 62.33 H new ATOM 0 HB3 PHE A 33 -5.734 6.657 2.168 1.00 62.33 H new ATOM 0 HD1 PHE A 33 -3.871 4.082 0.203 1.00 2.13 H new ATOM 0 HD2 PHE A 33 -3.976 6.372 3.816 1.00 12.01 H new ATOM 0 HE1 PHE A 33 -1.586 3.356 0.740 1.00 10.04 H new ATOM 0 HE2 PHE A 33 -1.696 5.638 4.341 1.00 32.44 H new ATOM 0 HZ PHE A 33 -0.496 4.136 2.803 1.00 0.33 H new ATOM 583 N GLU A 34 -7.168 5.405 4.282 1.00 12.45 N ATOM 584 CA GLU A 34 -7.307 5.282 5.760 1.00 73.12 C ATOM 585 C GLU A 34 -8.445 4.322 6.225 1.00 44.25 C ATOM 586 O GLU A 34 -8.588 4.088 7.431 1.00 74.32 O ATOM 587 CB GLU A 34 -7.451 6.683 6.433 1.00 65.33 C ATOM 588 CG GLU A 34 -8.476 7.650 5.793 1.00 42.14 C ATOM 589 CD GLU A 34 -8.691 8.940 6.607 1.00 13.40 C ATOM 590 OE1 GLU A 34 -7.697 9.532 7.080 1.00 53.41 O ATOM 591 OE2 GLU A 34 -9.852 9.373 6.776 1.00 22.20 O ATOM 0 H GLU A 34 -7.488 6.299 3.910 1.00 12.45 H new ATOM 0 HA GLU A 34 -6.379 4.818 6.095 1.00 73.12 H new ATOM 0 HB2 GLU A 34 -7.727 6.534 7.477 1.00 65.33 H new ATOM 0 HB3 GLU A 34 -6.474 7.167 6.427 1.00 65.33 H new ATOM 0 HG2 GLU A 34 -8.139 7.914 4.791 1.00 42.14 H new ATOM 0 HG3 GLU A 34 -9.430 7.135 5.683 1.00 42.14 H new ATOM 598 N GLN A 35 -9.238 3.760 5.286 1.00 61.43 N ATOM 599 CA GLN A 35 -10.266 2.732 5.619 1.00 12.22 C ATOM 600 C GLN A 35 -9.690 1.290 5.613 1.00 63.04 C ATOM 601 O GLN A 35 -10.290 0.391 6.216 1.00 4.44 O ATOM 602 CB GLN A 35 -11.487 2.831 4.657 1.00 34.52 C ATOM 603 CG GLN A 35 -12.373 4.069 4.886 1.00 4.43 C ATOM 604 CD GLN A 35 -13.604 4.121 3.972 1.00 14.45 C ATOM 605 OE1 GLN A 35 -13.461 4.692 2.790 1.00 51.33 O flip ATOM 606 NE2 GLN A 35 -14.673 3.635 4.319 1.00 0.10 N flip ATOM 0 H GLN A 35 -9.191 3.995 4.295 1.00 61.43 H new ATOM 0 HA GLN A 35 -10.598 2.944 6.635 1.00 12.22 H new ATOM 0 HB2 GLN A 35 -11.125 2.842 3.629 1.00 34.52 H new ATOM 0 HB3 GLN A 35 -12.098 1.935 4.770 1.00 34.52 H new ATOM 0 HG2 GLN A 35 -12.702 4.083 5.925 1.00 4.43 H new ATOM 0 HG3 GLN A 35 -11.776 4.967 4.728 1.00 4.43 H new ATOM 0 HE21 GLN A 35 -14.761 3.199 5.237 1.00 0.10 H new ATOM 0 HE22 GLN A 35 -15.476 3.666 3.690 1.00 0.10 H new ATOM 615 N TRP A 36 -8.531 1.059 4.947 1.00 34.20 N ATOM 616 CA TRP A 36 -7.935 -0.305 4.844 1.00 62.40 C ATOM 617 C TRP A 36 -6.525 -0.406 5.490 1.00 52.45 C ATOM 618 O TRP A 36 -6.214 -1.413 6.141 1.00 2.34 O ATOM 619 CB TRP A 36 -7.895 -0.785 3.367 1.00 25.24 C ATOM 620 CG TRP A 36 -6.954 -0.028 2.451 1.00 42.14 C ATOM 621 CD1 TRP A 36 -7.228 1.093 1.727 1.00 12.14 C ATOM 622 CD2 TRP A 36 -5.589 -0.361 2.146 1.00 41.51 C ATOM 623 NE1 TRP A 36 -6.121 1.491 1.027 1.00 31.35 N ATOM 624 CE2 TRP A 36 -5.103 0.620 1.266 1.00 73.23 C ATOM 625 CE3 TRP A 36 -4.736 -1.388 2.547 1.00 20.43 C ATOM 626 CZ2 TRP A 36 -3.799 0.611 0.788 1.00 15.22 C ATOM 627 CZ3 TRP A 36 -3.441 -1.397 2.073 1.00 34.43 C ATOM 628 CH2 TRP A 36 -2.984 -0.406 1.201 1.00 13.50 C ATOM 0 H TRP A 36 -7.993 1.787 4.477 1.00 34.20 H new ATOM 0 HA TRP A 36 -8.588 -0.966 5.414 1.00 62.40 H new ATOM 0 HB2 TRP A 36 -7.614 -1.838 3.355 1.00 25.24 H new ATOM 0 HB3 TRP A 36 -8.902 -0.719 2.956 1.00 25.24 H new ATOM 0 HD1 TRP A 36 -8.183 1.596 1.708 1.00 12.14 H new ATOM 0 HE1 TRP A 36 -6.068 2.311 0.422 1.00 31.35 H new ATOM 0 HE3 TRP A 36 -5.083 -2.162 3.216 1.00 20.43 H new ATOM 0 HZ2 TRP A 36 -3.443 1.378 0.116 1.00 15.22 H new ATOM 0 HZ3 TRP A 36 -2.769 -2.184 2.381 1.00 34.43 H new ATOM 0 HH2 TRP A 36 -1.965 -0.444 0.845 1.00 13.50 H new ATOM 639 N PHE A 37 -5.677 0.629 5.295 1.00 10.10 N ATOM 640 CA PHE A 37 -4.255 0.607 5.736 1.00 1.23 C ATOM 641 C PHE A 37 -4.135 0.851 7.270 1.00 54.22 C ATOM 642 O PHE A 37 -3.805 1.950 7.715 1.00 74.43 O ATOM 643 CB PHE A 37 -3.419 1.645 4.920 1.00 34.20 C ATOM 644 CG PHE A 37 -1.897 1.536 5.129 1.00 62.35 C ATOM 645 CD1 PHE A 37 -1.143 0.597 4.419 1.00 53.40 C ATOM 646 CD2 PHE A 37 -1.222 2.357 6.044 1.00 13.51 C ATOM 647 CE1 PHE A 37 0.224 0.483 4.614 1.00 43.33 C ATOM 648 CE2 PHE A 37 0.142 2.238 6.235 1.00 31.33 C ATOM 649 CZ PHE A 37 0.864 1.304 5.523 1.00 13.43 C ATOM 0 H PHE A 37 -5.950 1.496 4.833 1.00 10.10 H new ATOM 0 HA PHE A 37 -3.848 -0.385 5.539 1.00 1.23 H new ATOM 0 HB2 PHE A 37 -3.639 1.518 3.860 1.00 34.20 H new ATOM 0 HB3 PHE A 37 -3.741 2.650 5.194 1.00 34.20 H new ATOM 0 HD1 PHE A 37 -1.634 -0.050 3.707 1.00 53.40 H new ATOM 0 HD2 PHE A 37 -1.776 3.093 6.608 1.00 13.51 H new ATOM 0 HE1 PHE A 37 0.790 -0.248 4.055 1.00 43.33 H new ATOM 0 HE2 PHE A 37 0.644 2.879 6.945 1.00 31.33 H new ATOM 0 HZ PHE A 37 1.929 1.214 5.676 1.00 13.43 H new ATOM 659 N HIS A 38 -4.442 -0.184 8.070 1.00 3.44 N ATOM 660 CA HIS A 38 -4.391 -0.115 9.551 1.00 31.14 C ATOM 661 C HIS A 38 -4.223 -1.536 10.161 1.00 70.13 C ATOM 662 O HIS A 38 -4.896 -2.480 9.721 1.00 73.02 O ATOM 663 CB HIS A 38 -5.653 0.598 10.127 1.00 25.50 C ATOM 664 CG HIS A 38 -6.972 0.012 9.680 1.00 70.34 C ATOM 665 ND1 HIS A 38 -7.521 -1.124 10.237 1.00 41.12 N ATOM 666 CD2 HIS A 38 -7.845 0.409 8.717 1.00 0.42 C ATOM 667 CE1 HIS A 38 -8.664 -1.398 9.643 1.00 51.31 C ATOM 668 NE2 HIS A 38 -8.884 -0.489 8.720 1.00 4.21 N ATOM 0 H HIS A 38 -4.733 -1.094 7.714 1.00 3.44 H new ATOM 0 HA HIS A 38 -3.521 0.480 9.831 1.00 31.14 H new ATOM 0 HB2 HIS A 38 -5.607 0.564 11.215 1.00 25.50 H new ATOM 0 HB3 HIS A 38 -5.622 1.649 9.839 1.00 25.50 H new ATOM 0 HD2 HIS A 38 -7.741 1.268 8.071 1.00 0.42 H new ATOM 0 HE1 HIS A 38 -9.312 -2.230 9.876 1.00 51.31 H new ATOM 0 HE2 HIS A 38 -9.696 -0.456 8.104 1.00 4.21 H new ATOM 677 N PRO A 39 -3.309 -1.712 11.177 1.00 12.34 N ATOM 678 CA PRO A 39 -3.057 -3.034 11.827 1.00 15.34 C ATOM 679 C PRO A 39 -4.144 -3.432 12.883 1.00 22.02 C ATOM 680 O PRO A 39 -5.298 -2.994 12.793 1.00 10.14 O ATOM 681 CB PRO A 39 -1.653 -2.819 12.458 1.00 71.11 C ATOM 682 CG PRO A 39 -1.617 -1.361 12.813 1.00 32.45 C ATOM 683 CD PRO A 39 -2.429 -0.647 11.746 1.00 75.44 C ATOM 0 HA PRO A 39 -3.101 -3.868 11.127 1.00 15.34 H new ATOM 0 HB2 PRO A 39 -1.514 -3.445 13.339 1.00 71.11 H new ATOM 0 HB3 PRO A 39 -0.859 -3.076 11.756 1.00 71.11 H new ATOM 0 HG2 PRO A 39 -2.039 -1.191 13.803 1.00 32.45 H new ATOM 0 HG3 PRO A 39 -0.592 -0.991 12.836 1.00 32.45 H new ATOM 0 HD2 PRO A 39 -3.015 0.168 12.171 1.00 75.44 H new ATOM 0 HD3 PRO A 39 -1.786 -0.212 10.981 1.00 75.44 H new ATOM 691 N GLN A 40 -3.758 -4.286 13.862 1.00 72.21 N ATOM 692 CA GLN A 40 -4.685 -4.890 14.859 1.00 63.52 C ATOM 693 C GLN A 40 -5.401 -3.829 15.754 1.00 51.24 C ATOM 694 O GLN A 40 -6.552 -3.459 15.495 1.00 73.30 O ATOM 695 CB GLN A 40 -3.900 -5.909 15.745 1.00 54.21 C ATOM 696 CG GLN A 40 -3.214 -7.064 14.979 1.00 62.45 C ATOM 697 CD GLN A 40 -4.205 -8.023 14.314 1.00 53.14 C ATOM 698 OE1 GLN A 40 -4.598 -7.846 13.162 1.00 13.24 O ATOM 699 NE2 GLN A 40 -4.619 -9.049 15.035 1.00 13.22 N ATOM 0 H GLN A 40 -2.789 -4.579 13.986 1.00 72.21 H new ATOM 0 HA GLN A 40 -5.472 -5.400 14.303 1.00 63.52 H new ATOM 0 HB2 GLN A 40 -3.140 -5.366 16.306 1.00 54.21 H new ATOM 0 HB3 GLN A 40 -4.589 -6.337 16.473 1.00 54.21 H new ATOM 0 HG2 GLN A 40 -2.557 -6.645 14.217 1.00 62.45 H new ATOM 0 HG3 GLN A 40 -2.584 -7.625 15.669 1.00 62.45 H new ATOM 0 HE21 GLN A 40 -4.278 -9.173 15.988 1.00 13.22 H new ATOM 0 HE22 GLN A 40 -5.280 -9.717 14.639 1.00 13.22 H new ATOM 708 N ASP A 41 -4.697 -3.337 16.788 1.00 70.14 N ATOM 709 CA ASP A 41 -5.250 -2.392 17.789 1.00 72.41 C ATOM 710 C ASP A 41 -5.284 -0.942 17.255 1.00 23.02 C ATOM 711 O ASP A 41 -6.141 -0.148 17.652 1.00 23.33 O ATOM 712 CB ASP A 41 -4.385 -2.445 19.071 1.00 74.04 C ATOM 713 CG ASP A 41 -4.260 -3.860 19.651 1.00 40.23 C ATOM 714 OD1 ASP A 41 -3.410 -4.633 19.161 1.00 10.05 O ATOM 715 OD2 ASP A 41 -5.011 -4.211 20.584 1.00 43.34 O ATOM 0 H ASP A 41 -3.722 -3.582 16.959 1.00 70.14 H new ATOM 0 HA ASP A 41 -6.275 -2.693 18.005 1.00 72.41 H new ATOM 0 HB2 ASP A 41 -3.390 -2.061 18.847 1.00 74.04 H new ATOM 0 HB3 ASP A 41 -4.819 -1.787 19.823 1.00 74.04 H new ATOM 720 N ALA A 42 -4.347 -0.617 16.353 1.00 53.20 N ATOM 721 CA ALA A 42 -4.101 0.765 15.906 1.00 32.44 C ATOM 722 C ALA A 42 -4.945 1.166 14.673 1.00 35.25 C ATOM 723 O ALA A 42 -5.120 0.382 13.735 1.00 23.03 O ATOM 724 CB ALA A 42 -2.611 0.939 15.602 1.00 73.14 C ATOM 0 H ALA A 42 -3.737 -1.305 15.911 1.00 53.20 H new ATOM 0 HA ALA A 42 -4.407 1.427 16.716 1.00 32.44 H new ATOM 0 HB1 ALA A 42 -2.424 1.960 15.271 1.00 73.14 H new ATOM 0 HB2 ALA A 42 -2.030 0.737 16.502 1.00 73.14 H new ATOM 0 HB3 ALA A 42 -2.316 0.243 14.816 1.00 73.14 H new ATOM 730 N SER A 43 -5.454 2.405 14.712 1.00 3.15 N ATOM 731 CA SER A 43 -6.127 3.073 13.574 1.00 14.53 C ATOM 732 C SER A 43 -5.103 3.893 12.751 1.00 31.34 C ATOM 733 O SER A 43 -3.898 3.846 13.022 1.00 53.02 O ATOM 734 CB SER A 43 -7.257 3.993 14.104 1.00 33.04 C ATOM 735 OG SER A 43 -8.209 3.251 14.850 1.00 42.21 O ATOM 0 H SER A 43 -5.412 2.988 15.548 1.00 3.15 H new ATOM 0 HA SER A 43 -6.563 2.316 12.922 1.00 14.53 H new ATOM 0 HB2 SER A 43 -6.830 4.776 14.730 1.00 33.04 H new ATOM 0 HB3 SER A 43 -7.751 4.488 13.267 1.00 33.04 H new ATOM 0 HG SER A 43 -8.911 3.853 15.175 1.00 42.21 H new ATOM 741 N VAL A 44 -5.582 4.612 11.723 1.00 51.05 N ATOM 742 CA VAL A 44 -4.741 5.510 10.893 1.00 12.05 C ATOM 743 C VAL A 44 -5.481 6.839 10.576 1.00 14.43 C ATOM 744 O VAL A 44 -6.699 6.855 10.348 1.00 51.02 O ATOM 745 CB VAL A 44 -4.294 4.793 9.558 1.00 71.52 C ATOM 746 CG1 VAL A 44 -5.514 4.324 8.732 1.00 25.33 C ATOM 747 CG2 VAL A 44 -3.331 5.672 8.701 1.00 21.34 C ATOM 0 H VAL A 44 -6.561 4.592 11.439 1.00 51.05 H new ATOM 0 HA VAL A 44 -3.847 5.749 11.469 1.00 12.05 H new ATOM 0 HB VAL A 44 -3.730 3.908 9.854 1.00 71.52 H new ATOM 0 HG11 VAL A 44 -5.170 3.835 7.821 1.00 25.33 H new ATOM 0 HG12 VAL A 44 -6.103 3.621 9.321 1.00 25.33 H new ATOM 0 HG13 VAL A 44 -6.130 5.185 8.472 1.00 25.33 H new ATOM 0 HG21 VAL A 44 -3.055 5.132 7.795 1.00 21.34 H new ATOM 0 HG22 VAL A 44 -3.831 6.602 8.431 1.00 21.34 H new ATOM 0 HG23 VAL A 44 -2.434 5.897 9.277 1.00 21.34 H new ATOM 757 N THR A 45 -4.729 7.953 10.589 1.00 3.43 N ATOM 758 CA THR A 45 -5.227 9.288 10.195 1.00 51.13 C ATOM 759 C THR A 45 -4.294 9.891 9.127 1.00 15.30 C ATOM 760 O THR A 45 -3.090 10.036 9.360 1.00 0.14 O ATOM 761 CB THR A 45 -5.302 10.260 11.423 1.00 50.14 C ATOM 762 OG1 THR A 45 -6.120 9.698 12.465 1.00 41.44 O ATOM 763 CG2 THR A 45 -5.861 11.647 11.040 1.00 21.31 C ATOM 0 H THR A 45 -3.750 7.955 10.875 1.00 3.43 H new ATOM 0 HA THR A 45 -6.233 9.166 9.794 1.00 51.13 H new ATOM 0 HB THR A 45 -4.280 10.390 11.779 1.00 50.14 H new ATOM 0 HG1 THR A 45 -6.154 10.317 13.224 1.00 41.44 H new ATOM 0 HG21 THR A 45 -5.893 12.283 11.924 1.00 21.31 H new ATOM 0 HG22 THR A 45 -5.218 12.103 10.288 1.00 21.31 H new ATOM 0 HG23 THR A 45 -6.868 11.535 10.637 1.00 21.31 H new ATOM 771 N VAL A 46 -4.848 10.221 7.951 1.00 45.00 N ATOM 772 CA VAL A 46 -4.105 10.905 6.878 1.00 74.20 C ATOM 773 C VAL A 46 -4.280 12.439 7.008 1.00 71.15 C ATOM 774 O VAL A 46 -5.393 12.956 6.879 1.00 41.02 O ATOM 775 CB VAL A 46 -4.563 10.422 5.454 1.00 52.15 C ATOM 776 CG1 VAL A 46 -3.704 11.070 4.346 1.00 50.31 C ATOM 777 CG2 VAL A 46 -4.537 8.874 5.335 1.00 21.32 C ATOM 0 H VAL A 46 -5.820 10.023 7.716 1.00 45.00 H new ATOM 0 HA VAL A 46 -3.051 10.651 6.987 1.00 74.20 H new ATOM 0 HB VAL A 46 -5.596 10.745 5.320 1.00 52.15 H new ATOM 0 HG11 VAL A 46 -4.042 10.719 3.371 1.00 50.31 H new ATOM 0 HG12 VAL A 46 -3.804 12.154 4.396 1.00 50.31 H new ATOM 0 HG13 VAL A 46 -2.659 10.795 4.488 1.00 50.31 H new ATOM 0 HG21 VAL A 46 -4.860 8.580 4.336 1.00 21.32 H new ATOM 0 HG22 VAL A 46 -3.524 8.513 5.509 1.00 21.32 H new ATOM 0 HG23 VAL A 46 -5.209 8.441 6.076 1.00 21.32 H new ATOM 787 N TYR A 47 -3.173 13.149 7.279 1.00 32.12 N ATOM 788 CA TYR A 47 -3.164 14.622 7.480 1.00 13.23 C ATOM 789 C TYR A 47 -2.914 15.386 6.153 1.00 62.42 C ATOM 790 O TYR A 47 -3.326 16.540 6.000 1.00 12.51 O ATOM 791 CB TYR A 47 -2.079 14.981 8.526 1.00 1.24 C ATOM 792 CG TYR A 47 -2.312 14.353 9.913 1.00 32.21 C ATOM 793 CD1 TYR A 47 -1.800 13.090 10.236 1.00 12.23 C ATOM 794 CD2 TYR A 47 -3.061 15.013 10.896 1.00 73.30 C ATOM 795 CE1 TYR A 47 -2.022 12.522 11.478 1.00 74.12 C ATOM 796 CE2 TYR A 47 -3.280 14.447 12.140 1.00 61.14 C ATOM 797 CZ TYR A 47 -2.762 13.202 12.425 1.00 21.22 C ATOM 798 OH TYR A 47 -2.992 12.631 13.660 1.00 53.31 O ATOM 0 H TYR A 47 -2.250 12.723 7.367 1.00 32.12 H new ATOM 0 HA TYR A 47 -4.146 14.928 7.842 1.00 13.23 H new ATOM 0 HB2 TYR A 47 -1.107 14.659 8.151 1.00 1.24 H new ATOM 0 HB3 TYR A 47 -2.036 16.065 8.632 1.00 1.24 H new ATOM 0 HD1 TYR A 47 -1.221 12.549 9.502 1.00 12.23 H new ATOM 0 HD2 TYR A 47 -3.477 15.986 10.678 1.00 73.30 H new ATOM 0 HE1 TYR A 47 -1.617 11.547 11.707 1.00 74.12 H new ATOM 0 HE2 TYR A 47 -3.854 14.979 12.884 1.00 61.14 H new ATOM 0 HH TYR A 47 -2.706 11.694 13.645 1.00 53.31 H new ATOM 