USER MOD reduce.3.24.130724 H: found=0, std=0, add=1396, rem=0, adj=43 USER MOD reduce.3.24.130724 removed 1394 hydrogens (12 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 69 THR OG1 : rot 120:sc= 0.0256 USER MOD Set 1.2: A 71 MET CE :methyl 174:sc= -4.42! (180deg=-4.57!) USER MOD Set 2.1: A 51 THR OG1 : rot -121:sc= 1.25 USER MOD Set 2.2: A 55 LYS NZ :NH3+ -164:sc= 0.289 (180deg=-0.286) USER MOD Set 3.1: A 21 LYS NZ :NH3+ -143:sc= 1.16 (180deg=-0.0226) USER MOD Set 3.2: A 95 GLN : amide:sc= -1.47! K(o=-0.3!,f=-3.8) USER MOD Set 4.1: A 16 HIS : no HD1:sc= -8.74! C(o=-18!,f=-17!) USER MOD Set 4.2: A 19 HIS : no HD1:sc= -5.82! C(o=-18!,f=-32!) USER MOD Set 4.3: A 96 THR OG1 : rot -30:sc= -3.09! USER MOD Single : A 1 GLY N :NH3+ -171:sc= 1.31 (180deg=1.08) USER MOD Single : A 2 SER OG : rot 180:sc= 0.0283 USER MOD Single : A 3 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 4 MET CE :methyl 157:sc= -0.246 (180deg=-0.895) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 MET CE :methyl -151:sc= -2.88! (180deg=-3.3!) USER MOD Single : A 22 THR OG1 : rot 82:sc= -0.213 USER MOD Single : A 23 THR OG1 : rot -123:sc= -1.72! USER MOD Single : A 30 HIS : no HD1:sc= 0.0224 X(o=0.022,f=-0.36) USER MOD Single : A 31 SER OG : rot -93:sc= 1.13 USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 THR OG1 : rot -139:sc= -0.0527 USER MOD Single : A 36 GLN : amide:sc= 0 X(o=0,f=-0.1) USER MOD Single : A 42 THR OG1 : rot 180:sc= -0.141 USER MOD Single : A 43 GLN : amide:sc= 0 K(o=0,f=-0.66) USER MOD Single : A 44 HIS : no HD1:sc= -0.0179 X(o=-0.018,f=-0.023) USER MOD Single : A 48 TYR OH : rot 180:sc= -0.976 USER MOD Single : A 49 GLN : amide:sc= -1.18 K(o=-1.2,f=-3.4) USER MOD Single : A 53 ASN : amide:sc= 0.326 K(o=0.33,f=-13!) USER MOD Single : A 56 LYS NZ :NH3+ 131:sc= 0.00157 (180deg=-0.00706) USER MOD Single : A 58 THR OG1 : rot 170:sc= -0.548 USER MOD Single : A 62 THR OG1 : rot 24:sc= 1.15 USER MOD Single : A 65 HIS : no HD1:sc= 0 X(o=0,f=-0.0049) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 GLN : amide:sc= 0.995 K(o=0.99,f=-0.61) USER MOD Single : A 79 THR OG1 : rot 180:sc= -0.0486 USER MOD Single : A 93 MET CE :methyl -123:sc= -0.0198 (180deg=-0.326) USER MOD Single : A 101 ASN : amide:sc= -2.3! C(o=-2.3!,f=-2.6!) USER MOD Single : A 102 HIS : no HD1:sc= -1.48! C(o=-1.5!,f=-7.4!) USER MOD Single : A 104 LYS NZ :NH3+ 140:sc= -0.0939! (180deg=-1.94!) USER MOD Single : A 107 ASN : amide:sc= -0.0543 K(o=-0.054,f=-1.3) USER MOD Single : A 115 ASN : amide:sc= -7.55! C(o=-7.5!,f=-9.1!) USER MOD Single : A 116 LYS NZ :NH3+ -154:sc= 0.399 (180deg=-0.077) USER MOD Single : A 117 MET CE :methyl -110:sc= -2.9! (180deg=-6.98!) USER MOD Single : A 119 LYS NZ :NH3+ -172:sc= 2.55 (180deg=2.26) USER MOD Single : A 123 ASN : amide:sc= -7.66! C(o=-7.7!,f=-2.7!) USER MOD Single : A 128 MET CE :methyl 148:sc= -1.54 (180deg=-3.01) USER MOD Single : A 129 GLN : amide:sc= 0 K(o=0,f=-0.99) USER MOD Single : A 132 MET CE :methyl -125:sc= -0.485 (180deg=-3.31!) USER MOD Single : A 134 TYR OH : rot 180:sc= 0 USER MOD Single : A 135 ASN : amide:sc= -0.21 K(o=-0.21,f=-1.1) USER MOD Single : A 145 THR OG1 : rot -13:sc= -1.08! USER MOD Single : A 148 CYS SG : rot -140:sc= -1.13 USER MOD Single : A 149 LYS NZ :NH3+ 160:sc= 1.22 (180deg=0.406) USER MOD Single : A 151 SER OG : rot -118:sc= 0.87 USER MOD Single : A 153 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.0108) USER MOD Single : A 154 THR OG1 : rot 163:sc= -0.175 USER MOD Single : A 155 LYS NZ :NH3+ 146:sc= 1 (180deg=-0.685) USER MOD Single : A 160 HIS : no HD1:sc= -0.0162 X(o=-0.016,f=-0.016) USER MOD Single : A 164 MET CE :methyl 141:sc= -2.55! (180deg=-5.66!) USER MOD Single : A 169 SER OG : rot 69:sc= 0.793 USER MOD Single : A 171 MET CE :methyl 161:sc= -0.104 (180deg=-0.653) USER MOD Single : A 175 LYS NZ :NH3+ -157:sc= -0.106 (180deg=-0.632) USER MOD Single : A 177 ASN : amide:sc= -0.0796 X(o=-0.08,f=-0.08) USER MOD Single : A 179 GDP O2' : rot 5:sc= 0.348 USER MOD Single : A 179 GDP O3' : rot -176:sc= 0.26 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -19.832 -8.266 -13.729 1.00 11.58 N ATOM 2 CA GLY A 1 -19.441 -9.097 -14.893 1.00 11.11 C ATOM 3 C GLY A 1 -18.701 -8.289 -15.935 1.00 10.21 C ATOM 4 O GLY A 1 -17.992 -7.343 -15.596 1.00 9.82 O ATOM 0 H1 GLY A 1 -20.199 -8.878 -12.973 1.00 11.58 H new ATOM 0 H2 GLY A 1 -19.002 -7.744 -13.380 1.00 11.58 H new ATOM 0 H3 GLY A 1 -20.569 -7.591 -14.016 1.00 11.58 H new ATOM 0 HA2 GLY A 1 -18.811 -9.921 -14.557 1.00 11.11 H new ATOM 0 HA3 GLY A 1 -20.332 -9.539 -15.340 1.00 11.11 H new ATOM 10 N SER A 2 -18.875 -8.656 -17.196 1.00 10.08 N ATOM 11 CA SER A 2 -18.188 -7.995 -18.296 1.00 9.47 C ATOM 12 C SER A 2 -18.616 -6.531 -18.416 1.00 8.68 C ATOM 13 O SER A 2 -17.909 -5.630 -17.962 1.00 8.69 O ATOM 14 CB SER A 2 -18.482 -8.746 -19.588 1.00 9.96 C ATOM 15 OG SER A 2 -18.567 -10.138 -19.342 1.00 10.61 O ATOM 0 H SER A 2 -19.492 -9.415 -17.485 1.00 10.08 H new ATOM 0 HA SER A 2 -17.115 -8.006 -18.102 1.00 9.47 H new ATOM 0 HB2 SER A 2 -19.417 -8.389 -20.019 1.00 9.96 H new ATOM 0 HB3 SER A 2 -17.698 -8.547 -20.318 1.00 9.96 H new ATOM 0 HG SER A 2 -18.758 -10.607 -20.181 1.00 10.61 H new ATOM 21 N HIS A 3 -19.774 -6.295 -19.022 1.00 8.25 N ATOM 22 CA HIS A 3 -20.317 -4.943 -19.111 1.00 7.71 C ATOM 23 C HIS A 3 -21.400 -4.763 -18.053 1.00 6.90 C ATOM 24 O HIS A 3 -21.676 -3.652 -17.608 1.00 6.93 O ATOM 25 CB HIS A 3 -20.878 -4.664 -20.513 1.00 8.30 C ATOM 26 CG HIS A 3 -21.122 -3.206 -20.784 1.00 8.89 C ATOM 27 ND1 HIS A 3 -20.249 -2.418 -21.499 1.00 9.51 N ATOM 28 CD2 HIS A 3 -22.148 -2.393 -20.427 1.00 9.23 C ATOM 29 CE1 HIS A 3 -20.722 -1.188 -21.567 1.00 10.14 C ATOM 30 NE2 HIS A 3 -21.874 -1.146 -20.923 1.00 9.99 N ATOM 0 H HIS A 3 -20.352 -7.015 -19.456 1.00 8.25 H new ATOM 0 HA HIS A 3 -19.514 -4.228 -18.931 1.00 7.71 H new ATOM 0 HB2 HIS A 3 -20.183 -5.052 -21.257 1.00 8.30 H new ATOM 0 HB3 HIS A 3 -21.814 -5.209 -20.636 1.00 8.30 H new ATOM 0 HD2 HIS A 3 -23.020 -2.677 -19.857 1.00 9.23 H new ATOM 0 HE1 HIS A 3 -20.247 -0.356 -22.065 1.00 10.14 H new ATOM 0 HE2 HIS A 3 -22.463 -0.321 -20.813 1.00 9.99 H new ATOM 39 N MET A 4 -22.018 -5.873 -17.667 1.00 6.50 N ATOM 40 CA MET A 4 -23.020 -5.868 -16.612 1.00 6.05 C ATOM 41 C MET A 4 -22.336 -5.672 -15.265 1.00 5.19 C ATOM 42 O MET A 4 -21.469 -6.461 -14.882 1.00 5.17 O ATOM 43 CB MET A 4 -23.815 -7.180 -16.613 1.00 6.67 C ATOM 44 CG MET A 4 -24.558 -7.463 -17.914 1.00 7.26 C ATOM 45 SD MET A 4 -23.460 -7.923 -19.279 1.00 8.18 S ATOM 46 CE MET A 4 -22.722 -9.429 -18.645 1.00 8.77 C ATOM 0 H MET A 4 -21.840 -6.792 -18.072 1.00 6.50 H new ATOM 0 HA MET A 4 -23.716 -5.048 -16.790 1.00 6.05 H new ATOM 0 HB2 MET A 4 -23.132 -8.005 -16.412 1.00 6.67 H new ATOM 0 HB3 MET A 4 -24.535 -7.155 -15.795 1.00 6.67 H new ATOM 0 HG2 MET A 4 -25.276 -8.266 -17.747 1.00 7.26 H new ATOM 0 HG3 MET A 4 -25.129 -6.579 -18.198 1.00 7.26 H new ATOM 0 HE1 MET A 4 -22.361 -10.035 -19.476 1.00 8.77 H new ATOM 0 HE2 MET A 4 -21.888 -9.178 -17.990 1.00 8.77 H new ATOM 0 HE3 MET A 4 -23.468 -9.991 -18.083 1.00 8.77 H new ATOM 56 N VAL A 5 -22.717 -4.626 -14.548 1.00 4.89 N ATOM 57 CA VAL A 5 -22.010 -4.253 -13.331 1.00 4.47 C ATOM 58 C VAL A 5 -22.955 -3.996 -12.166 1.00 4.02 C ATOM 59 O VAL A 5 -24.156 -3.773 -12.348 1.00 4.26 O ATOM 60 CB VAL A 5 -21.136 -2.996 -13.546 1.00 5.11 C ATOM 61 CG1 VAL A 5 -20.005 -3.280 -14.523 1.00 5.46 C ATOM 62 CG2 VAL A 5 -21.979 -1.828 -14.035 1.00 5.74 C ATOM 0 H VAL A 5 -23.506 -4.024 -14.785 1.00 4.89 H new ATOM 0 HA VAL A 5 -21.375 -5.104 -13.085 1.00 4.47 H new ATOM 0 HB VAL A 5 -20.698 -2.726 -12.585 1.00 5.11 H new ATOM 0 HG11 VAL A 5 -19.405 -2.380 -14.657 1.00 5.46 H new ATOM 0 HG12 VAL A 5 -19.377 -4.079 -14.130 1.00 5.46 H new ATOM 0 HG13 VAL A 5 -20.421 -3.585 -15.483 1.00 5.46 H new ATOM 0 HG21 VAL A 5 -21.342 -0.955 -14.179 1.00 5.74 H new ATOM 0 HG22 VAL A 5 -22.453 -2.092 -14.981 1.00 5.74 H new ATOM 0 HG23 VAL A 5 -22.747 -1.599 -13.296 1.00 5.74 H new ATOM 72 N GLU A 6 -22.394 -4.045 -10.967 1.00 3.71 N ATOM 73 CA GLU A 6 -23.113 -3.721 -9.746 1.00 3.56 C ATOM 74 C GLU A 6 -22.172 -2.962 -8.817 1.00 3.07 C ATOM 75 O GLU A 6 -21.630 -3.527 -7.867 1.00 3.23 O ATOM 76 CB GLU A 6 -23.631 -5.002 -9.080 1.00 4.14 C ATOM 77 CG GLU A 6 -24.383 -4.785 -7.774 1.00 4.54 C ATOM 78 CD GLU A 6 -25.564 -3.844 -7.914 1.00 5.11 C ATOM 79 OE1 GLU A 6 -26.536 -4.210 -8.605 1.00 5.70 O ATOM 80 OE2 GLU A 6 -25.518 -2.734 -7.341 1.00 5.29 O ATOM 0 H GLU A 6 -21.422 -4.312 -10.814 1.00 3.71 H new ATOM 0 HA GLU A 6 -23.977 -3.096 -9.973 1.00 3.56 H new ATOM 0 HB2 GLU A 6 -24.288 -5.518 -9.780 1.00 4.14 H new ATOM 0 HB3 GLU A 6 -22.786 -5.663 -8.890 1.00 4.14 H new ATOM 0 HG2 GLU A 6 -24.735 -5.747 -7.401 1.00 4.54 H new ATOM 0 HG3 GLU A 6 -23.695 -4.386 -7.028 1.00 4.54 H new ATOM 87 N ARG A 7 -21.968 -1.680 -9.123 1.00 2.85 N ATOM 88 CA ARG A 7 -21.017 -0.839 -8.395 1.00 2.62 C ATOM 89 C ARG A 7 -19.646 -1.512 -8.309 1.00 2.19 C ATOM 90 O ARG A 7 -19.235 -1.961 -7.241 1.00 2.44 O ATOM 91 CB ARG A 7 -21.537 -0.506 -6.997 1.00 3.27 C ATOM 92 CG ARG A 7 -22.760 0.397 -7.000 1.00 3.86 C ATOM 93 CD ARG A 7 -23.894 -0.209 -6.199 1.00 4.69 C ATOM 94 NE ARG A 7 -23.507 -0.478 -4.813 1.00 5.27 N ATOM 95 CZ ARG A 7 -23.899 -1.557 -4.135 1.00 6.08 C ATOM 96 NH1 ARG A 7 -24.660 -2.472 -4.722 1.00 6.40 N ATOM 97 NH2 ARG A 7 -23.519 -1.722 -2.875 1.00 6.85 N ATOM 0 H ARG A 7 -22.455 -1.197 -9.878 1.00 2.85 H new ATOM 0 HA ARG A 7 -20.907 0.093 -8.949 1.00 2.62 H new ATOM 0 HB2 ARG A 7 -21.782 -1.433 -6.480 1.00 3.27 H new ATOM 0 HB3 ARG A 7 -20.742 -0.024 -6.428 1.00 3.27 H new ATOM 0 HG2 ARG A 7 -22.497 1.370 -6.584 1.00 3.86 H new ATOM 0 HG3 ARG A 7 -23.087 0.567 -8.026 1.00 3.86 H new ATOM 0 HD2 ARG A 7 -24.748 0.468 -6.212 1.00 4.69 H new ATOM 0 HD3 ARG A 7 -24.216 -1.137 -6.672 1.00 4.69 H new ATOM 0 HE ARG A 7 -22.905 0.196 -4.341 1.00 5.27 H new ATOM 0 HH11 ARG A 7 -24.946 -2.350 -5.694 1.00 6.40 H new ATOM 0 HH12 ARG A 7 -24.959 -3.297 -4.202 1.00 6.40 H new ATOM 0 HH21 ARG A 7 -22.927 -1.024 -2.425 1.00 6.85 H new ATOM 0 HH22 ARG A 7 -23.819 -2.547 -2.356 1.00 6.85 H new ATOM 111 N PRO A 8 -18.922 -1.555 -9.445 1.00 2.01 N ATOM 112 CA PRO A 8 -17.628 -2.258 -9.578 1.00 2.04 C ATOM 113 C PRO A 8 -16.601 -1.981 -8.465 1.00 1.71 C ATOM 114 O PRO A 8 -15.898 -2.907 -8.063 1.00 1.69 O ATOM 115 CB PRO A 8 -17.103 -1.770 -10.923 1.00 2.57 C ATOM 116 CG PRO A 8 -18.327 -1.466 -11.707 1.00 2.80 C ATOM 117 CD PRO A 8 -19.315 -0.916 -10.717 1.00 2.42 C ATOM 0 HA PRO A 8 -17.779 -3.335 -9.501 1.00 2.04 H new ATOM 0 HB2 PRO A 8 -16.475 -0.887 -10.808 1.00 2.57 H new ATOM 0 HB3 PRO A 8 -16.496 -2.531 -11.413 1.00 2.57 H new ATOM 0 HG2 PRO A 8 -18.118 -0.743 -12.495 1.00 2.80 H new ATOM 0 HG3 PRO A 8 -18.715 -2.362 -12.191 1.00 2.80 H new ATOM 0 HD2 PRO A 8 -19.258 0.171 -10.655 1.00 2.42 H new ATOM 0 HD3 PRO A 8 -20.340 -1.166 -10.992 1.00 2.42 H new ATOM 125 N PRO A 9 -16.447 -0.720 -7.973 1.00 1.83 N ATOM 126 CA PRO A 9 -15.530 -0.417 -6.857 1.00 1.84 C ATOM 127 C PRO A 9 -15.936 -1.087 -5.536 1.00 1.40 C ATOM 128 O PRO A 9 -16.286 -0.415 -4.566 1.00 1.72 O ATOM 129 CB PRO A 9 -15.600 1.109 -6.724 1.00 2.47 C ATOM 130 CG PRO A 9 -16.886 1.492 -7.368 1.00 2.76 C ATOM 131 CD PRO A 9 -17.084 0.511 -8.486 1.00 2.36 C ATOM 0 HA PRO A 9 -14.529 -0.797 -7.062 1.00 1.84 H new ATOM 0 HB2 PRO A 9 -15.575 1.416 -5.678 1.00 2.47 H new ATOM 0 HB3 PRO A 9 -14.754 1.588 -7.217 1.00 2.47 H new ATOM 0 HG2 PRO A 9 -17.710 1.447 -6.656 1.00 2.76 H new ATOM 0 HG3 PRO A 9 -16.847 2.514 -7.745 1.00 2.76 H new ATOM 0 HD2 PRO A 9 -18.141 0.357 -8.704 1.00 2.36 H new ATOM 0 HD3 PRO A 9 -16.615 0.852 -9.409 1.00 2.36 H new ATOM 139 N VAL A 10 -15.908 -2.407 -5.523 1.00 1.18 N ATOM 140 CA VAL A 10 -16.082 -3.184 -4.307 1.00 0.94 C ATOM 141 C VAL A 10 -14.704 -3.514 -3.757 1.00 0.94 C ATOM 142 O VAL A 10 -14.154 -4.581 -4.024 1.00 1.76 O ATOM 143 CB VAL A 10 -16.865 -4.491 -4.580 1.00 1.25 C ATOM 144 CG1 VAL A 10 -17.136 -5.247 -3.288 1.00 1.90 C ATOM 145 CG2 VAL A 10 -18.169 -4.202 -5.304 1.00 2.00 C ATOM 0 H VAL A 10 -15.763 -2.974 -6.359 1.00 1.18 H new ATOM 0 HA VAL A 10 -16.657 -2.602 -3.587 1.00 0.94 H new ATOM 0 HB VAL A 10 -16.246 -5.119 -5.221 1.00 1.25 H new ATOM 0 HG11 VAL A 10 -17.687 -6.161 -3.510 1.00 1.90 H new ATOM 0 HG12 VAL A 10 -16.190 -5.501 -2.810 1.00 1.90 H new ATOM 0 HG13 VAL A 10 -17.725 -4.622 -2.617 1.00 1.90 H new ATOM 0 HG21 VAL A 10 -18.700 -5.137 -5.484 1.00 2.00 H new ATOM 0 HG22 VAL A 10 -18.787 -3.545 -4.692 1.00 2.00 H new ATOM 0 HG23 VAL A 10 -17.956 -3.716 -6.256 1.00 2.00 H new ATOM 155 N VAL A 11 -14.127 -2.575 -3.021 1.00 0.62 N ATOM 156 CA VAL A 11 -12.735 -2.689 -2.630 1.00 0.61 C ATOM 157 C VAL A 11 -12.598 -3.415 -1.293 1.00 0.62 C ATOM 158 O VAL A 11 -13.457 -3.308 -0.423 1.00 0.93 O ATOM 159 CB VAL A 11 -12.033 -1.310 -2.573 1.00 0.76 C ATOM 160 CG1 VAL A 11 -12.402 -0.470 -3.788 1.00 1.35 C ATOM 161 CG2 VAL A 11 -12.347 -0.563 -1.292 1.00 0.95 C ATOM 0 H VAL A 11 -14.598 -1.734 -2.687 1.00 0.62 H new ATOM 0 HA VAL A 11 -12.237 -3.280 -3.399 1.00 0.61 H new ATOM 0 HB VAL A 11 -10.959 -1.493 -2.585 1.00 0.76 H new ATOM 0 HG11 VAL A 11 -11.899 0.495 -3.729 1.00 1.35 H new ATOM 0 HG12 VAL A 11 -12.091 -0.987 -4.696 1.00 1.35 H new ATOM 0 HG13 VAL A 11 -13.481 -0.316 -3.810 1.00 1.35 H new ATOM 0 HG21 VAL A 11 -11.833 0.398 -1.296 1.00 0.95 H new ATOM 0 HG22 VAL A 11 -13.422 -0.399 -1.220 1.00 0.95 H new ATOM 0 HG23 VAL A 11 -12.012 -1.150 -0.437 1.00 0.95 H new ATOM 171 N THR A 12 -11.517 -4.163 -1.151 1.00 0.44 N ATOM 172 CA THR A 12 -11.269 -4.930 0.056 1.00 0.45 C ATOM 173 C THR A 12 -10.385 -4.147 1.020 1.00 0.41 C ATOM 174 O THR A 12 -9.312 -3.678 0.643 1.00 0.50 O ATOM 175 CB THR A 12 -10.594 -6.276 -0.282 1.00 0.54 C ATOM 176 OG1 THR A 12 -11.416 -7.024 -1.190 1.00 0.61 O ATOM 177 CG2 THR A 12 -10.342 -7.099 0.974 1.00 0.64 C ATOM 0 H THR A 12 -10.793 -4.255 -1.863 1.00 0.44 H new ATOM 0 HA THR A 12 -12.231 -5.123 0.531 1.00 0.45 H new ATOM 0 HB THR A 12 -9.633 -6.060 -0.750 1.00 0.54 H new ATOM 0 HG1 THR A 12 -10.979 -7.876 -1.401 1.00 0.61 H new ATOM 0 HG21 THR A 12 -9.866 -8.041 0.702 1.00 0.64 H new ATOM 0 HG22 THR A 12 -9.690 -6.544 1.648 1.00 0.64 H new ATOM 0 HG23 THR A 12 -11.290 -7.302 1.472 1.00 0.64 H new ATOM 185 N ILE A 13 -10.850 -3.988 2.253 1.00 0.40 N ATOM 186 CA ILE A 13 -10.053 -3.345 3.287 1.00 0.40 C ATOM 187 C ILE A 13 -9.101 -4.355 3.920 1.00 0.37 C ATOM 188 O ILE A 13 -9.526 -5.390 4.425 1.00 0.52 O ATOM 189 CB ILE A 13 -10.936 -2.726 4.395 1.00 0.52 C ATOM 190 CG1 ILE A 13 -11.869 -1.665 3.811 1.00 1.15 C ATOM 191 CG2 ILE A 13 -10.070 -2.127 5.501 1.00 1.26 C ATOM 192 CD1 ILE A 13 -12.784 -1.029 4.837 1.00 1.30 C ATOM 0 H ILE A 13 -11.773 -4.295 2.560 1.00 0.40 H new ATOM 0 HA ILE A 13 -9.490 -2.544 2.808 1.00 0.40 H new ATOM 0 HB ILE A 13 -11.546 -3.519 4.828 1.00 0.52 H new ATOM 0 HG12 ILE A 13 -11.270 -0.886 3.339 1.00 1.15 H new ATOM 0 HG13 ILE A 13 -12.476 -2.119 3.027 1.00 1.15 H new ATOM 0 HG21 ILE A 13 -10.710 -1.696 6.271 1.00 1.26 H new ATOM 0 HG22 ILE A 13 -9.449 -2.908 5.940 1.00 1.26 H new ATOM 0 HG23 ILE A 13 -9.432 -1.349 5.082 1.00 1.26 H new ATOM 0 HD11 ILE A 13 -13.416 -0.287 4.350 1.00 1.30 H new ATOM 0 HD12 ILE A 13 -13.410 -1.797 5.292 1.00 1.30 H new ATOM 0 HD13 ILE A 13 -12.185 -0.545 5.608 1.00 1.30 H new ATOM 204 N MET A 14 -7.813 -4.062 3.873 1.00 0.26 N ATOM 205 CA MET A 14 -6.804 -4.910 4.456 1.00 0.28 C ATOM 206 C MET A 14 -5.851 -4.059 5.275 1.00 0.24 C ATOM 207 O MET A 14 -5.906 -2.831 5.220 1.00 0.29 O ATOM 208 CB MET A 14 -6.039 -5.648 3.358 1.00 0.36 C ATOM 209 CG MET A 14 -6.796 -6.819 2.746 1.00 0.49 C ATOM 210 SD MET A 14 -5.820 -7.697 1.506 1.00 0.79 S ATOM 211 CE MET A 14 -6.922 -9.034 1.069 1.00 0.69 C ATOM 0 H MET A 14 -7.442 -3.224 3.426 1.00 0.26 H new ATOM 0 HA MET A 14 -7.279 -5.648 5.102 1.00 0.28 H new ATOM 0 HB2 MET A 14 -5.787 -4.940 2.568 1.00 0.36 H new ATOM 0 HB3 MET A 14 -5.098 -6.014 3.770 1.00 0.36 H new ATOM 0 HG2 MET A 14 -7.085 -7.513 3.535 1.00 0.49 H new ATOM 0 HG3 MET A 14 -7.716 -6.454 2.289 1.00 0.49 H new ATOM 0 HE1 MET A 14 -6.338 -9.898 0.753 1.00 0.69 H new ATOM 0 HE2 MET A 14 -7.529 -9.303 1.934 1.00 0.69 H new ATOM 0 HE3 MET A 14 -7.572 -8.718 0.253 1.00 0.69 H new ATOM 221 N GLY A 15 -4.982 -4.699 6.036 1.00 0.27 N ATOM 222 CA GLY A 15 -4.046 -3.972 6.847 1.00 0.27 C ATOM 223 C GLY A 15 -3.934 -4.555 8.226 1.00 0.24 C ATOM 224 O GLY A 15 -4.615 -5.528 8.547 1.00 0.31 O ATOM 0 H GLY A 15 -4.911 -5.714 6.104 1.00 0.27 H new ATOM 0 HA2 GLY A 15 -3.067 -3.980 6.368 1.00 0.27 H new ATOM 0 HA3 GLY A 15 -4.358 -2.930 6.917 1.00 0.27 H new ATOM 228 N HIS A 16 -3.087 -3.961 9.043 1.00 0.20 N ATOM 229 CA HIS A 16 -2.823 -4.491 10.372 1.00 0.17 C ATOM 230 C HIS A 16 -3.846 -3.997 11.387 1.00 0.19 C ATOM 231 O HIS A 16 -4.530 -2.992 11.185 1.00 0.22 O ATOM 232 CB HIS A 16 -1.413 -4.111 10.830 1.00 0.17 C ATOM 233 CG HIS A 16 -0.971 -4.793 12.095 1.00 0.16 C ATOM 234 ND1 HIS A 16 -1.054 -6.156 12.250 1.00 0.16 N ATOM 235 CD2 HIS A 16 -0.471 -4.255 13.224 1.00 0.19 C ATOM 236 CE1 HIS A 16 -0.603 -6.406 13.470 1.00 0.19 C ATOM 237 NE2 HIS A 16 -0.238 -5.284 14.093 1.00 0.22 N ATOM 0 H HIS A 16 -2.569 -3.113 8.814 1.00 0.20 H new ATOM 0 HA HIS A 16 -2.902 -5.576 10.312 1.00 0.17 H new ATOM 0 HB2 HIS A 16 -0.708 -4.352 10.035 1.00 0.17 H new ATOM 0 HB3 HIS A 16 -1.370 -3.032 10.978 1.00 0.17 H new ATOM 0 HD2 HIS A 16 -0.288 -3.207 13.408 1.00 0.19 H new ATOM 0 HE1 HIS A 16 -0.539 -7.392 13.905 1.00 0.19 H new ATOM 0 HE2 HIS A 16 0.142 -5.209 15.037 1.00 0.22 H new ATOM 245 N VAL A 17 -3.946 -4.743 12.470 1.00 0.20 N ATOM 246 CA VAL A 17 -4.762 -4.377 13.612 1.00 0.25 C ATOM 247 C VAL A 17 -4.091 -3.248 14.379 1.00 0.26 C ATOM 248 O VAL A 17 -2.886 -3.073 14.267 1.00 0.25 O ATOM 249 CB VAL A 17 -4.947 -5.603 14.518 1.00 0.29 C ATOM 250 CG1 VAL A 17 -3.595 -6.183 14.902 1.00 0.30 C ATOM 251 CG2 VAL A 17 -5.737 -5.292 15.764 1.00 0.36 C ATOM 0 H VAL A 17 -3.457 -5.631 12.583 1.00 0.20 H new ATOM 0 HA VAL A 17 -5.740 -4.036 13.272 1.00 0.25 H new ATOM 0 HB VAL A 17 -5.517 -6.334 13.944 1.00 0.29 H new ATOM 0 HG11 VAL A 17 -3.741 -7.051 15.544 1.00 0.30 H new ATOM 0 HG12 VAL A 17 -3.059 -6.483 14.002 1.00 0.30 H new ATOM 0 HG13 VAL A 17 -3.015 -5.430 15.436 1.00 0.30 H new ATOM 0 HG21 VAL A 17 -5.837 -6.195 16.367 1.00 0.36 H new ATOM 0 HG22 VAL A 17 -5.219 -4.526 16.341 1.00 0.36 H new ATOM 0 HG23 VAL A 17 -6.727 -4.930 15.486 1.00 0.36 H new ATOM 261 N ASP A 18 -4.875 -2.459 15.115 1.00 0.31 N ATOM 262 CA ASP A 18 -4.353 -1.314 15.870 1.00 0.36 C ATOM 263 C ASP A 18 -3.978 -0.171 14.926 1.00 0.34 C ATOM 264 O ASP A 18 -3.837 0.978 15.341 1.00 0.41 O ATOM 265 CB ASP A 18 -3.156 -1.727 16.738 1.00 0.42 C ATOM 266 CG ASP A 18 -2.533 -0.563 17.482 1.00 0.55 C ATOM 267 OD1 ASP A 18 -3.089 -0.147 18.522 1.00 0.69 O ATOM 268 OD2 ASP A 18 -1.487 -0.049 17.023 1.00 0.59 O ATOM 0 H ASP A 18 -5.882 -2.592 15.206 1.00 0.31 H new ATOM 0 HA ASP A 18 -5.140 -0.959 16.536 1.00 0.36 H new ATOM 0 HB2 ASP A 18 -3.479 -2.480 17.457 1.00 0.42 H new ATOM 0 HB3 ASP A 18 -2.400 -2.193 16.106 1.00 0.42 H new ATOM 273 N HIS A 19 -3.828 -0.492 13.646 1.00 0.29 N ATOM 274 CA HIS A 19 -3.651 0.527 12.629 1.00 0.32 C ATOM 275 C HIS A 19 -5.016 1.013 12.173 1.00 0.43 C ATOM 276 O HIS A 19 -5.131 1.949 11.397 1.00 0.63 O ATOM 277 CB HIS A 19 -2.849 0.013 11.432 1.00 0.29 C ATOM 278 CG HIS A 19 -1.492 -0.507 11.774 1.00 0.22 C ATOM 279 ND1 HIS A 19 -0.591 -0.839 10.795 1.00 0.27 N ATOM 280 CD2 HIS A 19 -0.931 -0.736 12.984 1.00 0.21 C ATOM 281 CE1 HIS A 19 0.486 -1.260 11.423 1.00 0.26 C ATOM 282 NE2 HIS A 19 0.326 -1.216 12.747 1.00 0.24 N ATOM 0 H HIS A 19 -3.826 -1.449 13.293 1.00 0.29 H new ATOM 0 HA HIS A 19 -3.083 1.349 13.065 1.00 0.32 H new ATOM 0 HB2 HIS A 19 -3.416 -0.780 10.944 1.00 0.29 H new ATOM 0 HB3 HIS A 19 -2.743 0.821 10.708 1.00 0.29 H new ATOM 0 HD2 HIS A 19 -1.388 -0.571 