USER MOD reduce.3.24.130724 H: found=0, std=0, add=1315, rem=0, adj=49 USER MOD reduce.3.24.130724 removed 1313 hydrogens (52 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 21 ASN :FLIP amide:sc= -2.16 F(o=-10!,f=-6.5) USER MOD Set 1.2: A 110 HIS : no HD1:sc= -4.35! C(o=-6.5!,f=-11!) USER MOD Set 2.1: A 76 TYR OH : rot 30:sc= 0 USER MOD Set 2.2: A 300 ACD O2 : rot 127:sc= -1.26 USER MOD Set 3.1: A 51 TYR OH : rot 180:sc= -0.525 USER MOD Set 3.2: A 64 THR OG1 : rot 117:sc= 1.22 USER MOD Set 4.1: A 31 LYS NZ :NH3+ -150:sc= -1.69! (180deg=-3.25!) USER MOD Set 4.2: A 32 MET CE :methyl 135:sc= -1.38 (180deg=-1.49!) USER MOD Set 5.1: A 20 SER OG : rot 42:sc= 0.63 USER MOD Set 5.2: A 22 THR OG1 : rot 81:sc= -0.408 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -163:sc= -0.021 (180deg=-0.354) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0 USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 29 LYS NZ :NH3+ 148:sc= -5.42! (180deg=-7.07!) USER MOD Single : A 33 LYS NZ :NH3+ 167:sc= -1.39 (180deg=-2.02) USER MOD Single : A 34 MET CE :methyl -134:sc= -3.8! (180deg=-10.4!) USER MOD Single : A 36 MET CE :methyl 179:sc= -0.457 (180deg=-0.465) USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 48 LYS NZ :NH3+ -166:sc= -0.943 (180deg=-1.5) USER MOD Single : A 50 SER OG : rot 180:sc= 0 USER MOD Single : A 55 LYS NZ :NH3+ -146:sc= -1.03 (180deg=-3!) USER MOD Single : A 57 ASN : amide:sc= -0.277 X(o=-0.28,f=0) USER MOD Single : A 61 LYS NZ :NH3+ -140:sc= -0.168 (180deg=-1.76) USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 LYS NZ :NH3+ 143:sc= -2.32 (180deg=-3.51!) USER MOD Single : A 68 LYS NZ :NH3+ 157:sc= -1.37 (180deg=-1.92) USER MOD Single : A 69 THR OG1 : rot 180:sc= -0.292 USER MOD Single : A 70 SER OG : rot 67:sc= 0.927 USER MOD Single : A 77 TYR OH : rot -130:sc= -0.343 USER MOD Single : A 78 SER OG : rot 84:sc= 0.618 USER MOD Single : A 82 LYS NZ :NH3+ 168:sc= -1.49! (180deg=-1.57!) USER MOD Single : A 83 LYS NZ :NH3+ 168:sc= -8.01! (180deg=-8.36!) USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 THR OG1 : rot 180:sc=-0.00696 USER MOD Single : A 92 TYR OH : rot 164:sc= -4.99! USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 SER OG : rot 82:sc= 0.183 USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 TYR OH : rot 180:sc= -0.0249 USER MOD Single : A 101 THR OG1 : rot 180:sc= -0.0962 USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 111 MET CE :methyl 171:sc= -1.08 (180deg=-1.26) USER MOD Single : A 112 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 115 TYR OH : rot -108:sc= -5.32! USER MOD Single : A 116 SER OG : rot -148:sc= 1.98 USER MOD Single : A 118 SER OG : rot 180:sc= -0.561 USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 126 THR OG1 : rot 180:sc= -1.58 USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 ASN : amide:sc= -0.24 X(o=-0.24,f=0) USER MOD Single : A 138 TYR OH : rot 80:sc= 0.532 USER MOD Single : A 139 THR OG1 : rot 180:sc= 0 USER MOD Single : A 142 MET CE :methyl -133:sc= -0.745 (180deg=-4.59!) USER MOD Single : A 145 MET CE :methyl -175:sc= -0.461 (180deg=-0.488) USER MOD Single : A 149 GLN : amide:sc= -0.438 K(o=-0.44,f=-1.9!) USER MOD Single : A 153 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 5.711 21.378 -21.801 1.00 0.00 N ATOM 2 CA MET A 1 4.966 20.367 -22.603 1.00 52.33 C ATOM 3 C MET A 1 3.511 20.330 -22.144 1.00 72.55 C ATOM 4 O MET A 1 2.696 21.149 -22.569 1.00 2.15 O ATOM 5 CB MET A 1 5.609 18.992 -22.411 1.00 33.13 C ATOM 6 CG MET A 1 7.023 19.003 -22.993 1.00 24.32 C ATOM 7 SD MET A 1 7.734 17.343 -22.885 1.00 65.04 S ATOM 8 CE MET A 1 9.444 17.802 -23.256 1.00 21.43 C ATOM 0 H1 MET A 1 6.601 21.616 -22.283 1.00 0.00 H new ATOM 0 H2 MET A 1 5.132 22.236 -21.700 1.00 0.00 H new ATOM 0 H3 MET A 1 5.920 20.989 -20.860 1.00 0.00 H new ATOM 0 HA MET A 1 5.002 20.635 -23.659 1.00 52.33 H new ATOM 0 HB2 MET A 1 5.643 18.740 -21.351 1.00 33.13 H new ATOM 0 HB3 MET A 1 5.008 18.226 -22.902 1.00 33.13 H new ATOM 0 HG2 MET A 1 6.997 19.332 -24.032 1.00 24.32 H new ATOM 0 HG3 MET A 1 7.646 19.713 -22.449 1.00 24.32 H new ATOM 0 HE1 MET A 1 10.071 16.911 -23.242 1.00 21.43 H new ATOM 0 HE2 MET A 1 9.491 18.263 -24.242 1.00 21.43 H new ATOM 0 HE3 MET A 1 9.802 18.509 -22.507 1.00 21.43 H new ATOM 20 N THR A 2 3.194 19.375 -21.276 1.00 53.23 N ATOM 21 CA THR A 2 1.834 19.241 -20.767 1.00 10.40 C ATOM 22 C THR A 2 1.515 20.367 -19.788 1.00 24.00 C ATOM 23 O THR A 2 2.372 20.791 -19.013 1.00 54.11 O ATOM 24 CB THR A 2 1.671 17.889 -20.065 1.00 53.33 C ATOM 25 OG1 THR A 2 2.093 16.851 -20.938 1.00 24.30 O ATOM 26 CG2 THR A 2 0.203 17.680 -19.693 1.00 71.25 C ATOM 0 H THR A 2 3.854 18.688 -20.913 1.00 53.23 H new ATOM 0 HA THR A 2 1.143 19.300 -21.608 1.00 10.40 H new ATOM 0 HB THR A 2 2.278 17.873 -19.160 1.00 53.33 H new ATOM 0 HG1 THR A 2 1.991 15.985 -20.490 1.00 24.30 H new ATOM 0 HG21 THR A 2 0.088 16.718 -19.194 1.00 71.25 H new ATOM 0 HG22 THR A 2 -0.120 18.477 -19.024 1.00 71.25 H new ATOM 0 HG23 THR A 2 -0.407 17.695 -20.596 1.00 71.25 H new ATOM 34 N VAL A 3 0.276 20.847 -19.831 1.00 33.43 N ATOM 35 CA VAL A 3 -0.146 21.924 -18.944 1.00 44.34 C ATOM 36 C VAL A 3 0.242 21.604 -17.494 1.00 22.34 C ATOM 37 O VAL A 3 -0.009 20.496 -17.021 1.00 54.24 O ATOM 38 CB VAL A 3 -1.664 22.105 -19.042 1.00 2.41 C ATOM 39 CG1 VAL A 3 -2.367 20.886 -18.440 1.00 10.21 C ATOM 40 CG2 VAL A 3 -2.082 23.363 -18.276 1.00 52.20 C ATOM 0 H VAL A 3 -0.448 20.510 -20.466 1.00 33.43 H new ATOM 0 HA VAL A 3 0.352 22.845 -19.246 1.00 44.34 H new ATOM 0 HB VAL A 3 -1.947 22.207 -20.090 1.00 2.41 H new ATOM 0 HG11 VAL A 3 -3.447 21.017 -18.511 1.00 10.21 H new ATOM 0 HG12 VAL A 3 -2.074 19.990 -18.987 1.00 10.21 H new ATOM 0 HG13 VAL A 3 -2.082 20.782 -17.393 1.00 10.21 H new ATOM 0 HG21 VAL A 3 -3.162 23.490 -18.347 1.00 52.20 H new ATOM 0 HG22 VAL A 3 -1.796 23.263 -17.229 1.00 52.20 H new ATOM 0 HG23 VAL A 3 -1.585 24.233 -18.706 1.00 52.20 H new ATOM 50 N PRO A 4 0.841 22.532 -16.778 1.00 33.23 N ATOM 51 CA PRO A 4 1.247 22.302 -15.363 1.00 50.24 C ATOM 52 C PRO A 4 0.207 21.496 -14.586 1.00 72.31 C ATOM 53 O PRO A 4 -0.995 21.738 -14.703 1.00 41.02 O ATOM 54 CB PRO A 4 1.378 23.719 -14.802 1.00 23.44 C ATOM 55 CG PRO A 4 1.787 24.561 -15.969 1.00 63.04 C ATOM 56 CD PRO A 4 1.199 23.894 -17.224 1.00 1.02 C ATOM 0 HA PRO A 4 2.164 21.717 -15.284 1.00 50.24 H new ATOM 0 HB2 PRO A 4 0.435 24.064 -14.377 1.00 23.44 H new ATOM 0 HB3 PRO A 4 2.121 23.761 -14.005 1.00 23.44 H new ATOM 0 HG2 PRO A 4 1.413 25.579 -15.861 1.00 63.04 H new ATOM 0 HG3 PRO A 4 2.873 24.625 -16.038 1.00 63.04 H new ATOM 0 HD2 PRO A 4 0.327 24.435 -17.591 1.00 1.02 H new ATOM 0 HD3 PRO A 4 1.924 23.869 -18.038 1.00 1.02 H new ATOM 64 N ASP A 5 0.679 20.539 -13.793 1.00 54.52 N ATOM 65 CA ASP A 5 -0.217 19.704 -13.001 1.00 62.11 C ATOM 66 C ASP A 5 0.582 18.753 -12.114 1.00 24.51 C ATOM 67 O ASP A 5 0.386 18.709 -10.899 1.00 24.13 O ATOM 68 CB ASP A 5 -1.133 18.898 -13.922 1.00 62.43 C ATOM 69 CG ASP A 5 -0.307 18.186 -14.988 1.00 24.33 C ATOM 70 OD1 ASP A 5 0.853 18.534 -15.140 1.00 25.41 O ATOM 71 OD2 ASP A 5 -0.847 17.305 -15.637 1.00 64.54 O ATOM 0 H ASP A 5 1.670 20.323 -13.682 1.00 54.52 H new ATOM 0 HA ASP A 5 -0.822 20.353 -12.367 1.00 62.11 H new ATOM 0 HB2 ASP A 5 -1.697 18.169 -13.340 1.00 62.43 H new ATOM 0 HB3 ASP A 5 -1.860 19.559 -14.395 1.00 62.43 H new ATOM 76 N ARG A 6 1.483 17.995 -12.730 1.00 51.20 N ATOM 77 CA ARG A 6 2.307 17.048 -11.987 1.00 61.22 C ATOM 78 C ARG A 6 3.223 17.782 -11.014 1.00 53.24 C ATOM 79 O ARG A 6 3.413 17.353 -9.876 1.00 0.33 O ATOM 80 CB ARG A 6 3.152 16.222 -12.960 1.00 31.54 C ATOM 81 CG ARG A 6 2.234 15.459 -13.916 1.00 2.44 C ATOM 82 CD ARG A 6 3.079 14.658 -14.907 1.00 34.54 C ATOM 83 NE ARG A 6 4.052 15.527 -15.559 1.00 71.40 N ATOM 84 CZ ARG A 6 4.811 15.083 -16.556 1.00 61.22 C ATOM 85 NH1 ARG A 6 4.691 13.851 -16.968 1.00 0.53 N ATOM 86 NH2 ARG A 6 5.674 15.880 -17.123 1.00 4.30 N ATOM 0 H ARG A 6 1.661 18.017 -13.734 1.00 51.20 H new ATOM 0 HA ARG A 6 1.650 16.388 -11.421 1.00 61.22 H new ATOM 0 HB2 ARG A 6 3.819 16.875 -13.523 1.00 31.54 H new ATOM 0 HB3 ARG A 6 3.781 15.523 -12.409 1.00 31.54 H new ATOM 0 HG2 ARG A 6 1.582 14.790 -13.354 1.00 2.44 H new ATOM 0 HG3 ARG A 6 1.590 16.156 -14.452 1.00 2.44 H new ATOM 0 HD2 ARG A 6 3.594 13.850 -14.387 1.00 34.54 H new ATOM 0 HD3 ARG A 6 2.435 14.196 -15.655 1.00 34.54 H new ATOM 0 HE ARG A 6 4.152 16.492 -15.245 1.00 71.40 H new ATOM 0 HH11 ARG A 6 4.015 13.229 -16.525 1.00 0.53 H new ATOM 0 HH12 ARG A 6 5.273 13.510 -17.733 1.00 0.53 H new ATOM 0 HH21 ARG A 6 5.766 16.844 -16.801 1.00 4.30 H new ATOM 0 HH22 ARG A 6 6.257 15.540 -17.888 1.00 4.30 H new ATOM 100 N SER A 7 3.789 18.891 -11.475 1.00 33.12 N ATOM 101 CA SER A 7 4.689 19.688 -10.647 1.00 73.44 C ATOM 102 C SER A 7 3.936 20.339 -9.491 1.00 23.32 C ATOM 103 O SER A 7 4.504 20.575 -8.424 1.00 74.32 O ATOM 104 CB SER A 7 5.355 20.769 -11.497 1.00 20.22 C ATOM 105 OG SER A 7 4.375 21.719 -11.899 1.00 0.43 O ATOM 0 H SER A 7 3.642 19.259 -12.415 1.00 33.12 H new ATOM 0 HA SER A 7 5.449 19.025 -10.235 1.00 73.44 H new ATOM 0 HB2 SER A 7 6.144 21.261 -10.928 1.00 20.22 H new ATOM 0 HB3 SER A 7 5.825 20.321 -12.373 1.00 20.22 H new ATOM 0 HG SER A 7 4.798 22.415 -12.443 1.00 0.43 H new ATOM 111 N GLU A 8 2.665 20.648 -9.717 1.00 52.21 N ATOM 112 CA GLU A 8 1.852 21.297 -8.692 1.00 63.21 C ATOM 113 C GLU A 8 1.773 20.451 -7.422 1.00 54.05 C ATOM 114 O GLU A 8 2.009 20.955 -6.324 1.00 53.03 O ATOM 115 CB GLU A 8 0.441 21.544 -9.226 1.00 5.41 C ATOM 116 CG GLU A 8 0.503 22.522 -10.402 1.00 55.14 C ATOM 117 CD GLU A 8 -0.906 22.830 -10.898 1.00 1.44 C ATOM 118 OE1 GLU A 8 -1.829 22.179 -10.439 1.00 60.21 O ATOM 119 OE2 GLU A 8 -1.040 23.713 -11.729 1.00 31.32 O ATOM 0 H GLU A 8 2.177 20.462 -10.593 1.00 52.21 H new ATOM 0 HA GLU A 8 2.326 22.246 -8.442 1.00 63.21 H new ATOM 0 HB2 GLU A 8 -0.008 20.603 -9.545 1.00 5.41 H new ATOM 0 HB3 GLU A 8 -0.192 21.948 -8.436 1.00 5.41 H new ATOM 0 HG2 GLU A 8 0.999 23.443 -10.094 1.00 55.14 H new ATOM 0 HG3 GLU A 8 1.097 22.095 -11.210 1.00 55.14 H new ATOM 126 N ILE A 9 1.439 19.171 -7.566 1.00 21.51 N ATOM 127 CA ILE A 9 1.335 18.292 -6.401 1.00 20.35 C ATOM 128 C ILE A 9 2.672 17.636 -6.087 1.00 42.42 C ATOM 129 O ILE A 9 3.019 17.444 -4.921 1.00 3.11 O ATOM 130 CB ILE A 9 0.288 17.199 -6.637 1.00 32.33 C ATOM 131 CG1 ILE A 9 0.014 16.479 -5.310 1.00 13.11 C ATOM 132 CG2 ILE A 9 0.815 16.193 -7.665 1.00 52.32 C ATOM 133 CD1 ILE A 9 -0.995 15.341 -5.517 1.00 74.22 C ATOM 0 H ILE A 9 1.239 18.724 -8.461 1.00 21.51 H new ATOM 0 HA ILE A 9 1.033 18.910 -5.556 1.00 20.35 H new ATOM 0 HB ILE A 9 -0.632 17.646 -7.014 1.00 32.33 H new ATOM 0 HG12 ILE A 9 0.945 16.080 -4.907 1.00 13.11 H new ATOM 0 HG13 ILE A 9 -0.373 17.188 -4.578 1.00 13.11 H new ATOM 0 HG21 ILE A 9 0.068 15.417 -7.831 1.00 52.32 H new ATOM 0 HG22 ILE A 9 1.019 16.706 -8.605 1.00 52.32 H new ATOM 0 HG23 ILE A 9 1.733 15.739 -7.292 1.00 52.32 H new ATOM 0 HD11 ILE A 9 -1.179 14.840 -4.566 1.00 74.22 H new ATOM 0 HD12 ILE A 9 -1.931 15.749 -5.899 1.00 74.22 H new ATOM 0 HD13 ILE A 9 -0.593 14.624 -6.233 1.00 74.22 H new ATOM 145 N ALA A 10 3.411 17.279 -7.128 1.00 72.40 N ATOM 146 CA ALA A 10 4.693 16.629 -6.918 1.00 60.00 C ATOM 147 C ALA A 10 5.564 17.487 -6.022 1.00 70.33 C ATOM 148 O ALA A 10 5.623 18.707 -6.175 1.00 13.24 O ATOM 149 CB ALA A 10 5.397 16.325 -8.242 1.00 32.45 C ATOM 0 H ALA A 10 3.152 17.425 -8.104 1.00 72.40 H new ATOM 0 HA ALA A 10 4.514 15.673 -6.426 1.00 60.00 H new ATOM 0 HB1 ALA A 10 6.352 15.839 -8.043 1.00 32.45 H new ATOM 0 HB2 ALA A 10 4.772 15.664 -8.843 1.00 32.45 H new ATOM 0 HB3 ALA A 10 5.569 17.255 -8.785 1.00 32.45 H new ATOM 155 N GLY A 11 6.221 16.842 -5.063 1.00 0.21 N ATOM 156 CA GLY A 11 7.069 17.540 -4.109 1.00 53.25 C ATOM 157 C GLY A 11 6.463 17.426 -2.714 1.00 72.23 C ATOM 158 O GLY A 11 7.185 17.363 -1.719 1.00 35.34 O ATOM 0 H GLY A 11 6.180 15.832 -4.928 1.00 0.21 H new ATOM 0 HA2 GLY A 11 8.072 17.114 -4.118 1.00 53.25 H new ATOM 0 HA3 GLY A 11 7.166 18.588 -4.391 1.00 53.25 H new ATOM 162 N LYS A 12 5.128 17.380 -2.656 1.00 11.13 N ATOM 163 CA LYS A 12 4.424 17.258 -1.378 1.00 24.45 C ATOM 164 C LYS A 12 2.982 16.775 -1.576 1.00 62.22 C ATOM 165 O LYS A 12 2.130 17.532 -2.040 1.00 50.53 O ATOM 166 CB LYS A 12 4.384 18.617 -0.663 1.00 62.54 C ATOM 167 CG LYS A 12 5.783 19.010 -0.173 1.00 74.44 C ATOM 168 CD LYS A 12 5.663 20.114 0.881 1.00 24.43 C ATOM 169 CE LYS A 12 7.054 20.657 1.211 1.00 21.21 C ATOM 170 NZ LYS A 12 6.972 21.534 2.415 1.00 70.44 N ATOM 0 H LYS A 12 4.519 17.425 -3.473 1.00 11.13 H new ATOM 0 HA LYS A 12 4.967 16.528 -0.778 1.00 24.45 H new ATOM 0 HB2 LYS A 12 4.003 19.380 -1.342 1.00 62.54 H new ATOM 0 HB3 LYS A 12 3.697 18.570 0.182 1.00 62.54 H new ATOM 0 HG2 LYS A 12 6.289 18.142 0.250 1.00 74.44 H new ATOM 0 HG3 LYS A 12 6.389 19.356 -1.010 1.00 74.44 H new ATOM 0 HD2 LYS A 12 5.026 20.917 0.511 1.00 24.43 H new ATOM 0 HD3 LYS A 12 5.191 19.722 1.782 1.00 24.43 H new ATOM 0 HE2 LYS A 12 7.744 19.833 1.394 1.00 21.21 H new ATOM 0 HE3 LYS A 12 7.447 21.219 0.364 1.00 21.21 H new ATOM 0 HZ1 LYS A 12 7.918 21.904 2.640 1.00 70.44 H new ATOM 0 HZ2 LYS A 12 6.327 22.327 2.224 1.00 70.44 H new ATOM 0 HZ3 LYS A 12 6.614 20.984 3.222 1.00 70.44 H new ATOM 184 N TRP A 13 2.697 15.530 -1.176 1.00 11.35 N ATOM 185 CA TRP A 13 1.336 14.989 -1.269 1.00 74.30 C ATOM 186 C TRP A 13 0.833 14.789 0.158 1.00 52.15 C ATOM 187 O TRP A 13 1.530 14.187 0.976 1.00 4.13 O ATOM 188 CB TRP A 13 1.372 13.620 -1.981 1.00 12.43 C ATOM 189 CG TRP A 13 1.676 13.771 -3.415 1.00 2.51 C ATOM 190 CD1 TRP A 13 2.715 14.450 -3.930 1.00 41.34 C ATOM 191 CD2 TRP A 13 0.950 13.201 -4.537 1.00 41.43 C ATOM 192 NE1 TRP A 13 2.679 14.318 -5.294 1.00 64.01 N ATOM 193 CE2 TRP A 13 1.625 13.545 -5.712 1.00 20.04 C ATOM 194 CE3 TRP A 13 -0.207 12.411 -4.644 1.00 63.42 C ATOM 195 CZ2 TRP A 13 1.193 13.123 -6.960 1.00 74.32 C ATOM 196 CZ3 TRP A 13 -0.663 11.988 -5.905 1.00 60.42 C ATOM 197 CH2 TRP A 13 0.043 12.337 -7.063 1.00 3.11 C ATOM 0 H TRP A 13 3.384 14.883 -0.788 1.00 11.35 H new ATOM 0 HA TRP A 13 0.689 15.665 -1.828 1.00 74.30 H new ATOM 0 HB2 TRP A 13 2.123 12.984 -1.513 1.00 12.43 H new ATOM 0 HB3 TRP A 13 0.411 13.120 -1.861 1.00 12.43 H new ATOM 0 HD1 TRP A 13 3.451 15.004 -3.367 1.00 41.34 H new ATOM 0 HE1 TRP A 13 3.357 14.745 -5.925 1.00 64.01 H new ATOM 0 HE3 TRP A 13 -0.749 12.127 -3.754 1.00 63.42 H new ATOM 0 HZ2 TRP A 13 1.743 13.400 -7.847 1.00 74.32 H new ATOM 0 HZ3 TRP A 13 -1.561 11.392 -5.981 1.00 60.42 H new ATOM 0 HH2 TRP A 13 -0.300 12.000 -8.030 1.00 3.11 H new ATOM 208 N TYR A 14 -0.337 15.328 0.483 1.00 5.14 N ATOM 209 CA TYR A 14 -0.856 15.231 1.850 1.00 44.20 C ATOM 210 C TYR A 14 -1.916 14.137 1.981 1.00 43.20 C ATOM 211 O TYR A 14 -2.872 14.104 1.218 1.00 10.22 O ATOM 212 CB TYR A 14 -1.477 16.595 2.234 1.00 70.40 C ATOM 213 CG TYR A 14 -0.727 17.238 3.380 1.00 64.34 C ATOM 214 CD1 TYR A 14 -0.505 16.521 4.555 1.00 4.22 C ATOM 215 CD2 TYR A 14 -0.268 18.556 3.269 1.00 51.41 C ATOM 216 CE1 TYR A 14 0.178 17.116 5.622 1.00 14.02 C ATOM 217 CE2 TYR A 14 0.412 19.151 4.334 1.00 32.44 C ATOM 218 CZ TYR A 14 0.637 18.431 5.512 1.00 30.22 C ATOM 219 OH TYR A 14 1.309 19.019 6.565 1.00 54.24 O ATOM 0 H TYR A 14 -0.940 15.831 -0.168 1.00 5.14 H new ATOM 0 HA TYR A 14 -0.033 14.973 2.516 1.00 44.20 H new ATOM 0 HB2 TYR A 14 -1.464 17.259 1.370 1.00 70.40 H new ATOM 0 HB3 TYR A 14 -2.521 16.456 2.513 1.00 70.40 H new ATOM 0 HD1 TYR A 14 -0.861 15.505 4.642 1.00 4.22 H new ATOM 0 HD2 TYR A 14 -0.440 19.113 2.360 1.00 51.41 H new ATOM 0 HE1 TYR A 14 0.350 16.558 6.531 1.00 14.02 H new ATOM 0 HE2 TYR A 14 0.765 20.168 4.248 1.00 32.44 H new ATOM 0 HH TYR A 14 1.560 19.935 6.323 1.00 54.24 H new ATOM 229 N VAL A 15 -1.745 13.260 2.971 1.00 4.53 N ATOM 230 CA VAL A 15 -2.701 12.177 3.225 1.00 71.33 C ATOM 231 C VAL A 15 -3.516 12.508 4.477 1.00 53.32 C ATOM 232 O VAL A 15 -2.946 12.672 5.555 1.00 20.53 O ATOM 233 CB VAL A 15 -1.939 10.863 3.444 1.00 53.40 C ATOM 234 CG1 VAL A 15 -2.874 9.794 4.020 1.00 74.51 C ATOM 235 CG2 VAL A 15 -1.370 10.373 2.112 1.00 64.10 C ATOM 0 H VAL A 15 -0.952 13.277 3.612 1.00 4.53 H new ATOM 0 HA VAL A 15 -3.369 12.070 2.370 1.00 71.33 H new ATOM 0 HB VAL A 15 -1.127 11.042 4.149 1.00 53.40 H new ATOM 0 HG11 VAL A 15 -2.319 8.868 4.170 1.00 74.51 H new ATOM 0 HG12 VAL A 15 -3.273 10.136 4.975 1.00 74.51 H new ATOM 0 HG13 VAL A 15 -3.695 9.617 3.326 1.00 74.51 H new ATOM 0 HG21 VAL A 15 -0.829 9.440 2.269 1.00 64.10 H new ATOM 0 HG22 VAL A 15 -2.185 10.206 1.408 1.00 64.10 H new ATOM 0 HG23 VAL A 15 -0.690 11.123 1.709 1.00 64.10 H new ATOM 245 N VAL A 16 -4.845 12.617 4.340 1.00 25.41 N ATOM 246 CA VAL A 16 -5.690 12.946 5.496 1.00 3.42 C ATOM 247 C VAL A 16 -6.707 11.859 5.809 1.00 0.22 C ATOM 248 O VAL A 16 -7.132 11.730 6.950 1.00 73.32 O ATOM 249 CB VAL A 16 -6.445 14.250 5.274 1.00 22.02 C ATOM 250 CG1 VAL A 16 -5.490 15.300 4.716 1.00 51.45 C ATOM 251 CG2 VAL A 16 -7.596 14.037 4.280 1.00 14.31 C ATOM 0 H VAL A 16 -5.348 12.486 3.463 1.00 25.41 H new ATOM 0 HA VAL A 16 -5.006 13.042 6.339 1.00 3.42 H new ATOM 0 HB VAL A 16 -6.854 14.587 6.227 1.00 22.02 H new ATOM 0 HG11 VAL A 16 -6.029 16.234 4.557 1.00 51.45 H new ATOM 0 HG12 VAL A 16 -4.678 15.466 5.424 1.00 51.45 H new ATOM 0 HG13 VAL A 16 -5.080 14.952 3.768 1.00 51.45 H new ATOM 0 HG21 VAL A 16 -8.127 14.977 4.131 1.00 14.31 H new ATOM 0 HG22 VAL A 16 -7.195 13.692 3.327 1.00 14.31 H new ATOM 0 HG23 VAL A 16 -8.285 13.290 4.675 1.00 14.31 H new ATOM 261 N ALA A 17 -7.118 11.091 4.810 1.00 23.12 N ATOM 262 CA ALA A 17 -8.104 10.040 5.054 1.00 1.31 C ATOM 263 C ALA A 17 -7.563 8.687 4.647 1.00 43.24 C ATOM 264 O ALA A 17 -6.572 8.582 3.923 1.00 62.14 O ATOM 265 CB ALA A 17 -9.404 10.324 4.296 1.00 64.12 C ATOM 0 H ALA A 17 -6.796 11.169 3.845 1.00 23.12 H new ATOM 0 HA ALA A 17 -8.315 10.028 6.123 1.00 1.31 H new ATOM 0 HB1 ALA A 17 -10.122 9.528 4.494 1.00 64.12 H new ATOM 0 HB2 ALA A 17 -9.818 11.276 4.628 1.00 64.12 H new ATOM 0 HB3 ALA A 17 -9.199 10.370 3.226 1.00 64.12 H new ATOM 271 N LEU A 18 -8.263 7.662 5.094 1.00 31.44 N ATOM 272 CA LEU A 18 -7.902 6.295 4.769 1.00 1.30 C ATOM 273 C LEU A 18 -9.129 5.400 4.849 1.00 42.24 C ATOM 274 O LEU A 18 -10.066 5.672 5.601 1.00 2.25 O ATOM 275 CB LEU A 18 -6.810 5.792 5.722 1.00 74.04 C ATOM 276 CG LEU A 18 -6.480 4.309 5.421 1.00 52.40 C ATOM 277 CD1 LEU A 18 -4.963 4.081 5.474 1.00 43.23 C ATOM 278 CD2 LEU A 18 -7.165 3.404 6.454 1.00 35.25 C ATOM 0 H LEU A 18 -9.089 7.751 5.686 1.00 31.44 H new ATOM 0 HA LEU A 18 -7.512 6.266 3.751 1.00 1.30 H new ATOM 0 HB2 LEU A 18 -5.913 6.401 5.613 1.00 74.04 H new ATOM 0 HB3 LEU A 18 -7.142 5.896 6.755 1.00 74.04 H new ATOM 0 HG LEU A 18 -6.844 4.066 4.423 1.00 52.40 H new ATOM 0 HD11 LEU A 18 -4.745 3.035 5.261 1.00 43.23 H new ATOM 0 HD12 LEU A 18 -4.474 4.712 4.732 1.00 43.23 H new ATOM 0 HD13 LEU A 18 -4.592 4.334 6.467 1.00 43.23 H new ATOM 0 HD21 LEU A 18 -6.930 2.362 6.238 1.00 35.25 H new ATOM 0 HD22 LEU A 18 -6.808 3.657 7.453 1.00 35.25 H new ATOM 0 HD23 LEU A 18 -8.244 3.550 6.406 1.00 35.25 H new ATOM 290 N ALA A 19 -9.101 4.325 4.082 1.00 24.41 N ATOM 291 CA ALA A 19 -10.191 3.367 4.067 1.00 63.42 C ATOM 292 C ALA A 19 -9.615 1.981 3.849 1.00 63.33 C ATOM 293 O ALA A 19 -8.623 1.824 3.144 1.00 42.42 O ATOM 294 CB ALA A 19 -11.189 3.708 2.952 1.00 14.53 C ATOM 0 H ALA A 19 -8.329 4.093 3.457 1.00 24.41 H new ATOM 0 HA ALA A 19 -10.723 3.402 5.018 1.00 63.42 H new ATOM 0 HB1 ALA A 19 -12.000 2.980 2.955 1.00 14.53 H new ATOM 0 HB2 ALA A 19 -11.596 4.705 3.120 1.00 14.53 H new ATOM 0 HB3 ALA A 19 -10.681 3.682 1.988 1.00 14.53 H new ATOM 300 N SER A 20 -10.220 0.983 4.464 1.00 0.51 N ATOM 301 CA SER A 20 -9.717 -0.377 4.317 1.00 4.42 C ATOM 302 C SER A 20 -10.716 -1.395 4.831 1.00 32.13 C ATOM 303 O SER A 20 -11.772 -1.045 5.354 1.00 33.34 O ATOM 304 CB SER A 20 -8.402 -0.528 5.081 1.00 3.13 C ATOM 305 OG SER A 20 -7.803 -1.771 4.741 1.00 70.42 O ATOM 0 H SER A 20 -11.043 1.079 5.059 1.00 0.51 H new ATOM 0 HA SER A 20 -9.555 -0.561 3.255 1.00 4.42 H new ATOM 0 HB2 SER A 20 -7.729 0.293 4.835 1.00 3.13 H new ATOM 0 HB3 SER A 20 -8.584 -0.480 6.155 1.00 3.13 H new ATOM 0 HG SER A 20 -7.887 -1.921 3.776 1.00 70.42 H new ATOM 311 N ASN A 21 -10.346 -2.660 4.710 1.00 0.42 N ATOM 312 CA ASN A 21 -11.178 -3.752 5.194 1.00 41.14 C ATOM 313 C ASN A 21 -10.509 -4.358 6.401 1.00 45.11 C ATOM 314 O ASN A 21 -11.095 -5.158 7.130 1.00 13.02 O ATOM 315 CB ASN A 21 -11.366 -4.808 4.104 1.00 20.01 C ATOM 316 CG ASN A 21 -12.367 -4.310 3.066 1.00 34.54 C ATOM 317 OD1 ASN A 21 -11.954 -3.561 2.081 1.00 64.24 O flip ATOM 318 ND2 ASN A 21 -13.558 -4.612 3.157 1.00 21.31 N flip ATOM 0 H ASN A 21 -9.471 -2.958 4.279 1.00 0.42 H new ATOM 0 HA ASN A 21 -12.164 -3.374 5.464 1.00 41.14 H new ATOM 0 HB2 ASN A 21 -10.410 -5.024 3.626 1.00 20.01 H new ATOM 0 HB3 ASN A 21 -11.720 -5.740 4.545 1.00 20.01 H new ATOM 0 HD21 ASN A 21 -13.878 -5.198 3.928 1.00 21.31 H new ATOM 0 HD22 ASN A 21 -14.224 -4.276 2.461 1.00 21.31 H new ATOM 325 N THR A 22 -9.270 -3.944 6.610 1.00 44.35 N ATOM 326 CA THR A 22 -8.499 -4.416 7.734 1.00 1.21 C ATOM 327 C THR A 22 -8.919 -3.664 8.994 1.00 74.35 C ATOM 328 O THR A 22 -8.471 -2.543 9.236 1.00 43.53 O ATOM 329 CB THR A 22 -7.007 -4.193 7.456 1.00 12.11 C ATOM 330 OG1 THR A 22 -6.793 -4.158 6.053 1.00 20.14 O ATOM 331 CG2 THR A 22 -6.198 -5.333 8.064 1.00 42.02 C ATOM 0 H THR A 22 -8.781 -3.280 6.010 1.00 44.35 H new ATOM 0 HA THR A 22 -8.679 -5.481 7.883 1.00 1.21 H new ATOM 0 HB THR A 22 -6.691 -3.249 7.900 1.00 12.11 H new ATOM 0 HG1 THR A 22 -7.014 -3.267 5.711 1.00 20.14 H new ATOM 0 HG21 THR A 22 -5.138 -5.173 7.866 1.00 42.02 H new ATOM 0 HG22 THR A 22 -6.365 -5.364 9.141 1.00 42.02 H new ATOM 0 HG23 THR A 22 -6.512 -6.278 7.621 1.00 42.02 H new ATOM 339 N GLU A 23 -9.795 -4.275 9.785 1.00 74.11 N ATOM 340 CA GLU A 23 -10.277 -3.632 11.003 1.00 5.13 C ATOM 341 C GLU A 23 -9.119 -2.969 11.735 1.00 54.41 C ATOM 342 O GLU A 23 -9.291 -1.964 12.423 1.00 64.23 O ATOM 343 CB GLU A 23 -10.936 -4.667 11.917 1.00 61.01 C ATOM 344 CG GLU A 23 -12.200 -5.211 11.246 1.00 70.33 C ATOM 345 CD GLU A 23 -12.921 -6.167 12.191 1.00 42.41 C ATOM 346 OE1 GLU A 23 -12.367 -6.465 13.237 1.00 34.10 O ATOM 347 OE2 GLU A 23 -14.015 -6.588 11.855 1.00 32.22 O ATOM 0 H GLU A 23 -10.182 -5.202 9.609 1.00 74.11 H new ATOM 0 HA GLU A 23 -11.012 -2.874 10.732 1.00 5.13 H new ATOM 0 HB2 GLU A 23 -10.241 -5.481 12.122 1.00 61.01 H new ATOM 0 HB3 GLU A 23 -11.187 -4.213 12.876 1.00 61.01 H new ATOM 0 HG2 GLU A 23 -12.861 -4.388 10.974 1.00 70.33 H new ATOM 0 HG3 GLU A 23 -11.938 -5.728 10.323 1.00 70.33 H new ATOM 354 N PHE A 24 -7.941 -3.553 11.581 1.00 24.12 N ATOM 355 CA PHE A 24 -6.742 -3.040 12.222 1.00 32.22 C ATOM 356 C PHE A 24 -6.423 -1.602 11.779 1.00 52.03 C ATOM 357 O PHE A 24 -6.104 -0.756 12.615 1.00 74.33 O ATOM 358 CB PHE A 24 -5.568 -3.986 11.895 1.00 73.33 C ATOM 359 CG PHE A 24 -4.259 -3.231 11.849 1.00 63.21 C ATOM 360 CD1 PHE A 24 -3.883 -2.562 10.680 1.00 62.14 C ATOM 361 CD2 PHE A 24 -3.426 -3.203 12.972 1.00 74.51 C ATOM 362 CE1 PHE A 24 -2.672 -1.865 10.630 1.00 43.44 C ATOM 363 CE2 PHE A 24 -2.214 -2.506 12.925 1.00 60.14 C ATOM 364 CZ PHE A 24 -1.836 -1.837 11.754 1.00 60.30 C ATOM 0 H PHE A 24 -7.790 -4.387 11.014 1.00 24.12 H new ATOM 0 HA PHE A 24 -6.906 -3.004 13.299 1.00 32.22 H new ATOM 0 HB2 PHE A 24 -5.511 -4.774 12.646 1.00 73.33 H new ATOM 0 HB3 PHE A 24 -5.745 -4.473 10.936 1.00 73.33 H new ATOM 0 HD1 PHE A 24 -4.529 -2.584 9.815 1.00 62.14 H new ATOM 0 HD2 PHE A 24 -3.718 -3.719 13.875 1.00 74.51 H new ATOM 0 HE1 PHE A 24 -2.382 -1.349 9.727 1.00 43.44 H new ATOM 0 HE2 PHE A 24 -1.570 -2.484 13.792 1.00 60.14 H new ATOM 0 HZ PHE A 24 -0.900 -1.299 11.717 1.00 60.30 H new ATOM 374 N PHE A 25 -6.463 -1.330 10.471 1.00 42.42 N ATOM 375 CA PHE A 25 -6.123 0.006 9.965 1.00 21.15 C ATOM 376 C PHE A 25 -7.146 1.075 10.370 1.00 75.20 C ATOM 377 O PHE A 25 -6.765 2.150 10.829 1.00 52.44 O ATOM 378 CB PHE A 25 -6.004 -0.043 8.425 1.00 4.10 C ATOM 379 CG PHE A 25 -4.662 0.500 7.971 1.00 60.03 C ATOM 380 CD1 PHE A 25 -4.172 1.703 8.495 1.00 52.25 C ATOM 381 CD2 PHE A 25 -3.911 -0.202 7.019 1.00 21.21 C ATOM 382 CE1 PHE A 25 -2.934 2.202 8.069 1.00 0.24 C ATOM 383 CE2 PHE A 25 -2.675 0.297 6.595 1.00 70.01 C ATOM 384 CZ PHE A 25 -2.186 1.498 7.119 1.00 14.41 C ATOM 0 H PHE A 25 -6.723 -2.005 9.752 1.00 42.42 H new ATOM 0 HA PHE A 25 -5.171 0.289 10.415 1.00 21.15 H new ATOM 0 HB2 PHE A 25 -6.122 -1.070 8.079 1.00 4.10 H new ATOM 0 HB3 PHE A 25 -6.808 0.539 7.975 1.00 4.10 H new ATOM 0 HD1 PHE A 25 -4.749 2.247 9.228 1.00 52.25 H new ATOM 0 HD2 PHE A 25 -4.287 -1.129 6.612 1.00 21.21 H new ATOM 0 HE1 PHE A 25 -2.557 3.130 8.474 1.00 0.24 H new ATOM 0 HE2 PHE A 25 -2.097 -0.246 5.862 1.00 70.01 H new ATOM 0 HZ PHE A 25 -1.231 1.882 6.790 1.00 14.41 H new ATOM 394 N LEU A 26 -8.434 0.785 10.214 1.00 12.43 N ATOM 395 CA LEU A 26 -9.457 1.761 10.593 1.00 34.53 C ATOM 396 C LEU A 26 -9.383 1.989 12.096 1.00 2.45 C ATOM 397 O LEU A 26 -9.667 3.075 12.599 1.00 61.41 O ATOM 398 CB LEU A 26 -10.878 1.293 10.191 1.00 54.13 C ATOM 399 CG LEU A 26 -10.879 -0.197 9.815 1.00 31.12 C ATOM 400 CD1 LEU A 26 -12.293 -0.773 9.985 1.00 1.03 C ATOM 401 CD2 LEU A 26 -10.440 -0.358 8.354 1.00 21.53 C ATOM 0 H LEU A 26 -8.791 -0.093 9.838 1.00 12.43 H new ATOM 0 HA LEU A 26 -9.264 2.692 10.060 1.00 34.53 H new ATOM 0 HB2 LEU A 26 -11.569 1.464 11.017 1.00 54.13 H new ATOM 0 HB3 LEU A 26 -11.235 1.885 9.348 1.00 54.13 H new ATOM 0 HG LEU A 26 -10.188 -0.731 10.467 1.00 31.12 H new ATOM 0 HD11 LEU A 26 -12.290 -1.830 9.718 1.00 1.03 H new ATOM 0 HD12 LEU A 26 -12.609 -0.662 11.022 1.00 1.03 H new ATOM 0 HD13 LEU A 26 -12.985 -0.236 9.336 1.00 1.03 H new ATOM 0 HD21 LEU A 26 -10.441 -1.415 8.088 1.00 21.53 H new ATOM 0 HD22 LEU A 26 -11.131 0.180 7.705 1.00 21.53 H new ATOM 0 HD23 LEU A 26 -9.436 0.047 8.229 1.00 21.53 H new ATOM 413 N ARG A 27 -8.987 0.939 12.793 1.00 61.24 N ATOM 414 CA ARG A 27 -8.856 0.995 14.239 1.00 62.11 C ATOM 415 C ARG A 27 -7.711 1.925 14.640 1.00 73.41 C ATOM 416 O ARG A 27 -7.861 2.754 15.538 1.00 22.32 O ATOM 417 CB ARG A 27 -8.599 -0.406 14.797 1.00 32.31 C ATOM 418 CG ARG A 27 -8.392 -0.324 16.311 1.00 12.51 C ATOM 419 CD ARG A 27 -8.398 -1.734 16.905 1.00 12.43 C ATOM 420 NE ARG A 27 -7.961 -1.696 18.296 1.00 44.02 N ATOM 421 CZ ARG A 27 -8.239 -2.691 19.132 1.00 2.11 C ATOM 422 NH1 ARG A 27 -8.916 -3.725 18.713 1.00 32.54 N ATOM 423 NH2 ARG A 27 -7.835 -2.634 20.371 1.00 64.03 N ATOM 0 H ARG A 27 -8.750 0.036 12.381 1.00 61.24 H new ATOM 0 HA ARG A 27 -9.786 1.384 14.653 1.00 62.11 H new ATOM 0 HB2 ARG A 27 -9.441 -1.059 14.570 1.00 32.31 H new ATOM 0 HB3 ARG A 27 -7.720 -0.842 14.322 1.00 32.31 H new ATOM 0 HG2 ARG A 27 -7.447 0.171 16.533 1.00 12.51 H new ATOM 0 HG3 ARG A 27 -9.181 0.276 16.764 1.00 12.51 H new ATOM 0 HD2 ARG A 27 -9.400 -2.159 16.842 1.00 12.43 H new ATOM 0 HD3 ARG A 27 -7.740 -2.383 16.327 1.00 12.43 H new ATOM 0 HE ARG A 27 -7.433 -0.891 18.633 1.00 44.02 H new ATOM 0 HH11 ARG A 27 -9.232 -3.769 17.744 1.00 32.54 H new ATOM 0 HH12 ARG A 27 -9.129 -4.489 19.354 1.00 32.54 H new ATOM 0 HH21 ARG A 27 -7.306 -1.826 20.698 1.00 64.03 H new ATOM 0 HH22 ARG A 27 -8.048 -3.398 21.013 1.00 64.03 H new ATOM 437 N GLU A 28 -6.552 1.748 14.007 1.00 61.12 N ATOM 438 CA GLU A 28 -5.376 2.547 14.351 1.00 72.22 C ATOM 439 C GLU A 28 -5.317 3.908 13.643 1.00 61.24 C ATOM 440 O GLU A 28 -4.949 4.901 14.264 1.00 25.15 O ATOM 441 CB GLU A 28 -4.111 1.757 14.013 1.00 34.41 C ATOM 442 CG GLU A 28 -4.032 0.518 14.907 1.00 20.22 C ATOM 443 CD GLU A 28 -2.718 -0.217 14.664 1.00 32.23 C ATOM 444 OE1 GLU A 28 -2.081 0.065 13.662 1.00 4.12 O ATOM 445 OE2 GLU A 28 -2.369 -1.052 15.482 1.00 23.34 O ATOM 0 H GLU A 28 -6.402 1.067 13.262 1.00 61.12 H new ATOM 0 HA GLU A 28 -5.448 2.752 15.419 1.00 72.22 H new ATOM 0 HB2 GLU A 28 -4.123 1.462 12.964 1.00 34.41 H new ATOM 0 HB3 GLU A 28 -3.229 2.381 14.159 1.00 34.41 H new ATOM 0 HG2 GLU A 28 -4.107 0.810 15.955 1.00 20.22 H new ATOM 0 HG3 GLU A 28 -4.873 -0.144 14.700 1.00 20.22 H new ATOM 452 N LYS A 29 -5.646 3.982 12.356 1.00 62.34 N ATOM 453 CA LYS A 29 -5.559 5.274 11.672 1.00 12.14 C ATOM 454 C LYS A 29 -6.589 6.258 12.213 1.00 12.10 C ATOM 455 O LYS A 29 -6.340 7.463 12.259 1.00 42.03 O ATOM 456 CB LYS A 29 -5.730 5.106 10.152 1.00 12.14 C ATOM 457 CG LYS A 29 -4.358 4.876 9.499 1.00 54.21 C ATOM 458 CD LYS A 29 -3.612 6.217 9.331 1.00 52.41 C ATOM 459 CE LYS A 29 -3.929 6.835 7.963 1.00 71.02 C ATOM 460 NZ LYS A 29 -2.959 6.325 6.952 1.00 4.24 N ATOM 0 H LYS A 29 -5.963 3.200 11.783 1.00 62.34 H new ATOM 0 HA LYS A 29 -4.566 5.679 11.866 1.00 12.14 H new ATOM 0 HB2 LYS A 29 -6.390 4.264 9.941 1.00 12.14 H new ATOM 0 HB3 LYS A 29 -6.201 5.993 9.729 1.00 12.14 H new ATOM 0 HG2 LYS A 29 -3.765 4.197 10.112 1.00 54.21 H new ATOM 0 HG3 LYS A 29 -4.486 4.399 8.527 1.00 54.21 H new ATOM 0 HD2 LYS A 29 -3.903 6.905 10.125 1.00 52.41 H new ATOM 0 HD3 LYS A 29 -2.538 6.058 9.426 1.00 52.41 H new ATOM 0 HE2 LYS A 29 -4.947 6.584 7.665 1.00 71.02 H new ATOM 0 HE3 LYS A 29 -3.873 7.922 8.021 1.00 71.02 H new ATOM 0 HZ1 LYS A 29 -3.424 6.265 6.024 1.00 4.24 H new ATOM 0 HZ2 LYS A 29 -2.148 6.973 6.891 1.00 4.24 H new ATOM 0 HZ3 LYS A 29 -2.627 5.381 7.235 1.00 4.24 H new ATOM 474 N ASP A 30 -7.730 5.744 12.635 1.00 61.12 N ATOM 475 CA ASP A 30 -8.768 6.600 13.186 1.00 31.04 C ATOM 476 C ASP A 30 -8.209 7.353 14.379 1.00 22.34 C ATOM 477 O ASP A 30 -8.773 8.348 14.833 1.00 75.40 O ATOM 478 CB ASP A 30 -9.975 5.763 13.616 1.00 54.12 C ATOM 479 CG ASP A 30 -11.012 6.651 14.295 1.00 34.40 C ATOM 480 OD1 ASP A 30 -10.964 7.852 14.084 1.00 43.42 O ATOM 481 OD2 ASP A 30 -11.839 6.118 15.015 1.00 31.51 O ATOM 0 H ASP A 30 -7.961 4.751 12.608 1.00 61.12 H new ATOM 0 HA ASP A 30 -9.093 7.308 12.424 1.00 31.04 H new ATOM 0 HB2 ASP A 30 -10.416 5.274 12.748 1.00 54.12 H new ATOM 0 HB3 ASP A 30 -9.657 4.975 14.298 1.00 54.12 H new ATOM 486 N LYS A 31 -7.090 6.845 14.888 1.00 11.42 N ATOM 487 CA LYS A 31 -6.433 7.438 16.043 1.00 74.21 C ATOM 488 C LYS A 31 -5.285 8.357 15.623 1.00 35.44 C ATOM 489 O LYS A 31 -4.950 9.296 16.346 1.00 11.52 O ATOM 490 CB LYS A 31 -5.909 6.307 16.947 1.00 14.20 C ATOM 491 CG LYS A 31 -5.031 6.856 18.097 1.00 55.22 C ATOM 492 CD LYS A 31 -3.579 6.383 17.938 1.00 42.03 C ATOM 493 CE LYS A 31 -2.918 7.079 16.744 1.00 54.34 C ATOM 494 NZ LYS A 31 -1.456 6.789 16.771 1.00 63.23 N ATOM 0 H LYS A 31 -6.620 6.020 14.515 1.00 11.42 H new ATOM 0 HA LYS A 31 -7.154 8.049 16.586 1.00 74.21 H new ATOM 0 HB2 LYS A 31 -6.751 5.754 17.364 1.00 14.20 H new ATOM 0 HB3 LYS A 31 -5.329 5.603 16.350 1.00 14.20 H new ATOM 0 HG2 LYS A 31 -5.066 7.945 18.101 1.00 55.22 H new ATOM 0 HG3 LYS A 31 -5.426 6.521 19.056 1.00 55.22 H new ATOM 0 HD2 LYS A 31 -3.018 6.597 18.848 1.00 42.03 H new ATOM 0 HD3 LYS A 31 -3.555 5.303 17.796 1.00 42.03 H new ATOM 0 HE2 LYS A 31 -3.356 6.726 15.811 1.00 54.34 H new ATOM 0 HE3 LYS A 31 -3.091 8.154 16.790 1.00 54.34 H new ATOM 0 HZ1 LYS A 31 -0.936 7.584 16.348 1.00 63.23 H new ATOM 0 HZ2 LYS A 31 -1.146 6.658 17.755 1.00 63.23 H new ATOM 0 HZ3 LYS A 31 -1.264 5.922 16.229 1.00 63.23 H new ATOM 508 N MET A 32 -4.685 8.119 14.453 1.00 30.10 N ATOM 509 CA MET A 32 -3.580 8.970 13.999 1.00 72.42 C ATOM 510 C MET A 32 -4.107 10.269 13.411 1.00 62.55 C ATOM 511 O MET A 32 -5.296 10.573 13.501 1.00 33.21 O ATOM 512 CB MET A 32 -2.735 8.218 12.941 1.00 13.44 C ATOM 513 CG MET A 32 -1.389 7.759 13.532 1.00 2.54 C ATOM 514 SD MET A 32 -0.880 6.208 12.749 1.00 1.31 S ATOM 515 CE MET A 32 -1.851 5.111 13.810 1.00 35.13 C ATOM 0 H MET A 32 -4.937 7.363 13.816 1.00 30.10 H new ATOM 0 HA MET A 32 -2.953 9.209 14.858 1.00 72.42 H new ATOM 0 HB2 MET A 32 -3.289 7.353 12.576 1.00 13.44 H new ATOM 0 HB3 MET A 32 -2.557 8.868 12.084 1.00 13.44 H new ATOM 0 HG2 MET A 32 -0.630 8.525 13.372 1.00 2.54 H new ATOM 0 HG3 MET A 32 -1.481 7.621 14.609 1.00 2.54 H new ATOM 0 HE1 MET A 32 -2.355 4.364 13.197 1.00 35.13 H new ATOM 0 HE2 MET A 32 -1.190 4.613 14.519 1.00 35.13 H new ATOM 0 HE3 MET A 32 -2.594 5.695 14.354 1.00 35.13 H new ATOM 525 N LYS A 33 -3.199 11.032 12.807 1.00 62.22 N ATOM 526 CA LYS A 33 -3.555 12.303 12.199 1.00 53.41 C ATOM 527 C LYS A 33 -3.060 12.353 10.754 1.00 73.13 C ATOM 528 O LYS A 33 -2.796 11.319 10.142 1.00 14.11 O ATOM 529 CB LYS A 33 -2.932 13.451 12.995 1.00 34.43 C ATOM 530 CG LYS A 33 -3.402 13.382 14.456 1.00 63.31 C ATOM 531 CD LYS A 33 -2.463 14.210 15.355 1.00 1.24 C ATOM 532 CE LYS A 33 -1.358 13.316 15.932 1.00 65.24 C ATOM 533 NZ LYS A 33 -0.495 12.809 14.828 1.00 24.45 N ATOM 0 H LYS A 33 -2.212 10.788 12.728 1.00 62.22 H new ATOM 0 HA LYS A 33 -4.640 12.405 12.206 1.00 53.41 H new ATOM 0 HB2 LYS A 33 -1.845 13.390 12.949 1.00 34.43 H new ATOM 0 HB3 LYS A 33 -3.216 14.407 12.556 1.00 34.43 H new ATOM 0 HG2 LYS A 33 -4.421 13.760 14.536 1.00 63.31 H new ATOM 0 HG3 LYS A 33 -3.419 12.345 14.792 1.00 63.31 H new ATOM 0 HD2 LYS A 33 -2.020 15.023 14.780 1.00 1.24 H new ATOM 0 HD3 LYS A 33 -3.032 14.666 16.165 1.00 1.24 H new ATOM 0 HE2 LYS A 33 -0.758 13.879 16.647 1.00 65.24 H new ATOM 0 HE3 LYS A 33 -1.799 12.480 16.475 1.00 65.24 H new ATOM 0 HZ1 LYS A 33 0.370 12.392 15.227 1.00 24.45 H new ATOM 0 HZ2 LYS A 33 -1.011 12.085 14.288 1.00 24.45 H new ATOM 0 HZ3 LYS A 33 -0.241 13.596 14.197 1.00 24.45 H new ATOM 547 N MET A 34 -2.968 13.560 10.212 1.00 52.04 N ATOM 548 CA MET A 34 -2.548 13.766 8.842 1.00 41.01 C ATOM 549 C MET A 34 -1.123 13.283 8.569 1.00 31.30 C ATOM 550 O MET A 34 -0.202 13.546 9.343 1.00 25.12 O ATOM 551 CB MET A 34 -2.619 15.268 8.582 1.00 51.41 C ATOM 552 CG MET A 34 -2.621 15.548 7.083 1.00 3.23 C ATOM 553 SD MET A 34 -3.399 17.156 6.767 1.00 10.01 S ATOM 554 CE MET A 34 -5.051 16.763 7.401 1.00 72.31 C ATOM 0 H MET A 34 -3.184 14.421 10.714 1.00 52.04 H new ATOM 0 HA MET A 34 -3.201 13.189 8.187 1.00 41.01 H new ATOM 0 HB2 MET A 34 -3.520 15.680 9.037 1.00 51.41 H new ATOM 0 HB3 MET A 34 -1.770 15.765 9.050 1.00 51.41 H new ATOM 0 HG2 MET A 34 -1.600 15.545 6.701 1.00 3.23 H new ATOM 0 HG3 MET A 34 -3.161 14.761 6.556 1.00 3.23 H new ATOM 0 HE1 MET A 34 -5.804 17.114 6.696 1.00 72.31 H new ATOM 0 HE2 MET A 34 -5.146 15.684 7.526 1.00 72.31 H new ATOM 0 HE3 MET A 34 -5.198 17.254 8.363 1.00 72.31 H new ATOM 564 N ALA A 35 -0.957 12.593 7.434 1.00 10.11 N ATOM 565 CA ALA A 35 0.345 12.084 7.009 1.00 23.14 C ATOM 566 C ALA A 35 0.773 12.823 5.742 1.00 12.22 C ATOM 567 O ALA A 35 -0.047 13.475 5.104 1.00 13.14 O ATOM 568 CB ALA A 35 0.261 10.577 6.741 1.00 71.43 C ATOM 0 H ALA A 35 -1.718 12.375 6.791 1.00 10.11 H new ATOM 0 HA ALA A 35 1.080 12.251 7.796 1.00 23.14 H new ATOM 0 HB1 ALA A 35 1.237 10.209 6.425 1.00 71.43 H new ATOM 0 HB2 ALA A 35 -0.044 10.062 7.652 1.00 71.43 H new ATOM 0 HB3 ALA A 35 -0.470 10.387 5.955 1.00 71.43 H new ATOM 574 N MET A 36 2.055 12.738 5.386 1.00 63.32 N ATOM 575 CA MET A 36 2.558 13.439 4.197 1.00 43.35 C ATOM 576 C MET A 36 3.367 12.498 3.300 1.00 13.15 C ATOM 577 O MET A 36 3.805 11.430 3.726 1.00 70.33 O ATOM 578 CB MET A 36 3.433 14.637 4.628 1.00 11.10 C ATOM 579 CG MET A 36 3.795 14.525 6.113 1.00 54.52 C ATOM 580 SD MET A 36 2.365 14.969 7.127 1.00 24.42 S ATOM 581 CE MET A 36 2.929 14.193 8.661 1.00 34.32 C ATOM 0 H MET A 36 2.758 12.200 5.893 1.00 63.32 H new ATOM 0 HA MET A 36 1.702 13.799 3.625 1.00 43.35 H new ATOM 0 HB2 MET A 36 4.342 14.667 4.027 1.00 11.10 H new ATOM 0 HB3 MET A 36 2.899 15.570 4.446 1.00 11.10 H new ATOM 0 HG2 MET A 36 4.114 13.509 6.343 1.00 54.52 H new ATOM 0 HG3 MET A 36 4.634 15.182 6.343 1.00 54.52 H new ATOM 0 HE1 MET A 36 2.192 14.361 9.446 1.00 34.32 H new ATOM 0 HE2 MET A 36 3.052 13.122 8.503 1.00 34.32 H new ATOM 0 HE3 MET A 36 3.883 14.628 8.959 1.00 34.32 H new ATOM 591 N ALA A 37 3.545 12.916 2.044 1.00 23.03 N ATOM 592 CA ALA A 37 4.286 12.117 1.069 1.00 4.22 C ATOM 593 C ALA A 37 4.868 12.991 -0.046 1.00 14.13 C ATOM 594 O ALA A 37 4.434 14.120 -0.251 1.00 55.43 O ATOM 595 CB ALA A 37 3.355 11.066 0.460 1.00 43.11 C ATOM 0 H ALA A 37 3.187 13.800 1.681 1.00 23.03 H new ATOM 0 HA ALA A 37 5.114 11.632 1.586 1.00 4.22 H new ATOM 0 HB1 ALA A 37 3.906 10.469 -0.267 1.00 43.11 H new ATOM 0 HB2 ALA A 37 2.974 10.417 1.248 1.00 43.11 H new ATOM 0 HB3 ALA A 37 2.521 11.562 -0.036 1.00 43.11 H new ATOM 601 N ARG A 38 5.860 12.454 -0.758 1.00 71.23 N ATOM 602 CA ARG A 38 6.507 13.182 -1.851 1.00 71.55 C ATOM 603 C ARG A 38 6.710 12.239 -3.027 1.00 41.13 C ATOM 604 O ARG A 38 7.168 11.114 -2.843 1.00 54.42 O ATOM 605 CB ARG A 38 7.861 13.728 -1.391 1.00 44.23 C ATOM 606 CG ARG A 38 7.664 14.605 -0.153 1.00 31.14 C ATOM 607 CD ARG A 38 8.978 15.309 0.194 1.00 71.12 C ATOM 608 NE ARG A 38 9.984 14.333 0.608 1.00 14.31 N ATOM 609 CZ ARG A 38 10.805 13.765 -0.272 1.00 0.45 C ATOM 610 NH1 ARG A 38 10.720 14.068 -1.539 1.00 52.25 N ATOM 611 NH2 ARG A 38 11.697 12.902 0.132 1.00 50.34 N ATOM 0 H ARG A 38 6.233 11.518 -0.598 1.00 71.23 H new ATOM 0 HA ARG A 38 5.874 14.017 -2.152 1.00 71.55 H new ATOM 0 HB2 ARG A 38 8.538 12.905 -1.163 1.00 44.23 H new ATOM 0 HB3 ARG A 38 8.322 14.308 -2.191 1.00 44.23 H new ATOM 0 HG2 ARG A 38 6.883 15.342 -0.338 1.00 31.14 H new ATOM 0 HG3 ARG A 38 7.334 13.995 0.688 1.00 31.14 H new ATOM 0 HD2 ARG A 38 9.338 15.868 -0.670 1.00 71.12 H new ATOM 0 HD3 ARG A 38 8.811 16.031 0.994 1.00 71.12 H new ATOM 0 HE ARG A 38 10.059 14.081 1.594 1.00 14.31 H new ATOM 0 HH11 ARG A 38 10.023 14.742 -1.857 1.00 52.25 H new ATOM 0 HH12 ARG A 38 11.351 13.631 -2.211 1.00 52.25 H new ATOM 0 HH21 ARG A 38 11.764 12.663 