808 N ASP A 48 -2.239 14.718 5.208 1.00 2.53 N ATOM 809 CA ASP A 48 -1.890 15.274 3.883 1.00 3.31 C ATOM 810 C ASP A 48 -1.946 14.149 2.829 1.00 74.11 C ATOM 811 O ASP A 48 -1.478 13.039 3.088 1.00 72.25 O ATOM 812 CB ASP A 48 -0.475 15.911 3.939 1.00 4.53 C ATOM 813 CG ASP A 48 0.003 16.457 2.582 1.00 2.40 C ATOM 814 OD1 ASP A 48 -0.290 17.628 2.259 1.00 71.33 O ATOM 815 OD2 ASP A 48 0.653 15.706 1.821 1.00 62.22 O ATOM 0 H ASP A 48 -1.913 13.761 5.340 1.00 2.53 H new ATOM 0 HA ASP A 48 -2.603 16.050 3.605 1.00 3.31 H new ATOM 0 HB2 ASP A 48 -0.478 16.722 4.668 1.00 4.53 H new ATOM 0 HB3 ASP A 48 0.237 15.166 4.294 1.00 4.53 H new ATOM 820 N PHE A 49 -2.494 14.441 1.636 1.00 51.31 N ATOM 821 CA PHE A 49 -2.599 13.431 0.563 1.00 74.40 C ATOM 822 C PHE A 49 -2.665 14.099 -0.828 1.00 22.33 C ATOM 823 O PHE A 49 -3.493 14.986 -1.060 1.00 44.13 O ATOM 824 CB PHE A 49 -3.851 12.533 0.785 1.00 30.11 C ATOM 825 CG PHE A 49 -3.789 11.144 0.129 1.00 65.05 C ATOM 826 CD1 PHE A 49 -4.073 10.969 -1.221 1.00 13.30 C ATOM 827 CD2 PHE A 49 -3.477 10.006 0.884 1.00 13.42 C ATOM 828 CE1 PHE A 49 -4.042 9.714 -1.791 1.00 73.41 C ATOM 829 CE2 PHE A 49 -3.452 8.753 0.310 1.00 10.41 C ATOM 830 CZ PHE A 49 -3.732 8.607 -1.029 1.00 72.11 C ATOM 0 H PHE A 49 -2.868 15.358 1.390 1.00 51.31 H new ATOM 0 HA PHE A 49 -1.704 12.809 0.600 1.00 74.40 H new ATOM 0 HB2 PHE A 49 -3.999 12.404 1.857 1.00 30.11 H new ATOM 0 HB3 PHE A 49 -4.726 13.058 0.403 1.00 30.11 H new ATOM 0 HD1 PHE A 49 -4.321 11.826 -1.830 1.00 13.30 H new ATOM 0 HD2 PHE A 49 -3.252 10.112 1.935 1.00 13.42 H new ATOM 0 HE1 PHE A 49 -4.262 9.597 -2.842 1.00 73.41 H new ATOM 0 HE2 PHE A 49 -3.213 7.888 0.910 1.00 10.41 H new ATOM 0 HZ PHE A 49 -3.709 7.627 -1.483 1.00 72.11 H new ATOM 840 N ASN A 50 -1.782 13.662 -1.739 1.00 52.21 N ATOM 841 CA ASN A 50 -1.846 14.011 -3.173 1.00 71.21 C ATOM 842 C ASN A 50 -1.213 12.862 -3.989 1.00 42.14 C ATOM 843 O ASN A 50 0.013 12.730 -4.047 1.00 64.11 O ATOM 844 CB ASN A 50 -1.126 15.368 -3.432 1.00 21.33 C ATOM 845 CG ASN A 50 -1.237 15.865 -4.880 1.00 45.53 C ATOM 846 OD1 ASN A 50 -2.207 16.510 -5.254 1.00 14.32 O ATOM 847 ND2 ASN A 50 -0.233 15.598 -5.695 1.00 14.03 N ATOM 0 H ASN A 50 -0.998 13.053 -1.504 1.00 52.21 H new ATOM 0 HA ASN A 50 -2.883 14.134 -3.486 1.00 71.21 H new ATOM 0 HB2 ASN A 50 -1.544 16.123 -2.766 1.00 21.33 H new ATOM 0 HB3 ASN A 50 -0.072 15.264 -3.174 1.00 21.33 H new ATOM 0 HD21 ASN A 50 -0.256 15.931 -6.659 1.00 14.03 H new ATOM 0 HD22 ASN A 50 0.565 15.058 -5.361 1.00 14.03 H new ATOM 854 N ALA A 51 -2.057 12.022 -4.609 1.00 41.43 N ATOM 855 CA ALA A 51 -1.604 10.826 -5.352 1.00 14.13 C ATOM 856 C ALA A 51 -1.687 11.043 -6.871 1.00 0.02 C ATOM 857 O ALA A 51 -2.781 11.083 -7.451 1.00 31.54 O ATOM 858 CB ALA A 51 -2.421 9.609 -4.928 1.00 14.14 C ATOM 0 H ALA A 51 -3.069 12.148 -4.612 1.00 41.43 H new ATOM 0 HA ALA A 51 -0.557 10.648 -5.108 1.00 14.13 H new ATOM 0 HB1 ALA A 51 -2.081 8.732 -5.480 1.00 14.14 H new ATOM 0 HB2 ALA A 51 -2.291 9.438 -3.859 1.00 14.14 H new ATOM 0 HB3 ALA A 51 -3.475 9.786 -5.142 1.00 14.14 H new ATOM 864 N THR A 52 -0.514 11.192 -7.499 1.00 11.41 N ATOM 865 CA THR A 52 -0.386 11.440 -8.949 1.00 15.25 C ATOM 866 C THR A 52 1.062 11.163 -9.413 1.00 25.41 C ATOM 867 O THR A 52 1.936 10.853 -8.591 1.00 63.00 O ATOM 868 CB THR A 52 -0.799 12.919 -9.316 1.00 13.53 C ATOM 869 OG1 THR A 52 -0.775 13.116 -10.743 1.00 11.22 O ATOM 870 CG2 THR A 52 0.113 13.962 -8.643 1.00 11.31 C ATOM 0 H THR A 52 0.383 11.144 -7.015 1.00 11.41 H new ATOM 0 HA THR A 52 -1.064 10.761 -9.466 1.00 15.25 H new ATOM 0 HB THR A 52 -1.813 13.062 -8.942 1.00 13.53 H new ATOM 0 HG1 THR A 52 -1.035 14.038 -10.950 1.00 11.22 H new ATOM 0 HG21 THR A 52 -0.210 14.964 -8.925 1.00 11.31 H new ATOM 0 HG22 THR A 52 0.053 13.853 -7.560 1.00 11.31 H new ATOM 0 HG23 THR A 52 1.142 13.808 -8.967 1.00 11.31 H new ATOM 878 N LYS A 53 1.309 11.254 -10.729 1.00 73.50 N ATOM 879 CA LYS A 53 2.667 11.144 -11.292 1.00 61.13 C ATOM 880 C LYS A 53 3.490 12.403 -10.917 1.00 44.13 C ATOM 881 O LYS A 53 3.406 13.447 -11.575 1.00 11.34 O ATOM 882 CB LYS A 53 2.575 10.911 -12.823 1.00 61.51 C ATOM 883 CG LYS A 53 3.920 10.616 -13.529 1.00 31.44 C ATOM 884 CD LYS A 53 3.726 9.916 -14.898 1.00 72.20 C ATOM 885 CE LYS A 53 2.842 10.718 -15.876 1.00 23.43 C ATOM 886 NZ LYS A 53 2.643 10.006 -17.160 1.00 50.32 N ATOM 0 H LYS A 53 0.582 11.404 -11.428 1.00 73.50 H new ATOM 0 HA LYS A 53 3.190 10.286 -10.869 1.00 61.13 H new ATOM 0 HB2 LYS A 53 1.897 10.078 -13.007 1.00 61.51 H new ATOM 0 HB3 LYS A 53 2.128 11.793 -13.282 1.00 61.51 H new ATOM 0 HG2 LYS A 53 4.463 11.550 -13.675 1.00 31.44 H new ATOM 0 HG3 LYS A 53 4.535 9.986 -12.886 1.00 31.44 H new ATOM 0 HD2 LYS A 53 4.702 9.750 -15.354 1.00 72.20 H new ATOM 0 HD3 LYS A 53 3.279 8.935 -14.736 1.00 72.20 H new ATOM 0 HE2 LYS A 53 1.873 10.910 -15.414 1.00 23.43 H new ATOM 0 HE3 LYS A 53 3.301 11.688 -16.067 1.00 23.43 H new ATOM 0 HZ1 LYS A 53 1.824 10.410 -17.658 1.00 50.32 H new ATOM 0 HZ2 LYS A 53 3.493 10.111 -17.750 1.00 50.32 H new ATOM 0 HZ3 LYS A 53 2.472 8.997 -16.975 1.00 50.32 H new ATOM 900 N GLY A 54 4.256 12.282 -9.814 1.00 71.54 N ATOM 901 CA GLY A 54 4.907 13.429 -9.158 1.00 4.34 C ATOM 902 C GLY A 54 4.066 14.007 -8.005 1.00 33.03 C ATOM 903 O GLY A 54 3.881 15.225 -7.903 1.00 42.13 O ATOM 0 H GLY A 54 4.439 11.389 -9.356 1.00 71.54 H new ATOM 0 HA2 GLY A 54 5.879 13.120 -8.774 1.00 4.34 H new ATOM 0 HA3 GLY A 54 5.090 14.210 -9.896 1.00 4.34 H new ATOM 907 N GLY A 55 3.529 13.109 -7.151 1.00 2.24 N ATOM 908 CA GLY A 55 2.763 13.485 -5.943 1.00 44.13 C ATOM 909 C GLY A 55 3.414 13.040 -4.625 1.00 0.04 C ATOM 910 O GLY A 55 4.510 12.473 -4.623 1.00 22.13 O ATOM 0 H GLY A 55 3.615 12.101 -7.280 1.00 2.24 H new ATOM 0 HA2 GLY A 55 2.638 14.568 -5.927 1.00 44.13 H new ATOM 0 HA3 GLY A 55 1.766 13.050 -6.008 1.00 44.13 H new ATOM 914 N SER A 56 2.709 13.291 -3.494 1.00 42.55 N ATOM 915 CA SER A 56 3.206 12.982 -2.125 1.00 0.43 C ATOM 916 C SER A 56 2.051 12.967 -1.093 1.00 31.52 C ATOM 917 O SER A 56 1.046 13.662 -1.274 1.00 44.43 O ATOM 918 CB SER A 56 4.271 14.021 -1.704 1.00 44.33 C ATOM 919 OG SER A 56 3.753 15.339 -1.668 1.00 63.13 O ATOM 0 H SER A 56 1.780 13.713 -3.503 1.00 42.55 H new ATOM 0 HA SER A 56 3.653 11.988 -2.147 1.00 0.43 H new ATOM 0 HB2 SER A 56 4.661 13.760 -0.720 1.00 44.33 H new ATOM 0 HB3 SER A 56 5.109 13.981 -2.400 1.00 44.33 H new ATOM 0 HG SER A 56 4.460 15.961 -1.396 1.00 63.13 H new ATOM 925 N ALA A 57 2.210 12.195 0.007 1.00 11.24 N ATOM 926 CA ALA A 57 1.144 12.024 1.036 1.00 72.23 C ATOM 927 C ALA A 57 1.721 11.716 2.440 1.00 44.43 C ATOM 928 O ALA A 57 2.468 10.748 2.606 1.00 30.41 O ATOM 929 CB ALA A 57 0.177 10.904 0.607 1.00 65.03 C ATOM 0 H ALA A 57 3.065 11.678 0.210 1.00 11.24 H new ATOM 0 HA ALA A 57 0.608 12.970 1.108 1.00 72.23 H new ATOM 0 HB1 ALA A 57 -0.599 10.784 1.363 1.00 65.03 H new ATOM 0 HB2 ALA A 57 -0.282 11.165 -0.346 1.00 65.03 H new ATOM 0 HB3 ALA A 57 0.727 9.969 0.501 1.00 65.03 H new ATOM 935 N PHE A 58 1.338 12.527 3.451 1.00 52.14 N ATOM 936 CA PHE A 58 1.735 12.320 4.871 1.00 41.43 C ATOM 937 C PHE A 58 0.548 11.762 5.703 1.00 72.01 C ATOM 938 O PHE A 58 -0.564 12.297 5.663 1.00 32.54 O ATOM 939 CB PHE A 58 2.254 13.652 5.491 1.00 71.21 C ATOM 940 CG PHE A 58 2.502 13.604 7.010 1.00 23.13 C ATOM 941 CD1 PHE A 58 3.585 12.901 7.542 1.00 15.24 C ATOM 942 CD2 PHE A 58 1.635 14.241 7.904 1.00 32.13 C ATOM 943 CE1 PHE A 58 3.802 12.848 8.906 1.00 53.03 C ATOM 944 CE2 PHE A 58 1.854 14.187 9.267 1.00 44.04 C ATOM 945 CZ PHE A 58 2.932 13.486 9.767 1.00 31.41 C ATOM 0 H PHE A 58 0.745 13.345 3.311 1.00 52.14 H new ATOM 0 HA PHE A 58 2.541 11.587 4.894 1.00 41.43 H new ATOM 0 HB2 PHE A 58 3.183 13.930 4.994 1.00 71.21 H new ATOM 0 HB3 PHE A 58 1.532 14.440 5.280 1.00 71.21 H new ATOM 0 HD1 PHE A 58 4.265 12.390 6.876 1.00 15.24 H new ATOM 0 HD2 PHE A 58 0.782 14.783 7.523 1.00 32.13 H new ATOM 0 HE1 PHE A 58 4.651 12.308 9.298 1.00 53.03 H new ATOM 0 HE2 PHE A 58 1.180 14.694 9.942 1.00 44.04 H new ATOM 0 HZ PHE A 58 3.095 13.436 10.833 1.00 31.41 H new ATOM 955 N TYR A 59 0.814 10.712 6.497 1.00 34.13 N ATOM 956 CA TYR A 59 -0.192 10.082 7.382 1.00 51.14 C ATOM 957 C TYR A 59 0.466 9.523 8.664 1.00 74.12 C ATOM 958 O TYR A 59 1.683 9.647 8.852 1.00 34.01 O ATOM 959 CB TYR A 59 -0.991 8.989 6.609 1.00 10.24 C ATOM 960 CG TYR A 59 -0.153 7.889 5.925 1.00 22.02 C ATOM 961 CD1 TYR A 59 0.404 8.084 4.648 1.00 14.22 C ATOM 962 CD2 TYR A 59 0.071 6.656 6.547 1.00 44.40 C ATOM 963 CE1 TYR A 59 1.146 7.094 4.031 1.00 2.11 C ATOM 964 CE2 TYR A 59 0.810 5.668 5.929 1.00 1.32 C ATOM 965 CZ TYR A 59 1.346 5.887 4.672 1.00 10.24 C ATOM 966 OH TYR A 59 2.083 4.894 4.059 1.00 74.02 O ATOM 0 H TYR A 59 1.733 10.272 6.547 1.00 34.13 H new ATOM 0 HA TYR A 59 -0.902 10.846 7.699 1.00 51.14 H new ATOM 0 HB2 TYR A 59 -1.680 8.511 7.306 1.00 10.24 H new ATOM 0 HB3 TYR A 59 -1.597 9.481 5.848 1.00 10.24 H new ATOM 0 HD1 TYR A 59 0.249 9.025 4.140 1.00 14.22 H new ATOM 0 HD2 TYR A 59 -0.342 6.474 7.528 1.00 44.40 H new ATOM 0 HE1 TYR A 59 1.568 7.264 3.051 1.00 2.11 H new ATOM 0 HE2 TYR A 59 0.970 4.723 6.427 1.00 1.32 H new ATOM 0 HH TYR A 59 2.128 4.111 4.646 1.00 74.02 H new ATOM 976 N ALA A 60 -0.349 8.920 9.554 1.00 63.51 N ATOM 977 CA ALA A 60 0.132 8.421 10.858 1.00 74.13 C ATOM 978 C ALA A 60 -0.713 7.240 11.383 1.00 11.24 C ATOM 979 O ALA A 60 -1.941 7.281 11.340 1.00 43.14 O ATOM 980 CB ALA A 60 0.133 9.566 11.884 1.00 23.23 C ATOM 0 H ALA A 60 -1.344 8.767 9.393 1.00 63.51 H new ATOM 0 HA ALA A 60 1.147 8.051 10.713 1.00 74.13 H new ATOM 0 HB1 ALA A 60 0.489 9.193 12.845 1.00 23.23 H new ATOM 0 HB2 ALA A 60 0.790 10.364 11.538 1.00 23.23 H new ATOM 0 HB3 ALA A 60 -0.879 9.954 11.997 1.00 23.23 H new ATOM 986 N ILE A 61 -0.027 6.201 11.882 1.00 21.44 N ATOM 987 CA ILE A 61 -0.659 5.051 12.562 1.00 62.24 C ATOM 988 C ILE A 61 -0.934 5.405 14.055 1.00 63.23 C ATOM 989 O ILE A 61 -0.011 5.467 14.881 1.00 34.21 O ATOM 990 CB ILE A 61 0.252 3.765 12.442 1.00 24.32 C ATOM 991 CG1 ILE A 61 0.508 3.397 10.938 1.00 33.20 C ATOM 992 CG2 ILE A 61 -0.337 2.556 13.218 1.00 34.20 C ATOM 993 CD1 ILE A 61 -0.729 3.016 10.130 1.00 35.40 C ATOM 0 H ILE A 61 0.989 6.131 11.827 1.00 21.44 H new ATOM 0 HA ILE A 61 -1.610 4.831 12.077 1.00 62.24 H new ATOM 0 HB ILE A 61 1.209 4.006 12.904 1.00 24.32 H new ATOM 0 HG12 ILE A 61 0.989 4.246 10.452 1.00 33.20 H new ATOM 0 HG13 ILE A 61 1.213 2.567 10.901 1.00 33.20 H new ATOM 0 HG21 ILE A 61 0.323 1.696 13.107 1.00 34.20 H new ATOM 0 HG22 ILE A 61 -0.427 2.810 14.274 1.00 34.20 H new ATOM 0 HG23 ILE A 61 -1.321 2.312 12.819 1.00 34.20 H new ATOM 0 HD11 ILE A 61 -0.437 2.781 9.106 1.00 35.40 H new ATOM 0 HD12 ILE A 61 -1.204 2.145 10.581 1.00 35.40 H new ATOM 0 HD13 ILE A 61 -1.431 3.850 10.125 1.00 35.40 H new ATOM 1005 N GLN A 62 -2.215 5.662 14.366 1.00 52.05 N ATOM 1006 CA GLN A 62 -2.677 6.076 15.710 1.00 74.14 C ATOM 1007 C GLN A 62 -2.995 4.837 16.593 1.00 1.24 C ATOM 1008 O GLN A 62 -4.052 4.218 16.451 1.00 54.32 O ATOM 1009 CB GLN A 62 -3.944 6.966 15.562 1.00 42.23 C ATOM 1010 CG GLN A 62 -3.834 8.086 14.499 1.00 71.31 C ATOM 1011 CD GLN A 62 -2.901 9.246 14.862 1.00 32.44 C ATOM 1012 OE1 GLN A 62 -2.263 9.836 14.004 1.00 12.11 O ATOM 1013 NE2 GLN A 62 -2.869 9.630 16.121 1.00 33.13 N ATOM 0 H GLN A 62 -2.972 5.588 13.686 1.00 52.05 H new ATOM 0 HA GLN A 62 -1.884 6.642 16.198 1.00 74.14 H new ATOM 0 HB2 GLN A 62 -4.791 6.328 15.310 1.00 42.23 H new ATOM 0 HB3 GLN A 62 -4.165 7.422 16.527 1.00 42.23 H new ATOM 0 HG2 GLN A 62 -3.490 7.644 13.564 1.00 71.31 H new ATOM 0 HG3 GLN A 62 -4.830 8.487 14.314 1.00 71.31 H new ATOM 0 HE21 GLN A 62 -3.409 9.124 16.823 1.00 33.13 H new ATOM 0 HE22 GLN A 62 -2.304 10.434 16.395 1.00 33.13 H new ATOM 1022 N ALA A 63 -2.061 4.480 17.482 1.00 62.41 N ATOM 1023 CA ALA A 63 -2.195 3.318 18.404 1.00 43.24 C ATOM 1024 C ALA A 63 -2.679 3.766 19.813 1.00 71.51 C ATOM 1025 O ALA A 63 -2.405 4.898 20.227 1.00 35.03 O ATOM 1026 CB ALA A 63 -0.844 2.579 18.497 1.00 42.44 C ATOM 0 H ALA A 63 -1.181 4.984 17.592 1.00 62.41 H new ATOM 0 HA ALA A 63 -2.949 2.640 18.004 1.00 43.24 H new ATOM 0 HB1 ALA A 63 -0.940 1.728 19.172 1.00 42.44 H new ATOM 0 HB2 ALA A 63 -0.553 2.226 17.507 1.00 42.44 H new ATOM 0 HB3 ALA A 63 -0.082 3.260 18.878 1.00 42.44 H new ATOM 1032 N PRO A 64 -3.407 2.881 20.584 1.00 30.24 N ATOM 1033 CA PRO A 64 -3.918 3.221 21.957 1.00 2.55 C ATOM 1034 C PRO A 64 -2.810 3.578 22.997 1.00 44.41 C ATOM 1035 O PRO A 64 -3.111 4.134 24.061 1.00 65.02 O ATOM 1036 CB PRO A 64 -4.688 1.934 22.382 1.00 12.40 C ATOM 1037 CG PRO A 64 -5.016 1.239 21.091 1.00 54.44 C ATOM 1038 CD PRO A 64 -3.838 1.508 20.181 1.00 41.03 C