13.949 1.00 0.21 H new ATOM 0 HE1 HIS A 19 1.385 -1.598 10.930 1.00 0.26 H new ATOM 0 HE2 HIS A 19 1.013 -1.489 13.450 1.00 0.24 H new ATOM 290 N GLY A 20 -6.063 0.360 12.652 1.00 0.42 N ATOM 291 CA GLY A 20 -7.380 0.888 12.418 1.00 0.54 C ATOM 292 C GLY A 20 -8.389 -0.113 11.895 1.00 0.57 C ATOM 293 O GLY A 20 -9.187 0.240 11.032 1.00 0.79 O ATOM 0 H GLY A 20 -6.023 -0.508 13.187 1.00 0.42 H new ATOM 0 HA2 GLY A 20 -7.757 1.308 13.350 1.00 0.54 H new ATOM 0 HA3 GLY A 20 -7.304 1.710 11.706 1.00 0.54 H new ATOM 297 N LYS A 21 -8.371 -1.356 12.388 1.00 0.61 N ATOM 298 CA LYS A 21 -9.362 -2.335 11.964 1.00 0.95 C ATOM 299 C LYS A 21 -10.787 -1.795 12.119 1.00 0.89 C ATOM 300 O LYS A 21 -11.493 -1.591 11.135 1.00 1.05 O ATOM 301 CB LYS A 21 -9.208 -3.609 12.776 1.00 1.36 C ATOM 302 CG LYS A 21 -9.336 -4.857 11.940 1.00 1.79 C ATOM 303 CD LYS A 21 -8.229 -4.929 10.904 1.00 2.30 C ATOM 304 CE LYS A 21 -8.416 -6.126 10.005 1.00 2.66 C ATOM 305 NZ LYS A 21 -7.301 -6.291 9.039 1.00 3.31 N ATOM 0 H LYS A 21 -7.692 -1.698 13.068 1.00 0.61 H new ATOM 0 HA LYS A 21 -9.193 -2.547 10.908 1.00 0.95 H new ATOM 0 HB2 LYS A 21 -8.235 -3.605 13.267 1.00 1.36 H new ATOM 0 HB3 LYS A 21 -9.962 -3.626 13.563 1.00 1.36 H new ATOM 0 HG2 LYS A 21 -9.296 -5.736 12.583 1.00 1.79 H new ATOM 0 HG3 LYS A 21 -10.306 -4.869 11.443 1.00 1.79 H new ATOM 0 HD2 LYS A 21 -8.223 -4.017 10.307 1.00 2.30 H new ATOM 0 HD3 LYS A 21 -7.261 -4.990 11.402 1.00 2.30 H new ATOM 0 HE2 LYS A 21 -8.500 -7.025 10.615 1.00 2.66 H new ATOM 0 HE3 LYS A 21 -9.354 -6.023 9.459 1.00 2.66 H new ATOM 0 HZ1 LYS A 21 -7.676 -6.629 8.130 1.00 3.31 H new ATOM 0 HZ2 LYS A 21 -6.825 -5.377 8.899 1.00 3.31 H new ATOM 0 HZ3 LYS A 21 -6.619 -6.983 9.410 1.00 3.31 H new ATOM 319 N THR A 22 -11.201 -1.566 13.357 1.00 0.84 N ATOM 320 CA THR A 22 -12.515 -1.008 13.628 1.00 0.87 C ATOM 321 C THR A 22 -12.458 0.521 13.656 1.00 0.79 C ATOM 322 O THR A 22 -13.423 1.196 13.302 1.00 0.79 O ATOM 323 CB THR A 22 -13.068 -1.540 14.967 1.00 1.02 C ATOM 324 OG1 THR A 22 -13.141 -2.973 14.927 1.00 1.21 O ATOM 325 CG2 THR A 22 -14.449 -0.970 15.269 1.00 1.18 C ATOM 0 H THR A 22 -10.644 -1.759 14.190 1.00 0.84 H new ATOM 0 HA THR A 22 -13.184 -1.318 12.825 1.00 0.87 H new ATOM 0 HB THR A 22 -12.389 -1.223 15.758 1.00 1.02 H new ATOM 0 HG1 THR A 22 -12.258 -3.351 15.120 1.00 1.21 H new ATOM 0 HG21 THR A 22 -14.807 -1.367 16.219 1.00 1.18 H new ATOM 0 HG22 THR A 22 -14.389 0.117 15.329 1.00 1.18 H new ATOM 0 HG23 THR A 22 -15.141 -1.252 14.475 1.00 1.18 H new ATOM 333 N THR A 23 -11.306 1.057 14.047 1.00 0.75 N ATOM 334 CA THR A 23 -11.129 2.494 14.200 1.00 0.75 C ATOM 335 C THR A 23 -11.413 3.266 12.911 1.00 0.67 C ATOM 336 O THR A 23 -11.925 4.375 12.960 1.00 0.66 O ATOM 337 CB THR A 23 -9.715 2.819 14.685 1.00 0.82 C ATOM 338 OG1 THR A 23 -8.968 1.604 14.845 1.00 1.25 O ATOM 339 CG2 THR A 23 -9.755 3.575 16.005 1.00 1.17 C ATOM 0 H THR A 23 -10.474 0.509 14.265 1.00 0.75 H new ATOM 0 HA THR A 23 -11.858 2.813 14.945 1.00 0.75 H new ATOM 0 HB THR A 23 -9.231 3.451 13.941 1.00 0.82 H new ATOM 0 HG1 THR A 23 -8.634 1.544 15.764 1.00 1.25 H new ATOM 0 HG21 THR A 23 -8.738 3.795 16.329 1.00 1.17 H new ATOM 0 HG22 THR A 23 -10.303 4.508 15.874 1.00 1.17 H new ATOM 0 HG23 THR A 23 -10.252 2.965 16.759 1.00 1.17 H new ATOM 347 N LEU A 24 -11.103 2.682 11.761 1.00 0.65 N ATOM 348 CA LEU A 24 -11.370 3.342 10.480 1.00 0.63 C ATOM 349 C LEU A 24 -12.836 3.265 10.144 1.00 0.64 C ATOM 350 O LEU A 24 -13.393 4.189 9.574 1.00 0.65 O ATOM 351 CB LEU A 24 -10.542 2.718 9.383 1.00 0.67 C ATOM 352 CG LEU A 24 -9.209 3.412 9.072 1.00 0.84 C ATOM 353 CD1 LEU A 24 -9.448 4.828 8.581 1.00 1.49 C ATOM 354 CD2 LEU A 24 -8.299 3.426 10.288 1.00 1.30 C ATOM 0 H LEU A 24 -10.670 1.762 11.683 1.00 0.65 H new ATOM 0 HA LEU A 24 -11.091 4.392 10.567 1.00 0.63 H new ATOM 0 HB2 LEU A 24 -10.336 1.683 9.654 1.00 0.67 H new ATOM 0 HB3 LEU A 24 -11.139 2.696 8.471 1.00 0.67 H new ATOM 0 HG LEU A 24 -8.714 2.844 8.284 1.00 0.84 H new ATOM 0 HD11 LEU A 24 -8.492 5.305 8.365 1.00 1.49 H new ATOM 0 HD12 LEU A 24 -10.053 4.802 7.675 1.00 1.49 H new ATOM 0 HD13 LEU A 24 -9.971 5.396 9.350 1.00 1.49 H new ATOM 0 HD21 LEU A 24 -7.363 3.924 10.036 1.00 1.30 H new ATOM 0 HD22 LEU A 24 -8.788 3.962 11.102 1.00 1.30 H new ATOM 0 HD23 LEU A 24 -8.093 2.402 10.600 1.00 1.30 H new ATOM 366 N LEU A 25 -13.482 2.187 10.536 1.00 0.68 N ATOM 367 CA LEU A 25 -14.907 2.064 10.312 1.00 0.75 C ATOM 368 C LEU A 25 -15.662 2.990 11.261 1.00 0.74 C ATOM 369 O LEU A 25 -16.880 3.122 11.176 1.00 0.82 O ATOM 370 CB LEU A 25 -15.376 0.622 10.482 1.00 0.85 C ATOM 371 CG LEU A 25 -16.224 0.101 9.323 1.00 0.92 C ATOM 372 CD1 LEU A 25 -15.378 0.006 8.061 1.00 1.63 C ATOM 373 CD2 LEU A 25 -16.844 -1.244 9.665 1.00 1.69 C ATOM 0 H LEU A 25 -13.049 1.392 11.006 1.00 0.68 H new ATOM 0 HA LEU A 25 -15.118 2.357 9.284 1.00 0.75 H new ATOM 0 HB2 LEU A 25 -14.504 -0.021 10.598 1.00 0.85 H new ATOM 0 HB3 LEU A 25 -15.953 0.545 11.404 1.00 0.85 H new ATOM 0 HG LEU A 25 -17.038 0.803 9.144 1.00 0.92 H new ATOM 0 HD11 LEU A 25 -15.990 -0.366 7.240 1.00 1.63 H new ATOM 0 HD12 LEU A 25 -14.991 0.993 7.807 1.00 1.63 H new ATOM 0 HD13 LEU A 25 -14.546 -0.677 8.231 1.00 1.63 H new ATOM 0 HD21 LEU A 25 -17.443 -1.593 8.824 1.00 1.69 H new ATOM 0 HD22 LEU A 25 -16.055 -1.966 9.873 1.00 1.69 H new ATOM 0 HD23 LEU A 25 -17.480 -1.139 10.544 1.00 1.69 H new ATOM 385 N ASP A 26 -14.922 3.592 12.185 1.00 0.71 N ATOM 386 CA ASP A 26 -15.464 4.591 13.096 1.00 0.75 C ATOM 387 C ASP A 26 -15.071 5.971 12.628 1.00 0.70 C ATOM 388 O ASP A 26 -15.890 6.879 12.524 1.00 0.76 O ATOM 389 CB ASP A 26 -14.917 4.377 14.492 1.00 0.81 C ATOM 390 CG ASP A 26 -15.317 5.483 15.453 1.00 1.01 C ATOM 391 OD1 ASP A 26 -16.481 5.481 15.917 1.00 1.13 O ATOM 392 OD2 ASP A 26 -14.485 6.356 15.743 1.00 1.23 O ATOM 0 H ASP A 26 -13.930 3.401 12.323 1.00 0.71 H new ATOM 0 HA ASP A 26 -16.550 4.496 13.111 1.00 0.75 H new ATOM 0 HB2 ASP A 26 -15.274 3.421 14.875 1.00 0.81 H new ATOM 0 HB3 ASP A 26 -13.830 4.316 14.447 1.00 0.81 H new ATOM 397 N ALA A 27 -13.792 6.097 12.328 1.00 0.63 N ATOM 398 CA ALA A 27 -13.213 7.359 11.898 1.00 0.61 C ATOM 399 C ALA A 27 -13.801 7.785 10.563 1.00 0.58 C ATOM 400 O ALA A 27 -14.133 8.949 10.347 1.00 0.62 O ATOM 401 CB ALA A 27 -11.709 7.206 11.793 1.00 0.61 C ATOM 0 H ALA A 27 -13.124 5.328 12.375 1.00 0.63 H new ATOM 0 HA ALA A 27 -13.446 8.132 12.630 1.00 0.61 H new ATOM 0 HB1 ALA A 27 -11.269 8.150 11.471 1.00 0.61 H new ATOM 0 HB2 ALA A 27 -11.303 6.930 12.766 1.00 0.61 H new ATOM 0 HB3 ALA A 27 -11.472 6.428 11.067 1.00 0.61 H new ATOM 407 N ILE A 28 -13.933 6.820 9.673 1.00 0.56 N ATOM 408 CA ILE A 28 -14.547 7.039 8.380 1.00 0.57 C ATOM 409 C ILE A 28 -16.059 7.175 8.538 1.00 0.64 C ATOM 410 O ILE A 28 -16.709 7.911 7.801 1.00 0.71 O ATOM 411 CB ILE A 28 -14.211 5.875 7.423 1.00 0.61 C ATOM 412 CG1 ILE A 28 -12.712 5.828 7.137 1.00 0.84 C ATOM 413 CG2 ILE A 28 -14.978 5.981 6.130 1.00 1.02 C ATOM 414 CD1 ILE A 28 -12.310 4.640 6.294 1.00 0.85 C ATOM 0 H ILE A 28 -13.617 5.862 9.827 1.00 0.56 H new ATOM 0 HA ILE A 28 -14.152 7.962 7.954 1.00 0.57 H new ATOM 0 HB ILE A 28 -14.508 4.951 7.918 1.00 0.61 H new ATOM 0 HG12 ILE A 28 -12.416 6.745 6.628 1.00 0.84 H new ATOM 0 HG13 ILE A 28 -12.168 5.798 8.081 1.00 0.84 H new ATOM 0 HG21 ILE A 28 -14.716 5.145 5.482 1.00 1.02 H new ATOM 0 HG22 ILE A 28 -16.048 5.957 6.338 1.00 1.02 H new ATOM 0 HG23 ILE A 28 -14.726 6.918 5.633 1.00 1.02 H new ATOM 0 HD11 ILE A 28 -11.233 4.662 6.125 1.00 0.85 H new ATOM 0 HD12 ILE A 28 -12.577 3.719 6.812 1.00 0.85 H new ATOM 0 HD13 ILE A 28 -12.829 4.681 5.336 1.00 0.85 H new ATOM 426 N ARG A 29 -16.610 6.479 9.524 1.00 0.70 N ATOM 427 CA ARG A 29 -18.033 6.574 9.831 1.00 0.82 C ATOM 428 C ARG A 29 -18.378 8.000 10.244 1.00 0.86 C ATOM 429 O ARG A 29 -19.446 8.516 9.930 1.00 1.07 O ATOM 430 CB ARG A 29 -18.390 5.614 10.966 1.00 0.99 C ATOM 431 CG ARG A 29 -19.880 5.447 11.202 1.00 1.06 C ATOM 432 CD ARG A 29 -20.504 4.508 10.179 1.00 1.06 C ATOM 433 NE ARG A 29 -20.084 3.120 10.375 1.00 1.62 N ATOM 434 CZ ARG A 29 -20.646 2.080 9.764 1.00 2.19 C ATOM 435 NH1 ARG A 29 -21.607 2.270 8.870 1.00 2.49 N ATOM 436 NH2 ARG A 29 -20.244 0.845 10.042 1.00 3.04 N ATOM 0 H ARG A 29 -16.092 5.840 10.127 1.00 0.70 H new ATOM 0 HA ARG A 29 -18.604 6.305 8.942 1.00 0.82 H new ATOM 0 HB2 ARG A 29 -17.957 4.637 10.749 1.00 0.99 H new ATOM 0 HB3 ARG A 29 -17.927 5.970 11.886 1.00 0.99 H new ATOM 0 HG2 ARG A 29 -20.049 5.058 12.206 1.00 1.06 H new ATOM 0 HG3 ARG A 29 -20.369 6.420 11.151 1.00 1.06 H new ATOM 0 HD2 ARG A 29 -21.590 4.570 10.246 1.00 1.06 H new ATOM 0 HD3 ARG A 29 -20.228 4.831 9.175 1.00 1.06 H new ATOM 0 HE ARG A 29 -19.314 2.939 11.019 1.00 1.62 H new ATOM 0 HH11 ARG A 29 -21.918 3.216 8.649 1.00 2.49 H new ATOM 0 HH12 ARG A 29 -22.035 1.470 8.404 1.00 2.49 H new ATOM 0 HH21 ARG A 29 -19.503 0.692 10.726 1.00 3.04 H new ATOM 0 HH22 ARG A 29 -20.677 0.050 9.572 1.00 3.04 H new ATOM 450 N HIS A 30 -17.444 8.622 10.950 1.00 0.83 N ATOM 451 CA HIS A 30 -17.622 9.964 11.474 1.00 0.98 C ATOM 452 C HIS A 30 -16.870 10.985 10.647 1.00 0.95 C ATOM 453 O HIS A 30 -16.494 12.051 11.130 1.00 1.10 O ATOM 454 CB HIS A 30 -17.115 10.019 12.890 1.00 1.15 C ATOM 455 CG HIS A 30 -17.904 9.225 13.870 1.00 1.60 C ATOM 456 ND1 HIS A 30 -17.341 8.559 14.932 1.00 2.04 N ATOM 457 CD2 HIS A 30 -19.219 9.010 13.943 1.00 2.10 C ATOM 458 CE1 HIS A 30 -18.293 7.963 15.624 1.00 2.61 C ATOM 459 NE2 HIS A 30 -19.448 8.222 15.043 1.00 2.65 N ATOM 0 H HIS A 30 -16.540 8.207 11.175 1.00 0.83 H new ATOM 0 HA HIS A 30 -18.685 10.201 11.437 1.00 0.98 H new ATOM 0 HB2 HIS A 30 -16.084 9.666 12.905 1.00 1.15 H new ATOM 0 HB3 HIS A 30 -17.101 11.059 13.215 1.00 1.15 H new ATOM 0 HD2 HIS A 30 -19.967 9.387 13.261 1.00 2.10 H new ATOM 0 HE1 HIS A 30 -18.151 7.366 16.513 1.00 2.61 H new ATOM 0 HE2 HIS A 30 -20.360 7.892 15.359 1.00 2.65 H new ATOM 468 N SER A 31 -16.633 10.632 9.417 1.00 0.82 N ATOM 469 CA SER A 31 -16.008 11.537 8.477 1.00 0.84 C ATOM 470 C SER A 31 -17.105 12.360 7.836 1.00 1.00 C ATOM 471 O SER A 31 -17.014 13.585 7.748 1.00 1.38 O ATOM 472 CB SER A 31 -15.199 10.772 7.416 1.00 0.78 C ATOM 473 OG SER A 31 -16.042 10.043 6.539 1.00 1.46 O ATOM 0 H SER A 31 -16.863 9.716 9.032 1.00 0.82 H new ATOM 0 HA SER A 31 -15.302 12.185 8.996 1.00 0.84 H new ATOM 0 HB2 SER A 31 -14.596 11.475 6.841 1.00 0.78 H new ATOM 0 HB3 SER A 31 -14.508 10.088 7.909 1.00 0.78 H new ATOM 0 HG SER A 31 -16.146 9.127 6.871 1.00 1.46 H new ATOM 479 N LYS A 32 -18.161 11.655 7.434 1.00 0.91 N ATOM 480 CA LYS A 32 -19.349 12.252 6.869 1.00 1.09 C ATOM 481 C LYS A 32 -20.324 11.143 6.503 1.00 1.10 C ATOM 482 O LYS A 32 -20.141 10.015 6.951 1.00 1.37 O ATOM 483 CB LYS A 32 -18.993 13.120 5.661 1.00 1.39 C ATOM 484 CG LYS A 32 -18.625 12.366 4.398 1.00 1.56 C ATOM 485 CD LYS A 32 -18.230 13.338 3.296 1.00 2.24 C ATOM 486 CE LYS A 32 -17.737 12.624 2.050 1.00 3.10 C ATOM 487 NZ LYS A 32 -17.552 13.572 0.918 1.00 3.92 N ATOM 0 H LYS A 32 -18.207 10.638 7.497 1.00 0.91 H new ATOM 0 HA LYS A 32 -19.822 12.908 7.599 1.00 1.09 H new ATOM 0 HB2 LYS A 32 -19.840 13.770 5.441 1.00 1.39 H new ATOM 0 HB3 LYS A 32 -18.158 13.766 5.934 1.00 1.39 H new ATOM 0 HG2 LYS A 32 -17.800 11.683 4.602 1.00 1.56 H new ATOM 0 HG3 LYS A 32 -19.469 11.758 4.071 1.00 1.56 H new ATOM 0 HD2 LYS A 32 -19.086 13.962 3.040 1.00 2.24 H new ATOM 0 HD3 LYS A 32 -17.449 14.004 3.664 1.00 2.24 H new ATOM 0 HE2 LYS A 32 -16.793 12.123 2.265 1.00 3.10 H new ATOM 0 HE3 LYS A 32 -18.450 11.850 1.766 1.00 3.10 H new ATOM 0 HZ1 LYS A 32 -17.215 13.053 0.082 1.00 3.92 H new ATOM 0 HZ2 LYS A 32 -18.459 14.031 0.698 1.00 3.92 H new ATOM 0 HZ3 LYS A 32 -16.853 14.295 1.182 1.00 3.92 H new ATOM 501 N VAL A 33 -21.327 11.483 5.690 1.00 1.17 N ATOM 502 CA VAL A 33 -22.445 10.597 5.291 1.00 1.39 C ATOM 503 C VAL A 33 -23.187 9.944 6.478 1.00 1.51 C ATOM 504 O VAL A 33 -24.374 10.197 6.684 1.00 2.31 O ATOM 505 CB VAL A 33 -22.067 9.521 4.217 1.00 2.16 C ATOM 506 CG1 VAL A 33 -20.978 8.559 4.667 1.00 3.10 C ATOM 507 CG2 VAL A 33 -23.306 8.742 3.803 1.00 3.06 C ATOM 0 H VAL A 33 -21.394 12.411 5.273 1.00 1.17 H new ATOM 0 HA VAL A 33 -23.141 11.288 4.815 1.00 1.39 H new ATOM 0 HB VAL A 33 -21.660 10.069 3.368 1.00 2.16 H new ATOM 0 HG11 VAL A 33 -20.772 7.845 3.870 1.00 3.10 H new ATOM 0 HG12 VAL A 33 -20.071 9.118 4.897 1.00 3.10 H new ATOM 0 HG13 VAL A 33 -21.310 8.024 5.557 1.00 3.10 H new ATOM 0 HG21 VAL A 33 -23.034 7.996 3.056 1.00 3.06 H new ATOM 0 HG22 VAL A 33 -23.731 8.244 4.675 1.00 3.06 H new ATOM 0 HG23 VAL A 33 -24.042 9.426 3.381 1.00 3.06 H new ATOM 517 N THR A 34 -22.499 9.126 7.249 1.00 1.46 N ATOM 518 CA THR A 34 -23.106 8.363 8.321 1.00 1.91 C ATOM 519 C THR A 34 -22.702 8.915 9.687 1.00 2.50 C ATOM 520 O THR A 34 -21.917 9.861 9.774 1.00 2.78 O ATOM 521 CB THR A 34 -22.651 6.897 8.209 1.00 1.83 C ATOM 522 OG1 THR A 34 -21.220 6.825 8.212 1.00 2.42 O ATOM 523 CG2 THR A 34 -23.182 6.256 6.938 1.00 1.73 C ATOM 0 H THR A 34 -21.496 8.971 7.149 1.00 1.46 H new ATOM 0 HA THR A 34 -24.190 8.435 8.231 1.00 1.91 H new ATOM 0 HB THR A 34 -23.049 6.356 9.067 1.00 1.83 H new ATOM 0 HG1 THR A 34 -20.925 6.157 7.558 1.00 2.42 H new ATOM 0 HG21 THR A 34 -22.845 5.221 6.885 1.00 1.73 H new ATOM 0 HG22 THR A 34 -24.272 6.283 6.945 1.00 1.73 H new ATOM 0 HG23 THR A 34 -22.811 6.803 6.072 1.00 1.73 H new ATOM 531 N GLU A 35 -23.263 8.346 10.753 1.00 3.15 N ATOM 532 CA GLU A 35 -22.829 8.664 12.106 1.00 3.98 C ATOM 533 C GLU A 35 -22.807 7.403 12.975 1.00 4.05 C ATOM 534 O GLU A 35 -21.906 7.222 13.792 1.00 4.33 O ATOM 535 CB GLU A 35 -23.717 9.745 12.742 1.00 4.75 C ATOM 536 CG GLU A 35 -25.123 9.283 13.080 1.00 5.08 C ATOM 537 CD GLU A 35 -25.957 10.372 13.713 1.00 5.84 C ATOM 538 OE1 GLU A 35 -25.703 10.712 14.887 1.00 6.34 O ATOM 539 OE2 GLU A 35 -26.865 10.902 13.039 1.00 6.16 O ATOM 0 H GLU A 35 -24.019 7.663 10.702 1.00 3.15 H new ATOM 0 HA GLU A 35 -21.816 9.062 12.045 1.00 3.98 H new ATOM 0 HB2 GLU A 35 -23.237 10.103 13.653 1.00 4.75 H new ATOM 0 HB3 GLU A 35 -23.780 10.593 12.060 1.00 4.75 H new ATOM 0 HG2 GLU A 35 -25.615 8.935 12.172 1.00 5.08 H new ATOM 0 HG3 GLU A 35 -25.068 8.432 13.759 1.00 5.08 H new ATOM 546 N GLN A 36 -23.790 6.529 12.783 1.00 4.07 N ATOM 547 CA GLN A 36 -23.840 5.261 13.503 1.00 4.38 C ATOM 548 C GLN A 36 -24.511 4.184 12.655 1.00 4.02 C ATOM 549 O GLN A 36 -23.846 3.440 11.933 1.00 4.41 O ATOM 550 CB GLN A 36 -24.579 5.404 14.844 1.00 5.16 C ATOM 551 CG GLN A 36 -24.676 4.095 15.621 1.00 5.59 C ATOM 552 CD GLN A 36 -25.708 4.142 16.731 1.00 6.26 C ATOM 553 OE1 GLN A 36 -26.885 3.856 16.509 1.00 6.59 O ATOM 554 NE2 GLN A 36 -25.276 4.476 17.935 1.00 6.79 N ATOM 0 H GLN A 36 -24.563 6.676 12.134 1.00 4.07 H new ATOM 0 HA GLN A 36 -22.812 4.963 13.709 1.00 4.38 H new ATOM 0 HB2 GLN A 36 -24.066 6.145 15.457 1.00 5.16 H new ATOM 0 HB3 GLN A 36 -25.584 5.784 14.659 1.00 5.16 H new ATOM 0 HG2 GLN A 36 -24.927 3.288 14.933 1.00 5.59 H new ATOM 0 HG3 GLN A 36 -23.701 3.859 16.048 1.00 5.59 H new ATOM 0 HE21 GLN A 36 -24.293 4.706 18.078 1.00 6.79 H new ATOM 0 HE22 GLN A 36 -25.926 4.503 18.721 1.00 6.79 H new ATOM 563 N GLU A 37 -25.834 4.124 12.714 1.00 3.65 N ATOM 564 CA GLU A 37 -26.572 3.063 12.053 1.00 3.72 C ATOM 565 C GLU A 37 -26.965 3.474 10.644 1.00 3.46 C ATOM 566 O GLU A 37 -28.072 3.954 10.408 1.00 3.48 O ATOM 567 CB GLU A 37 -27.813 2.675 12.859 1.00 4.27 C ATOM 568 CG GLU A 37 -28.549 1.472 12.295 1.00 4.95 C ATOM 569 CD GLU A 37 -29.805 1.146 13.070 1.00 5.60 C ATOM 570 OE1 GLU A 37 -30.852 1.769 12.794 1.00 6.24 O ATOM 571 OE2 GLU A 37 -29.748 0.278 13.968 1.00 5.76 O ATOM 0 H GLU A 37 -26.415 4.798 13.213 1.00 3.65 H new ATOM 0 HA GLU A 37 -25.919 2.193 11.989 1.00 3.72 H new ATOM 0 HB2 GLU A 37 -27.517 2.462 13.886 1.00 4.27 H new ATOM 0 HB3 GLU A 37 -28.495 3.525 12.893 1.00 4.27 H new ATOM 0 HG2 GLU A 37 -28.808 1.664 11.254 1.00 4.95 H new ATOM 0 HG3 GLU A 37 -27.886 0.607 12.304 1.00 4.95 H new ATOM 578 N ALA A 38 -26.038 3.308 9.722 1.00 3.77 N ATOM 579 CA ALA A 38 -26.299 3.555 8.319 1.00 4.17 C ATOM 580 C ALA A 38 -25.336 2.745 7.470 1.00 4.07 C ATOM 581 O ALA A 38 -24.136 2.703 7.751 1.00 4.46 O ATOM 582 CB ALA A 38 -26.186 5.037 7.999 1.00 4.95 C ATOM 0 H ALA A 38 -25.087 2.999 9.923 1.00 3.77 H new ATOM 0 HA ALA A 38 -27.319 3.245 8.091 1.00 4.17 H new ATOM 0 HB1 ALA A 38 -26.386 5.197 6.940 1.00 4.95 H new ATOM 0 HB2 ALA A 38 -26.910 5.594 8.593 1.00 4.95 H new ATOM 0 HB3 ALA A 38 -25.180 5.384 8.234 1.00 4.95 H new ATOM 588 N GLY A 39 -25.863 2.072 6.466 1.00 4.00 N ATOM 589 CA GLY A 39 -25.035 1.255 5.606 1.00 4.22 C ATOM 590 C GLY A 39 -24.926 -0.166 6.108 1.00 4.22 C ATOM 591 O GLY A 39 -25.305 -1.108 5.415 1.00 4.68 O ATOM 0 H GLY A 39 -26.855 2.075 6.228 1.00 4.00 H new ATOM 0 HA2 GLY A 39 -25.451 1.253 4.598 1.00 4.22 H new ATOM 0 HA3 GLY A 39 -24.039 1.693 5.539 1.00 4.22 H new ATOM 595 N GLY A 40 -24.426 -0.321 7.327 1.00 4.14 N ATOM 596 CA GLY A 40 -24.287 -1.644 7.901 1.00 4.55 C ATOM 597 C GLY A 40 -23.567 -1.637 9.237 1.00 4.28 C ATOM 598 O GLY A 40 -22.392 -1.268 9.313 1.00 4.37 O ATOM 0 H GLY A 40 -24.115 0.443 7.927 1.00 4.14 H new ATOM 0 HA2 GLY A 40 -25.276 -2.084 8.030 1.00 4.55 H new ATOM 0 HA3 GLY A 40 -23.743 -2.281 7.204 1.00 4.55 H new ATOM 602 N ILE A 41 -24.290 -2.016 10.287 1.00 4.35 N ATOM 603 CA ILE A 41 -23.716 -2.214 11.619 1.00 4.40 C ATOM 604 C ILE A 41 -24.434 -3.364 12.316 1.00 4.54 C ATOM 605 O ILE A 41 -25.612 -3.615 12.052 1.00 5.04 O ATOM 606 CB ILE A 41 -23.790 -0.939 12.510 1.00 4.99 C ATOM 607 CG1 ILE A 41 -25.181 -0.294 12.471 1.00 5.27 C ATOM 608 CG2 ILE A 41 -22.730 0.072 12.107 1.00 5.57 C ATOM 609 CD1 ILE A 41 -26.154 -0.865 13.483 1.00 5.56 C ATOM 0 H ILE A 41 -25.293 -2.195 10.240 1.00 4.35 H new ATOM 0 HA ILE A 41 -22.660 -2.446 11.480 1.00 4.40 H new ATOM 0 HB ILE A 41 -23.598 -1.256 13.535 1.00 4.99 H new ATOM 0 HG12 ILE A 41 -25.079 0.777 12.645 1.00 5.27 H new ATOM 0 HG13 ILE A 41 -25.599 -0.416 11.472 1.00 5.27 H new ATOM 0 HG21 ILE A 41 -22.805 0.952 12.746 1.00 5.57 H new ATOM 0 HG22 ILE A 41 -21.741 -0.374 12.218 1.00 5.57 H new ATOM 0 HG23 ILE A 41 -22.882 0.364 11.068 1.00 5.57 H new ATOM 0 HD11 ILE A 41 -27.114 -0.357 13.392 1.00 5.56 H new ATOM 0 HD12 ILE A 41 -26.289 -1.931 13.297 1.00 5.56 H new ATOM 0 HD13 ILE A 41 -25.760 -0.719 14.489 1.00 5.56 H new ATOM 621 N THR A 42 -23.729 -4.083 13.175 1.00 4.43 N ATOM 622 CA THR A 42 -24.324 -5.192 13.912 1.00 4.86 C ATOM 623 C THR A 42 -23.553 -5.445 15.206 1.00 4.64 C ATOM 624 O THR A 42 -24.012 -5.104 16.295 1.00 4.68 O ATOM 625 CB THR A 42 -24.339 -6.491 13.070 1.00 5.21 C ATOM 626 OG1 THR A 42 -25.017 -6.274 11.824 1.00 5.55 O ATOM 627 CG2 THR A 42 -25.024 -7.622 13.825 1.00 5.93 C ATOM 0 H THR A 42 -22.743 -3.920 13.381 1.00 4.43 H new ATOM 0 HA THR A 42 -25.352 -4.914 14.142 1.00 4.86 H new ATOM 0 HB THR A 42 -23.304 -6.772 12.876 1.00 5.21 H new ATOM 0 HG1 THR A 42 -25.017 -7.104 11.303 1.00 5.55 H new ATOM 0 HG21 THR A 42 -25.021 -8.523 13.212 1.00 5.93 H new ATOM 0 HG22 THR A 42 -24.489 -7.815 14.755 1.00 5.93 H new ATOM 0 HG23 THR A 42 -26.052 -7.339 14.049 1.00 5.93 H new ATOM 635 N GLN A 43 -22.365 -6.015 15.064 1.00 4.73 N ATOM 636 CA GLN A 43 -21.528 -6.376 16.196 1.00 4.79 C ATOM 637 C GLN A 43 -20.107 -6.586 15.705 1.00 4.45 C ATOM 638 O GLN A 43 -19.172 -5.918 16.154 1.00 4.74 O ATOM 639 CB GLN A 43 -22.068 -7.635 16.873 1.00 5.52 C ATOM 640 CG GLN A 43 -21.201 -8.153 18.010 1.00 5.96 C ATOM 641 CD GLN A 43 -21.812 -9.362 18.683 1.00 6.23 C ATOM 642 OE1 GLN A 43 -22.541 -10.134 18.057 1.00 6.39 O ATOM 643 NE2 GLN A 43 -21.518 -9.543 19.957 1.00 6.63 N ATOM 0 H GLN A 43 -21.955 -6.240 14.158 1.00 4.73 H new ATOM 0 HA GLN A 43 -21.536 -5.575 16.936 1.00 4.79 H new ATOM 0 HB2 GLN A 43 -23.066 -7.427 17.258 1.00 5.52 H new ATOM 0 HB3 GLN A 43 -22.172 -8.420 16.124 1.00 5.52 H new ATOM 0 HG2 GLN A 43 -20.215 -8.412 