1.121 1.00 50.34 H new ATOM 0 HH22 ARG A 38 12.327 12.466 -0.542 1.00 50.34 H new ATOM 625 N ILE A 39 6.344 12.677 -4.231 1.00 41.44 N ATOM 626 CA ILE A 39 6.454 11.856 -5.432 1.00 43.23 C ATOM 627 C ILE A 39 7.433 12.497 -6.409 1.00 20.53 C ATOM 628 O ILE A 39 7.474 13.722 -6.529 1.00 42.23 O ATOM 629 CB ILE A 39 5.070 11.793 -6.022 1.00 63.50 C ATOM 630 CG1 ILE A 39 4.945 10.836 -7.205 1.00 44.50 C ATOM 631 CG2 ILE A 39 4.678 13.156 -6.470 1.00 14.25 C ATOM 632 CD1 ILE A 39 3.471 10.402 -7.298 1.00 31.03 C ATOM 0 H ILE A 39 5.964 13.609 -4.399 1.00 41.44 H new ATOM 0 HA ILE A 39 6.828 10.857 -5.210 1.00 43.23 H new ATOM 0 HB ILE A 39 4.413 11.414 -5.239 1.00 63.50 H new ATOM 0 HG12 ILE A 39 5.259 11.324 -8.127 1.00 44.50 H new ATOM 0 HG13 ILE A 39 5.591 9.969 -7.067 1.00 44.50 H new ATOM 0 HG21 ILE A 39 3.677 13.124 -6.900 1.00 14.25 H new ATOM 0 HG22 ILE A 39 4.686 13.835 -5.618 1.00 14.25 H new ATOM 0 HG23 ILE A 39 5.384 13.509 -7.222 1.00 14.25 H new ATOM 0 HD11 ILE A 39 3.346 9.716 -8.135 1.00 31.03 H new ATOM 0 HD12 ILE A 39 3.179 9.903 -6.374 1.00 31.03 H new ATOM 0 HD13 ILE A 39 2.842 11.279 -7.451 1.00 31.03 H new ATOM 644 N SER A 40 8.223 11.695 -7.103 1.00 43.21 N ATOM 645 CA SER A 40 9.178 12.250 -8.057 1.00 34.01 C ATOM 646 C SER A 40 9.273 11.371 -9.294 1.00 3.51 C ATOM 647 O SER A 40 9.079 10.158 -9.225 1.00 21.34 O ATOM 648 CB SER A 40 10.541 12.405 -7.395 1.00 15.42 C ATOM 649 OG SER A 40 11.352 11.279 -7.703 1.00 73.23 O ATOM 0 H SER A 40 8.226 10.678 -7.030 1.00 43.21 H new ATOM 0 HA SER A 40 8.830 13.234 -8.372 1.00 34.01 H new ATOM 0 HB2 SER A 40 11.023 13.319 -7.742 1.00 15.42 H new ATOM 0 HB3 SER A 40 10.424 12.497 -6.315 1.00 15.42 H new ATOM 0 HG SER A 40 12.229 11.381 -7.278 1.00 73.23 H new ATOM 655 N PHE A 41 9.522 12.004 -10.437 1.00 33.43 N ATOM 656 CA PHE A 41 9.582 11.282 -11.703 1.00 3.22 C ATOM 657 C PHE A 41 10.977 10.761 -12.040 1.00 61.31 C ATOM 658 O PHE A 41 11.748 11.424 -12.735 1.00 63.23 O ATOM 659 CB PHE A 41 9.102 12.196 -12.829 1.00 44.51 C ATOM 660 CG PHE A 41 7.630 12.480 -12.644 1.00 2.51 C ATOM 661 CD1 PHE A 41 7.220 13.548 -11.837 1.00 74.50 C ATOM 662 CD2 PHE A 41 6.677 11.672 -13.274 1.00 14.20 C ATOM 663 CE1 PHE A 41 5.855 13.806 -11.660 1.00 32.43 C ATOM 664 CE2 PHE A 41 5.313 11.932 -13.099 1.00 52.42 C ATOM 665 CZ PHE A 41 4.902 12.998 -12.290 1.00 30.32 C ATOM 0 H PHE A 41 9.684 13.008 -10.512 1.00 33.43 H new ATOM 0 HA PHE A 41 8.935 10.411 -11.599 1.00 3.22 H new ATOM 0 HB2 PHE A 41 9.668 13.128 -12.824 1.00 44.51 H new ATOM 0 HB3 PHE A 41 9.275 11.723 -13.796 1.00 44.51 H new ATOM 0 HD1 PHE A 41 7.956 14.172 -11.352 1.00 74.50 H new ATOM 0 HD2 PHE A 41 6.994 10.848 -13.895 1.00 14.20 H new ATOM 0 HE1 PHE A 41 5.538 14.629 -11.037 1.00 32.43 H new ATOM 0 HE2 PHE A 41 4.578 11.310 -13.588 1.00 52.42 H new ATOM 0 HZ PHE A 41 3.849 13.197 -12.152 1.00 30.32 H new ATOM 675 N LEU A 42 11.270 9.544 -11.590 1.00 2.12 N ATOM 676 CA LEU A 42 12.553 8.923 -11.907 1.00 72.44 C ATOM 677 C LEU A 42 12.637 8.781 -13.418 1.00 54.23 C ATOM 678 O LEU A 42 13.641 9.116 -14.047 1.00 51.04 O ATOM 679 CB LEU A 42 12.654 7.525 -11.288 1.00 61.51 C ATOM 680 CG LEU A 42 12.506 7.591 -9.766 1.00 61.51 C ATOM 681 CD1 LEU A 42 12.173 6.192 -9.237 1.00 63.32 C ATOM 682 CD2 LEU A 42 13.818 8.073 -9.134 1.00 63.11 C ATOM 0 H LEU A 42 10.648 8.976 -11.014 1.00 2.12 H new ATOM 0 HA LEU A 42 13.359 9.541 -11.510 1.00 72.44 H new ATOM 0 HB2 LEU A 42 11.880 6.881 -11.705 1.00 61.51 H new ATOM 0 HB3 LEU A 42 13.614 7.077 -11.545 1.00 61.51 H new ATOM 0 HG LEU A 42 11.708 8.288 -9.509 1.00 61.51 H new ATOM 0 HD11 LEU A 42 12.066 6.229 -8.153 1.00 63.32 H new ATOM 0 HD12 LEU A 42 11.240 5.847 -9.683 1.00 63.32 H new ATOM 0 HD13 LEU A 42 12.976 5.503 -9.499 1.00 63.32 H new ATOM 0 HD21 LEU A 42 13.705 8.118 -8.051 1.00 63.11 H new ATOM 0 HD22 LEU A 42 14.620 7.380 -9.387 1.00 63.11 H new ATOM 0 HD23 LEU A 42 14.062 9.065 -9.514 1.00 63.11 H new ATOM 694 N GLY A 43 11.541 8.284 -13.975 1.00 60.32 N ATOM 695 CA GLY A 43 11.408 8.079 -15.408 1.00 4.13 C ATOM 696 C GLY A 43 9.932 7.900 -15.754 1.00 10.42 C ATOM 697 O GLY A 43 9.122 7.583 -14.884 1.00 70.23 O ATOM 0 H GLY A 43 10.716 8.011 -13.441 1.00 60.32 H new ATOM 0 HA2 GLY A 43 11.820 8.931 -15.949 1.00 4.13 H new ATOM 0 HA3 GLY A 43 11.975 7.201 -15.716 1.00 4.13 H new ATOM 701 N GLU A 44 9.581 8.112 -17.015 1.00 52.23 N ATOM 702 CA GLU A 44 8.190 7.973 -17.432 1.00 24.11 C ATOM 703 C GLU A 44 7.620 6.629 -16.988 1.00 62.20 C ATOM 704 O GLU A 44 6.406 6.472 -16.866 1.00 20.44 O ATOM 705 CB GLU A 44 8.083 8.098 -18.954 1.00 74.44 C ATOM 706 CG GLU A 44 8.386 9.538 -19.375 1.00 21.21 C ATOM 707 CD GLU A 44 9.866 9.841 -19.169 1.00 63.53 C ATOM 708 OE1 GLU A 44 10.653 8.910 -19.217 1.00 52.21 O ATOM 709 OE2 GLU A 44 10.190 10.999 -18.967 1.00 53.03 O ATOM 0 H GLU A 44 10.228 8.377 -17.758 1.00 52.23 H new ATOM 0 HA GLU A 44 7.613 8.769 -16.960 1.00 24.11 H new ATOM 0 HB2 GLU A 44 8.782 7.413 -19.435 1.00 74.44 H new ATOM 0 HB3 GLU A 44 7.083 7.815 -19.283 1.00 74.44 H new ATOM 0 HG2 GLU A 44 8.119 9.683 -20.422 1.00 21.21 H new ATOM 0 HG3 GLU A 44 7.780 10.231 -18.792 1.00 21.21 H new ATOM 716 N ASP A 45 8.503 5.658 -16.752 1.00 54.34 N ATOM 717 CA ASP A 45 8.075 4.324 -16.325 1.00 12.35 C ATOM 718 C ASP A 45 8.540 4.028 -14.901 1.00 32.33 C ATOM 719 O ASP A 45 8.443 2.894 -14.433 1.00 33.21 O ATOM 720 CB ASP A 45 8.649 3.270 -17.274 1.00 64.25 C ATOM 721 CG ASP A 45 8.245 3.584 -18.709 1.00 13.43 C ATOM 722 OD1 ASP A 45 7.255 4.275 -18.888 1.00 60.21 O ATOM 723 OD2 ASP A 45 8.929 3.128 -19.610 1.00 70.34 O ATOM 0 H ASP A 45 9.512 5.768 -16.848 1.00 54.34 H new ATOM 0 HA ASP A 45 6.986 4.293 -16.348 1.00 12.35 H new ATOM 0 HB2 ASP A 45 9.736 3.247 -17.190 1.00 64.25 H new ATOM 0 HB3 ASP A 45 8.287 2.281 -16.994 1.00 64.25 H new ATOM 728 N GLU A 46 9.049 5.050 -14.215 1.00 53.15 N ATOM 729 CA GLU A 46 9.528 4.876 -12.844 1.00 74.25 C ATOM 730 C GLU A 46 9.348 6.161 -12.037 1.00 61.30 C ATOM 731 O GLU A 46 9.735 7.237 -12.485 1.00 13.22 O ATOM 732 CB GLU A 46 11.010 4.488 -12.859 1.00 64.21 C ATOM 733 CG GLU A 46 11.193 3.190 -13.647 1.00 24.42 C ATOM 734 CD GLU A 46 12.597 2.638 -13.422 1.00 35.14 C ATOM 735 OE1 GLU A 46 13.396 3.335 -12.819 1.00 23.21 O ATOM 736 OE2 GLU A 46 12.852 1.526 -13.856 1.00 52.34 O ATOM 0 H GLU A 46 9.140 5.998 -14.581 1.00 53.15 H new ATOM 0 HA GLU A 46 8.943 4.085 -12.375 1.00 74.25 H new ATOM 0 HB2 GLU A 46 11.600 5.285 -13.310 1.00 64.21 H new ATOM 0 HB3 GLU A 46 11.373 4.360 -11.839 1.00 64.21 H new ATOM 0 HG2 GLU A 46 10.450 2.457 -13.333 1.00 24.42 H new ATOM 0 HG3 GLU A 46 11.031 3.374 -14.709 1.00 24.42 H new ATOM 743 N LEU A 47 8.776 6.031 -10.837 1.00 42.34 N ATOM 744 CA LEU A 47 8.559 7.182 -9.951 1.00 73.12 C ATOM 745 C LEU A 47 8.913 6.815 -8.509 1.00 74.24 C ATOM 746 O LEU A 47 8.758 5.666 -8.093 1.00 72.11 O ATOM 747 CB LEU A 47 7.106 7.693 -9.998 1.00 13.24 C ATOM 748 CG LEU A 47 6.427 7.349 -11.327 1.00 23.31 C ATOM 749 CD1 LEU A 47 4.979 7.831 -11.251 1.00 73.04 C ATOM 750 CD2 LEU A 47 7.128 8.048 -12.508 1.00 3.41 C ATOM 0 H LEU A 47 8.454 5.142 -10.455 1.00 42.34 H new ATOM 0 HA LEU A 47 9.210 7.981 -10.308 1.00 73.12 H new ATOM 0 HB2 LEU A 47 6.540 7.255 -9.176 1.00 13.24 H new ATOM 0 HB3 LEU A 47 7.095 8.773 -9.853 1.00 13.24 H new ATOM 0 HG LEU A 47 6.481 6.273 -11.491 1.00 23.31 H new ATOM 0 HD11 LEU A 47 4.469 7.599 -12.186 1.00 73.04 H new ATOM 0 HD12 LEU A 47 4.472 7.330 -10.427 1.00 73.04 H new ATOM 0 HD13 LEU A 47 4.962 8.908 -11.086 1.00 73.04 H new ATOM 0 HD21 LEU A 47 6.624 7.785 -13.438 1.00 3.41 H new ATOM 0 HD22 LEU A 47 7.089 9.128 -12.367 1.00 3.41 H new ATOM 0 HD23 LEU A 47 8.168 7.726 -12.556 1.00 3.41 H new ATOM 762 N LYS A 48 9.373 7.807 -7.751 1.00 13.33 N ATOM 763 CA LYS A 48 9.732 7.600 -6.346 1.00 62.51 C ATOM 764 C LYS A 48 8.682 8.238 -5.438 1.00 21.24 C ATOM 765 O LYS A 48 8.452 9.441 -5.524 1.00 54.31 O ATOM 766 CB LYS A 48 11.099 8.234 -6.066 1.00 12.22 C ATOM 767 CG LYS A 48 11.683 7.662 -4.771 1.00 14.03 C ATOM 768 CD LYS A 48 12.814 8.567 -4.270 1.00 11.31 C ATOM 769 CE LYS A 48 13.924 8.640 -5.320 1.00 11.23 C ATOM 770 NZ LYS A 48 14.240 7.267 -5.808 1.00 45.31 N ATOM 0 H LYS A 48 9.507 8.762 -8.083 1.00 13.33 H new ATOM 0 HA LYS A 48 9.777 6.530 -6.146 1.00 62.51 H new ATOM 0 HB2 LYS A 48 11.777 8.040 -6.898 1.00 12.22 H new ATOM 0 HB3 LYS A 48 10.998 9.316 -5.983 1.00 12.22 H new ATOM 0 HG2 LYS A 48 10.904 7.584 -4.013 1.00 14.03 H new ATOM 0 HG3 LYS A 48 12.061 6.654 -4.945 1.00 14.03 H new ATOM 0 HD2 LYS A 48 12.429 9.566 -4.065 1.00 11.31 H new ATOM 0 HD3 LYS A 48 13.213 8.180 -3.332 1.00 11.31 H new ATOM 0 HE2 LYS A 48 13.610 9.270 -6.153 1.00 11.23 H new ATOM 0 HE3 LYS A 48 14.815 9.099 -4.891 1.00 11.23 H new ATOM 0 HZ1 LYS A 48 15.138 7.283 -6.333 1.00 45.31 H new ATOM 0 HZ2 LYS A 48 14.325 6.621 -4.997 1.00 45.31 H new ATOM 0 HZ3 LYS A 48 13.478 6.937 -6.435 1.00 45.31 H new ATOM 784 N VAL A 49 8.062 7.441 -4.553 1.00 22.31 N ATOM 785 CA VAL A 49 7.054 7.979 -3.626 1.00 23.45 C ATOM 786 C VAL A 49 7.493 7.771 -2.190 1.00 74.44 C ATOM 787 O VAL A 49 8.062 6.742 -1.825 1.00 64.34 O ATOM 788 CB VAL A 49 5.654 7.374 -3.901 1.00 44.22 C ATOM 789 CG1 VAL A 49 4.796 7.274 -2.632 1.00 43.52 C ATOM 790 CG2 VAL A 49 4.920 8.290 -4.864 1.00 54.13 C ATOM 0 H VAL A 49 8.236 6.440 -4.460 1.00 22.31 H new ATOM 0 HA VAL A 49 6.968 9.053 -3.794 1.00 23.45 H new ATOM 0 HB VAL A 49 5.804 6.371 -4.300 1.00 44.22 H new ATOM 0 HG11 VAL A 49 3.826 6.844 -2.882 1.00 43.52 H new ATOM 0 HG12 VAL A 49 5.298 6.638 -1.903 1.00 43.52 H new ATOM 0 HG13 VAL A 49 4.654 8.269 -2.210 1.00 43.52 H new ATOM 0 HG21 VAL A 49 3.931 7.882 -5.071 1.00 54.13 H new ATOM 0 HG22 VAL A 49 4.818 9.280 -4.419 1.00 54.13 H new ATOM 0 HG23 VAL A 49 5.483 8.367 -5.794 1.00 54.13 H new ATOM 800 N SER A 50 7.259 8.806 -1.403 1.00 11.12 N ATOM 801 CA SER A 50 7.654 8.832 -0.007 1.00 24.33 C ATOM 802 C SER A 50 6.446 8.880 0.915 1.00 71.12 C ATOM 803 O SER A 50 5.449 9.524 0.600 1.00 3.43 O ATOM 804 CB SER A 50 8.485 10.085 0.199 1.00 43.41 C ATOM 805 OG SER A 50 9.137 10.029 1.460 1.00 33.34 O ATOM 0 H SER A 50 6.788 9.655 -1.716 1.00 11.12 H new ATOM 0 HA SER A 50 8.214 7.927 0.230 1.00 24.33 H new ATOM 0 HB2 SER A 50 9.223 10.178 -0.598 1.00 43.41 H new ATOM 0 HB3 SER A 50 7.847 10.968 0.148 1.00 43.41 H new ATOM 0 HG SER A 50 9.673 10.839 1.587 1.00 33.34 H new ATOM 811 N TYR A 51 6.542 8.205 2.060 1.00 11.22 N ATOM 812 CA TYR A 51 5.450 8.193 3.026 1.00 3.13 C ATOM 813 C TYR A 51 5.933 8.746 4.361 1.00 31.11 C ATOM 814 O TYR A 51 6.963 8.314 4.880 1.00 4.40 O ATOM 815 CB TYR A 51 4.965 6.753 3.259 1.00 53.15 C ATOM 816 CG TYR A 51 4.992 5.962 1.969 1.00 21.30 C ATOM 817 CD1 TYR A 51 6.212 5.672 1.341 1.00 4.44 C ATOM 818 CD2 TYR A 51 3.795 5.511 1.407 1.00 32.23 C ATOM 819 CE1 TYR A 51 6.227 4.936 0.153 1.00 60.25 C ATOM 820 CE2 TYR A 51 3.811 4.773 0.218 1.00 44.53 C ATOM 821 CZ TYR A 51 5.027 4.486 -0.409 1.00 34.44 C ATOM 822 OH TYR A 51 5.043 3.758 -1.581 1.00 60.41 O ATOM 0 H TYR A 51 7.360 7.663 2.338 1.00 11.22 H new ATOM 0 HA TYR A 51 4.639 8.804 2.631 1.00 3.13 H new ATOM 0 HB2 TYR A 51 5.597 6.267 4.002 1.00 53.15 H new ATOM 0 HB3 TYR A 51 3.952 6.766 3.662 1.00 53.15 H new ATOM 0 HD1 TYR A 51 7.139 6.017 1.775 1.00 4.44 H new ATOM 0 HD2 TYR A 51 2.855 5.732 1.891 1.00 32.23 H new ATOM 0 HE1 TYR A 51 7.166 4.714 -0.332 1.00 60.25 H new ATOM 0 HE2 TYR A 51 2.885 4.425 -0.215 1.00 44.53 H new ATOM 0 HH TYR A 51 4.125 3.523 -1.833 1.00 60.41 H new ATOM 832 N ALA A 52 5.185 9.686 4.924 1.00 25.33 N ATOM 833 CA ALA A 52 5.545 10.270 6.211 1.00 4.01 C ATOM 834 C ALA A 52 4.333 10.249 7.133 1.00 54.51 C ATOM 835 O ALA A 52 3.363 10.978 6.922 1.00 5.04 O ATOM 836 CB ALA A 52 6.050 11.701 6.012 1.00 34.04 C ATOM 0 H ALA A 52 4.329 10.059 4.513 1.00 25.33 H new ATOM 0 HA ALA A 52 6.344 9.686 6.667 1.00 4.01 H new ATOM 0 HB1 ALA A 52 6.317 12.130 6.978 1.00 34.04 H new ATOM 0 HB2 ALA A 52 6.927 11.691 5.365 1.00 34.04 H new ATOM 0 HB3 ALA A 52 5.266 12.303 5.552 1.00 34.04 H new ATOM 842 N VAL A 53 4.392 9.387 8.146 1.00 11.31 N ATOM 843 CA VAL A 53 3.290 9.243 9.096 1.00 4.25 C ATOM 844 C VAL A 53 3.727 9.643 10.510 1.00 33.04 C ATOM 845 O VAL A 53 4.767 9.181 10.993 1.00 1.44 O ATOM 846 CB VAL A 53 2.817 7.788 9.113 1.00 33.11 C ATOM 847 CG1 VAL A 53 1.478 7.695 9.847 1.00 24.22 C ATOM 848 CG2 VAL A 53 2.643 7.295 7.674 1.00 45.44 C ATOM 0 H VAL A 53 5.190 8.778 8.330 1.00 11.31 H new ATOM 0 HA VAL A 53 2.479 9.900 8.781 1.00 4.25 H new ATOM 0 HB VAL A 53 3.555 7.171 9.625 1.00 33.11 H new ATOM 0 HG11 VAL A 53 1.141 6.658 9.859 1.00 24.22 H new ATOM 0 HG12 VAL A 53 1.599 8.049 10.871 1.00 24.22 H new ATOM 0 HG13 VAL A 53 0.739 8.311 9.335 1.00 24.22 H new ATOM 0 HG21 VAL A 53 2.306 6.258 7.683 1.00 45.44 H new ATOM 0 HG22 VAL A 53 1.903 7.913 7.165 1.00 45.44 H new ATOM 0 HG23 VAL A 53 3.596 7.362 7.149 1.00 45.44 H new ATOM 858 N PRO A 54 2.961 10.471 11.192 1.00 52.35 N ATOM 859 CA PRO A 54 3.296 10.901 12.578 1.00 14.42 C ATOM 860 C PRO A 54 2.941 9.820 13.592 1.00 13.13 C ATOM 861 O PRO A 54 1.923 9.140 13.455 1.00 72.24 O ATOM 862 CB PRO A 54 2.432 12.147 12.779 1.00 61.14 C ATOM 863 CG PRO A 54 1.223 11.904 11.939 1.00 14.32 C ATOM 864 CD PRO A 54 1.701 11.091 10.731 1.00 4.20 C ATOM 0 HA PRO A 54 4.360 11.092 12.717 1.00 14.42 H new ATOM 0 HB2 PRO A 54 2.166 12.281 13.828 1.00 61.14 H new ATOM 0 HB3 PRO A 54 2.958 13.049 12.466 1.00 61.14 H new ATOM 0 HG2 PRO A 54 0.463 11.360 12.499 1.00 14.32 H new ATOM 0 HG3 PRO A 54 0.773 12.845 11.622 1.00 14.32 H new ATOM 0 HD2 PRO A 54 0.968 10.338 10.442 1.00 4.20 H new ATOM 0 HD3 PRO A 54 1.864 11.727 9.861 1.00 4.20 H new ATOM 872 N LYS A 55 3.780 9.664 14.607 1.00 73.41 N ATOM 873 CA LYS A 55 3.538 8.659 15.633 1.00 42.31 C ATOM 874 C LYS A 55 4.167 9.096 16.957 1.00 1.31 C ATOM 875 O LYS A 55 5.327 8.788 17.223 1.00 53.30 O ATOM 876 CB LYS A 55 4.136 7.316 15.191 1.00 74.14 C ATOM 877 CG LYS A 55 3.437 6.166 15.928 1.00 30.24 C ATOM 878 CD LYS A 55 3.974 4.815 15.419 1.00 12.50 C ATOM 879 CE LYS A 55 5.242 4.423 16.190 1.00 0.43 C ATOM 880 NZ LYS A 55 4.865 3.612 17.382 1.00 34.34 N ATOM 0 H LYS A 55 4.627 10.215 14.742 1.00 73.41 H new ATOM 0 HA LYS A 55 2.463 8.547 15.774 1.00 42.31 H new ATOM 0 HB2 LYS A 55 4.020 7.193 14.114 1.00 74.14 H new ATOM 0 HB3 LYS A 55 5.205 7.297 15.401 1.00 74.14 H new ATOM 0 HG2 LYS A 55 3.607 6.254 17.001 1.00 30.24 H new ATOM 0 HG3 LYS A 55 2.360 6.222 15.770 1.00 30.24 H new ATOM 0 HD2 LYS A 55 3.213 4.044 15.540 1.00 12.50 H new ATOM 0 HD3 LYS A 55 4.194 4.881 14.353 1.00 12.50 H new ATOM 0 HE2 LYS A 55 5.911 3.853 15.546 1.00 0.43 H new ATOM 0 HE3 LYS A 55 5.783 5.317 16.501 1.00 0.43 H new ATOM 0 HZ1 LYS A 55 5.521 3.817 18.163 1.00 34.34 H new ATOM 0 HZ2 LYS A 55 3.896 3.852 17.673 1.00 34.34 H new ATOM 0 HZ3 LYS A 55 4.915 2.601 17.144 1.00 34.34 H new ATOM 894 N PRO A 56 3.439 9.811 17.786 1.00 11.12 N ATOM 895 CA PRO A 56 3.962 10.289 19.097 1.00 63.43 C ATOM 896 C PRO A 56 4.813 9.233 19.805 1.00 21.45 C ATOM 897 O PRO A 56 5.567 9.547 20.727 1.00 21.00 O ATOM 898 CB PRO A 56 2.690 10.602 19.886 1.00 25.13 C ATOM 899 CG PRO A 56 1.690 11.016 18.853 1.00 55.31 C ATOM 900 CD PRO A 56 2.042 10.247 17.571 1.00 3.24 C ATOM 0 HA PRO A 56 4.628 11.146 18.992 1.00 63.43 H new ATOM 0 HB2 PRO A 56 2.346 9.730 20.443 1.00 25.13 H new ATOM 0 HB3 PRO A 56 2.861 11.397 20.612 1.00 25.13 H new ATOM 0 HG2 PRO A 56 0.676 10.783 19.179 1.00 55.31 H new ATOM 0 HG3 PRO A 56 1.731 12.092 18.683 1.00 55.31 H new ATOM 0 HD2 PRO A 56 1.377 9.396 17.421 1.00 3.24 H new ATOM 0 HD3 PRO A 56 1.953 10.881 16.689 1.00 3.24 H new ATOM 908 N ASN A 57 4.690 7.983 19.366 1.00 44.53 N ATOM 909 CA ASN A 57 5.452 6.886 19.960 1.00 64.23 C ATOM 910 C ASN A 57 6.698 6.580 19.128 1.00 23.11 C ATOM 911 O ASN A 57 7.285 5.505 19.250 1.00 64.11 O ATOM 912 CB ASN A 57 4.578 5.634 20.048 1.00 12.42 C ATOM 913 CG ASN A 57 3.265 5.964 20.750 1.00 43.43 C ATOM 914 OD1 ASN A 57 2.206 5.482 20.346 1.00 42.33 O ATOM 915 ND2 ASN A 57 3.270 6.761 21.783 1.00 73.42 N ATOM 0 H ASN A 57 4.072 7.704 18.604 1.00 44.53 H new ATOM 0 HA ASN A 57 5.763 7.187 20.960 1.00 64.23 H new ATOM 0 HB2 ASN A 57 4.379 5.248 19.048 1.00 12.42 H new ATOM 0 HB3 ASN A 57 5.104 4.850 20.593 1.00 12.42 H new ATOM 0 HD21 ASN A 57 2.396 6.986 22.258 1.00 73.42 H new ATOM 0 HD22 ASN A 57 4.148 7.159 22.116 1.00 73.42 H new ATOM 922 N GLY A 58 7.094 7.532 18.283 1.00 41.14 N ATOM 923 CA GLY A 58 8.273 7.359 17.430 1.00 40.05 C ATOM 924 C GLY A 58 7.903 7.491 15.955 1.00 72.43 C ATOM 925 O GLY A 58 7.380 6.556 15.350 1.00 33.42 O ATOM 0 H GLY A 58 6.619 8.428 18.170 1.00 41.14 H new ATOM 0 HA2 GLY A 58 9.026 8.104 17.688 1.00 40.05 H new ATOM 0 HA3 GLY A 58 8.717 6.380 17.611 1.00 40.05 H new ATOM 929 N CYS A 59 8.179 8.660 15.381 1.00 14.40 N ATOM 930 CA CYS A 59 7.867 8.906 13.976 1.00 33.35 C ATOM 931 C CYS A 59 8.375 7.765 13.099 1.00 41.44 C ATOM 932 O CYS A 59 9.382 7.131 13.412 1.00 42.15 O ATOM 933 CB CYS A 59 8.510 10.219 13.521 1.00 0.11 C ATOM 934 SG CYS A 59 8.352 11.460 14.829 1.00 4.12 S ATOM 0 H CYS A 59 8.615 9.446 15.863 1.00 14.40 H new ATOM 0 HA CYS A 59 6.784 8.972 13.875 1.00 33.35 H new ATOM 0 HB2 CYS A 59 9.562 10.057 13.285 1.00 0.11 H new ATOM 0 HB3 CYS A 59 8.029 10.574 12.609 1.00 0.11 H new ATOM 939 N ARG A 60 7.672 7.513 11.994 1.00 3.04 N ATOM 940 CA ARG A 60 8.062 6.447 11.068 1.00 32.43 C ATOM 941 C ARG A 60 8.045 6.969 9.633 1.00 24.23 C ATOM 942 O ARG A 60 7.003 7.387 9.128 1.00 14.42 O ATOM 943 CB ARG A 60 7.097 5.261 11.214 1.00 53.42 C ATOM 944 CG ARG A 60 7.767 3.968 10.736 1.00 71.33 C ATOM 945 CD ARG A 60 6.908 2.769 11.144 1.00 33.12 C ATOM 946 NE ARG A 60 7.558 1.525 10.744 1.00 11.54 N ATOM 947 CZ ARG A 60 7.260 0.372 11.337 1.00 44.42 C ATOM 948 NH1 ARG A 60 6.372 0.340 12.293 1.00 23.53 N ATOM 949 NH2 ARG A 60 7.856 -0.727 10.962 1.00 75.41 N ATOM 0 H ARG A 60 6.836 8.028 11.719 1.00 3.04 H new ATOM 0 HA ARG A 60 9.073 6.115 11.305 1.00 32.43 H new ATOM 0 HB2 ARG A 60 6.792 5.157 12.255 1.00 53.42 H new ATOM 0 HB3 ARG A 60 6.193 5.446 10.634 1.00 53.42 H new ATOM 0 HG2 ARG A 60 7.891 3.989 9.653 1.00 71.33 H new ATOM 0 HG3 ARG A 60 8.763 3.880 11.170 1.00 71.33 H new ATOM 0 HD2 ARG A 60 6.750 2.775 12.223 1.00 33.12 H new ATOM 0 HD3 ARG A 60 5.925 2.841 10.678 1.00 33.12 H new ATOM 0 HE ARG A 60 8.253 1.540 9.997 1.00 11.54 H new ATOM 0 HH11 ARG A 60 5.906 1.199 12.586 1.00 23.53 H new ATOM 0 HH12 ARG A 60 6.144 -0.544 12.748 1.00 23.53 H new ATOM 0 HH21 ARG A 60 8.550 -0.701 10.215 1.00 75.41 H new ATOM 0 HH22 ARG A 60 7.628 -1.611 11.416 1.00 75.41 H new ATOM 963 N LYS A 61 9.208 6.945 8.979 1.00 34.13 N ATOM 964 CA LYS A 61 9.314 7.424 7.598 1.00 32.24 C ATOM 965 C LYS A 61 10.121 6.463 6.730 1.00 65.44 C ATOM 966 O LYS A 61 11.189 5.995 7.123 