ATOM 0 HA PRO A 64 -4.528 4.124 21.929 1.00 2.55 H new ATOM 0 HB2 PRO A 64 -4.077 1.302 23.027 1.00 12.40 H new ATOM 0 HB3 PRO A 64 -5.592 2.180 22.940 1.00 12.40 H new ATOM 0 HG2 PRO A 64 -5.157 0.169 21.245 1.00 54.44 H new ATOM 0 HG3 PRO A 64 -5.941 1.624 20.661 1.00 54.44 H new ATOM 0 HD2 PRO A 64 -3.042 0.777 20.325 1.00 41.03 H new ATOM 0 HD3 PRO A 64 -4.123 1.467 19.130 1.00 41.03 H new ATOM 1046 N GLN A 65 -1.536 3.230 22.694 1.00 33.11 N ATOM 1047 CA GLN A 65 -0.368 3.486 23.596 1.00 43.10 C ATOM 1048 C GLN A 65 0.795 4.237 22.884 1.00 30.33 C ATOM 1049 O GLN A 65 1.833 4.501 23.503 1.00 32.51 O ATOM 1050 CB GLN A 65 0.165 2.135 24.148 1.00 42.20 C ATOM 1051 CG GLN A 65 -0.858 1.314 24.959 1.00 13.23 C ATOM 1052 CD GLN A 65 -0.349 -0.060 25.426 1.00 22.31 C ATOM 1053 OE1 GLN A 65 -1.119 -1.009 25.529 1.00 64.14 O ATOM 1054 NE2 GLN A 65 0.933 -0.176 25.741 1.00 44.45 N ATOM 0 H GLN A 65 -1.281 2.765 21.823 1.00 33.11 H new ATOM 0 HA GLN A 65 -0.724 4.126 24.404 1.00 43.10 H new ATOM 0 HB2 GLN A 65 0.513 1.529 23.311 1.00 42.20 H new ATOM 0 HB3 GLN A 65 1.031 2.334 24.779 1.00 42.20 H new ATOM 0 HG2 GLN A 65 -1.157 1.892 25.833 1.00 13.23 H new ATOM 0 HG3 GLN A 65 -1.751 1.169 24.352 1.00 13.23 H new ATOM 0 HE21 GLN A 65 1.556 0.626 25.648 1.00 44.45 H new ATOM 0 HE22 GLN A 65 1.297 -1.068 26.077 1.00 44.45 H new ATOM 1063 N MET A 66 0.607 4.594 21.603 1.00 41.12 N ATOM 1064 CA MET A 66 1.710 5.086 20.729 1.00 14.45 C ATOM 1065 C MET A 66 1.140 5.827 19.500 1.00 14.23 C ATOM 1066 O MET A 66 0.047 5.521 19.060 1.00 51.43 O ATOM 1067 CB MET A 66 2.563 3.861 20.270 1.00 34.34 C ATOM 1068 CG MET A 66 3.731 4.165 19.316 1.00 51.30 C ATOM 1069 SD MET A 66 4.610 2.669 18.801 1.00 3.33 S ATOM 1070 CE MET A 66 3.344 1.793 17.872 1.00 43.32 C ATOM 0 H MET A 66 -0.300 4.554 21.138 1.00 41.12 H new ATOM 0 HA MET A 66 2.332 5.787 21.285 1.00 14.45 H new ATOM 0 HB2 MET A 66 2.964 3.371 21.157 1.00 34.34 H new ATOM 0 HB3 MET A 66 1.900 3.145 19.783 1.00 34.34 H new ATOM 0 HG2 MET A 66 3.351 4.681 18.434 1.00 51.30 H new ATOM 0 HG3 MET A 66 4.430 4.843 19.806 1.00 51.30 H new ATOM 0 HE1 MET A 66 3.814 1.050 17.228 1.00 43.32 H new ATOM 0 HE2 MET A 66 2.664 1.296 18.564 1.00 43.32 H new ATOM 0 HE3 MET A 66 2.786 2.502 17.260 1.00 43.32 H new ATOM 1080 N ILE A 67 1.867 6.815 18.941 1.00 44.32 N ATOM 1081 CA ILE A 67 1.507 7.407 17.629 1.00 44.34 C ATOM 1082 C ILE A 67 2.747 7.413 16.710 1.00 32.23 C ATOM 1083 O ILE A 67 3.688 8.190 16.911 1.00 64.50 O ATOM 1084 CB ILE A 67 0.891 8.863 17.758 1.00 41.34 C ATOM 1085 CG1 ILE A 67 -0.406 8.837 18.641 1.00 34.02 C ATOM 1086 CG2 ILE A 67 0.606 9.477 16.359 1.00 13.15 C ATOM 1087 CD1 ILE A 67 -1.115 10.173 18.820 1.00 31.10 C ATOM 0 H ILE A 67 2.700 7.219 19.369 1.00 44.32 H new ATOM 0 HA ILE A 67 0.726 6.786 17.190 1.00 44.34 H new ATOM 0 HB ILE A 67 1.625 9.500 18.252 1.00 41.34 H new ATOM 0 HG12 ILE A 67 -1.109 8.131 18.199 1.00 34.02 H new ATOM 0 HG13 ILE A 67 -0.144 8.452 19.626 1.00 34.02 H new ATOM 0 HG21 ILE A 67 0.184 10.475 16.479 1.00 13.15 H new ATOM 0 HG22 ILE A 67 1.536 9.541 15.794 1.00 13.15 H new ATOM 0 HG23 ILE A 67 -0.102 8.846 15.822 1.00 13.15 H new ATOM 0 HD11 ILE A 67 -1.996 10.036 19.447 1.00 31.10 H new ATOM 0 HD12 ILE A 67 -0.438 10.883 19.295 1.00 31.10 H new ATOM 0 HD13 ILE A 67 -1.419 10.557 17.846 1.00 31.10 H new ATOM 1099 N SER A 68 2.739 6.515 15.715 1.00 61.53 N ATOM 1100 CA SER A 68 3.794 6.421 14.688 1.00 45.43 C ATOM 1101 C SER A 68 3.345 7.157 13.417 1.00 53.10 C ATOM 1102 O SER A 68 2.151 7.308 13.183 1.00 53.21 O ATOM 1103 CB SER A 68 4.093 4.937 14.364 1.00 40.24 C ATOM 1104 OG SER A 68 4.447 4.212 15.536 1.00 52.25 O ATOM 0 H SER A 68 1.996 5.827 15.597 1.00 61.53 H new ATOM 0 HA SER A 68 4.704 6.885 15.069 1.00 45.43 H new ATOM 0 HB2 SER A 68 3.218 4.480 13.902 1.00 40.24 H new ATOM 0 HB3 SER A 68 4.904 4.877 13.638 1.00 40.24 H new ATOM 0 HG SER A 68 4.628 3.278 15.301 1.00 52.25 H new ATOM 1110 N TYR A 69 4.301 7.618 12.602 1.00 61.53 N ATOM 1111 CA TYR A 69 4.010 8.368 11.354 1.00 2.42 C ATOM 1112 C TYR A 69 4.673 7.662 10.152 1.00 30.25 C ATOM 1113 O TYR A 69 5.738 7.058 10.301 1.00 43.51 O ATOM 1114 CB TYR A 69 4.517 9.837 11.463 1.00 63.52 C ATOM 1115 CG TYR A 69 4.039 10.595 12.715 1.00 61.51 C ATOM 1116 CD1 TYR A 69 4.652 10.387 13.949 1.00 53.25 C ATOM 1117 CD2 TYR A 69 2.977 11.496 12.669 1.00 30.31 C ATOM 1118 CE1 TYR A 69 4.226 11.038 15.080 1.00 61.31 C ATOM 1119 CE2 TYR A 69 2.543 12.152 13.805 1.00 61.14 C ATOM 1120 CZ TYR A 69 3.172 11.920 15.009 1.00 52.21 C ATOM 1121 OH TYR A 69 2.740 12.561 16.150 1.00 3.44 O ATOM 0 H TYR A 69 5.297 7.487 12.779 1.00 61.53 H new ATOM 0 HA TYR A 69 2.931 8.390 11.204 1.00 2.42 H new ATOM 0 HB2 TYR A 69 5.607 9.832 11.453 1.00 63.52 H new ATOM 0 HB3 TYR A 69 4.193 10.385 10.578 1.00 63.52 H new ATOM 0 HD1 TYR A 69 5.481 9.698 14.017 1.00 53.25 H new ATOM 0 HD2 TYR A 69 2.484 11.685 11.727 1.00 30.31 H new ATOM 0 HE1 TYR A 69 4.718 10.858 16.025 1.00 61.31 H new ATOM 0 HE2 TYR A 69 1.715 12.843 13.750 1.00 61.14 H new ATOM 0 HH TYR A 69 1.989 13.150 15.930 1.00 3.44 H new ATOM 1131 N THR A 70 4.040 7.740 8.969 1.00 61.30 N ATOM 1132 CA THR A 70 4.571 7.140 7.715 1.00 64.53 C ATOM 1133 C THR A 70 4.131 7.989 6.491 1.00 73.44 C ATOM 1134 O THR A 70 3.070 8.615 6.509 1.00 72.22 O ATOM 1135 CB THR A 70 4.109 5.641 7.534 1.00 52.23 C ATOM 1136 OG1 THR A 70 4.449 4.858 8.697 1.00 0.32 O ATOM 1137 CG2 THR A 70 4.743 4.975 6.294 1.00 43.35 C ATOM 0 H THR A 70 3.147 8.218 8.846 1.00 61.30 H new ATOM 0 HA THR A 70 5.659 7.139 7.785 1.00 64.53 H new ATOM 0 HB THR A 70 3.028 5.670 7.399 1.00 52.23 H new ATOM 0 HG1 THR A 70 4.153 3.933 8.566 1.00 0.32 H new ATOM 0 HG21 THR A 70 4.393 3.946 6.215 1.00 43.35 H new ATOM 0 HG22 THR A 70 4.456 5.526 5.398 1.00 43.35 H new ATOM 0 HG23 THR A 70 5.829 4.983 6.392 1.00 43.35 H new ATOM 1145 N ILE A 71 4.961 8.007 5.430 1.00 51.24 N ATOM 1146 CA ILE A 71 4.754 8.839 4.222 1.00 25.21 C ATOM 1147 C ILE A 71 4.844 7.966 2.947 1.00 71.44 C ATOM 1148 O ILE A 71 5.681 7.065 2.872 1.00 13.14 O ATOM 1149 CB ILE A 71 5.845 9.987 4.141 1.00 62.22 C ATOM 1150 CG1 ILE A 71 5.777 10.912 5.392 1.00 30.21 C ATOM 1151 CG2 ILE A 71 5.701 10.816 2.849 1.00 22.10 C ATOM 1152 CD1 ILE A 71 6.843 11.996 5.458 1.00 13.04 C ATOM 0 H ILE A 71 5.806 7.438 5.384 1.00 51.24 H new ATOM 0 HA ILE A 71 3.763 9.288 4.288 1.00 25.21 H new ATOM 0 HB ILE A 71 6.822 9.504 4.122 1.00 62.22 H new ATOM 0 HG12 ILE A 71 4.797 11.388 5.419 1.00 30.21 H new ATOM 0 HG13 ILE A 71 5.856 10.293 6.286 1.00 30.21 H new ATOM 0 HG21 ILE A 71 6.465 11.593 2.828 1.00 22.10 H new ATOM 0 HG22 ILE A 71 5.822 10.165 1.983 1.00 22.10 H new ATOM 0 HG23 ILE A 71 4.714 11.277 2.821 1.00 22.10 H new ATOM 0 HD11 ILE A 71 6.708 12.584 6.366 1.00 13.04 H new ATOM 0 HD12 ILE A 71 7.831 11.535 5.468 1.00 13.04 H new ATOM 0 HD13 ILE A 71 6.755 12.646 4.588 1.00 13.04 H new ATOM 1164 N ALA A 72 3.975 8.233 1.953 1.00 0.51 N ATOM 1165 CA ALA A 72 4.110 7.666 0.595 1.00 42.10 C ATOM 1166 C ALA A 72 4.371 8.803 -0.424 1.00 31.31 C ATOM 1167 O ALA A 72 3.520 9.676 -0.614 1.00 41.43 O ATOM 1168 CB ALA A 72 2.838 6.879 0.231 1.00 53.31 C ATOM 0 H ALA A 72 3.165 8.843 2.066 1.00 0.51 H new ATOM 0 HA ALA A 72 4.957 6.980 0.567 1.00 42.10 H new ATOM 0 HB1 ALA A 72 2.942 6.463 -0.771 1.00 53.31 H new ATOM 0 HB2 ALA A 72 2.693 6.070 0.947 1.00 53.31 H new ATOM 0 HB3 ALA A 72 1.977 7.546 0.259 1.00 53.31 H new ATOM 1174 N GLU A 73 5.554 8.791 -1.071 1.00 72.54 N ATOM 1175 CA GLU A 73 5.887 9.745 -2.151 1.00 21.53 C ATOM 1176 C GLU A 73 5.549 9.105 -3.501 1.00 64.41 C ATOM 1177 O GLU A 73 6.259 8.202 -3.944 1.00 40.42 O ATOM 1178 CB GLU A 73 7.402 10.087 -2.102 1.00 23.40 C ATOM 1179 CG GLU A 73 7.886 10.716 -0.783 1.00 73.32 C ATOM 1180 CD GLU A 73 7.348 12.135 -0.541 1.00 63.44 C ATOM 1181 OE1 GLU A 73 8.010 13.113 -0.957 1.00 41.14 O ATOM 1182 OE2 GLU A 73 6.284 12.283 0.088 1.00 65.54 O ATOM 0 H GLU A 73 6.300 8.127 -0.863 1.00 72.54 H new ATOM 0 HA GLU A 73 5.312 10.662 -2.021 1.00 21.53 H new ATOM 0 HB2 GLU A 73 7.971 9.175 -2.282 1.00 23.40 H new ATOM 0 HB3 GLU A 73 7.631 10.772 -2.919 1.00 23.40 H new ATOM 0 HG2 GLU A 73 7.584 10.076 0.046 1.00 73.32 H new ATOM 0 HG3 GLU A 73 8.976 10.745 -0.783 1.00 73.32 H new ATOM 1189 N TYR A 74 4.510 9.605 -4.179 1.00 41.21 N ATOM 1190 CA TYR A 74 4.030 9.009 -5.440 1.00 55.21 C ATOM 1191 C TYR A 74 4.932 9.465 -6.601 1.00 24.25 C ATOM 1192 O TYR A 74 4.707 10.510 -7.207 1.00 62.02 O ATOM 1193 CB TYR A 74 2.540 9.364 -5.676 1.00 72.02 C ATOM 1194 CG TYR A 74 1.600 8.771 -4.609 1.00 3.02 C ATOM 1195 CD1 TYR A 74 1.367 9.436 -3.399 1.00 22.01 C ATOM 1196 CD2 TYR A 74 0.964 7.535 -4.802 1.00 41.53 C ATOM 1197 CE1 TYR A 74 0.542 8.896 -2.433 1.00 21.51 C ATOM 1198 CE2 TYR A 74 0.134 6.996 -3.835 1.00 44.43 C ATOM 1199 CZ TYR A 74 -0.072 7.679 -2.653 1.00 31.03 C ATOM 1200 OH TYR A 74 -0.900 7.147 -1.687 1.00 61.35 O ATOM 0 H TYR A 74 3.981 10.423 -3.878 1.00 41.21 H new ATOM 0 HA TYR A 74 4.089 7.922 -5.380 1.00 55.21 H new ATOM 0 HB2 TYR A 74 2.429 10.448 -5.687 1.00 72.02 H new ATOM 0 HB3 TYR A 74 2.238 9.002 -6.659 1.00 72.02 H new ATOM 0 HD1 TYR A 74 1.842 10.389 -3.218 1.00 22.01 H new ATOM 0 HD2 TYR A 74 1.125 6.994 -5.723 1.00 41.53 H new ATOM 0 HE1 TYR A 74 0.377 9.425 -1.506 1.00 21.51 H new ATOM 0 HE2 TYR A 74 -0.350 6.046 -4.004 1.00 44.43 H new ATOM 0 HH TYR A 74 -1.706 7.698 -1.607 1.00 61.35 H new ATOM 1210 N LEU A 75 5.987 8.669 -6.861 1.00 2.42 N ATOM 1211 CA LEU A 75 7.037 8.999 -7.844 1.00 43.22 C ATOM 1212 C LEU A 75 6.415 9.080 -9.260 1.00 23.03 C ATOM 1213 O LEU A 75 6.416 10.145 -9.892 1.00 74.54 O ATOM 1214 CB LEU A 75 8.195 7.943 -7.751 1.00 70.24 C ATOM 1215 CG LEU A 75 9.639 8.398 -8.179 1.00 51.44 C ATOM 1216 CD1 LEU A 75 9.751 8.713 -9.685 1.00 34.43 C ATOM 1217 CD2 LEU A 75 10.131 9.587 -7.320 1.00 71.35 C ATOM 0 H LEU A 75 6.135 7.775 -6.393 1.00 2.42 H new ATOM 0 HA LEU A 75 7.471 9.975 -7.626 1.00 43.22 H new ATOM 0 HB2 LEU A 75 8.246 7.592 -6.720 1.00 70.24 H new ATOM 0 HB3 LEU A 75 7.918 7.087 -8.366 1.00 70.24 H new ATOM 0 HG LEU A 75 10.295 7.547 -7.994 1.00 51.44 H new ATOM 0 HD11 LEU A 75 10.770 9.021 -9.917 1.00 34.43 H new ATOM 0 HD12 LEU A 75 9.500 7.823 -10.262 1.00 34.43 H new ATOM 0 HD13 LEU A 75 9.062 9.518 -9.941 1.00 34.43 H new ATOM 0 HD21 LEU A 75 11.131 9.878 -7.640 1.00 71.35 H new ATOM 0 HD22 LEU A 75 9.451 10.430 -7.443 1.00 71.35 H new ATOM 0 HD23 LEU A 75 10.157 9.292 -6.271 1.00 71.35 H new ATOM 1229 N GLN A 76 5.851 7.952 -9.731 1.00 23.12 N ATOM 1230 CA GLN A 76 5.142 7.888 -11.029 1.00 75.24 C ATOM 1231 C GLN A 76 3.875 7.001 -10.923 1.00 60.52 C ATOM 1232 O GLN A 76 3.959 5.789 -10.782 1.00 1.25 O ATOM 1233 CB GLN A 76 6.103 7.333 -12.127 1.00 75.04 C ATOM 1234 CG GLN A 76 7.208 8.310 -12.584 1.00 34.50 C ATOM 1235 CD GLN A 76 8.249 7.663 -13.495 1.00 52.34 C ATOM 1236 OE1 GLN A 76 9.274 7.173 -13.038 1.00 51.14 O ATOM 1237 NE2 GLN A 76 7.980 7.617 -14.782 1.00 53.32 N ATOM 0 H GLN A 76 5.872 7.064 -9.229 1.00 23.12 H new ATOM 0 HA GLN A 76 4.827 8.894 -11.304 1.00 75.24 H new ATOM 0 HB2 GLN A 76 6.575 6.426 -11.750 1.00 75.04 H new ATOM 0 HB3 GLN A 76 5.510 7.047 -12.996 1.00 75.04 H new ATOM 0 HG2 GLN A 76 6.748 9.148 -13.108 1.00 34.50 H new ATOM 0 HG3 GLN A 76 7.708 8.718 -11.706 1.00 34.50 H new ATOM 0 HE21 GLN A 76 7.119 8.033 -15.138 1.00 53.32 H new ATOM 0 HE22 GLN A 76 8.632 7.166 -15.424 1.00 53.32 H new ATOM 1246 N VAL A 77 2.700 7.628 -11.039 1.00 24.23 N ATOM 1247 CA VAL A 77 1.408 6.924 -11.135 1.00 3.15 C ATOM 1248 C VAL A 77 0.872 7.141 -12.563 1.00 60.01 C ATOM 1249 O VAL A 77 0.509 8.263 -12.935 1.00 52.01 O ATOM 1250 CB VAL A 77 0.377 7.447 -10.060 1.00 42.33 C ATOM 1251 CG1 VAL A 77 -0.983 6.703 -10.160 1.00 42.34 C ATOM 1252 CG2 VAL A 77 0.967 7.335 -8.630 1.00 23.20 C ATOM 0 H VAL A 77 2.613 8.644 -11.070 1.00 24.23 H new ATOM 0 HA VAL A 77 1.548 5.862 -10.933 1.00 3.15 H new ATOM 0 HB VAL A 77 0.189 8.500 -10.271 1.00 42.33 H new ATOM 0 HG11 VAL A 77 -1.666 7.091 -9.404 1.00 42.34 H new ATOM 0 HG12 VAL A 77 -1.411 6.859 -11.150 1.00 42.34 H new ATOM 0 HG13 VAL A 77 -0.827 5.637 -9.996 1.00 42.34 H new ATOM 0 HG21 VAL A 77 0.239 7.701 -7.906 1.00 23.20 H new ATOM 0 HG22 VAL A 77 1.201 6.293 -8.414 1.00 23.20 H new ATOM 0 HG23 VAL A 77 1.876 7.932 -8.564 1.00 23.20 H new ATOM 1262 N ASP A 78 0.855 6.070 -13.366 1.00 25.15 N ATOM 1263 CA ASP A 78 0.555 6.147 -14.807 1.00 10.20 C ATOM 1264 C ASP A 78 -0.675 5.272 -15.126 1.00 64.03 C ATOM 1265 O ASP A 78 -0.564 4.036 -15.151 1.00 53.42 O ATOM 1266 CB ASP A 78 1.801 5.694 -15.618 1.00 11.44 C ATOM 1267 CG ASP A 78 1.706 6.043 -17.115 1.00 52.51 C ATOM 1268 OD1 ASP A 78 2.131 7.156 -17.502 1.00 4.20 O ATOM 1269 OD2 