17.625 1.00 5.96 H new ATOM 0 HG3 GLN A 43 -21.058 -7.362 18.746 1.00 5.96 H new ATOM 0 HE21 GLN A 43 -20.910 -8.881 20.439 1.00 6.63 H new ATOM 0 HE22 GLN A 43 -21.898 -10.345 20.459 1.00 6.63 H new ATOM 652 N HIS A 44 -19.945 -7.526 14.784 1.00 4.15 N ATOM 653 CA HIS A 44 -18.697 -7.643 14.048 1.00 4.05 C ATOM 654 C HIS A 44 -18.673 -6.553 12.983 1.00 3.55 C ATOM 655 O HIS A 44 -19.698 -6.275 12.355 1.00 3.72 O ATOM 656 CB HIS A 44 -18.552 -9.040 13.408 1.00 4.61 C ATOM 657 CG HIS A 44 -19.290 -9.222 12.111 1.00 5.23 C ATOM 658 ND1 HIS A 44 -18.685 -9.125 10.876 1.00 5.76 N ATOM 659 CD2 HIS A 44 -20.591 -9.489 11.867 1.00 5.72 C ATOM 660 CE1 HIS A 44 -19.586 -9.320 9.930 1.00 6.54 C ATOM 661 NE2 HIS A 44 -20.751 -9.543 10.505 1.00 6.49 N ATOM 0 H HIS A 44 -20.656 -8.212 14.531 1.00 4.15 H new ATOM 0 HA HIS A 44 -17.856 -7.520 14.730 1.00 4.05 H new ATOM 0 HB2 HIS A 44 -17.494 -9.237 13.238 1.00 4.61 H new ATOM 0 HB3 HIS A 44 -18.905 -9.787 14.118 1.00 4.61 H new ATOM 0 HD2 HIS A 44 -21.364 -9.634 12.608 1.00 5.72 H new ATOM 0 HE1 HIS A 44 -19.400 -9.300 8.866 1.00 6.54 H new ATOM 0 HE2 HIS A 44 -21.628 -9.726 10.017 1.00 6.49 H new ATOM 670 N ILE A 45 -17.534 -5.915 12.793 1.00 3.31 N ATOM 671 CA ILE A 45 -17.431 -4.868 11.797 1.00 3.06 C ATOM 672 C ILE A 45 -17.240 -5.445 10.404 1.00 2.33 C ATOM 673 O ILE A 45 -16.896 -6.618 10.237 1.00 2.50 O ATOM 674 CB ILE A 45 -16.303 -3.861 12.119 1.00 3.87 C ATOM 675 CG1 ILE A 45 -15.005 -4.561 12.546 1.00 4.51 C ATOM 676 CG2 ILE A 45 -16.764 -2.885 13.188 1.00 4.43 C ATOM 677 CD1 ILE A 45 -14.181 -5.096 11.392 1.00 5.17 C ATOM 0 H ILE A 45 -16.675 -6.101 13.310 1.00 3.31 H new ATOM 0 HA ILE A 45 -18.376 -4.325 11.822 1.00 3.06 H new ATOM 0 HB ILE A 45 -16.081 -3.311 11.204 1.00 3.87 H new ATOM 0 HG12 ILE A 45 -14.397 -3.859 13.117 1.00 4.51 H new ATOM 0 HG13 ILE A 45 -15.253 -5.386 13.214 1.00 4.51 H new ATOM 0 HG21 ILE A 45 -15.962 -2.180 13.407 1.00 4.43 H new ATOM 0 HG22 ILE A 45 -17.638 -2.340 12.831 1.00 4.43 H new ATOM 0 HG23 ILE A 45 -17.023 -3.433 14.094 1.00 4.43 H new ATOM 0 HD11 ILE A 45 -13.282 -5.575 11.779 1.00 5.17 H new ATOM 0 HD12 ILE A 45 -14.768 -5.824 10.832 1.00 5.17 H new ATOM 0 HD13 ILE A 45 -13.900 -4.274 10.734 1.00 5.17 H new ATOM 689 N GLY A 46 -17.493 -4.610 9.415 1.00 2.18 N ATOM 690 CA GLY A 46 -17.316 -4.992 8.034 1.00 2.10 C ATOM 691 C GLY A 46 -17.054 -3.774 7.179 1.00 1.86 C ATOM 692 O GLY A 46 -15.910 -3.355 7.033 1.00 2.51 O ATOM 0 H GLY A 46 -17.825 -3.655 9.548 1.00 2.18 H new ATOM 0 HA2 GLY A 46 -16.484 -5.691 7.947 1.00 2.10 H new ATOM 0 HA3 GLY A 46 -18.206 -5.510 7.677 1.00 2.10 H new ATOM 696 N ALA A 47 -18.123 -3.187 6.653 1.00 1.36 N ATOM 697 CA ALA A 47 -18.025 -1.981 5.845 1.00 1.12 C ATOM 698 C ALA A 47 -19.404 -1.511 5.414 1.00 1.01 C ATOM 699 O ALA A 47 -20.415 -1.992 5.923 1.00 1.17 O ATOM 700 CB ALA A 47 -17.152 -2.218 4.634 1.00 1.29 C ATOM 0 H ALA A 47 -19.075 -3.532 6.774 1.00 1.36 H new ATOM 0 HA ALA A 47 -17.567 -1.202 6.455 1.00 1.12 H new ATOM 0 HB1 ALA A 47 -17.092 -1.304 4.044 1.00 1.29 H new ATOM 0 HB2 ALA A 47 -16.152 -2.507 4.957 1.00 1.29 H new ATOM 0 HB3 ALA A 47 -17.581 -3.015 4.026 1.00 1.29 H new ATOM 706 N TYR A 48 -19.433 -0.583 4.465 1.00 0.85 N ATOM 707 CA TYR A 48 -20.672 0.033 4.018 1.00 0.89 C ATOM 708 C TYR A 48 -20.401 0.913 2.805 1.00 0.81 C ATOM 709 O TYR A 48 -19.245 1.205 2.488 1.00 0.73 O ATOM 710 CB TYR A 48 -21.310 0.862 5.146 1.00 0.97 C ATOM 711 CG TYR A 48 -20.478 2.040 5.602 1.00 0.94 C ATOM 712 CD1 TYR A 48 -19.250 1.849 6.220 1.00 0.92 C ATOM 713 CD2 TYR A 48 -20.928 3.340 5.423 1.00 1.20 C ATOM 714 CE1 TYR A 48 -18.492 2.922 6.647 1.00 1.15 C ATOM 715 CE2 TYR A 48 -20.177 4.419 5.847 1.00 1.40 C ATOM 716 CZ TYR A 48 -18.961 4.204 6.456 1.00 1.37 C ATOM 717 OH TYR A 48 -18.215 5.275 6.883 1.00 1.70 O ATOM 0 H TYR A 48 -18.601 -0.239 3.986 1.00 0.85 H new ATOM 0 HA TYR A 48 -21.372 -0.755 3.740 1.00 0.89 H new ATOM 0 HB2 TYR A 48 -22.280 1.227 4.808 1.00 0.97 H new ATOM 0 HB3 TYR A 48 -21.494 0.210 6.000 1.00 0.97 H new ATOM 0 HD1 TYR A 48 -18.881 0.845 6.369 1.00 0.92 H new ATOM 0 HD2 TYR A 48 -21.881 3.511 4.944 1.00 1.20 H new ATOM 0 HE1 TYR A 48 -17.539 2.758 7.127 1.00 1.15 H new ATOM 0 HE2 TYR A 48 -20.541 5.425 5.702 1.00 1.40 H new ATOM 0 HH TYR A 48 -18.687 6.107 6.672 1.00 1.70 H new ATOM 727 N GLN A 49 -21.461 1.316 2.126 1.00 0.91 N ATOM 728 CA GLN A 49 -21.342 2.168 0.957 1.00 0.89 C ATOM 729 C GLN A 49 -21.226 3.622 1.390 1.00 0.90 C ATOM 730 O GLN A 49 -22.205 4.223 1.839 1.00 1.02 O ATOM 731 CB GLN A 49 -22.547 2.000 0.022 1.00 1.02 C ATOM 732 CG GLN A 49 -22.807 0.569 -0.430 1.00 1.09 C ATOM 733 CD GLN A 49 -23.524 -0.267 0.617 1.00 1.45 C ATOM 734 OE1 GLN A 49 -22.899 -0.923 1.449 1.00 1.87 O ATOM 735 NE2 GLN A 49 -24.845 -0.249 0.577 1.00 1.91 N ATOM 0 H GLN A 49 -22.420 1.064 2.367 1.00 0.91 H new ATOM 0 HA GLN A 49 -20.445 1.874 0.412 1.00 0.89 H new ATOM 0 HB2 GLN A 49 -23.437 2.374 0.528 1.00 1.02 H new ATOM 0 HB3 GLN A 49 -22.395 2.623 -0.859 1.00 1.02 H new ATOM 0 HG2 GLN A 49 -23.402 0.585 -1.343 1.00 1.09 H new ATOM 0 HG3 GLN A 49 -21.857 0.094 -0.677 1.00 1.09 H new ATOM 0 HE21 GLN A 49 -25.326 0.308 -0.129 1.00 1.91 H new ATOM 0 HE22 GLN A 49 -25.383 -0.792 1.252 1.00 1.91 H new ATOM 744 N VAL A 50 -20.033 4.177 1.264 1.00 0.85 N ATOM 745 CA VAL A 50 -19.778 5.541 1.699 1.00 0.91 C ATOM 746 C VAL A 50 -20.219 6.531 0.624 1.00 0.96 C ATOM 747 O VAL A 50 -20.265 6.207 -0.563 1.00 1.01 O ATOM 748 CB VAL A 50 -18.281 5.757 2.022 1.00 0.93 C ATOM 749 CG1 VAL A 50 -18.058 7.076 2.747 1.00 1.53 C ATOM 750 CG2 VAL A 50 -17.735 4.596 2.844 1.00 1.34 C ATOM 0 H VAL A 50 -19.223 3.703 0.863 1.00 0.85 H new ATOM 0 HA VAL A 50 -20.354 5.712 2.608 1.00 0.91 H new ATOM 0 HB VAL A 50 -17.739 5.798 1.077 1.00 0.93 H new ATOM 0 HG11 VAL A 50 -16.996 7.199 2.960 1.00 1.53 H new ATOM 0 HG12 VAL A 50 -18.400 7.899 2.119 1.00 1.53 H new ATOM 0 HG13 VAL A 50 -18.618 7.077 3.682 1.00 1.53 H new ATOM 0 HG21 VAL A 50 -16.681 4.768 3.060 1.00 1.34 H new ATOM 0 HG22 VAL A 50 -18.290 4.520 3.779 1.00 1.34 H new ATOM 0 HG23 VAL A 50 -17.844 3.669 2.281 1.00 1.34 H new ATOM 760 N THR A 51 -20.552 7.735 1.045 1.00 1.09 N ATOM 761 CA THR A 51 -20.993 8.761 0.128 1.00 1.16 C ATOM 762 C THR A 51 -19.860 9.741 -0.185 1.00 1.19 C ATOM 763 O THR A 51 -19.631 10.714 0.531 1.00 1.28 O ATOM 764 CB THR A 51 -22.244 9.499 0.672 1.00 1.29 C ATOM 765 OG1 THR A 51 -23.385 8.626 0.594 1.00 1.51 O ATOM 766 CG2 THR A 51 -22.534 10.772 -0.104 1.00 1.42 C ATOM 0 H THR A 51 -20.524 8.025 2.022 1.00 1.09 H new ATOM 0 HA THR A 51 -21.279 8.276 -0.805 1.00 1.16 H new ATOM 0 HB THR A 51 -22.044 9.775 1.707 1.00 1.29 H new ATOM 0 HG1 THR A 51 -24.074 9.038 0.032 1.00 1.51 H new ATOM 0 HG21 THR A 51 -23.418 11.257 0.310 1.00 1.42 H new ATOM 0 HG22 THR A 51 -21.681 11.446 -0.029 1.00 1.42 H new ATOM 0 HG23 THR A 51 -22.711 10.527 -1.151 1.00 1.42 H new ATOM 774 N VAL A 52 -19.114 9.433 -1.239 1.00 1.36 N ATOM 775 CA VAL A 52 -18.158 10.378 -1.803 1.00 1.62 C ATOM 776 C VAL A 52 -18.934 11.404 -2.616 1.00 1.81 C ATOM 777 O VAL A 52 -18.758 12.615 -2.486 1.00 2.11 O ATOM 778 CB VAL A 52 -17.104 9.669 -2.701 1.00 1.88 C ATOM 779 CG1 VAL A 52 -17.777 8.799 -3.759 1.00 1.98 C ATOM 780 CG2 VAL A 52 -16.188 10.686 -3.361 1.00 2.27 C ATOM 0 H VAL A 52 -19.153 8.535 -1.721 1.00 1.36 H new ATOM 0 HA VAL A 52 -17.612 10.859 -0.992 1.00 1.62 H new ATOM 0 HB VAL A 52 -16.504 9.023 -2.060 1.00 1.88 H new ATOM 0 HG11 VAL A 52 -17.015 8.316 -4.371 1.00 1.98 H new ATOM 0 HG12 VAL A 52 -18.386 8.038 -3.271 1.00 1.98 H new ATOM 0 HG13 VAL A 52 -18.411 9.420 -4.392 1.00 1.98 H new ATOM 0 HG21 VAL A 52 -15.459 10.168 -3.984 1.00 2.27 H new ATOM 0 HG22 VAL A 52 -16.780 11.361 -3.979 1.00 2.27 H new ATOM 0 HG23 VAL A 52 -15.668 11.259 -2.594 1.00 2.27 H new ATOM 790 N ASN A 53 -19.801 10.872 -3.450 1.00 1.81 N ATOM 791 CA ASN A 53 -20.796 11.625 -4.147 1.00 1.99 C ATOM 792 C ASN A 53 -22.147 11.201 -3.610 1.00 1.80 C ATOM 793 O ASN A 53 -22.922 12.017 -3.113 1.00 1.82 O ATOM 794 CB ASN A 53 -20.688 11.388 -5.659 1.00 2.39 C ATOM 795 CG ASN A 53 -20.297 9.983 -6.059 1.00 3.10 C ATOM 796 OD1 ASN A 53 -20.551 9.008 -5.353 1.00 3.68 O ATOM 797 ND2 ASN A 53 -19.678 9.878 -7.215 1.00 3.42 N ATOM 0 H ASN A 53 -19.826 9.874 -3.661 1.00 1.81 H new ATOM 0 HA ASN A 53 -20.656 12.694 -3.988 1.00 1.99 H new ATOM 0 HB2 ASN A 53 -21.647 11.627 -6.118 1.00 2.39 H new ATOM 0 HB3 ASN A 53 -19.956 12.084 -6.069 1.00 2.39 H new ATOM 0 HD21 ASN A 53 -19.389 8.962 -7.557 1.00 3.42 H new ATOM 0 HD22 ASN A 53 -19.487 10.713 -7.769 1.00 3.42 H new ATOM 804 N ASP A 54 -22.385 9.901 -3.699 1.00 1.81 N ATOM 805 CA ASP A 54 -23.445 9.232 -2.956 1.00 1.82 C ATOM 806 C ASP A 54 -23.467 7.743 -3.258 1.00 2.08 C ATOM 807 O ASP A 54 -23.865 7.329 -4.346 1.00 2.23 O ATOM 808 CB ASP A 54 -24.819 9.818 -3.218 1.00 2.01 C ATOM 809 CG ASP A 54 -25.850 9.227 -2.279 1.00 2.47 C ATOM 810 OD1 ASP A 54 -25.587 9.193 -1.055 1.00 2.99 O ATOM 811 OD2 ASP A 54 -26.908 8.770 -2.755 1.00 2.69 O ATOM 0 H ASP A 54 -21.843 9.274 -4.294 1.00 1.81 H new ATOM 0 HA ASP A 54 -23.214 9.393 -1.903 1.00 1.82 H new ATOM 0 HB2 ASP A 54 -24.786 10.900 -3.093 1.00 2.01 H new ATOM 0 HB3 ASP A 54 -25.110 9.625 -4.251 1.00 2.01 H new ATOM 816 N LYS A 55 -23.002 6.955 -2.292 1.00 2.27 N ATOM 817 CA LYS A 55 -23.056 5.491 -2.362 1.00 2.75 C ATOM 818 C LYS A 55 -22.160 4.960 -3.476 1.00 1.92 C ATOM 819 O LYS A 55 -22.600 4.223 -4.359 1.00 2.45 O ATOM 820 CB LYS A 55 -24.499 4.996 -2.548 1.00 4.02 C ATOM 821 CG LYS A 55 -25.443 5.454 -1.448 1.00 5.04 C ATOM 822 CD LYS A 55 -24.947 5.033 -0.073 1.00 5.92 C ATOM 823 CE LYS A 55 -25.861 5.535 1.037 1.00 6.66 C ATOM 824 NZ LYS A 55 -26.000 7.016 1.022 1.00 7.36 N ATOM 0 H LYS A 55 -22.576 7.311 -1.436 1.00 2.27 H new ATOM 0 HA LYS A 55 -22.685 5.104 -1.413 1.00 2.75 H new ATOM 0 HB2 LYS A 55 -24.875 5.348 -3.509 1.00 4.02 H new ATOM 0 HB3 LYS A 55 -24.499 3.907 -2.586 1.00 4.02 H new ATOM 0 HG2 LYS A 55 -25.544 6.539 -1.483 1.00 5.04 H new ATOM 0 HG3 LYS A 55 -26.435 5.036 -1.621 1.00 5.04 H new ATOM 0 HD2 LYS A 55 -24.883 3.946 -0.027 1.00 5.92 H new ATOM 0 HD3 LYS A 55 -23.940 5.419 0.084 1.00 5.92 H new ATOM 0 HE2 LYS A 55 -26.845 5.078 0.930 1.00 6.66 H new ATOM 0 HE3 LYS A 55 -25.466 5.218 2.002 1.00 6.66 H new ATOM 0 HZ1 LYS A 55 -26.394 7.337 1.929 1.00 7.36 H new ATOM 0 HZ2 LYS A 55 -25.066 7.451 0.877 1.00 7.36 H new ATOM 0 HZ3 LYS A 55 -26.636 7.297 0.249 1.00 7.36 H new ATOM 838 N LYS A 56 -20.894 5.331 -3.414 1.00 1.27 N ATOM 839 CA LYS A 56 -19.909 4.865 -4.366 1.00 1.10 C ATOM 840 C LYS A 56 -18.701 4.346 -3.603 1.00 1.03 C ATOM 841 O LYS A 56 -18.315 4.936 -2.594 1.00 1.91 O ATOM 842 CB LYS A 56 -19.506 5.986 -5.332 1.00 1.91 C ATOM 843 CG LYS A 56 -18.491 5.560 -6.389 1.00 2.63 C ATOM 844 CD LYS A 56 -19.039 4.453 -7.278 1.00 3.33 C ATOM 845 CE LYS A 56 -20.053 4.973 -8.287 1.00 3.92 C ATOM 846 NZ LYS A 56 -19.400 5.691 -9.416 1.00 4.46 N ATOM 0 H LYS A 56 -20.523 5.962 -2.704 1.00 1.27 H new ATOM 0 HA LYS A 56 -20.335 4.060 -4.965 1.00 1.10 H new ATOM 0 HB2 LYS A 56 -20.400 6.360 -5.831 1.00 1.91 H new ATOM 0 HB3 LYS A 56 -19.091 6.815 -4.758 1.00 1.91 H new ATOM 0 HG2 LYS A 56 -18.221 6.420 -7.002 1.00 2.63 H new ATOM 0 HG3 LYS A 56 -17.579 5.217 -5.901 1.00 2.63 H new ATOM 0 HD2 LYS A 56 -18.216 3.974 -7.807 1.00 3.33 H new ATOM 0 HD3 LYS A 56 -19.506 3.689 -6.657 1.00 3.33 H new ATOM 0 HE2 LYS A 56 -20.636 4.139 -8.677 1.00 3.92 H new ATOM 0 HE3 LYS A 56 -20.751 5.644 -7.786 1.00 3.92 H new ATOM 0 HZ1 LYS A 56 -19.776 5.335 -10.318 1.00 4.46 H new ATOM 0 HZ2 LYS A 56 -19.594 6.710 -9.338 1.00 4.46 H new ATOM 0 HZ3 LYS A 56 -18.373 5.531 -9.382 1.00 4.46 H new ATOM 860 N ILE A 57 -18.129 3.246 -4.083 1.00 0.92 N ATOM 861 CA ILE A 57 -17.015 2.584 -3.417 1.00 0.72 C ATOM 862 C ILE A 57 -17.488 1.917 -2.138 1.00 0.69 C ATOM 863 O ILE A 57 -17.402 2.482 -1.044 1.00 0.80 O ATOM 864 CB ILE A 57 -15.843 3.540 -3.094 1.00 0.65 C ATOM 865 CG1 ILE A 57 -15.480 4.377 -4.326 1.00 0.73 C ATOM 866 CG2 ILE A 57 -14.634 2.739 -2.618 1.00 0.71 C ATOM 867 CD1 ILE A 57 -14.621 5.580 -4.007 1.00 0.75 C ATOM 0 H ILE A 57 -18.426 2.789 -4.945 1.00 0.92 H new ATOM 0 HA ILE A 57 -16.640 1.838 -4.117 1.00 0.72 H new ATOM 0 HB ILE A 57 -16.151 4.218 -2.298 1.00 0.65 H new ATOM 0 HG12 ILE A 57 -14.955 3.745 -5.042 1.00 0.73 H new ATOM 0 HG13 ILE A 57 -16.397 4.713 -4.810 1.00 0.73 H new ATOM 0 HG21 ILE A 57 -13.813 3.419 -2.393 1.00 0.71 H new ATOM 0 HG22 ILE A 57 -14.899 2.180 -1.721 1.00 0.71 H new ATOM 0 HG23 ILE A 57 -14.326 2.045 -3.400 1.00 0.71 H new ATOM 0 HD11 ILE A 57 -14.403 6.125 -4.925 1.00 0.75 H new ATOM 0 HD12 ILE A 57 -15.152 6.233 -3.315 1.00 0.75 H new ATOM 0 HD13 ILE A 57 -13.688 5.250 -3.551 1.00 0.75 H new ATOM 879 N THR A 58 -18.014 0.717 -2.284 1.00 0.71 N ATOM 880 CA THR A 58 -18.361 -0.075 -1.134 1.00 0.71 C ATOM 881 C THR A 58 -17.090 -0.667 -0.552 1.00 0.71 C ATOM 882 O THR A 58 -16.477 -1.552 -1.145 1.00 0.82 O ATOM 883 CB THR A 58 -19.347 -1.204 -1.473 1.00 0.85 C ATOM 884 OG1 THR A 58 -20.403 -0.699 -2.306 1.00 0.96 O ATOM 885 CG2 THR A 58 -19.938 -1.794 -0.200 1.00 0.86 C ATOM 0 H THR A 58 -18.207 0.276 -3.183 1.00 0.71 H new ATOM 0 HA THR A 58 -18.856 0.576 -0.413 1.00 0.71 H new ATOM 0 HB THR A 58 -18.808 -1.986 -2.007 1.00 0.85 H new ATOM 0 HG1 THR A 58 -20.935 -1.447 -2.650 1.00 0.96 H new ATOM 0 HG21 THR A 58 -20.634 -2.592 -0.458 1.00 0.86 H new ATOM 0 HG22 THR A 58 -19.137 -2.197 0.420 1.00 0.86 H new ATOM 0 HG23 THR A 58 -20.466 -1.016 0.351 1.00 0.86 H new ATOM 893 N PHE A 59 -16.684 -0.129 0.585 1.00 0.67 N ATOM 894 CA PHE A 59 -15.500 -0.604 1.310 1.00 0.77 C ATOM 895 C PHE A 59 -15.635 -2.070 1.736 1.00 0.96 C ATOM 896 O PHE A 59 -14.700 -2.649 2.286 1.00 1.57 O ATOM 897 CB PHE A 59 -15.266 0.264 2.551 1.00 0.80 C ATOM 898 CG PHE A 59 -14.638 1.604 2.280 1.00 0.72 C ATOM 899 CD1 PHE A 59 -15.244 2.519 1.433 1.00 1.04 C ATOM 900 CD2 PHE A 59 -13.447 1.953 2.894 1.00 1.07 C ATOM 901 CE1 PHE A 59 -14.668 3.757 1.201 1.00 1.06 C ATOM 902 CE2 PHE A 59 -12.867 3.186 2.666 1.00 1.10 C ATOM 903 CZ PHE A 59 -13.478 4.089 1.821 1.00 0.80 C ATOM 0 H PHE A 59 -17.161 0.650 1.039 1.00 0.67 H new ATOM 0 HA PHE A 59 -14.651 -0.528 0.631 1.00 0.77 H new ATOM 0 HB2 PHE A 59 -16.222 0.422 3.051 1.00 0.80 H new ATOM 0 HB3 PHE A 59 -14.630 -0.285 3.245 1.00 0.80 H new ATOM 0 HD1 PHE A 59 -16.175 2.264 0.949 1.00 1.04 H new ATOM 0 HD2 PHE A 59 -12.965 1.252 3.560 1.00 1.07 H new ATOM 0 HE1 PHE A 59 -15.147 4.461 0.537 1.00 1.06 H new ATOM 0 HE2 PHE A 59 -11.936 3.443 3.149 1.00 1.10 H new ATOM 0 HZ PHE A 59 -13.027 5.054 1.644 1.00 0.80 H new ATOM 913 N LEU A 60 -16.804 -2.656 1.507 1.00 1.19 N ATOM 914 CA LEU A 60 -17.049 -4.039 1.876 1.00 1.38 C ATOM 915 C LEU A 60 -16.453 -4.970 0.838 1.00 1.95 C ATOM 916 O LEU A 60 -16.671 -4.800 -0.355 1.00 2.65 O ATOM 917 CB LEU A 60 -18.551 -4.293 2.012 1.00 1.84 C ATOM 918 CG LEU A 60 -18.935 -5.706 2.462 1.00 2.35 C ATOM 919 CD1 LEU A 60 -18.377 -6.003 3.846 1.00 2.89 C ATOM 920 CD2 LEU A 60 -20.445 -5.878 2.448 1.00 3.21 C ATOM 0 H LEU A 60 -17.597 -2.191 1.066 1.00 1.19 H new ATOM 0 HA LEU A 60 -16.573 -4.234 2.837 1.00 1.38 H new ATOM 0 HB2 LEU A 60 -18.961 -3.578 2.725 1.00 1.84 H new ATOM 0 HB3 LEU A 60 -19.026 -4.093 1.051 1.00 1.84 H new ATOM 0 HG LEU A 60 -18.500 -6.417 1.760 1.00 2.35 H new ATOM 0 HD11 LEU A 60 -18.662 -7.012 4.145 1.00 2.89 H new ATOM 0 HD12 LEU A 60 -17.290 -5.925 3.825 1.00 2.89 H new ATOM 0 HD13 LEU A 60 -18.778 -5.286 4.562 1.00 2.89 H new ATOM 0 HD21 LEU A 60 -20.699 -6.888 2.770 1.00 3.21 H new ATOM 0 HD22 LEU A 60 -20.900 -5.155 3.126 1.00 3.21 H new ATOM 0 HD23 LEU A 60 -20.820 -5.714 1.438 1.00 3.21 H new ATOM 932 N ASP A 61 -15.700 -5.950 1.307 1.00 2.43 N ATOM 933 CA ASP A 61 -15.042 -6.899 0.423 1.00 3.40 C ATOM 934 C ASP A 61 -16.006 -7.996 -0.023 1.00 3.45 C ATOM 935 O ASP A 61 -17.225 -7.858 0.096 1.00 3.73 O ATOM 936 CB ASP A 61 -13.828 -7.524 1.122 1.00 4.36 C ATOM 937 CG ASP A 61 -14.181 -8.270 2.401 1.00 5.14 C ATOM 938 OD1 ASP A 61 -14.838 -9.327 2.316 1.00 5.55 O ATOM 939 OD2 ASP A 61 -13.819 -7.794 3.497 1.00 5.61 O ATOM 0 H ASP A 61 -15.528 -6.110 2.300 1.00 2.43 H new ATOM 0 HA ASP A 61 -14.707 -6.357 -0.461 1.00 3.40 H new ATOM 0 HB2 ASP A 61 -13.337 -8.212 0.434 1.00 4.36 H new ATOM 0 HB3 ASP A 61 -13.109 -6.739 1.356 1.00 4.36 H new ATOM 944 N THR A 62 -15.429 -9.079 -0.542 1.00 3.65 N ATOM 945 CA THR A 62 -16.165 -10.261 -0.986 1.00 4.03 C ATOM 946 C THR A 62 -16.706 -10.090 -2.405 1.00 4.27 C ATOM 947 O THR A 62 -17.833 -9.638 -2.610 1.00 4.71 O ATOM 948 CB THR A 62 -17.305 -10.638 -0.013 1.00 4.83 C ATOM 949 OG1 THR A 62 -16.786 -10.790 1.318 1.00 5.19 O ATOM 950 CG2 THR A 62 -17.981 -11.933 -0.440 1.00 5.45 C ATOM 0 H THR A 62 -14.420 -9.161 -0.668 1.00 3.65 H new ATOM 0 HA THR A 62 -15.450 -11.084 -0.992 1.00 4.03 H new ATOM 0 HB THR A 62 -18.042 -9.835 -0.031 1.00 4.83 H new ATOM 0 HG1 THR A 62 -15.960 -10.270 1.409 1.00 5.19 H new ATOM 0 HG21 THR A 62 -18.779 -12.175 0.262 1.00 5.45 H new ATOM 0 HG22 THR A 62 -18.400 -11.812 -1.439 1.00 5.45 H new ATOM 0 HG23 THR A 62 -17.248 -12.740 -0.449 1.00 5.45 H new ATOM 958 N PRO A 63 -15.888 -10.447 -3.414 1.00 4.49 N ATOM 959 CA PRO A 63 -16.297 -10.445 -4.807 1.00 5.20 C ATOM 960 C PRO A 63 -16.860 -11.802 -5.236 1.00 5.56 C ATOM 961 O PRO A 63 -17.074 -12.054 -6.424 1.00 6.11 O ATOM 962 CB PRO A 63 -14.996 -10.135 -5.547 1.00 5.69 C ATOM 963 CG PRO A 63 -13.884 -10.566 -4.634 1.00 5.34 C ATOM 964 CD PRO A 63 -14.485 -10.866 -3.281 1.00 4.58 C ATOM 0 HA PRO A 63 -17.095 -9.731 -5.010 1.00 5.20 H new ATOM 0 HB2 PRO A 63 -14.951 -10.670 -6.496 1.00 5.69 H new ATOM 0 HB3 PRO A 63 -14.922 -9.072 -5.776 1.00 5.69 H new ATOM 0 HG2 PRO A 63 -13.383 -11.448 -5.033 1.00 5.34 H new ATOM 0 HG3 PRO A 63 -13.132 -9.781 -4.552 1.00 5.34 H new ATOM 0 HD2 PRO A 63 -14.406 -11.925 -3.035 1.00 4.58 H new ATOM 0 HD3 PRO A 63 -13.978 -10.316 -2.488 1.00 4.58 H new ATOM 972 N GLY A 64 -17.071 -12.675 -4.258 1.00 5.49 N ATOM 973 CA GLY A 64 -17.671 -13.967 -4.518 1.00 6.04 C ATOM 974 C GLY A 64 -16.649 -15.044 -4.825 1.00 5.99 C ATOM 975 O GLY A 64 -16.437 -15.953 -4.026 1.00 6.36 O ATOM 0 H GLY A 64 -16.834 -12.507 -3.280 1.00 5.49 H new ATOM 0 HA2 GLY A 64 -18.260 -14.269 -3.652 1.00 6.04 H new ATOM 0 HA3 GLY A 64 -18.361 -13.879 -5.357 1.00 6.04 H new ATOM 979 N HIS A 65 -16.012 -14.927 -5.980 1.00 5.85 N ATOM 980 CA HIS A 65 -15.081 -15.948 -6.456 1.00 6.04 C ATOM 981 C HIS A 65 -13.797 -15.974 -5.631 1.00 5.42 C ATOM 982 O HIS A 65 -13.508 -16.961 -4.955 1.00 5.51 O ATOM 983 CB HIS A 65 -14.757 -15.724 -7.936 1.00 6.53 C ATOM 984 CG HIS A 65 -15.927 -15.963 -8.840 1.00 7.30 C ATOM 985 ND1 HIS A 65 -16.587 -14.958 -9.512 1.00 8.05 N ATOM 986 CD2 HIS A 65 -16.554 -17.114 -9.180 1.00 7.71 C ATOM 987 CE1 HIS A 65 -17.569 -15.480 -10.225 1.00 8.78 C ATOM 988 NE2 HIS A 65 -17.570 -16.785 -10.042 1.00 8.61 N ATOM 0 H HIS A 65 -16.121 -14.133 -6.610 1.00 5.85 H new ATOM 0 HA HIS A 65 -15.567 -16.916 -6.339 1.00 6.04 H new ATOM 0 HB2 HIS A 65 -14.403 -14.702 -8.073 1.00 6.53 H new ATOM 0 HB3 HIS A 65 -13.941 -16.385 -8.227 1.00 6.53 H new ATOM 0 HD2 HIS A 65 -16.302 -18.106 -8.837 1.00 7.71 H new ATOM 0 HE1 HIS A 65 -18.255 -14.930 -10.852 1.00 8.78 H new ATOM 0 HE2 HIS A 65 -18.220 -17.443 -10.471 1.00 8.61 H new ATOM 997 N GLU A 66 -13.027 -14.896 -5.696 1.00 5.13 N ATOM 998 CA GLU A 66 -11.789 -14.807 -4.935 1.00 4.83 C ATOM 999 C GLU A 66 -12.104 -14.549 -3.468 1.00 4.30 C ATOM 1000 O GLU A 66 -13.037 -13.813 -3.150 1.00 4.72 O ATOM 1001 CB GLU A 66 -10.891 -13.705 -5.507 1.00 5.31 C ATOM 1002 CG GLU A 66 -9.552 -13.556 -4.798 1.00 5.97 C ATOM 1003 CD GLU A 66 -8.827 -14.874 -4.609 1.00 6.59 C ATOM 1004 OE1 GLU A 66 -8.536 -15.536 -5.632 1.00 7.05 O ATOM 1005 OE2 GLU A 66 -8.527 -15.238 -3.455 1.00 6.87 O ATOM 0 H GLU A 66 -13.236 -14.075 -6.265 1.00 5.13 H new ATOM 0 HA GLU A 66 -11.251 -15.752 -5.012 