1.00 30.04 O ATOM 967 CB LYS A 61 9.963 8.811 7.575 1.00 40.21 C ATOM 968 CG LYS A 61 10.256 9.230 6.131 1.00 2.42 C ATOM 969 CD LYS A 61 10.600 10.720 6.093 1.00 20.13 C ATOM 970 CE LYS A 61 10.780 11.165 4.640 1.00 75.42 C ATOM 971 NZ LYS A 61 11.231 12.585 4.608 1.00 71.12 N ATOM 0 H LYS A 61 10.082 6.603 9.378 1.00 34.13 H new ATOM 0 HA LYS A 61 8.306 7.482 7.188 1.00 32.24 H new ATOM 0 HB2 LYS A 61 9.302 9.538 8.046 1.00 40.21 H new ATOM 0 HB3 LYS A 61 10.887 8.799 8.153 1.00 40.21 H new ATOM 0 HG2 LYS A 61 11.084 8.644 5.732 1.00 2.42 H new ATOM 0 HG3 LYS A 61 9.390 9.029 5.500 1.00 2.42 H new ATOM 0 HD2 LYS A 61 9.807 11.299 6.566 1.00 20.13 H new ATOM 0 HD3 LYS A 61 11.513 10.908 6.658 1.00 20.13 H new ATOM 0 HE2 LYS A 61 11.511 10.529 4.141 1.00 75.42 H new ATOM 0 HE3 LYS A 61 9.841 11.058 4.097 1.00 75.42 H new ATOM 0 HZ1 LYS A 61 10.749 13.085 3.834 1.00 71.12 H new ATOM 0 HZ2 LYS A 61 11.000 13.043 5.513 1.00 71.12 H new ATOM 0 HZ3 LYS A 61 12.259 12.619 4.455 1.00 71.12 H new ATOM 985 N TRP A 62 9.594 6.190 5.543 1.00 34.24 N ATOM 986 CA TRP A 62 10.253 5.296 4.592 1.00 72.44 C ATOM 987 C TRP A 62 9.989 5.766 3.163 1.00 74.11 C ATOM 988 O TRP A 62 9.121 6.607 2.933 1.00 73.51 O ATOM 989 CB TRP A 62 9.727 3.870 4.762 1.00 51.14 C ATOM 990 CG TRP A 62 8.269 3.848 4.445 1.00 44.14 C ATOM 991 CD1 TRP A 62 7.743 3.912 3.201 1.00 53.31 C ATOM 992 CD2 TRP A 62 7.142 3.763 5.363 1.00 72.31 C ATOM 993 NE1 TRP A 62 6.364 3.880 3.298 1.00 42.13 N ATOM 994 CE2 TRP A 62 5.947 3.787 4.609 1.00 11.51 C ATOM 995 CE3 TRP A 62 7.042 3.671 6.762 1.00 14.12 C ATOM 996 CZ2 TRP A 62 4.697 3.722 5.220 1.00 53.31 C ATOM 997 CZ3 TRP A 62 5.783 3.606 7.381 1.00 22.34 C ATOM 998 CH2 TRP A 62 4.612 3.630 6.611 1.00 70.10 C ATOM 0 H TRP A 62 8.709 6.575 5.213 1.00 34.24 H new ATOM 0 HA TRP A 62 11.326 5.311 4.785 1.00 72.44 H new ATOM 0 HB2 TRP A 62 10.266 3.189 4.103 1.00 51.14 H new ATOM 0 HB3 TRP A 62 9.895 3.526 5.782 1.00 51.14 H new ATOM 0 HD1 TRP A 62 8.307 3.977 2.282 1.00 53.31 H new ATOM 0 HE1 TRP A 62 5.733 3.920 2.498 1.00 42.13 H new ATOM 0 HE3 TRP A 62 7.938 3.650 7.364 1.00 14.12 H new ATOM 0 HZ2 TRP A 62 3.798 3.743 4.621 1.00 53.31 H new ATOM 0 HZ3 TRP A 62 5.717 3.537 8.457 1.00 22.34 H new ATOM 0 HH2 TRP A 62 3.647 3.577 7.092 1.00 70.10 H new ATOM 1009 N GLU A 63 10.742 5.221 2.208 1.00 22.51 N ATOM 1010 CA GLU A 63 10.580 5.597 0.802 1.00 4.21 C ATOM 1011 C GLU A 63 10.440 4.354 -0.074 1.00 22.40 C ATOM 1012 O GLU A 63 11.038 3.316 0.206 1.00 60.51 O ATOM 1013 CB GLU A 63 11.786 6.420 0.344 1.00 51.41 C ATOM 1014 CG GLU A 63 11.603 6.842 -1.118 1.00 54.12 C ATOM 1015 CD GLU A 63 12.022 5.711 -2.052 1.00 33.43 C ATOM 1016 OE1 GLU A 63 13.016 5.065 -1.760 1.00 70.53 O ATOM 1017 OE2 GLU A 63 11.345 5.507 -3.045 1.00 41.51 O ATOM 0 H GLU A 63 11.465 4.523 2.379 1.00 22.51 H new ATOM 0 HA GLU A 63 9.674 6.195 0.704 1.00 4.21 H new ATOM 0 HB2 GLU A 63 11.897 7.302 0.975 1.00 51.41 H new ATOM 0 HB3 GLU A 63 12.699 5.834 0.451 1.00 51.41 H new ATOM 0 HG2 GLU A 63 10.561 7.106 -1.300 1.00 54.12 H new ATOM 0 HG3 GLU A 63 12.198 7.732 -1.324 1.00 54.12 H new ATOM 1024 N THR A 64 9.638 4.467 -1.134 1.00 73.12 N ATOM 1025 CA THR A 64 9.417 3.342 -2.044 1.00 63.14 C ATOM 1026 C THR A 64 9.409 3.800 -3.498 1.00 22.13 C ATOM 1027 O THR A 64 8.911 4.878 -3.821 1.00 65.14 O ATOM 1028 CB THR A 64 8.077 2.673 -1.733 1.00 23.03 C ATOM 1029 OG1 THR A 64 7.943 2.513 -0.327 1.00 34.22 O ATOM 1030 CG2 THR A 64 8.019 1.304 -2.412 1.00 64.01 C ATOM 0 H THR A 64 9.134 5.319 -1.382 1.00 73.12 H new ATOM 0 HA THR A 64 10.234 2.635 -1.900 1.00 63.14 H new ATOM 0 HB THR A 64 7.264 3.296 -2.106 1.00 23.03 H new ATOM 0 HG1 THR A 64 7.175 3.033 -0.010 1.00 34.22 H new ATOM 0 HG21 THR A 64 7.064 0.828 -2.190 1.00 64.01 H new ATOM 0 HG22 THR A 64 8.121 1.428 -3.490 1.00 64.01 H new ATOM 0 HG23 THR A 64 8.831 0.679 -2.041 1.00 64.01 H new ATOM 1038 N THR A 65 9.950 2.956 -4.373 1.00 10.35 N ATOM 1039 CA THR A 65 9.992 3.254 -5.802 1.00 11.51 C ATOM 1040 C THR A 65 8.906 2.464 -6.523 1.00 61.02 C ATOM 1041 O THR A 65 8.617 1.327 -6.151 1.00 21.33 O ATOM 1042 CB THR A 65 11.362 2.884 -6.375 1.00 51.14 C ATOM 1043 OG1 THR A 65 12.362 3.683 -5.759 1.00 55.12 O ATOM 1044 CG2 THR A 65 11.370 3.127 -7.885 1.00 53.23 C ATOM 0 H THR A 65 10.365 2.060 -4.117 1.00 10.35 H new ATOM 0 HA THR A 65 9.822 4.321 -5.947 1.00 11.51 H new ATOM 0 HB THR A 65 11.565 1.831 -6.179 1.00 51.14 H new ATOM 0 HG1 THR A 65 13.240 3.446 -6.123 1.00 55.12 H new ATOM 0 HG21 THR A 65 12.347 2.863 -8.291 1.00 53.23 H new ATOM 0 HG22 THR A 65 10.603 2.513 -8.356 1.00 53.23 H new ATOM 0 HG23 THR A 65 11.166 4.179 -8.085 1.00 53.23 H new ATOM 1052 N PHE A 66 8.305 3.062 -7.555 1.00 13.41 N ATOM 1053 CA PHE A 66 7.256 2.381 -8.306 1.00 51.23 C ATOM 1054 C PHE A 66 7.653 2.238 -9.771 1.00 44.34 C ATOM 1055 O PHE A 66 8.084 3.199 -10.404 1.00 55.41 O ATOM 1056 CB PHE A 66 5.936 3.170 -8.207 1.00 51.33 C ATOM 1057 CG PHE A 66 5.295 3.239 -9.577 1.00 73.14 C ATOM 1058 CD1 PHE A 66 4.964 2.058 -10.246 1.00 71.33 C ATOM 1059 CD2 PHE A 66 5.068 4.472 -10.190 1.00 12.13 C ATOM 1060 CE1 PHE A 66 4.413 2.110 -11.524 1.00 42.14 C ATOM 1061 CE2 PHE A 66 4.503 4.521 -11.474 1.00 62.23 C ATOM 1062 CZ PHE A 66 4.180 3.339 -12.139 1.00 42.31 C ATOM 0 H PHE A 66 8.525 4.002 -7.883 1.00 13.41 H new ATOM 0 HA PHE A 66 7.118 1.388 -7.878 1.00 51.23 H new ATOM 0 HB2 PHE A 66 5.261 2.687 -7.500 1.00 51.33 H new ATOM 0 HB3 PHE A 66 6.126 4.175 -7.830 1.00 51.33 H new ATOM 0 HD1 PHE A 66 5.136 1.103 -9.771 1.00 71.33 H new ATOM 0 HD2 PHE A 66 5.327 5.387 -9.677 1.00 12.13 H new ATOM 0 HE1 PHE A 66 4.165 1.194 -12.041 1.00 42.14 H new ATOM 0 HE2 PHE A 66 4.318 5.474 -11.947 1.00 62.23 H new ATOM 0 HZ PHE A 66 3.750 3.376 -13.129 1.00 42.31 H new ATOM 1072 N LYS A 67 7.478 1.030 -10.309 1.00 73.13 N ATOM 1073 CA LYS A 67 7.792 0.764 -11.707 1.00 13.11 C ATOM 1074 C LYS A 67 6.544 0.282 -12.448 1.00 21.45 C ATOM 1075 O LYS A 67 5.654 -0.351 -11.854 1.00 52.30 O ATOM 1076 CB LYS A 67 8.884 -0.303 -11.809 1.00 64.24 C ATOM 1077 CG LYS A 67 10.171 0.202 -11.145 1.00 53.34 C ATOM 1078 CD LYS A 67 11.373 -0.545 -11.728 1.00 2.41 C ATOM 1079 CE LYS A 67 12.607 -0.284 -10.864 1.00 62.33 C ATOM 1080 NZ LYS A 67 12.980 1.156 -10.953 1.00 12.12 N ATOM 0 H LYS A 67 7.121 0.224 -9.796 1.00 73.13 H new ATOM 0 HA LYS A 67 8.146 1.689 -12.162 1.00 13.11 H new ATOM 0 HB2 LYS A 67 8.552 -1.222 -11.327 1.00 64.24 H new ATOM 0 HB3 LYS A 67 9.074 -0.542 -12.855 1.00 64.24 H new ATOM 0 HG2 LYS A 67 10.281 1.274 -11.309 1.00 53.34 H new ATOM 0 HG3 LYS A 67 10.121 0.048 -10.067 1.00 53.34 H new ATOM 0 HD2 LYS A 67 11.165 -1.614 -11.769 1.00 2.41 H new ATOM 0 HD3 LYS A 67 11.557 -0.217 -12.751 1.00 2.41 H new ATOM 0 HE2 LYS A 67 12.403 -0.554 -9.828 1.00 62.33 H new ATOM 0 HE3 LYS A 67 13.437 -0.907 -11.198 1.00 62.33 H new ATOM 0 HZ1 LYS A 67 13.320 1.484 -10.027 1.00 12.12 H new ATOM 0 HZ2 LYS A 67 13.733 1.277 -11.661 1.00 12.12 H new ATOM 0 HZ3 LYS A 67 12.148 1.713 -11.234 1.00 12.12 H new ATOM 1094 N LYS A 68 6.476 0.623 -13.737 1.00 3.43 N ATOM 1095 CA LYS A 68 5.335 0.260 -14.580 1.00 21.33 C ATOM 1096 C LYS A 68 5.361 -1.218 -14.953 1.00 72.40 C ATOM 1097 O LYS A 68 6.328 -1.710 -15.535 1.00 23.10 O ATOM 1098 CB LYS A 68 5.351 1.102 -15.857 1.00 53.12 C ATOM 1099 CG LYS A 68 4.080 0.829 -16.665 1.00 53.35 C ATOM 1100 CD LYS A 68 3.943 1.871 -17.777 1.00 31.23 C ATOM 1101 CE LYS A 68 5.195 1.854 -18.657 1.00 15.54 C ATOM 1102 NZ LYS A 68 5.633 0.447 -18.878 1.00 52.14 N ATOM 0 H LYS A 68 7.201 1.152 -14.221 1.00 3.43 H new ATOM 0 HA LYS A 68 4.425 0.453 -14.012 1.00 21.33 H new ATOM 0 HB2 LYS A 68 5.415 2.161 -15.606 1.00 53.12 H new ATOM 0 HB3 LYS A 68 6.232 0.862 -16.453 1.00 53.12 H new ATOM 0 HG2 LYS A 68 4.118 -0.172 -17.094 1.00 53.35 H new ATOM 0 HG3 LYS A 68 3.208 0.863 -16.012 1.00 53.35 H new ATOM 0 HD2 LYS A 68 3.060 1.659 -18.380 1.00 31.23 H new ATOM 0 HD3 LYS A 68 3.804 2.862 -17.345 1.00 31.23 H new ATOM 0 HE2 LYS A 68 4.986 2.335 -19.613 1.00 15.54 H new ATOM 0 HE3 LYS A 68 5.994 2.423 -18.181 1.00 15.54 H new ATOM 0 HZ1 LYS A 68 6.204 0.393 -19.746 1.00 52.14 H new ATOM 0 HZ2 LYS A 68 6.203 0.130 -18.068 1.00 52.14 H new ATOM 0 HZ3 LYS A 68 4.798 -0.165 -18.975 1.00 52.14 H new ATOM 1116 N THR A 69 4.279 -1.920 -14.617 1.00 15.53 N ATOM 1117 CA THR A 69 4.159 -3.346 -14.918 1.00 52.53 C ATOM 1118 C THR A 69 2.826 -3.627 -15.607 1.00 3.13 C ATOM 1119 O THR A 69 1.978 -2.742 -15.720 1.00 60.33 O ATOM 1120 CB THR A 69 4.245 -4.158 -13.625 1.00 54.42 C ATOM 1121 OG1 THR A 69 4.202 -5.544 -13.935 1.00 51.20 O ATOM 1122 CG2 THR A 69 3.069 -3.797 -12.717 1.00 40.11 C ATOM 0 H THR A 69 3.472 -1.523 -14.136 1.00 15.53 H new ATOM 0 HA THR A 69 4.973 -3.634 -15.583 1.00 52.53 H new ATOM 0 HB THR A 69 5.179 -3.930 -13.112 1.00 54.42 H new ATOM 0 HG1 THR A 69 4.259 -6.066 -13.108 1.00 51.20 H new ATOM 0 HG21 THR A 69 3.130 -4.376 -11.795 1.00 40.11 H new ATOM 0 HG22 THR A 69 3.105 -2.733 -12.481 1.00 40.11 H new ATOM 0 HG23 THR A 69 2.133 -4.024 -13.227 1.00 40.11 H new ATOM 1130 N SER A 70 2.647 -4.861 -16.066 1.00 51.44 N ATOM 1131 CA SER A 70 1.411 -5.244 -16.741 1.00 20.11 C ATOM 1132 C SER A 70 0.290 -5.460 -15.728 1.00 64.35 C ATOM 1133 O SER A 70 -0.323 -6.526 -15.682 1.00 41.34 O ATOM 1134 CB SER A 70 1.630 -6.527 -17.543 1.00 55.14 C ATOM 1135 OG SER A 70 1.769 -7.622 -16.647 1.00 40.14 O ATOM 0 H SER A 70 3.336 -5.609 -15.984 1.00 51.44 H new ATOM 0 HA SER A 70 1.124 -4.438 -17.416 1.00 20.11 H new ATOM 0 HB2 SER A 70 0.790 -6.697 -18.216 1.00 55.14 H new ATOM 0 HB3 SER A 70 2.521 -6.434 -18.163 1.00 55.14 H new ATOM 0 HG SER A 70 0.918 -7.779 -16.188 1.00 40.14 H new ATOM 1141 N ASP A 71 0.034 -4.441 -14.912 1.00 62.33 N ATOM 1142 CA ASP A 71 -1.009 -4.530 -13.895 1.00 24.34 C ATOM 1143 C ASP A 71 -2.393 -4.631 -14.534 1.00 41.40 C ATOM 1144 O ASP A 71 -2.873 -5.728 -14.820 1.00 21.04 O ATOM 1145 CB ASP A 71 -0.955 -3.303 -12.988 1.00 22.22 C ATOM 1146 CG ASP A 71 -2.074 -3.370 -11.955 1.00 14.42 C ATOM 1147 OD1 ASP A 71 -1.867 -3.990 -10.926 1.00 53.51 O ATOM 1148 OD2 ASP A 71 -3.123 -2.800 -12.209 1.00 10.44 O ATOM 0 H ASP A 71 0.531 -3.550 -14.935 1.00 62.33 H new ATOM 0 HA ASP A 71 -0.833 -5.431 -13.307 1.00 24.34 H new ATOM 0 HB2 ASP A 71 0.012 -3.253 -12.487 1.00 22.22 H new ATOM 0 HB3 ASP A 71 -1.052 -2.395 -13.584 1.00 22.22 H new ATOM 1153 N ASP A 72 -3.034 -3.484 -14.753 1.00 44.31 N ATOM 1154 CA ASP A 72 -4.364 -3.468 -15.355 1.00 34.55 C ATOM 1155 C ASP A 72 -4.737 -2.065 -15.812 1.00 53.33 C ATOM 1156 O ASP A 72 -5.262 -1.265 -15.039 1.00 52.31 O ATOM 1157 CB ASP A 72 -5.400 -3.975 -14.353 1.00 22.10 C ATOM 1158 CG ASP A 72 -6.796 -3.902 -14.964 1.00 22.13 C ATOM 1159 OD1 ASP A 72 -7.147 -4.812 -15.696 1.00 34.23 O ATOM 1160 OD2 ASP A 72 -7.492 -2.939 -14.689 1.00 61.14 O ATOM 0 H ASP A 72 -2.658 -2.564 -14.525 1.00 44.31 H new ATOM 0 HA ASP A 72 -4.350 -4.124 -16.225 1.00 34.55 H new ATOM 0 HB2 ASP A 72 -5.171 -5.002 -14.069 1.00 22.10 H new ATOM 0 HB3 ASP A 72 -5.361 -3.377 -13.443 1.00 22.10 H new ATOM 1165 N GLY A 73 -4.463 -1.779 -17.078 1.00 23.25 N ATOM 1166 CA GLY A 73 -4.773 -0.474 -17.639 1.00 53.43 C ATOM 1167 C GLY A 73 -3.737 0.555 -17.206 1.00 12.24 C ATOM 1168 O GLY A 73 -2.605 0.550 -17.690 1.00 4.21 O ATOM 0 H GLY A 73 -4.029 -2.431 -17.732 1.00 23.25 H new ATOM 0 HA2 GLY A 73 -4.799 -0.537 -18.727 1.00 53.43 H new ATOM 0 HA3 GLY A 73 -5.765 -0.159 -17.314 1.00 53.43 H new ATOM 1172 N GLU A 74 -4.129 1.429 -16.282 1.00 71.24 N ATOM 1173 CA GLU A 74 -3.220 2.459 -15.774 1.00 22.12 C ATOM 1174 C GLU A 74 -3.054 2.333 -14.262 1.00 50.12 C ATOM 1175 O GLU A 74 -3.768 2.983 -13.502 1.00 62.23 O ATOM 1176 CB GLU A 74 -3.781 3.852 -16.104 1.00 23.30 C ATOM 1177 CG GLU A 74 -3.390 4.249 -17.529 1.00 13.31 C ATOM 1178 CD GLU A 74 -3.980 3.260 -18.528 1.00 60.21 C ATOM 1179 OE1 GLU A 74 -4.982 2.645 -18.201 1.00 30.21 O ATOM 1180 OE2 GLU A 74 -3.422 3.132 -19.605 1.00 43.32 O ATOM 0 H GLU A 74 -5.062 1.447 -15.871 1.00 71.24 H new ATOM 0 HA GLU A 74 -2.248 2.326 -16.250 1.00 22.12 H new ATOM 0 HB2 GLU A 74 -4.866 3.849 -16.003 1.00 23.30 H new ATOM 0 HB3 GLU A 74 -3.397 4.585 -15.395 1.00 23.30 H new ATOM 0 HG2 GLU A 74 -3.749 5.255 -17.746 1.00 13.31 H new ATOM 0 HG3 GLU A 74 -2.304 4.270 -17.624 1.00 13.31 H new ATOM 1187 N VAL A 75 -2.096 1.518 -13.831 1.00 2.15 N ATOM 1188 CA VAL A 75 -1.829 1.339 -12.404 1.00 53.31 C ATOM 1189 C VAL A 75 -0.336 1.309 -12.143 1.00 50.30 C ATOM 1190 O VAL A 75 0.455 0.972 -13.024 1.00 43.11 O ATOM 1191 CB VAL A 75 -2.463 0.066 -11.837 1.00 0.40 C ATOM 1192 CG1 VAL A 75 -2.433 0.126 -10.287 1.00 10.03 C ATOM 1193 CG2 VAL A 75 -3.908 -0.058 -12.339 1.00 74.02 C ATOM 0 H VAL A 75 -1.492 0.972 -14.446 1.00 2.15 H new ATOM 0 HA VAL A 75 -2.283 2.191 -11.898 1.00 53.31 H new ATOM 0 HB VAL A 75 -1.901 -0.807 -12.170 1.00 0.40 H new ATOM 0 HG11 VAL A 75 -2.884 -0.779 -9.879 1.00 10.03 H new ATOM 0 HG12 VAL A 75 -1.401 0.203 -9.946 1.00 10.03 H new ATOM 0 HG13 VAL A 75 -2.994 0.996 -9.946 1.00 10.03 H new ATOM 0 HG21 VAL A 75 -4.357 -0.965 -11.934 1.00 74.02 H new ATOM 0 HG22 VAL A 75 -4.482 0.809 -12.012 1.00 74.02 H new ATOM 0 HG23 VAL A 75 -3.912 -0.106 -13.428 1.00 74.02 H new ATOM 1203 N TYR A 76 0.043 1.696 -10.936 1.00 41.24 N ATOM 1204 CA TYR A 76 1.452 1.750 -10.566 1.00 31.34 C ATOM 1205 C TYR A 76 1.784 0.613 -9.594 1.00 33.21 C ATOM 1206 O TYR A 76 0.948 0.232 -8.781 1.00 53.44 O ATOM 1207 CB TYR A 76 1.721 3.118 -9.932 1.00 0.45 C ATOM 1208 CG TYR A 76 0.971 4.188 -10.711 1.00 33.40 C ATOM 1209 CD1 TYR A 76 0.964 4.171 -12.116 1.00 32.40 C ATOM 1210 CD2 TYR A 76 0.275 5.194 -10.029 1.00 75.13 C ATOM 1211 CE1 TYR A 76 0.266 5.156 -12.827 1.00 63.24 C ATOM 1212 CE2 TYR A 76 -0.424 6.176 -10.742 1.00 11.13 C ATOM 1213 CZ TYR A 76 -0.427 6.157 -12.140 1.00 53.01 C ATOM 1214 OH TYR A 76 -1.116 7.125 -12.842 1.00 25.04 O ATOM 0 H TYR A 76 -0.601 1.977 -10.197 1.00 41.24 H new ATOM 0 HA TYR A 76 2.086 1.624 -11.443 1.00 31.34 H new ATOM 0 HB2 TYR A 76 1.401 3.118 -8.890 1.00 0.45 H new ATOM 0 HB3 TYR A 76 2.790 3.330 -9.937 1.00 0.45 H new ATOM 0 HD1 TYR A 76 1.497 3.398 -12.649 1.00 32.40 H new ATOM 0 HD2 TYR A 76 0.277 5.213 -8.949 1.00 75.13 H new ATOM 0 HE1 TYR A 76 0.263 5.142 -13.907 1.00 63.24 H new ATOM 0 HE2 TYR A 76 -0.961 6.948 -10.212 1.00 11.13 H new ATOM 0 HH TYR A 76 -1.429 6.752 -13.692 1.00 25.04 H new ATOM 1224 N TYR A 77 3.000 0.035 -9.716 1.00 62.44 N ATOM 1225 CA TYR A 77 3.369 -1.104 -8.856 1.00 14.20 C ATOM 1226 C TYR A 77 4.838 -1.091 -8.422 1.00 35.53 C ATOM 1227 O TYR A 77 5.746 -1.059 -9.252 1.00 65.53 O ATOM 1228 CB TYR A 77 3.078 -2.408 -9.629 1.00 11.22 C ATOM 1229 CG TYR A 77 2.430 -3.450 -8.735 1.00 13.50 C ATOM 1230 CD1 TYR A 77 2.862 -3.625 -7.413 1.00 40.43 C ATOM 1231 CD2 TYR A 77 1.395 -4.248 -9.240 1.00 1.34 C ATOM 1232 CE1 TYR A 77 2.258 -4.593 -6.601 1.00 22.15 C ATOM 1233 CE2 TYR A 77 0.795 -5.217 -8.428 1.00 62.04 C ATOM 1234 CZ TYR A 77 1.225 -5.389 -7.108 1.00 21.52 C ATOM 1235 OH TYR A 77 0.634 -6.344 -6.307 1.00 71.13 O ATOM 0 H TYR A 77 3.718 0.328 -10.378 1.00 62.44 H new ATOM 0 HA TYR A 77 2.777 -1.032 -7.944 1.00 14.20 H new ATOM 0 HB2 TYR A 77 2.423 -2.193 -10.474 1.00 11.22 H new ATOM 0 HB3 TYR A 77 4.007 -2.805 -10.038 1.00 11.22 H new ATOM 0 HD1 TYR A 77 3.661 -3.013 -7.021 1.00 40.43 H new ATOM 0 HD2 TYR A 77 1.060 -4.115 -10.258 1.00 1.34 H new ATOM 0 HE1 TYR A 77 2.590 -4.725 -5.582 1.00 22.15 H new ATOM 0 HE2 TYR A 77 -0.001 -5.833 -8.821 1.00 62.04 H new ATOM 0 HH TYR A 77 0.608 -7.200 -6.783 1.00 71.13 H new ATOM 1245 N SER A 78 5.054 -1.170 -7.106 1.00 52.42 N ATOM 1246 CA SER A 78 6.403 -1.223 -6.547 1.00 33.40 C ATOM 1247 C SER A 78 6.745 -2.673 -6.200 1.00 2.11 C ATOM 1248 O SER A 78 6.274 -3.215 -5.200 1.00 13.25 O ATOM 1249 CB SER A 78 6.486 -0.357 -5.289 1.00 32.11 C ATOM 1250 OG SER A 78 7.731 -0.588 -4.643 1.00 13.05 O ATOM 0 H SER A 78 4.310 -1.199 -6.409 1.00 52.42 H new ATOM 0 HA SER A 78 7.113 -0.843 -7.281 1.00 33.40 H new ATOM 0 HB2 SER A 78 6.389 0.696 -5.551 1.00 32.11 H new ATOM 0 HB3 SER A 78 5.663 -0.595 -4.615 1.00 32.11 H new ATOM 0 HG SER A 78 8.422 -0.027 -5.053 1.00 13.05 H new ATOM 1256 N GLU A 79 7.541 -3.296 -7.059 1.00 53.42 N ATOM 1257 CA GLU A 79 7.924 -4.696 -6.879 1.00 22.02 C ATOM 1258 C GLU A 79 8.528 -4.961 -5.497 1.00 4.50 C ATOM 1259 O GLU A 79 8.275 -6.005 -4.896 1.00 64.42 O ATOM 1260 CB GLU A 79 8.936 -5.094 -7.955 1.00 64.13 C ATOM 1261 CG GLU A 79 9.124 -6.613 -7.944 1.00 32.42 C ATOM 1262 CD GLU A 79 10.203 -7.012 -8.945 1.00 73.51 C ATOM 1263 OE1 GLU A 79 10.740 -6.127 -9.591 1.00 13.33 O ATOM 1264 OE2 GLU A 79 10.475 -8.196 -9.052 1.00 40.23 O ATOM 0 H GLU A 79 7.936 -2.856 -7.890 1.00 53.42 H new ATOM 0 HA GLU A 79 7.017 -5.294 -6.966 1.00 22.02 H new ATOM 0 HB2 GLU A 79 8.588 -4.767 -8.935 1.00 64.13 H new ATOM 0 HB3 GLU A 79 9.889 -4.598 -7.774 1.00 64.13 H new ATOM 0 HG2 GLU A 79 9.403 -6.946 -6.944 1.00 32.42 H new ATOM 0 HG3 GLU A 79 8.184 -7.106 -8.194 1.00 32.42 H new ATOM 1271 N GLU A 80 9.349 -4.036 -5.016 1.00 14.34 N ATOM 1272 CA GLU A 80 10.010 -4.211 -3.722 1.00 1.03 C ATOM 1273 C GLU A 80 9.029 -4.189 -2.547 1.00 32.02 C ATOM 1274 O GLU A 80 9.209 -4.924 -1.575 1.00 62.24 O ATOM 1275 CB GLU A 80 11.050 -3.106 -3.525 1.00 21.40 C ATOM 1276 CG GLU A 80 12.161 -3.260 -4.565 1.00 55.13 C ATOM 1277 CD GLU A 80 13.248 -2.217 -4.326 1.00 55.42 C ATOM 1278 OE1 GLU A 80 13.016 -1.321 -3.532 1.00 13.24 O ATOM 1279 OE2 GLU A 80 14.295 -2.331 -4.940 1.00 52.05 O ATOM 0 H GLU A 80 9.574 -3.164 -5.494 1.00 14.34 H new ATOM 0 HA GLU A 80 10.483 -5.193 -3.736 1.00 1.03 H new ATOM 0 HB2 GLU A 80 10.579 -2.128 -3.622 1.00 21.40 H new ATOM 0 HB3 GLU A 80 11.468 -3.160 -2.520 1.00 21.40 H new ATOM 0 HG2 GLU A 80 12.588 -4.261 -4.508 1.00 55.13 H new ATOM 0 HG3 GLU A 80 11.750 -3.145 -5.568 1.00 55.13 H new ATOM 1286 N ALA A 81 8.018 -3.327 -2.614 1.00 20.24 N ATOM 1287 CA ALA A 81 7.049 -3.204 -1.519 1.00 42.22 C ATOM 1288 C ALA A 81 5.715 -3.874 -1.842 1.00 23.30 C ATOM 1289 O ALA A 81 4.741 -3.682 -1.114 1.00 15.54 O ATOM 1290 CB ALA A 81 6.803 -1.725 -1.218 1.00 33.54 C ATOM 0 H ALA A 81 7.846 -2.707 -3.405 1.00 20.24 H new ATOM 0 HA ALA A 81 7.475 -3.710 -0.653 1.00 42.22 H new ATOM 0 HB1 ALA A 81 6.083 -1.634 -0.405 1.00 33.54 H new ATOM 0 HB2 ALA A 81 7.741 -1.252 -0.927 1.00 33.54 H new ATOM 0 HB3 ALA A 81 6.409 -1.233 -2.108 1.00 33.54 H new ATOM 1296 N LYS A 82 5.667 -4.656 -2.920 1.00 42.01 N ATOM 1297 CA LYS A 82 4.425 -5.339 -3.308 1.00 74.32 C ATOM 1298 C LYS A 82 3.216 -4.474 -2.958 1.00 54.44 C ATOM 1299 O LYS A 82 2.318 -4.888 -2.216 1.00 13.43 O ATOM 1300 CB LYS A 82 4.320 -6.691 -2.598 1.00 34.34 C ATOM 1301 CG LYS A 82 5.418 -7.624 -3.117 1.00 0.32 C ATOM 1302 CD LYS A 82 5.408 -8.937 -2.321 1.00 35.42 C ATOM 1303 CE LYS A 82 4.282 -9.847 -2.824 