ASP A 78 1.201 5.218 -17.910 1.00 33.11 O ATOM 0 H ASP A 78 1.049 5.124 -13.038 1.00 25.15 H new ATOM 0 HA ASP A 78 0.321 7.174 -15.088 1.00 10.20 H new ATOM 0 HB2 ASP A 78 2.691 6.162 -15.197 1.00 11.44 H new ATOM 0 HB3 ASP A 78 1.926 4.617 -15.509 1.00 11.44 H new ATOM 1274 N ALA A 79 -1.850 5.932 -15.320 1.00 75.43 N ATOM 1275 CA ALA A 79 -3.142 5.263 -15.622 1.00 2.23 C ATOM 1276 C ALA A 79 -3.647 4.375 -14.429 1.00 14.21 C ATOM 1277 O ALA A 79 -2.905 4.147 -13.463 1.00 44.11 O ATOM 1278 CB ALA A 79 -3.022 4.473 -16.953 1.00 2.02 C ATOM 0 H ALA A 79 -1.925 6.948 -15.271 1.00 75.43 H new ATOM 0 HA ALA A 79 -3.908 6.028 -15.751 1.00 2.23 H new ATOM 0 HB1 ALA A 79 -3.971 3.983 -17.172 1.00 2.02 H new ATOM 0 HB2 ALA A 79 -2.772 5.159 -17.762 1.00 2.02 H new ATOM 0 HB3 ALA A 79 -2.238 3.721 -16.860 1.00 2.02 H new ATOM 1284 N PRO A 80 -4.940 3.871 -14.436 1.00 71.20 N ATOM 1285 CA PRO A 80 -5.431 2.906 -13.395 1.00 31.24 C ATOM 1286 C PRO A 80 -4.738 1.504 -13.424 1.00 42.13 C ATOM 1287 O PRO A 80 -5.115 0.611 -12.661 1.00 42.12 O ATOM 1288 CB PRO A 80 -6.956 2.798 -13.697 1.00 51.31 C ATOM 1289 CG PRO A 80 -7.085 3.175 -15.141 1.00 13.11 C ATOM 1290 CD PRO A 80 -6.048 4.255 -15.364 1.00 12.43 C ATOM 0 HA PRO A 80 -5.200 3.264 -12.392 1.00 31.24 H new ATOM 0 HB2 PRO A 80 -7.325 1.788 -13.517 1.00 51.31 H new ATOM 0 HB3 PRO A 80 -7.534 3.467 -13.060 1.00 51.31 H new ATOM 0 HG2 PRO A 80 -6.906 2.317 -15.789 1.00 13.11 H new ATOM 0 HG3 PRO A 80 -8.088 3.540 -15.365 1.00 13.11 H new ATOM 0 HD2 PRO A 80 -5.712 4.281 -16.401 1.00 12.43 H new ATOM 0 HD3 PRO A 80 -6.442 5.244 -15.131 1.00 12.43 H new ATOM 1298 N TYR A 81 -3.712 1.336 -14.285 1.00 71.40 N ATOM 1299 CA TYR A 81 -3.007 0.053 -14.491 1.00 75.14 C ATOM 1300 C TYR A 81 -1.655 0.000 -13.735 1.00 30.41 C ATOM 1301 O TYR A 81 -1.229 -1.075 -13.296 1.00 4.12 O ATOM 1302 CB TYR A 81 -2.784 -0.167 -16.010 1.00 60.44 C ATOM 1303 CG TYR A 81 -4.083 -0.095 -16.833 1.00 61.45 C ATOM 1304 CD1 TYR A 81 -4.950 -1.190 -16.912 1.00 34.15 C ATOM 1305 CD2 TYR A 81 -4.458 1.076 -17.502 1.00 41.51 C ATOM 1306 CE1 TYR A 81 -6.134 -1.121 -17.627 1.00 72.25 C ATOM 1307 CE2 TYR A 81 -5.637 1.145 -18.220 1.00 11.01 C ATOM 1308 CZ TYR A 81 -6.473 0.045 -18.278 1.00 42.33 C ATOM 1309 OH TYR A 81 -7.654 0.121 -18.988 1.00 25.22 O ATOM 0 H TYR A 81 -3.347 2.094 -14.862 1.00 71.40 H new ATOM 0 HA TYR A 81 -3.629 -0.745 -14.085 1.00 75.14 H new ATOM 0 HB2 TYR A 81 -2.086 0.584 -16.380 1.00 60.44 H new ATOM 0 HB3 TYR A 81 -2.318 -1.140 -16.165 1.00 60.44 H new ATOM 0 HD1 TYR A 81 -4.691 -2.108 -16.405 1.00 34.15 H new ATOM 0 HD2 TYR A 81 -3.814 1.942 -17.456 1.00 41.51 H new ATOM 0 HE1 TYR A 81 -6.789 -1.978 -17.674 1.00 72.25 H new ATOM 0 HE2 TYR A 81 -5.905 2.056 -18.735 1.00 11.01 H new ATOM 0 HH TYR A 81 -7.740 1.013 -19.385 1.00 25.22 H new ATOM 1319 N TYR A 82 -0.973 1.162 -13.586 1.00 21.25 N ATOM 1320 CA TYR A 82 0.374 1.221 -12.959 1.00 24.53 C ATOM 1321 C TYR A 82 0.481 2.335 -11.886 1.00 44.15 C ATOM 1322 O TYR A 82 0.067 3.478 -12.105 1.00 70.33 O ATOM 1323 CB TYR A 82 1.470 1.410 -14.040 1.00 63.21 C ATOM 1324 CG TYR A 82 2.902 1.501 -13.463 1.00 2.52 C ATOM 1325 CD1 TYR A 82 3.505 0.384 -12.869 1.00 52.10 C ATOM 1326 CD2 TYR A 82 3.634 2.699 -13.485 1.00 31.00 C ATOM 1327 CE1 TYR A 82 4.777 0.457 -12.335 1.00 54.10 C ATOM 1328 CE2 TYR A 82 4.908 2.769 -12.952 1.00 2.30 C ATOM 1329 CZ TYR A 82 5.472 1.649 -12.375 1.00 21.22 C ATOM 1330 OH TYR A 82 6.740 1.719 -11.845 1.00 42.23 O ATOM 0 H TYR A 82 -1.330 2.068 -13.889 1.00 21.25 H new ATOM 0 HA TYR A 82 0.529 0.269 -12.452 1.00 24.53 H new ATOM 0 HB2 TYR A 82 1.423 0.578 -14.742 1.00 63.21 H new ATOM 0 HB3 TYR A 82 1.257 2.317 -14.606 1.00 63.21 H new ATOM 0 HD1 TYR A 82 2.966 -0.551 -12.828 1.00 52.10 H new ATOM 0 HD2 TYR A 82 3.194 3.581 -13.926 1.00 31.00 H new ATOM 0 HE1 TYR A 82 5.227 -0.417 -11.887 1.00 54.10 H new ATOM 0 HE2 TYR A 82 5.460 3.697 -12.987 1.00 2.30 H new ATOM 0 HH TYR A 82 7.003 2.658 -11.749 1.00 42.23 H new ATOM 1340 N ILE A 83 1.069 1.969 -10.728 1.00 41.15 N ATOM 1341 CA ILE A 83 1.390 2.897 -9.620 1.00 74.32 C ATOM 1342 C ILE A 83 2.892 2.741 -9.239 1.00 33.30 C ATOM 1343 O ILE A 83 3.450 1.645 -9.337 1.00 1.14 O ATOM 1344 CB ILE A 83 0.519 2.620 -8.316 1.00 72.13 C ATOM 1345 CG1 ILE A 83 -1.027 2.527 -8.606 1.00 1.30 C ATOM 1346 CG2 ILE A 83 0.811 3.676 -7.213 1.00 54.41 C ATOM 1347 CD1 ILE A 83 -1.517 1.175 -9.129 1.00 23.03 C ATOM 0 H ILE A 83 1.339 1.005 -10.532 1.00 41.15 H new ATOM 0 HA ILE A 83 1.166 3.904 -9.972 1.00 74.32 H new ATOM 0 HB ILE A 83 0.824 1.638 -7.953 1.00 72.13 H new ATOM 0 HG12 ILE A 83 -1.566 2.759 -7.688 1.00 1.30 H new ATOM 0 HG13 ILE A 83 -1.290 3.295 -9.333 1.00 1.30 H new ATOM 0 HG21 ILE A 83 0.202 3.462 -6.334 1.00 54.41 H new ATOM 0 HG22 ILE A 83 1.866 3.637 -6.942 1.00 54.41 H new ATOM 0 HG23 ILE A 83 0.570 4.670 -7.588 1.00 54.41 H new ATOM 0 HD11 ILE A 83 -2.593 1.218 -9.296 1.00 23.03 H new ATOM 0 HD12 ILE A 83 -1.013 0.944 -10.068 1.00 23.03 H new ATOM 0 HD13 ILE A 83 -1.294 0.399 -8.397 1.00 23.03 H new ATOM 1359 N GLU A 84 3.539 3.841 -8.814 1.00 0.41 N ATOM 1360 CA GLU A 84 4.878 3.808 -8.181 1.00 4.13 C ATOM 1361 C GLU A 84 4.940 4.839 -7.035 1.00 21.14 C ATOM 1362 O GLU A 84 4.660 6.024 -7.257 1.00 42.53 O ATOM 1363 CB GLU A 84 5.994 4.099 -9.221 1.00 33.54 C ATOM 1364 CG GLU A 84 7.425 4.177 -8.642 1.00 52.33 C ATOM 1365 CD GLU A 84 8.519 4.433 -9.697 1.00 51.41 C ATOM 1366 OE1 GLU A 84 8.407 3.926 -10.829 1.00 55.34 O ATOM 1367 OE2 GLU A 84 9.530 5.086 -9.374 1.00 64.44 O ATOM 0 H GLU A 84 3.151 4.781 -8.898 1.00 0.41 H new ATOM 0 HA GLU A 84 5.043 2.809 -7.778 1.00 4.13 H new ATOM 0 HB2 GLU A 84 5.969 3.321 -9.984 1.00 33.54 H new ATOM 0 HB3 GLU A 84 5.768 5.042 -9.719 1.00 33.54 H new ATOM 0 HG2 GLU A 84 7.461 4.972 -7.897 1.00 52.33 H new ATOM 0 HG3 GLU A 84 7.647 3.244 -8.124 1.00 52.33 H new ATOM 1374 N TYR A 85 5.296 4.382 -5.817 1.00 23.50 N ATOM 1375 CA TYR A 85 5.537 5.276 -4.664 1.00 74.53 C ATOM 1376 C TYR A 85 6.703 4.779 -3.772 1.00 61.40 C ATOM 1377 O TYR A 85 7.141 3.629 -3.867 1.00 41.21 O ATOM 1378 CB TYR A 85 4.238 5.507 -3.826 1.00 70.22 C ATOM 1379 CG TYR A 85 3.647 4.277 -3.115 1.00 63.23 C ATOM 1380 CD1 TYR A 85 4.077 3.898 -1.833 1.00 14.44 C ATOM 1381 CD2 TYR A 85 2.639 3.509 -3.709 1.00 74.13 C ATOM 1382 CE1 TYR A 85 3.531 2.806 -1.184 1.00 75.24 C ATOM 1383 CE2 TYR A 85 2.091 2.416 -3.059 1.00 53.11 C ATOM 1384 CZ TYR A 85 2.538 2.068 -1.801 1.00 65.32 C ATOM 1385 OH TYR A 85 1.996 0.971 -1.161 1.00 75.34 O ATOM 0 H TYR A 85 5.424 3.392 -5.605 1.00 23.50 H new ATOM 0 HA TYR A 85 5.837 6.240 -5.076 1.00 74.53 H new ATOM 0 HB2 TYR A 85 4.449 6.266 -3.073 1.00 70.22 H new ATOM 0 HB3 TYR A 85 3.475 5.917 -4.487 1.00 70.22 H new ATOM 0 HD1 TYR A 85 4.850 4.471 -1.344 1.00 14.44 H new ATOM 0 HD2 TYR A 85 2.282 3.774 -4.693 1.00 74.13 H new ATOM 0 HE1 TYR A 85 3.879 2.531 -0.199 1.00 75.24 H new ATOM 0 HE2 TYR A 85 1.315 1.837 -3.536 1.00 53.11 H new ATOM 0 HH TYR A 85 1.310 0.565 -1.731 1.00 75.34 H new ATOM 1395 N LEU A 86 7.181 5.684 -2.902 1.00 32.30 N ATOM 1396 CA LEU A 86 8.303 5.440 -1.972 1.00 33.15 C ATOM 1397 C LEU A 86 7.796 5.500 -0.516 1.00 55.23 C ATOM 1398 O LEU A 86 7.182 6.494 -0.122 1.00 51.01 O ATOM 1399 CB LEU A 86 9.388 6.527 -2.184 1.00 21.22 C ATOM 1400 CG LEU A 86 9.990 6.633 -3.618 1.00 54.32 C ATOM 1401 CD1 LEU A 86 10.901 7.866 -3.755 1.00 64.21 C ATOM 1402 CD2 LEU A 86 10.745 5.343 -4.001 1.00 13.32 C ATOM 0 H LEU A 86 6.793 6.624 -2.822 1.00 32.30 H new ATOM 0 HA LEU A 86 8.726 4.454 -2.165 1.00 33.15 H new ATOM 0 HB2 LEU A 86 8.959 7.494 -1.921 1.00 21.22 H new ATOM 0 HB3 LEU A 86 10.202 6.338 -1.484 1.00 21.22 H new ATOM 0 HG LEU A 86 9.160 6.756 -4.314 1.00 54.32 H new ATOM 0 HD11 LEU A 86 11.304 7.910 -4.767 1.00 64.21 H new ATOM 0 HD12 LEU A 86 10.324 8.769 -3.555 1.00 64.21 H new ATOM 0 HD13 LEU A 86 11.721 7.794 -3.041 1.00 64.21 H new ATOM 0 HD21 LEU A 86 11.154 5.446 -5.006 1.00 13.32 H new ATOM 0 HD22 LEU A 86 11.557 5.173 -3.294 1.00 13.32 H new ATOM 0 HD23 LEU A 86 10.058 4.497 -3.974 1.00 13.32 H new ATOM 1414 N ASP A 87 8.067 4.457 0.275 1.00 40.12 N ATOM 1415 CA ASP A 87 7.649 4.394 1.687 1.00 2.22 C ATOM 1416 C ASP A 87 8.768 4.952 2.602 1.00 64.44 C ATOM 1417 O ASP A 87 9.872 4.403 2.659 1.00 35.20 O ATOM 1418 CB ASP A 87 7.300 2.933 2.073 1.00 1.31 C ATOM 1419 CG ASP A 87 6.646 2.818 3.463 1.00 31.43 C ATOM 1420 OD1 ASP A 87 5.424 3.051 3.569 1.00 63.11 O ATOM 1421 OD2 ASP A 87 7.356 2.516 4.453 1.00 3.03 O ATOM 0 H ASP A 87 8.580 3.634 -0.040 1.00 40.12 H new ATOM 0 HA ASP A 87 6.759 5.009 1.822 1.00 2.22 H new ATOM 0 HB2 ASP A 87 6.626 2.516 1.325 1.00 1.31 H new ATOM 0 HB3 ASP A 87 8.208 2.331 2.054 1.00 1.31 H new ATOM 1426 N TYR A 88 8.480 6.071 3.280 1.00 73.42 N ATOM 1427 CA TYR A 88 9.375 6.675 4.293 1.00 12.14 C ATOM 1428 C TYR A 88 8.704 6.633 5.678 1.00 61.31 C ATOM 1429 O TYR A 88 7.644 7.233 5.864 1.00 63.04 O ATOM 1430 CB TYR A 88 9.690 8.151 3.933 1.00 14.32 C ATOM 1431 CG TYR A 88 10.532 8.344 2.664 1.00 5.24 C ATOM 1432 CD1 TYR A 88 9.930 8.492 1.412 1.00 14.43 C ATOM 1433 CD2 TYR A 88 11.930 8.387 2.719 1.00 61.30 C ATOM 1434 CE1 TYR A 88 10.689 8.672 0.272 1.00 64.34 C ATOM 1435 CE2 TYR A 88 12.688 8.569 1.577 1.00 34.01 C ATOM 1436 CZ TYR A 88 12.063 8.713 0.356 1.00 63.24 C ATOM 1437 OH TYR A 88 12.819 8.895 -0.785 1.00 22.34 O ATOM 0 H TYR A 88 7.613 6.592 3.144 1.00 73.42 H new ATOM 0 HA TYR A 88 10.303 6.103 4.311 1.00 12.14 H new ATOM 0 HB2 TYR A 88 8.749 8.688 3.812 1.00 14.32 H new ATOM 0 HB3 TYR A 88 10.214 8.610 4.772 1.00 14.32 H new ATOM 0 HD1 TYR A 88 8.853 8.465 1.334 1.00 14.43 H new ATOM 0 HD2 TYR A 88 12.426 8.276 3.672 1.00 61.30 H new ATOM 0 HE1 TYR A 88 10.204 8.781 -0.687 1.00 64.34 H new ATOM 0 HE2 TYR A 88 13.766 8.598 1.641 1.00 34.01 H new ATOM 0 HH TYR A 88 13.770 8.901 -0.550 1.00 22.34 H new ATOM 1447 N PHE A 89 9.324 5.935 6.640 1.00 21.13 N ATOM 1448 CA PHE A 89 8.886 5.974 8.048 1.00 22.05 C ATOM 1449 C PHE A 89 9.146 7.384 8.622 1.00 50.35 C ATOM 1450 O PHE A 89 10.291 7.803 8.720 1.00 54.32 O ATOM 1451 CB PHE A 89 9.626 4.902 8.886 1.00 73.14 C ATOM 1452 CG PHE A 89 9.125 4.800 10.328 1.00 34.42 C ATOM 1453 CD1 PHE A 89 7.782 4.515 10.595 1.00 5.04 C ATOM 1454 CD2 PHE A 89 9.977 5.027 11.409 1.00 3.14 C ATOM 1455 CE1 PHE A 89 7.316 4.448 11.893 1.00 21.10 C ATOM 1456 CE2 PHE A 89 9.504 4.961 12.705 1.00 13.12 C ATOM 1457 CZ PHE A 89 8.175 4.675 12.946 1.00 4.51 C ATOM 0 H PHE A 89 10.132 5.335 6.471 1.00 21.13 H new ATOM 0 HA PHE A 89 7.819 5.754 8.095 1.00 22.05 H new ATOM 0 HB2 PHE A 89 9.513 3.932 8.401 1.00 73.14 H new ATOM 0 HB3 PHE A 89 10.691 5.132 8.896 1.00 73.14 H new ATOM 0 HD1 PHE A 89 7.100 4.345 9.775 1.00 5.04 H new ATOM 0 HD2 PHE A 89 11.017 5.257 11.231 1.00 3.14 H new ATOM 0 HE1 PHE A 89 6.278 4.218 12.083 1.00 21.10 H new ATOM 0 HE2 PHE A 89 10.176 5.134 13.533 1.00 13.12 H new ATOM 0 HZ PHE A 89 7.808 4.629 13.961 1.00 4.51 H new ATOM 1467 N ALA A 90 8.072 8.102 8.975 1.00 63.41 N ATOM 1468 CA ALA A 90 8.143 9.528 9.361 1.00 11.21 C ATOM 1469 C ALA A 90 8.290 9.719 10.887 1.00 74.14 C ATOM 1470 O ALA A 90 7.688 8.991 11.681 1.00 44.33 O ATOM 1471 CB ALA A 90 6.908 10.267 8.829 1.00 52.54 C ATOM 0 H ALA A 90 7.128 7.717 9.003 1.00 63.41 H new ATOM 0 HA ALA A 90 9.040 9.953 8.911 1.00 11.21 H new ATOM 0 HB1 ALA A 90 6.962 11.318 9.114 1.00 52.54 H new ATOM 0 HB2 ALA A 90 6.876 10.187 7.742 1.00 52.54 H new ATOM 0 HB3 ALA A 90 6.007 9.822 9.252 1.00 52.54 H new ATOM 1477 N THR A 91 9.091 10.729 11.278 1.00 43.43 N ATOM 1478 CA THR A 91 9.420 11.015 12.691 1.00 13.10 C ATOM 1479 C THR A 91 8.255 11.686 13.468 1.00 4.11 C ATOM 1480 O THR A 91 7.703 11.085 14.397 1.00 11.53 O ATOM 1481 CB THR A 91 10.737 11.868 12.813 1.00 32.32 C ATOM 1482 OG1 THR A 91 10.937 12.285 14.174 1.00 14.44 O ATOM 1483 CG2 THR A 91 10.758 13.100 11.880 1.00 74.13 C ATOM 0 H THR A 91 9.531 11.373 10.621 1.00 43.43 H new ATOM 0 HA THR A 91 9.589 10.046 13.160 1.00 13.10 H new ATOM 0 HB THR A 91 11.553 11.218 12.496 1.00 32.32 H new ATOM 0 HG1 THR A 91 11.760 12.813 14.237 1.00 14.44 H new ATOM 0 HG21 THR A 91 11.694 13.643 12.015 1.00 74.13 H new ATOM 0 HG22 THR A 91 10.675 12.773 10.844 1.00 74.13 H new ATOM 0 HG23 THR A 91 9.921 13.754 12.122 1.00 74.13 H new ATOM 1491 N SER A 92 7.879 12.917 13.060 1.00 3.24 N ATOM 1492 CA SER A 92 6.911 13.782 13.794 1.00 3.42 C ATOM 1493 C SER A 92 6.730 15.139 13.075 1.00 45.23 C ATOM 1494 O SER A 92 5.619 15.673 12.998 1.00 31.41 O ATOM 1495 CB SER A 92 7.373 14.059 15.253 1.00 73.21 C ATOM 1496 OG SER A 92 8.604 14.779 15.287 1.00 64.32 O ATOM 0 H SER A 92 8.237 13.348 12.207 1.00 3.24 H new ATOM 0 HA SER A 92 5.966 13.240 13.816 1.00 3.42 H new ATOM 0 