1.00 4.83 H new ATOM 0 HB2 GLU A 66 -10.709 -13.912 -6.562 1.00 5.31 H new ATOM 0 HB3 GLU A 66 -11.424 -12.755 -5.456 1.00 5.31 H new ATOM 0 HG2 GLU A 66 -8.918 -12.879 -5.371 1.00 5.97 H new ATOM 0 HG3 GLU A 66 -9.713 -13.094 -3.824 1.00 5.97 H new ATOM 1012 N ALA A 67 -11.321 -15.147 -2.584 1.00 3.82 N ATOM 1013 CA ALA A 67 -11.600 -15.098 -1.160 1.00 3.70 C ATOM 1014 C ALA A 67 -10.461 -14.433 -0.405 1.00 2.58 C ATOM 1015 O ALA A 67 -9.752 -15.078 0.366 1.00 2.95 O ATOM 1016 CB ALA A 67 -11.844 -16.497 -0.624 1.00 4.55 C ATOM 0 H ALA A 67 -10.483 -15.674 -2.831 1.00 3.82 H new ATOM 0 HA ALA A 67 -12.500 -14.501 -1.009 1.00 3.70 H new ATOM 0 HB1 ALA A 67 -12.052 -16.446 0.445 1.00 4.55 H new ATOM 0 HB2 ALA A 67 -12.696 -16.940 -1.139 1.00 4.55 H new ATOM 0 HB3 ALA A 67 -10.959 -17.111 -0.793 1.00 4.55 H new ATOM 1022 N PHE A 68 -10.315 -13.138 -0.627 1.00 1.79 N ATOM 1023 CA PHE A 68 -9.226 -12.357 -0.040 1.00 1.15 C ATOM 1024 C PHE A 68 -9.189 -12.466 1.483 1.00 1.77 C ATOM 1025 O PHE A 68 -8.271 -13.053 2.049 1.00 2.37 O ATOM 1026 CB PHE A 68 -9.349 -10.885 -0.442 1.00 1.18 C ATOM 1027 CG PHE A 68 -9.097 -10.624 -1.899 1.00 1.12 C ATOM 1028 CD1 PHE A 68 -7.809 -10.636 -2.409 1.00 1.08 C ATOM 1029 CD2 PHE A 68 -10.153 -10.375 -2.764 1.00 1.67 C ATOM 1030 CE1 PHE A 68 -7.578 -10.402 -3.751 1.00 1.52 C ATOM 1031 CE2 PHE A 68 -9.930 -10.141 -4.106 1.00 2.10 C ATOM 1032 CZ PHE A 68 -8.627 -10.119 -4.592 1.00 2.00 C ATOM 0 H PHE A 68 -10.944 -12.594 -1.217 1.00 1.79 H new ATOM 0 HA PHE A 68 -8.295 -12.771 -0.428 1.00 1.15 H new ATOM 0 HB2 PHE A 68 -10.349 -10.533 -0.188 1.00 1.18 H new ATOM 0 HB3 PHE A 68 -8.645 -10.298 0.148 1.00 1.18 H new ATOM 0 HD1 PHE A 68 -6.976 -10.831 -1.750 1.00 1.08 H new ATOM 0 HD2 PHE A 68 -11.163 -10.364 -2.382 1.00 1.67 H new ATOM 0 HE1 PHE A 68 -6.571 -10.442 -4.140 1.00 1.52 H new ATOM 0 HE2 PHE A 68 -10.762 -9.976 -4.774 1.00 2.10 H new ATOM 0 HZ PHE A 68 -8.440 -9.880 -5.628 1.00 2.00 H new ATOM 1042 N THR A 69 -10.189 -11.905 2.142 1.00 2.35 N ATOM 1043 CA THR A 69 -10.228 -11.873 3.596 1.00 3.31 C ATOM 1044 C THR A 69 -10.980 -13.074 4.169 1.00 3.54 C ATOM 1045 O THR A 69 -11.868 -12.913 5.007 1.00 3.89 O ATOM 1046 CB THR A 69 -10.885 -10.566 4.078 1.00 4.11 C ATOM 1047 OG1 THR A 69 -11.984 -10.241 3.217 1.00 4.46 O ATOM 1048 CG2 THR A 69 -9.876 -9.422 4.086 1.00 4.90 C ATOM 0 H THR A 69 -10.990 -11.463 1.691 1.00 2.35 H new ATOM 0 HA THR A 69 -9.200 -11.920 3.955 1.00 3.31 H new ATOM 0 HB THR A 69 -11.245 -10.710 5.097 1.00 4.11 H new ATOM 0 HG1 THR A 69 -12.812 -10.211 3.741 1.00 4.46 H new ATOM 0 HG21 THR A 69 -10.363 -8.510 4.430 1.00 4.90 H new ATOM 0 HG22 THR A 69 -9.052 -9.668 4.756 1.00 4.90 H new ATOM 0 HG23 THR A 69 -9.491 -9.270 3.078 1.00 4.90 H new ATOM 1056 N THR A 70 -10.606 -14.273 3.721 1.00 3.82 N ATOM 1057 CA THR A 70 -11.243 -15.511 4.176 1.00 4.35 C ATOM 1058 C THR A 70 -12.748 -15.475 3.910 1.00 4.41 C ATOM 1059 O THR A 70 -13.551 -15.223 4.806 1.00 4.95 O ATOM 1060 CB THR A 70 -10.992 -15.758 5.679 1.00 5.16 C ATOM 1061 OG1 THR A 70 -9.591 -15.635 5.968 1.00 5.40 O ATOM 1062 CG2 THR A 70 -11.477 -17.141 6.092 1.00 5.84 C ATOM 0 H THR A 70 -9.861 -14.414 3.039 1.00 3.82 H new ATOM 0 HA THR A 70 -10.796 -16.329 3.611 1.00 4.35 H new ATOM 0 HB THR A 70 -11.550 -15.011 6.244 1.00 5.16 H new ATOM 0 HG1 THR A 70 -9.439 -15.791 6.923 1.00 5.40 H new ATOM 0 HG21 THR A 70 -11.289 -17.290 7.155 1.00 5.84 H new ATOM 0 HG22 THR A 70 -12.546 -17.225 5.898 1.00 5.84 H new ATOM 0 HG23 THR A 70 -10.944 -17.900 5.519 1.00 5.84 H new ATOM 1070 N MET A 71 -13.123 -15.707 2.665 1.00 4.19 N ATOM 1071 CA MET A 71 -14.522 -15.653 2.279 1.00 4.50 C ATOM 1072 C MET A 71 -15.081 -17.061 2.135 1.00 4.86 C ATOM 1073 O MET A 71 -15.944 -17.471 2.909 1.00 5.21 O ATOM 1074 CB MET A 71 -14.667 -14.844 0.992 1.00 4.42 C ATOM 1075 CG MET A 71 -14.132 -13.428 1.143 1.00 4.38 C ATOM 1076 SD MET A 71 -13.858 -12.599 -0.427 1.00 4.69 S ATOM 1077 CE MET A 71 -13.016 -11.120 0.126 1.00 4.34 C ATOM 0 H MET A 71 -12.481 -15.934 1.906 1.00 4.19 H new ATOM 0 HA MET A 71 -15.101 -15.153 3.055 1.00 4.50 H new ATOM 0 HB2 MET A 71 -14.135 -15.348 0.185 1.00 4.42 H new ATOM 0 HB3 MET A 71 -15.718 -14.805 0.705 1.00 4.42 H new ATOM 0 HG2 MET A 71 -14.835 -12.843 1.737 1.00 4.38 H new ATOM 0 HG3 MET A 71 -13.194 -13.459 1.698 1.00 4.38 H new ATOM 0 HE1 MET A 71 -12.681 -10.547 -0.739 1.00 4.34 H new ATOM 0 HE2 MET A 71 -13.699 -10.514 0.721 1.00 4.34 H new ATOM 0 HE3 MET A 71 -12.154 -11.397 0.733 1.00 4.34 H new ATOM 1087 N ARG A 72 -14.597 -17.810 1.153 1.00 5.04 N ATOM 1088 CA ARG A 72 -14.924 -19.226 1.081 1.00 5.54 C ATOM 1089 C ARG A 72 -13.658 -20.083 0.960 1.00 5.80 C ATOM 1090 O ARG A 72 -13.213 -20.658 1.953 1.00 6.36 O ATOM 1091 CB ARG A 72 -15.965 -19.526 -0.017 1.00 5.95 C ATOM 1092 CG ARG A 72 -15.590 -19.126 -1.438 1.00 6.36 C ATOM 1093 CD ARG A 72 -16.786 -19.313 -2.357 1.00 6.73 C ATOM 1094 NE ARG A 72 -16.422 -19.385 -3.772 1.00 7.09 N ATOM 1095 CZ ARG A 72 -17.305 -19.265 -4.764 1.00 7.63 C ATOM 1096 NH1 ARG A 72 -18.565 -18.948 -4.498 1.00 7.86 N ATOM 1097 NH2 ARG A 72 -16.924 -19.448 -6.024 1.00 8.21 N ATOM 0 H ARG A 72 -13.988 -17.469 0.409 1.00 5.04 H new ATOM 0 HA ARG A 72 -15.400 -19.505 2.021 1.00 5.54 H new ATOM 0 HB2 ARG A 72 -16.172 -20.596 -0.007 1.00 5.95 H new ATOM 0 HB3 ARG A 72 -16.894 -19.019 0.246 1.00 5.95 H new ATOM 0 HG2 ARG A 72 -15.263 -18.087 -1.459 1.00 6.36 H new ATOM 0 HG3 ARG A 72 -14.753 -19.731 -1.787 1.00 6.36 H new ATOM 0 HD2 ARG A 72 -17.311 -20.226 -2.077 1.00 6.73 H new ATOM 0 HD3 ARG A 72 -17.482 -18.487 -2.209 1.00 6.73 H new ATOM 0 HE ARG A 72 -15.442 -19.535 -4.012 1.00 7.09 H new ATOM 0 HH11 ARG A 72 -18.860 -18.796 -3.534 1.00 7.86 H new ATOM 0 HH12 ARG A 72 -19.239 -18.857 -5.258 1.00 7.86 H new ATOM 0 HH21 ARG A 72 -15.954 -19.681 -6.235 1.00 8.21 H new ATOM 0 HH22 ARG A 72 -17.602 -19.355 -6.780 1.00 8.21 H new ATOM 1111 N ALA A 73 -13.067 -20.159 -0.223 1.00 5.58 N ATOM 1112 CA ALA A 73 -11.839 -20.924 -0.397 1.00 6.01 C ATOM 1113 C ALA A 73 -10.818 -20.148 -1.221 1.00 5.86 C ATOM 1114 O ALA A 73 -9.860 -19.596 -0.680 1.00 6.36 O ATOM 1115 CB ALA A 73 -12.134 -22.269 -1.043 1.00 6.36 C ATOM 0 H ALA A 73 -13.412 -19.706 -1.069 1.00 5.58 H new ATOM 0 HA ALA A 73 -11.411 -21.099 0.590 1.00 6.01 H new ATOM 0 HB1 ALA A 73 -11.205 -22.826 -1.165 1.00 6.36 H new ATOM 0 HB2 ALA A 73 -12.816 -22.835 -0.409 1.00 6.36 H new ATOM 0 HB3 ALA A 73 -12.593 -22.111 -2.019 1.00 6.36 H new ATOM 1121 N ARG A 74 -11.050 -20.100 -2.527 1.00 5.40 N ATOM 1122 CA ARG A 74 -10.175 -19.404 -3.462 1.00 5.50 C ATOM 1123 C ARG A 74 -10.901 -19.273 -4.795 1.00 5.18 C ATOM 1124 O ARG A 74 -11.843 -20.022 -5.057 1.00 5.49 O ATOM 1125 CB ARG A 74 -8.865 -20.183 -3.656 1.00 6.12 C ATOM 1126 CG ARG A 74 -7.855 -19.478 -4.549 1.00 6.76 C ATOM 1127 CD ARG A 74 -6.778 -20.428 -5.047 1.00 7.55 C ATOM 1128 NE ARG A 74 -5.842 -20.834 -3.997 1.00 8.14 N ATOM 1129 CZ ARG A 74 -5.272 -22.038 -3.942 1.00 8.93 C ATOM 1130 NH1 ARG A 74 -5.687 -23.005 -4.747 1.00 9.21 N ATOM 1131 NH2 ARG A 74 -4.321 -22.283 -3.053 1.00 9.65 N ATOM 0 H ARG A 74 -11.854 -20.545 -2.969 1.00 5.40 H new ATOM 0 HA ARG A 74 -9.929 -18.418 -3.067 1.00 5.50 H new ATOM 0 HB2 ARG A 74 -8.411 -20.360 -2.681 1.00 6.12 H new ATOM 0 HB3 ARG A 74 -9.094 -21.159 -4.083 1.00 6.12 H new ATOM 0 HG2 ARG A 74 -8.371 -19.035 -5.401 1.00 6.76 H new ATOM 0 HG3 ARG A 74 -7.391 -18.660 -3.997 1.00 6.76 H new ATOM 0 HD2 ARG A 74 -7.251 -21.316 -5.468 1.00 7.55 H new ATOM 0 HD3 ARG A 74 -6.224 -19.949 -5.854 1.00 7.55 H new ATOM 0 HE ARG A 74 -5.613 -20.159 -3.268 1.00 8.14 H new ATOM 0 HH11 ARG A 74 -6.443 -22.828 -5.409 1.00 9.21 H new ATOM 0 HH12 ARG A 74 -5.251 -23.926 -4.705 1.00 9.21 H new ATOM 0 HH21 ARG A 74 -4.024 -21.550 -2.409 1.00 9.65 H new ATOM 0 HH22 ARG A 74 -3.886 -23.205 -3.012 1.00 9.65 H new ATOM 1145 N GLY A 75 -10.492 -18.332 -5.633 1.00 4.93 N ATOM 1146 CA GLY A 75 -11.138 -18.185 -6.919 1.00 4.87 C ATOM 1147 C GLY A 75 -10.333 -17.350 -7.881 1.00 4.49 C ATOM 1148 O GLY A 75 -9.215 -17.717 -8.247 1.00 4.54 O ATOM 0 H GLY A 75 -9.734 -17.675 -5.448 1.00 4.93 H new ATOM 0 HA2 GLY A 75 -11.305 -19.171 -7.352 1.00 4.87 H new ATOM 0 HA3 GLY A 75 -12.118 -17.728 -6.779 1.00 4.87 H new ATOM 1152 N ALA A 76 -10.910 -16.233 -8.295 1.00 4.53 N ATOM 1153 CA ALA A 76 -10.271 -15.330 -9.235 1.00 4.52 C ATOM 1154 C ALA A 76 -10.993 -13.994 -9.248 1.00 3.91 C ATOM 1155 O ALA A 76 -12.189 -13.918 -8.944 1.00 4.15 O ATOM 1156 CB ALA A 76 -10.261 -15.931 -10.634 1.00 5.47 C ATOM 0 H ALA A 76 -11.834 -15.928 -7.988 1.00 4.53 H new ATOM 0 HA ALA A 76 -9.240 -15.175 -8.918 1.00 4.52 H new ATOM 0 HB1 ALA A 76 -9.778 -15.239 -11.324 1.00 5.47 H new ATOM 0 HB2 ALA A 76 -9.713 -16.873 -10.621 1.00 5.47 H new ATOM 0 HB3 ALA A 76 -11.285 -16.112 -10.960 1.00 5.47 H new ATOM 1162 N GLN A 77 -10.263 -12.947 -9.587 1.00 3.61 N ATOM 1163 CA GLN A 77 -10.836 -11.617 -9.706 1.00 3.40 C ATOM 1164 C GLN A 77 -10.537 -11.032 -11.081 1.00 2.90 C ATOM 1165 O GLN A 77 -9.842 -11.649 -11.886 1.00 3.33 O ATOM 1166 CB GLN A 77 -10.334 -10.703 -8.576 1.00 4.25 C ATOM 1167 CG GLN A 77 -8.850 -10.834 -8.242 1.00 4.87 C ATOM 1168 CD GLN A 77 -7.930 -10.264 -9.307 1.00 5.70 C ATOM 1169 OE1 GLN A 77 -7.478 -10.972 -10.202 1.00 6.14 O ATOM 1170 NE2 GLN A 77 -7.669 -8.972 -9.225 1.00 6.26 N ATOM 0 H GLN A 77 -9.264 -12.993 -9.786 1.00 3.61 H new ATOM 0 HA GLN A 77 -11.919 -11.691 -9.605 1.00 3.40 H new ATOM 0 HB2 GLN A 77 -10.538 -9.668 -8.850 1.00 4.25 H new ATOM 0 HB3 GLN A 77 -10.912 -10.914 -7.676 1.00 4.25 H new ATOM 0 HG2 GLN A 77 -8.654 -10.328 -7.297 1.00 4.87 H new ATOM 0 HG3 GLN A 77 -8.612 -11.887 -8.095 1.00 4.87 H new ATOM 0 HE21 GLN A 77 -8.065 -8.419 -8.465 1.00 6.26 H new ATOM 0 HE22 GLN A 77 -7.072 -8.527 -9.922 1.00 6.26 H new ATOM 1179 N VAL A 78 -11.080 -9.855 -11.356 1.00 2.65 N ATOM 1180 CA VAL A 78 -10.914 -9.226 -12.659 1.00 2.75 C ATOM 1181 C VAL A 78 -10.191 -7.892 -12.517 1.00 2.21 C ATOM 1182 O VAL A 78 -9.056 -7.733 -12.971 1.00 2.72 O ATOM 1183 CB VAL A 78 -12.274 -8.999 -13.357 1.00 3.65 C ATOM 1184 CG1 VAL A 78 -12.081 -8.421 -14.750 1.00 4.31 C ATOM 1185 CG2 VAL A 78 -13.069 -10.294 -13.424 1.00 4.21 C ATOM 0 H VAL A 78 -11.639 -9.316 -10.695 1.00 2.65 H new ATOM 0 HA VAL A 78 -10.319 -9.902 -13.273 1.00 2.75 H new ATOM 0 HB VAL A 78 -12.838 -8.279 -12.764 1.00 3.65 H new ATOM 0 HG11 VAL A 78 -13.053 -8.271 -15.220 1.00 4.31 H new ATOM 0 HG12 VAL A 78 -11.561 -7.466 -14.679 1.00 4.31 H new ATOM 0 HG13 VAL A 78 -11.490 -9.112 -15.352 1.00 4.31 H new ATOM 0 HG21 VAL A 78 -14.023 -10.110 -13.919 1.00 4.21 H new ATOM 0 HG22 VAL A 78 -12.505 -11.038 -13.987 1.00 4.21 H new ATOM 0 HG23 VAL A 78 -13.250 -10.663 -12.414 1.00 4.21 H new ATOM 1195 N THR A 79 -10.858 -6.930 -11.902 1.00 1.82 N ATOM 1196 CA THR A 79 -10.254 -5.641 -11.613 1.00 1.90 C ATOM 1197 C THR A 79 -10.855 -5.067 -10.335 1.00 1.53 C ATOM 1198 O THR A 79 -11.783 -4.262 -10.373 1.00 1.82 O ATOM 1199 CB THR A 79 -10.443 -4.649 -12.781 1.00 2.70 C ATOM 1200 OG1 THR A 79 -10.015 -5.258 -14.007 1.00 3.20 O ATOM 1201 CG2 THR A 79 -9.641 -3.375 -12.547 1.00 3.41 C ATOM 0 H THR A 79 -11.825 -7.019 -11.591 1.00 1.82 H new ATOM 0 HA THR A 79 -9.183 -5.792 -11.479 1.00 1.90 H new ATOM 0 HB THR A 79 -11.500 -4.391 -12.843 1.00 2.70 H new ATOM 0 HG1 THR A 79 -10.138 -4.626 -14.746 1.00 3.20 H new ATOM 0 HG21 THR A 79 -9.791 -2.692 -13.383 1.00 3.41 H new ATOM 0 HG22 THR A 79 -9.975 -2.899 -11.625 1.00 3.41 H new ATOM 0 HG23 THR A 79 -8.582 -3.621 -12.465 1.00 3.41 H new ATOM 1209 N ASP A 80 -10.344 -5.532 -9.208 1.00 1.21 N ATOM 1210 CA ASP A 80 -10.785 -5.056 -7.906 1.00 1.14 C ATOM 1211 C ASP A 80 -9.705 -4.179 -7.292 1.00 0.88 C ATOM 1212 O ASP A 80 -8.670 -3.930 -7.917 1.00 1.12 O ATOM 1213 CB ASP A 80 -11.092 -6.239 -6.982 1.00 1.60 C ATOM 1214 CG ASP A 80 -9.864 -7.078 -6.685 1.00 2.14 C ATOM 1215 OD1 ASP A 80 -9.333 -7.705 -7.621 1.00 2.60 O ATOM 1216 OD2 ASP A 80 -9.439 -7.113 -5.510 1.00 2.66 O ATOM 0 H ASP A 80 -9.616 -6.246 -9.168 1.00 1.21 H new ATOM 0 HA ASP A 80 -11.696 -4.470 -8.031 1.00 1.14 H new ATOM 0 HB2 ASP A 80 -11.508 -5.866 -6.046 1.00 1.60 H new ATOM 0 HB3 ASP A 80 -11.855 -6.867 -7.442 1.00 1.60 H new ATOM 1221 N ILE A 81 -9.948 -3.704 -6.078 1.00 0.63 N ATOM 1222 CA ILE A 81 -9.008 -2.826 -5.400 1.00 0.42 C ATOM 1223 C ILE A 81 -8.852 -3.255 -3.952 1.00 0.38 C ATOM 1224 O ILE A 81 -9.845 -3.522 -3.275 1.00 0.57 O ATOM 1225 CB ILE A 81 -9.475 -1.350 -5.419 1.00 0.42 C ATOM 1226 CG1 ILE A 81 -9.928 -0.938 -6.820 1.00 0.56 C ATOM 1227 CG2 ILE A 81 -8.349 -0.445 -4.943 1.00 0.50 C ATOM 1228 CD1 ILE A 81 -10.516 0.457 -6.887 1.00 0.71 C ATOM 0 H ILE A 81 -10.791 -3.913 -5.543 1.00 0.63 H new ATOM 0 HA ILE A 81 -8.060 -2.901 -5.933 1.00 0.42 H new ATOM 0 HB ILE A 81 -10.325 -1.249 -4.745 1.00 0.42 H new ATOM 0 HG12 ILE A 81 -9.077 -0.997 -7.499 1.00 0.56 H new ATOM 0 HG13 ILE A 81 -10.670 -1.652 -7.177 1.00 0.56 H new ATOM 0 HG21 ILE A 81 -8.684 0.592 -4.959 1.00 0.50 H new ATOM 0 HG22 ILE A 81 -8.067 -0.720 -3.927 1.00 0.50 H new ATOM 0 HG23 ILE A 81 -7.488 -0.558 -5.602 1.00 0.50 H new ATOM 0 HD11 ILE A 81 -10.814 0.677 -7.912 1.00 0.71 H new ATOM 0 HD12 ILE A 81 -11.387 0.516 -6.235 1.00 0.71 H new ATOM 0 HD13 ILE A 81 -9.770 1.182 -6.562 1.00 0.71 H new ATOM 1240 N VAL A 82 -7.625 -3.322 -3.470 1.00 0.27 N ATOM 1241 CA VAL A 82 -7.400 -3.627 -2.070 1.00 0.28 C ATOM 1242 C VAL A 82 -6.755 -2.464 -1.355 1.00 0.23 C ATOM 1243 O VAL A 82 -5.657 -2.033 -1.700 1.00 0.26 O ATOM 1244 CB VAL A 82 -6.551 -4.897 -1.872 1.00 0.35 C ATOM 1245 CG1 VAL A 82 -5.972 -4.959 -0.461 1.00 1.02 C ATOM 1246 CG2 VAL A 82 -7.410 -6.114 -2.138 1.00 1.17 C ATOM 0 H VAL A 82 -6.779 -3.171 -4.019 1.00 0.27 H new ATOM 0 HA VAL A 82 -8.383 -3.813 -1.637 1.00 0.28 H new ATOM 0 HB VAL A 82 -5.716 -4.874 -2.572 1.00 0.35 H new ATOM 0 HG11 VAL A 82 -5.378 -5.866 -0.351 1.00 1.02 H new ATOM 0 HG12 VAL A 82 -5.340 -4.088 -0.289 1.00 1.02 H new ATOM 0 HG13 VAL A 82 -6.784 -4.967 0.266 1.00 1.02 H new ATOM 0 HG21 VAL A 82 -6.815 -7.017 -2.000 1.00 1.17 H new ATOM 0 HG22 VAL A 82 -8.251 -6.124 -1.445 1.00 1.17 H new ATOM 0 HG23 VAL A 82 -7.783 -6.079 -3.161 1.00 1.17 H new ATOM 1256 N ILE A 83 -7.456 -1.952 -0.369 1.00 0.22 N ATOM 1257 CA ILE A 83 -6.900 -0.940 0.497 1.00 0.19 C ATOM 1258 C ILE A 83 -6.065 -1.589 1.565 1.00 0.19 C ATOM 1259 O ILE A 83 -6.491 -2.542 2.203 1.00 0.24 O ATOM 1260 CB ILE A 83 -7.981 -0.064 1.147 1.00 0.22 C ATOM 1261 CG1 ILE A 83 -8.642 0.756 0.061 1.00 0.27 C ATOM 1262 CG2 ILE A 83 -7.375 0.842 2.224 1.00 0.24 C ATOM 1263 CD1 ILE A 83 -9.704 1.713 0.566 1.00 0.37 C ATOM 0 H ILE A 83 -8.415 -2.221 -0.147 1.00 0.22 H new ATOM 0 HA ILE A 83 -6.282 -0.289 -0.121 1.00 0.19 H new ATOM 0 HB ILE A 83 -8.723 -0.694 1.638 1.00 0.22 H new ATOM 0 HG12 ILE A 83 -7.876 1.325 -0.466 1.00 0.27 H new ATOM 0 HG13 ILE A 83 -9.093 0.080 -0.666 1.00 0.27 H new ATOM 0 HG21 ILE A 83 -8.160 1.453 2.670 1.00 0.24 H new ATOM 0 HG22 ILE A 83 -6.910 0.229 2.996 1.00 0.24 H new ATOM 0 HG23 ILE A 83 -6.623 1.490 1.774 1.00 0.24 H new ATOM 0 HD11 ILE A 83 -10.128 2.262 -0.275 1.00 0.37 H new ATOM 0 HD12 ILE A 83 -10.492 1.151 1.067 1.00 0.37 H new ATOM 0 HD13 ILE A 83 -9.256 2.415 1.269 1.00 0.37 H new ATOM 1275 N LEU A 84 -4.878 -1.081 1.746 1.00 0.19 N ATOM 1276 CA LEU A 84 -3.980 -1.629 2.722 1.00 0.23 C ATOM 1277 C LEU A 84 -3.652 -0.548 3.744 1.00 0.24 C ATOM 1278 O LEU A 84 -2.969 0.432 3.440 1.00 0.31 O ATOM 1279 CB LEU A 84 -2.739 -2.191 2.008 1.00 0.39 C ATOM 1280 CG LEU A 84 -1.618 -2.739 2.896 1.00 0.31 C ATOM 1281 CD1 LEU A 84 -0.750 -1.599 3.373 1.00 0.91 C ATOM 1282 CD2 LEU A 84 -2.170 -3.524 4.081 1.00 1.01 C ATOM 0 H LEU A 84 -4.509 -0.284 1.227 1.00 0.19 H new ATOM 0 HA LEU A 84 -4.433 -2.459 3.263 1.00 0.23 H new ATOM 0 HB2 LEU A 84 -3.064 -2.989 1.340 1.00 0.39 H new ATOM 0 HB3 LEU A 84 -2.321 -1.402 1.382 1.00 0.39 H new ATOM 0 HG LEU A 84 -1.018 -3.430 2.303 1.00 0.31 H new ATOM 0 HD11 LEU A 84 0.048 -1.989 4.005 1.00 0.91 H new ATOM 0 HD12 LEU A 84 -0.315 -1.088 2.514 1.00 0.91 H new ATOM 0 HD13 LEU A 84 -1.355 -0.896 3.945 1.00 0.91 H new ATOM 0 HD21 LEU A 84 -1.344 -3.896 4.687 1.00 1.01 H new ATOM 0 HD22 LEU A 84 -2.800 -2.873 4.687 1.00 1.01 H new ATOM 0 HD23 LEU A 84 -2.761 -4.365 3.717 1.00 1.01 H new ATOM 1294 N VAL A 85 -4.195 -0.703 4.935 1.00 0.21 N ATOM 1295 CA VAL A 85 -3.989 0.249 6.007 1.00 0.27 C ATOM 1296 C VAL A 85 -2.753 -0.106 6.828 1.00 0.25 C ATOM 1297 O VAL A 85 -2.702 -1.159 7.472 1.00 0.29 O ATOM 1298 CB VAL A 85 -5.224 0.302 6.925 1.00 0.34 C ATOM 1299 CG1 VAL A 85 -5.002 1.278 8.058 1.00 0.43 C ATOM 1300 CG2 VAL A 85 -6.466 0.676 6.132 1.00 0.40 C ATOM 0 H VAL A 85 -4.791 -1.492 5.186 1.00 0.21 H new ATOM 0 HA VAL A 85 -3.835 1.229 5.555 1.00 0.27 H new ATOM 0 HB VAL A 85 -5.377 -0.690 7.351 1.00 0.34 H new ATOM 0 HG11 VAL A 85 -5.885 1.302 8.696 1.00 0.43 H new ATOM 0 HG12 VAL A 85 -4.139 0.964 8.645 1.00 0.43 H new ATOM 0 HG13 VAL A 85 -4.821 2.273 7.651 1.00 0.43 H new ATOM 0 HG21 VAL A 85 -7.328 0.708 6.799 1.00 0.40 H new ATOM 0 HG22 VAL A 85 -6.325 1.655 5.675 1.00 0.40 H new ATOM 0 HG23 VAL A 85 -6.638 -0.067 5.353 1.00 0.40 H new ATOM 1310 N VAL A 86 -1.754 0.762 6.771 1.00 0.22 N ATOM 1311 CA VAL A 86 -0.560 0.621 7.579 1.00 0.20 C ATOM 1312 C VAL A 86 -0.279 1.902 8.345 1.00 0.17 C ATOM 1313 O VAL A 86 -0.172 2.980 7.762 1.00 0.22 O ATOM 1314 CB VAL A 86 0.672 0.272 6.728 1.00 0.23 C ATOM 1315 CG1 VAL A 86 0.692 -1.206 6.395 1.00 0.49 C ATOM 1316 CG2 VAL A 86 0.713 1.110 5.457 1.00 0.64 C ATOM 0 H VAL A 86 -1.752 1.581 6.163 1.00 0.22 H new ATOM 0 HA VAL A 86 -0.746 -0.197 8.275 1.00 0.20 H new ATOM 0 HB VAL A 86 1.562 0.504 7.313 1.00 0.23 H new ATOM 0 HG11 VAL A 86 1.572 -1.431 5.792 1.00 0.49 H new ATOM 0 HG12 VAL A 86 0.725 -1.786 7.317 1.00 0.49 H new ATOM 0 HG13 VAL A 86 -0.207 -1.465 5.836 1.00 0.49 H new ATOM 0 HG21 VAL A 86 1.594 0.843 4.874 1.00 0.64 H new ATOM 0 HG22 VAL A 86 -0.184 0.920 4.867 1.00 0.64 H new ATOM 0 HG23 VAL A 86 0.758 2.167 5.719 1.00 0.64 H new ATOM 1326 N ALA A 87 -0.185 1.786 9.654 1.00 0.17 N ATOM 1327 CA ALA A 87 0.155 2.922 10.490 1.00 0.18 C ATOM 1328 C ALA A 87 1.608 3.318 10.256 1.00 0.16 C ATOM 1329 O ALA A 87 2.481 2.459 10.207 1.00 0.24 O ATOM 1330 CB ALA A 87 -0.087 2.573 11.946 1.00 0.28 C ATOM 0 H ALA A 87 -0.339 0.916 10.164 1.00 0.17 H new ATOM 0 HA ALA A 87 -0.476 3.772 10.230 1.00 0.18 H new ATOM 0 HB1 ALA A 87 0.169 3.428 12.572 1.00 0.28 H new ATOM 0 HB2 ALA A 87 -1.137 2.319 12.090 1.00 0.28 H new ATOM 0 HB3 ALA A 87 0.533 1.721 12.224 1.00 0.28 H new ATOM 1336 N ALA A 88 1.873 4.612 10.119 1.00 0.12 N ATOM 1337 CA ALA A 88 3.208 5.082 9.757 1.00 0.14 C ATOM 1338 C ALA A 88 4.170 4.935 10.903 1.00 0.16 C ATOM 1339 O ALA A 88 5.384 5.039 10.730 1.00 0.22 O ATOM 1340 CB ALA A 88 3.173 6.534 9.330 1.00 0.17 C ATOM 0 H ALA A 88 1.185 5.353 10.252 1.00 0.12 H new ATOM 0 HA ALA A 88 3.548 4.465 8.925 1.00 0.14 H new ATOM 0 HB1 ALA A 88 4.179 6.860 9.066 1.00 0.17 H new ATOM 0 HB2 ALA A 88 2.517 6.644 8.466 1.00 0.17 H new ATOM 0 HB3 ALA A 88 2.797 7.146 10.150 1.00 0.17 H new ATOM 1346 N ASP A 89 3.630 4.735 12.075 1.00 0.16 N ATOM 1347 CA ASP A 89 4.474 4.565 13.249 1.00 0.21 C ATOM 1348 C ASP A 89 4.819 3.092 13.475 1.00 0.22 C ATOM 1349 O ASP A 89 5.849 2.778 14.074 1.00 0.37 O ATOM 1350 CB ASP A 89 3.793 5.142 14.485 1.00 0.30 C ATOM 1351 CG ASP A 89 2.693 4.250 15.015 1.00 0.39 C ATOM 1352 OD1 ASP A 89 1.798 3.878 14.228 1.00 0.47 O ATOM 1353 OD2 ASP A 89 2.724 3.916 16.213 1.00 0.58 O ATOM 0 H ASP A 89 2.627 4.685 12.252 1.00 0.16 H new ATOM 0 HA ASP A 89 5.403 5.107 13.073 1.00 0.21 H new ATOM 0 HB2 ASP A 89 4.537 5.297 15.266 1.00 0.30 H new ATOM 0 HB3 ASP A 89 3.377 6.120 14.242 1.00 0.30 H new ATOM 1358 N ASP A 90 3.980 2.196 12.966 1.00 0.19 N ATOM 1359 CA ASP A 90 4.127 0.767 13.246 1.00 0.23 C ATOM 1360 C ASP A 90 4.498 -0.012 11.979 1.00 0.25 C ATOM 1361 O ASP A 