1.00 21.43 C ATOM 1304 NZ LYS A 82 4.426 -11.196 -2.209 1.00 62.44 N ATOM 0 H LYS A 82 6.461 -4.833 -3.536 1.00 42.01 H new ATOM 0 HA LYS A 82 4.442 -5.505 -4.385 1.00 74.32 H new ATOM 0 HB2 LYS A 82 4.420 -6.557 -1.521 1.00 34.34 H new ATOM 0 HB3 LYS A 82 3.339 -7.132 -2.775 1.00 34.34 H new ATOM 0 HG2 LYS A 82 5.262 -7.830 -4.176 1.00 0.32 H new ATOM 0 HG3 LYS A 82 6.391 -7.141 -3.026 1.00 0.32 H new ATOM 0 HD2 LYS A 82 6.368 -9.442 -2.425 1.00 35.42 H new ATOM 0 HD3 LYS A 82 5.271 -8.728 -1.260 1.00 35.42 H new ATOM 0 HE2 LYS A 82 3.312 -9.420 -2.568 1.00 21.43 H new ATOM 0 HE3 LYS A 82 4.320 -9.924 -3.911 1.00 21.43 H new ATOM 0 HZ1 LYS A 82 3.563 -11.750 -2.382 1.00 62.44 H new ATOM 0 HZ2 LYS A 82 5.242 -11.684 -2.631 1.00 62.44 H new ATOM 0 HZ3 LYS A 82 4.574 -11.096 -1.184 1.00 62.44 H new ATOM 1318 N LYS A 83 3.218 -3.272 -3.515 1.00 32.32 N ATOM 1319 CA LYS A 83 2.141 -2.314 -3.285 1.00 20.41 C ATOM 1320 C LYS A 83 1.933 -1.444 -4.515 1.00 12.15 C ATOM 1321 O LYS A 83 2.888 -0.930 -5.098 1.00 62.32 O ATOM 1322 CB LYS A 83 2.472 -1.430 -2.082 1.00 53.34 C ATOM 1323 CG LYS A 83 1.370 -0.382 -1.900 1.00 51.31 C ATOM 1324 CD LYS A 83 1.563 0.340 -0.563 1.00 35.34 C ATOM 1325 CE LYS A 83 2.943 1.004 -0.524 1.00 72.41 C ATOM 1326 NZ LYS A 83 3.962 0.008 -0.090 1.00 63.53 N ATOM 0 H LYS A 83 3.956 -2.934 -4.133 1.00 32.32 H new ATOM 0 HA LYS A 83 1.224 -2.868 -3.084 1.00 20.41 H new ATOM 0 HB2 LYS A 83 2.561 -2.040 -1.183 1.00 53.34 H new ATOM 0 HB3 LYS A 83 3.434 -0.940 -2.231 1.00 53.34 H new ATOM 0 HG2 LYS A 83 1.398 0.336 -2.720 1.00 51.31 H new ATOM 0 HG3 LYS A 83 0.391 -0.860 -1.928 1.00 51.31 H new ATOM 0 HD2 LYS A 83 0.784 1.091 -0.430 1.00 35.34 H new ATOM 0 HD3 LYS A 83 1.467 -0.368 0.260 1.00 35.34 H new ATOM 0 HE2 LYS A 83 3.198 1.395 -1.509 1.00 72.41 H new ATOM 0 HE3 LYS A 83 2.932 1.851 0.162 1.00 72.41 H new ATOM 0 HZ1 LYS A 83 4.915 0.391 -0.256 1.00 63.53 H new ATOM 0 HZ2 LYS A 83 3.842 -0.193 0.923 1.00 63.53 H new ATOM 0 HZ3 LYS A 83 3.842 -0.870 -0.634 1.00 63.53 H new ATOM 1340 N LYS A 84 0.678 -1.306 -4.915 1.00 63.04 N ATOM 1341 CA LYS A 84 0.332 -0.520 -6.095 1.00 54.11 C ATOM 1342 C LYS A 84 -0.739 0.503 -5.774 1.00 33.54 C ATOM 1343 O LYS A 84 -1.654 0.236 -4.996 1.00 25.45 O ATOM 1344 CB LYS A 84 -0.178 -1.465 -7.193 1.00 73.22 C ATOM 1345 CG LYS A 84 -0.908 -2.647 -6.549 1.00 33.44 C ATOM 1346 CD LYS A 84 -1.767 -3.356 -7.599 1.00 43.33 C ATOM 1347 CE LYS A 84 -2.232 -4.707 -7.050 1.00 24.33 C ATOM 1348 NZ LYS A 84 -3.286 -5.270 -7.941 1.00 2.52 N ATOM 0 H LYS A 84 -0.120 -1.728 -4.441 1.00 63.04 H new ATOM 0 HA LYS A 84 1.221 0.011 -6.434 1.00 54.11 H new ATOM 0 HB2 LYS A 84 -0.850 -0.931 -7.865 1.00 73.22 H new ATOM 0 HB3 LYS A 84 0.656 -1.824 -7.796 1.00 73.22 H new ATOM 0 HG2 LYS A 84 -0.186 -3.345 -6.124 1.00 33.44 H new ATOM 0 HG3 LYS A 84 -1.534 -2.297 -5.729 1.00 33.44 H new ATOM 0 HD2 LYS A 84 -2.629 -2.740 -7.856 1.00 43.33 H new ATOM 0 HD3 LYS A 84 -1.194 -3.501 -8.515 1.00 43.33 H new ATOM 0 HE2 LYS A 84 -1.389 -5.395 -6.986 1.00 24.33 H new ATOM 0 HE3 LYS A 84 -2.622 -4.586 -6.039 1.00 24.33 H new ATOM 0 HZ1 LYS A 84 -3.602 -6.188 -7.568 1.00 2.52 H new ATOM 0 HZ2 LYS A 84 -4.093 -4.616 -7.980 1.00 2.52 H new ATOM 0 HZ3 LYS A 84 -2.899 -5.400 -8.898 1.00 2.52 H new ATOM 1362 N VAL A 85 -0.633 1.671 -6.409 1.00 35.51 N ATOM 1363 CA VAL A 85 -1.620 2.717 -6.210 1.00 1.33 C ATOM 1364 C VAL A 85 -2.142 3.209 -7.553 1.00 13.53 C ATOM 1365 O VAL A 85 -1.375 3.476 -8.479 1.00 51.21 O ATOM 1366 CB VAL A 85 -1.046 3.858 -5.344 1.00 60.34 C ATOM 1367 CG1 VAL A 85 -0.239 3.247 -4.196 1.00 14.11 C ATOM 1368 CG2 VAL A 85 -0.141 4.852 -6.128 1.00 43.32 C ATOM 0 H VAL A 85 0.119 1.909 -7.056 1.00 35.51 H new ATOM 0 HA VAL A 85 -2.469 2.308 -5.662 1.00 1.33 H new ATOM 0 HB VAL A 85 -1.896 4.435 -4.981 1.00 60.34 H new ATOM 0 HG11 VAL A 85 0.172 4.044 -3.576 1.00 14.11 H new ATOM 0 HG12 VAL A 85 -0.889 2.615 -3.591 1.00 14.11 H new ATOM 0 HG13 VAL A 85 0.575 2.647 -4.603 1.00 14.11 H new ATOM 0 HG21 VAL A 85 0.223 5.624 -5.451 1.00 43.32 H new ATOM 0 HG22 VAL A 85 0.706 4.314 -6.554 1.00 43.32 H new ATOM 0 HG23 VAL A 85 -0.717 5.315 -6.929 1.00 43.32 H new ATOM 1378 N GLU A 86 -3.473 3.265 -7.658 1.00 22.14 N ATOM 1379 CA GLU A 86 -4.131 3.654 -8.905 1.00 64.25 C ATOM 1380 C GLU A 86 -4.943 4.922 -8.725 1.00 70.44 C ATOM 1381 O GLU A 86 -5.706 5.069 -7.773 1.00 75.21 O ATOM 1382 CB GLU A 86 -5.067 2.536 -9.366 1.00 54.40 C ATOM 1383 CG GLU A 86 -5.609 2.865 -10.758 1.00 1.34 C ATOM 1384 CD GLU A 86 -6.533 1.751 -11.237 1.00 40.41 C ATOM 1385 OE1 GLU A 86 -6.752 0.822 -10.478 1.00 61.22 O ATOM 1386 OE2 GLU A 86 -7.006 1.841 -12.358 1.00 62.22 O ATOM 0 H GLU A 86 -4.113 3.046 -6.895 1.00 22.14 H new ATOM 0 HA GLU A 86 -3.355 3.833 -9.650 1.00 64.25 H new ATOM 0 HB2 GLU A 86 -4.533 1.586 -9.387 1.00 54.40 H new ATOM 0 HB3 GLU A 86 -5.891 2.423 -8.661 1.00 54.40 H new ATOM 0 HG2 GLU A 86 -6.150 3.811 -10.732 1.00 1.34 H new ATOM 0 HG3 GLU A 86 -4.783 2.989 -11.458 1.00 1.34 H new ATOM 1393 N VAL A 87 -4.713 5.849 -9.637 1.00 2.52 N ATOM 1394 CA VAL A 87 -5.358 7.150 -9.594 1.00 1.41 C ATOM 1395 C VAL A 87 -6.685 7.202 -10.363 1.00 50.33 C ATOM 1396 O VAL A 87 -6.698 7.364 -11.583 1.00 15.04 O ATOM 1397 CB VAL A 87 -4.378 8.166 -10.180 1.00 33.21 C ATOM 1398 CG1 VAL A 87 -4.144 7.887 -11.679 1.00 33.42 C ATOM 1399 CG2 VAL A 87 -4.944 9.561 -9.990 1.00 43.40 C ATOM 0 H VAL A 87 -4.077 5.723 -10.425 1.00 2.52 H new ATOM 0 HA VAL A 87 -5.608 7.373 -8.557 1.00 1.41 H new ATOM 0 HB VAL A 87 -3.420 8.084 -9.666 1.00 33.21 H new ATOM 0 HG11 VAL A 87 -3.444 8.620 -12.080 1.00 33.42 H new ATOM 0 HG12 VAL A 87 -3.732 6.885 -11.803 1.00 33.42 H new ATOM 0 HG13 VAL A 87 -5.091 7.959 -12.215 1.00 33.42 H new ATOM 0 HG21 VAL A 87 -4.252 10.294 -10.405 1.00 43.40 H new ATOM 0 HG22 VAL A 87 -5.903 9.637 -10.502 1.00 43.40 H new ATOM 0 HG23 VAL A 87 -5.084 9.755 -8.927 1.00 43.40 H new ATOM 1409 N LEU A 88 -7.807 7.083 -9.641 1.00 71.42 N ATOM 1410 CA LEU A 88 -9.114 7.148 -10.301 1.00 15.35 C ATOM 1411 C LEU A 88 -9.457 8.604 -10.572 1.00 2.33 C ATOM 1412 O LEU A 88 -9.705 8.990 -11.714 1.00 34.13 O ATOM 1413 CB LEU A 88 -10.238 6.526 -9.444 1.00 74.33 C ATOM 1414 CG LEU A 88 -9.735 5.314 -8.645 1.00 43.14 C ATOM 1415 CD1 LEU A 88 -8.852 4.424 -9.530 1.00 63.22 C ATOM 1416 CD2 LEU A 88 -8.950 5.777 -7.401 1.00 50.24 C ATOM 0 H LEU A 88 -7.837 6.945 -8.631 1.00 71.42 H new ATOM 0 HA LEU A 88 -9.045 6.577 -11.227 1.00 15.35 H new ATOM 0 HB2 LEU A 88 -10.631 7.277 -8.758 1.00 74.33 H new ATOM 0 HB3 LEU A 88 -11.062 6.221 -10.089 1.00 74.33 H new ATOM 0 HG LEU A 88 -10.597 4.734 -8.315 1.00 43.14 H new ATOM 0 HD11 LEU A 88 -8.502 3.569 -8.952 1.00 63.22 H new ATOM 0 HD12 LEU A 88 -9.430 4.072 -10.384 1.00 63.22 H new ATOM 0 HD13 LEU A 88 -7.995 4.998 -9.883 1.00 63.22 H new ATOM 0 HD21 LEU A 88 -8.601 4.906 -6.846 1.00 50.24 H new ATOM 0 HD22 LEU A 88 -8.094 6.376 -7.713 1.00 50.24 H new ATOM 0 HD23 LEU A 88 -9.599 6.377 -6.763 1.00 50.24 H new ATOM 1428 N ASP A 89 -9.463 9.418 -9.516 1.00 60.22 N ATOM 1429 CA ASP A 89 -9.768 10.841 -9.642 1.00 13.11 C ATOM 1430 C ASP A 89 -8.686 11.641 -8.931 1.00 71.02 C ATOM 1431 O ASP A 89 -8.337 11.346 -7.788 1.00 73.23 O ATOM 1432 CB ASP A 89 -11.128 11.151 -9.009 1.00 12.20 C ATOM 1433 CG ASP A 89 -11.613 12.524 -9.461 1.00 71.45 C ATOM 1434 OD1 ASP A 89 -10.836 13.230 -10.082 1.00 2.22 O ATOM 1435 OD2 ASP A 89 -12.755 12.850 -9.180 1.00 55.02 O ATOM 0 H ASP A 89 -9.260 9.115 -8.564 1.00 60.22 H new ATOM 0 HA ASP A 89 -9.803 11.110 -10.698 1.00 13.11 H new ATOM 0 HB2 ASP A 89 -11.853 10.388 -9.293 1.00 12.20 H new ATOM 0 HB3 ASP A 89 -11.047 11.124 -7.922 1.00 12.20 H new ATOM 1440 N THR A 90 -8.133 12.632 -9.616 1.00 41.23 N ATOM 1441 CA THR A 90 -7.064 13.439 -9.041 1.00 43.32 C ATOM 1442 C THR A 90 -7.178 14.886 -9.528 1.00 71.42 C ATOM 1443 O THR A 90 -7.176 15.151 -10.730 1.00 3.31 O ATOM 1444 CB THR A 90 -5.725 12.788 -9.446 1.00 10.50 C ATOM 1445 OG1 THR A 90 -4.706 12.984 -8.459 1.00 24.53 O ATOM 1446 CG2 THR A 90 -5.252 13.338 -10.786 1.00 21.23 C ATOM 0 H THR A 90 -8.404 12.896 -10.563 1.00 41.23 H new ATOM 0 HA THR A 90 -7.131 13.473 -7.954 1.00 43.32 H new ATOM 0 HB THR A 90 -5.905 11.716 -9.530 1.00 10.50 H new ATOM 0 HG1 THR A 90 -3.877 12.554 -8.755 1.00 24.53 H new ATOM 0 HG21 THR A 90 -4.306 12.869 -11.058 1.00 21.23 H new ATOM 0 HG22 THR A 90 -5.998 13.122 -11.551 1.00 21.23 H new ATOM 0 HG23 THR A 90 -5.113 14.416 -10.708 1.00 21.23 H new ATOM 1454 N ASP A 91 -7.281 15.815 -8.585 1.00 12.43 N ATOM 1455 CA ASP A 91 -7.396 17.230 -8.931 1.00 32.40 C ATOM 1456 C ASP A 91 -6.033 17.779 -9.322 1.00 54.15 C ATOM 1457 O ASP A 91 -5.928 18.714 -10.116 1.00 12.41 O ATOM 1458 CB ASP A 91 -7.939 18.020 -7.743 1.00 10.41 C ATOM 1459 CG ASP A 91 -8.331 19.425 -8.187 1.00 54.10 C ATOM 1460 OD1 ASP A 91 -7.467 20.287 -8.187 1.00 11.43 O ATOM 1461 OD2 ASP A 91 -9.488 19.618 -8.520 1.00 55.21 O ATOM 0 H ASP A 91 -7.287 15.619 -7.584 1.00 12.43 H new ATOM 0 HA ASP A 91 -8.083 17.330 -9.771 1.00 32.40 H new ATOM 0 HB2 ASP A 91 -8.804 17.509 -7.320 1.00 10.41 H new ATOM 0 HB3 ASP A 91 -7.186 18.075 -6.957 1.00 10.41 H new ATOM 1466 N TYR A 92 -4.993 17.183 -8.751 1.00 21.14 N ATOM 1467 CA TYR A 92 -3.623 17.598 -9.028 1.00 20.30 C ATOM 1468 C TYR A 92 -3.393 19.041 -8.572 1.00 24.21 C ATOM 1469 O TYR A 92 -2.414 19.665 -8.982 1.00 41.10 O ATOM 1470 CB TYR A 92 -3.330 17.496 -10.549 1.00 53.22 C ATOM 1471 CG TYR A 92 -2.466 16.292 -10.866 1.00 13.25 C ATOM 1472 CD1 TYR A 92 -1.232 16.131 -10.234 1.00 3.53 C ATOM 1473 CD2 TYR A 92 -2.901 15.341 -11.800 1.00 61.01 C ATOM 1474 CE1 TYR A 92 -0.433 15.020 -10.528 1.00 33.00 C ATOM 1475 CE2 TYR A 92 -2.103 14.232 -12.094 1.00 61.10 C ATOM 1476 CZ TYR A 92 -0.871 14.071 -11.455 1.00 63.53 C ATOM 1477 OH TYR A 92 -0.088 12.975 -11.740 1.00 11.54 O ATOM 0 H TYR A 92 -5.073 16.409 -8.092 1.00 21.14 H new ATOM 0 HA TYR A 92 -2.953 16.937 -8.479 1.00 20.30 H new ATOM 0 HB2 TYR A 92 -4.269 17.427 -11.098 1.00 53.22 H new ATOM 0 HB3 TYR A 92 -2.830 18.404 -10.886 1.00 53.22 H new ATOM 0 HD1 TYR A 92 -0.893 16.864 -9.517 1.00 3.53 H new ATOM 0 HD2 TYR A 92 -3.854 15.466 -12.293 1.00 61.01 H new ATOM 0 HE1 TYR A 92 0.522 14.896 -10.038 1.00 33.00 H new ATOM 0 HE2 TYR A 92 -2.438 13.500 -12.814 1.00 61.10 H new ATOM 0 HH TYR A 92 -0.629 12.296 -12.194 1.00 11.54 H new ATOM 1487 N LYS A 93 -4.285 19.591 -7.744 1.00 53.41 N ATOM 1488 CA LYS A 93 -4.115 20.973 -7.306 1.00 75.44 C ATOM 1489 C LYS A 93 -4.893 21.265 -6.020 1.00 25.03 C ATOM 1490 O LYS A 93 -4.602 22.237 -5.327 1.00 51.50 O ATOM 1491 CB LYS A 93 -4.612 21.910 -8.408 1.00 14.33 C ATOM 1492 CG LYS A 93 -4.004 23.304 -8.223 1.00 41.01 C ATOM 1493 CD LYS A 93 -4.800 24.325 -9.038 1.00 31.43 C ATOM 1494 CE LYS A 93 -4.680 23.998 -10.527 1.00 11.33 C ATOM 1495 NZ LYS A 93 -5.145 25.164 -11.331 1.00 15.34 N ATOM 0 H LYS A 93 -5.108 19.115 -7.374 1.00 53.41 H new ATOM 0 HA LYS A 93 -3.056 21.133 -7.104 1.00 75.44 H new ATOM 0 HB2 LYS A 93 -4.340 21.512 -9.386 1.00 14.33 H new ATOM 0 HB3 LYS A 93 -5.700 21.972 -8.381 1.00 14.33 H new ATOM 0 HG2 LYS A 93 -4.014 23.579 -7.168 1.00 41.01 H new ATOM 0 HG3 LYS A 93 -2.962 23.302 -8.542 1.00 41.01 H new ATOM 0 HD2 LYS A 93 -5.847 24.310 -8.735 1.00 31.43 H new ATOM 0 HD3 LYS A 93 -4.426 25.331 -8.845 1.00 31.43 H new ATOM 0 HE2 LYS A 93 -3.646 23.760 -10.776 1.00 11.33 H new ATOM 0 HE3 LYS A 93 -5.276 23.117 -10.766 1.00 11.33 H new ATOM 0 HZ1 LYS A 93 -5.064 24.942 -12.344 1.00 15.34 H new ATOM 0 HZ2 LYS A 93 -6.138 25.371 -11.101 1.00 15.34 H new ATOM 0 HZ3 LYS A 93 -4.558 25.994 -11.110 1.00 15.34 H new ATOM 1509 N SER A 94 -5.895 20.440 -5.717 1.00 32.43 N ATOM 1510 CA SER A 94 -6.714 20.655 -4.517 1.00 4.11 C ATOM 1511 C SER A 94 -6.842 19.377 -3.694 1.00 32.02 C ATOM 1512 O SER A 94 -6.540 19.366 -2.500 1.00 70.34 O ATOM 1513 CB SER A 94 -8.106 21.135 -4.925 1.00 72.20 C ATOM 1514 OG SER A 94 -7.981 22.216 -5.841 1.00 51.42 O ATOM 0 H SER A 94 -6.159 19.628 -6.274 1.00 32.43 H new ATOM 0 HA SER A 94 -6.222 21.410 -3.904 1.00 4.11 H new ATOM 0 HB2 SER A 94 -8.665 20.319 -5.382 1.00 72.20 H new ATOM 0 HB3 SER A 94 -8.666 21.452 -4.045 1.00 72.20 H new ATOM 0 HG SER A 94 -7.815 21.865 -6.741 1.00 51.42 H new ATOM 1520 N TYR A 95 -7.298 18.308 -4.331 1.00 55.23 N ATOM 1521 CA TYR A 95 -7.470 17.033 -3.641 1.00 10.25 C ATOM 1522 C TYR A 95 -7.514 15.888 -4.644 1.00 15.01 C ATOM 1523 O TYR A 95 -7.693 16.111 -5.841 1.00 62.22 O ATOM 1524 CB TYR A 95 -8.766 17.051 -2.829 1.00 62.10 C ATOM 1525 CG TYR A 95 -9.906 17.485 -3.718 1.00 44.32 C ATOM 1526 CD1 TYR A 95 -10.540 16.554 -4.549 1.00 41.20 C ATOM 1527 CD2 TYR A 95 -10.330 18.820 -3.714 1.00 31.43 C ATOM 1528 CE1 TYR A 95 -11.596 16.956 -5.374 1.00 10.40 C ATOM 1529 CE2 TYR A 95 -11.386 19.223 -4.539 1.00 15.31 C ATOM 1530 CZ TYR A 95 -12.019 18.290 -5.369 1.00 3.43 C ATOM 1531 OH TYR A 95 -13.061 18.687 -6.183 1.00 2.42 O ATOM 0 H TYR A 95 -7.555 18.295 -5.318 1.00 55.23 H new ATOM 0 HA TYR A 95 -6.623 16.884 -2.971 1.00 10.25 H new ATOM 0 HB2 TYR A 95 -8.966 16.061 -2.419 1.00 62.10 H new ATOM 0 HB3 TYR A 95 -8.669 17.732 -1.984 1.00 62.10 H new ATOM 0 HD1 TYR A 95 -10.214 15.524 -4.553 1.00 41.20 H new ATOM 0 HD2 TYR A 95 -9.841 19.539 -3.073 1.00 31.43 H new ATOM 0 HE1 TYR A 95 -12.085 16.237 -6.015 1.00 10.40 H new ATOM 0 HE2 TYR A 95 -11.712 20.253 -4.535 1.00 15.31 H new ATOM 0 HH TYR A 95 -13.228 19.644 -6.057 1.00 2.42 H new ATOM 1541 N ALA A 96 -7.343 14.661 -4.162 1.00 33.31 N ATOM 1542 CA ALA A 96 -7.362 13.505 -5.052 1.00 74.55 C ATOM 1543 C ALA A 96 -7.776 12.235 -4.316 1.00 74.33 C ATOM 1544 O ALA A 96 -7.466 12.053 -3.139 1.00 15.54 O ATOM 1545 CB ALA A 96 -5.974 13.304 -5.663 1.00 75.12 C ATOM 0 H ALA A 96 -7.192 14.443 -3.177 1.00 33.31 H new ATOM 0 HA ALA A 96 -8.095 13.699 -5.835 1.00 74.55 H new ATOM 0 HB1 ALA A 96 -5.991 12.440 -6.327 1.00 75.12 H new ATOM 0 HB2 ALA A 96 -5.694 14.192 -6.229 1.00 75.12 H new ATOM 0 HB3 ALA A 96 -5.247 13.136 -4.868 1.00 75.12 H new ATOM 1551 N VAL A 97 -8.464 11.353 -5.036 1.00 30.22 N ATOM 1552 CA VAL A 97 -8.911 10.074 -4.480 1.00 42.51 C ATOM 1553 C VAL A 97 -8.185 8.961 -5.212 1.00 44.40 C ATOM 1554 O VAL A 97 -8.239 8.903 -6.441 1.00 60.30 O ATOM 1555 CB VAL A 97 -10.422 9.910 -4.678 1.00 65.01 C ATOM 1556 CG1 VAL A 97 -10.921 8.685 -3.901 1.00 64.11 C ATOM 1557 CG2 VAL A 97 -11.144 11.170 -4.185 1.00 22.32 C ATOM 0 H VAL A 97 -8.726 11.500 -6.011 1.00 30.22 H new ATOM 0 HA VAL A 97 -8.693 10.039 -3.413 1.00 42.51 H new ATOM 0 HB VAL A 97 -10.632 9.766 -5.738 1.00 65.01 H new ATOM 0 HG11 VAL A 97 -11.996 8.575 -4.046 1.00 64.11 H new ATOM 0 HG12 VAL A 97 -10.412 7.792 -4.264 1.00 64.11 H new ATOM 0 HG13 VAL A 97 -10.710 8.817 -2.840 1.00 64.11 H new ATOM 0 HG21 VAL A 97 -12.218 11.052 -4.326 1.00 22.32 H new ATOM 0 HG22 VAL A 97 -10.931 11.321 -3.127 1.00 22.32 H new ATOM 0 HG23 VAL A 97 -10.796 12.034 -4.751 1.00 22.32 H new ATOM 1567 N ILE A 98 -7.458 8.105 -4.491 1.00 25.41 N ATOM 1568 CA ILE A 98 -6.687 7.048 -5.139 1.00 61.15 C ATOM 1569 C ILE A 98 -6.981 5.678 -4.528 1.00 32.24 C ATOM 1570 O ILE A 98 -7.234 5.555 -3.326 1.00 53.35 O ATOM 1571 CB ILE A 98 -5.206 7.373 -4.954 1.00 61.10 C ATOM 1572 CG1 ILE A 98 -4.948 8.814 -5.415 1.00 14.24 C ATOM 1573 CG2 ILE A 98 -4.330 6.411 -5.767 1.00 62.13 C ATOM 1574 CD1 ILE A 98 -3.522 9.223 -5.054 1.00 44.22 C ATOM 0 H ILE A 98 -7.388 8.123 -3.474 1.00 25.41 H new ATOM 0 HA ILE A 98 -6.959 7.004 -6.193 1.00 61.15 H new ATOM 0 HB ILE A 98 -4.951 7.263 -3.900 1.00 61.10 H new ATOM 0 HG12 ILE A 98 -5.098 8.894 -6.492 1.00 14.24 H new ATOM 0 HG13 ILE A 98 -5.661 9.490 -4.943 1.00 14.24 H new ATOM 0 HG21 ILE A 98 -3.280 6.662 -5.619 1.00 62.13 H new ATOM 0 HG22 ILE A 98 -4.509 5.388 -5.436 1.00 62.13 H new ATOM 0 HG23 ILE A 98 -4.579 6.498 -6.825 1.00 62.13 H new ATOM 0 HD11 ILE A 98 -3.343 10.247 -5.383 1.00 44.22 H new ATOM 0 HD12 ILE A 98 -3.388 9.160 -3.974 1.00 44.22 H new ATOM 0 HD13 ILE A 98 -2.816 8.555 -5.547 1.00 44.22 H new ATOM 1586 N TYR A 99 -6.943 4.656 -5.381 1.00 53.24 N ATOM 1587 CA TYR A 99 -7.198 3.284 -4.952 1.00 23.15 C ATOM 1588 C TYR A 99 -5.879 2.564 -4.675 1.00 61.34 C ATOM 1589 O TYR A 99 -5.098 2.292 -5.586 1.00 12.32 O ATOM 1590 CB TYR A 99 -7.977 2.534 -6.037 1.00 70.10 C ATOM 1591 CG TYR A 99 -8.613 1.297 -5.447 1.00 33.33 C ATOM 1592 CD1 TYR A 99 -7.904 0.090 -5.417 1.00 34.55 C ATOM 1593 CD2 TYR A 99 -9.913 1.358 -4.930 1.00 60.32 C ATOM 1594 CE1 TYR A 99 -8.495 -1.055 -4.870 1.00 2.30 C ATOM 1595 CE2 TYR A 99 -10.504 0.212 -4.384 1.00 45.42 C ATOM 1596 CZ TYR A 99 -9.795 -0.994 -4.353 1.00 14.12 C ATOM 1597 OH TYR A 99 -10.378 -2.123 -3.815 1.00 72.31 O ATOM 0 H TYR A 99 -6.738 4.754 -6.375 1.00 53.24 H new ATOM 0 HA TYR A 99 -7.789 3.307 -4.036 1.00 23.15 H new ATOM 0 HB2 TYR A 99 -8.744 3.182 -6.460 1.00 70.10 H new ATOM 0 HB3 TYR A 99 -7.308 2.257 -6.852 1.00 70.10 H new ATOM 0 HD1 TYR A 99 -6.901 0.042 -5.816 1.00 34.55 H new ATOM 0 HD2 TYR A 99 -10.460 2.289 -4.952 1.00 60.32 H new ATOM 0 HE1 TYR A 99 -7.948 -1.986 -4.847 1.00 2.30 H new ATOM 0 HE2 TYR A 99 -11.507 0.259 -3.987 1.00 45.42 H new ATOM 0 HH TYR A 99 -11.281 -1.907 -3.501 1.00 72.31 H new ATOM 1607 N ALA A 100 -5.644 2.277 -3.399 1.00 61.15 N ATOM 1608 CA ALA A 100 -4.415 1.603 -2.977 1.00 74.52 C ATOM 1609 C ALA A 100 -4.673 0.124 -2.708 1.00 15.42 C ATOM 1610 O ALA A 100 -5.656 -0.240 -2.061 1.00 3.20 O ATOM 1611 CB ALA A 100 -3.865 2.272 -1.712 1.00 23.01 C ATOM 0 H ALA A 100 -6.286 2.499 -2.638 1.00 61.15 H new ATOM 0 HA ALA A 100 -3.683 1.685 -3.780 1.00 74.52 H new ATOM 0 HB1 ALA A 100 -2.950 1.767 -1.402 1.00 23.01 H new ATOM 0 HB2 ALA A 100 -3.648 3.320 -1.919 1.00 23.01 H new ATOM 0 HB3 ALA A 100 -4.605 2.205 -0.914 1.00 23.01 H new ATOM 1617 N THR A 101 -3.785 -0.726 -3.222 1.00 22.14 N ATOM 1618 CA THR A 101 -3.914 -2.171 -3.048 1.00 2.44 C ATOM 1619 C THR A 101 -2.558 -2.781 -2.702 1.00 65.14 C ATOM 1620 O THR A 101 -1.579 -2.588 -3.423 1.00 34.23 O ATOM 1621 CB THR A 101 -4.450 -2.791 -4.346 1.00 71.34 C ATOM 1622 OG1 THR A 101 -5.604 -2.077 -4.762 1.00 60.50 O ATOM 1623 CG2 THR A 101 -4.819 -4.263 -4.125 1.00 45.34 C ATOM 0 H THR A 101 -2.969 -0.438 -3.762 1.00 22.14 H new ATOM 0 HA THR A 101 -4.607 -2.376 -2.232 1.00 2.44 H new ATOM 0 HB THR A 101 -3.676 -2.733 -5.111 1.00 71.34 H new ATOM 0 HG1 THR A 101 -5.949 -2.468 -5.591 1.00 60.50 H new ATOM 0 HG21 THR A 101 -5.197 -4.687 -5.055 1.00 45.34 H new ATOM 0 HG22 THR A 101 -3.935 -4.816 -3.807 1.00 45.34 H new ATOM 0 HG23 THR A 101 -5.587 -4.334 -3.355 1.00 45.34 H new ATOM 1631 N ARG A 102 -2.504 -3.518 -1.591 1.00 63.03 N ATOM 1632 CA ARG A 102 -1.262 -4.155 -1.150 1.00 41.10 C ATOM 1633 C ARG A 102 -1.492 -5.645 -0.996 1.00 45.01 C ATOM 1634 O ARG A 102 -2.445 -6.056 -0.333 1.00 64.44 O ATOM 1635 CB ARG A 102 -0.813 -3.560 