HB2 SER A 92 6.604 14.627 15.777 1.00 73.21 H new ATOM 0 HB3 SER A 92 7.489 13.114 15.784 1.00 73.21 H new ATOM 0 HG SER A 92 8.865 14.938 16.218 1.00 64.32 H new ATOM 1502 N LYS A 93 7.851 15.681 12.533 1.00 15.12 N ATOM 1503 CA LYS A 93 7.910 17.039 11.904 1.00 73.41 C ATOM 1504 C LYS A 93 7.259 17.112 10.487 1.00 72.51 C ATOM 1505 O LYS A 93 7.508 18.069 9.740 1.00 4.42 O ATOM 1506 CB LYS A 93 9.397 17.522 11.818 1.00 71.54 C ATOM 1507 CG LYS A 93 10.176 17.509 13.158 1.00 63.10 C ATOM 1508 CD LYS A 93 11.491 18.332 13.108 1.00 54.03 C ATOM 1509 CE LYS A 93 12.540 17.784 12.118 1.00 42.04 C ATOM 1510 NZ LYS A 93 13.130 16.498 12.574 1.00 24.34 N ATOM 0 H LYS A 93 8.746 15.192 12.517 1.00 15.12 H new ATOM 0 HA LYS A 93 7.324 17.694 12.549 1.00 73.41 H new ATOM 0 HB2 LYS A 93 9.926 16.892 11.103 1.00 71.54 H new ATOM 0 HB3 LYS A 93 9.410 18.536 11.419 1.00 71.54 H new ATOM 0 HG2 LYS A 93 9.536 17.905 13.947 1.00 63.10 H new ATOM 0 HG3 LYS A 93 10.410 16.478 13.425 1.00 63.10 H new ATOM 0 HD2 LYS A 93 11.253 19.360 12.836 1.00 54.03 H new ATOM 0 HD3 LYS A 93 11.928 18.359 14.106 1.00 54.03 H new ATOM 0 HE2 LYS A 93 12.076 17.642 11.142 1.00 42.04 H new ATOM 0 HE3 LYS A 93 13.334 18.520 11.989 1.00 42.04 H new ATOM 0 HZ1 LYS A 93 13.828 16.170 11.877 1.00 24.34 H new ATOM 0 HZ2 LYS A 93 13.597 16.637 13.493 1.00 24.34 H new ATOM 0 HZ3 LYS A 93 12.378 15.786 12.672 1.00 24.34 H new ATOM 1524 N GLY A 94 6.393 16.140 10.140 1.00 2.53 N ATOM 1525 CA GLY A 94 5.833 16.038 8.784 1.00 64.54 C ATOM 1526 C GLY A 94 6.830 15.503 7.750 1.00 11.15 C ATOM 1527 O GLY A 94 6.600 15.608 6.540 1.00 53.21 O ATOM 0 H GLY A 94 6.068 15.416 10.781 1.00 2.53 H new ATOM 0 HA2 GLY A 94 4.961 15.385 8.808 1.00 64.54 H new ATOM 0 HA3 GLY A 94 5.486 17.022 8.468 1.00 64.54 H new ATOM 1531 N GLU A 95 7.933 14.903 8.239 1.00 22.11 N ATOM 1532 CA GLU A 95 9.026 14.381 7.395 1.00 51.14 C ATOM 1533 C GLU A 95 9.550 13.030 7.929 1.00 0.11 C ATOM 1534 O GLU A 95 9.156 12.587 9.009 1.00 62.41 O ATOM 1535 CB GLU A 95 10.193 15.397 7.313 1.00 0.43 C ATOM 1536 CG GLU A 95 10.956 15.641 8.633 1.00 34.42 C ATOM 1537 CD GLU A 95 12.260 16.425 8.420 1.00 23.33 C ATOM 1538 OE1 GLU A 95 13.245 15.821 7.943 1.00 73.33 O ATOM 1539 OE2 GLU A 95 12.308 17.634 8.715 1.00 64.44 O ATOM 0 H GLU A 95 8.092 14.766 9.237 1.00 22.11 H new ATOM 0 HA GLU A 95 8.619 14.226 6.396 1.00 51.14 H new ATOM 0 HB2 GLU A 95 10.903 15.049 6.562 1.00 0.43 H new ATOM 0 HB3 GLU A 95 9.798 16.350 6.960 1.00 0.43 H new ATOM 0 HG2 GLU A 95 10.315 16.188 9.324 1.00 34.42 H new ATOM 0 HG3 GLU A 95 11.184 14.683 9.100 1.00 34.42 H new ATOM 1546 N LYS A 96 10.485 12.430 7.167 1.00 25.52 N ATOM 1547 CA LYS A 96 11.038 11.077 7.423 1.00 24.01 C ATOM 1548 C LYS A 96 11.975 11.019 8.673 1.00 12.11 C ATOM 1549 O LYS A 96 12.408 12.050 9.206 1.00 15.13 O ATOM 1550 CB LYS A 96 11.794 10.574 6.133 1.00 33.13 C ATOM 1551 CG LYS A 96 13.297 10.987 5.973 1.00 44.24 C ATOM 1552 CD LYS A 96 13.588 12.512 6.067 1.00 32.13 C ATOM 1553 CE LYS A 96 12.974 13.336 4.929 1.00 24.54 C ATOM 1554 NZ LYS A 96 13.207 14.790 5.116 1.00 51.34 N ATOM 0 H LYS A 96 10.887 12.875 6.342 1.00 25.52 H new ATOM 0 HA LYS A 96 10.200 10.417 7.649 1.00 24.01 H new ATOM 0 HB2 LYS A 96 11.740 9.486 6.113 1.00 33.13 H new ATOM 0 HB3 LYS A 96 11.250 10.936 5.261 1.00 33.13 H new ATOM 0 HG2 LYS A 96 13.879 10.476 6.740 1.00 44.24 H new ATOM 0 HG3 LYS A 96 13.654 10.626 5.008 1.00 44.24 H new ATOM 0 HD2 LYS A 96 13.209 12.886 7.018 1.00 32.13 H new ATOM 0 HD3 LYS A 96 14.667 12.666 6.072 1.00 32.13 H new ATOM 0 HE2 LYS A 96 13.402 13.018 3.978 1.00 24.54 H new ATOM 0 HE3 LYS A 96 11.902 13.143 4.877 1.00 24.54 H new ATOM 0 HZ1 LYS A 96 12.459 15.327 4.632 1.00 51.34 H new ATOM 0 HZ2 LYS A 96 13.194 15.016 6.131 1.00 51.34 H new ATOM 0 HZ3 LYS A 96 14.132 15.048 4.716 1.00 51.34 H new ATOM 1568 N ASP A 97 12.262 9.788 9.113 1.00 60.44 N ATOM 1569 CA ASP A 97 13.331 9.469 10.075 1.00 32.30 C ATOM 1570 C ASP A 97 14.666 9.325 9.317 1.00 32.22 C ATOM 1571 O ASP A 97 14.816 8.420 8.479 1.00 45.04 O ATOM 1572 CB ASP A 97 12.993 8.148 10.845 1.00 72.02 C ATOM 1573 CG ASP A 97 12.190 8.389 12.130 1.00 43.11 C ATOM 1574 OD1 ASP A 97 12.790 8.882 13.116 1.00 33.01 O ATOM 1575 OD2 ASP A 97 10.977 8.094 12.167 1.00 60.32 O ATOM 0 H ASP A 97 11.746 8.964 8.804 1.00 60.44 H new ATOM 0 HA ASP A 97 13.416 10.274 10.805 1.00 32.30 H new ATOM 0 HB2 ASP A 97 12.427 7.487 10.189 1.00 72.02 H new ATOM 0 HB3 ASP A 97 13.920 7.632 11.094 1.00 72.02 H new ATOM 1580 N THR A 98 15.622 10.234 9.592 1.00 72.03 N ATOM 1581 CA THR A 98 16.987 10.165 9.018 1.00 24.43 C ATOM 1582 C THR A 98 17.765 8.991 9.667 1.00 2.34 C ATOM 1583 O THR A 98 18.527 9.165 10.625 1.00 3.41 O ATOM 1584 CB THR A 98 17.763 11.522 9.189 1.00 11.41 C ATOM 1585 OG1 THR A 98 16.964 12.597 8.661 1.00 3.31 O ATOM 1586 CG2 THR A 98 19.136 11.521 8.471 1.00 50.13 C ATOM 0 H THR A 98 15.476 11.031 10.212 1.00 72.03 H new ATOM 0 HA THR A 98 16.900 9.986 7.946 1.00 24.43 H new ATOM 0 HB THR A 98 17.947 11.655 10.255 1.00 11.41 H new ATOM 0 HG1 THR A 98 17.444 13.445 8.768 1.00 3.31 H new ATOM 0 HG21 THR A 98 19.627 12.482 8.623 1.00 50.13 H new ATOM 0 HG22 THR A 98 19.760 10.726 8.880 1.00 50.13 H new ATOM 0 HG23 THR A 98 18.989 11.354 7.404 1.00 50.13 H new ATOM 1594 N SER A 99 17.505 7.779 9.140 1.00 11.50 N ATOM 1595 CA SER A 99 18.038 6.505 9.673 1.00 54.23 C ATOM 1596 C SER A 99 17.813 5.371 8.649 1.00 55.33 C ATOM 1597 O SER A 99 18.721 4.579 8.363 1.00 44.11 O ATOM 1598 CB SER A 99 17.349 6.134 11.012 1.00 52.24 C ATOM 1599 OG SER A 99 17.901 4.955 11.576 1.00 72.40 O ATOM 0 H SER A 99 16.911 7.653 8.321 1.00 11.50 H new ATOM 0 HA SER A 99 19.106 6.632 9.853 1.00 54.23 H new ATOM 0 HB2 SER A 99 17.455 6.959 11.717 1.00 52.24 H new ATOM 0 HB3 SER A 99 16.281 5.992 10.845 1.00 52.24 H new ATOM 0 HG SER A 99 17.445 4.751 12.419 1.00 72.40 H new ATOM 1605 N MET A 100 16.583 5.312 8.098 1.00 71.32 N ATOM 1606 CA MET A 100 16.170 4.275 7.124 1.00 43.01 C ATOM 1607 C MET A 100 15.749 4.919 5.766 1.00 25.04 C ATOM 1608 O MET A 100 15.229 6.041 5.750 1.00 70.35 O ATOM 1609 CB MET A 100 15.025 3.407 7.734 1.00 72.35 C ATOM 1610 CG MET A 100 13.737 4.153 8.103 1.00 20.31 C ATOM 1611 SD MET A 100 12.516 3.059 8.872 1.00 61.43 S ATOM 1612 CE MET A 100 12.239 1.835 7.581 1.00 33.25 C ATOM 0 H MET A 100 15.845 5.982 8.315 1.00 71.32 H new ATOM 0 HA MET A 100 17.018 3.623 6.915 1.00 43.01 H new ATOM 0 HB2 MET A 100 14.774 2.621 7.022 1.00 72.35 H new ATOM 0 HB3 MET A 100 15.406 2.917 8.630 1.00 72.35 H new ATOM 0 HG2 MET A 100 13.974 4.969 8.786 1.00 20.31 H new ATOM 0 HG3 MET A 100 13.308 4.602 7.207 1.00 20.31 H new ATOM 0 HE1 MET A 100 11.298 1.317 7.767 1.00 33.25 H new ATOM 0 HE2 MET A 100 12.195 2.332 6.612 1.00 33.25 H new ATOM 0 HE3 MET A 100 13.056 1.114 7.582 1.00 33.25 H new ATOM 1622 N PRO A 101 15.990 4.225 4.600 1.00 22.43 N ATOM 1623 CA PRO A 101 15.759 4.802 3.245 1.00 44.11 C ATOM 1624 C PRO A 101 14.297 4.677 2.717 1.00 22.40 C ATOM 1625 O PRO A 101 13.388 4.242 3.436 1.00 75.44 O ATOM 1626 CB PRO A 101 16.734 3.963 2.388 1.00 32.33 C ATOM 1627 CG PRO A 101 16.681 2.597 3.013 1.00 4.31 C ATOM 1628 CD PRO A 101 16.517 2.829 4.506 1.00 74.11 C ATOM 0 HA PRO A 101 15.921 5.880 3.228 1.00 44.11 H new ATOM 0 HB2 PRO A 101 16.426 3.936 1.343 1.00 32.33 H new ATOM 0 HB3 PRO A 101 17.743 4.375 2.412 1.00 32.33 H new ATOM 0 HG2 PRO A 101 15.849 2.017 2.614 1.00 4.31 H new ATOM 0 HG3 PRO A 101 17.591 2.035 2.802 1.00 4.31 H new ATOM 0 HD2 PRO A 101 15.826 2.111 4.948 1.00 74.11 H new ATOM 0 HD3 PRO A 101 17.466 2.724 5.033 1.00 74.11 H new ATOM 1636 N GLY A 102 14.103 5.080 1.442 1.00 64.45 N ATOM 1637 CA GLY A 102 12.804 4.984 0.762 1.00 33.04 C ATOM 1638 C GLY A 102 12.534 3.594 0.171 1.00 34.50 C ATOM 1639 O GLY A 102 13.156 3.208 -0.827 1.00 43.30 O ATOM 0 H GLY A 102 14.842 5.478 0.863 1.00 64.45 H new ATOM 0 HA2 GLY A 102 12.012 5.232 1.469 1.00 33.04 H new ATOM 0 HA3 GLY A 102 12.763 5.726 -0.036 1.00 33.04 H new ATOM 1643 N MET A 103 11.617 2.849 0.808 1.00 24.21 N ATOM 1644 CA MET A 103 11.181 1.507 0.363 1.00 43.10 C ATOM 1645 C MET A 103 10.350 1.606 -0.956 1.00 55.41 C ATOM 1646 O MET A 103 9.188 2.018 -0.944 1.00 30.14 O ATOM 1647 CB MET A 103 10.382 0.848 1.528 1.00 34.53 C ATOM 1648 CG MET A 103 9.742 -0.509 1.233 1.00 62.32 C ATOM 1649 SD MET A 103 8.918 -1.202 2.685 1.00 32.34 S ATOM 1650 CE MET A 103 7.995 -2.560 1.976 1.00 11.33 C ATOM 0 H MET A 103 11.149 3.162 1.658 1.00 24.21 H new ATOM 0 HA MET A 103 12.041 0.879 0.129 1.00 43.10 H new ATOM 0 HB2 MET A 103 11.053 0.731 2.379 1.00 34.53 H new ATOM 0 HB3 MET A 103 9.595 1.537 1.835 1.00 34.53 H new ATOM 0 HG2 MET A 103 9.020 -0.400 0.424 1.00 62.32 H new ATOM 0 HG3 MET A 103 10.508 -1.203 0.886 1.00 62.32 H new ATOM 0 HE1 MET A 103 7.875 -3.347 2.721 1.00 11.33 H new ATOM 0 HE2 MET A 103 7.013 -2.207 1.660 1.00 11.33 H new ATOM 0 HE3 MET A 103 8.533 -2.955 1.115 1.00 11.33 H new ATOM 1660 N HIS A 104 10.978 1.239 -2.091 1.00 13.12 N ATOM 1661 CA HIS A 104 10.419 1.458 -3.451 1.00 4.42 C ATOM 1662 C HIS A 104 9.368 0.384 -3.837 1.00 42.03 C ATOM 1663 O HIS A 104 9.714 -0.765 -4.136 1.00 71.11 O ATOM 1664 CB HIS A 104 11.586 1.487 -4.472 1.00 52.33 C ATOM 1665 CG HIS A 104 11.208 1.786 -5.901 1.00 44.32 C ATOM 1666 ND1 HIS A 104 11.673 1.047 -6.960 1.00 23.35 N ATOM 1667 CD2 HIS A 104 10.486 2.794 -6.451 1.00 32.23 C ATOM 1668 CE1 HIS A 104 11.270 1.578 -8.091 1.00 71.53 C ATOM 1669 NE2 HIS A 104 10.548 2.640 -7.812 1.00 45.12 N ATOM 0 H HIS A 104 11.889 0.781 -2.096 1.00 13.12 H new ATOM 0 HA HIS A 104 9.894 2.413 -3.460 1.00 4.42 H new ATOM 0 HB2 HIS A 104 12.310 2.233 -4.145 1.00 52.33 H new ATOM 0 HB3 HIS A 104 12.090 0.521 -4.445 1.00 52.33 H new ATOM 0 HD1 HIS A 104 12.248 0.208 -6.880 1.00 23.35 H new ATOM 0 HD2 HIS A 104 9.961 3.572 -5.917 1.00 32.23 H new ATOM 0 HE1 HIS A 104 11.493 1.206 -9.080 1.00 71.53 H new ATOM 1678 N ILE A 105 8.077 0.772 -3.800 1.00 72.02 N ATOM 1679 CA ILE A 105 6.943 -0.082 -4.250 1.00 22.11 C ATOM 1680 C ILE A 105 6.476 0.364 -5.662 1.00 2.13 C ATOM 1681 O ILE A 105 6.263 1.553 -5.910 1.00 31.32 O ATOM 1682 CB ILE A 105 5.716 -0.053 -3.225 1.00 22.13 C ATOM 1683 CG1 ILE A 105 5.954 -0.957 -1.973 1.00 73.11 C ATOM 1684 CG2 ILE A 105 4.390 -0.488 -3.891 1.00 32.11 C ATOM 1685 CD1 ILE A 105 7.205 -0.681 -1.189 1.00 23.23 C ATOM 0 H ILE A 105 7.784 1.687 -3.458 1.00 72.02 H new ATOM 0 HA ILE A 105 7.302 -1.110 -4.290 1.00 22.11 H new ATOM 0 HB ILE A 105 5.642 0.986 -2.905 1.00 22.13 H new ATOM 0 HG12 ILE A 105 5.099 -0.850 -1.305 1.00 73.11 H new ATOM 0 HG13 ILE A 105 5.976 -1.997 -2.299 1.00 73.11 H new ATOM 0 HG21 ILE A 105 3.585 -0.453 -3.157 1.00 32.11 H new ATOM 0 HG22 ILE A 105 4.159 0.186 -4.716 1.00 32.11 H new ATOM 0 HG23 ILE A 105 4.490 -1.505 -4.271 1.00 32.11 H new ATOM 0 HD11 ILE A 105 7.264 -1.368 -0.345 1.00 23.23 H new ATOM 0 HD12 ILE A 105 8.075 -0.819 -1.831 1.00 23.23 H new ATOM 0 HD13 ILE A 105 7.185 0.345 -0.821 1.00 23.23 H new ATOM 1697 N THR A 106 6.345 -0.608 -6.581 1.00 44.45 N ATOM 1698 CA THR A 106 5.728 -0.414 -7.910 1.00 71.04 C ATOM 1699 C THR A 106 4.629 -1.471 -8.123 1.00 53.02 C ATOM 1700 O THR A 106 4.925 -2.666 -8.180 1.00 1.50 O ATOM 1701 CB THR A 106 6.790 -0.532 -9.062 1.00 33.52 C ATOM 1702 OG1 THR A 106 7.454 -1.810 -9.010 1.00 75.44 O ATOM 1703 CG2 THR A 106 7.840 0.582 -8.978 1.00 33.21 C ATOM 0 H THR A 106 6.668 -1.563 -6.423 1.00 44.45 H new ATOM 0 HA THR A 106 5.302 0.589 -7.941 1.00 71.04 H new ATOM 0 HB THR A 106 6.252 -0.435 -10.005 1.00 33.52 H new ATOM 0 HG1 THR A 106 8.111 -1.867 -9.735 1.00 75.44 H new ATOM 0 HG21 THR A 106 8.557 0.468 -9.791 1.00 33.21 H new ATOM 0 HG22 THR A 106 7.349 1.552 -9.061 1.00 33.21 H new ATOM 0 HG23 THR A 106 8.361 0.520 -8.023 1.00 33.21 H new ATOM 1711 N LEU A 107 3.363 -1.042 -8.261 1.00 51.04 N ATOM 1712 CA LEU A 107 2.239 -1.976 -8.446 1.00 42.14 C ATOM 1713 C LEU A 107 1.898 -2.042 -9.948 1.00 33.22 C ATOM 1714 O LEU A 107 1.429 -1.068 -10.538 1.00 12.33 O ATOM 1715 CB LEU A 107 0.977 -1.566 -7.617 1.00 4.24 C ATOM 1716 CG LEU A 107 1.180 -1.232 -6.093 1.00 12.45 C ATOM 1717 CD1 LEU A 107 1.675 0.210 -5.890 1.00 24.21 C ATOM 1718 CD2 LEU A 107 -0.119 -1.487 -5.286 1.00 0.34 C ATOM 0 H LEU A 107 3.093 -0.059 -8.248 1.00 51.04 H new ATOM 0 HA LEU A 107 2.543 -2.956 -8.080 1.00 42.14 H new ATOM 0 HB2 LEU A 107 0.531 -0.694 -8.095 1.00 4.24 H new ATOM 0 HB3 LEU A 107 0.251 -2.376 -7.689 1.00 4.24 H new ATOM 0 HG LEU A 107 1.952 -1.903 -5.715 1.00 12.45 H new ATOM 0 HD11 LEU A 107 1.804 0.404 -4.825 1.00 24.21 H new ATOM 0 HD12 LEU A 107 2.629 0.343 -6.401 1.00 24.21 H new ATOM 0 HD13 LEU A 107 0.944 0.907 -6.300 1.00 24.21 H new ATOM 0 HD21 LEU A 107 0.052 -1.247 -4.236 1.00 0.34 H new ATOM 0 HD22 LEU A 107 -0.919 -0.858 -5.676 1.00 0.34 H new ATOM 0 HD23 LEU A 107 -0.404 -2.535 -5.377 1.00 0.34 H new ATOM 1730 N ASN A 108 2.171 -3.206 -10.545 1.00 14.20 N ATOM 1731 CA ASN A 108 1.995 -3.472 -11.980 1.00 75.43 C ATOM 1732 C ASN A 108 0.707 -4.288 -12.210 1.00 61.14 C ATOM 1733 O ASN A 108 0.439 -5.242 -11.469 1.00 72.33 O ATOM 1734 CB ASN A 108 3.228 -4.261 -12.507 1.00 45.20 C ATOM 1735 CG ASN A 108 4.556 -3.533 -12.258 1.00 25.52 C ATOM 1736 OD1 ASN A 108 5.181 -3.682 -11.207 1.00 13.21 O ATOM 1737 ND2 ASN A 108 5.001 -2.750 -13.225 1.00 31.43 N ATOM 0 H ASN A 108 2.530 -4.012 -10.032 1.00 14.20 H new ATOM 0 HA ASN A 108 1.910 -2.528 -12.519 1.00 75.43 H new ATOM 0 HB2 ASN A 108 3.260 -5.238 -12.026 1.00 45.20 H new ATOM 0 HB3 ASN A 108 3.111 -4.436 -13.576 1.00 45.20 H new ATOM 0 HD21 ASN A 108 5.883 -2.250 -13.111 1.00 31.43 H new ATOM 0 HD22 ASN A 108 4.463 -2.645 -14.085 1.00 31.43 H new ATOM 1744 N PHE A 109 -0.081 -3.899 -13.228 1.00 4.05 N ATOM 1745 CA PHE A 109 -1.304 -4.626 -13.647 1.00 12.14 C ATOM 1746 C PHE A 109 -0.990 -6.095 -14.030 1.00 53.35 C ATOM 1747 O PHE A 109 0.074 -6.391 -14.593 1.00 24.34 O ATOM 1748 CB PHE A 109 -1.987 -3.890 -14.842 1.00 75.21 C ATOM 1749 CG PHE A 109 -1.130 -3.799 -16.119 1.00 74.53 C ATOM 1750 CD1 PHE A 109 -0.086 -2.871 -16.226 1.00 55.21 C ATOM 1751 CD2 PHE A 109 -1.362 -4.647 -17.210 1.00 22.14 C ATOM 1752 CE1 PHE A 109 0.689 -2.797 -17.370 1.00 54.30 C ATOM 1753 CE2 PHE A 109 -0.586 -4.569 -18.353 1.00 53.32 C ATOM 1754 CZ PHE A 109 0.438 -3.647 -18.432 1.00 51.25 C ATOM 0 H PHE A 109 0.109 -3.069 -13.789 1.00 4.05 H new ATOM 0 HA PHE A 109 -1.989 -4.642 -12.799 1.00 12.14 H new ATOM 0 HB2 PHE A 109 -2.918 -4.403 -15.082 1.00 75.21 H new ATOM 0 HB3 PHE A 109 -2.251 -2.881 -14.526 1.00 75.21 H new ATOM 0 HD1 PHE A 109 0.117 -2.203 -15.402 1.00 55.21 H new ATOM 0 HD2 PHE A 109 -2.160 -5.373 -17.158 1.00 22.14 H new ATOM 0 HE1 PHE A 109 1.490 -2.075 -17.434 1.00 54.30 H new ATOM 0 HE2 PHE A 109 -0.782 -5.230 -19.184 1.00 53.32 H new ATOM 0 HZ PHE A 109 1.044 -3.589 -19.324 1.00 51.25 H new ATOM 1764 N GLU A 110 -1.916 -7.004 -13.718 1.00 32.43 N ATOM 1765 CA GLU A 110 -1.787 -8.439 -14.059 1.00 34.31 C ATOM 1766 C GLU A 110 -3.148 -8.971 -14.594 1.00 33.24 C ATOM 1767 O GLU A 110 -4.157 -8.262 -14.514 1.00 44.35 O ATOM 1768 CB GLU A 110 -1.269 -9.224 -12.813 1.00 3.32 C ATOM 1769 CG GLU A 110 -0.820 -10.677 -13.094 1.00 5.51 C ATOM 1770 CD GLU A 110 -0.154 -11.359 -11.888 1.00 20.42 C ATOM 1771 OE1 GLU A 110 -0.856 -11.672 -10.908 1.00 62.23 O ATOM 1772 OE2 GLU A 110 1.075 -11.587 -11.918 1.00 64.01 O ATOM 0 H GLU A 110 -2.778 -6.776 -13.223 1.00 32.43 H new ATOM 0 HA GLU A 110 -1.056 -8.584 -14.854 1.00 34.31 H new ATOM 0 HB2 GLU A 110 -0.430 -8.678 -12.382 1.00 3.32 H new ATOM 0 HB3 GLU A 110 -2.058 -9.243 -12.061 1.00 3.32 H new ATOM 0 HG2 GLU A 110 -1.686 -11.264 -13.400 1.00 5.51 H new ATOM 0 HG3 GLU A 110 -0.123 -10.677 -13.932 1.00 5.51 H new ATOM 1832 N GLY A 114 -11.973 -10.973 -15.199 1.00 35.43 N ATOM 1833 CA GLY A 114 -13.281 -10.583 -14.635 1.00 63.12 C ATOM 1834 C GLY A 114 -13.115 -9.920 -13.266 1.00 13.22 C ATOM 1835 O GLY A 114 -13.743 -8.898 -12.965 1.00 33.24 O ATOM 0 HA2 GLY A 114 -13.784 -9.897 -15.316 1.00 63.12 H new ATOM 0 HA3 GLY A 114 -13.917 -11.463 -14.542 1.00 63.12 H new ATOM 1839 N LYS A 115 -12.249 -10.520 -12.439 1.00 23.54 N ATOM 1840 CA LYS A 115 -11.878 -10.013 -11.099 1.00 61.13 C ATOM 1841 C LYS A 115 -10.531 -9.241 -11.175 1.00 42.14 C ATOM 1842 O LYS A 115 -9.560 -9.746 -11.763 1.00 63.11 O ATOM 1843 CB LYS A 115 -11.767 -11.219 -10.134 1.00 54.32 C ATOM 1844 CG LYS A 115 -13.080 -12.020 -9.938 1.00 73.04 C ATOM 1845 CD LYS A 115 -12.848 -13.421 -9.315 1.00 1.13 C ATOM 1846 CE LYS A 115 -12.154 -13.379 -7.941 1.00 35.10 C ATOM 1847 NZ LYS A 115 -11.946 -14.742 -7.387 1.00 13.04 N ATOM 0 H LYS A 115 -11.774 -11.389 -12.682 1.00 23.54 H new ATOM 0 HA LYS A 115 -12.638 -9.323 -10.733 1.00 61.13 H new ATOM 0 HB2 LYS A 115 -10.998 -11.895 -10.508 1.00 54.32 H new ATOM 0 HB3 LYS A 115 -11.430 -10.859 -9.162 1.00 54.32 H new ATOM 0 HG2 LYS A 115 -13.754 -11.451 -9.298 1.00 73.04 H new ATOM 0 HG3 LYS A 115 -13.576 -12.135 -10.902 1.00 73.04 H new ATOM 0 HD2 LYS A 115 -13.808 -13.927 -9.212 1.00 1.13 H new ATOM 0 HD3 LYS A 115 -12.245 -14.018 -9.999 1.00 1.13 H new ATOM 0 HE2 LYS A 115 -11.193 -12.874 -8.034 1.00 35.10 H new ATOM 0 HE3 LYS A 115 -12.756 -12.792 -7.247 1.00 35.10 H new ATOM 0 HZ1 LYS A 115 -11.476 -14.673 -6.462 1.00 13.04 H new ATOM 0 HZ2 LYS A 115 -12.865 -15.215 -7.274 1.00 13.04 H new ATOM 0 HZ3 LYS A 115 -11.350 -15.294 -8.037 1.00 13.04 H new ATOM 1861 N THR A 116 -10.479 -8.032 -10.576 1.00 31.24 N ATOM 1862 CA THR A 116 -9.300 -7.121 -10.676 1.00 12.40 C ATOM 1863 C THR A 116 -8.034 -7.715 -10.004 1.00 75.45 C ATOM 1864 O THR A 116 -8.029 -7.957 -8.802 1.00 71.14 O ATOM 1865 CB THR A 116 -9.592 -5.720 -10.036 1.00 1.40 C ATOM 1866 OG1 THR A 116 -10.755 -5.130 -10.636 1.00 31.23 O ATOM 1867 CG2 THR A 116 -8.402 -4.751 -10.195 1.00 64.12 C ATOM 0 H THR A 116 -11.241 -7.655 -10.013 1.00 31.24 H new ATOM 0 HA THR A 116 -9.112 -7.004 -11.743 1.00 12.40 H new ATOM 0 HB THR A 116 -9.761 -5.886 -8.972 1.00 1.40 H new ATOM 0 HG1 THR A 116 -11.493 -5.133 -9.991 1.00 31.23 H new ATOM 0 HG21 THR A 116 -8.649 -3.793 -9.737 1.00 64.12 H new ATOM 0 HG22 THR A 116 -7.523 -5.171 -9.706 1.00 64.12 H new ATOM 0 HG23 THR A 116 -8.192 -4.603 -11.254 1.00 64.12 H new ATOM 1875 N THR A 117 -6.960 -7.912 -10.789 1.00 71.14 N ATOM 1876 CA THR A 117 -5.673 -8.443 -10.281 1.00 35.42 C ATOM 1877 C THR A 117 -4.538 -7.416 -10.483 1.00 22.34 C ATOM 1878 O THR A 117 -4.306 -6.949 -11.606 1.00 34.14 O ATOM 1879 CB THR A 117 -5.291 -9.790 -10.984 1.00 40.31 C ATOM 1880 OG1 THR A 117 -6.359 -10.744 -10.827 1.00 45.52 O ATOM 1881 CG2 THR A 117 -3.991 -10.396 -10.409 1.00 33.51 C ATOM 0 H THR A 117 -6.955 -7.710 -11.789 1.00 71.14 H new ATOM 0 HA THR A 117 -5.801 -8.632 -9.215 1.00 35.42 H new ATOM 0 HB THR A 117 -5.128 -9.569 -12.039 1.00 40.31 H new ATOM 0 HG1 THR A 117 -6.115 -11.584 -11.270 1.00 45.52 H new ATOM 0 HG21 THR A 117 -3.765 -11.329 -10.926 1.00 33.51 H new ATOM 0 HG22 THR A 117 -3.169 -9.694 -10.550 1.00 33.51 H new ATOM 0 HG23 THR A 117 -4.121 -10.593 -9.345 1.00 33.51 H new ATOM 1889 N VAL A 118 -3.836 -7.068 -9.388 1.00 22.01 N ATOM 1890 CA VAL A 118 -2.649 -6.183 -9.433 1.00 34.11 C ATOM 1891 C VAL A 118 -1.531 -6.747 -8.514 1.00 74.13 C ATOM 1892 O VAL A 118 -1.788 -7.217 -7.396 1.00 10.42 O ATOM 1893 CB VAL A 118 -3.009 -4.683 -9.060 1.00 21.30 C ATOM 1894 CG1 VAL A 118 -3.484 -4.538 -7.593 1.00 5.20 C ATOM 1895 CG2 VAL A 118 -1.827 -3.721 -9.369 1.00 54.01 C ATOM 0 H VAL A 118 -4.072 -7.389 -8.449 1.00 22.01 H new ATOM 0 HA VAL A 118 -2.280 -6.165 -10.458 1.00 34.11 H new ATOM 0 HB VAL A 118 -3.848 -4.396 -9.693 1.00 21.30 H new ATOM 0 HG11 VAL A 118 -3.718 -3.493 -7.388 1.00 5.20 H new ATOM 0 HG12 VAL A 118 -4.375 -5.147 -7.437 1.00 5.20 H new ATOM 0 HG13 VAL A 118 -2.694 -4.872 -6.920 1.00 5.20 H new ATOM 0 HG21 VAL A 118 -2.108 -2.702 -9.102 1.00 54.01 H new ATOM 0 HG22 VAL A 118 -0.953 -4.020 -8.790 1.00 54.01 H new ATOM 0 HG23 VAL A 118 -1.590 -3.765 -10.432 1.00 54.01 H new ATOM 1905 N THR A 119 -0.301 -6.752 -9.034 1.00 62.13 N ATOM 1906 CA THR A 119 0.903 -7.231 -8.314 1.00 33.32 C ATOM 1907 C THR A 119 1.757 -6.056 -7.758 1.00 51.21 C ATOM 1908 O THR A 119 2.312 -5.275 -8.526 1.00 54.33 O ATOM 1909 CB THR A 119 1.763 -8.122 -9.271 1.00 51.25 C ATOM 1910 OG1 THR A 119 1.032 -9.312 -9.622 1.00 13.12 O ATOM 1911 CG2 THR A 119 3.112 -8.535 -8.662 1.00 72.41 C ATOM 0 H THR A 119 -0.101 -6.421 -9.978 1.00 62.13 H new ATOM 0 HA THR A 119 0.572 -7.820 -7.459 1.00 33.32 H new ATOM 0 HB THR A 119 1.970 -7.515 -10.153 1.00 51.25 H new ATOM 0 HG1 THR A 119 1.575 -9.864 -10.222 1.00 13.12 H new ATOM 0 HG21 THR A 119 3.660 -9.151 -9.375 1.00 72.41 H new ATOM 0 HG22 THR A 119 3.695 -7.643 -8.430 1.00 72.41 H new ATOM 0 HG23 THR A 119 2.940 -9.104 -7.748 1.00 72.41 H new ATOM 1919 N SER A 120 1.861 -5.952 -6.415 1.00 64.30 N ATOM 1920 CA SER A 120 2.685 -4.922 -5.731 1.00 54.25 C ATOM 1921 C SER A 120 4.145 -5.416 -5.517 1.00 42.13 C ATOM 1922 O SER A 120 4.401 -6.308 -4.711 1.00 30.12 O ATOM 1923 CB SER A 120 2.034 -4.543 -4.374 1.00 53.31 C ATOM 1924 OG SER A 120 2.118 -5.577 -3.408 1.00 22.45 O ATOM 0 H SER A 120 1.377 -6.578 -5.771 1.00 64.30 H new ATOM 0 HA SER A 120 2.726 -4.038 -6.367 1.00 54.25 H new ATOM 0 HB2 SER A 120 2.519 -3.648 -3.983 1.00 53.31 H new ATOM 0 HB3 SER A 120 0.986 -4.292 -4.538 1.00 53.31 H new ATOM 0 HG SER A 120 1.694 -5.282 -2.575 1.00 22.45 H new ATOM 1930 N THR A 121 5.100 -4.817 -6.239 1.00 62.23 N ATOM 1931 CA THR A 121 6.534 -5.199 -6.177 1.00 35.20 C ATOM 1932 C THR A 121 7.300 -4.264 -5.207 1.00 30.21 C ATOM 1933 O THR A 121 7.563 -3.106 -5.526 1.00 22.50 O ATOM 1934 CB THR A 121 7.184 -5.152 -7.604 1.00 73.05 C ATOM 1935 OG1 THR A 121 6.414 -5.956 -8.520 1.00 61.31 O ATOM 1936 CG2 THR A 121 8.640 -5.654 -7.600 1.00 1.42 C ATOM 0 H THR A 121 4.910 -4.052 -6.886 1.00 62.23 H new ATOM 0 HA THR A 121 6.599 -6.221 -5.803 1.00 35.20 H new ATOM 0 HB THR A 121 7.187 -4.109 -7.920 1.00 73.05 H new ATOM 0 HG1 THR A 121 6.824 -5.921 -9.410 1.00 61.31 H new ATOM 0 HG21 THR A 121 9.046 -5.602 -8.610 1.00 1.42 H new ATOM 0 HG22 THR A 121 9.238 -5.030 -6.936 1.00 1.42 H new ATOM 0 HG23 THR A 121 8.668 -6.686 -7.251 1.00 1.42 H new ATOM 1944 N SER A 122 7.641 -4.781 -4.017 1.00 3.33 N ATOM 1945 CA SER A 122 8.293 -4.001 -2.932 1.00 14.12 C ATOM 1946 C SER A 122 9.823 -4.129 -2.993 1.00 12.50 C ATOM 1947 O SER A 122 10.335 -5.160 -3.409 1.00 12.01 O ATOM 1948 CB SER A 122 7.811 -4.499 -1.554 1.00 52.00 C ATOM 1949 OG SER A 122 8.290 -5.803 -1.270 1.00 43.32 O ATOM 0 H SER A 122 7.475 -5.757 -3.770 1.00 3.33 H new ATOM 0 HA SER A 122 8.018 -2.955 -3.071 1.00 14.12 H new ATOM 0 HB2 SER A 122 8.149 -3.811 -0.780 1.00 52.00 H new ATOM 0 HB3 SER A 122 6.721 -4.498 -1.528 1.00 52.00 H new ATOM 0 HG SER A 122 7.934 -6.433 -1.930 1.00 43.32 H new ATOM 1955 N THR A 123 10.551 -3.079 -2.590 1.00 72.24 N ATOM 1956 CA THR A 123 12.023 -3.152 -2.432 1.00 43.10 C ATOM 1957 C THR A 123 12.434 -2.740 -0.996 1.00 21.54 C ATOM 1958 O THR A 123 12.437 -1.556 -0.646 1.00 2.20 O ATOM 1959 CB THR A 123 12.773 -2.282 -3.496 1.00 14.14 C ATOM 1960 OG1 THR A 123 12.213 -2.528 -4.797 1.00 72.14 O ATOM 1961 CG2 THR A 123 14.285 -2.597 -3.539 1.00 12.02 C ATOM 0 H THR A 123 10.152 -2.167 -2.366 1.00 72.24 H new ATOM 0 HA THR A 123 12.319 -4.188 -2.599 1.00 43.10 H new ATOM 0 HB THR A 123 12.649 -1.237 -3.212 1.00 14.14 H new ATOM 0 HG1 THR A 123 11.355 -2.061 -4.878 1.00 72.14 H new ATOM 0 HG21 THR A 123 14.766 -1.971 -4.291 1.00 12.02 H new ATOM 0 HG22 THR A 123 14.726 -2.396 -2.563 1.00 12.02 H new ATOM 0 HG23 THR A 123 14.431 -3.647 -3.794 1.00 12.02 H new ATOM 1969 N PHE A 124 12.731 -3.759 -0.173 1.00 11.32 N ATOM 1970 CA PHE A 124 13.230 -3.619 1.217 1.00 1.35 C ATOM 1971 C PHE A 124 14.715 -3.125 1.260 1.00 74.34 C ATOM 1972 O PHE A 124 15.425 -3.223 0.253 1.00 43.24 O ATOM 1973 CB PHE A 124 13.066 -4.992 1.950 1.00 60.10 C ATOM 1974 CG PHE A 124 11.634 -5.314 2.382 1.00 63.24 C ATOM 1975 CD1 PHE A 124 10.636 -5.572 1.440 1.00 51.54 C ATOM 1976 CD2 PHE A 124 11.292 -5.383 3.737 1.00 42.11 C ATOM 1977 CE1 PHE A 124 9.352 -5.889 1.839 1.00 20.35 C ATOM 1978 CE2 PHE A 124 10.007 -5.694 4.131 1.00 61.43 C ATOM 1979 CZ PHE A 124 9.037 -5.947 3.183 1.00 41.31 C ATOM 0 H PHE A 124 12.630 -4.733 -0.458 1.00 11.32 H new ATOM 0 HA PHE A 124 12.641 -2.858 1.729 1.00 1.35 H new ATOM 0 HB2 PHE A 124 13.421 -5.785 1.292 1.00 60.10 H new ATOM 0 HB3 PHE A 124 13.708 -4.998 2.831 1.00 60.10 H new ATOM 0 HD1 PHE A 124 10.871 -5.523 0.387 1.00 51.54 H new ATOM 0 HD2 PHE A 124 12.046 -5.190 4.486 1.00 42.11 H new ATOM 0 HE1 PHE A 124 8.592 -6.092 1.099 1.00 20.35 H new ATOM 0 HE2 PHE A 124 9.760 -5.739 5.181 1.00 61.43 H new ATOM 0 HZ PHE A 124 8.031 -6.190 3.492 1.00 41.31 H new ATOM 1989 N PRO A 125 15.208 -2.598 2.445 1.00 63.51 N ATOM 1990 CA PRO A 125 16.571 -1.988 2.577 1.00 54.31 C ATOM 1991 C PRO A 125 17.755 -3.011 2.605 1.00 60.13 C ATOM 1992 O PRO A 125 18.426 -3.174 3.636 1.00 50.23 O ATOM 1993 CB PRO A 125 16.458 -1.201 3.914 1.00 44.43 C ATOM 1994 CG PRO A 125 15.494 -2.008 4.733 1.00 44.12 C ATOM 1995 CD PRO A 125 14.465 -2.530 3.746 1.00 51.43 C ATOM 0 HA PRO A 125 16.819 -1.378 1.709 1.00 54.31 H new ATOM 0 HB2 PRO A 125 17.426 -1.114 4.408 1.00 44.43 H new ATOM 0 HB3 PRO A 125 16.091 -0.188 3.750 1.00 44.43 H new ATOM 0 HG2 PRO A 125 16.001 -2.828 5.242 1.00 44.12 H new ATOM 0 HG3 PRO A 125 15.025 -1.396 5.503 1.00 44.12 H new