90 5.351 -0.894 12.014 1.00 0.42 O ATOM 1362 CB ASP A 90 2.837 0.236 13.862 1.00 0.26 C ATOM 1363 CG ASP A 90 3.029 -1.070 14.602 1.00 0.36 C ATOM 1364 OD1 ASP A 90 4.032 -1.205 15.334 1.00 0.56 O ATOM 1365 OD2 ASP A 90 2.163 -1.958 14.475 1.00 0.46 O ATOM 0 H ASP A 90 3.194 2.430 12.360 1.00 0.19 H new ATOM 0 HA ASP A 90 4.942 0.628 13.956 1.00 0.23 H new ATOM 0 HB2 ASP A 90 2.435 0.981 14.549 1.00 0.26 H new ATOM 0 HB3 ASP A 90 2.096 0.096 13.075 1.00 0.26 H new ATOM 1370 N GLY A 91 3.864 0.330 10.859 1.00 0.20 N ATOM 1371 CA GLY A 91 4.270 -0.207 9.566 1.00 0.21 C ATOM 1372 C GLY A 91 3.610 -1.521 9.198 1.00 0.22 C ATOM 1373 O GLY A 91 2.394 -1.655 9.273 1.00 0.37 O ATOM 0 H GLY A 91 3.073 0.972 10.822 1.00 0.20 H new ATOM 0 HA2 GLY A 91 4.043 0.528 8.794 1.00 0.21 H new ATOM 0 HA3 GLY A 91 5.351 -0.345 9.567 1.00 0.21 H new ATOM 1377 N VAL A 92 4.414 -2.477 8.769 1.00 0.26 N ATOM 1378 CA VAL A 92 3.913 -3.771 8.323 1.00 0.26 C ATOM 1379 C VAL A 92 4.207 -4.839 9.354 1.00 0.24 C ATOM 1380 O VAL A 92 5.333 -4.971 9.842 1.00 0.28 O ATOM 1381 CB VAL A 92 4.515 -4.153 6.958 1.00 0.32 C ATOM 1382 CG1 VAL A 92 4.245 -5.610 6.623 1.00 0.96 C ATOM 1383 CG2 VAL A 92 3.939 -3.258 5.884 1.00 1.03 C ATOM 0 H VAL A 92 5.428 -2.382 8.719 1.00 0.26 H new ATOM 0 HA VAL A 92 2.832 -3.694 8.206 1.00 0.26 H new ATOM 0 HB VAL A 92 5.595 -4.018 7.009 1.00 0.32 H new ATOM 0 HG11 VAL A 92 4.683 -5.848 5.654 1.00 0.96 H new ATOM 0 HG12 VAL A 92 4.689 -6.247 7.388 1.00 0.96 H new ATOM 0 HG13 VAL A 92 3.169 -5.782 6.587 1.00 0.96 H new ATOM 0 HG21 VAL A 92 4.365 -3.528 4.918 1.00 1.03 H new ATOM 0 HG22 VAL A 92 2.856 -3.381 5.850 1.00 1.03 H new ATOM 0 HG23 VAL A 92 4.180 -2.219 6.109 1.00 1.03 H new ATOM 1393 N MET A 93 3.177 -5.587 9.670 1.00 0.22 N ATOM 1394 CA MET A 93 3.192 -6.537 10.766 1.00 0.22 C ATOM 1395 C MET A 93 2.648 -7.888 10.277 1.00 0.22 C ATOM 1396 O MET A 93 2.261 -7.998 9.112 1.00 0.23 O ATOM 1397 CB MET A 93 2.333 -5.961 11.890 1.00 0.21 C ATOM 1398 CG MET A 93 2.771 -4.569 12.323 1.00 0.23 C ATOM 1399 SD MET A 93 4.237 -4.601 13.361 1.00 0.28 S ATOM 1400 CE MET A 93 3.500 -5.172 14.883 1.00 0.27 C ATOM 0 H MET A 93 2.290 -5.555 9.168 1.00 0.22 H new ATOM 0 HA MET A 93 4.204 -6.704 11.135 1.00 0.22 H new ATOM 0 HB2 MET A 93 1.294 -5.923 11.562 1.00 0.21 H new ATOM 0 HB3 MET A 93 2.372 -6.631 12.749 1.00 0.21 H new ATOM 0 HG2 MET A 93 2.969 -3.962 11.439 1.00 0.23 H new ATOM 0 HG3 MET A 93 1.957 -4.087 12.864 1.00 0.23 H new ATOM 0 HE1 MET A 93 3.702 -4.453 15.677 1.00 0.27 H new ATOM 0 HE2 MET A 93 2.423 -5.273 14.750 1.00 0.27 H new ATOM 0 HE3 MET A 93 3.924 -6.139 15.152 1.00 0.27 H new ATOM 1410 N PRO A 94 2.621 -8.929 11.141 1.00 0.25 N ATOM 1411 CA PRO A 94 2.151 -10.273 10.766 1.00 0.30 C ATOM 1412 C PRO A 94 0.891 -10.291 9.888 1.00 0.28 C ATOM 1413 O PRO A 94 0.948 -10.742 8.740 1.00 0.31 O ATOM 1414 CB PRO A 94 1.874 -10.920 12.116 1.00 0.37 C ATOM 1415 CG PRO A 94 2.888 -10.320 13.023 1.00 0.58 C ATOM 1416 CD PRO A 94 3.086 -8.904 12.548 1.00 0.30 C ATOM 0 HA PRO A 94 2.889 -10.787 10.150 1.00 0.30 H new ATOM 0 HB2 PRO A 94 0.860 -10.710 12.458 1.00 0.37 H new ATOM 0 HB3 PRO A 94 1.976 -12.004 12.066 1.00 0.37 H new ATOM 0 HG2 PRO A 94 2.546 -10.340 14.058 1.00 0.58 H new ATOM 0 HG3 PRO A 94 3.823 -10.878 12.986 1.00 0.58 H new ATOM 0 HD2 PRO A 94 2.510 -8.198 13.146 1.00 0.30 H new ATOM 0 HD3 PRO A 94 4.131 -8.602 12.618 1.00 0.30 H new ATOM 1424 N GLN A 95 -0.241 -9.796 10.402 1.00 0.29 N ATOM 1425 CA GLN A 95 -1.495 -9.884 9.660 1.00 0.32 C ATOM 1426 C GLN A 95 -1.510 -8.911 8.487 1.00 0.31 C ATOM 1427 O GLN A 95 -2.283 -9.073 7.541 1.00 0.37 O ATOM 1428 CB GLN A 95 -2.705 -9.630 10.563 1.00 0.37 C ATOM 1429 CG GLN A 95 -2.994 -8.163 10.827 1.00 0.45 C ATOM 1430 CD GLN A 95 -4.438 -7.921 11.222 1.00 0.50 C ATOM 1431 OE1 GLN A 95 -5.294 -7.719 10.362 1.00 0.75 O ATOM 1432 NE2 GLN A 95 -4.725 -7.911 12.515 1.00 0.34 N ATOM 0 H GLN A 95 -0.311 -9.339 11.311 1.00 0.29 H new ATOM 0 HA GLN A 95 -1.564 -10.901 9.274 1.00 0.32 H new ATOM 0 HB2 GLN A 95 -3.585 -10.085 10.108 1.00 0.37 H new ATOM 0 HB3 GLN A 95 -2.544 -10.133 11.516 1.00 0.37 H new ATOM 0 HG2 GLN A 95 -2.338 -7.803 11.620 1.00 0.45 H new ATOM 0 HG3 GLN A 95 -2.762 -7.583 9.934 1.00 0.45 H new ATOM 0 HE21 GLN A 95 -3.991 -8.082 13.202 1.00 0.34 H new ATOM 0 HE22 GLN A 95 -5.680 -7.732 12.824 1.00 0.34 H new ATOM 1441 N THR A 96 -0.647 -7.911 8.553 1.00 0.26 N ATOM 1442 CA THR A 96 -0.531 -6.923 7.498 1.00 0.25 C ATOM 1443 C THR A 96 -0.013 -7.598 6.244 1.00 0.25 C ATOM 1444 O THR A 96 -0.535 -7.404 5.145 1.00 0.31 O ATOM 1445 CB THR A 96 0.437 -5.813 7.902 1.00 0.25 C ATOM 1446 OG1 THR A 96 0.491 -5.738 9.325 1.00 0.24 O ATOM 1447 CG2 THR A 96 -0.010 -4.474 7.350 1.00 0.28 C ATOM 0 H THR A 96 -0.011 -7.763 9.336 1.00 0.26 H new ATOM 0 HA THR A 96 -1.513 -6.485 7.318 1.00 0.25 H new ATOM 0 HB THR A 96 1.421 -6.044 7.494 1.00 0.25 H new ATOM 0 HG1 THR A 96 -0.370 -6.019 9.700 1.00 0.24 H new ATOM 0 HG21 THR A 96 0.697 -3.701 7.653 1.00 0.28 H new ATOM 0 HG22 THR A 96 -0.049 -4.524 6.262 1.00 0.28 H new ATOM 0 HG23 THR A 96 -1.000 -4.232 7.738 1.00 0.28 H new ATOM 1455 N VAL A 97 1.012 -8.417 6.434 1.00 0.25 N ATOM 1456 CA VAL A 97 1.599 -9.152 5.347 1.00 0.31 C ATOM 1457 C VAL A 97 0.639 -10.168 4.763 1.00 0.23 C ATOM 1458 O VAL A 97 0.558 -10.318 3.553 1.00 0.24 O ATOM 1459 CB VAL A 97 2.838 -9.927 5.761 1.00 0.48 C ATOM 1460 CG1 VAL A 97 3.492 -10.458 4.518 1.00 1.02 C ATOM 1461 CG2 VAL A 97 3.794 -9.078 6.556 1.00 1.38 C ATOM 0 H VAL A 97 1.449 -8.583 7.341 1.00 0.25 H new ATOM 0 HA VAL A 97 1.857 -8.388 4.613 1.00 0.31 H new ATOM 0 HB VAL A 97 2.547 -10.750 6.414 1.00 0.48 H new ATOM 0 HG11 VAL A 97 4.386 -11.020 4.789 1.00 1.02 H new ATOM 0 HG12 VAL A 97 2.797 -11.113 3.993 1.00 1.02 H new ATOM 0 HG13 VAL A 97 3.768 -9.627 3.869 1.00 1.02 H new ATOM 0 HG21 VAL A 97 4.666 -9.672 6.831 1.00 1.38 H new ATOM 0 HG22 VAL A 97 4.111 -8.226 5.954 1.00 1.38 H new ATOM 0 HG23 VAL A 97 3.299 -8.721 7.459 1.00 1.38 H new ATOM 1471 N GLU A 98 -0.062 -10.887 5.631 1.00 0.24 N ATOM 1472 CA GLU A 98 -0.969 -11.949 5.184 1.00 0.29 C ATOM 1473 C GLU A 98 -2.008 -11.398 4.216 1.00 0.31 C ATOM 1474 O GLU A 98 -2.557 -12.127 3.388 1.00 0.37 O ATOM 1475 CB GLU A 98 -1.663 -12.611 6.375 1.00 0.39 C ATOM 1476 CG GLU A 98 -0.702 -13.266 7.352 1.00 0.92 C ATOM 1477 CD GLU A 98 -1.412 -14.104 8.390 1.00 1.64 C ATOM 1478 OE1 GLU A 98 -1.715 -15.282 8.108 1.00 1.97 O ATOM 1479 OE2 GLU A 98 -1.665 -13.589 9.499 1.00 2.35 O ATOM 0 H GLU A 98 -0.024 -10.759 6.642 1.00 0.24 H new ATOM 0 HA GLU A 98 -0.373 -12.701 4.668 1.00 0.29 H new ATOM 0 HB2 GLU A 98 -2.251 -11.862 6.904 1.00 0.39 H new ATOM 0 HB3 GLU A 98 -2.361 -13.362 6.006 1.00 0.39 H new ATOM 0 HG2 GLU A 98 -0.001 -13.893 6.801 1.00 0.92 H new ATOM 0 HG3 GLU A 98 -0.116 -12.495 7.852 1.00 0.92 H new ATOM 1486 N ALA A 99 -2.265 -10.104 4.324 1.00 0.31 N ATOM 1487 CA ALA A 99 -3.147 -9.418 3.402 1.00 0.35 C ATOM 1488 C ALA A 99 -2.439 -9.155 2.075 1.00 0.34 C ATOM 1489 O ALA A 99 -3.021 -9.330 1.005 1.00 0.44 O ATOM 1490 CB ALA A 99 -3.635 -8.121 4.024 1.00 0.39 C ATOM 0 H ALA A 99 -1.869 -9.506 5.049 1.00 0.31 H new ATOM 0 HA ALA A 99 -4.010 -10.053 3.199 1.00 0.35 H new ATOM 0 HB1 ALA A 99 -4.298 -7.610 3.326 1.00 0.39 H new ATOM 0 HB2 ALA A 99 -4.176 -8.340 4.944 1.00 0.39 H new ATOM 0 HB3 ALA A 99 -2.781 -7.481 4.249 1.00 0.39 H new ATOM 1496 N ILE A 100 -1.163 -8.782 2.148 1.00 0.28 N ATOM 1497 CA ILE A 100 -0.383 -8.487 0.962 1.00 0.29 C ATOM 1498 C ILE A 100 -0.088 -9.775 0.220 1.00 0.29 C ATOM 1499 O ILE A 100 -0.154 -9.847 -1.006 1.00 0.34 O ATOM 1500 CB ILE A 100 0.951 -7.837 1.346 1.00 0.32 C ATOM 1501 CG1 ILE A 100 0.713 -6.495 2.039 1.00 0.35 C ATOM 1502 CG2 ILE A 100 1.811 -7.681 0.108 1.00 0.36 C ATOM 1503 CD1 ILE A 100 1.944 -5.942 2.728 1.00 0.41 C ATOM 0 H ILE A 100 -0.651 -8.678 3.024 1.00 0.28 H new ATOM 0 HA ILE A 100 -0.955 -7.804 0.334 1.00 0.29 H new ATOM 0 HB ILE A 100 1.479 -8.477 2.053 1.00 0.32 H new ATOM 0 HG12 ILE A 100 0.364 -5.772 1.302 1.00 0.35 H new ATOM 0 HG13 ILE A 100 -0.083 -6.611 2.774 1.00 0.35 H new ATOM 0 HG21 ILE A 100 2.760 -7.219 0.380 1.00 0.36 H new ATOM 0 HG22 ILE A 100 1.997 -8.661 -0.331 1.00 0.36 H new ATOM 0 HG23 ILE A 100 1.295 -7.051 -0.616 1.00 0.36 H new ATOM 0 HD11 ILE A 100 1.701 -4.989 3.198 1.00 0.41 H new ATOM 0 HD12 ILE A 100 2.282 -6.646 3.489 1.00 0.41 H new ATOM 0 HD13 ILE A 100 2.736 -5.793 1.994 1.00 0.41 H new ATOM 1515 N ASN A 101 0.238 -10.787 0.998 1.00 0.29 N ATOM 1516 CA ASN A 101 0.554 -12.101 0.485 1.00 0.34 C ATOM 1517 C ASN A 101 -0.629 -12.689 -0.263 1.00 0.36 C ATOM 1518 O ASN A 101 -0.451 -13.462 -1.201 1.00 0.43 O ATOM 1519 CB ASN A 101 0.992 -13.003 1.645 1.00 0.44 C ATOM 1520 CG ASN A 101 2.485 -12.971 1.854 1.00 0.53 C ATOM 1521 OD1 ASN A 101 3.256 -12.787 0.910 1.00 0.67 O ATOM 1522 ND2 ASN A 101 2.912 -13.148 3.091 1.00 0.64 N ATOM 0 H ASN A 101 0.291 -10.718 2.014 1.00 0.29 H new ATOM 0 HA ASN A 101 1.375 -12.024 -0.228 1.00 0.34 H new ATOM 0 HB2 ASN A 101 0.491 -12.686 2.560 1.00 0.44 H new ATOM 0 HB3 ASN A 101 0.676 -14.027 1.447 1.00 0.44 H new ATOM 0 HD21 ASN A 101 3.912 -13.135 3.292 1.00 0.64 H new ATOM 0 HD22 ASN A 101 2.242 -13.297 3.845 1.00 0.64 H new ATOM 1529 N HIS A 102 -1.835 -12.296 0.129 1.00 0.35 N ATOM 1530 CA HIS A 102 -3.024 -12.708 -0.584 1.00 0.43 C ATOM 1531 C HIS A 102 -3.258 -11.785 -1.776 1.00 0.37 C ATOM 1532 O HIS A 102 -3.729 -12.216 -2.829 1.00 0.41 O ATOM 1533 CB HIS A 102 -4.247 -12.698 0.334 1.00 0.61 C ATOM 1534 CG HIS A 102 -5.368 -13.524 -0.212 1.00 1.18 C ATOM 1535 ND1 HIS A 102 -5.819 -14.686 0.374 1.00 2.07 N ATOM 1536 CD2 HIS A 102 -6.103 -13.358 -1.329 1.00 1.10 C ATOM 1537 CE1 HIS A 102 -6.783 -15.202 -0.365 1.00 2.50 C ATOM 1538 NE2 HIS A 102 -6.979 -14.415 -1.409 1.00 1.91 N ATOM 0 H HIS A 102 -2.009 -11.695 0.934 1.00 0.35 H new ATOM 0 HA HIS A 102 -2.875 -13.728 -0.939 1.00 0.43 H new ATOM 0 HB2 HIS A 102 -3.965 -13.075 1.317 1.00 0.61 H new ATOM 0 HB3 HIS A 102 -4.587 -11.672 0.472 1.00 0.61 H new ATOM 0 HD2 HIS A 102 -6.019 -12.543 -2.033 1.00 1.10 H new ATOM 0 HE1 HIS A 102 -7.321 -16.114 -0.153 1.00 2.50 H new ATOM 0 HE2 HIS A 102 -7.664 -14.566 -2.149 1.00 1.91 H new ATOM 1547 N ALA A 103 -2.917 -10.517 -1.609 1.00 0.37 N ATOM 1548 CA ALA A 103 -3.100 -9.536 -2.667 1.00 0.41 C ATOM 1549 C ALA A 103 -2.205 -9.846 -3.862 1.00 0.40 C ATOM 1550 O ALA A 103 -2.639 -9.754 -5.008 1.00 0.44 O ATOM 1551 CB ALA A 103 -2.830 -8.130 -2.146 1.00 0.47 C ATOM 0 H ALA A 103 -2.512 -10.143 -0.751 1.00 0.37 H new ATOM 0 HA ALA A 103 -4.137 -9.588 -3.000 1.00 0.41 H new ATOM 0 HB1 ALA A 103 -2.972 -7.410 -2.952 1.00 0.47 H new ATOM 0 HB2 ALA A 103 -3.520 -7.905 -1.332 1.00 0.47 H new ATOM 0 HB3 ALA A 103 -1.805 -8.068 -1.780 1.00 0.47 H new ATOM 1557 N LYS A 104 -0.957 -10.226 -3.599 1.00 0.41 N ATOM 1558 CA LYS A 104 -0.036 -10.583 -4.671 1.00 0.49 C ATOM 1559 C LYS A 104 -0.416 -11.923 -5.245 1.00 0.54 C ATOM 1560 O LYS A 104 -0.274 -12.171 -6.442 1.00 0.66 O ATOM 1561 CB LYS A 104 1.386 -10.654 -4.144 1.00 0.61 C ATOM 1562 CG LYS A 104 1.821 -9.389 -3.461 1.00 0.70 C ATOM 1563 CD LYS A 104 1.589 -8.179 -4.348 1.00 0.84 C ATOM 1564 CE LYS A 104 2.623 -7.100 -4.110 1.00 0.99 C ATOM 1565 NZ LYS A 104 3.953 -7.489 -4.641 1.00 1.66 N ATOM 0 H LYS A 104 -0.564 -10.294 -2.660 1.00 0.41 H new ATOM 0 HA LYS A 104 -0.094 -9.819 -5.446 1.00 0.49 H new ATOM 0 HB2 LYS A 104 1.467 -11.485 -3.444 1.00 0.61 H new ATOM 0 HB3 LYS A 104 2.064 -10.866 -4.971 1.00 0.61 H new ATOM 0 HG2 LYS A 104 1.272 -9.269 -2.527 1.00 0.70 H new ATOM 0 HG3 LYS A 104 2.878 -9.457 -3.203 1.00 0.70 H new ATOM 0 HD2 LYS A 104 1.617 -8.485 -5.394 1.00 0.84 H new ATOM 0 HD3 LYS A 104 0.594 -7.776 -4.160 1.00 0.84 H new ATOM 0 HE2 LYS A 104 2.298 -6.174 -4.584 1.00 0.99 H new ATOM 0 HE3 LYS A 104 2.702 -6.901 -3.041 1.00 0.99 H new ATOM 0 HZ1 LYS A 104 4.404 -6.664 -5.086 1.00 1.66 H new ATOM 0 HZ2 LYS A 104 4.551 -7.832 -3.862 1.00 1.66 H new ATOM 0 HZ3 LYS A 104 3.838 -8.244 -5.347 1.00 1.66 H new ATOM 1579 N ALA A 105 -0.878 -12.782 -4.358 1.00 0.51 N ATOM 1580 CA ALA A 105 -1.382 -14.100 -4.746 1.00 0.61 C ATOM 1581 C ALA A 105 -2.419 -13.994 -5.867 1.00 0.62 C ATOM 1582 O ALA A 105 -2.426 -14.804 -6.798 1.00 0.77 O ATOM 1583 CB ALA A 105 -1.983 -14.822 -3.550 1.00 0.65 C ATOM 0 H ALA A 105 -0.918 -12.596 -3.356 1.00 0.51 H new ATOM 0 HA ALA A 105 -0.535 -14.676 -5.117 1.00 0.61 H new ATOM 0 HB1 ALA A 105 -2.351 -15.799 -3.862 1.00 0.65 H new ATOM 0 HB2 ALA A 105 -1.221 -14.950 -2.782 1.00 0.65 H new ATOM 0 HB3 ALA A 105 -2.809 -14.235 -3.148 1.00 0.65 H new ATOM 1589 N ALA A 106 -3.289 -12.996 -5.772 1.00 0.54 N ATOM 1590 CA ALA A 106 -4.297 -12.763 -6.802 1.00 0.64 C ATOM 1591 C ALA A 106 -3.770 -11.814 -7.878 1.00 0.64 C ATOM 1592 O ALA A 106 -4.112 -11.943 -9.055 1.00 0.74 O ATOM 1593 CB ALA A 106 -5.577 -12.217 -6.187 1.00 0.68 C ATOM 0 H ALA A 106 -3.318 -12.336 -4.995 1.00 0.54 H new ATOM 0 HA ALA A 106 -4.523 -13.719 -7.275 1.00 0.64 H new ATOM 0 HB1 ALA A 106 -6.315 -12.050 -6.971 1.00 0.68 H new ATOM 0 HB2 ALA A 106 -5.969 -12.934 -5.466 1.00 0.68 H new ATOM 0 HB3 ALA A 106 -5.365 -11.275 -5.682 1.00 0.68 H new ATOM 1599 N ASN A 107 -2.956 -10.852 -7.432 1.00 0.59 N ATOM 1600 CA ASN A 107 -2.226 -9.915 -8.297 1.00 0.65 C ATOM 1601 C ASN A 107 -3.094 -8.706 -8.584 1.00 0.60 C ATOM 1602 O ASN A 107 -3.305 -8.309 -9.733 1.00 0.85 O ATOM 1603 CB ASN A 107 -1.722 -10.561 -9.586 1.00 0.85 C ATOM 1604 CG ASN A 107 -0.719 -9.701 -10.320 1.00 1.04 C ATOM 1605 OD1 ASN A 107 -0.035 -8.867 -9.725 1.00 1.17 O ATOM 1606 ND2 ASN A 107 -0.600 -9.922 -11.613 1.00 1.41 N ATOM 0 H ASN A 107 -2.781 -10.698 -6.439 1.00 0.59 H new ATOM 0 HA ASN A 107 -1.332 -9.597 -7.760 1.00 0.65 H new ATOM 0 HB2 ASN A 107 -1.266 -11.522 -9.351 1.00 0.85 H new ATOM 0 HB3 ASN A 107 -2.569 -10.762 -10.241 1.00 0.85 H new ATOM 0 HD21 ASN A 107 0.079 -9.393 -12.160 1.00 1.41 H new ATOM 0 HD22 ASN A 107 -1.186 -10.622 -12.067 1.00 1.41 H new ATOM 1613 N VAL A 108 -3.592 -8.137 -7.506 1.00 0.44 N ATOM 1614 CA VAL A 108 -4.472 -6.993 -7.551 1.00 0.42 C ATOM 1615 C VAL A 108 -3.714 -5.717 -7.183 1.00 0.37 C ATOM 1616 O VAL A 108 -2.831 -5.736 -6.319 1.00 0.38 O ATOM 1617 CB VAL A 108 -5.652 -7.200 -6.572 1.00 0.49 C ATOM 1618 CG1 VAL A 108 -5.188 -7.869 -5.287 1.00 1.06 C ATOM 1619 CG2 VAL A 108 -6.298 -5.877 -6.249 1.00 1.35 C ATOM 0 H VAL A 108 -3.392 -8.463 -6.560 1.00 0.44 H new ATOM 0 HA VAL A 108 -4.856 -6.890 -8.566 1.00 0.42 H new ATOM 0 HB VAL A 108 -6.379 -7.851 -7.057 1.00 0.49 H new ATOM 0 HG11 VAL A 108 -6.038 -8.002 -4.618 1.00 1.06 H new ATOM 0 HG12 VAL A 108 -4.754 -8.841 -5.519 1.00 1.06 H new ATOM 0 HG13 VAL A 108 -4.439 -7.244 -4.801 1.00 1.06 H new ATOM 0 HG21 VAL A 108 -7.127 -6.036 -5.559 1.00 1.35 H new ATOM 0 HG22 VAL A 108 -5.564 -5.216 -5.788 1.00 1.35 H new ATOM 0 HG23 VAL A 108 -6.671 -5.421 -7.166 1.00 1.35 H new ATOM 1629 N PRO A 109 -4.020 -4.595 -7.862 1.00 0.35 N ATOM 1630 CA PRO A 109 -3.464 -3.289 -7.514 1.00 0.33 C ATOM 1631 C PRO A 109 -3.927 -2.820 -6.141 1.00 0.28 C ATOM 1632 O PRO A 109 -5.091 -2.988 -5.774 1.00 0.29 O ATOM 1633 CB PRO A 109 -4.002 -2.350 -8.596 1.00 0.37 C ATOM 1634 CG PRO A 109 -4.477 -3.242 -9.693 1.00 0.47 C ATOM 1635 CD PRO A 109 -4.910 -4.517 -9.031 1.00 0.40 C ATOM 0 HA PRO A 109 -2.375 -3.318 -7.468 1.00 0.33 H new ATOM 0 HB2 PRO A 109 -4.814 -1.732 -8.212 1.00 0.37 H new ATOM 0 HB3 PRO A 109 -3.225 -1.672 -8.949 1.00 0.37 H new ATOM 0 HG2 PRO A 109 -5.303 -2.785 -10.237 1.00 0.47 H new ATOM 0 HG3 PRO A 109 -3.683 -3.428 -10.416 1.00 0.47 H new ATOM 0 HD2 PRO A 109 -5.960 -4.485 -8.739 1.00 0.40 H new ATOM 0 HD3 PRO A 109 -4.789 -5.377 -9.690 1.00 0.40 H new ATOM 1643 N ILE A 110 -3.026 -2.207 -5.394 1.00 0.25 N ATOM 1644 CA ILE A 110 -3.317 -1.864 -4.016 1.00 0.21 C ATOM 1645 C ILE A 110 -3.602 -0.364 -3.878 1.00 0.19 C ATOM 1646 O ILE A 110 -3.229 0.443 -4.732 1.00 0.23 O ATOM 1647 CB ILE A 110 -2.134 -2.276 -3.098 1.00 0.23 C ATOM 1648 CG1 ILE A 110 -1.866 -3.789 -3.189 1.00 0.38 C ATOM 1649 CG2 ILE A 110 -2.371 -1.874 -1.652 1.00 0.21 C ATOM 1650 CD1 ILE A 110 -2.930 -4.649 -2.536 1.00 0.60 C ATOM 0 H ILE A 110 -2.096 -1.939 -5.715 1.00 0.25 H new ATOM 0 HA ILE A 110 -4.208 -2.411 -3.707 1.00 0.21 H new ATOM 0 HB ILE A 110 -1.254 -1.740 -3.455 1.00 0.23 H new ATOM 0 HG12 ILE A 110 -1.782 -4.069 -4.239 1.00 0.38 H new ATOM 0 HG13 ILE A 110 -0.904 -4.005 -2.724 1.00 0.38 H new ATOM 0 HG21 ILE A 110 -1.519 -2.181 -1.045 1.00 0.21 H new ATOM 0 HG22 ILE A 110 -2.490 -0.792 -1.590 1.00 0.21 H new ATOM 0 HG23 ILE A 110 -3.274 -2.360 -1.283 1.00 0.21 H new ATOM 0 HD11 ILE A 110 -2.665 -5.701 -2.645 1.00 0.60 H new ATOM 0 HD12 ILE A 110 -3.000 -4.400 -1.477 1.00 0.60 H new ATOM 0 HD13 ILE A 110 -3.891 -4.465 -3.016 1.00 0.60 H new ATOM 1662 N ILE A 111 -4.288 -0.029 -2.803 1.00 0.18 N ATOM 1663 CA ILE A 111 -4.515 1.340 -2.380 1.00 0.18 C ATOM 1664 C ILE A 111 -4.127 1.437 -0.918 1.00 0.16 C ATOM 1665 O ILE A 111 -4.925 1.182 -0.020 1.00 0.18 O ATOM 1666 CB ILE A 111 -5.984 1.796 -2.583 1.00 0.25 C ATOM 1667 CG1 ILE A 111 -6.257 2.043 -4.063 1.00 0.32 C ATOM 1668 CG2 ILE A 111 -6.291 3.062 -1.782 1.00 0.27 C ATOM 1669 CD1 ILE A 111 -5.453 3.194 -4.621 1.00 0.37 C ATOM 0 H ILE A 111 -4.714 -0.718 -2.184 1.00 0.18 H new ATOM 0 HA ILE A 111 -3.909 2.005 -2.995 1.00 0.18 H new ATOM 0 HB ILE A 111 -6.634 0.999 -2.221 1.00 0.25 H new ATOM 0 HG12 ILE A 111 -6.028 1.138 -4.626 1.00 0.32 H new ATOM 0 HG13 ILE A 111 -7.319 2.245 -4.203 1.00 0.32 H new ATOM 0 HG21 ILE A 111 -7.328 3.354 -1.947 1.00 0.27 H new ATOM 0 HG22 ILE A 111 -6.133 2.869 -0.721 1.00 0.27 H new ATOM 0 HG23 ILE A 111 -5.631 3.867 -2.107 1.00 0.27 H new ATOM 0 HD11 ILE A 111 -5.688 3.324 -5.677 1.00 0.37 H new ATOM 0 HD12 ILE A 111 -5.701 4.107 -4.080 1.00 0.37 H new ATOM 0 HD13 ILE A 111 -4.389 2.983 -4.509 1.00 0.37 H new ATOM 1681 N VAL A 112 -2.871 1.726 -0.684 1.00 0.16 N ATOM 1682 CA VAL A 112 -2.369 1.810 0.657 1.00 0.18 C ATOM 1683 C VAL A 112 -2.759 3.116 1.278 1.00 0.20 C ATOM 1684 O VAL A 112 -2.853 4.148 0.617 1.00 0.22 O ATOM 1685 CB VAL A 112 -0.851 1.675 0.715 1.00 0.19 C ATOM 1686 CG1 VAL A 112 -0.364 1.667 2.134 1.00 0.26 C ATOM 1687 CG2 VAL A 112 -0.411 0.415 0.028 1.00 0.19 C ATOM 0 H VAL A 112 -2.178 1.907 -1.411 1.00 0.16 H new ATOM 0 HA VAL A 112 -2.810 0.980 1.209 1.00 0.18 H new ATOM 0 HB VAL A 112 -0.421 2.536 0.203 1.00 0.19 H new ATOM 0 HG11 VAL A 112 0.722 1.570 2.146 1.00 0.26 H new ATOM 0 HG12 VAL A 112 -0.650 2.599 2.622 1.00 0.26 H new ATOM 0 HG13 VAL A 112 -0.809 0.827 2.667 1.00 0.26 H new ATOM 0 HG21 VAL A 112 0.675 0.333 0.078 1.00 0.19 H new ATOM 0 HG22 VAL A 112 -0.863 -0.445 0.522 1.00 0.19 H new ATOM 0 HG23 VAL A 112 -0.725 0.441 -1.015 1.00 0.19 H new ATOM 1697 N ALA A 113 -2.973 3.048 2.551 1.00 0.21 N ATOM 1698 CA ALA A 113 -3.307 4.209 3.326 1.00 0.24 C ATOM 1699 C ALA A 113 -2.591 4.169 4.661 1.00 0.25 C ATOM 1700 O ALA A 113 -2.866 3.325 5.512 1.00 0.28 O ATOM 1701 CB ALA A 113 -4.806 4.315 3.484 1.00 0.29 C ATOM 0 H ALA A 113 -2.922 2.184 3.090 1.00 0.21 H new ATOM 0 HA ALA A 113 -2.971 5.105 2.804 1.00 0.24 H new ATOM 0 HB1 ALA A 113 -5.048 5.199 4.074 1.00 0.29 H new ATOM 0 HB2 ALA A 113 -5.271 4.396 2.501 1.00 0.29 H new ATOM 0 HB3 ALA A 113 -5.182 3.427 3.991 1.00 0.29 H new ATOM 1707 N ILE A 114 -1.647 5.078 4.805 1.00 0.24 N ATOM 1708 CA ILE A 114 -0.854 5.192 6.000 1.00 0.27 C ATOM 1709 C ILE A 114 -1.606 6.003 7.041 1.00 0.30 C ATOM 1710 O ILE A 114 -2.022 7.107 6.760 1.00 0.50 O ATOM 1711 CB ILE A 114 0.497 5.871 5.685 1.00 0.33 C ATOM 1712 CG1 ILE A 114 1.437 4.903 4.967 1.00 0.38 C ATOM 1713 CG2 ILE A 114 1.144 6.405 6.938 1.00 0.44 C ATOM 1714 CD1 ILE A 114 1.253 4.863 3.465 1.00 0.59 C ATOM 0 H ILE A 114 -1.411 5.762 4.086 1.00 0.24 H new ATOM 0 HA ILE A 114 -0.662 4.192 6.390 1.00 0.27 H new ATOM 0 HB ILE A 114 0.298 6.714 5.023 1.00 0.33 H new ATOM 0 HG12 ILE A 114 2.467 5.182 