0.186 1.00 61.23 C ATOM 1636 CG ARG A 102 0.434 -4.294 0.685 1.00 32.22 C ATOM 1637 CD ARG A 102 1.003 -3.561 1.901 1.00 63.32 C ATOM 1638 NE ARG A 102 2.193 -4.248 2.396 1.00 44.34 N ATOM 1639 CZ ARG A 102 3.392 -4.012 1.873 1.00 61.05 C ATOM 1640 NH1 ARG A 102 3.521 -3.154 0.898 1.00 43.54 N ATOM 1641 NH2 ARG A 102 4.440 -4.638 2.334 1.00 22.11 N ATOM 0 H ARG A 102 -3.304 -3.688 -0.981 1.00 63.03 H new ATOM 0 HA ARG A 102 -0.483 -3.980 -1.892 1.00 41.10 H new ATOM 0 HB2 ARG A 102 -0.599 -2.498 0.068 1.00 61.23 H new ATOM 0 HB3 ARG A 102 -1.614 -3.644 0.920 1.00 61.23 H new ATOM 0 HG2 ARG A 102 0.183 -5.321 0.950 1.00 32.22 H new ATOM 0 HG3 ARG A 102 1.182 -4.343 -0.107 1.00 32.22 H new ATOM 0 HD2 ARG A 102 1.253 -2.535 1.631 1.00 63.32 H new ATOM 0 HD3 ARG A 102 0.251 -3.510 2.688 1.00 63.32 H new ATOM 0 HE ARG A 102 2.102 -4.921 3.157 1.00 44.34 H new ATOM 0 HH11 ARG A 102 2.702 -2.665 0.538 1.00 43.54 H new ATOM 0 HH12 ARG A 102 4.441 -2.973 0.497 1.00 43.54 H new ATOM 0 HH21 ARG A 102 4.339 -5.309 3.096 1.00 22.11 H new ATOM 0 HH22 ARG A 102 5.360 -4.457 1.932 1.00 22.11 H new ATOM 1655 N VAL A 103 -0.644 -6.467 -1.619 1.00 70.43 N ATOM 1656 CA VAL A 103 -0.815 -7.916 -1.540 1.00 10.05 C ATOM 1657 C VAL A 103 0.383 -8.575 -0.871 1.00 54.11 C ATOM 1658 O VAL A 103 1.511 -8.478 -1.352 1.00 2.21 O ATOM 1659 CB VAL A 103 -0.998 -8.484 -2.955 1.00 31.23 C ATOM 1660 CG1 VAL A 103 0.222 -8.138 -3.817 1.00 51.32 C ATOM 1661 CG2 VAL A 103 -1.161 -10.006 -2.893 1.00 33.31 C ATOM 0 H VAL A 103 0.154 -6.159 -2.174 1.00 70.43 H new ATOM 0 HA VAL A 103 -1.698 -8.128 -0.937 1.00 10.05 H new ATOM 0 HB VAL A 103 -1.892 -8.044 -3.397 1.00 31.23 H new ATOM 0 HG11 VAL A 103 0.086 -8.544 -4.819 1.00 51.32 H new ATOM 0 HG12 VAL A 103 0.331 -7.055 -3.876 1.00 51.32 H new ATOM 0 HG13 VAL A 103 1.118 -8.569 -3.370 1.00 51.32 H new ATOM 0 HG21 VAL A 103 -1.290 -10.399 -3.901 1.00 33.31 H new ATOM 0 HG22 VAL A 103 -0.273 -10.449 -2.442 1.00 33.31 H new ATOM 0 HG23 VAL A 103 -2.036 -10.254 -2.292 1.00 33.31 H new ATOM 1671 N LYS A 104 0.123 -9.257 0.241 1.00 41.30 N ATOM 1672 CA LYS A 104 1.169 -9.951 0.977 1.00 42.44 C ATOM 1673 C LYS A 104 1.161 -11.419 0.582 1.00 54.14 C ATOM 1674 O LYS A 104 0.236 -11.881 -0.085 1.00 32.45 O ATOM 1675 CB LYS A 104 0.925 -9.812 2.484 1.00 51.32 C ATOM 1676 CG LYS A 104 2.131 -10.351 3.261 1.00 75.04 C ATOM 1677 CD LYS A 104 2.070 -9.858 4.708 1.00 50.41 C ATOM 1678 CE LYS A 104 0.833 -10.438 5.397 1.00 54.34 C ATOM 1679 NZ LYS A 104 0.964 -10.274 6.873 1.00 25.13 N ATOM 0 H LYS A 104 -0.807 -9.342 0.651 1.00 41.30 H new ATOM 0 HA LYS A 104 2.139 -9.514 0.738 1.00 42.44 H new ATOM 0 HB2 LYS A 104 0.756 -8.766 2.739 1.00 51.32 H new ATOM 0 HB3 LYS A 104 0.025 -10.358 2.767 1.00 51.32 H new ATOM 0 HG2 LYS A 104 2.134 -11.441 3.237 1.00 75.04 H new ATOM 0 HG3 LYS A 104 3.057 -10.019 2.792 1.00 75.04 H new ATOM 0 HD2 LYS A 104 2.971 -10.158 5.243 1.00 50.41 H new ATOM 0 HD3 LYS A 104 2.034 -8.769 4.730 1.00 50.41 H new ATOM 0 HE2 LYS A 104 -0.065 -9.932 5.042 1.00 54.34 H new ATOM 0 HE3 LYS A 104 0.725 -11.493 5.146 1.00 54.34 H new ATOM 0 HZ1 LYS A 104 0.124 -10.668 7.342 1.00 25.13 H new ATOM 0 HZ2 LYS A 104 1.813 -10.776 7.204 1.00 25.13 H new ATOM 0 HZ3 LYS A 104 1.047 -9.263 7.104 1.00 25.13 H new ATOM 1693 N ASP A 105 2.189 -12.149 0.979 1.00 3.11 N ATOM 1694 CA ASP A 105 2.267 -13.558 0.633 1.00 35.33 C ATOM 1695 C ASP A 105 1.048 -14.312 1.160 1.00 3.02 C ATOM 1696 O ASP A 105 0.912 -14.536 2.363 1.00 72.23 O ATOM 1697 CB ASP A 105 3.540 -14.170 1.220 1.00 23.03 C ATOM 1698 CG ASP A 105 4.768 -13.557 0.555 1.00 34.35 C ATOM 1699 OD1 ASP A 105 4.605 -12.923 -0.475 1.00 41.32 O ATOM 1700 OD2 ASP A 105 5.853 -13.732 1.084 1.00 53.11 O ATOM 0 H ASP A 105 2.970 -11.797 1.533 1.00 3.11 H new ATOM 0 HA ASP A 105 2.289 -13.643 -0.453 1.00 35.33 H new ATOM 0 HB2 ASP A 105 3.574 -13.997 2.296 1.00 23.03 H new ATOM 0 HB3 ASP A 105 3.536 -15.250 1.071 1.00 23.03 H new ATOM 1705 N GLY A 106 0.182 -14.728 0.237 1.00 63.24 N ATOM 1706 CA GLY A 106 -1.010 -15.495 0.594 1.00 64.54 C ATOM 1707 C GLY A 106 -2.207 -14.611 0.948 1.00 13.22 C ATOM 1708 O GLY A 106 -3.299 -15.126 1.189 1.00 71.13 O ATOM 0 H GLY A 106 0.283 -14.547 -0.762 1.00 63.24 H new ATOM 0 HA2 GLY A 106 -1.279 -16.145 -0.238 1.00 64.54 H new ATOM 0 HA3 GLY A 106 -0.779 -16.141 1.441 1.00 64.54 H new ATOM 1712 N ARG A 107 -2.015 -13.292 1.000 1.00 24.31 N ATOM 1713 CA ARG A 107 -3.119 -12.392 1.352 1.00 34.31 C ATOM 1714 C ARG A 107 -3.163 -11.158 0.452 1.00 33.21 C ATOM 1715 O ARG A 107 -2.129 -10.637 0.037 1.00 12.22 O ATOM 1716 CB ARG A 107 -2.976 -11.949 2.809 1.00 65.14 C ATOM 1717 CG ARG A 107 -3.045 -13.175 3.723 1.00 72.35 C ATOM 1718 CD ARG A 107 -3.009 -12.726 5.184 1.00 74.21 C ATOM 1719 NE ARG A 107 -2.777 -13.871 6.058 1.00 33.21 N ATOM 1720 CZ ARG A 107 -3.122 -13.839 7.342 1.00 12.54 C ATOM 1721 NH1 ARG A 107 -3.681 -12.769 7.840 1.00 41.13 N ATOM 1722 NH2 ARG A 107 -2.904 -14.876 8.103 1.00 32.22 N ATOM 0 H ARG A 107 -1.127 -12.829 0.808 1.00 24.31 H new ATOM 0 HA ARG A 107 -4.049 -12.943 1.211 1.00 34.31 H new ATOM 0 HB2 ARG A 107 -2.029 -11.429 2.951 1.00 65.14 H new ATOM 0 HB3 ARG A 107 -3.768 -11.245 3.066 1.00 65.14 H new ATOM 0 HG2 ARG A 107 -3.958 -13.737 3.527 1.00 72.35 H new ATOM 0 HG3 ARG A 107 -2.209 -13.843 3.516 1.00 72.35 H new ATOM 0 HD2 ARG A 107 -2.221 -11.986 5.325 1.00 74.21 H new ATOM 0 HD3 ARG A 107 -3.950 -12.243 5.447 1.00 74.21 H new ATOM 0 HE ARG A 107 -2.342 -14.711 5.677 1.00 33.21 H new ATOM 0 HH11 ARG A 107 -3.853 -11.959 7.244 1.00 41.13 H new ATOM 0 HH12 ARG A 107 -3.946 -12.743 8.825 1.00 41.13 H new ATOM 0 HH21 ARG A 107 -2.469 -15.712 7.713 1.00 32.22 H new ATOM 0 HH22 ARG A 107 -3.169 -14.851 9.088 1.00 32.22 H new ATOM 1736 N THR A 108 -4.384 -10.688 0.179 1.00 21.31 N ATOM 1737 CA THR A 108 -4.602 -9.502 -0.652 1.00 3.44 C ATOM 1738 C THR A 108 -5.205 -8.390 0.196 1.00 34.05 C ATOM 1739 O THR A 108 -5.765 -8.652 1.260 1.00 54.34 O ATOM 1740 CB THR A 108 -5.549 -9.837 -1.807 1.00 44.21 C ATOM 1741 OG1 THR A 108 -5.029 -10.940 -2.537 1.00 23.54 O ATOM 1742 CG2 THR A 108 -5.677 -8.626 -2.732 1.00 62.20 C ATOM 0 H THR A 108 -5.243 -11.116 0.525 1.00 21.31 H new ATOM 0 HA THR A 108 -3.646 -9.173 -1.060 1.00 3.44 H new ATOM 0 HB THR A 108 -6.531 -10.093 -1.410 1.00 44.21 H new ATOM 0 HG1 THR A 108 -5.634 -11.158 -3.276 1.00 23.54 H new ATOM 0 HG21 THR A 108 -6.351 -8.866 -3.554 1.00 62.20 H new ATOM 0 HG22 THR A 108 -6.075 -7.780 -2.171 1.00 62.20 H new ATOM 0 HG23 THR A 108 -4.696 -8.368 -3.131 1.00 62.20 H new ATOM 1750 N LEU A 109 -5.083 -7.147 -0.263 1.00 1.25 N ATOM 1751 CA LEU A 109 -5.621 -6.022 0.495 1.00 44.12 C ATOM 1752 C LEU A 109 -6.039 -4.879 -0.413 1.00 21.02 C ATOM 1753 O LEU A 109 -5.532 -4.722 -1.520 1.00 0.23 O ATOM 1754 CB LEU A 109 -4.565 -5.509 1.479 1.00 1.31 C ATOM 1755 CG LEU A 109 -5.236 -4.963 2.751 1.00 74.42 C ATOM 1756 CD1 LEU A 109 -5.513 -6.111 3.730 1.00 53.21 C ATOM 1757 CD2 LEU A 109 -4.307 -3.945 3.416 1.00 22.22 C ATOM 0 H LEU A 109 -4.625 -6.896 -1.139 1.00 1.25 H new ATOM 0 HA LEU A 109 -6.502 -6.378 1.029 1.00 44.12 H new ATOM 0 HB2 LEU A 109 -3.880 -6.315 1.740 1.00 1.31 H new ATOM 0 HB3 LEU A 109 -3.971 -4.725 1.009 1.00 1.31 H new ATOM 0 HG LEU A 109 -6.178 -4.485 2.483 1.00 74.42 H new ATOM 0 HD11 LEU A 109 -5.988 -5.717 4.628 1.00 53.21 H new ATOM 0 HD12 LEU A 109 -6.174 -6.839 3.260 1.00 53.21 H new ATOM 0 HD13 LEU A 109 -4.574 -6.594 3.999 1.00 53.21 H new ATOM 0 HD21 LEU A 109 -4.780 -3.556 4.318 1.00 22.22 H new ATOM 0 HD22 LEU A 109 -3.366 -4.428 3.679 1.00 22.22 H new ATOM 0 HD23 LEU A 109 -4.113 -3.124 2.725 1.00 22.22 H new ATOM 1769 N HIS A 110 -6.953 -4.071 0.099 1.00 74.14 N ATOM 1770 CA HIS A 110 -7.443 -2.910 -0.630 1.00 2.42 C ATOM 1771 C HIS A 110 -7.748 -1.779 0.346 1.00 61.44 C ATOM 1772 O HIS A 110 -8.218 -2.024 1.458 1.00 4.14 O ATOM 1773 CB HIS A 110 -8.697 -3.275 -1.444 1.00 4.35 C ATOM 1774 CG HIS A 110 -9.430 -4.407 -0.775 1.00 42.25 C ATOM 1775 ND1 HIS A 110 -10.669 -4.238 -0.179 1.00 22.43 N ATOM 1776 CD2 HIS A 110 -9.113 -5.734 -0.608 1.00 72.54 C ATOM 1777 CE1 HIS A 110 -11.051 -5.432 0.312 1.00 13.53 C ATOM 1778 NE2 HIS A 110 -10.138 -6.378 0.077 1.00 3.34 N ATOM 0 H HIS A 110 -7.373 -4.198 1.020 1.00 74.14 H new ATOM 0 HA HIS A 110 -6.672 -2.577 -1.325 1.00 2.42 H new ATOM 0 HB2 HIS A 110 -9.351 -2.407 -1.530 1.00 4.35 H new ATOM 0 HB3 HIS A 110 -8.413 -3.562 -2.457 1.00 4.35 H new ATOM 0 HD2 HIS A 110 -8.206 -6.205 -0.956 1.00 72.54 H new ATOM 0 HE1 HIS A 110 -11.982 -5.604 0.832 1.00 13.53 H new ATOM 0 HE2 HIS A 110 -10.183 -7.362 0.343 1.00 3.34 H new ATOM 1786 N MET A 111 -7.489 -0.538 -0.067 1.00 73.00 N ATOM 1787 CA MET A 111 -7.755 0.609 0.795 1.00 41.14 C ATOM 1788 C MET A 111 -7.919 1.883 -0.038 1.00 62.23 C ATOM 1789 O MET A 111 -7.318 2.020 -1.103 1.00 11.35 O ATOM 1790 CB MET A 111 -6.605 0.788 1.799 1.00 54.23 C ATOM 1791 CG MET A 111 -5.274 0.396 1.147 1.00 11.02 C ATOM 1792 SD MET A 111 -3.935 1.362 1.889 1.00 15.40 S ATOM 1793 CE MET A 111 -4.102 0.726 3.575 1.00 40.11 C ATOM 0 H MET A 111 -7.101 -0.305 -0.981 1.00 73.00 H new ATOM 0 HA MET A 111 -8.682 0.426 1.338 1.00 41.14 H new ATOM 0 HB2 MET A 111 -6.563 1.824 2.136 1.00 54.23 H new ATOM 0 HB3 MET A 111 -6.782 0.173 2.681 1.00 54.23 H new ATOM 0 HG2 MET A 111 -5.089 -0.669 1.285 1.00 11.02 H new ATOM 0 HG3 MET A 111 -5.315 0.576 0.073 1.00 11.02 H new ATOM 0 HE1 MET A 111 -3.263 1.072 4.179 1.00 40.11 H new ATOM 0 HE2 MET A 111 -5.035 1.087 4.009 1.00 40.11 H new ATOM 0 HE3 MET A 111 -4.109 -0.364 3.554 1.00 40.11 H new ATOM 1803 N MET A 112 -8.719 2.821 0.471 1.00 12.55 N ATOM 1804 CA MET A 112 -8.940 4.099 -0.215 1.00 21.34 C ATOM 1805 C MET A 112 -8.373 5.235 0.635 1.00 60.43 C ATOM 1806 O MET A 112 -8.395 5.164 1.864 1.00 63.12 O ATOM 1807 CB MET A 112 -10.441 4.323 -0.452 1.00 24.24 C ATOM 1808 CG MET A 112 -10.648 5.254 -1.651 1.00 34.21 C ATOM 1809 SD MET A 112 -10.433 4.314 -3.186 1.00 52.03 S ATOM 1810 CE MET A 112 -12.020 4.729 -3.952 1.00 62.30 C ATOM 0 H MET A 112 -9.224 2.723 1.352 1.00 12.55 H new ATOM 0 HA MET A 112 -8.434 4.079 -1.180 1.00 21.34 H new ATOM 0 HB2 MET A 112 -10.936 3.369 -0.632 1.00 24.24 H new ATOM 0 HB3 MET A 112 -10.898 4.756 0.438 1.00 24.24 H new ATOM 0 HG2 MET A 112 -11.645 5.693 -1.617 1.00 34.21 H new ATOM 0 HG3 MET A 112 -9.935 6.078 -1.613 1.00 34.21 H new ATOM 0 HE1 MET A 112 -12.093 4.242 -4.925 1.00 62.30 H new ATOM 0 HE2 MET A 112 -12.833 4.386 -3.313 1.00 62.30 H new ATOM 0 HE3 MET A 112 -12.091 5.809 -4.080 1.00 62.30 H new ATOM 1820 N ARG A 113 -7.854 6.277 -0.014 1.00 34.35 N ATOM 1821 CA ARG A 113 -7.277 7.405 0.724 1.00 24.33 C ATOM 1822 C ARG A 113 -7.636 8.737 0.065 1.00 31.12 C ATOM 1823 O ARG A 113 -7.869 8.801 -1.143 1.00 0.13 O ATOM 1824 CB ARG A 113 -5.750 7.251 0.793 1.00 4.41 C ATOM 1825 CG ARG A 113 -5.389 5.763 0.822 1.00 54.44 C ATOM 1826 CD ARG A 113 -3.886 5.596 1.063 1.00 61.22 C ATOM 1827 NE ARG A 113 -3.594 5.683 2.491 1.00 62.31 N ATOM 1828 CZ ARG A 113 -2.523 5.093 3.012 1.00 24.31 C ATOM 1829 NH1 ARG A 113 -1.701 4.432 2.243 1.00 71.52 N ATOM 1830 NH2 ARG A 113 -2.292 5.175 4.293 1.00 30.23 N ATOM 0 H ARG A 113 -7.820 6.366 -1.030 1.00 34.35 H new ATOM 0 HA ARG A 113 -7.691 7.403 1.732 1.00 24.33 H new ATOM 0 HB2 ARG A 113 -5.286 7.732 -0.068 1.00 4.41 H new ATOM 0 HB3 ARG A 113 -5.363 7.748 1.683 1.00 4.41 H new ATOM 0 HG2 ARG A 113 -5.950 5.259 1.609 1.00 54.44 H new ATOM 0 HG3 ARG A 113 -5.669 5.293 -0.121 1.00 54.44 H new ATOM 0 HD2 ARG A 113 -3.552 4.634 0.674 1.00 61.22 H new ATOM 0 HD3 ARG A 113 -3.335 6.367 0.524 1.00 61.22 H new ATOM 0 HE ARG A 113 -4.223 6.206 3.100 1.00 62.31 H new ATOM 0 HH11 ARG A 113 -1.880 4.368 1.241 1.00 71.52 H new ATOM 0 HH12 ARG A 113 -0.879 3.980 2.644 1.00 71.52 H new ATOM 0 HH21 ARG A 113 -2.933 5.692 4.895 1.00 30.23 H new ATOM 0 HH22 ARG A 113 -1.470 4.722 4.693 1.00 30.23 H new ATOM 1844 N LEU A 114 -7.679 9.800 0.876 1.00 65.42 N ATOM 1845 CA LEU A 114 -8.013 11.138 0.370 1.00 33.01 C ATOM 1846 C LEU A 114 -6.841 12.091 0.544 1.00 14.45 C ATOM 1847 O LEU A 114 -6.312 12.242 1.648 1.00 44.00 O ATOM 1848 CB LEU A 114 -9.213 11.706 1.130 1.00 20.54 C ATOM 1849 CG LEU A 114 -9.601 13.081 0.571 1.00 10.22 C ATOM 1850 CD1 LEU A 114 -10.026 12.957 -0.897 1.00 43.22 C ATOM 1851 CD2 LEU A 114 -10.763 13.635 1.399 1.00 25.23 C ATOM 0 H LEU A 114 -7.489 9.762 1.877 1.00 65.42 H new ATOM 0 HA LEU A 114 -8.250 11.041 -0.690 1.00 33.01 H new ATOM 0 HB2 LEU A 114 -10.058 11.023 1.050 1.00 20.54 H new ATOM 0 HB3 LEU A 114 -8.972 11.792 2.190 1.00 20.54 H new ATOM 0 HG LEU A 114 -8.745 13.753 0.628 1.00 10.22 H new ATOM 0 HD11 LEU A 114 -10.299 13.940 -1.281 1.00 43.22 H new ATOM 0 HD12 LEU A 114 -9.199 12.555 -1.483 1.00 43.22 H new ATOM 0 HD13 LEU A 114 -10.883 12.288 -0.972 1.00 43.22 H new ATOM 0 HD21 LEU A 114 -11.051 14.613 1.014 1.00 25.23 H new ATOM 0 HD22 LEU A 114 -11.613 12.955 1.334 1.00 25.23 H new ATOM 0 HD23 LEU A 114 -10.454 13.732 2.440 1.00 25.23 H new ATOM 1863 N TYR A 115 -6.439 12.731 -0.551 1.00 41.23 N ATOM 1864 CA TYR A 115 -5.324 13.672 -0.511 1.00 35.42 C ATOM 1865 C TYR A 115 -5.817 15.116 -0.554 1.00 43.40 C ATOM 1866 O TYR A 115 -6.934 15.392 -0.989 1.00 11.25 O ATOM 1867 CB TYR A 115 -4.388 13.414 -1.690 1.00 64.12 C ATOM 1868 CG TYR A 115 -3.804 12.029 -1.561 1.00 63.00 C ATOM 1869 CD1 TYR A 115 -4.580 10.912 -1.890 1.00 23.32 C ATOM 1870 CD2 TYR A 115 -2.492 11.862 -1.108 1.00 62.34 C ATOM 1871 CE1 TYR A 115 -4.045 9.627 -1.761 1.00 1.21 C ATOM 1872 CE2 TYR A 115 -1.956 10.578 -0.983 1.00 11.23 C ATOM 1873 CZ TYR A 115 -2.733 9.458 -1.307 1.00 21.35 C ATOM 1874 OH TYR A 115 -2.209 8.189 -1.175 1.00 24.05 O ATOM 0 H TYR A 115 -6.865 12.616 -1.471 1.00 41.23 H new ATOM 0 HA TYR A 115 -4.787 13.522 0.426 1.00 35.42 H new ATOM 0 HB2 TYR A 115 -4.932 13.507 -2.630 1.00 64.12 H new ATOM 0 HB3 TYR A 115 -3.592 14.158 -1.708 1.00 64.12 H new ATOM 0 HD1 TYR A 115 -5.592 11.043 -2.244 1.00 23.32 H new ATOM 0 HD2 TYR A 115 -1.894 12.725 -0.855 1.00 62.34 H new ATOM 0 HE1 TYR A 115 -4.645 8.765 -2.012 1.00 1.21 H new ATOM 0 HE2 TYR A 115 -0.941 10.449 -0.636 1.00 11.23 H new ATOM 0 HH TYR A 115 -2.128 7.966 -0.224 1.00 24.05 H new ATOM 1884 N SER A 116 -4.963 16.033 -0.101 1.00 23.20 N ATOM 1885 CA SER A 116 -5.294 17.458 -0.087 1.00 54.05 C ATOM 1886 C SER A 116 -4.075 18.279 -0.494 1.00 53.25 C ATOM 1887 O SER A 116 -2.943 17.902 -0.203 1.00 35.31 O ATOM 1888 CB SER A 116 -5.740 17.880 1.316 1.00 20.03 C ATOM 1889 OG SER A 116 -5.952 19.286 1.335 1.00 51.40 O ATOM 0 H SER A 116 -4.035 15.814 0.262 1.00 23.20 H new ATOM 0 HA SER A 116 -6.105 17.635 -0.793 1.00 54.05 H new ATOM 0 HB2 SER A 116 -6.656 17.358 1.592 1.00 20.03 H new ATOM 0 HB3 SER A 116 -4.983 17.604 2.050 1.00 20.03 H new ATOM 0 HG SER A 116 -5.737 19.637 2.224 1.00 51.40 H new ATOM 1895 N ARG A 117 -4.306 19.401 -1.167 1.00 35.02 N ATOM 1896 CA ARG A 117 -3.205 20.257 -1.598 1.00 71.21 C ATOM 1897 C ARG A 117 -2.743 21.139 -0.444 1.00 13.41 C ATOM 1898 O ARG A 117 -1.615 21.631 -0.432 1.00 44.44 O ATOM 1899 CB ARG A 117 -3.665 21.134 -2.766 1.00 40.43 C ATOM 1900 CG ARG A 117 -2.466 21.865 -3.395 1.00 11.15 C ATOM 1901 CD ARG A 117 -1.719 20.935 -4.359 1.00 3.14 C ATOM 1902 NE ARG A 117 -0.785 21.707 -5.173 1.00 73.35 N ATOM 1903 CZ ARG A 117 0.285 22.283 -4.634 1.00 71.11 C ATOM 1904 NH1 ARG A 117 0.527 22.147 -3.359 1.00 45.01 N ATOM 1905 NH2 ARG A 117 1.096 22.980 -5.383 1.00 11.31 N ATOM 0 H ARG A 117 -5.234 19.737 -1.424 1.00 35.02 H new ATOM 0 HA ARG A 117 -2.372 19.631 -1.919 1.00 71.21 H new ATOM 0 HB2 ARG A 117 -4.159 20.519 -3.518 1.00 40.43 H new ATOM 0 HB3 ARG A 117 -4.399 21.860 -2.416 1.00 40.43 H new ATOM 0 HG2 ARG A 117 -2.811 22.751 -3.928 1.00 11.15 H new ATOM 0 HG3 ARG A 117 -1.789 22.207 -2.612 1.00 11.15 H new ATOM 0 HD2 ARG A 117 -1.180 20.172 -3.797 1.00 3.14 H new ATOM 0 HD3 ARG A 117 -2.430 20.415 -5.001 1.00 3.14 H new ATOM 0 HE ARG A 117 -0.956 21.806 -6.174 1.00 73.35 H new ATOM 0 HH11 ARG A 117 -0.105 21.599 -2.776 1.00 45.01 H new ATOM 0 HH12 ARG A 117 1.348 22.589 -2.946 1.00 45.01 H new ATOM 0 HH21 ARG A 117 0.908 23.082 -6.380 1.00 11.31 H new ATOM 0 HH22 ARG A 117 1.917 23.423 -4.971 1.00 11.31 H new ATOM 1919 N SER A 118 -3.625 21.326 0.533 1.00 32.40 N ATOM 1920 CA SER A 118 -3.312 22.147 1.702 1.00 63.20 C ATOM 1921 C SER A 118 -3.544 21.348 2.987 1.00 61.33 C ATOM 1922 O SER A 118 -4.473 20.547 3.059 1.00 30.25 O ATOM 1923 CB SER A 118 -4.206 23.387 1.701 1.00 51.41 C ATOM 1924 OG SER A 118 -3.889 24.201 2.823 1.00 31.33 O ATOM 0 H SER A 118 -4.561 20.922 0.540 1.00 32.40 H new ATOM 0 HA SER A 118 -2.265 22.447 1.659 1.00 63.20 H new ATOM 0 HB2 SER A 118 -4.064 23.950 0.778 1.00 51.41 H new ATOM 0 HB3 SER A 118 -5.255 23.092 1.737 1.00 51.41 H new ATOM 0 HG SER A 118 -4.461 24.997 2.822 1.00 31.33 H new ATOM 1930 N PRO A 119 -2.728 21.546 3.996 1.00 3.24 N ATOM 1931 CA PRO A 119 -2.868 20.824 5.291 1.00 44.12 C ATOM 1932 C PRO A 119 -4.329 20.619 5.687 1.00 72.42 C ATOM 1933 O PRO A 119 -4.653 19.713 6.455 1.00 71.12 O ATOM 1934 CB PRO A 119 -2.154 21.746 6.279 1.00 52.42 C ATOM 1935 CG PRO A 119 -1.092 22.435 5.478 1.00 34.50 C ATOM 1936 CD PRO A 119 -1.581 22.473 4.021 1.00 15.31 C ATOM 0 HA PRO A 119 -2.451 19.818 5.253 1.00 44.12 H new ATOM 0 HB2 PRO A 119 -2.846 22.466 6.716 1.00 52.42 H new ATOM 0 HB3 PRO A 119 -1.720 21.179 7.103 1.00 52.42 H new ATOM 0 HG2 PRO A 119 -0.920 23.444 5.853 1.00 34.50 H new ATOM 0 HG3 PRO A 119 -0.145 21.901 5.553 1.00 34.50 H new ATOM 0 HD2 PRO A 119 -1.877 23.480 3.727 1.00 15.31 H new ATOM 0 HD3 PRO A 119 -0.799 22.157 3.331 1.00 15.31 H new ATOM 1944 N GLU A 120 -5.206 21.469 5.159 1.00 12.04 N ATOM 1945 CA GLU A 120 -6.630 21.381 5.464 1.00 73.12 C ATOM 1946 C GLU A 120 -7.354 20.543 4.418 1.00 71.11 C ATOM 1947 O GLU A 120 -6.769 20.139 3.413 1.00 70.14 O ATOM 1948 CB GLU A 120 -7.239 22.782 5.494 1.00 71.14 C ATOM 1949 CG GLU A 120 -6.360 23.706 6.337 1.00 62.05 C ATOM 1950 CD GLU A 120 -7.014 25.078 6.463 1.00 43.35 C ATOM 1951 OE1 GLU A 120 -7.959 25.330 5.734 1.00 30.22 O ATOM 1952 OE2 GLU A 120 -6.560 25.857 7.285 1.00 53.21 O ATOM 0 H GLU A 120 -4.956 22.224 4.520 1.00 12.04 H new ATOM 0 HA GLU A 120 -6.744 20.906 6.438 1.00 73.12 H new ATOM 0 HB2 GLU A 120 -7.327 23.173 4.480 1.00 71.14 H new ATOM 0 HB3 GLU A 120 -8.246 22.743 5.909 1.00 71.14 H new ATOM 0 HG2 GLU A 120 -6.209 23.274 7.326 1.00 62.05 H new ATOM 0 HG3 GLU A 120 -5.376 23.804 5.878 1.00 62.05 H new ATOM 1959 N VAL A 121 -8.636 20.295 4.663 1.00 51.32 N ATOM 1960 CA VAL A 121 -9.457 19.510 3.743 1.00 70.22 C ATOM 1961 C VAL A 121 -10.595 20.366 3.195 1.00 31.20 C ATOM 1962 O VAL A 121 -11.333 20.993 3.954 1.00 54.13 O ATOM 1963 CB VAL A 121 -10.035 18.295 4.469 1.00 45.22 C ATOM 1964 CG1 VAL A 121 -10.591 17.303 3.446 1.00 2.32 C