ATOM 0 HD2 PRO A 125 14.089 -3.509 4.042 1.00 51.43 H new ATOM 0 HD3 PRO A 125 13.604 -1.865 3.679 1.00 51.43 H new ATOM 2003 N THR A 126 17.990 -3.661 1.443 1.00 60.14 N ATOM 2004 CA THR A 126 19.143 -4.571 1.136 1.00 33.34 C ATOM 2005 C THR A 126 19.452 -5.673 2.206 1.00 72.31 C ATOM 2006 O THR A 126 18.726 -5.820 3.188 1.00 62.31 O ATOM 2007 CB THR A 126 20.445 -3.761 0.740 1.00 22.34 C ATOM 2008 OG1 THR A 126 21.394 -4.626 0.084 1.00 51.43 O ATOM 2009 CG2 THR A 126 21.132 -3.083 1.944 1.00 41.51 C ATOM 0 H THR A 126 17.357 -3.568 0.648 1.00 60.14 H new ATOM 0 HA THR A 126 18.801 -5.135 0.268 1.00 33.34 H new ATOM 0 HB THR A 126 20.115 -2.972 0.064 1.00 22.34 H new ATOM 0 HG1 THR A 126 22.193 -4.112 -0.157 1.00 51.43 H new ATOM 0 HG21 THR A 126 22.017 -2.545 1.603 1.00 41.51 H new ATOM 0 HG22 THR A 126 20.440 -2.383 2.411 1.00 41.51 H new ATOM 0 HG23 THR A 126 21.426 -3.841 2.670 1.00 41.51 H new ATOM 2017 N GLU A 127 20.483 -6.511 1.922 1.00 31.54 N ATOM 2018 CA GLU A 127 21.014 -7.545 2.855 1.00 11.02 C ATOM 2019 C GLU A 127 19.921 -8.596 3.234 1.00 31.42 C ATOM 2020 O GLU A 127 19.854 -9.087 4.374 1.00 35.13 O ATOM 2021 CB GLU A 127 21.657 -6.856 4.104 1.00 42.34 C ATOM 2022 CG GLU A 127 22.574 -7.764 4.955 1.00 23.54 C ATOM 2023 CD GLU A 127 23.172 -7.042 6.172 1.00 23.15 C ATOM 2024 OE1 GLU A 127 22.519 -7.007 7.233 1.00 51.45 O ATOM 2025 OE2 GLU A 127 24.294 -6.495 6.071 1.00 12.33 O ATOM 0 H GLU A 127 20.976 -6.489 1.029 1.00 31.54 H new ATOM 0 HA GLU A 127 21.799 -8.107 2.350 1.00 11.02 H new ATOM 0 HB2 GLU A 127 22.235 -5.996 3.767 1.00 42.34 H new ATOM 0 HB3 GLU A 127 20.858 -6.474 4.740 1.00 42.34 H new ATOM 0 HG2 GLU A 127 22.004 -8.629 5.296 1.00 23.54 H new ATOM 0 HG3 GLU A 127 23.383 -8.142 4.330 1.00 23.54 H new ATOM 2032 N SER A 128 19.072 -8.930 2.234 1.00 20.11 N ATOM 2033 CA SER A 128 17.963 -9.914 2.363 1.00 72.15 C ATOM 2034 C SER A 128 16.903 -9.500 3.413 1.00 43.50 C ATOM 2035 O SER A 128 16.190 -10.350 3.936 1.00 3.12 O ATOM 2036 CB SER A 128 18.527 -11.333 2.661 1.00 65.15 C ATOM 2037 OG SER A 128 19.446 -11.746 1.657 1.00 24.31 O ATOM 0 H SER A 128 19.136 -8.521 1.302 1.00 20.11 H new ATOM 0 HA SER A 128 17.445 -9.934 1.404 1.00 72.15 H new ATOM 0 HB2 SER A 128 19.022 -11.333 3.632 1.00 65.15 H new ATOM 0 HB3 SER A 128 17.706 -12.047 2.721 1.00 65.15 H new ATOM 0 HG SER A 128 19.785 -12.640 1.872 1.00 24.31 H new ATOM 2043 N ALA A 129 16.769 -8.177 3.670 1.00 20.31 N ATOM 2044 CA ALA A 129 15.789 -7.620 4.651 1.00 41.32 C ATOM 2045 C ALA A 129 14.336 -8.111 4.397 1.00 22.24 C ATOM 2046 O ALA A 129 13.551 -8.297 5.333 1.00 42.31 O ATOM 2047 CB ALA A 129 15.845 -6.081 4.638 1.00 10.44 C ATOM 0 H ALA A 129 17.332 -7.463 3.208 1.00 20.31 H new ATOM 0 HA ALA A 129 16.077 -7.989 5.635 1.00 41.32 H new ATOM 0 HB1 ALA A 129 15.127 -5.685 5.356 1.00 10.44 H new ATOM 0 HB2 ALA A 129 16.848 -5.751 4.908 1.00 10.44 H new ATOM 0 HB3 ALA A 129 15.599 -5.716 3.641 1.00 10.44 H new ATOM 2053 N ALA A 130 14.012 -8.329 3.113 1.00 14.43 N ATOM 2054 CA ALA A 130 12.707 -8.885 2.685 1.00 4.13 C ATOM 2055 C ALA A 130 12.577 -10.397 2.979 1.00 21.22 C ATOM 2056 O ALA A 130 11.494 -10.872 3.332 1.00 4.14 O ATOM 2057 CB ALA A 130 12.506 -8.615 1.202 1.00 72.02 C ATOM 0 H ALA A 130 14.643 -8.127 2.338 1.00 14.43 H new ATOM 0 HA ALA A 130 11.930 -8.388 3.265 1.00 4.13 H new ATOM 0 HB1 ALA A 130 11.546 -9.023 0.885 1.00 72.02 H new ATOM 0 HB2 ALA A 130 12.520 -7.540 1.023 1.00 72.02 H new ATOM 0 HB3 ALA A 130 13.307 -9.088 0.634 1.00 72.02 H new ATOM 2063 N GLN A 131 13.686 -11.142 2.799 1.00 41.23 N ATOM 2064 CA GLN A 131 13.750 -12.588 3.144 1.00 0.02 C ATOM 2065 C GLN A 131 13.482 -12.813 4.647 1.00 15.40 C ATOM 2066 O GLN A 131 12.678 -13.675 5.014 1.00 54.11 O ATOM 2067 CB GLN A 131 15.127 -13.198 2.765 1.00 54.41 C ATOM 2068 CG GLN A 131 15.346 -14.658 3.231 1.00 1.33 C ATOM 2069 CD GLN A 131 14.401 -15.672 2.566 1.00 4.42 C ATOM 2070 OE1 GLN A 131 14.689 -16.199 1.499 1.00 3.44 O ATOM 2071 NE2 GLN A 131 13.281 -15.968 3.206 1.00 72.42 N ATOM 0 H GLN A 131 14.555 -10.770 2.416 1.00 41.23 H new ATOM 0 HA GLN A 131 12.974 -13.090 2.567 1.00 0.02 H new ATOM 0 HB2 GLN A 131 15.240 -13.157 1.682 1.00 54.41 H new ATOM 0 HB3 GLN A 131 15.913 -12.575 3.191 1.00 54.41 H new ATOM 0 HG2 GLN A 131 16.377 -14.945 3.022 1.00 1.33 H new ATOM 0 HG3 GLN A 131 15.214 -14.708 4.312 1.00 1.33 H new ATOM 0 HE21 GLN A 131 13.066 -15.514 4.094 1.00 72.42 H new ATOM 0 HE22 GLN A 131 12.633 -16.650 2.812 1.00 72.42 H new ATOM 2080 N GLN A 132 14.171 -12.031 5.506 1.00 13.02 N ATOM 2081 CA GLN A 132 13.955 -12.089 6.975 1.00 52.35 C ATOM 2082 C GLN A 132 12.462 -11.849 7.345 1.00 11.51 C ATOM 2083 O GLN A 132 11.940 -12.447 8.293 1.00 64.03 O ATOM 2084 CB GLN A 132 14.855 -11.068 7.739 1.00 61.55 C ATOM 2085 CG GLN A 132 16.334 -11.476 7.926 1.00 71.03 C ATOM 2086 CD GLN A 132 17.193 -11.381 6.668 1.00 35.50 C ATOM 2087 OE1 GLN A 132 17.309 -12.328 5.895 1.00 54.32 O ATOM 2088 NE2 GLN A 132 17.801 -10.226 6.452 1.00 11.33 N ATOM 0 H GLN A 132 14.877 -11.356 5.214 1.00 13.02 H new ATOM 0 HA GLN A 132 14.236 -13.095 7.285 1.00 52.35 H new ATOM 0 HB2 GLN A 132 14.826 -10.118 7.206 1.00 61.55 H new ATOM 0 HB3 GLN A 132 14.419 -10.895 8.723 1.00 61.55 H new ATOM 0 HG2 GLN A 132 16.775 -10.844 8.697 1.00 71.03 H new ATOM 0 HG3 GLN A 132 16.369 -12.501 8.295 1.00 71.03 H new ATOM 0 HE21 GLN A 132 17.685 -9.457 7.113 1.00 11.33 H new ATOM 0 HE22 GLN A 132 18.385 -10.104 5.625 1.00 11.33 H new ATOM 2097 N ALA A 133 11.795 -10.977 6.562 1.00 51.42 N ATOM 2098 CA ALA A 133 10.370 -10.649 6.748 1.00 74.32 C ATOM 2099 C ALA A 133 9.451 -11.865 6.428 1.00 4.11 C ATOM 2100 O ALA A 133 8.368 -11.996 7.006 1.00 71.10 O ATOM 2101 CB ALA A 133 10.000 -9.427 5.892 1.00 0.34 C ATOM 0 H ALA A 133 12.230 -10.482 5.784 1.00 51.42 H new ATOM 0 HA ALA A 133 10.209 -10.403 7.798 1.00 74.32 H new ATOM 0 HB1 ALA A 133 8.946 -9.189 6.034 1.00 0.34 H new ATOM 0 HB2 ALA A 133 10.608 -8.574 6.194 1.00 0.34 H new ATOM 0 HB3 ALA A 133 10.184 -9.650 4.841 1.00 0.34 H new ATOM 2107 N ILE A 134 9.892 -12.748 5.511 1.00 13.44 N ATOM 2108 CA ILE A 134 9.135 -13.979 5.143 1.00 2.33 C ATOM 2109 C ILE A 134 9.113 -14.980 6.316 1.00 3.55 C ATOM 2110 O ILE A 134 8.066 -15.554 6.639 1.00 52.22 O ATOM 2111 CB ILE A 134 9.725 -14.671 3.857 1.00 21.02 C ATOM 2112 CG1 ILE A 134 9.867 -13.643 2.698 1.00 54.31 C ATOM 2113 CG2 ILE A 134 8.859 -15.882 3.412 1.00 64.55 C ATOM 2114 CD1 ILE A 134 8.579 -12.943 2.312 1.00 35.41 C ATOM 0 H ILE A 134 10.771 -12.638 5.005 1.00 13.44 H new ATOM 0 HA ILE A 134 8.114 -13.670 4.918 1.00 2.33 H new ATOM 0 HB ILE A 134 10.716 -15.049 4.110 1.00 21.02 H new ATOM 0 HG12 ILE A 134 10.602 -12.891 2.986 1.00 54.31 H new ATOM 0 HG13 ILE A 134 10.263 -14.156 1.822 1.00 54.31 H new ATOM 0 HG21 ILE A 134 9.296 -16.335 2.522 1.00 64.55 H new ATOM 0 HG22 ILE A 134 8.825 -16.619 4.214 1.00 64.55 H new ATOM 0 HG23 ILE A 134 7.848 -15.543 3.187 1.00 64.55 H new ATOM 0 HD11 ILE A 134 8.774 -12.246 1.497 1.00 35.41 H new ATOM 0 HD12 ILE A 134 7.846 -13.682 1.989 1.00 35.41 H new ATOM 0 HD13 ILE A 134 8.190 -12.397 3.171 1.00 35.41 H new ATOM 2126 N ASP A 135 10.282 -15.157 6.955 1.00 34.31 N ATOM 2127 CA ASP A 135 10.422 -15.968 8.186 1.00 23.10 C ATOM 2128 C ASP A 135 9.634 -15.350 9.376 1.00 34.33 C ATOM 2129 O ASP A 135 9.249 -16.059 10.305 1.00 22.32 O ATOM 2130 CB ASP A 135 11.920 -16.115 8.537 1.00 51.42 C ATOM 2131 CG ASP A 135 12.708 -16.875 7.453 1.00 31.23 C ATOM 2132 OD1 ASP A 135 13.057 -16.269 6.414 1.00 73.21 O ATOM 2133 OD2 ASP A 135 12.968 -18.089 7.626 1.00 72.21 O ATOM 0 H ASP A 135 11.158 -14.744 6.636 1.00 34.31 H new ATOM 0 HA ASP A 135 9.995 -16.953 7.999 1.00 23.10 H new ATOM 0 HB2 ASP A 135 12.357 -15.126 8.673 1.00 51.42 H new ATOM 0 HB3 ASP A 135 12.017 -16.640 9.487 1.00 51.42 H new ATOM 2138 N MET A 136 9.420 -14.018 9.328 1.00 43.00 N ATOM 2139 CA MET A 136 8.557 -13.285 10.289 1.00 11.43 C ATOM 2140 C MET A 136 7.041 -13.545 10.015 1.00 71.22 C ATOM 2141 O MET A 136 6.216 -13.496 10.935 1.00 32.10 O ATOM 2142 CB MET A 136 8.887 -11.767 10.207 1.00 13.10 C ATOM 2143 CG MET A 136 8.081 -10.855 11.145 1.00 31.15 C ATOM 2144 SD MET A 136 8.523 -9.107 10.985 1.00 74.21 S ATOM 2145 CE MET A 136 8.032 -8.738 9.296 1.00 22.22 C ATOM 0 H MET A 136 9.841 -13.415 8.621 1.00 43.00 H new ATOM 0 HA MET A 136 8.761 -13.648 11.296 1.00 11.43 H new ATOM 0 HB2 MET A 136 9.947 -11.633 10.423 1.00 13.10 H new ATOM 0 HB3 MET A 136 8.726 -11.435 9.181 1.00 13.10 H new ATOM 0 HG2 MET A 136 7.018 -10.976 10.935 1.00 31.15 H new ATOM 0 HG3 MET A 136 8.241 -11.171 12.176 1.00 31.15 H new ATOM 0 HE1 MET A 136 7.496 -7.789 9.272 1.00 22.22 H new ATOM 0 HE2 MET A 136 8.919 -8.670 8.666 1.00 22.22 H new ATOM 0 HE3 MET A 136 7.383 -9.531 8.924 1.00 22.22 H new ATOM 2155 N GLY A 137 6.698 -13.833 8.738 1.00 10.23 N ATOM 2156 CA GLY A 137 5.304 -14.088 8.315 1.00 71.11 C ATOM 2157 C GLY A 137 4.605 -12.851 7.735 1.00 30.10 C ATOM 2158 O GLY A 137 3.390 -12.664 7.916 1.00 22.52 O ATOM 0 H GLY A 137 7.375 -13.895 7.978 1.00 10.23 H new ATOM 0 HA2 GLY A 137 5.299 -14.882 7.568 1.00 71.11 H new ATOM 0 HA3 GLY A 137 4.734 -14.450 9.170 1.00 71.11 H new ATOM 2162 N VAL A 138 5.373 -12.024 6.997 1.00 43.11 N ATOM 2163 CA VAL A 138 4.873 -10.757 6.408 1.00 5.02 C ATOM 2164 C VAL A 138 3.867 -11.006 5.248 1.00 11.02 C ATOM 2165 O VAL A 138 3.030 -10.153 4.975 1.00 24.24 O ATOM 2166 CB VAL A 138 6.067 -9.860 5.897 1.00 41.21 C ATOM 2167 CG1 VAL A 138 6.699 -10.429 4.601 1.00 44.25 C ATOM 2168 CG2 VAL A 138 5.645 -8.377 5.718 1.00 31.12 C ATOM 0 H VAL A 138 6.354 -12.211 6.791 1.00 43.11 H new ATOM 0 HA VAL A 138 4.345 -10.230 7.203 1.00 5.02 H new ATOM 0 HB VAL A 138 6.833 -9.885 6.672 1.00 41.21 H new ATOM 0 HG11 VAL A 138 7.517 -9.783 4.281 1.00 44.25 H new ATOM 0 HG12 VAL A 138 7.081 -11.432 4.793 1.00 44.25 H new ATOM 0 HG13 VAL A 138 5.943 -10.473 3.817 1.00 44.25 H new ATOM 0 HG21 VAL A 138 6.497 -7.796 5.365 1.00 31.12 H new ATOM 0 HG22 VAL A 138 4.837 -8.314 4.990 1.00 31.12 H new ATOM 0 HG23 VAL A 138 5.304 -7.978 6.673 1.00 31.12 H new ATOM 2178 N GLU A 139 3.965 -12.185 4.585 1.00 4.10 N ATOM 2179 CA GLU A 139 3.084 -12.565 3.443 1.00 61.40 C ATOM 2180 C GLU A 139 1.599 -12.519 3.863 1.00 2.14 C ATOM 2181 O GLU A 139 0.788 -11.806 3.262 1.00 0.35 O ATOM 2182 CB GLU A 139 3.483 -13.992 2.935 1.00 61.42 C ATOM 2183 CG GLU A 139 2.714 -14.538 1.687 1.00 74.14 C ATOM 2184 CD GLU A 139 1.299 -15.083 1.981 1.00 10.34 C ATOM 2185 OE1 GLU A 139 1.174 -15.955 2.876 1.00 13.44 O ATOM 2186 OE2 GLU A 139 0.316 -14.628 1.345 1.00 72.32 O ATOM 0 H GLU A 139 4.653 -12.899 4.823 1.00 4.10 H new ATOM 0 HA GLU A 139 3.217 -11.851 2.630 1.00 61.40 H new ATOM 0 HB2 GLU A 139 4.548 -13.984 2.701 1.00 61.42 H new ATOM 0 HB3 GLU A 139 3.342 -14.696 3.755 1.00 61.42 H new ATOM 0 HG2 GLU A 139 2.634 -13.739 0.950 1.00 74.14 H new ATOM 0 HG3 GLU A 139 3.306 -15.332 1.233 1.00 74.14 H new ATOM 2193 N THR A 140 1.286 -13.252 4.943 1.00 72.11 N ATOM 2194 CA THR A 140 -0.076 -13.339 5.499 1.00 75.33 C ATOM 2195 C THR A 140 -0.505 -11.993 6.137 1.00 52.15 C ATOM 2196 O THR A 140 -1.685 -11.644 6.123 1.00 64.33 O ATOM 2197 CB THR A 140 -0.165 -14.505 6.545 1.00 12.34 C ATOM 2198 OG1 THR A 140 0.354 -15.725 5.968 1.00 50.33 O ATOM 2199 CG2 THR A 140 -1.606 -14.763 7.031 1.00 10.34 C ATOM 0 H THR A 140 1.972 -13.804 5.458 1.00 72.11 H new ATOM 0 HA THR A 140 -0.765 -13.554 4.682 1.00 75.33 H new ATOM 0 HB THR A 140 0.429 -14.198 7.406 1.00 12.34 H new ATOM 0 HG1 THR A 140 0.449 -15.614 4.999 1.00 50.33 H new ATOM 0 HG21 THR A 140 -1.606 -15.580 7.753 1.00 10.34 H new ATOM 0 HG22 THR A 140 -1.998 -13.862 7.503 1.00 10.34 H new ATOM 0 HG23 THR A 140 -2.234 -15.030 6.181 1.00 10.34 H new ATOM 2207 N GLY A 141 0.483 -11.236 6.670 1.00 62.42 N ATOM 2208 CA GLY A 141 0.242 -9.897 7.239 1.00 2.14 C ATOM 2209 C GLY A 141 -0.246 -8.868 6.199 1.00 14.23 C ATOM 2210 O GLY A 141 -1.251 -8.181 6.416 1.00 53.05 O ATOM 0 H GLY A 141 1.457 -11.535 6.716 1.00 62.42 H new ATOM 0 HA2 GLY A 141 -0.498 -9.977 8.035 1.00 2.14 H new ATOM 0 HA3 GLY A 141 1.163 -9.533 7.695 1.00 2.14 H new ATOM 2214 N MET A 142 0.472 -8.788 5.059 1.00 31.13 N ATOM 2215 CA MET A 142 0.128 -7.892 3.922 1.00 3.21 C ATOM 2216 C MET A 142 -1.193 -8.330 3.256 1.00 11.44 C ATOM 2217 O MET A 142 -1.985 -7.492 2.808 1.00 74.11 O ATOM 2218 CB MET A 142 1.275 -7.892 2.870 1.00 13.30 C ATOM 2219 CG MET A 142 2.601 -7.294 3.360 1.00 22.30 C ATOM 2220 SD MET A 142 3.907 -7.356 2.108 1.00 42.31 S ATOM 2221 CE MET A 142 4.145 -9.123 1.900 1.00 63.43 C ATOM 0 H MET A 142 1.312 -9.344 4.895 1.00 31.13 H new ATOM 0 HA MET A 142 0.000 -6.883 4.313 1.00 3.21 H new ATOM 0 HB2 MET A 142 1.453 -8.918 