5.189 1.00 0.38 H new ATOM 0 HG13 ILE A 114 1.285 3.901 5.368 1.00 0.38 H new ATOM 0 HG21 ILE A 114 2.093 6.877 6.685 1.00 0.44 H new ATOM 0 HG22 ILE A 114 0.486 7.139 7.403 1.00 0.44 H new ATOM 0 HG23 ILE A 114 1.321 5.585 7.634 1.00 0.44 H new ATOM 0 HD11 ILE A 114 1.957 4.153 3.031 1.00 0.59 H new ATOM 0 HD12 ILE A 114 0.234 4.553 3.231 1.00 0.59 H new ATOM 0 HD13 ILE A 114 1.435 5.854 3.050 1.00 0.59 H new ATOM 1726 N ASN A 115 -1.770 5.462 8.235 1.00 0.19 N ATOM 1727 CA ASN A 115 -2.520 6.136 9.290 1.00 0.22 C ATOM 1728 C ASN A 115 -1.558 6.463 10.383 1.00 0.20 C ATOM 1729 O ASN A 115 -0.412 6.020 10.349 1.00 0.22 O ATOM 1730 CB ASN A 115 -3.662 5.238 9.781 1.00 0.33 C ATOM 1731 CG ASN A 115 -3.211 4.068 10.623 1.00 0.84 C ATOM 1732 OD1 ASN A 115 -2.646 3.119 10.108 1.00 1.85 O ATOM 1733 ND2 ASN A 115 -3.546 4.076 11.908 1.00 0.56 N ATOM 0 H ASN A 115 -1.393 4.553 8.503 1.00 0.19 H new ATOM 0 HA ASN A 115 -2.979 7.055 8.924 1.00 0.22 H new ATOM 0 HB2 ASN A 115 -4.360 5.841 10.362 1.00 0.33 H new ATOM 0 HB3 ASN A 115 -4.209 4.860 8.917 1.00 0.33 H new ATOM 0 HD21 ASN A 115 -3.331 3.271 12.496 1.00 0.56 H new ATOM 0 HD22 ASN A 115 -4.018 4.887 12.307 1.00 0.56 H new ATOM 1740 N LYS A 116 -2.002 7.270 11.313 1.00 0.19 N ATOM 1741 CA LYS A 116 -1.172 7.686 12.406 1.00 0.20 C ATOM 1742 C LYS A 116 -0.069 8.644 11.953 1.00 0.21 C ATOM 1743 O LYS A 116 1.013 8.679 12.537 1.00 0.26 O ATOM 1744 CB LYS A 116 -0.589 6.458 13.109 1.00 0.25 C ATOM 1745 CG LYS A 116 -1.616 5.711 13.941 1.00 0.32 C ATOM 1746 CD LYS A 116 -0.985 4.592 14.748 1.00 0.40 C ATOM 1747 CE LYS A 116 -2.028 3.680 15.379 1.00 0.51 C ATOM 1748 NZ LYS A 116 -1.403 2.492 16.023 1.00 0.59 N ATOM 0 H LYS A 116 -2.947 7.654 11.331 1.00 0.19 H new ATOM 0 HA LYS A 116 -1.791 8.237 13.114 1.00 0.20 H new ATOM 0 HB2 LYS A 116 -0.172 5.782 12.362 1.00 0.25 H new ATOM 0 HB3 LYS A 116 0.234 6.770 13.752 1.00 0.25 H new ATOM 0 HG2 LYS A 116 -2.114 6.408 14.615 1.00 0.32 H new ATOM 0 HG3 LYS A 116 -2.383 5.298 13.286 1.00 0.32 H new ATOM 0 HD2 LYS A 116 -0.333 4.004 14.102 1.00 0.40 H new ATOM 0 HD3 LYS A 116 -0.358 5.019 15.530 1.00 0.40 H new ATOM 0 HE2 LYS A 116 -2.598 4.238 16.121 1.00 0.51 H new ATOM 0 HE3 LYS A 116 -2.734 3.351 14.616 1.00 0.51 H new ATOM 0 HZ1 LYS A 116 -2.087 1.709 16.045 1.00 0.59 H new ATOM 0 HZ2 LYS A 116 -0.564 2.204 15.480 1.00 0.59 H new ATOM 0 HZ3 LYS A 116 -1.120 2.732 16.995 1.00 0.59 H new ATOM 1762 N MET A 117 -0.365 9.438 10.923 1.00 0.21 N ATOM 1763 CA MET A 117 0.530 10.499 10.486 1.00 0.28 C ATOM 1764 C MET A 117 0.354 11.712 11.385 1.00 0.29 C ATOM 1765 O MET A 117 1.112 12.679 11.316 1.00 0.37 O ATOM 1766 CB MET A 117 0.246 10.865 9.036 1.00 0.38 C ATOM 1767 CG MET A 117 0.668 9.786 8.060 1.00 0.48 C ATOM 1768 SD MET A 117 2.439 9.758 7.786 1.00 0.77 S ATOM 1769 CE MET A 117 2.630 11.271 6.852 1.00 0.92 C ATOM 0 H MET A 117 -1.223 9.362 10.377 1.00 0.21 H new ATOM 0 HA MET A 117 1.561 10.151 10.554 1.00 0.28 H new ATOM 0 HB2 MET A 117 -0.820 11.057 8.918 1.00 0.38 H new ATOM 0 HB3 MET A 117 0.766 11.791 8.792 1.00 0.38 H new ATOM 0 HG2 MET A 117 0.347 8.815 8.437 1.00 0.48 H new ATOM 0 HG3 MET A 117 0.159 9.943 7.109 1.00 0.48 H new ATOM 0 HE1 MET A 117 2.880 11.031 5.818 1.00 0.92 H new ATOM 0 HE2 MET A 117 1.698 11.835 6.878 1.00 0.92 H new ATOM 0 HE3 MET A 117 3.429 11.870 7.289 1.00 0.92 H new ATOM 1779 N ASP A 118 -0.677 11.647 12.218 1.00 0.27 N ATOM 1780 CA ASP A 118 -0.902 12.660 13.249 1.00 0.34 C ATOM 1781 C ASP A 118 0.192 12.567 14.294 1.00 0.33 C ATOM 1782 O ASP A 118 0.597 13.563 14.891 1.00 0.47 O ATOM 1783 CB ASP A 118 -2.267 12.478 13.928 1.00 0.39 C ATOM 1784 CG ASP A 118 -2.365 11.189 14.719 1.00 0.55 C ATOM 1785 OD1 ASP A 118 -2.455 10.123 14.092 1.00 0.67 O ATOM 1786 OD2 ASP A 118 -2.370 11.234 15.966 1.00 0.76 O ATOM 0 H ASP A 118 -1.374 10.902 12.202 1.00 0.27 H new ATOM 0 HA ASP A 118 -0.887 13.639 12.770 1.00 0.34 H new ATOM 0 HB2 ASP A 118 -2.452 13.322 14.593 1.00 0.39 H new ATOM 0 HB3 ASP A 118 -3.049 12.493 13.169 1.00 0.39 H new ATOM 1791 N LYS A 119 0.660 11.350 14.504 1.00 0.23 N ATOM 1792 CA LYS A 119 1.727 11.098 15.451 1.00 0.26 C ATOM 1793 C LYS A 119 3.071 11.537 14.878 1.00 0.28 C ATOM 1794 O LYS A 119 3.345 11.341 13.702 1.00 0.26 O ATOM 1795 CB LYS A 119 1.777 9.611 15.818 1.00 0.29 C ATOM 1796 CG LYS A 119 0.555 9.136 16.591 1.00 0.36 C ATOM 1797 CD LYS A 119 0.921 8.062 17.602 1.00 0.72 C ATOM 1798 CE LYS A 119 1.510 6.834 16.934 1.00 0.87 C ATOM 1799 NZ LYS A 119 2.096 5.890 17.922 1.00 1.17 N ATOM 0 H LYS A 119 0.314 10.517 14.027 1.00 0.23 H new ATOM 0 HA LYS A 119 1.525 11.678 16.352 1.00 0.26 H new ATOM 0 HB2 LYS A 119 1.871 9.022 14.905 1.00 0.29 H new ATOM 0 HB3 LYS A 119 2.670 9.421 16.413 1.00 0.29 H new ATOM 0 HG2 LYS A 119 0.097 9.981 17.105 1.00 0.36 H new ATOM 0 HG3 LYS A 119 -0.188 8.745 15.896 1.00 0.36 H new ATOM 0 HD2 LYS A 119 1.638 8.466 18.317 1.00 0.72 H new ATOM 0 HD3 LYS A 119 0.033 7.777 18.167 1.00 0.72 H new ATOM 0 HE2 LYS A 119 0.734 6.325 16.362 1.00 0.87 H new ATOM 0 HE3 LYS A 119 2.279 7.141 16.225 1.00 0.87 H new ATOM 0 HZ1 LYS A 119 2.605 5.134 17.421 1.00 1.17 H new ATOM 0 HZ2 LYS A 119 2.757 6.401 18.541 1.00 1.17 H new ATOM 0 HZ3 LYS A 119 1.336 5.473 18.497 1.00 1.17 H new ATOM 1813 N PRO A 120 3.920 12.159 15.710 1.00 0.38 N ATOM 1814 CA PRO A 120 5.286 12.538 15.320 1.00 0.45 C ATOM 1815 C PRO A 120 6.144 11.311 15.028 1.00 0.40 C ATOM 1816 O PRO A 120 7.215 11.405 14.425 1.00 0.45 O ATOM 1817 CB PRO A 120 5.826 13.280 16.543 1.00 0.57 C ATOM 1818 CG PRO A 120 4.960 12.849 17.674 1.00 0.58 C ATOM 1819 CD PRO A 120 3.609 12.568 17.085 1.00 0.48 C ATOM 0 HA PRO A 120 5.300 13.139 14.410 1.00 0.45 H new ATOM 0 HB2 PRO A 120 6.870 13.027 16.728 1.00 0.57 H new ATOM 0 HB3 PRO A 120 5.780 14.360 16.401 1.00 0.57 H new ATOM 0 HG2 PRO A 120 5.366 11.961 18.158 1.00 0.58 H new ATOM 0 HG3 PRO A 120 4.898 13.627 18.435 1.00 0.58 H new ATOM 0 HD2 PRO A 120 3.088 11.782 17.631 1.00 0.48 H new ATOM 0 HD3 PRO A 120 2.969 13.450 17.108 1.00 0.48 H new ATOM 1827 N GLU A 121 5.655 10.163 15.476 1.00 0.35 N ATOM 1828 CA GLU A 121 6.311 8.884 15.235 1.00 0.37 C ATOM 1829 C GLU A 121 6.019 8.399 13.819 1.00 0.30 C ATOM 1830 O GLU A 121 6.584 7.406 13.363 1.00 0.37 O ATOM 1831 CB GLU A 121 5.812 7.857 16.249 1.00 0.48 C ATOM 1832 CG GLU A 121 5.899 8.339 17.684 1.00 0.62 C ATOM 1833 CD GLU A 121 5.319 7.346 18.665 1.00 1.04 C ATOM 1834 OE1 GLU A 121 4.086 7.358 18.864 1.00 1.45 O ATOM 1835 OE2 GLU A 121 6.085 6.543 19.238 1.00 1.40 O ATOM 0 H GLU A 121 4.793 10.091 16.016 1.00 0.35 H new ATOM 0 HA GLU A 121 7.388 9.010 15.345 1.00 0.37 H new ATOM 0 HB2 GLU A 121 4.777 7.604 16.020 1.00 0.48 H new ATOM 0 HB3 GLU A 121 6.394 6.941 16.145 1.00 0.48 H new ATOM 0 HG2 GLU A 121 6.942 8.528 17.938 1.00 0.62 H new ATOM 0 HG3 GLU A 121 5.371 9.288 17.778 1.00 0.62 H new ATOM 1842 N ALA A 122 5.122 9.109 13.139 1.00 0.24 N ATOM 1843 CA ALA A 122 4.754 8.788 11.763 1.00 0.22 C ATOM 1844 C ALA A 122 5.963 8.810 10.857 1.00 0.21 C ATOM 1845 O ALA A 122 6.591 9.852 10.656 1.00 0.26 O ATOM 1846 CB ALA A 122 3.713 9.762 11.243 1.00 0.27 C ATOM 0 H ALA A 122 4.633 9.917 13.523 1.00 0.24 H new ATOM 0 HA ALA A 122 4.334 7.782 11.763 1.00 0.22 H new ATOM 0 HB1 ALA A 122 3.454 9.504 10.216 1.00 0.27 H new ATOM 0 HB2 ALA A 122 2.821 9.708 11.867 1.00 0.27 H new ATOM 0 HB3 ALA A 122 4.116 10.775 11.272 1.00 0.27 H new ATOM 1852 N ASN A 123 6.290 7.658 10.319 1.00 0.21 N ATOM 1853 CA ASN A 123 7.337 7.563 9.333 1.00 0.23 C ATOM 1854 C ASN A 123 6.799 6.813 8.135 1.00 0.23 C ATOM 1855 O ASN A 123 7.077 5.630 7.939 1.00 0.25 O ATOM 1856 CB ASN A 123 8.559 6.856 9.897 1.00 0.26 C ATOM 1857 CG ASN A 123 9.828 7.547 9.532 1.00 0.42 C ATOM 1858 OD1 ASN A 123 10.270 8.471 10.211 1.00 0.95 O ATOM 1859 ND2 ASN A 123 10.428 7.110 8.466 1.00 0.52 N ATOM 0 H ASN A 123 5.843 6.771 10.550 1.00 0.21 H new ATOM 0 HA ASN A 123 7.649 8.565 9.039 1.00 0.23 H new ATOM 0 HB2 ASN A 123 8.476 6.802 10.982 1.00 0.26 H new ATOM 0 HB3 ASN A 123 8.586 5.831 9.528 1.00 0.26 H new ATOM 0 HD21 ASN A 123 11.303 7.537 8.162 1.00 0.52 H new ATOM 0 HD22 ASN A 123 10.024 6.340 7.933 1.00 0.52 H new ATOM 1866 N PRO A 124 6.012 7.509 7.321 1.00 0.25 N ATOM 1867 CA PRO A 124 5.255 6.904 6.226 1.00 0.32 C ATOM 1868 C PRO A 124 6.135 6.330 5.155 1.00 0.33 C ATOM 1869 O PRO A 124 5.974 5.188 4.749 1.00 0.35 O ATOM 1870 CB PRO A 124 4.469 8.071 5.671 1.00 0.40 C ATOM 1871 CG PRO A 124 5.259 9.275 6.038 1.00 0.32 C ATOM 1872 CD PRO A 124 5.799 8.966 7.397 1.00 0.27 C ATOM 0 HA PRO A 124 4.646 6.068 6.572 1.00 0.32 H new ATOM 0 HB2 PRO A 124 4.352 7.990 4.590 1.00 0.40 H new ATOM 0 HB3 PRO A 124 3.467 8.111 6.098 1.00 0.40 H new ATOM 0 HG2 PRO A 124 6.062 9.456 5.323 1.00 0.32 H new ATOM 0 HG3 PRO A 124 4.636 10.170 6.052 1.00 0.32 H new ATOM 0 HD2 PRO A 124 6.726 9.503 7.599 1.00 0.27 H new ATOM 0 HD3 PRO A 124 5.096 9.235 8.186 1.00 0.27 H new ATOM 1880 N ASP A 125 7.060 7.144 4.703 1.00 0.37 N ATOM 1881 CA ASP A 125 8.030 6.730 3.708 1.00 0.44 C ATOM 1882 C ASP A 125 8.753 5.479 4.175 1.00 0.34 C ATOM 1883 O ASP A 125 9.170 4.653 3.370 1.00 0.33 O ATOM 1884 CB ASP A 125 9.031 7.851 3.450 1.00 0.61 C ATOM 1885 CG ASP A 125 8.349 9.163 3.119 1.00 0.99 C ATOM 1886 OD1 ASP A 125 8.052 9.393 1.928 1.00 1.13 O ATOM 1887 OD2 ASP A 125 8.123 9.979 4.035 1.00 1.44 O ATOM 0 H ASP A 125 7.164 8.111 5.012 1.00 0.37 H new ATOM 0 HA ASP A 125 7.507 6.508 2.778 1.00 0.44 H new ATOM 0 HB2 ASP A 125 9.661 7.983 4.330 1.00 0.61 H new ATOM 0 HB3 ASP A 125 9.688 7.567 2.628 1.00 0.61 H new ATOM 1892 N ARG A 126 8.834 5.308 5.486 1.00 0.31 N ATOM 1893 CA ARG A 126 9.531 4.159 6.051 1.00 0.31 C ATOM 1894 C ARG A 126 8.636 2.943 5.974 1.00 0.27 C ATOM 1895 O ARG A 126 9.005 1.911 5.421 1.00 0.30 O ATOM 1896 CB ARG A 126 9.926 4.417 7.503 1.00 0.35 C ATOM 1897 CG ARG A 126 10.726 3.291 8.144 1.00 0.51 C ATOM 1898 CD ARG A 126 10.812 3.445 9.660 1.00 1.24 C ATOM 1899 NE ARG A 126 9.637 2.887 10.339 1.00 1.92 N ATOM 1900 CZ ARG A 126 9.113 3.371 11.471 1.00 2.94 C ATOM 1901 NH1 ARG A 126 9.630 4.454 12.045 1.00 3.49 N ATOM 1902 NH2 ARG A 126 8.069 2.766 12.025 1.00 3.79 N ATOM 0 H ARG A 126 8.430 5.943 6.175 1.00 0.31 H new ATOM 0 HA ARG A 126 10.441 3.988 5.476 1.00 0.31 H new ATOM 0 HB2 ARG A 126 10.511 5.335 7.550 1.00 0.35 H new ATOM 0 HB3 ARG A 126 9.022 4.584 8.089 1.00 0.35 H new ATOM 0 HG2 ARG A 126 10.264 2.334 7.902 1.00 0.51 H new ATOM 0 HG3 ARG A 126 11.731 3.275 7.723 1.00 0.51 H new ATOM 0 HD2 ARG A 126 11.711 2.947 10.024 1.00 1.24 H new ATOM 0 HD3 ARG A 126 10.908 4.501 9.912 1.00 1.24 H new ATOM 0 HE ARG A 126 9.188 2.073 9.919 1.00 1.92 H new ATOM 0 HH11 ARG A 126 10.432 4.922 11.622 1.00 3.49 H new ATOM 0 HH12 ARG A 126 9.225 4.817 12.908 1.00 3.49 H new ATOM 0 HH21 ARG A 126 7.670 1.936 11.588 1.00 3.79 H new ATOM 0 HH22 ARG A 126 7.666 3.132 12.888 1.00 3.79 H new ATOM 1916 N VAL A 127 7.443 3.086 6.520 1.00 0.25 N ATOM 1917 CA VAL A 127 6.481 2.001 6.530 1.00 0.28 C ATOM 1918 C VAL A 127 6.021 1.630 5.114 1.00 0.28 C ATOM 1919 O VAL A 127 5.713 0.470 4.845 1.00 0.33 O ATOM 1920 CB VAL A 127 5.283 2.317 7.453 1.00 0.36 C ATOM 1921 CG1 VAL A 127 5.790 2.604 8.852 1.00 0.59 C ATOM 1922 CG2 VAL A 127 4.438 3.485 6.948 1.00 0.44 C ATOM 0 H VAL A 127 7.117 3.945 6.963 1.00 0.25 H new ATOM 0 HA VAL A 127 6.987 1.127 6.939 1.00 0.28 H new ATOM 0 HB VAL A 127 4.633 1.442 7.459 1.00 0.36 H new ATOM 0 HG11 VAL A 127 4.947 2.827 9.506 1.00 0.59 H new ATOM 0 HG12 VAL A 127 6.323 1.732 9.232 1.00 0.59 H new ATOM 0 HG13 VAL A 127 6.465 3.459 8.826 1.00 0.59 H new ATOM 0 HG21 VAL A 127 3.611 3.661 7.637 1.00 0.44 H new ATOM 0 HG22 VAL A 127 5.056 4.381 6.886 1.00 0.44 H new ATOM 0 HG23 VAL A 127 4.043 3.248 5.960 1.00 0.44 H new ATOM 1932 N MET A 128 6.020 2.600 4.199 1.00 0.27 N ATOM 1933 CA MET A 128 5.655 2.334 2.806 1.00 0.31 C ATOM 1934 C MET A 128 6.831 1.702 2.058 1.00 0.26 C ATOM 1935 O MET A 128 6.662 1.142 0.975 1.00 0.35 O ATOM 1936 CB MET A 128 5.155 3.614 2.102 1.00 0.52 C ATOM 1937 CG MET A 128 6.249 4.596 1.698 1.00 0.81 C ATOM 1938 SD MET A 128 5.630 6.272 1.381 1.00 0.67 S ATOM 1939 CE MET A 128 4.563 6.050 -0.046 1.00 0.46 C ATOM 0 H MET A 128 6.266 3.570 4.395 1.00 0.27 H new ATOM 0 HA MET A 128 4.829 1.623 2.798 1.00 0.31 H new ATOM 0 HB2 MET A 128 4.598 3.326 1.210 1.00 0.52 H new ATOM 0 HB3 MET A 128 4.455 4.125 2.763 1.00 0.52 H new ATOM 0 HG2 MET A 128 7.000 4.637 2.487 1.00 0.81 H new ATOM 0 HG3 MET A 128 6.748 4.225 0.802 1.00 0.81 H new ATOM 0 HE1 MET A 128 3.740 6.763 0.001 1.00 0.46 H new ATOM 0 HE2 MET A 128 5.136 6.216 -0.958 1.00 0.46 H new ATOM 0 HE3 MET A 128 4.164 5.036 -0.048 1.00 0.46 H new ATOM 1949 N GLN A 129 8.025 1.778 2.643 1.00 0.24 N ATOM 1950 CA GLN A 129 9.171 1.048 2.111 1.00 0.27 C ATOM 1951 C GLN A 129 9.120 -0.414 2.543 1.00 0.30 C ATOM 1952 O GLN A 129 9.668 -1.281 1.868 1.00 0.33 O ATOM 1953 CB GLN A 129 10.493 1.693 2.528 1.00 0.32 C ATOM 1954 CG GLN A 129 10.863 2.891 1.673 1.00 0.42 C ATOM 1955 CD GLN A 129 12.058 3.660 2.200 1.00 0.54 C ATOM 1956 OE1 GLN A 129 12.327 3.674 3.404 1.00 1.17 O ATOM 1957 NE2 GLN A 129 12.766 4.331 1.307 1.00 1.31 N ATOM 0 H GLN A 129 8.222 2.332 3.477 1.00 0.24 H new ATOM 0 HA GLN A 129 9.117 1.091 1.023 1.00 0.27 H new ATOM 0 HB2 GLN A 129 10.426 2.004 3.571 1.00 0.32 H new ATOM 0 HB3 GLN A 129 11.289 0.950 2.467 1.00 0.32 H new ATOM 0 HG2 GLN A 129 11.076 2.552 0.659 1.00 0.42 H new ATOM 0 HG3 GLN A 129 10.007 3.562 1.611 1.00 0.42 H new ATOM 0 HE21 GLN A 129 12.510 4.293 0.320 1.00 1.31 H new ATOM 0 HE22 GLN A 129 13.568 4.887 1.605 1.00 1.31 H new ATOM 1966 N GLU A 130 8.446 -0.687 3.654 1.00 0.37 N ATOM 1967 CA GLU A 130 8.183 -2.064 4.066 1.00 0.43 C ATOM 1968 C GLU A 130 7.220 -2.683 3.078 1.00 0.36 C ATOM 1969 O GLU A 130 7.251 -3.885 2.801 1.00 0.35 O ATOM 1970 CB GLU A 130 7.571 -2.103 5.460 1.00 0.61 C ATOM 1971 CG GLU A 130 8.277 -1.198 6.433 1.00 0.63 C ATOM 1972 CD GLU A 130 9.699 -1.646 6.714 1.00 1.04 C ATOM 1973 OE1 GLU A 130 9.889 -2.530 7.578 1.00 1.63 O ATOM 1974 OE2 GLU A 130 10.633 -1.116 6.078 1.00 1.64 O ATOM 0 H GLU A 130 8.072 0.022 4.285 1.00 0.37 H new ATOM 0 HA GLU A 130 9.121 -2.618 4.088 1.00 0.43 H new ATOM 0 HB2 GLU A 130 6.521 -1.815 5.399 1.00 0.61 H new ATOM 0 HB3 GLU A 130 7.600 -3.126 5.836 1.00 0.61 H new ATOM 0 HG2 GLU A 130 8.291 -0.183 6.036 1.00 0.63 H new ATOM 0 HG3 GLU A 130 7.717 -1.167 7.368 1.00 0.63 H new ATOM 1981 N LEU A 131 6.368 -1.832 2.534 1.00 0.36 N ATOM 1982 CA LEU A 131 5.456 -2.253 1.498 1.00 0.37 C ATOM 1983 C LEU A 131 6.248 -2.740 0.299 1.00 0.29 C ATOM 1984 O LEU A 131 5.978 -3.816 -0.232 1.00 0.32 O ATOM 1985 CB LEU A 131 4.496 -1.133 1.079 1.00 0.49 C ATOM 1986 CG LEU A 131 3.240 -0.946 1.949 1.00 0.71 C ATOM 1987 CD1 LEU A 131 2.886 -2.224 2.661 1.00 1.36 C ATOM 1988 CD2 LEU A 131 3.409 0.168 2.958 1.00 1.18 C ATOM 0 H LEU A 131 6.292 -0.849 2.795 1.00 0.36 H new ATOM 0 HA LEU A 131 4.846 -3.063 1.897 1.00 0.37 H new ATOM 0 HB2 LEU A 131 5.049 -0.194 1.072 1.00 0.49 H new ATOM 0 HB3 LEU A 131 4.176 -1.323 0.054 1.00 0.49 H new ATOM 0 HG LEU A 131 2.428 -0.672 1.275 1.00 0.71 H new ATOM 0 HD11 LEU A 131 1.995 -2.067 3.269 1.00 1.36 H new ATOM 0 HD12 LEU A 131 2.691 -3.007 1.928 1.00 1.36 H new ATOM 0 HD13 LEU A 131 3.715 -2.525 3.302 1.00 1.36 H new ATOM 0 HD21 LEU A 131 2.499 0.264 3.550 1.00 1.18 H new ATOM 0 HD22 LEU A 131 4.247 -0.061 3.616 1.00 1.18 H new ATOM 0 HD23 LEU A 131 3.603 1.105 2.436 1.00 1.18 H new ATOM 2000 N MET A 132 7.267 -1.980 -0.101 1.00 0.25 N ATOM 2001 CA MET A 132 8.056 -2.373 -1.258 1.00 0.26 C ATOM 2002 C MET A 132 8.989 -3.532 -0.915 1.00 0.30 C ATOM 2003 O MET A 132 9.617 -4.116 -1.800 1.00 0.37 O ATOM 2004 CB MET A 132 8.847 -1.209 -1.873 1.00 0.32 C ATOM 2005 CG MET A 132 10.013 -0.727 -1.032 1.00 0.88 C ATOM 2006 SD MET A 132 11.496 -0.416 -2.015 1.00 1.60 S ATOM 2007 CE MET A 132 10.876 0.718 -3.255 1.00 1.61 C ATOM 0 H MET A 132 7.557 -1.111 0.348 1.00 0.25 H new ATOM 0 HA MET A 132 7.343 -2.701 -2.015 1.00 0.26 H new ATOM 0 HB2 MET A 132 9.222 -1.517 -2.849 1.00 0.32 H new ATOM 0 HB3 MET A 132 8.167 -0.374 -2.042 1.00 0.32 H new ATOM 0 HG2 MET A 132 9.728 0.188 -0.512 1.00 0.88 H new ATOM 0 HG3 MET A 132 10.237 -1.471 -0.268 1.00 0.88 H new ATOM 0 HE1 MET A 132 11.092 0.325 -4.248 1.00 1.61 H new ATOM 0 HE2 MET A 132 9.799 0.833 -3.137 1.00 1.61 H new ATOM 0 HE3 MET A 132 11.359 1.688 -3.135 1.00 1.61 H new ATOM 2017 N GLU A 133 9.060 -3.876 0.367 1.00 0.32 N ATOM 2018 CA GLU A 133 9.779 -5.059 0.801 1.00 0.40 C ATOM 2019 C GLU A 133 8.983 -6.284 0.393 1.00 0.38 C ATOM 2020 O GLU A 133 9.530 -7.364 0.183 1.00 0.45 O ATOM 2021 CB GLU A 133 9.975 -5.035 2.310 1.00 0.54 C ATOM 2022 CG GLU A 133 10.958 -3.982 2.776 1.00 0.79 C ATOM 2023 CD GLU A 133 12.392 -4.395 2.538 1.00 1.07 C ATOM 2024 OE1 GLU A 133 12.867 -5.312 3.238 1.00 1.53 O ATOM 2025 OE2 GLU A 133 13.055 -3.810 1.653 1.00 1.67 O ATOM 0 H GLU A 133 8.625 -3.347 1.123 1.00 0.32 H new ATOM 0 HA GLU A 133 10.763 -5.085 0.334 1.00 0.40 H new ATOM 0 HB2 GLU A 133 9.012 -4.860 2.790 1.00 0.54 H new ATOM 0 HB3 GLU A 133 10.322 -6.015 2.639 1.00 0.54 H new ATOM 0 HG2 GLU A 133 10.760 -3.046 2.254 1.00 0.79 H new ATOM 0 HG3 GLU A 133 10.808 -3.792 3.839 1.00 0.79 H new ATOM 2032 N TYR A 134 7.674 -6.099 0.307 1.00 0.35 N ATOM 2033 CA TYR A 134 6.791 -7.101 -0.249 1.00 0.40 C ATOM 2034 C TYR A 134 6.379 -6.714 -1.668 1.00 0.41 C ATOM 2035 O TYR A 134 5.273 -7.014 -2.121 1.00 0.50 O ATOM 2036 CB TYR A 134 5.590 -7.280 0.656 1.00 0.46 C ATOM 2037 CG TYR A 134 5.961 -7.878 1.992 1.00 0.55 C ATOM 2038 CD1 TYR A 134 6.490 -9.160 2.073 1.00 0.98 C ATOM 2039 CD2 TYR A 134 5.818 -7.153 3.168 1.00 0.88 C ATOM 2040 CE1 TYR A 134 6.861 -9.705 3.286 1.00 1.08 C ATOM 2041 CE2 TYR A 134 6.191 -7.690 4.384 1.00 0.95 C ATOM 2042 CZ TYR A 134 6.710 -8.967 4.437 1.00 0.80 C ATOM 2043 OH TYR A 134 7.087 -9.503 5.647 1.00 0.95 O ATOM 0 H TYR A 134 7.200 -5.252 0.621 1.00 0.35 H new ATOM 0 HA TYR A 134 7.313 -8.056 -0.310 1.00 0.40 H new ATOM 0 HB2 TYR A 134 5.110 -6.314 0.814 1.00 0.46 H new ATOM 0 HB3 TYR A 134 4.860 -7.922 0.164 1.00 0.46 H new ATOM 0 HD1 TYR A 134 6.613 -9.741 1.171 1.00 0.98 H new ATOM 0 HD2 TYR A 134 5.409 -6.154 3.131 1.00 0.88 H new ATOM 0 HE1 TYR A 134 7.267 -10.705 3.331 1.00 1.08 H new ATOM 0 HE2 TYR A 134 6.077 -7.113 5.290 1.00 0.95 H new ATOM 0 HH TYR A 134 6.916 -8.853 6.360 1.00 0.95 H new ATOM 2053 N ASN A 135 7.300 -6.032 -2.349 1.00 0.36 N ATOM 2054 CA ASN A 135 7.139 -5.622 -3.743 1.00 0.43 C ATOM 2055 C ASN A 135 5.863 -4.795 -3.949 1.00 0.48 C ATOM 2056 O ASN A 135 5.104 -5.014 -4.890 1.00 0.64 O ATOM 2057 CB ASN A 135 7.156 -6.854 -4.658 1.00 0.58 C ATOM 2058 CG ASN A 135 7.237 -6.508 -6.126 1.00 0.71 C ATOM 2059 OD1 ASN A 135 7.754 -5.459 -6.504 1.00 0.89 O ATOM 2060 ND2 ASN A 135 6.743 -7.398 -6.963 1.00 1.10 N ATOM 0 H ASN A 135 8.190 -5.745 -1.942 1.00 0.36 H new ATOM 0 HA ASN A 135 7.979 -4.979 -4.007 1.00 0.43 H new ATOM 0 HB2 ASN A 135 8.006 -7.483 -4.393 1.00 0.58 H new ATOM 0 HB3 ASN A 135 6.256 -7.443 -4.480 1.00 0.58 H new ATOM 0 HD21 ASN A 135 6.781 -7.229 -7.968 1.00 1.10 H new ATOM 0 HD22 ASN A 135 6.323 -8.256 -6.606 1.00 1.10 H new ATOM 2067 N LEU A 136 5.617 -3.872 -3.034 1.00 0.44 N ATOM 2068 CA LEU A 136 4.536 -2.914 -3.179 1.00 0.54 C ATOM 2069 C LEU A 136 5.105 -1.527 -3.363 1.00 0.41 C ATOM 2070 O LEU A 136 5.577 -0.910 -2.409 1.00 0.47 O ATOM 2071 CB LEU A 136 3.653 -2.938 -1.955 1.00 0.78 C ATOM 2072 CG LEU A 136 2.770 -4.164 -1.819 1.00 0.64 C ATOM 2073 CD1 LEU A 136 2.258 -4.266 -0.396 1.00 1.36 C ATOM 2074 CD2 LEU A 136 1.623 -4.087 -2.809 1.00 1.17 C ATOM 0 H LEU A 136 6.158 -3.767 -2.175 1.00 0.44 H new ATOM 0 HA LEU A 136 3.942 -3.182 -4.053 1.00 0.54 H new ATOM 0 HB2 LEU A 136 4.285 -2.865 -1.070 1.00 0.78 H new ATOM 0 HB3 LEU A 136 3.018 -2.052 -1.967 1.00 0.78 H new ATOM 0 HG LEU A 136 3.349 -5.060 -2.042 1.00 0.64 H new ATOM 0 HD11 LEU A 136 1.624 -5.147 -0.300 1.00 1.36 H new ATOM 0 HD12 LEU A 136 3.102 -4.350 0.289 1.00 1.36 H new ATOM 0 HD13 LEU A 136 1.680 -3.375 -0.153 1.00 1.36 H new ATOM 0 HD21 LEU A 136 0.993 -4.971 -2.706 1.00 1.17 H new ATOM 0 HD22 LEU A 136 1.031 -3.194 -2.611 1.00 1.17 H new ATOM 0 HD23 LEU A 136 2.020 -4.041 -3.823 1.00 1.17 H new ATOM 2086 N VAL A 137 5.066 -1.028 -4.578 1.00 0.31 N ATOM 2087 CA VAL A 137 5.718 0.228 -4.867 1.00 0.27 C ATOM 2088 C VAL A 137 4.712 1.354 -4.997 1.00 0.29 C ATOM 2089 O VAL A 137 3.823 1.322 -5.851 1.00 0.33 O ATOM 2090 CB VAL A 137 6.572 0.169 -6.136 1.00 0.29 C ATOM 2091 CG1 VAL A 137 7.362 1.458 -6.291 1.00 0.43 C ATOM 2092 CG2 VAL A 137 7.484 -1.042 -6.117 1.00 0.41 C ATOM 0 H VAL A 137 4.597 -1.465 -5.371 1.00 0.31 H new ATOM 0 HA VAL A 137 6.377 0.423 -4.021 1.00 0.27 H new ATOM 0 HB VAL A 137 5.914 0.066 -6.999 1.00 0.29 H new ATOM 0 HG11 VAL A 137 7.967 1.407 -7.196 1.00 0.43 H new ATOM 0 HG12 VAL A 137 6.674 2.300 -6.361 1.00 0.43 H new ATOM 0 HG13 VAL A 137 8.013 1.592 -5.427 1.00 0.43 H new ATOM 0 HG21 VAL A 137 8.081 -1.062 -7.029 1.00 0.41 H new ATOM 0 HG22 VAL A 137 8.145 -0.986 -5.252 1.00 0.41 H new ATOM 0 HG23 VAL A 137 6.883 -1.949 -6.056 1.00 0.41 H new ATOM 2102 N PRO A 138 4.828 2.328 -4.093 1.00 0.34 N ATOM 2103 CA PRO A 138 4.094 3.573 -4.141 1.00 0.43 C ATOM 2104 C PRO A 138 4.057 4.164 -5.524 1.00 0.43 C ATOM 2105 O PRO A 138 5.044 4.149 -6.263 1.00 0.45 O ATOM 2106 CB PRO A 138 4.888 4.480 -3.214 1.00 0.53 C ATOM 2107 CG PRO A 138 5.479 3.565 -2.211 1.00 0.54 C ATOM 2108 CD PRO A 138 5.668 2.246 -2.901 1.00 0.39 C ATOM 0 HA PRO A 138 3.051 3.440 -3.854 1.00 0.43 H new ATOM 0 HB2 PRO A 138 5.660 5.024 -3.758 1.00 0.53 H new ATOM 0 HB3 PRO A 138 4.246 5.224 -2.742 1.00 0.53 H new ATOM 0 HG2 PRO A 138 6.430 3.952 -1.845 1.00 0.54 H new ATOM 0 HG3 PRO A 138 4.823 3.461 -1.346 1.00 0.54 H new ATOM 0 HD2 PRO A 138 6.713 2.083 -3.163 1.00 0.39 H new ATOM 0 HD3 PRO A 138 5.367 1.417 -2.260 1.00 0.39 H new ATOM 2116 N GLU A 139 2.911 4.685 -5.856 1.00 0.48 N ATOM 2117 CA GLU A 139 2.707 5.321 -7.148 1.00 0.56 C ATOM 2118 C GLU A 139 3.449 6.647 -7.201 1.00 0.56 C ATOM 2119 O GLU A 139 3.719 7.183 -8.275 1.00 0.64 O ATOM 2120 CB GLU A 139 1.222 5.499 -7.439 1.00 0.71 C ATOM 2121 CG GLU A 139 0.680 4.467 -8.405 1.00 1.35 C ATOM 2122 CD GLU A 139 1.304 4.591 -9.778 1.00 2.40 C ATOM 2123 OE1 GLU A 139 2.424 4.078 -9.971 1.00 3.08 O ATOM 2124 OE2 GLU A 139 0.682 5.211 -10.660 1.00 2.78 O ATOM 0 H GLU A 139 2.090 4.687 -5.251 1.00 0.48 H new ATOM 0 HA GLU A 139 3.113 4.674 -7.925 1.00 0.56 H new ATOM 0 HB2 GLU A 139 0.665 5.441 -6.504 1.00 0.71 H new ATOM 0 HB3 GLU A 139 1.055 6.495 -7.849 1.00 0.71 H new ATOM 0 HG2 GLU A 139 0.867 3.468 -8.011 1.00 1.35 H new ATOM 0 HG3 GLU A 139 -0.401 4.580 -8.487 1.00 1.35 H new ATOM 2131 N GLU A 140 3.792 7.163 -6.028 1.00 0.54 N ATOM 2132 CA GLU A 140 4.712 8.287 -5.927 1.00 0.60 C ATOM 2133 C GLU A 140 6.076 7.899 -6.486 1.00 0.56 C ATOM 2134 O GLU A 140 6.824 8.751 -6.963 1.00 0.65 O ATOM 2135 CB GLU A 140 4.875 8.760 -4.473 1.00 0.67 C ATOM 2136 CG GLU A 140 4.539 7.718 -3.430 1.00 0.63 C ATOM 2137 CD GLU A 140 3.061 7.692 -3.118 1.00 1.12 C ATOM 2138 OE1 GLU A 140 2.595 8.587 -2.385 1.00 1.27 O ATOM 2139 OE2 GLU A 140 2.362 6.794 -3.632 1.00 1.57 O ATOM 0 H GLU A 140 3.446 6.820 -5.132 1.00 0.54 H new ATOM 0 HA GLU A 140 4.291 9.107 -6.508 1.00 0.60 H new ATOM 0 HB2 GLU A 140 5.905 9.085 -4.324 1.00 0.67 H new ATOM 0 HB3 GLU A 140 4.239 9.631 -4.315 1.00 0.67 H new ATOM 0 HG2 GLU A 140 4.853 6.736 -3.783 1.00 0.63 H new ATOM 0 HG3 GLU A 140 5.099 7.923 -2.518 1.00 0.63 H new ATOM 2146 N TRP A 141 6.392 6.608 -6.431 1.00 0.47 N ATOM 2147 CA TRP A 141 7.687 6.128 -6.849 1.00 0.49 C ATOM 2148 C TRP A 141 7.604 5.488 -8.226 1.00 0.51 C ATOM 2149 O TRP A 141 8.576 5.486 -8.979 1.00 0.66 O ATOM 2150 CB TRP A 141 8.227 5.147 -5.831 1.00 0.45 C ATOM 2151 CG TRP A 141 8.299 5.694 -4.432 1.00 0.46 C ATOM 2152 CD1 TRP A 141 8.144 6.993 -4.027 1.00 0.54 C ATOM 2153 CD2 TRP A 141 8.546 4.940 -3.249 1.00 0.44 C ATOM 2154 NE1 TRP A 141 8.265 7.081 -2.665 1.00 0.55 N ATOM 2155 CE2 TRP A 141 8.515 5.834 -2.162 1.00 0.49 C ATOM 2156 CE3 TRP A 141 8.782 3.593 -3.007 1.00 0.45 C ATOM 2157 CZ2 TRP A 141 8.713 5.416 -0.852 1.00 0.52 C ATOM 2158 CZ3 TRP A 141 8.978 3.174 -1.706 1.00 0.50 C ATOM 2159 CH2 TRP A 141 8.942 4.085 -0.643 1.00 0.52 C ATOM 0 H TRP A 141 5.760 5.880 -6.098 1.00 0.47 H new ATOM 0 HA TRP A 141 8.371 6.974 -6.914 1.00 0.49 H new ATOM 0 HB2 TRP A 141 7.598 4.257 -5.830 1.00 0.45 H new ATOM 0 HB3 TRP A 141 9.224 4.832 -6.139 1.00 0.45 H new ATOM 0 HD1 TRP A 141 7.954 7.827 -4.686 1.00 0.54 H new ATOM 0 HE1 TRP A 141 8.182 7.937 -2.116 1.00 0.55 H new ATOM 0 HE3 TRP A 141 8.812 2.885 -3.822 1.00 0.45 H new ATOM 0 HZ2 TRP A 141 8.687 6.116 -0.030 1.00 0.52 H new ATOM 0 HZ3 TRP A 141 9.162 2.129 -1.505 1.00 0.50 H new ATOM 0 HH2 TRP A 141 9.099 3.728 0.364 1.00 0.52 H new ATOM 2170 N GLY A 142 6.436 4.958 -8.553 1.00 0.45 N ATOM 2171 CA GLY A 142 6.223 4.388 -9.867 1.00 0.50 C ATOM 2172 C GLY A 142 6.013 2.889 -9.834 1.00 0.45 C ATOM 2173 O GLY A 142 6.410 2.183 -10.762 1.00 0.53 O ATOM 0 H GLY A 142 5.629 4.912 -7.930 1.00 0.45 H new ATOM 0 HA2 GLY A 142 5.355 4.861 -10.326 1.00 0.50 H new ATOM 0 HA3 GLY A 142 7.081 4.615 -10.499 1.00 0.50 H new ATOM 2177 N GLY A 143 5.423 2.390 -8.756 1.00 0.39 N ATOM 2178 CA GLY A 143 5.095 0.979 -8.701 1.00 0.41 C ATOM 2179 C GLY A 143 3.697 0.699 -9.188 1.00 0.45 C ATOM 2180 O GLY A 143 3.376 0.979 -10.343 1.00 0.60 O ATOM 0 H GLY A 143 5.168 2.929 -7.928 1.00 0.39 H new ATOM 0 HA2 GLY A 143 5.808 0.418 -9.306 1.00 0.41 H new ATOM 0 HA3 GLY A 143 5.199 0.624 -7.676 1.00 0.41 H new ATOM 2184 N ASP A 144 2.866 0.144 -8.315 1.00 0.40 N ATOM 2185 CA ASP A 144 1.469 -0.122 -8.661 1.00 0.45 C ATOM 2186 C ASP A 144 0.573 -0.089 -7.427 1.00 0.33 C ATOM 2187 O ASP A 144 -0.140 -1.064 -7.105 1.00 0.35 O ATOM 2188 CB ASP A 144 1.304 -1.482 -9.340 1.00 0.64 C ATOM 2189 CG ASP A 144 1.893 -1.567 -10.734 1.00 1.33 C ATOM 2190 OD1 ASP A 144 1.208 -1.178 -11.702 1.00 1.91 O ATOM 2191 OD2 ASP A 144 3.038 -2.054 -10.872 1.00 1.91 O ATOM 0 H ASP A 144 3.129 -0.130 -7.368 1.00 0.40 H new ATOM 0 HA ASP A 144 1.171 0.667 -9.352 1.00 0.45 H new ATOM 0 HB2 ASP A 144 1.770 -2.244 -8.716 1.00 0.64 H new ATOM 0 HB3 ASP A 144 0.242 -1.720 -9.394 1.00 0.64 H new ATOM 2196 N THR A 145 0.566 1.049 -6.766 1.00 0.26 N ATOM 2197 CA THR A 145 -0.280 1.263 -5.608 1.00 0.24 C ATOM 2198 C THR A 145 -0.358 2.745 -5.272 1.00 0.27 C ATOM 2199 O THR A 145 0.671 3.388 -5.061 1.00 0.37 O ATOM 2200 CB THR A 145 0.249 0.517 -4.367 1.00 0.25 C ATOM 2201 OG1 THR A 145 0.292 -0.898 -4.590 1.00 0.30 O ATOM 2202 CG2 THR A 145 -0.622 0.815 -3.169 1.00 0.30 C ATOM 0 H THR A 145 1.145 1.851 -7.014 1.00 0.26 H new ATOM 0 HA THR A 145 -1.267 0.877 -5.864 1.00 0.24 H new ATOM 0 HB THR A 145 1.264 0.866 -4.176 1.00 0.25 H new ATOM 0 HG1 THR A 145 -0.220 -1.118 -5.396 1.00 0.30 H new ATOM 0 HG21 THR A 145 -0.238 0.282 -2.299 1.00 0.30 H new ATOM 0 HG22 THR A 145 -0.614 1.887 -2.971 1.00 0.30 H new ATOM 0 HG23 THR A 145 -1.643 0.491 -3.372 1.00 0.30 H new ATOM 2210 N ILE A 146 -1.558 3.293 -5.216 1.00 0.26 N ATOM 2211 CA ILE A 146 -1.726 4.639 -4.728 1.00 0.28 C ATOM 2212 C ILE A 146 -1.594 4.639 -3.211 1.00 0.23 C ATOM 2213 O ILE A 146 -2.479 4.169 -2.493 1.00 0.24 O ATOM 2214 CB ILE A 146 -3.082 5.241 -5.154 1.00 0.36 C ATOM 2215 CG1 ILE A 146 -3.108 5.494 -6.664 1.00 0.53 C ATOM 2216 CG2 ILE A 146 -3.364 6.523 -4.391 1.00 0.34 C ATOM 2217 CD1 ILE A 146 -2.104 6.529 -7.122 1.00 0.63 C ATOM 0 H ILE A 146 -2.420 2.828 -5.501 1.00 0.26 H new ATOM 0 HA ILE A 146 -0.949 5.265 -5.167 1.00 0.28 H new ATOM 0 HB ILE A 146 -3.866 4.523 -4.913 1.00 0.36 H new ATOM 0 HG12 ILE A 146 -2.914 4.556 -7.184 1.00 0.53 H new ATOM 0 HG13 ILE A 146 -4.108 5.817 -6.953 1.00 0.53 H new ATOM 0 HG21 ILE A 146 -4.324 6.931 -4.707 1.00 0.34 H new ATOM 0 HG22 ILE A 146 -3.393 6.311 -3.322 1.00 0.34 H new ATOM 0 HG23 ILE A 146 -2.577 7.249 -4.596 1.00 0.34 H new ATOM 0 HD11 ILE A 146 -2.179 6.656 -8.202 1.00 0.63 H new ATOM 0 HD12 ILE A 146 -2.311 7.479 -6.629 1.00 0.63 H new ATOM 0 HD13 ILE A 146 -1.098 6.198 -6.865 1.00 0.63 H new ATOM 2229 N PHE A 147 -0.452 5.107 -2.742 1.00 0.25 N ATOM 2230 CA PHE A 147 -0.181 5.199 -1.319 1.00 0.30 C ATOM 2231 C PHE A 147 -0.670 6.535 -0.776 1.00 0.32 C ATOM 2232 O PHE A 147 -0.212 7.590 -1.209 1.00 0.50 O ATOM 2233 CB PHE A 147 1.316 5.068 -1.054 1.00 0.41 C ATOM 2234 CG PHE A 147 1.836 3.660 -1.014 1.00 0.33 C ATOM 2235 CD1 PHE A 147 1.794 2.855 -2.144 1.00 0.32 C ATOM 2236 CD2 PHE A 147 2.341 3.129 0.154 1.00 0.37 C ATOM 2237 CE1 PHE A 147 2.253 1.556 -2.100 1.00 0.33 C ATOM 2238 CE2 PHE A 147 2.795 1.827 0.203 1.00 0.36 C ATOM 2239 CZ PHE A 147 2.837 1.072 -0.957 1.00 0.33 C ATOM 0 H PHE A 147 0.312 5.433 -3.334 1.00 0.25 H new ATOM 0 HA PHE A 147 -0.708 4.388 -0.817 1.00 0.30 H new ATOM 0 HB2 PHE A 147 1.855 5.616 -1.827 1.00 0.41 H new ATOM 0 HB3 PHE A 147 1.544 5.550 -0.103 1.00 0.41 H new ATOM 0 HD1 PHE A 147 1.398 3.251 -3.067 1.00 0.32 H new ATOM 0 HD2 PHE A 147 2.382 3.741 1.043 1.00 0.37 H new ATOM 0 HE1 PHE A 147 2.153 0.919 -2.966 1.00 0.33 H new ATOM 0 HE2 PHE A 147 3.116 1.399 1.141 1.00 0.36 H new ATOM 0 HZ PHE A 147 3.326 0.109 -0.962 1.00 0.33 H new ATOM 2249 N CYS A 148 -1.614 6.495 0.138 1.00 0.26 N ATOM 2250 CA CYS A 148 -2.077 7.701 0.797 1.00 0.27 C ATOM 2251 C CYS A 148 -1.453 7.811 2.187 1.00 0.31 C ATOM 2252 O CYS A 148 -1.356 6.822 2.899 1.00 0.53 O ATOM 2253 CB CYS A 148 -3.596 7.678 0.893 1.00 0.30 C ATOM 2254 SG CYS A 148 -4.427 7.651 -0.714 1.00 0.68 S ATOM 0 H CYS A 148 -2.078 5.640 0.444 1.00 0.26 H new ATOM 0 HA CYS A 148 -1.774 8.571 0.215 1.00 0.27 H new ATOM 0 HB2 CYS A 148 -3.902 6.802 1.465 1.00 0.30 H new ATOM 0 HB3 CYS A 148 -3.929 8.554 1.450 1.00 0.30 H new ATOM 0 HG CYS A 148 -5.474 8.421 -0.674 1.00 0.68 H new ATOM 2260 N LYS A 149 -1.005 9.002 2.551 1.00 0.29 N ATOM 2261 CA LYS A 149 -0.411 9.230 3.867 1.00 0.28 C ATOM 2262 C LYS A 149 -1.362 10.045 4.733 1.00 0.28 C ATOM 2263 O LYS A 149 -1.337 11.275 4.702 1.00 0.40 O ATOM 2264 CB LYS A 149 0.918 9.973 3.727 1.00 0.36 C ATOM 2265 CG LYS A 149 1.989 9.195 2.979 1.00 0.56 C ATOM 2266 CD LYS A 149 3.184 10.077 2.665 1.00 0.89 C ATOM 2267 CE LYS A 149 4.335 9.277 2.077 1.00 1.01 C ATOM 2268 NZ LYS A 149 5.440 10.159 1.616 1.00 1.44 N ATOM 0 H LYS A 149 -1.040 9.829 1.956 1.00 0.29 H new ATOM 0 HA LYS A 149 -0.230 8.264 4.339 1.00 0.28 H new ATOM 0 HB2 LYS A 149 0.742 10.916 3.210 1.00 0.36 H new ATOM 0 HB3 LYS A 149 1.291 10.219 4.721 1.00 0.36 H new ATOM 0 HG2 LYS A 149 2.309 8.343 3.578 1.00 0.56 H new ATOM 0 HG3 LYS A 149 1.574 8.796 2.053 1.00 0.56 H new ATOM 0 HD2 LYS A 149 2.887 10.856 1.963 1.00 0.89 H new ATOM 0 HD3 LYS A 149 3.516 10.577 3.575 1.00 0.89 H new ATOM 0 HE2 LYS A 149 4.714 8.581 2.825 1.00 1.01 H new ATOM 0 HE3 LYS A 149 3.973 8.680 1.240 1.00 1.01 H new ATOM 0 HZ1 LYS A 149 6.318 9.606 1.542 1.00 1.44 H new ATOM 0 HZ2 LYS A 149 5.202 10.556 0.685 1.00 1.44 H new ATOM 0 HZ3 LYS A 149 5.575 10.932 2.298 1.00 1.44 H new ATOM 2282 N LEU A 150 -2.204 9.369 5.499 1.00 0.21 N ATOM 2283 CA LEU A 150 -3.220 10.039 6.265 1.00 0.22 C ATOM 2284 C LEU A 150 -3.111 9.787 7.761 1.00 0.19 C ATOM 2285 O LEU A 150 -2.146 9.245 8.277 1.00 0.17 O ATOM 2286 CB LEU A 150 -4.612 9.621 5.778 1.00 0.25 C ATOM 2287 CG LEU A 150 -4.991 8.134 5.699 1.00 0.26 C ATOM 2288 CD1 LEU A 150 -4.167 7.390 4.669 1.00 0.79 C ATOM 2289 CD2 LEU A 150 -4.952 7.437 7.051 1.00 0.84 C ATOM 0 H LEU A 150 -2.196 8.354 5.601 1.00 0.21 H new ATOM 0 HA LEU A 150 -3.067 11.107 6.108 1.00 0.22 H new ATOM 0 HB2 LEU A 150 -5.340 10.106 6.428 1.00 0.25 H new ATOM 0 HB3 LEU A 150 -4.745 10.041 4.781 1.00 0.25 H new ATOM 0 HG LEU A 150 -6.029 8.111 5.369 1.00 0.26 H new ATOM 0 HD11 LEU A 150 -4.470 6.343 4.648 1.00 0.79 H new ATOM 0 HD12 LEU A 150 -4.327 7.833 3.686 1.00 0.79 H new ATOM 0 HD13 LEU A 150 -3.111 7.457 4.930 1.00 0.79 H new ATOM 0 HD21 LEU A 150 -5.229 6.390 6.929 1.00 0.84 H new ATOM 0 HD22 LEU A 150 -3.945 7.500 7.464 1.00 0.84 H new ATOM 0 HD23 LEU A 150 -5.654 7.921 7.730 1.00 0.84 H new ATOM 2301 N SER A 151 -4.161 10.175 8.427 1.00 0.26 N ATOM 2302 CA SER A 151 -4.339 9.945 9.835 1.00 0.29 C ATOM 2303 C SER A 151 -5.781 10.191 10.123 1.00 0.25 C ATOM 2304 O SER A 151 -6.250 11.328 10.076 1.00 0.29 O ATOM 2305 CB SER A 151 -3.473 10.835 10.698 1.00 0.46 C ATOM 2306 OG SER A 151 -2.785 10.035 11.621 1.00 1.77 O ATOM 0 H SER A 151 -4.939 10.674 7.995 1.00 0.26 H new ATOM 0 HA SER A 151 -4.037 8.926 10.075 1.00 0.29 H new ATOM 0 HB2 SER A 151 -2.768 11.390 10.080 1.00 0.46 H new ATOM 0 HB3 SER A 151 -4.087 11.570 11.219 1.00 0.46 H new ATOM 0 HG SER A 151 -3.046 10.288 12.531 1.00 1.77 H new ATOM 2312 N ALA A 152 -6.502 9.125 10.348 1.00 0.28 N ATOM 2313 CA ALA A 152 -7.909 9.241 10.645 1.00 0.31 C ATOM 2314 C ALA A 152 -8.087 9.945 11.973 1.00 0.33 C ATOM 2315 O ALA A 152 -9.175 10.409 12.304 1.00 0.41 O ATOM 2316 CB ALA A 152 -8.562 7.882 10.643 1.00 0.41 C ATOM 0 H ALA A 152 -6.143 8.170 10.332 1.00 0.28 H new ATOM 0 HA ALA A 152 -8.398 9.836 9.873 1.00 0.31 H new ATOM 0 HB1 ALA A 152 -9.623 7.988 10.869 1.00 0.41 H new ATOM 0 HB2 ALA A 152 -8.444 7.423 9.661 1.00 0.41 H new ATOM 0 HB3 ALA A 152 -8.092 7.251 11.397 1.00 0.41 H new ATOM 2322 N LYS A 153 -6.990 10.040 12.712 1.00 0.30 N ATOM 2323 CA LYS A 153 -6.979 10.812 13.944 1.00 0.34 C ATOM 2324 C LYS A 153 -7.128 12.303 13.646 1.00 0.36 C ATOM 2325 O LYS A 153 -8.016 12.962 14.185 1.00 0.49 O ATOM 2326 CB LYS A 153 -5.701 10.569 14.725 1.00 0.35 C ATOM 2327 CG LYS A 153 -5.923 10.064 16.144 1.00 0.60 C ATOM 2328 CD LYS A 153 -6.898 10.943 16.913 1.00 1.12 C ATOM 2329 CE LYS A 153 -6.908 10.605 18.396 1.00 1.65 C ATOM 2330 NZ LYS A 153 -5.711 11.145 19.096 1.00 2.30 N ATOM 0 H LYS A 153 -6.102 9.595 12.481 1.00 0.30 H new ATOM 0 HA LYS A 153 -7.825 10.485 14.549 1.00 0.34 H new ATOM 0 HB2 LYS A 153 -5.091 9.845 14.185 1.00 0.35 H new ATOM 0 HB3 LYS A 153 -5.132 11.498 14.767 1.00 0.35 H new ATOM 0 HG2 LYS A 153 -6.303 9.043 16.111 1.00 0.60 H new ATOM 0 HG3 LYS A 153 -4.970 10.032 16.671 1.00 0.60 H new ATOM 0 HD2 LYS A 153 -6.627 11.990 16.780 1.00 1.12 H new ATOM 0 HD3 LYS A 153 -7.901 10.819 16.504 1.00 1.12 H new ATOM 0 HE2 LYS A 153 -7.810 11.010 18.855 1.00 1.65 H new ATOM 0 HE3 LYS A 153 -6.945 9.523 18.522 1.00 1.65 H new ATOM 0 HZ1 LYS A 153 -5.780 10.937 20.113 1.00 2.30 H new ATOM 0 HZ2 LYS A 153 -4.853 10.701 18.710 1.00 2.30 H new ATOM 0 HZ3 LYS A 153 -5.662 12.174 18.955 1.00 2.30 H new ATOM 2344 N THR A 154 -6.275 12.833 12.767 1.00 0.30 N ATOM 2345 CA THR A 154 -6.294 14.257 12.471 1.00 0.39 C ATOM 2346 C THR A 154 -7.318 14.614 11.399 1.00 0.36 C ATOM 2347 O THR A 154 -7.561 15.790 11.125 1.00 0.41 O ATOM 2348 CB THR A 154 -4.909 14.751 12.044 1.00 0.47 C ATOM 2349 OG1 THR A 154 -4.238 13.719 11.308 1.00 0.50 O ATOM 2350 CG2 THR A 154 -4.082 15.156 13.253 1.00 0.70 C ATOM 0 H THR A 154 -5.572 12.300 12.255 1.00 0.30 H new ATOM 0 HA THR A 154 -6.586 14.758 13.394 1.00 0.39 H new ATOM 0 HB THR A 154 -5.031 15.629 11.409 1.00 0.47 H new ATOM 0 HG1 THR A 154 -3.488 14.107 10.810 1.00 0.50 H new ATOM 0 HG21 THR A 154 -3.103 15.503 12.924 1.00 0.70 H new ATOM 0 HG22 THR A 154 -4.590 15.958 13.789 1.00 0.70 H new ATOM 0 HG23 THR A 154 -3.960 14.298 13.914 1.00 0.70 H new ATOM 2358 N LYS A 155 -7.908 13.580 10.796 1.00 0.30 N ATOM 2359 CA LYS A 155 -8.973 13.749 9.805 1.00 0.32 C ATOM 2360 C LYS A 155 -8.475 14.490 8.578 1.00 0.34 C ATOM 2361 O LYS A 155 -9.128 15.401 8.076 1.00 0.41 O ATOM 2362 CB LYS A 155 -10.172 14.485 10.405 1.00 0.38 C ATOM 2363 CG LYS A 155 -11.083 13.589 11.210 1.00 0.40 C ATOM 2364 CD LYS A 155 -11.575 12.426 10.368 1.00 0.45 C ATOM 2365 CE LYS A 155 -12.779 11.752 11.006 1.00 0.61 C ATOM 2366 NZ LYS A 155 -13.846 12.730 11.357 1.00 1.36 N ATOM 0 H LYS A 155 -7.663 12.607 10.979 1.00 0.30 H new ATOM 0 HA LYS A 155 -9.290 12.751 9.501 1.00 0.32 H new ATOM 0 HB2 LYS A 155 -9.812 15.292 11.043 1.00 0.38 H new ATOM 0 HB3 LYS A 155 -10.746 14.946 9.601 1.00 0.38 H new ATOM 0 HG2 LYS A 155 -10.551 13.212 12.084 1.00 0.40 H new ATOM 0 HG3 LYS A 155 -11.933 14.163 11.578 1.00 0.40 H new ATOM 0 HD2 LYS A 155 -11.840 12.782 9.372 1.00 0.45 H new ATOM 0 HD3 LYS A 155 -10.772 11.699 10.244 1.00 0.45 H new ATOM 0 HE2 LYS A 155 -13.182 11.006 10.321 1.00 0.61 H new ATOM 0 HE3 LYS A 155 -12.464 11.222 11.905 1.00 0.61 H new ATOM 0 HZ1 LYS A 155 -14.778 12.286 11.234 1.00 1.36 H new ATOM 0 HZ2 LYS A 155 -13.732 13.027 12.347 1.00 1.36 H new ATOM 0 HZ3 LYS A 155 -13.774 13.561 10.736 1.00 1.36 H new ATOM 2380 N GLU A 156 -7.327 14.075 8.089 1.00 0.30 N ATOM 2381 CA GLU A 156 -6.710 14.746 6.943 1.00 0.33 C ATOM 2382 C GLU A 156 -6.815 13.884 5.700 1.00 0.28 C ATOM 2383 O GLU A 156 -7.575 14.150 4.753 1.00 0.30 O ATOM 2384 CB GLU A 156 -5.226 15.010 7.212 1.00 0.40 C ATOM 2385 CG GLU A 156 -4.933 15.569 8.588 1.00 1.30 C ATOM 2386 CD GLU A 156 -3.452 15.789 8.808 1.00 1.70 C ATOM 2387 OE1 GLU A 156 -2.897 16.749 8.233 1.00 1.52 O ATOM 2388 OE2 GLU A 156 -2.840 15.012 9.567 1.00 2.48 O ATOM 0 H GLU A 156 -6.798 13.284 8.456 1.00 0.30 H new ATOM 0 HA GLU A 156 -7.238 15.688 6.790 1.00 0.33 H new ATOM 0 HB2 GLU A 156 -4.674 14.078 7.086 1.00 0.40 H new ATOM 0 HB3 GLU A 156 -4.851 15.706 6.462 1.00 0.40 H new ATOM 0 HG2 GLU A 156 -5.462 16.513 8.716 1.00 1.30 H new ATOM 0 HG3 GLU A 156 -5.314 14.885 9.346 1.00 1.30 H new ATOM 2395 N GLY A 157 -6.045 12.822 5.729 1.00 0.29 N ATOM 2396 CA GLY A 157 -5.939 11.953 4.600 1.00 0.28 C ATOM 2397 C GLY A 157 -7.218 11.198 4.304 1.00 0.27 C ATOM 2398 O GLY A 157 -7.301 10.527 3.288 1.00 0.29 O ATOM 0 H GLY A 157 -5.482 12.545 6.533 1.00 0.29 H new ATOM 0 HA2 GLY A 157 -5.660 12.539 3.724 1.00 0.28 H new ATOM 0 HA3 GLY A 157 -5.135 11.238 4.775 1.00 0.28 H new ATOM 2402 N LEU A 158 -8.209 11.281 5.193 1.00 0.26 N ATOM 2403 CA LEU A 158 -9.470 10.598 4.965 1.00 0.28 C ATOM 2404 C LEU A 158 -10.204 11.265 3.823 1.00 0.30 C ATOM 2405 O LEU A 158 -10.788 10.597 2.969 1.00 0.33 O ATOM 2406 CB LEU A 158 -10.331 10.596 6.226 1.00 0.31 C ATOM 2407 CG LEU A 158 -9.819 9.709 7.361 1.00 0.47 C ATOM 2408 CD1 LEU A 158 -10.851 9.634 8.475 1.00 0.73 C ATOM 2409 CD2 LEU A 158 -9.488 8.315 6.847 1.00 0.80 C ATOM 0 H LEU A 158 -8.159 11.809 6.065 1.00 0.26 H new ATOM 0 HA LEU A 158 -9.264 9.560 4.705 1.00 0.28 H new ATOM 0 HB2 LEU A 158 -10.411 11.619 6.594 1.00 0.31 H new ATOM 0 HB3 LEU A 158 -11.337 10.273 5.959 1.00 0.31 H new ATOM 0 HG LEU A 158 -8.906 10.151 7.760 1.00 0.47 H new ATOM 0 HD11 LEU A 158 -10.475 8.999 9.277 1.00 0.73 H new ATOM 0 HD12 LEU A 158 -11.041 10.635 8.863 1.00 0.73 H new ATOM 0 HD13 LEU A 158 -11.778 9.214 8.085 1.00 0.73 H new ATOM 0 HD21 LEU A 158 -9.125 7.700 7.671 1.00 0.80 H new ATOM 0 HD22 LEU A 158 -10.384 7.862 6.423 1.00 0.80 H new ATOM 0 HD23 LEU A 158 -8.717 8.384 6.079 1.00 0.80 H new ATOM 2421 N ASP A 159 -10.148 12.588 3.805 1.00 0.32 N ATOM 2422 CA ASP A 159 -10.703 13.350 2.704 1.00 0.38 C ATOM 2423 C ASP A 159 -9.921 13.048 1.439 1.00 0.32 C ATOM 2424 O ASP A 159 -10.499 12.809 0.379 1.00 0.33 O ATOM 2425 CB ASP A 159 -10.660 14.854 2.986 1.00 0.50 C ATOM 2426 CG ASP A 159 -11.492 15.263 4.183 1.00 1.25 C ATOM 2427 OD1 ASP A 159 -10.976 15.185 5.317 1.00 2.20 O ATOM 2428 OD2 ASP A 159 -12.656 15.678 3.993 1.00 1.42 O ATOM 0 H ASP A 159 -9.724 13.153 4.541 1.00 0.32 H new ATOM 0 HA ASP A 159 -11.746 13.060 2.580 1.00 0.38 H new ATOM 0 HB2 ASP A 159 -9.626 15.156 3.151 1.00 0.50 H new ATOM 0 HB3 ASP A 159 -11.013 15.392 2.106 1.00 0.50 H new ATOM 2433 N HIS A 160 -8.594 13.022 1.563 1.00 0.30 N ATOM 2434 CA HIS A 160 -7.737 12.761 0.412 1.00 0.30 C ATOM 2435 C HIS A 160 -7.836 11.299 -0.041 1.00 0.28 C ATOM 2436 O HIS A 160 -7.473 10.968 -1.173 1.00 0.33 O ATOM 2437 CB HIS A 160 -6.283 13.124 0.745 1.00 0.34 C ATOM 2438 CG