2.548 1.00 13.30 H new ATOM 0 HB3 MET A 142 0.944 -7.335 1.993 1.00 13.30 H new ATOM 0 HG2 MET A 142 2.439 -6.258 3.657 1.00 22.30 H new ATOM 0 HG3 MET A 142 2.930 -7.833 4.248 1.00 22.30 H new ATOM 0 HE1 MET A 142 5.183 -9.378 2.115 1.00 63.43 H new ATOM 0 HE2 MET A 142 3.489 -9.661 2.584 1.00 63.43 H new ATOM 0 HE3 MET A 142 3.908 -9.404 0.874 1.00 63.43 H new ATOM 2231 N ASN A 143 -1.414 -9.657 3.210 1.00 14.24 N ATOM 2232 CA ASN A 143 -2.659 -10.248 2.691 1.00 70.31 C ATOM 2233 C ASN A 143 -3.858 -9.875 3.594 1.00 34.43 C ATOM 2234 O ASN A 143 -4.946 -9.629 3.092 1.00 10.15 O ATOM 2235 CB ASN A 143 -2.509 -11.791 2.561 1.00 62.00 C ATOM 2236 CG ASN A 143 -3.630 -12.448 1.748 1.00 13.41 C ATOM 2237 OD1 ASN A 143 -4.197 -11.844 0.837 1.00 53.54 O ATOM 2238 ND2 ASN A 143 -3.939 -13.691 2.047 1.00 44.03 N ATOM 0 H ASN A 143 -0.735 -10.347 3.531 1.00 14.24 H new ATOM 0 HA ASN A 143 -2.853 -9.841 1.698 1.00 70.31 H new ATOM 0 HB2 ASN A 143 -1.551 -12.017 2.093 1.00 62.00 H new ATOM 0 HB3 ASN A 143 -2.488 -12.231 3.558 1.00 62.00 H new ATOM 0 HD21 ASN A 143 -4.664 -14.177 1.519 1.00 44.03 H new ATOM 0 HD22 ASN A 143 -3.454 -14.169 2.807 1.00 44.03 H new ATOM 2245 N SER A 144 -3.614 -9.800 4.926 1.00 44.13 N ATOM 2246 CA SER A 144 -4.637 -9.396 5.935 1.00 41.11 C ATOM 2247 C SER A 144 -4.982 -7.891 5.840 1.00 44.13 C ATOM 2248 O SER A 144 -6.138 -7.503 6.047 1.00 22.55 O ATOM 2249 CB SER A 144 -4.171 -9.729 7.374 1.00 45.13 C ATOM 2250 OG SER A 144 -4.104 -11.133 7.590 1.00 31.25 O ATOM 0 H SER A 144 -2.705 -10.017 5.335 1.00 44.13 H new ATOM 0 HA SER A 144 -5.536 -9.970 5.709 1.00 41.11 H new ATOM 0 HB2 SER A 144 -3.191 -9.286 7.552 1.00 45.13 H new ATOM 0 HB3 SER A 144 -4.858 -9.282 8.092 1.00 45.13 H new ATOM 0 HG SER A 144 -3.302 -11.493 7.156 1.00 31.25 H new ATOM 2256 N THR A 145 -3.969 -7.051 5.542 1.00 14.12 N ATOM 2257 CA THR A 145 -4.167 -5.594 5.324 1.00 12.51 C ATOM 2258 C THR A 145 -5.027 -5.354 4.053 1.00 43.13 C ATOM 2259 O THR A 145 -5.884 -4.465 4.016 1.00 63.31 O ATOM 2260 CB THR A 145 -2.789 -4.847 5.200 1.00 4.25 C ATOM 2261 OG1 THR A 145 -1.922 -5.229 6.284 1.00 24.11 O ATOM 2262 CG2 THR A 145 -2.949 -3.313 5.215 1.00 22.55 C ATOM 0 H THR A 145 -3.000 -7.354 5.445 1.00 14.12 H new ATOM 0 HA THR A 145 -4.693 -5.190 6.189 1.00 12.51 H new ATOM 0 HB THR A 145 -2.359 -5.136 4.241 1.00 4.25 H new ATOM 0 HG1 THR A 145 -1.633 -6.157 6.160 1.00 24.11 H new ATOM 0 HG21 THR A 145 -1.969 -2.844 5.127 1.00 22.55 H new ATOM 0 HG22 THR A 145 -3.576 -3.004 4.378 1.00 22.55 H new ATOM 0 HG23 THR A 145 -3.416 -3.005 6.151 1.00 22.55 H new ATOM 2270 N LEU A 146 -4.788 -6.182 3.018 1.00 52.24 N ATOM 2271 CA LEU A 146 -5.621 -6.216 1.793 1.00 22.31 C ATOM 2272 C LEU A 146 -6.965 -6.967 2.010 1.00 1.15 C ATOM 2273 O LEU A 146 -7.904 -6.778 1.244 1.00 54.21 O ATOM 2274 CB LEU A 146 -4.822 -6.798 0.597 1.00 61.45 C ATOM 2275 CG LEU A 146 -3.541 -5.993 0.184 1.00 24.24 C ATOM 2276 CD1 LEU A 146 -2.920 -6.539 -1.105 1.00 44.33 C ATOM 2277 CD2 LEU A 146 -3.824 -4.485 0.042 1.00 4.42 C ATOM 0 H LEU A 146 -4.014 -6.846 3.004 1.00 52.24 H new ATOM 0 HA LEU A 146 -5.883 -5.186 1.552 1.00 22.31 H new ATOM 0 HB2 LEU A 146 -4.525 -7.818 0.843 1.00 61.45 H new ATOM 0 HB3 LEU A 146 -5.486 -6.858 -0.266 1.00 61.45 H new ATOM 0 HG LEU A 146 -2.823 -6.124 0.993 1.00 24.24 H new ATOM 0 HD11 LEU A 146 -2.035 -5.955 -1.358 1.00 44.33 H new ATOM 0 HD12 LEU A 146 -2.638 -7.582 -0.960 1.00 44.33 H new ATOM 0 HD13 LEU A 146 -3.645 -6.469 -1.916 1.00 44.33 H new ATOM 0 HD21 LEU A 146 -2.908 -3.968 -0.245 1.00 4.42 H new ATOM 0 HD22 LEU A 146 -4.584 -4.328 -0.723 1.00 4.42 H new ATOM 0 HD23 LEU A 146 -4.180 -4.090 0.994 1.00 4.42 H new ATOM 2289 N ASN A 147 -7.042 -7.853 3.025 1.00 30.21 N ATOM 2290 CA ASN A 147 -8.332 -8.446 3.468 1.00 43.42 C ATOM 2291 C ASN A 147 -9.215 -7.380 4.169 1.00 14.15 C ATOM 2292 O ASN A 147 -10.430 -7.528 4.210 1.00 45.43 O ATOM 2293 CB ASN A 147 -8.113 -9.679 4.390 1.00 62.11 C ATOM 2294 CG ASN A 147 -7.660 -10.950 3.651 1.00 74.12 C ATOM 2295 OD1 ASN A 147 -8.258 -11.242 2.508 1.00 62.21 O flip ATOM 2296 ND2 ASN A 147 -6.821 -11.700 4.136 1.00 3.44 N flip ATOM 0 H ASN A 147 -6.232 -8.176 3.555 1.00 30.21 H new ATOM 0 HA ASN A 147 -8.855 -8.795 2.578 1.00 43.42 H new ATOM 0 HB2 ASN A 147 -7.368 -9.426 5.144 1.00 62.11 H new ATOM 0 HB3 ASN A 147 -9.042 -9.892 4.919 1.00 62.11 H new ATOM 0 HD21 ASN A 147 -6.370 -11.458 5.018 1.00 3.44 H new ATOM 0 HD22 ASN A 147 -6.573 -12.566 3.657 1.00 3.44 H new ATOM 2303 N GLN A 148 -8.597 -6.315 4.725 1.00 61.43 N ATOM 2304 CA GLN A 148 -9.340 -5.112 5.197 1.00 12.11 C ATOM 2305 C GLN A 148 -9.861 -4.287 3.993 1.00 23.35 C ATOM 2306 O GLN A 148 -10.984 -3.760 4.019 1.00 65.54 O ATOM 2307 CB GLN A 148 -8.439 -4.234 6.111 1.00 22.42 C ATOM 2308 CG GLN A 148 -8.019 -4.899 7.441 1.00 63.03 C ATOM 2309 CD GLN A 148 -9.212 -5.243 8.348 1.00 42.30 C ATOM 2310 OE1 GLN A 148 -9.645 -4.435 9.163 1.00 65.33 O ATOM 2311 NE2 GLN A 148 -9.761 -6.437 8.205 1.00 52.20 N ATOM 0 H GLN A 148 -7.588 -6.258 4.860 1.00 61.43 H new ATOM 0 HA GLN A 148 -10.197 -5.447 5.781 1.00 12.11 H new ATOM 0 HB2 GLN A 148 -7.540 -3.962 5.558 1.00 22.42 H new ATOM 0 HB3 GLN A 148 -8.967 -3.307 6.336 1.00 22.42 H new ATOM 0 HG2 GLN A 148 -7.461 -5.810 7.224 1.00 63.03 H new ATOM 0 HG3 GLN A 148 -7.344 -4.231 7.977 1.00 63.03 H new ATOM 0 HE21 GLN A 148 -9.384 -7.093 7.521 1.00 52.20 H new ATOM 0 HE22 GLN A 148 -10.561 -6.702 8.779 1.00 52.20 H new ATOM 2320 N LEU A 149 -9.025 -4.210 2.939 1.00 3.14 N ATOM 2321 CA LEU A 149 -9.369 -3.567 1.654 1.00 1.40 C ATOM 2322 C LEU A 149 -10.501 -4.337 0.924 1.00 4.32 C ATOM 2323 O LEU A 149 -11.327 -3.743 0.237 1.00 51.43 O ATOM 2324 CB LEU A 149 -8.080 -3.459 0.780 1.00 0.13 C ATOM 2325 CG LEU A 149 -8.217 -2.716 -0.584 1.00 50.31 C ATOM 2326 CD1 LEU A 149 -8.918 -1.370 -0.402 1.00 64.22 C ATOM 2327 CD2 LEU A 149 -6.846 -2.521 -1.275 1.00 32.05 C ATOM 0 H LEU A 149 -8.081 -4.597 2.955 1.00 3.14 H new ATOM 0 HA LEU A 149 -9.752 -2.564 1.841 1.00 1.40 H new ATOM 0 HB2 LEU A 149 -7.313 -2.954 1.367 1.00 0.13 H new ATOM 0 HB3 LEU A 149 -7.718 -4.468 0.583 1.00 0.13 H new ATOM 0 HG LEU A 149 -8.827 -3.344 -1.233 1.00 50.31 H new ATOM 0 HD11 LEU A 149 -9.002 -0.870 -1.367 1.00 64.22 H new ATOM 0 HD12 LEU A 149 -9.914 -1.531 0.011 1.00 64.22 H new ATOM 0 HD13 LEU A 149 -8.339 -0.747 0.280 1.00 64.22 H new ATOM 0 HD21 LEU A 149 -6.987 -2.000 -2.222 1.00 32.05 H new ATOM 0 HD22 LEU A 149 -6.194 -1.932 -0.630 1.00 32.05 H new ATOM 0 HD23 LEU A 149 -6.391 -3.494 -1.461 1.00 32.05 H new ATOM 2339 N GLU A 150 -10.523 -5.658 1.118 1.00 63.20 N ATOM 2340 CA GLU A 150 -11.557 -6.566 0.575 1.00 22.14 C ATOM 2341 C GLU A 150 -12.989 -6.149 1.022 1.00 13.24 C ATOM 2342 O GLU A 150 -13.893 -6.011 0.192 1.00 41.42 O ATOM 2343 CB GLU A 150 -11.237 -7.997 1.060 1.00 21.01 C ATOM 2344 CG GLU A 150 -12.136 -9.117 0.518 1.00 45.10 C ATOM 2345 CD GLU A 150 -11.883 -10.449 1.244 1.00 42.11 C ATOM 2346 OE1 GLU A 150 -10.803 -11.041 1.045 1.00 12.14 O ATOM 2347 OE2 GLU A 150 -12.735 -10.872 2.052 1.00 22.22 O ATOM 0 H GLU A 150 -9.813 -6.143 1.666 1.00 63.20 H new ATOM 0 HA GLU A 150 -11.542 -6.515 -0.514 1.00 22.14 H new ATOM 0 HB2 GLU A 150 -10.206 -8.226 0.792 1.00 21.01 H new ATOM 0 HB3 GLU A 150 -11.294 -8.010 2.148 1.00 21.01 H new ATOM 0 HG2 GLU A 150 -13.182 -8.832 0.633 1.00 45.10 H new ATOM 0 HG3 GLU A 150 -11.956 -9.244 -0.549 1.00 45.10 H new ATOM 2354 N LYS A 151 -13.163 -5.928 2.344 1.00 1.11 N ATOM 2355 CA LYS A 151 -14.464 -5.503 2.940 1.00 61.00 C ATOM 2356 C LYS A 151 -14.829 -4.046 2.537 1.00 22.02 C ATOM 2357 O LYS A 151 -16.008 -3.716 2.419 1.00 5.50 O ATOM 2358 CB LYS A 151 -14.452 -5.649 4.499 1.00 41.03 C ATOM 2359 CG LYS A 151 -14.584 -7.095 5.057 1.00 34.53 C ATOM 2360 CD LYS A 151 -13.406 -8.014 4.673 1.00 43.54 C ATOM 2361 CE LYS A 151 -13.489 -9.417 5.291 1.00 70.31 C ATOM 2362 NZ LYS A 151 -12.305 -10.238 4.929 1.00 3.53 N ATOM 0 H LYS A 151 -12.416 -6.036 3.030 1.00 1.11 H new ATOM 0 HA LYS A 151 -15.230 -6.167 2.539 1.00 61.00 H new ATOM 0 HB2 LYS A 151 -13.523 -5.220 4.876 1.00 41.03 H new ATOM 0 HB3 LYS A 151 -15.267 -5.050 4.905 1.00 41.03 H new ATOM 0 HG2 LYS A 151 -14.661 -7.051 6.143 1.00 34.53 H new ATOM 0 HG3 LYS A 151 -15.512 -7.534 4.690 1.00 34.53 H new ATOM 0 HD2 LYS A 151 -13.368 -8.107 3.588 1.00 43.54 H new ATOM 0 HD3 LYS A 151 -12.474 -7.544 4.985 1.00 43.54 H new ATOM 0 HE2 LYS A 151 -13.559 -9.335 6.376 1.00 70.31 H new ATOM 0 HE3 LYS A 151 -14.397 -9.914 4.949 1.00 70.31 H new ATOM 0 HZ1 LYS A 151 -12.285 -11.096 5.516 1.00 3.53 H new ATOM 0 HZ2 LYS A 151 -12.362 -10.506 3.926 1.00 3.53 H new ATOM 0 HZ3 LYS A 151 -11.438 -9.687 5.092 1.00 3.53 H new ATOM 2376 N LEU A 152 -13.799 -3.189 2.347 1.00 34.34 N ATOM 2377 CA LEU A 152 -13.972 -1.789 1.867 1.00 34.23 C ATOM 2378 C LEU A 152 -14.600 -1.741 0.443 1.00 51.33 C ATOM 2379 O LEU A 152 -15.609 -1.064 0.219 1.00 53.12 O ATOM 2380 CB LEU A 152 -12.597 -1.043 1.900 1.00 72.03 C ATOM 2381 CG LEU A 152 -12.504 0.342 1.155 1.00 11.04 C ATOM 2382 CD1 LEU A 152 -13.589 1.331 1.619 1.00 52.41 C ATOM 2383 CD2 LEU A 152 -11.097 0.967 1.305 1.00 72.13 C ATOM 0 H LEU A 152 -12.826 -3.443 2.520 1.00 34.34 H new ATOM 0 HA LEU A 152 -14.666 -1.282 2.537 1.00 34.23 H new ATOM 0 HB2 LEU A 152 -12.326 -0.883 2.944 1.00 72.03 H new ATOM 0 HB3 LEU A 152 -11.844 -1.706 1.473 1.00 72.03 H new ATOM 0 HG LEU A 152 -12.681 0.139 0.099 1.00 11.04 H new ATOM 0 HD11 LEU A 152 -13.482 2.270 1.076 1.00 52.41 H new ATOM 0 HD12 LEU A 152 -14.574 0.909 1.423 1.00 52.41 H new ATOM 0 HD13 LEU A 152 -13.480 1.516 2.688 1.00 52.41 H new ATOM 0 HD21 LEU A 152 -11.065 1.922 0.780 1.00 72.13 H new ATOM 0 HD22 LEU A 152 -10.880 1.126 2.361 1.00 72.13 H new ATOM 0 HD23 LEU A 152 -10.353 0.294 0.880 1.00 72.13 H new ATOM 2395 N LEU A 153 -14.002 -2.484 -0.502 1.00 44.22 N ATOM 2396 CA LEU A 153 -14.368 -2.415 -1.944 1.00 31.33 C ATOM 2397 C LEU A 153 -15.672 -3.180 -2.254 1.00 75.31 C ATOM 2398 O LEU A 153 -16.422 -2.808 -3.157 1.00 41.31 O ATOM 2399 CB LEU A 153 -13.195 -2.951 -2.798 1.00 42.22 C ATOM 2400 CG LEU A 153 -11.827 -2.260 -2.518 1.00 31.20 C ATOM 2401 CD1 LEU A 153 -10.693 -2.898 -3.326 1.00 21.55 C ATOM 2402 CD2 LEU A 153 -11.901 -0.731 -2.734 1.00 25.34 C ATOM 0 H LEU A 153 -13.255 -3.148 -0.300 1.00 44.22 H new ATOM 0 HA LEU A 153 -14.555 -1.371 -2.197 1.00 31.33 H new ATOM 0 HB2 LEU A 153 -13.091 -4.021 -2.620 1.00 42.22 H new ATOM 0 HB3 LEU A 153 -13.442 -2.826 -3.852 1.00 42.22 H new ATOM 0 HG LEU A 153 -11.596 -2.420 -1.465 1.00 31.20 H new ATOM 0 HD11 LEU A 153 -9.756 -2.388 -3.103 1.00 21.55 H new ATOM 0 HD12 LEU A 153 -10.605 -3.952 -3.061 1.00 21.55 H new ATOM 0 HD13 LEU A 153 -10.910 -2.809 -4.390 1.00 21.55 H new ATOM 0 HD21 LEU A 153 -10.927 -0.287 -2.528 1.00 25.34 H new ATOM 0 HD22 LEU A 153 -12.184 -0.523 -3.766 1.00 25.34 H new ATOM 0 HD23 LEU A 153 -12.644 -0.304 -2.060 1.00 25.34 H new ATOM 2414 N ASN A 154 -15.928 -4.258 -1.508 1.00 72.53 N ATOM 2415 CA ASN A 154 -17.217 -4.990 -1.579 1.00 43.44 C ATOM 2416 C ASN A 154 -18.316 -4.288 -0.734 1.00 23.24 C ATOM 2417 O ASN A 154 -19.509 -4.564 -0.909 1.00 42.11 O ATOM 2418 CB ASN A 154 -17.011 -6.458 -1.154 1.00 23.52 C ATOM 2419 CG ASN A 154 -16.287 -7.260 -2.231 1.00 22.52 C ATOM 2420 OD1 ASN A 154 -16.898 -8.003 -2.993 1.00 5.41 O ATOM 2421 ND2 ASN A 154 -14.988 -7.079 -2.342 1.00 73.12 N ATOM 0 H ASN A 154 -15.263 -4.652 -0.842 1.00 72.53 H new ATOM 0 HA ASN A 154 -17.568 -4.982 -2.611 1.00 43.44 H new ATOM 0 HB2 ASN A 154 -16.438 -6.492 -0.228 1.00 23.52 H new ATOM 0 HB3 ASN A 154 -17.978 -6.916 -0.947 1.00 23.52 H new ATOM 0 HD21 ASN A 154 -14.467 -7.562 -3.074 1.00 73.12 H new ATOM 0 HD22 ASN A 154 -14.503 -6.456 -1.696 1.00 73.12 H new ATOM 2428 N GLN A 155 -17.875 -3.384 0.177 1.00 54.42 N ATOM 2429 CA GLN A 155 -18.732 -2.493 1.011 1.00 73.33 C ATOM 2430 C GLN A 155 -19.596 -3.266 2.046 1.00 44.34 C ATOM 2431 O GLN A 155 -19.322 -3.220 3.245 1.00 25.53 O ATOM 2432 CB GLN A 155 -19.602 -1.542 0.137 1.00 63.23 C ATOM 2433 CG GLN A 155 -18.798 -0.542 -0.724 1.00 1.52 C ATOM 2434 CD GLN A 155 -19.695 0.419 -1.511 1.00 23.43 C ATOM 2435 OE1 GLN A 155 -20.068 0.156 -2.648 1.00 60.45 O ATOM 2436 NE2 GLN A 155 -20.057 1.538 -0.909 1.00 65.42 N ATOM 0 H GLN A 155 -16.881 -3.248 0.360 1.00 54.42 H new ATOM 0 HA GLN A 155 -18.044 -1.876 1.590 1.00 73.33 H new ATOM 0 HB2 GLN A 155 -20.228 -2.146 -0.520 1.00 63.23 H new ATOM 0 HB3 GLN A 155 -20.272 -0.982 0.790 1.00 63.23 H new ATOM 0 HG2 GLN A 155 -18.134 0.034 -0.079 1.00 1.52 H new ATOM 0 HG3 GLN A 155 -18.166 -1.094 -1.420 1.00 1.52 H new ATOM 0 HE21 GLN A 155 -19.734 1.735 0.038 1.00 65.42 H new ATOM 0 HE22 GLN A 155 -20.660 2.205 -1.391 1.00 65.42 H new