HIS A 160 -5.332 12.960 -0.404 1.00 0.41 C ATOM 2439 ND1 HIS A 160 -5.214 13.877 -1.424 1.00 0.52 N ATOM 2440 CD2 HIS A 160 -4.446 11.976 -0.686 1.00 0.46 C ATOM 2441 CE1 HIS A 160 -4.295 13.469 -2.279 1.00 0.58 C ATOM 2442 NE2 HIS A 160 -3.808 12.319 -1.855 1.00 0.54 N ATOM 0 H HIS A 160 -8.096 13.177 2.439 1.00 0.30 H new ATOM 0 HA HIS A 160 -8.080 13.385 -0.413 1.00 0.30 H new ATOM 0 HB2 HIS A 160 -6.247 14.158 1.087 1.00 0.34 H new ATOM 0 HB3 HIS A 160 -5.945 12.502 1.574 1.00 0.34 H new ATOM 0 HD2 HIS A 160 -4.272 11.085 -0.100 1.00 0.46 H new ATOM 0 HE1 HIS A 160 -3.992 13.990 -3.176 1.00 0.58 H new ATOM 0 HE2 HIS A 160 -3.080 11.775 -2.317 1.00 0.54 H new ATOM 2451 N LEU A 161 -8.343 10.432 0.825 1.00 0.27 N ATOM 2452 CA LEU A 161 -8.444 9.015 0.511 1.00 0.28 C ATOM 2453 C LEU A 161 -9.531 8.783 -0.510 1.00 0.29 C ATOM 2454 O LEU A 161 -9.282 8.256 -1.590 1.00 0.31 O ATOM 2455 CB LEU A 161 -8.730 8.188 1.770 1.00 0.29 C ATOM 2456 CG LEU A 161 -7.521 7.485 2.383 1.00 0.57 C ATOM 2457 CD1 LEU A 161 -7.906 6.821 3.694 1.00 1.15 C ATOM 2458 CD2 LEU A 161 -6.961 6.457 1.412 1.00 1.16 C ATOM 0 H LEU A 161 -8.690 10.686 1.750 1.00 0.27 H new ATOM 0 HA LEU A 161 -7.487 8.694 0.099 1.00 0.28 H new ATOM 0 HB2 LEU A 161 -9.167 8.844 2.523 1.00 0.29 H new ATOM 0 HB3 LEU A 161 -9.481 7.436 1.527 1.00 0.29 H new ATOM 0 HG LEU A 161 -6.750 8.228 2.585 1.00 0.57 H new ATOM 0 HD11 LEU A 161 -7.034 6.324 4.120 1.00 1.15 H new ATOM 0 HD12 LEU A 161 -8.270 7.576 4.391 1.00 1.15 H new ATOM 0 HD13 LEU A 161 -8.691 6.086 3.513 1.00 1.15 H new ATOM 0 HD21 LEU A 161 -6.100 5.963 1.862 1.00 1.16 H new ATOM 0 HD22 LEU A 161 -7.727 5.715 1.186 1.00 1.16 H new ATOM 0 HD23 LEU A 161 -6.655 6.955 0.492 1.00 1.16 H new ATOM 2470 N LEU A 162 -10.733 9.208 -0.167 1.00 0.31 N ATOM 2471 CA LEU A 162 -11.887 9.019 -1.024 1.00 0.37 C ATOM 2472 C LEU A 162 -11.686 9.719 -2.367 1.00 0.38 C ATOM 2473 O LEU A 162 -12.204 9.267 -3.384 1.00 0.45 O ATOM 2474 CB LEU A 162 -13.146 9.508 -0.294 1.00 0.47 C ATOM 2475 CG LEU A 162 -13.129 10.961 0.204 1.00 0.85 C ATOM 2476 CD1 LEU A 162 -13.557 11.926 -0.891 1.00 1.49 C ATOM 2477 CD2 LEU A 162 -14.026 11.111 1.423 1.00 1.51 C ATOM 0 H LEU A 162 -10.936 9.691 0.708 1.00 0.31 H new ATOM 0 HA LEU A 162 -12.013 7.959 -1.243 1.00 0.37 H new ATOM 0 HB2 LEU A 162 -13.997 9.387 -0.964 1.00 0.47 H new ATOM 0 HB3 LEU A 162 -13.319 8.856 0.562 1.00 0.47 H new ATOM 0 HG LEU A 162 -12.105 11.208 0.486 1.00 0.85 H new ATOM 0 HD11 LEU A 162 -13.534 12.946 -0.507 1.00 1.49 H new ATOM 0 HD12 LEU A 162 -12.875 11.842 -1.737 1.00 1.49 H new ATOM 0 HD13 LEU A 162 -14.569 11.683 -1.215 1.00 1.49 H new ATOM 0 HD21 LEU A 162 -14.005 12.146 1.765 1.00 1.51 H new ATOM 0 HD22 LEU A 162 -15.048 10.837 1.159 1.00 1.51 H new ATOM 0 HD23 LEU A 162 -13.670 10.458 2.219 1.00 1.51 H new ATOM 2489 N GLU A 163 -10.913 10.803 -2.366 1.00 0.37 N ATOM 2490 CA GLU A 163 -10.552 11.486 -3.601 1.00 0.44 C ATOM 2491 C GLU A 163 -9.726 10.570 -4.499 1.00 0.41 C ATOM 2492 O GLU A 163 -10.047 10.374 -5.672 1.00 0.50 O ATOM 2493 CB GLU A 163 -9.763 12.756 -3.287 1.00 0.56 C ATOM 2494 CG GLU A 163 -10.573 13.810 -2.555 1.00 1.03 C ATOM 2495 CD GLU A 163 -11.618 14.459 -3.437 1.00 1.78 C ATOM 2496 OE1 GLU A 163 -11.253 15.298 -4.288 1.00 2.57 O ATOM 2497 OE2 GLU A 163 -12.808 14.121 -3.293 1.00 2.14 O ATOM 0 H GLU A 163 -10.526 11.225 -1.522 1.00 0.37 H new ATOM 0 HA GLU A 163 -11.468 11.755 -4.127 1.00 0.44 H new ATOM 0 HB2 GLU A 163 -8.894 12.494 -2.683 1.00 0.56 H new ATOM 0 HB3 GLU A 163 -9.388 13.180 -4.218 1.00 0.56 H new ATOM 0 HG2 GLU A 163 -11.062 13.354 -1.694 1.00 1.03 H new ATOM 0 HG3 GLU A 163 -9.901 14.577 -2.170 1.00 1.03 H new ATOM 2504 N MET A 164 -8.668 9.993 -3.934 1.00 0.37 N ATOM 2505 CA MET A 164 -7.779 9.113 -4.690 1.00 0.39 C ATOM 2506 C MET A 164 -8.498 7.832 -5.074 1.00 0.37 C ATOM 2507 O MET A 164 -8.430 7.389 -6.220 1.00 0.43 O ATOM 2508 CB MET A 164 -6.529 8.772 -3.879 1.00 0.43 C ATOM 2509 CG MET A 164 -5.606 9.952 -3.605 1.00 0.64 C ATOM 2510 SD MET A 164 -4.810 10.611 -5.086 1.00 0.58 S ATOM 2511 CE MET A 164 -6.136 11.578 -5.805 1.00 0.53 C ATOM 0 H MET A 164 -8.405 10.119 -2.956 1.00 0.37 H new ATOM 0 HA MET A 164 -7.479 9.642 -5.595 1.00 0.39 H new ATOM 0 HB2 MET A 164 -6.837 8.341 -2.927 1.00 0.43 H new ATOM 0 HB3 MET A 164 -5.966 8.004 -4.410 1.00 0.43 H new ATOM 0 HG2 MET A 164 -6.179 10.747 -3.127 1.00 0.64 H new ATOM 0 HG3 MET A 164 -4.837 9.643 -2.897 1.00 0.64 H new ATOM 0 HE1 MET A 164 -5.730 12.501 -6.219 1.00 0.53 H new ATOM 0 HE2 MET A 164 -6.616 11.005 -6.598 1.00 0.53 H new ATOM 0 HE3 MET A 164 -6.870 11.817 -5.036 1.00 0.53 H new ATOM 2521 N ILE A 165 -9.189 7.252 -4.109 1.00 0.34 N ATOM 2522 CA ILE A 165 -9.916 6.014 -4.317 1.00 0.38 C ATOM 2523 C ILE A 165 -10.943 6.165 -5.436 1.00 0.44 C ATOM 2524 O ILE A 165 -11.069 5.293 -6.294 1.00 0.52 O ATOM 2525 CB ILE A 165 -10.630 5.563 -3.032 1.00 0.40 C ATOM 2526 CG1 ILE A 165 -9.612 5.248 -1.937 1.00 0.42 C ATOM 2527 CG2 ILE A 165 -11.498 4.350 -3.314 1.00 0.50 C ATOM 2528 CD1 ILE A 165 -10.239 4.973 -0.588 1.00 0.50 C ATOM 0 H ILE A 165 -9.262 7.625 -3.162 1.00 0.34 H new ATOM 0 HA ILE A 165 -9.185 5.257 -4.600 1.00 0.38 H new ATOM 0 HB ILE A 165 -11.268 6.376 -2.684 1.00 0.40 H new ATOM 0 HG12 ILE A 165 -9.023 4.381 -2.238 1.00 0.42 H new ATOM 0 HG13 ILE A 165 -8.921 6.086 -1.843 1.00 0.42 H new ATOM 0 HG21 ILE A 165 -11.999 4.040 -2.397 1.00 0.50 H new ATOM 0 HG22 ILE A 165 -12.244 4.604 -4.067 1.00 0.50 H new ATOM 0 HG23 ILE A 165 -10.875 3.534 -3.681 1.00 0.50 H new ATOM 0 HD11 ILE A 165 -9.457 4.757 0.140 1.00 0.50 H new ATOM 0 HD12 ILE A 165 -10.804 5.847 -0.265 1.00 0.50 H new ATOM 0 HD13 ILE A 165 -10.908 4.116 -0.666 1.00 0.50 H new ATOM 2540 N LEU A 166 -11.669 7.275 -5.425 1.00 0.46 N ATOM 2541 CA LEU A 166 -12.671 7.538 -6.448 1.00 0.57 C ATOM 2542 C LEU A 166 -12.027 7.751 -7.804 1.00 0.61 C ATOM 2543 O LEU A 166 -12.531 7.270 -8.814 1.00 0.70 O ATOM 2544 CB LEU A 166 -13.522 8.754 -6.074 1.00 0.66 C ATOM 2545 CG LEU A 166 -14.266 9.402 -7.241 1.00 1.07 C ATOM 2546 CD1 LEU A 166 -15.771 9.313 -7.040 1.00 1.73 C ATOM 2547 CD2 LEU A 166 -13.819 10.844 -7.408 1.00 1.38 C ATOM 0 H LEU A 166 -11.583 8.007 -4.720 1.00 0.46 H new ATOM 0 HA LEU A 166 -13.317 6.663 -6.509 1.00 0.57 H new ATOM 0 HB2 LEU A 166 -14.250 8.452 -5.321 1.00 0.66 H new ATOM 0 HB3 LEU A 166 -12.878 9.502 -5.613 1.00 0.66 H new ATOM 0 HG LEU A 166 -14.024 8.859 -8.155 1.00 1.07 H new ATOM 0 HD11 LEU A 166 -16.279 9.781 -7.883 1.00 1.73 H new ATOM 0 HD12 LEU A 166 -16.068 8.266 -6.973 1.00 1.73 H new ATOM 0 HD13 LEU A 166 -16.046 9.828 -6.120 1.00 1.73 H new ATOM 0 HD21 LEU A 166 -14.355 11.297 -8.242 1.00 1.38 H new ATOM 0 HD22 LEU A 166 -14.033 11.399 -6.495 1.00 1.38 H new ATOM 0 HD23 LEU A 166 -12.748 10.872 -7.607 1.00 1.38 H new ATOM 2559 N LEU A 167 -10.922 8.477 -7.823 1.00 0.56 N ATOM 2560 CA LEU A 167 -10.166 8.669 -9.050 1.00 0.64 C ATOM 2561 C LEU A 167 -9.846 7.320 -9.666 1.00 0.66 C ATOM 2562 O LEU A 167 -9.982 7.120 -10.873 1.00 0.75 O ATOM 2563 CB LEU A 167 -8.874 9.426 -8.768 1.00 0.64 C ATOM 2564 CG LEU A 167 -8.099 9.889 -10.004 1.00 0.81 C ATOM 2565 CD1 LEU A 167 -8.930 10.862 -10.824 1.00 1.47 C ATOM 2566 CD2 LEU A 167 -6.781 10.524 -9.595 1.00 1.51 C ATOM 0 H LEU A 167 -10.529 8.942 -7.005 1.00 0.56 H new ATOM 0 HA LEU A 167 -10.768 9.254 -9.745 1.00 0.64 H new ATOM 0 HB2 LEU A 167 -9.110 10.300 -8.160 1.00 0.64 H new ATOM 0 HB3 LEU A 167 -8.223 8.788 -8.170 1.00 0.64 H new ATOM 0 HG LEU A 167 -7.885 9.018 -10.623 1.00 0.81 H new ATOM 0 HD11 LEU A 167 -8.361 11.179 -11.698 1.00 1.47 H new ATOM 0 HD12 LEU A 167 -9.849 10.373 -11.147 1.00 1.47 H new ATOM 0 HD13 LEU A 167 -9.176 11.732 -10.216 1.00 1.47 H new ATOM 0 HD21 LEU A 167 -6.242 10.848 -10.485 1.00 1.51 H new ATOM 0 HD22 LEU A 167 -6.975 11.385 -8.955 1.00 1.51 H new ATOM 0 HD23 LEU A 167 -6.179 9.796 -9.051 1.00 1.51 H new ATOM 2578 N VAL A 168 -9.440 6.401 -8.808 1.00 0.61 N ATOM 2579 CA VAL A 168 -9.165 5.038 -9.209 1.00 0.69 C ATOM 2580 C VAL A 168 -10.455 4.307 -9.591 1.00 0.77 C ATOM 2581 O VAL A 168 -10.499 3.610 -10.605 1.00 0.89 O ATOM 2582 CB VAL A 168 -8.442 4.270 -8.083 1.00 0.68 C ATOM 2583 CG1 VAL A 168 -8.199 2.832 -8.488 1.00 0.84 C ATOM 2584 CG2 VAL A 168 -7.129 4.952 -7.729 1.00 0.66 C ATOM 0 H VAL A 168 -9.293 6.581 -7.815 1.00 0.61 H new ATOM 0 HA VAL A 168 -8.514 5.076 -10.083 1.00 0.69 H new ATOM 0 HB VAL A 168 -9.082 4.275 -7.201 1.00 0.68 H new ATOM 0 HG11 VAL A 168 -7.688 2.308 -7.680 1.00 0.84 H new ATOM 0 HG12 VAL A 168 -9.153 2.345 -8.691 1.00 0.84 H new ATOM 0 HG13 VAL A 168 -7.581 2.806 -9.385 1.00 0.84 H new ATOM 0 HG21 VAL A 168 -6.633 4.396 -6.933 1.00 0.66 H new ATOM 0 HG22 VAL A 168 -6.485 4.980 -8.608 1.00 0.66 H new ATOM 0 HG23 VAL A 168 -7.327 5.970 -7.392 1.00 0.66 H new ATOM 2594 N SER A 169 -11.512 4.485 -8.795 1.00 0.74 N ATOM 2595 CA SER A 169 -12.791 3.841 -9.074 1.00 0.87 C ATOM 2596 C SER A 169 -13.352 4.267 -10.433 1.00 0.96 C ATOM 2597 O SER A 169 -13.888 3.444 -11.178 1.00 1.12 O ATOM 2598 CB SER A 169 -13.788 4.164 -7.964 1.00 0.88 C ATOM 2599 OG SER A 169 -13.290 3.754 -6.700 1.00 1.35 O ATOM 0 H SER A 169 -11.505 5.067 -7.957 1.00 0.74 H new ATOM 0 HA SER A 169 -12.626 2.764 -9.109 1.00 0.87 H new ATOM 0 HB2 SER A 169 -13.988 5.235 -7.950 1.00 0.88 H new ATOM 0 HB3 SER A 169 -14.736 3.665 -8.165 1.00 0.88 H new ATOM 0 HG SER A 169 -12.531 4.320 -6.448 1.00 1.35 H new ATOM 2605 N GLU A 170 -13.211 5.545 -10.769 1.00 0.96 N ATOM 2606 CA GLU A 170 -13.738 6.055 -12.027 1.00 1.11 C ATOM 2607 C GLU A 170 -12.784 5.733 -13.172 1.00 1.17 C ATOM 2608 O GLU A 170 -13.151 5.807 -14.348 1.00 1.37 O ATOM 2609 CB GLU A 170 -13.959 7.562 -11.934 1.00 1.26 C ATOM 2610 CG GLU A 170 -14.939 7.967 -10.843 1.00 1.84 C ATOM 2611 CD GLU A 170 -16.347 7.470 -11.103 1.00 2.19 C ATOM 2612 OE1 GLU A 170 -16.636 6.289 -10.817 1.00 2.73 O ATOM 2613 OE2 GLU A 170 -17.180 8.267 -11.581 1.00 2.56 O ATOM 0 H GLU A 170 -12.740 6.241 -10.192 1.00 0.96 H new ATOM 0 HA GLU A 170 -14.695 5.571 -12.224 1.00 1.11 H new ATOM 0 HB2 GLU A 170 -13.002 8.051 -11.751 1.00 1.26 H new ATOM 0 HB3 GLU A 170 -14.325 7.927 -12.894 1.00 1.26 H new ATOM 0 HG2 GLU A 170 -14.592 7.577 -9.886 1.00 1.84 H new ATOM 0 HG3 GLU A 170 -14.952 9.054 -10.758 1.00 1.84 H new ATOM 2620 N MET A 171 -11.563 5.351 -12.816 1.00 1.11 N ATOM 2621 CA MET A 171 -10.531 5.039 -13.797 1.00 1.28 C ATOM 2622 C MET A 171 -10.795 3.678 -14.438 1.00 1.54 C ATOM 2623 O MET A 171 -10.146 3.311 -15.416 1.00 1.88 O ATOM 2624 CB MET A 171 -9.143 5.061 -13.149 1.00 1.31 C ATOM 2625 CG MET A 171 -8.007 5.063 -14.158 1.00 1.43 C ATOM 2626 SD MET A 171 -6.379 5.003 -13.387 1.00 1.66 S ATOM 2627 CE MET A 171 -6.434 3.385 -12.620 1.00 1.68 C ATOM 0 H MET A 171 -11.262 5.249 -11.847 1.00 1.11 H new ATOM 0 HA MET A 171 -10.560 5.802 -14.575 1.00 1.28 H new ATOM 0 HB2 MET A 171 -9.059 5.945 -12.517 1.00 1.31 H new ATOM 0 HB3 MET A 171 -9.040 4.193 -12.498 1.00 1.31 H new ATOM 0 HG2 MET A 171 -8.119 4.208 -14.824 1.00 1.43 H new ATOM 0 HG3 MET A 171 -8.078 5.959 -14.775 1.00 1.43 H new ATOM 0 HE1 MET A 171 -5.420 3.053 -12.398 1.00 1.68 H new ATOM 0 HE2 MET A 171 -7.009 3.440 -11.695 1.00 1.68 H new ATOM 0 HE3 MET A 171 -6.907 2.676 -13.299 1.00 1.68 H new ATOM 2637 N GLU A 172 -11.746 2.935 -13.870 1.00 1.62 N ATOM 2638 CA GLU A 172 -12.172 1.651 -14.427 1.00 2.07 C ATOM 2639 C GLU A 172 -12.399 1.761 -15.933 1.00 2.05 C ATOM 2640 O GLU A 172 -11.879 0.964 -16.707 1.00 2.58 O ATOM 2641 CB GLU A 172 -13.462 1.175 -13.755 1.00 2.47 C ATOM 2642 CG GLU A 172 -14.078 -0.043 -14.429 1.00 3.01 C ATOM 2643 CD GLU A 172 -15.469 -0.361 -13.925 1.00 3.71 C ATOM 2644 OE1 GLU A 172 -16.261 0.582 -13.715 1.00 4.27 O ATOM 2645 OE2 GLU A 172 -15.783 -1.556 -13.764 1.00 4.04 O ATOM 0 H GLU A 172 -12.239 3.203 -13.018 1.00 1.62 H new ATOM 0 HA GLU A 172 -11.379 0.928 -14.238 1.00 2.07 H new ATOM 0 HB2 GLU A 172 -13.254 0.938 -12.712 1.00 2.47 H new ATOM 0 HB3 GLU A 172 -14.187 1.989 -13.758 1.00 2.47 H new ATOM 0 HG2 GLU A 172 -14.118 0.126 -15.505 1.00 3.01 H new ATOM 0 HG3 GLU A 172 -13.433 -0.906 -14.266 1.00 3.01 H new ATOM 2652 N GLU A 173 -13.178 2.756 -16.332 1.00 1.85 N ATOM 2653 CA GLU A 173 -13.449 3.005 -17.740 1.00 2.28 C ATOM 2654 C GLU A 173 -12.572 4.142 -18.253 1.00 2.77 C ATOM 2655 O GLU A 173 -12.309 4.262 -19.450 1.00 3.47 O ATOM 2656 CB GLU A 173 -14.923 3.365 -17.922 1.00 2.50 C ATOM 2657 CG GLU A 173 -15.879 2.249 -17.530 1.00 2.86 C ATOM 2658 CD GLU A 173 -15.937 1.142 -18.563 1.00 3.41 C ATOM 2659 OE1 GLU A 173 -16.768 1.216 -19.492 1.00 3.91 O ATOM 2660 OE2 GLU A 173 -15.141 0.187 -18.447 1.00 3.82 O ATOM 0 H GLU A 173 -13.636 3.408 -15.695 1.00 1.85 H new ATOM 0 HA GLU A 173 -13.223 2.104 -18.310 1.00 2.28 H new ATOM 0 HB2 GLU A 173 -15.148 4.250 -17.326 1.00 2.50 H new ATOM 0 HB3 GLU A 173 -15.097 3.630 -18.965 1.00 2.50 H new ATOM 0 HG2 GLU A 173 -15.570 1.831 -16.572 1.00 2.86 H new ATOM 0 HG3 GLU A 173 -16.877 2.663 -17.390 1.00 2.86 H new ATOM 2667 N LEU A 174 -12.094 4.954 -17.326 1.00 2.83 N ATOM 2668 CA LEU A 174 -11.356 6.166 -17.659 1.00 3.69 C ATOM 2669 C LEU A 174 -9.871 5.993 -17.344 1.00 3.89 C ATOM 2670 O LEU A 174 -9.277 6.827 -16.659 1.00 4.73 O ATOM 2671 CB LEU A 174 -11.934 7.356 -16.879 1.00 4.31 C ATOM 2672 CG LEU A 174 -12.067 8.671 -17.663 1.00 4.98 C ATOM 2673 CD1 LEU A 174 -10.710 9.186 -18.117 1.00 5.48 C ATOM 2674 CD2 LEU A 174 -12.987 8.484 -18.859 1.00 5.72 C ATOM 0 H LEU A 174 -12.204 4.795 -16.325 1.00 2.83 H new ATOM 0 HA LEU A 174 -11.457 6.359 -18.727 1.00 3.69 H new ATOM 0 HB2 LEU A 174 -12.919 7.077 -16.506 1.00 4.31 H new ATOM 0 HB3 LEU A 174 -11.303 7.536 -16.009 1.00 4.31 H new ATOM 0 HG LEU A 174 -12.501 9.415 -16.995 1.00 4.98 H new ATOM 0 HD11 LEU A 174 -10.840 10.117 -18.668 1.00 5.48 H new ATOM 0 HD12 LEU A 174 -10.079 9.365 -17.246 1.00 5.48 H new ATOM 0 HD13 LEU A 174 -10.237 8.445 -18.762 1.00 5.48 H new ATOM 0 HD21 LEU A 174 -13.071 9.424 -19.404 1.00 5.72 H new ATOM 0 HD22 LEU A 174 -12.577 7.718 -19.517 1.00 5.72 H new ATOM 0 HD23 LEU A 174 -13.974 8.175 -18.514 1.00 5.72 H new ATOM 2686 N LYS A 175 -9.297 4.875 -17.791 1.00 3.42 N ATOM 2687 CA LYS A 175 -7.880 4.590 -17.582 1.00 3.88 C ATOM 2688 C LYS A 175 -7.012 5.787 -17.958 1.00 4.00 C ATOM 2689 O LYS A 175 -7.014 6.235 -19.108 1.00 4.36 O ATOM 2690 CB LYS A 175 -7.440 3.380 -18.408 1.00 4.27 C ATOM 2691 CG LYS A 175 -8.269 2.122 -18.193 1.00 4.29 C ATOM 2692 CD LYS A 175 -9.513 2.097 -19.066 1.00 4.24 C ATOM 2693 CE LYS A 175 -10.152 0.717 -19.076 1.00 4.99 C ATOM 2694 NZ LYS A 175 -9.233 -0.324 -19.609 1.00 5.49 N ATOM 0 H LYS A 175 -9.797 4.149 -18.303 1.00 3.42 H new ATOM 0 HA LYS A 175 -7.750 4.375 -16.521 1.00 3.88 H new ATOM 0 HB2 LYS A 175 -7.478 3.646 -19.464 1.00 4.27 H new ATOM 0 HB3 LYS A 175 -6.399 3.157 -18.173 1.00 4.27 H new ATOM 0 HG2 LYS A 175 -7.658 1.245 -18.409 1.00 4.29 H new ATOM 0 HG3 LYS A 175 -8.561 2.057 -17.145 1.00 4.29 H new ATOM 0 HD2 LYS A 175 -10.232 2.830 -18.700 1.00 4.24 H new ATOM 0 HD3 LYS A 175 -9.252 2.387 -20.084 1.00 4.24 H new ATOM 0 HE2 LYS A 175 -10.452 0.450 -18.063 1.00 4.99 H new ATOM 0 HE3 LYS A 175 -11.059 0.743 -19.680 1.00 4.99 H new ATOM 0 HZ1 LYS A 175 -9.788 -1.130 -19.962 1.00 5.49 H new ATOM 0 HZ2 LYS A 175 -8.670 0.075 -20.387 1.00 5.49 H new ATOM 0 HZ3 LYS A 175 -8.597 -0.647 -18.852 1.00 5.49 H new ATOM 2708 N ALA A 176 -6.284 6.308 -16.988 1.00 4.26 N ATOM 2709 CA ALA A 176 -5.388 7.425 -17.225 1.00 4.89 C ATOM 2710 C ALA A 176 -3.974 6.919 -17.465 1.00 5.36 C ATOM 2711 O ALA A 176 -3.483 6.054 -16.738 1.00 5.78 O ATOM 2712 CB ALA A 176 -5.422 8.385 -16.045 1.00 5.48 C ATOM 0 H ALA A 176 -6.296 5.974 -16.024 1.00 4.26 H new ATOM 0 HA ALA A 176 -5.718 7.962 -18.114 1.00 4.89 H new ATOM 0 HB1 ALA A 176 -4.746 9.219 -16.235 1.00 5.48 H new ATOM 0 HB2 ALA A 176 -6.436 8.763 -15.912 1.00 5.48 H new ATOM 0 HB3 ALA A 176 -5.109 7.862 -15.141 1.00 5.48 H new ATOM 2718 N ASN A 177 -3.327 7.446 -18.490 1.00 5.66 N ATOM 2719 CA ASN A 177 -1.981 7.016 -18.823 1.00 6.40 C ATOM 2720 C ASN A 177 -0.972 8.126 -18.527 1.00 6.79 C ATOM 2721 O ASN A 177 -1.127 9.266 -18.969 1.00 6.94 O ATOM 2722 CB ASN A 177 -1.897 6.572 -20.294 1.00 6.79 C ATOM 2723 CG ASN A 177 -2.063 7.712 -21.283 1.00 7.41 C ATOM 2724 OD1 ASN A 177 -3.181 8.091 -21.634 1.00 7.72 O ATOM 2725 ND2 ASN A 177 -0.952 8.237 -21.770 1.00 7.88 N ATOM 0 H ASN A 177 -3.709 8.167 -19.102 1.00 5.66 H new ATOM 0 HA ASN A 177 -1.732 6.157 -18.199 1.00 6.40 H new ATOM 0 HB2 ASN A 177 -0.934 6.091 -20.465 1.00 6.79 H new ATOM 0 HB3 ASN A 177 -2.666 5.823 -20.483 1.00 6.79 H new ATOM 0 HD21 ASN A 177 -1.002 8.984 -22.463 1.00 7.88 H new ATOM 0 HD22 ASN A 177 -0.045 7.895 -21.453 1.00 7.88 H new ATOM 2732 N PRO A 178 0.036 7.817 -17.705 1.00 7.29 N ATOM 2733 CA PRO A 178 1.119 8.728 -17.392 1.00 8.00 C ATOM 2734 C PRO A 178 2.302 8.548 -18.340 1.00 8.71 C ATOM 2735 O PRO A 178 2.428 9.335 -19.305 1.00 9.19 O ATOM 2736 CB PRO A 178 1.502 8.331 -15.958 1.00 8.54 C ATOM 2737 CG PRO A 178 0.841 7.004 -15.692 1.00 8.16 C ATOM 2738 CD PRO A 178 0.192 6.560 -16.977 1.00 7.54 C ATOM 2739 OXT PRO A 178 3.093 7.605 -18.133 1.00 9.00 O ATOM 0 HA PRO A 178 0.831 9.774 -17.492 1.00 8.00 H new ATOM 0 HB2 PRO A 178 2.584 8.254 -15.853 1.00 8.54 H new ATOM 0 HB3 PRO A 178 1.165 9.083 -15.244 1.00 8.54 H new ATOM 0 HG2 PRO A 178 1.574 6.270 -15.358 1.00 8.16 H new ATOM 0 HG3 PRO A 178 0.099 7.097 -14.899 1.00 8.16 H new ATOM 0 HD2 PRO A 178 0.815 5.850 -17.522 1.00 7.54 H new ATOM 0 HD3 PRO A 178 -0.767 6.072 -16.800 1.00 7.54 H new TER 2747 PRO A 178 HETATM 2748 PB GDP A 179 -8.746 -2.809 16.126 1.00 0.68 P HETATM 2749 O1B GDP A 179 -7.706 -2.348 15.146 1.00 1.61 O HETATM 2750 O2B GDP A 179 -8.395 -4.115 16.829 1.00 1.63 O HETATM 2751 O3B GDP A 179 -10.189 -2.752 15.601 1.00 1.65 O HETATM 2752 O3A GDP A 179 -8.695 -1.673 17.346 1.00 0.68 O HETATM 2753 PA GDP A 179 -9.482 -0.327 17.520 1.00 0.75 P HETATM 2754 O1A GDP A 179 -9.972 -0.155 18.909 1.00 0.87 O HETATM 2755 O2A GDP A 179 -10.466 -0.081 16.401 1.00 0.88 O HETATM 2756 O5' GDP A 179 -8.297 0.731 17.283 1.00 0.69 O HETATM 2757 C5' GDP A 179 -6.999 0.475 17.811 1.00 0.65 C HETATM 2758 C4' GDP A 179 -6.178 1.739 17.870 1.00 0.66 C HETATM 2759 O4' GDP A 179 -5.976 2.252 16.534 1.00 0.63 O HETATM 2760 C3' GDP A 179 -6.799 2.912 18.622 1.00 0.75 C HETATM 2761 O3' GDP A 179 -6.317 2.964 19.960 1.00 0.96 O HETATM 2762 C2' GDP A 179 -6.390 4.160 17.833 1.00 0.75 C HETATM 2763 O2' GDP A 179 -5.584 5.028 18.605 1.00 0.95 O HETATM 2764 C1' GDP A 179 -5.542 3.578 16.697 1.00 0.62 C HETATM 2765 N9 GDP A 179 -5.661 4.285 15.427 1.00 0.55 N HETATM 2766 C8 GDP A 179 -6.329 3.868 14.299 1.00 0.62 C HETATM 2767 N7 GDP A 179 -6.227 4.708 13.302 1.00 0.61 N HETATM 2768 C5 GDP A 179 -5.445 5.738 13.800 1.00 0.49 C HETATM 2769 C6 GDP A 179 -4.992 6.931 13.182 1.00 0.45 C HETATM 2770 O6 GDP A 179 -5.193 7.319 12.021 1.00 0.55 O HETATM 2771 N1 GDP A 179 -4.221 7.703 14.043 1.00 0.37 N HETATM 2772 C2 GDP A 179 -3.922 7.364 15.343 1.00 0.40 C HETATM 2773 N2 GDP A 179 -3.162 8.229 16.033 1.00 0.46 N HETATM 2774 N3 GDP A 179 -4.340 6.253 15.932 1.00 0.45 N HETATM 2775 C4 GDP A 179 -5.089 5.493 15.111 1.00 0.46 C HETATM 0 HO3' GDP A 179 -6.773 3.684 20.444 1.00 0.96 H new HETATM 0 HO2' GDP A 179 -5.394 4.613 19.472 1.00 0.95 H new HETATM 0 HN22 GDP A 179 -2.910 8.027 17.001 1.00 0.46 H new HETATM 0 HN21 GDP A 179 -2.836 9.088 15.590 1.00 0.46 H new HETATM 0 H5'' GDP A 179 -7.087 0.048 18.810 1.00 0.65 H new HETATM 0 HN1 GDP A 179 -3.850 8.584 13.686 1.00 0.37 H new HETATM 0 H8 GDP A 179 -6.886 2.933 14.242 1.00 0.62 H new HETATM 0 H5' GDP A 179 -6.490 -0.264 17.192 1.00 0.65 H new HETATM 0 H4' GDP A 179 -5.276 1.421 18.393 1.00 0.66 H new HETATM 0 H3' GDP A 179 -7.883 2.824 18.695 1.00 0.75 H new HETATM 0 H2' GDP A 179 -7.252 4.744 17.511 1.00 0.75 H new HETATM 0 H1' GDP A 179 -4.491 3.666 16.971 1.00 0.62 H new