ATOM 1965 CG2 VAL A 121 -8.931 17.617 5.284 1.00 14.34 C ATOM 0 H VAL A 121 -9.131 20.626 5.491 1.00 51.32 H new ATOM 0 HA VAL A 121 -8.833 19.173 2.916 1.00 70.22 H new ATOM 0 HB VAL A 121 -10.836 18.618 5.134 1.00 45.22 H new ATOM 0 HG11 VAL A 121 -11.003 16.437 3.965 1.00 2.32 H new ATOM 0 HG12 VAL A 121 -11.376 17.784 2.863 1.00 2.32 H new ATOM 0 HG13 VAL A 121 -9.791 16.980 2.780 1.00 2.32 H new ATOM 0 HG21 VAL A 121 -9.341 16.750 5.802 1.00 14.34 H new ATOM 0 HG22 VAL A 121 -8.131 17.296 4.617 1.00 14.34 H new ATOM 0 HG23 VAL A 121 -8.533 18.322 6.014 1.00 14.34 H new ATOM 1975 N SER A 122 -10.729 20.390 1.872 1.00 1.10 N ATOM 1976 CA SER A 122 -11.778 21.176 1.235 1.00 43.21 C ATOM 1977 C SER A 122 -13.112 20.414 1.275 1.00 54.54 C ATOM 1978 O SER A 122 -13.161 19.239 0.912 1.00 31.13 O ATOM 1979 CB SER A 122 -11.389 21.467 -0.218 1.00 63.12 C ATOM 1980 OG SER A 122 -10.567 22.625 -0.258 1.00 31.32 O ATOM 0 H SER A 122 -10.129 19.878 1.225 1.00 1.10 H new ATOM 0 HA SER A 122 -11.895 22.116 1.775 1.00 43.21 H new ATOM 0 HB2 SER A 122 -10.858 20.615 -0.643 1.00 63.12 H new ATOM 0 HB3 SER A 122 -12.283 21.620 -0.823 1.00 63.12 H new ATOM 0 HG SER A 122 -10.314 22.815 -1.186 1.00 31.32 H new ATOM 1986 N PRO A 123 -14.189 21.044 1.696 1.00 44.52 N ATOM 1987 CA PRO A 123 -15.522 20.379 1.761 1.00 42.35 C ATOM 1988 C PRO A 123 -15.779 19.481 0.552 1.00 51.43 C ATOM 1989 O PRO A 123 -16.385 18.417 0.674 1.00 53.20 O ATOM 1990 CB PRO A 123 -16.500 21.555 1.791 1.00 40.41 C ATOM 1991 CG PRO A 123 -15.755 22.662 2.465 1.00 11.25 C ATOM 1992 CD PRO A 123 -14.266 22.445 2.156 1.00 24.14 C ATOM 0 HA PRO A 123 -15.613 19.717 2.622 1.00 42.35 H new ATOM 0 HB2 PRO A 123 -16.805 21.840 0.784 1.00 40.41 H new ATOM 0 HB3 PRO A 123 -17.407 21.300 2.338 1.00 40.41 H new ATOM 0 HG2 PRO A 123 -16.089 23.633 2.098 1.00 11.25 H new ATOM 0 HG3 PRO A 123 -15.933 22.649 3.540 1.00 11.25 H new ATOM 0 HD2 PRO A 123 -13.914 23.135 1.389 1.00 24.14 H new ATOM 0 HD3 PRO A 123 -13.649 22.608 3.039 1.00 24.14 H new ATOM 2000 N ALA A 124 -15.313 19.920 -0.613 1.00 11.33 N ATOM 2001 CA ALA A 124 -15.499 19.150 -1.838 1.00 55.41 C ATOM 2002 C ALA A 124 -14.566 17.943 -1.858 1.00 44.30 C ATOM 2003 O ALA A 124 -14.897 16.901 -2.424 1.00 71.20 O ATOM 2004 CB ALA A 124 -15.222 20.032 -3.056 1.00 72.33 C ATOM 0 H ALA A 124 -14.808 20.798 -0.735 1.00 11.33 H new ATOM 0 HA ALA A 124 -16.530 18.799 -1.872 1.00 55.41 H new ATOM 0 HB1 ALA A 124 -15.363 19.450 -3.967 1.00 72.33 H new ATOM 0 HB2 ALA A 124 -15.909 20.878 -3.056 1.00 72.33 H new ATOM 0 HB3 ALA A 124 -14.196 20.398 -3.015 1.00 72.33 H new ATOM 2010 N ALA A 125 -13.399 18.093 -1.241 1.00 1.14 N ATOM 2011 CA ALA A 125 -12.425 17.009 -1.197 1.00 25.50 C ATOM 2012 C ALA A 125 -12.937 15.858 -0.340 1.00 15.54 C ATOM 2013 O ALA A 125 -12.826 14.695 -0.719 1.00 3.41 O ATOM 2014 CB ALA A 125 -11.101 17.514 -0.620 1.00 34.13 C ATOM 0 H ALA A 125 -13.106 18.948 -0.768 1.00 1.14 H new ATOM 0 HA ALA A 125 -12.270 16.653 -2.215 1.00 25.50 H new ATOM 0 HB1 ALA A 125 -10.381 16.696 -0.592 1.00 34.13 H new ATOM 0 HB2 ALA A 125 -10.714 18.317 -1.247 1.00 34.13 H new ATOM 0 HB3 ALA A 125 -11.264 17.889 0.390 1.00 34.13 H new ATOM 2020 N THR A 126 -13.500 16.193 0.814 1.00 71.53 N ATOM 2021 CA THR A 126 -14.028 15.176 1.718 1.00 45.41 C ATOM 2022 C THR A 126 -15.323 14.580 1.167 1.00 61.13 C ATOM 2023 O THR A 126 -15.631 13.416 1.413 1.00 32.34 O ATOM 2024 CB THR A 126 -14.269 15.772 3.119 1.00 22.40 C ATOM 2025 OG1 THR A 126 -13.351 16.833 3.340 1.00 13.42 O ATOM 2026 CG2 THR A 126 -14.067 14.689 4.194 1.00 4.31 C ATOM 0 H THR A 126 -13.603 17.152 1.145 1.00 71.53 H new ATOM 0 HA THR A 126 -13.290 14.378 1.800 1.00 45.41 H new ATOM 0 HB THR A 126 -15.291 16.147 3.179 1.00 22.40 H new ATOM 0 HG1 THR A 126 -13.502 17.216 4.229 1.00 13.42 H new ATOM 0 HG21 THR A 126 -14.239 15.119 5.181 1.00 4.31 H new ATOM 0 HG22 THR A 126 -14.770 13.874 4.026 1.00 4.31 H new ATOM 0 HG23 THR A 126 -13.048 14.306 4.138 1.00 4.31 H new ATOM 2034 N ALA A 127 -16.101 15.392 0.454 1.00 15.42 N ATOM 2035 CA ALA A 127 -17.378 14.941 -0.091 1.00 52.14 C ATOM 2036 C ALA A 127 -17.228 14.045 -1.321 1.00 32.11 C ATOM 2037 O ALA A 127 -17.834 12.975 -1.383 1.00 52.32 O ATOM 2038 CB ALA A 127 -18.204 16.155 -0.472 1.00 34.42 C ATOM 0 H ALA A 127 -15.870 16.362 0.241 1.00 15.42 H new ATOM 0 HA ALA A 127 -17.864 14.347 0.683 1.00 52.14 H new ATOM 0 HB1 ALA A 127 -19.161 15.830 -0.881 1.00 34.42 H new ATOM 0 HB2 ALA A 127 -18.377 16.770 0.412 1.00 34.42 H new ATOM 0 HB3 ALA A 127 -17.669 16.739 -1.221 1.00 34.42 H new ATOM 2044 N ILE A 128 -16.417 14.460 -2.294 1.00 12.23 N ATOM 2045 CA ILE A 128 -16.222 13.644 -3.479 1.00 11.33 C ATOM 2046 C ILE A 128 -15.703 12.292 -3.021 1.00 64.23 C ATOM 2047 O ILE A 128 -16.072 11.237 -3.537 1.00 44.43 O ATOM 2048 CB ILE A 128 -15.234 14.350 -4.428 1.00 23.41 C ATOM 2049 CG1 ILE A 128 -15.549 13.974 -5.875 1.00 32.13 C ATOM 2050 CG2 ILE A 128 -13.778 13.974 -4.111 1.00 22.34 C ATOM 2051 CD1 ILE A 128 -15.564 12.450 -6.036 1.00 71.02 C ATOM 0 H ILE A 128 -15.897 15.338 -2.282 1.00 12.23 H new ATOM 0 HA ILE A 128 -17.152 13.502 -4.029 1.00 11.33 H new ATOM 0 HB ILE A 128 -15.347 15.425 -4.286 1.00 23.41 H new ATOM 0 HG12 ILE A 128 -16.516 14.387 -6.163 1.00 32.13 H new ATOM 0 HG13 ILE A 128 -14.805 14.410 -6.542 1.00 32.13 H new ATOM 0 HG21 ILE A 128 -13.110 14.491 -4.800 1.00 22.34 H new ATOM 0 HG22 ILE A 128 -13.541 14.267 -3.088 1.00 22.34 H new ATOM 0 HG23 ILE A 128 -13.648 12.897 -4.219 1.00 22.34 H new ATOM 0 HD11 ILE A 128 -15.790 12.196 -7.072 1.00 71.02 H new ATOM 0 HD12 ILE A 128 -14.588 12.046 -5.768 1.00 71.02 H new ATOM 0 HD13 ILE A 128 -16.325 12.023 -5.383 1.00 71.02 H new ATOM 2063 N PHE A 129 -14.851 12.374 -2.020 1.00 20.10 N ATOM 2064 CA PHE A 129 -14.252 11.203 -1.417 1.00 64.04 C ATOM 2065 C PHE A 129 -15.336 10.237 -0.952 1.00 52.22 C ATOM 2066 O PHE A 129 -15.234 9.029 -1.155 1.00 14.21 O ATOM 2067 CB PHE A 129 -13.406 11.643 -0.226 1.00 23.32 C ATOM 2068 CG PHE A 129 -12.609 10.474 0.315 1.00 23.21 C ATOM 2069 CD1 PHE A 129 -11.735 9.762 -0.521 1.00 24.04 C ATOM 2070 CD2 PHE A 129 -12.742 10.101 1.658 1.00 54.41 C ATOM 2071 CE1 PHE A 129 -11.001 8.685 -0.013 1.00 43.23 C ATOM 2072 CE2 PHE A 129 -12.005 9.025 2.164 1.00 21.44 C ATOM 2073 CZ PHE A 129 -11.135 8.316 1.330 1.00 24.12 C ATOM 0 H PHE A 129 -14.554 13.256 -1.602 1.00 20.10 H new ATOM 0 HA PHE A 129 -13.626 10.694 -2.150 1.00 64.04 H new ATOM 0 HB2 PHE A 129 -12.731 12.444 -0.527 1.00 23.32 H new ATOM 0 HB3 PHE A 129 -14.049 12.046 0.556 1.00 23.32 H new ATOM 0 HD1 PHE A 129 -11.629 10.046 -1.558 1.00 24.04 H new ATOM 0 HD2 PHE A 129 -13.415 10.645 2.304 1.00 54.41 H new ATOM 0 HE1 PHE A 129 -10.330 8.138 -0.658 1.00 43.23 H new ATOM 0 HE2 PHE A 129 -12.108 8.741 3.201 1.00 21.44 H new ATOM 0 HZ PHE A 129 -10.567 7.485 1.722 1.00 24.12 H new ATOM 2083 N ARG A 130 -16.377 10.783 -0.329 1.00 63.11 N ATOM 2084 CA ARG A 130 -17.481 9.965 0.164 1.00 64.23 C ATOM 2085 C ARG A 130 -18.301 9.392 -0.990 1.00 1.41 C ATOM 2086 O ARG A 130 -18.723 8.237 -0.943 1.00 30.33 O ATOM 2087 CB ARG A 130 -18.387 10.803 1.070 1.00 42.52 C ATOM 2088 CG ARG A 130 -17.703 11.019 2.422 1.00 72.41 C ATOM 2089 CD ARG A 130 -18.632 11.808 3.345 1.00 4.30 C ATOM 2090 NE ARG A 130 -19.785 10.996 3.716 1.00 72.10 N ATOM 2091 CZ ARG A 130 -20.522 11.294 4.781 1.00 72.25 C ATOM 2092 NH1 ARG A 130 -20.218 12.329 5.516 1.00 33.33 N ATOM 2093 NH2 ARG A 130 -21.550 10.552 5.091 1.00 55.14 N ATOM 0 H ARG A 130 -16.479 11.783 -0.154 1.00 63.11 H new ATOM 0 HA ARG A 130 -17.059 9.136 0.732 1.00 64.23 H new ATOM 0 HB2 ARG A 130 -18.599 11.764 0.601 1.00 42.52 H new ATOM 0 HB3 ARG A 130 -19.343 10.299 1.211 1.00 42.52 H new ATOM 0 HG2 ARG A 130 -17.455 10.058 2.873 1.00 72.41 H new ATOM 0 HG3 ARG A 130 -16.766 11.558 2.285 1.00 72.41 H new ATOM 0 HD2 ARG A 130 -18.091 12.115 4.240 1.00 4.30 H new ATOM 0 HD3 ARG A 130 -18.965 12.718 2.846 1.00 4.30 H new ATOM 0 HE ARG A 130 -20.030 10.185 3.148 1.00 72.10 H new ATOM 0 HH11 ARG A 130 -19.415 12.909 5.273 1.00 33.33 H new ATOM 0 HH12 ARG A 130 -20.784 12.558 6.333 1.00 33.33 H new ATOM 0 HH21 ARG A 130 -21.787 9.744 4.516 1.00 55.14 H new ATOM 0 HH22 ARG A 130 -22.116 10.780 5.908 1.00 55.14 H new ATOM 2107 N LYS A 131 -18.541 10.204 -2.017 1.00 20.25 N ATOM 2108 CA LYS A 131 -19.332 9.753 -3.159 1.00 5.14 C ATOM 2109 C LYS A 131 -18.808 8.422 -3.686 1.00 2.24 C ATOM 2110 O LYS A 131 -19.536 7.431 -3.718 1.00 44.11 O ATOM 2111 CB LYS A 131 -19.285 10.800 -4.274 1.00 25.44 C ATOM 2112 CG LYS A 131 -20.019 12.063 -3.820 1.00 21.23 C ATOM 2113 CD LYS A 131 -20.075 13.065 -4.975 1.00 20.44 C ATOM 2114 CE LYS A 131 -20.681 14.379 -4.482 1.00 61.22 C ATOM 2115 NZ LYS A 131 -20.701 15.367 -5.599 1.00 32.24 N ATOM 0 H LYS A 131 -18.204 11.165 -2.082 1.00 20.25 H new ATOM 0 HA LYS A 131 -20.362 9.618 -2.830 1.00 5.14 H new ATOM 0 HB2 LYS A 131 -18.250 11.037 -4.521 1.00 25.44 H new ATOM 0 HB3 LYS A 131 -19.746 10.404 -5.179 1.00 25.44 H new ATOM 0 HG2 LYS A 131 -21.028 11.812 -3.493 1.00 21.23 H new ATOM 0 HG3 LYS A 131 -19.508 12.506 -2.965 1.00 21.23 H new ATOM 0 HD2 LYS A 131 -19.073 13.239 -5.368 1.00 20.44 H new ATOM 0 HD3 LYS A 131 -20.672 12.661 -5.792 1.00 20.44 H new ATOM 0 HE2 LYS A 131 -21.693 14.210 -4.114 1.00 61.22 H new ATOM 0 HE3 LYS A 131 -20.099 14.770 -3.647 1.00 61.22 H new ATOM 0 HZ1 LYS A 131 -21.113 16.261 -5.264 1.00 32.24 H new ATOM 0 HZ2 LYS A 131 -19.730 15.536 -5.930 1.00 32.24 H new ATOM 0 HZ3 LYS A 131 -21.274 14.994 -6.382 1.00 32.24 H new ATOM 2129 N LEU A 132 -17.543 8.400 -4.092 1.00 54.13 N ATOM 2130 CA LEU A 132 -16.948 7.172 -4.603 1.00 11.42 C ATOM 2131 C LEU A 132 -16.980 6.096 -3.526 1.00 42.24 C ATOM 2132 O LEU A 132 -17.396 4.959 -3.770 1.00 74.41 O ATOM 2133 CB LEU A 132 -15.501 7.426 -5.034 1.00 63.54 C ATOM 2134 CG LEU A 132 -15.423 8.714 -5.856 1.00 70.23 C ATOM 2135 CD1 LEU A 132 -14.017 8.857 -6.444 1.00 55.02 C ATOM 2136 CD2 LEU A 132 -16.449 8.665 -6.995 1.00 71.22 C ATOM 0 H LEU A 132 -16.918 9.206 -4.078 1.00 54.13 H new ATOM 0 HA LEU A 132 -17.522 6.836 -5.467 1.00 11.42 H new ATOM 0 HB2 LEU A 132 -14.859 7.504 -4.157 1.00 63.54 H new ATOM 0 HB3 LEU A 132 -15.134 6.585 -5.623 1.00 63.54 H new ATOM 0 HG LEU A 132 -15.640 9.566 -5.212 1.00 70.23 H new ATOM 0 HD11 LEU A 132 -13.959 9.774 -7.030 1.00 55.02 H new ATOM 0 HD12 LEU A 132 -13.287 8.896 -5.636 1.00 55.02 H new ATOM 0 HD13 LEU A 132 -13.802 8.002 -7.086 1.00 55.02 H new ATOM 0 HD21 LEU A 132 -16.390 9.584 -7.578 1.00 71.22 H new ATOM 0 HD22 LEU A 132 -16.236 7.812 -7.640 1.00 71.22 H new ATOM 0 HD23 LEU A 132 -17.451 8.564 -6.578 1.00 71.22 H new ATOM 2148 N ALA A 133 -16.549 6.464 -2.326 1.00 43.34 N ATOM 2149 CA ALA A 133 -16.543 5.522 -1.222 1.00 74.12 C ATOM 2150 C ALA A 133 -17.932 4.917 -1.052 1.00 44.24 C ATOM 2151 O ALA A 133 -18.065 3.754 -0.670 1.00 4.35 O ATOM 2152 CB ALA A 133 -16.114 6.217 0.068 1.00 75.44 C ATOM 0 H ALA A 133 -16.204 7.396 -2.097 1.00 43.34 H new ATOM 0 HA ALA A 133 -15.830 4.727 -1.442 1.00 74.12 H new ATOM 0 HB1 ALA A 133 -16.115 5.497 0.887 1.00 75.44 H new ATOM 0 HB2 ALA A 133 -15.111 6.626 -0.055 1.00 75.44 H new ATOM 0 HB3 ALA A 133 -16.810 7.025 0.295 1.00 75.44 H new ATOM 2158 N GLY A 134 -18.968 5.700 -1.358 1.00 22.24 N ATOM 2159 CA GLY A 134 -20.337 5.210 -1.253 1.00 3.24 C ATOM 2160 C GLY A 134 -20.569 4.113 -2.276 1.00 43.14 C ATOM 2161 O GLY A 134 -21.216 3.104 -1.993 1.00 43.50 O ATOM 0 H GLY A 134 -18.884 6.665 -1.677 1.00 22.24 H new ATOM 0 HA2 GLY A 134 -20.521 4.828 -0.249 1.00 3.24 H new ATOM 0 HA3 GLY A 134 -21.039 6.027 -1.417 1.00 3.24 H new ATOM 2165 N GLU A 135 -20.018 4.315 -3.466 1.00 22.13 N ATOM 2166 CA GLU A 135 -20.146 3.337 -4.530 1.00 13.44 C ATOM 2167 C GLU A 135 -19.458 2.043 -4.123 1.00 74.23 C ATOM 2168 O GLU A 135 -19.684 0.993 -4.724 1.00 52.13 O ATOM 2169 CB GLU A 135 -19.520 3.873 -5.819 1.00 74.13 C ATOM 2170 CG GLU A 135 -20.210 5.179 -6.218 1.00 62.43 C ATOM 2171 CD GLU A 135 -19.664 5.671 -7.554 1.00 15.20 C ATOM 2172 OE1 GLU A 135 -18.659 5.137 -7.993 1.00 23.12 O ATOM 2173 OE2 GLU A 135 -20.259 6.575 -8.118 1.00 34.54 O ATOM 0 H GLU A 135 -19.481 5.145 -3.715 1.00 22.13 H new ATOM 0 HA GLU A 135 -21.204 3.144 -4.707 1.00 13.44 H new ATOM 0 HB2 GLU A 135 -18.453 4.043 -5.674 1.00 74.13 H new ATOM 0 HB3 GLU A 135 -19.620 3.138 -6.617 1.00 74.13 H new ATOM 0 HG2 GLU A 135 -21.286 5.024 -6.291 1.00 62.43 H new ATOM 0 HG3 GLU A 135 -20.048 5.935 -5.449 1.00 62.43 H new ATOM 2180 N ARG A 136 -18.619 2.124 -3.087 1.00 64.24 N ATOM 2181 CA ARG A 136 -17.903 0.949 -2.591 1.00 71.45 C ATOM 2182 C ARG A 136 -18.559 0.420 -1.311 1.00 72.55 C ATOM 2183 O ARG A 136 -17.977 -0.398 -0.599 1.00 43.12 O ATOM 2184 CB ARG A 136 -16.441 1.323 -2.308 1.00 61.14 C ATOM 2185 CG ARG A 136 -15.564 0.066 -2.332 1.00 23.23 C ATOM 2186 CD ARG A 136 -14.103 0.460 -2.103 1.00 22.12 C ATOM 2187 NE ARG A 136 -13.315 -0.715 -1.748 1.00 75.22 N ATOM 2188 CZ ARG A 136 -12.187 -0.604 -1.053 1.00 31.41 C ATOM 2189 NH1 ARG A 136 -11.767 0.574 -0.676 1.00 61.52 N ATOM 2190 NH2 ARG A 136 -11.502 -1.670 -0.745 1.00 33.01 N ATOM 0 H ARG A 136 -18.420 2.986 -2.579 1.00 64.24 H new ATOM 0 HA ARG A 136 -17.942 0.167 -3.349 1.00 71.45 H new ATOM 0 HB2 ARG A 136 -16.089 2.036 -3.053 1.00 61.14 H new ATOM 0 HB3 ARG A 136 -16.364 1.812 -1.337 1.00 61.14 H new ATOM 0 HG2 ARG A 136 -15.889 -0.632 -1.561 1.00 23.23 H new ATOM 0 HG3 ARG A 136 -15.668 -0.445 -3.289 1.00 23.23 H new ATOM 0 HD2 ARG A 136 -13.697 0.921 -3.004 1.00 22.12 H new ATOM 0 HD3 ARG A 136 -14.039 1.203 -1.308 1.00 22.12 H new ATOM 0 HE ARG A 136 -13.635 -1.639 -2.038 1.00 75.22 H new ATOM 0 HH11 ARG A 136 -12.304 1.407 -0.915 1.00 61.52 H new ATOM 0 HH12 ARG A 136 -10.902 0.660 -0.143 1.00 61.52 H new ATOM 0 HH21 ARG A 136 -11.831 -2.590 -1.037 1.00 33.01 H new ATOM 0 HH22 ARG A 136 -10.637 -1.584 -0.212 1.00 33.01 H new ATOM 2204 N ASN A 137 -19.778 0.882 -1.033 1.00 3.34 N ATOM 2205 CA ASN A 137 -20.508 0.435 0.155 1.00 50.42 C ATOM 2206 C ASN A 137 -19.687 0.647 1.423 1.00 33.51 C ATOM 2207 O ASN A 137 -19.726 -0.167 2.345 1.00 21.54 O ATOM 2208 CB ASN A 137 -20.814 -1.041 0.019 1.00 13.44 C ATOM 2209 CG ASN A 137 -21.573 -1.306 -1.276 1.00 21.32 C ATOM 2210 OD1 ASN A 137 -21.285 -2.275 -1.978 1.00 50.41 O ATOM 2211 ND2 ASN A 137 -22.531 -0.497 -1.637 1.00 61.02 N ATOM 0 H ASN A 137 -20.278 1.560 -1.608 1.00 3.34 H new ATOM 0 HA ASN A 137 -21.425 1.019 0.232 1.00 50.42 H new ATOM 0 HB2 ASN A 137 -19.887 -1.614 0.029 1.00 13.44 H new ATOM 0 HB3 ASN A 137 -21.406 -1.377 0.871 1.00 13.44 H new ATOM 0 HD21 ASN A 137 -23.043 -0.667 -2.503 1.00 61.02 H new ATOM 0 HD22 ASN A 137 -22.768 0.305 -1.054 1.00 61.02 H new ATOM 2218 N TYR A 138 -18.951 1.738 1.454 1.00 34.52 N ATOM 2219 CA TYR A 138 -18.112 2.069 2.605 1.00 71.23 C ATOM 2220 C TYR A 138 -18.951 2.484 3.820 1.00 31.11 C ATOM 2221 O TYR A 138 -20.052 3.017 3.683 1.00 63.53 O ATOM 2222 CB TYR A 138 -17.148 3.206 2.228 1.00 5.32 C ATOM 2223 CG TYR A 138 -17.833 4.556 2.357 1.00 21.44 C ATOM 2224 CD1 TYR A 138 -19.171 4.716 1.975 1.00 43.42 C ATOM 2225 CD2 TYR A 138 -17.122 5.649 2.862 1.00 41.32 C ATOM 2226 CE1 TYR A 138 -19.794 5.963 2.100 1.00 54.40 C ATOM 2227 CE2 TYR A 138 -17.745 6.898 2.986 1.00 45.41 C ATOM 2228 CZ TYR A 138 -19.081 7.054 2.606 1.00 62.20 C ATOM 2229 OH TYR A 138 -19.695 8.284 2.728 1.00 40.12 O ATOM 0 H TYR A 138 -18.911 2.419 0.695 1.00 34.52 H new ATOM 0 HA TYR A 138 -17.549 1.176 2.879 1.00 71.23 H new ATOM 0 HB2 TYR A 138 -16.271 3.175 2.874 1.00 5.32 H new ATOM 0 HB3 TYR A 138 -16.796 3.067 1.206 1.00 5.32 H new ATOM 0 HD1 TYR A 138 -19.723 3.875 1.583 1.00 43.42 H new ATOM 0 HD2 TYR A 138 -16.090 5.530 3.157 1.00 41.32 H new ATOM 0 HE1 TYR A 138 -20.826 6.083 1.805 1.00 54.40 H new ATOM 0 HE2 TYR A 138 -17.193 7.740 3.375 1.00 45.41 H new ATOM 0 HH TYR A 138 -20.244 8.297 3.540 1.00 40.12 H new ATOM 2239 N THR A 139 -18.405 2.253 5.015 1.00 11.21 N ATOM 2240 CA THR A 139 -19.083 2.631 6.257 1.00 3.42 C ATOM 2241 C THR A 139 -18.184 3.568 7.064 1.00 30.54 C ATOM 2242 O THR A 139 -16.966 3.547 6.913 1.00 72.01 O ATOM 2243 CB THR A 139 -19.394 1.380 7.086 1.00 42.45 C ATOM 2244 OG1 THR A 139 -18.281 1.076 7.915 1.00 64.53 O ATOM 2245 CG2 THR A 139 -19.673 0.201 6.153 1.00 10.25 C ATOM 0 H THR A 139 -17.498 1.807 5.150 1.00 11.21 H new ATOM 0 HA THR A 139 -20.016 3.139 6.014 1.00 3.42 H new ATOM 0 HB THR A 139 -20.272 1.564 7.706 1.00 42.45 H new ATOM 0 HG1 THR A 139 -18.478 0.277 8.447 1.00 64.53 H new ATOM 0 HG21 THR A 139 -19.894 -0.687 6.745 1.00 10.25 H new ATOM 0 HG22 THR A 139 -20.527 0.435 5.517 1.00 10.25 H new ATOM 0 HG23 THR A 139 -18.798 0.014 5.531 1.00 10.25 H new ATOM 2253 N ASP A 140 -18.779 4.425 7.884 1.00 64.41 N ATOM 2254 CA ASP A 140 -17.978 5.382 8.645 1.00 12.20 C ATOM 2255 C ASP A 140 -16.744 4.713 9.252 1.00 73.25 C ATOM 2256 O ASP A 140 -15.624 5.178 9.046 1.00 10.33 O ATOM 2257 CB ASP A 140 -18.826 5.997 9.760 1.00 22.52 C ATOM 2258 CG ASP A 140 -19.915 6.881 9.159 1.00 50.22 C ATOM 2259 OD1 ASP A 140 -19.851 7.139 7.969 1.00 54.33 O ATOM 2260 OD2 ASP A 140 -20.796 7.286 9.900 1.00 73.21 O ATOM 0 H ASP A 140 -19.786 4.480 8.039 1.00 64.41 H new ATOM 0 HA ASP A 140 -17.644 6.162 7.961 1.00 12.20 H new ATOM 0 HB2 ASP A 140 -19.277 5.208 10.362 1.00 22.52 H new ATOM 0 HB3 ASP A 140 -18.195 6.585 10.426 1.00 22.52 H new ATOM 2265 N GLU A 141 -16.939 3.639 10.012 1.00 54.32 N ATOM 2266 CA GLU A 141 -15.813 2.955 10.646 1.00 62.02 C ATOM 2267 C GLU A 141 -14.818 2.421 9.616 1.00 43.11 C ATOM 2268 O GLU A 141 -13.646 2.211 9.931 1.00 42.22 O ATOM 2269 CB GLU A 141 -16.328 1.795 11.499 1.00 42.10 C ATOM 2270 CG GLU A 141 -17.184 2.343 12.643 1.00 63.25 C ATOM 2271 CD GLU A 141 -17.636 1.203 13.549 1.00 35.14 C ATOM 2272 OE1 GLU A 141 -17.453 0.059 13.165 1.00 12.21 O ATOM 2273 OE2 GLU A 141 -18.158 1.489 14.614 1.00 62.23 O ATOM 0 H GLU A 141 -17.852 3.227 10.203 1.00 54.32 H new ATOM 0 HA GLU A 141 -15.295 3.683 11.271 1.00 62.02 H new ATOM 0 HB2 GLU A 141 -16.916 1.112 10.886 1.00 42.10 H new ATOM 0 HB3 GLU A 141 -15.490 1.224 11.899 1.00 42.10 H new ATOM 0 HG2 GLU A 141 -16.613 3.071 13.219 1.00 63.25 H new ATOM 0 HG3 GLU A 141 -18.052 2.865 12.241 1.00 63.25 H new ATOM 2280 N MET A 142 -15.281 2.202 8.391 1.00 13.13 N ATOM 2281 CA MET A 142 -14.413 1.688 7.336 1.00 2.03 C ATOM 2282 C MET A 142 -13.543 2.801 6.763 1.00 44.23 C ATOM 2283 O MET A 142 -12.495 2.546 6.174 1.00 11.51 O ATOM 2284 CB MET A 142 -15.266 1.071 6.221 1.00 63.42 C ATOM 2285 CG MET A 142 -14.402 0.788 4.982 1.00 20.11 C ATOM 2286 SD MET A 142 -15.041 -0.669 4.115 1.00 32.02 S ATOM 2287 CE MET A 142 -14.704 -1.883 5.415 1.00 54.35 C ATOM 0 H MET A 142 -16.245 2.370 8.104 1.00 13.13 H new ATOM 0 HA MET A 142 -13.762 0.925 7.763 1.00 2.03 H new ATOM 0 HB2 MET A 142 -15.723 0.146 6.573 1.00 63.42 H new ATOM 0 HB3 MET A 142 -16.079 1.748 5.959 1.00 63.42 H new ATOM 0 HG2 MET A 142 -14.409 1.651 4.317 1.00 20.11 H new ATOM 0 HG3 MET A 142 -13.366 0.622 5.279 1.00 20.11 H new ATOM 0 HE1 MET A 142 -14.222 -2.758 4.979 1.00 54.35 H new ATOM 0 HE2 MET A 142 -14.046 -1.441 6.164 1.00 54.35 H new ATOM 0 HE3 MET A 142 -15.641 -2.182 5.886 1.00 54.35 H new ATOM 2297 N VAL A 143 -13.994 4.035 6.934 1.00 13.55 N ATOM 2298 CA VAL A 143 -13.265 5.199 6.424 1.00 41.44 C ATOM 2299 C VAL A 143 -13.041 6.226 7.532 1.00 52.04 C ATOM 2300 O VAL A 143 -13.983 6.619 8.218 1.00 64.33 O ATOM 2301 CB VAL A 143 -14.077 5.829 5.294 1.00 14.41 C ATOM 2302 CG1 VAL A 143 -15.313 6.522 5.876 1.00 31.43 C ATOM 2303 CG2 VAL A 143 -13.219 6.849 4.548 1.00 31.14 C ATOM 0 H VAL A 143 -14.861 4.262 7.421 1.00 13.55 H new ATOM 0 HA VAL A 143 -12.291 4.878 6.055 1.00 41.44 H new ATOM 0 HB VAL A 143 -14.392 5.050 4.599 1.00 14.41 H new ATOM 0 HG11 VAL A 143 -15.892 6.971 5.069 1.00 31.43 H new ATOM 0 HG12 VAL A 143 -15.928 5.790 6.400 1.00 31.43 H new ATOM 0 HG13 VAL A 143 -15.000 7.299 6.574 1.00 31.43 H new ATOM 0 HG21 VAL A 143 -13.802 7.296 3.743 1.00 31.14 H new ATOM 0 HG22 VAL A 143 -12.897 7.628 5.239 1.00 31.14 H new ATOM 0 HG23 VAL A 143 -12.344 6.352 4.129 1.00 31.14 H new ATOM 2313 N ALA A 144 -11.786 6.643 7.723 1.00 72.15 N ATOM 2314 CA ALA A 144 -11.469 7.613 8.784 1.00 14.32 C ATOM 2315 C ALA A 144 -10.694 8.834 8.270 1.00 35.44 C ATOM 2316 O ALA A 144 -9.607 8.706 7.708 1.00 32.23 O ATOM 2317 CB ALA A 144 -10.649 6.923 9.874 1.00 41.21 C ATOM 0 H ALA A 144 -10.985 6.334 7.171 1.00 72.15 H new ATOM 0 HA ALA A 144 -12.419 7.975 9.178 1.00 14.32 H new ATOM 0 HB1 ALA A 144 -10.413 7.640 10.661 1.00 41.21 H new ATOM 0 HB2 ALA A 144 -11.224 6.098 10.295 1.00 41.21 H new ATOM 0 HB3 ALA A 144 -9.724 6.538 9.445 1.00 41.21 H new ATOM 2323 N MET A 145 -11.265 10.021 8.504 1.00 51.40 N ATOM 2324 CA MET A 145 -10.647 11.283 8.112 1.00 50.21 C ATOM 2325 C MET A 145 -9.654 11.723 9.196 1.00 75.31 C ATOM 2326 O MET A 145 -9.820 11.375 10.365 1.00 70.10 O ATOM 2327 CB MET A 145 -11.732 12.363 7.911 1.00 51.22 C ATOM 2328 CG MET A 145 -13.089 11.710 7.557 1.00 64.22 C ATOM 2329 SD MET A 145 -13.822 12.553 6.139 1.00 24.31 S ATOM 2330 CE MET A 145 -12.954 11.607 4.863 1.00 74.21 C ATOM 0 H MET A 145 -12.166 10.129 8.969 1.00 51.40 H new ATOM 0 HA MET A 145 -10.113 11.148 7.171 1.00 50.21 H new ATOM 0 HB2 MET A 145 -11.834 12.958 8.819 1.00 51.22 H new ATOM 0 HB3 MET A 145 -11.432 13.045 7.115 1.00 51.22 H new ATOM 0 HG2 MET A 145 -12.946 10.654 7.330 1.00 64.22 H new ATOM 0 HG3 MET A 145 -13.763 11.764 8.412 1.00 64.22 H new ATOM 0 HE1 MET A 145 -13.188 12.020 3.882 1.00 74.21 H new ATOM 0 HE2 MET A 145 -11.879 11.666 5.035 1.00 74.21 H new ATOM 0 HE3 MET A 145 -13.271 10.565 4.903 1.00 74.21 H new ATOM 2340 N LEU A 146 -8.624 12.485 8.810 1.00 41.21 N ATOM 2341 CA LEU A 146 -7.619 12.956 9.780 1.00 72.34 C ATOM 2342 C LEU A 146 -7.573 14.494 9.819 1.00 1.24 C ATOM 2343 O LEU A 146 -7.633 15.141 8.774 1.00 73.40 O ATOM 2344 CB LEU A 146 -6.232 12.421 9.399 1.00 10.20 C ATOM 2345 CG LEU A 146 -6.277 10.881 9.264 1.00 21.43 C ATOM 2346 CD1 LEU A 146 -5.186 10.375 8.297 1.00 62.15 C ATOM 2347 CD2 LEU A 146 -6.057 10.236 10.638 1.00 1.24 C ATOM 0 H LEU A 146 -8.462 12.787 7.849 1.00 41.21 H new ATOM 0 HA LEU A 146 -7.901 12.586 10.766 1.00 72.34 H new ATOM 0 HB2 LEU A 146 -5.907 12.867 8.459 1.00 10.20 H new ATOM 0 HB3 LEU A 146 -5.502 12.707 10.157 1.00 10.20 H new ATOM 0 HG LEU A 146 -7.255 10.606 8.868 1.00 21.43 H new ATOM 0 HD11 LEU A 146 -5.242 9.289 8.222 1.00 62.15 H new ATOM 0 HD12 LEU A 146 -5.340 10.815 7.312 1.00 62.15 H new ATOM 0 HD13 LEU A 146 -4.204 10.663 8.673 1.00 62.15 H new ATOM 0 HD21 LEU A 146 -6.089 9.151 10.540 1.00 1.24 H new ATOM 0 HD22 LEU A 146 -5.085 10.536 11.029 1.00 1.24 H new ATOM 0 HD23 LEU A 146 -6.840 10.562 11.322 1.00 1.24 H new ATOM 2359 N PRO A 147 -7.463 15.093 10.993 1.00 61.04 N ATOM 2360 CA PRO A 147 -7.405 16.584 11.137 1.00 71.15 C ATOM 2361 C PRO A 147 -6.016 17.159 10.839 1.00 54.51 C ATOM 2362 O PRO A 147 -5.049 16.418 10.654 1.00 73.42 O ATOM 2363 CB PRO A 147 -7.776 16.798 12.605 1.00 45.23 C ATOM 2364 CG PRO A 147 -7.240 15.593 13.301 1.00 4.21 C ATOM 2365 CD PRO A 147 -7.389 14.430 12.313 1.00 51.13 C ATOM 0 HA PRO A 147 -8.064 17.090 10.431 1.00 71.15 H new ATOM 0 HB2 PRO A 147 -7.334 17.714 12.998 1.00 45.23 H new ATOM 0 HB3 PRO A 147 -8.855 16.885 12.734 1.00 45.23 H new ATOM 0 HG2 PRO A 147 -6.196 15.736 13.580 1.00 4.21 H new ATOM 0 HG3 PRO A 147 -7.791 15.396 14.220 1.00 4.21 H new ATOM 0 HD2 PRO A 147 -6.542 13.746 12.370 1.00 51.13 H new ATOM 0 HD3 PRO A 147 -8.286 13.845 12.517 1.00 51.13 H new ATOM 2373 N ARG A 148 -5.935 18.490 10.788 1.00 0.13 N ATOM 2374 CA ARG A 148 -4.674 19.181 10.507 1.00 14.33 C ATOM 2375 C ARG A 148 -3.613 18.871 11.560 1.00 12.42 C ATOM 2376 O ARG A 148 -2.430 19.139 11.351 1.00 21.44 O ATOM 2377 CB ARG A 148 -4.914 20.691 10.459 1.00 73.03 C ATOM 2378 CG ARG A 148 -5.565 21.151 11.766 1.00 23.30 C ATOM 2379 CD ARG A 148 -6.021 22.604 11.623 1.00 11.41 C ATOM 2380 NE ARG A 148 -6.637 23.063 12.863 1.00 52.11 N ATOM 2381 CZ ARG A 148 -7.221 24.255 12.940 1.00 5.31 C ATOM 2382 NH1 ARG A 148 -7.249 25.037 11.895 1.00 2.34 N ATOM 2383 NH2 ARG A 148 -7.766 24.643 14.061 1.00 32.22 N ATOM 0 H ARG A 148 -6.729 19.112 10.938 1.00 0.13 H new ATOM 0 HA ARG A 148 -4.308 18.827 9.543 1.00 14.33 H new ATOM 0 HB2 ARG A 148 -3.970 21.214 10.308 1.00 73.03 H new ATOM 0 HB3 ARG A 148 -5.556 20.940 9.614 1.00 73.03 H new ATOM 0 HG2 ARG A 148 -6.416 20.513 12.005 1.00 23.30 H new ATOM 0 HG3 ARG A 148 -4.857 21.060 12.590 1.00 23.30 H new ATOM 0 HD2 ARG A 148 -5.169 23.237 11.375 1.00 11.41 H new ATOM 0 HD3 ARG A 148 -6.732 22.690 10.801 1.00 11.41 H new ATOM 0 HE ARG A 148 -6.619 22.459 13.685 1.00 52.11 H new ATOM 0 HH11 ARG A 148 -6.823 24.734 11.019 1.00 2.34 H new ATOM 0 HH12 ARG A 148 -7.697 25.951 11.954 1.00 2.34 H new ATOM 0 HH21 ARG A 148 -7.744 24.032 14.877 1.00 32.22 H new ATOM 0 HH22 ARG A 148 -8.214 25.557 14.121 1.00 32.22 H new ATOM 2397 N GLN A 149 -4.033 18.313 12.689 1.00 62.24 N ATOM 2398 CA GLN A 149 -3.092 17.984 13.756 1.00 72.22 C ATOM 2399 C GLN A 149 -1.862 17.281 13.184 1.00 30.32 C ATOM 2400 O GLN A 149 -1.979 16.283 12.477 1.00 51.33 O ATOM 2401 CB GLN A 149 -3.763 17.081 14.793 1.00 43.22 C ATOM 2402 CG GLN A 149 -5.026 17.760 15.328 1.00 65.22 C ATOM 2403 CD GLN A 149 -4.649 18.879 16.293 1.00 74.22 C ATOM 2404 OE1 GLN A 149 -4.139 19.918 15.872 1.00 70.23 O ATOM 2405 NE2 GLN A 149 -4.871 18.729 17.570 1.00 53.41 N ATOM 0 H GLN A 149 -5.006 18.081 12.890 1.00 62.24 H new ATOM 0 HA GLN A 149 -2.780 18.911 14.236 1.00 72.22 H new ATOM 0 HB2 GLN A 149 -4.017 16.121 14.343 1.00 43.22 H new ATOM 0 HB3 GLN A 149 -3.073 16.877 15.612 1.00 43.22 H new ATOM 0 HG2 GLN A 149 -5.610 18.164 14.501 1.00 65.22 H new ATOM 0 HG3 GLN A 149 -5.655 17.028 15.835 1.00 65.22 H new ATOM 0 HE21 GLN A 149 -5.293 17.868 17.916 1.00 53.41 H new ATOM 0 HE22 GLN A 149 -4.622 19.473 18.222 1.00 53.41 H new ATOM 2414 N GLU A 150 -0.680 17.816 13.483 1.00 42.23 N ATOM 2415 CA GLU A 150 0.567 17.238 12.982 1.00 21.23 C ATOM 2416 C GLU A 150 1.608 17.146 14.093 1.00 62.23 C ATOM 2417 O GLU A 150 1.700 18.029 14.945 1.00 71.24 O ATOM 2418 CB GLU A 150 1.115 18.103 11.846 1.00 71.11 C ATOM 2419 CG GLU A 150 1.433 19.503 12.376 1.00 1.21 C ATOM 2420 CD GLU A 150 1.782 20.432 11.219 1.00 52.05 C ATOM 2421 OE1 GLU A 150 1.859 19.951 10.101 1.00 21.00 O ATOM 2422 OE2 GLU A 150 1.965 21.613 11.467 1.00 55.32 O ATOM 0 H GLU A 150 -0.559 18.644 14.066 1.00 42.23 H new ATOM 0 HA GLU A 150 0.357 16.233 12.616 1.00 21.23 H new ATOM 0 HB2 GLU A 150 2.014 17.648 11.429 1.00 71.11 H new ATOM 0 HB3 GLU A 150 0.386 18.166 11.038 1.00 71.11 H new ATOM 0 HG2 GLU A 150 0.577 19.897 12.924 1.00 1.21 H new ATOM 0 HG3 GLU A 150 2.265 19.455 13.078 1.00 1.21 H new ATOM 2429 N GLU A 151 2.415 16.086 14.053 1.00 74.43 N ATOM 2430 CA GLU A 151 3.478 15.895 15.031 1.00 45.11 C ATOM 2431 C GLU A 151 4.804 15.935 14.295 1.00 63.01 C ATOM 2432 O GLU A 151 5.502 16.949 14.305 1.00 2.22 O ATOM 2433 CB GLU A 151 3.312 14.549 15.742 1.00 75.41 C ATOM 2434 CG GLU A 151 1.902 14.449 16.323 1.00 44.43 C ATOM 2435 CD GLU A 151 1.714 15.493 17.419 1.00 42.42 C ATOM 2436 OE1 GLU A 151 2.712 15.993 17.911 1.00 43.23 O ATOM 2437 OE2 GLU A 151 0.575 15.776 17.751 1.00 72.33 O ATOM 0 H GLU A 151 2.350 15.348 13.352 1.00 74.43 H new ATOM 0 HA GLU A 151 3.439 16.681 15.785 1.00 45.11 H new ATOM 0 HB2 GLU A 151 3.487 13.732 15.042 1.00 75.41 H new ATOM 0 HB3 GLU A 151 4.052 14.452 16.537 1.00 75.41 H new ATOM 0 HG2 GLU A 151 1.164 14.600 15.535 1.00 44.43 H new ATOM 0 HG3 GLU A 151 1.737 13.451 16.728 1.00 44.43 H new ATOM 2444 N CYS A 152 5.139 14.830 13.642 1.00 71.14 N ATOM 2445 CA CYS A 152 6.370 14.740 12.884 1.00 3.32 C ATOM 2446 C CYS A 152 6.105 15.158 11.441 1.00 71.52 C ATOM 2447 O CYS A 152 4.959 15.207 10.996 1.00 54.34 O ATOM 2448 CB CYS A 152 6.890 13.295 12.926 1.00 30.35 C ATOM 2449 SG CYS A 152 8.450 13.221 13.845 1.00 21.52 S ATOM 0 H CYS A 152 4.570 13.983 13.625 1.00 71.14 H new ATOM 0 HA CYS A 152 7.120 15.402 13.317 1.00 3.32 H new ATOM 0 HB2 CYS A 152 6.150 12.648 13.397 1.00 30.35 H new ATOM 0 HB3 CYS A 152 7.038 12.924 11.912 1.00 30.35 H new ATOM 2454 N THR A 153 7.175 15.461 10.727 1.00 33.31 N ATOM 2455 CA THR A 153 7.067 15.887 9.334 1.00 75.00 C ATOM 2456 C THR A 153 8.366 15.596 8.586 1.00 5.21 C ATOM 2457 O THR A 153 9.408 15.374 9.203 1.00 61.12 O ATOM 2458 CB THR A 153 6.742 17.384 9.266 1.00 64.34 C ATOM 2459 OG1 THR A 153 7.686 18.105 10.045 1.00 31.32 O ATOM 2460 CG2 THR A 153 5.329 17.635 9.808 1.00 63.01 C ATOM 0 H THR A 153 8.130 15.421 11.084 1.00 33.31 H new ATOM 0 HA THR A 153 6.261 15.328 8.859 1.00 75.00 H new ATOM 0 HB THR A 153 6.791 17.718 8.230 1.00 64.34 H new ATOM 0 HG1 THR A 153 7.482 19.063 10.002 1.00 31.32 H new ATOM 0 HG21 THR A 153 5.104 18.700 9.757 1.00 63.01 H new ATOM 0 HG22 THR A 153 4.606 17.082 9.208 1.00 63.01 H new ATOM 0 HG23 THR A 153 5.272 17.301 10.844 1.00 63.01 H new ATOM 2468 N VAL A 154 8.306 15.607 7.256 1.00 75.41 N ATOM 2469 CA VAL A 154 9.477 15.355 6.448 1.00 73.31 C ATOM 2470 C VAL A 154 10.450 16.512 6.576 1.00 20.13 C ATOM 2471 O VAL A 154 10.052 17.678 6.598 1.00 73.12 O ATOM 2472 CB VAL A 154 9.072 15.205 4.983 1.00 53.32 C ATOM 2473 CG1 VAL A 154 8.192 13.965 4.805 1.00 60.11 C ATOM 2474 CG2 VAL A 154 8.302 16.452 4.541 1.00 73.12 C ATOM 0 H VAL A 154 7.455 15.789 6.724 1.00 75.41 H new ATOM 0 HA VAL A 154 9.952 14.437 6.793 1.00 73.31 H new ATOM 0 HB VAL A 154 9.968 15.092 4.372 1.00 53.32 H new ATOM 0 HG11 VAL A 154 7.909 13.867 3.757 1.00 60.11 H new ATOM 0 HG12 VAL A 154 8.745 13.079 5.116 1.00 60.11 H new ATOM 0 HG13 VAL A 154 7.295 14.065 5.416 1.00 60.11 H new ATOM 0 HG21 VAL A 154 8.011 16.349 3.496 1.00 73.12 H new ATOM 0 HG22 VAL A 154 7.410 16.566 5.156 1.00 73.12 H new ATOM 0 HG23 VAL A 154 8.936 17.331 4.656 1.00 73.12 H new ATOM 2484 N ASP A 155 11.725 16.186 6.657 1.00 44.51 N ATOM 2485 CA ASP A 155 12.755 17.210 6.781 1.00 60.43 C ATOM 2486 C ASP A 155 12.803 18.056 5.510 1.00 52.41 C ATOM 2487 O ASP A 155 12.783 17.529 4.398 1.00 44.23 O ATOM 2488 CB ASP A 155 14.134 16.571 7.045 1.00 13.14 C ATOM 2489 CG ASP A 155 14.009 15.053 7.152 1.00 73.11 C ATOM 2490 OD1 ASP A 155 13.116 14.600 7.850 1.00 25.24 O ATOM 2491 OD2 ASP A 155 14.808 14.369 6.536 1.00 2.12 O ATOM 0 H ASP A 155 12.075 15.228 6.640 1.00 44.51 H new ATOM 0 HA ASP A 155 12.507 17.849 7.628 1.00 60.43 H new ATOM 0 HB2 ASP A 155 14.821 16.829 6.239 1.00 13.14 H new ATOM 0 HB3 ASP A 155 14.557 16.973 7.966 1.00 13.14 H new ATOM 2496 N GLU A 156 12.863 19.366 5.691 1.00 11.22 N ATOM 2497 CA GLU A 156 12.912 20.286 4.571 1.00 33.33 C ATOM 2498 C GLU A 156 14.208 20.112 3.787 1.00 45.13 C ATOM 2499 O GLU A 156 14.224 20.225 2.561 1.00 43.22 O ATOM 2500 CB GLU A 156 12.812 21.715 5.095 1.00 51.45 C ATOM 2501 CG GLU A 156 11.511 21.884 5.881 1.00 73.13 C ATOM 2502 CD GLU A 156 10.313 21.711 4.953 1.00 34.21 C ATOM 2503 OE1 GLU A 156 10.495 21.837 3.753 1.00 35.50 O ATOM 2504 OE2 GLU A 156 9.231 21.455 5.456 1.00 3.15 O ATOM 0 H GLU A 156 12.879 19.815 6.607 1.00 11.22 H new ATOM 0 HA GLU A 156 12.077 20.077 3.902 1.00 33.33 H new ATOM 0 HB2 GLU A 156 13.666 21.939 5.734 1.00 51.45 H new ATOM 0 HB3 GLU A 156 12.841 22.420 4.265 1.00 51.45 H new ATOM 0 HG2 GLU A 156 11.466 21.151 6.687 1.00 73.13 H new ATOM 0 HG3 GLU A 156 11.482 22.870 6.345 1.00 73.13 H new ATOM 2511 N VAL A 157 15.293 19.837 4.503 1.00 74.02 N ATOM 2512 CA VAL A 157 16.592 19.651 3.864 1.00 31.04 C ATOM 2513 C VAL A 157 16.615 18.349 3.069 1.00 42.05 C ATOM 2514 O VAL A 157 16.922 17.325 3.656 1.00 44.11 O ATOM 2515 CB VAL A 157 17.695 19.624 4.923 1.00 71.14 C ATOM 2516 CG1 VAL A 157 19.058 19.794 4.247 1.00 14.14 C ATOM 2517 CG2 VAL A 157 17.474 20.767 5.916 1.00 0.35 C ATOM 2518 OXT VAL A 157 16.323 18.396 1.884 1.00 44.11 O ATOM 0 H VAL A 157 15.300 19.738 5.518 1.00 74.02 H new ATOM 0 HA VAL A 157 16.764 20.484 3.182 1.00 31.04 H new ATOM 0 HB VAL A 157 17.668 18.671 5.451 1.00 71.14 H new ATOM 0 HG11 VAL A 157 19.844 19.775 5.002 1.00 14.14 H new ATOM 0 HG12 VAL A 157 19.216 18.981 3.538 1.00 14.14 H new ATOM 0 HG13 VAL A 157 19.086 20.747 3.719 1.00 14.14 H new ATOM 0 HG21 VAL A 157 18.259 20.749 6.672 1.00 0.35 H new ATOM 0 HG22 VAL A 157 17.501 21.719 5.386 1.00 0.35 H new ATOM 0 HG23 VAL A 157 16.504 20.648 6.398 1.00 0.35 H new TER 2528 VAL A 157 HETATM 2529 O6 EB4 A 200 1.555 3.814 3.536 1.00 20.00 O HETATM 2530 O4 EB4 A 200 0.636 2.004 2.549 1.00 20.00 O HETATM 2531 O5 EB4 A 200 2.963 2.347 2.750 1.00 20.00 O HETATM 2532 N1 EB4 A 200 0.229 -1.697 5.679 1.00 20.00 N HETATM 2533 C5 EB4 A 200 4.125 1.655 2.892 1.00 20.00 C HETATM 2534 C4 EB4 A 200 -0.137 0.890 2.457 1.00 20.00 C HETATM 2535 C1 EB4 A 200 -0.015 0.021 3.536 1.00 20.00 C HETATM 2536 C2 EB4 A 200 4.332 1.103 4.150 1.00 20.00 C HETATM 2537 C6 EB4 A 200 0.945 4.469 4.560 1.00 20.00 C HETATM 2538 C8 EB4 A 200 5.075 1.478 1.892 1.00 20.00 C HETATM 2539 N2 EB4 A 200 4.645 -0.133 6.498 1.00 20.00 N HETATM 2540 C9 EB4 A 200 0.356 5.724 4.463 1.00 20.00 C HETATM 2541 C10 EB4 A 200 -1.734 -0.603 1.441 1.00 20.00 C HETATM 2542 O3 EB4 A 200 1.494 2.546 5.736 1.00 20.00 O HETATM 2543 N3 EB4 A 200 0.789 2.386 8.161 1.00 20.00 N HETATM 2544 C16 EB4 A 200 -0.752 -1.158 3.567 1.00 20.00 C HETATM 2545 C7 EB4 A 200 -0.997 0.574 1.411 1.00 20.00 C HETATM 2546 C3 EB4 A 200 0.937 3.786 5.772 1.00 20.00 C HETATM 2547 C11 EB4 A 200 6.229 0.748 2.152 1.00 20.00 C HETATM 2548 O1 EB4 A 200 0.854 0.434 4.497 1.00 20.00 O HETATM 2549 O2 EB4 A 200 3.346 1.333 5.058 1.00 20.00 O HETATM 2550 C12 EB4 A 200 -0.211 6.311 5.588 1.00 20.00 C HETATM 2551 C15 EB4 A 200 -0.187 5.644 6.808 1.00 20.00 C HETATM 2552 C14 EB4 A 200 6.434 0.195 3.410 1.00 20.00 C HETATM 2553 C13 EB4 A 200 -1.611 -1.471 2.520 1.00 20.00 C HETATM 2554 O7 EB4 A 200 -1.267 -3.137 4.765 1.00 20.00 O HETATM 2555 C19 EB4 A 200 -0.623 -2.089 4.722 1.00 20.00 C HETATM 2556 C22 EB4 A 200 0.467 -2.506 6.884 1.00 20.00 C HETATM 2557 C25 EB4 A 200 0.096 -1.723 8.134 1.00 20.00 C HETATM 2558 O10 EB4 A 200 -0.356 -2.301 9.122 1.00 20.00 O HETATM 2559 O15 EB4 A 200 0.293 -0.379 8.077 1.00 20.00 O HETATM 2560 C30 EB4 A 200 -0.076 0.372 9.243 1.00 20.00 C HETATM 2561 C24 EB4 A 200 0.863 1.559 9.374 1.00 20.00 C HETATM 2562 C21 EB4 A 200 0.410 3.670 8.211 1.00 20.00 C HETATM 2563 C18 EB4 A 200 0.386 4.381 6.901 1.00 20.00 C HETATM 2564 O9 EB4 A 200 0.096 4.252 9.248 1.00 20.00 O HETATM 2565 C27 EB4 A 200 2.275 0.971 9.671 1.00 20.00 C HETATM 2566 O12 EB4 A 200 2.557 0.520 10.780 1.00 20.00 O HETATM 2567 C28 EB4 A 200 1.894 -3.033 6.897 1.00 20.00 C HETATM 2568 O13 EB4 A 200 2.891 -1.999 6.864 1.00 20.00 O HETATM 2569 C26 EB4 A 200 3.603 -1.758 7.997 1.00 20.00 C HETATM 2570 O11 EB4 A 200 3.426 -2.349 9.061 1.00 20.00 O HETATM 2571 C23 EB4 A 200 4.674 -0.671 7.867 1.00 20.00 C HETATM 2572 C29 EB4 A 200 4.429 0.440 8.875 1.00 20.00 C HETATM 2573 O14 EB4 A 200 3.136 1.004 8.619 1.00 20.00 O HETATM 2574 C20 EB4 A 200 5.697 -0.181 5.669 1.00 20.00 C HETATM 2575 O8 EB4 A 200 6.784 -0.673 5.969 1.00 20.00 O HETATM 2576 C17 EB4 A 200 5.486 0.372 4.412 1.00 20.00 C HETATM 0 H30A EB4 A 200 -1.108 0.713 9.162 1.00 20.00 H new HETATM 0 H29A EB4 A 200 4.478 0.048 9.891 1.00 20.00 H new HETATM 0 H28A EB4 A 200 2.040 -3.638 7.792 1.00 20.00 H new HETATM 0 HN3 EB4 A 200 1.032 1.973 7.261 1.00 20.00 H new HETATM 0 HN2 EB4 A 200 3.783 0.297 6.164 1.00 20.00 H new HETATM 0 HN1 EB4 A 200 0.726 -0.813 5.569 1.00 20.00 H new HETATM 0 H9 EB4 A 200 0.339 6.247 3.507 1.00 20.00 H new HETATM 0 H8 EB4 A 200 4.915 1.911 0.905 1.00 20.00 H new HETATM 0 H7 EB4 A 200 -1.093 1.253 0.564 1.00 20.00 H new HETATM 0 H30 EB4 A 200 -0.017 -0.256 10.132 1.00 20.00 H new HETATM 0 H29 EB4 A 200 5.200 1.206 8.791 1.00 20.00 H new HETATM 0 H28 EB4 A 200 2.037 -3.691 6.040 1.00 20.00 H new HETATM 0 H24 EB4 A 200 0.594 2.232 10.188 1.00 20.00 H new HETATM 0 H23 EB4 A 200 5.654 -1.102 8.070 1.00 20.00 H new HETATM 0 H22 EB4 A 200 -0.182 -3.382 6.870 1.00 20.00 H new HETATM 0 H15 EB4 A 200 -0.618 6.112 7.693 1.00 20.00 H new HETATM 0 H14 EB4 A 200 7.339 -0.378 3.612 1.00 20.00 H new HETATM 0 H13 EB4 A 200 -2.187 -2.396 2.545 1.00 20.00 H new HETATM 0 H12 EB4 A 200 -0.675 7.295 5.514 1.00 20.00 H new HETATM 0 H11 EB4 A 200 6.974 0.609 1.368 1.00 20.00 H new HETATM 0 H10 EB4 A 200 -2.408 -0.846 0.620 1.00 20.00 H new HETATM 2598 GA GA A 201 1.812 1.954 4.042 1.00 20.00 GA HETATM 2599 C1 ACD A 300 -1.204 10.617 -10.669 1.00 20.00 C HETATM 2600 C2 ACD A 300 0.311 10.566 -10.884 1.00 20.00 C HETATM 2601 C3 ACD A 300 0.916 9.411 -10.082 1.00 20.00 C HETATM 2602 C4 ACD A 300 0.628 9.617 -8.594 1.00 20.00 C HETATM 2603 C5 ACD A 300 1.265 8.489 -7.780 1.00 20.00 C HETATM 2604 C6 ACD A 300 0.578 7.966 -6.516 1.00 20.00 C HETATM 2605 C7 ACD A 300 -0.753 8.564 -6.054 1.00 20.00 C HETATM 2606 C8 ACD A 300 -0.632 9.062 -4.612 1.00 20.00 C HETATM 2607 C9 ACD A 300 -0.669 8.081 -3.438 1.00 20.00 C HETATM 2608 C10 ACD A 300 -0.827 6.579 -3.679 1.00 20.00 C HETATM 2609 C11 ACD A 300 -1.651 5.972 -2.541 1.00 20.00 C HETATM 2610 C12 ACD A 300 -0.960 5.540 -1.247 1.00 20.00 C HETATM 2611 C13 ACD A 300 0.553 5.719 -1.101 1.00 20.00 C HETATM 2612 C14 ACD A 300 0.835 5.973 0.382 1.00 20.00 C HETATM 2613 C15 ACD A 300 0.960 7.400 0.921 1.00 20.00 C HETATM 2614 C16 ACD A 300 0.806 8.598 -0.018 1.00 20.00 C HETATM 2615 C17 ACD A 300 1.963 8.641 -1.018 1.00 20.00 C HETATM 2616 C18 ACD A 300 1.701 9.746 -2.044 1.00 20.00 C HETATM 2617 C19 ACD A 300 2.632 9.547 -3.240 1.00 20.00 C HETATM 2618 C20 ACD A 300 2.235 10.486 -4.380 1.00 20.00 C HETATM 2619 O1 ACD A 300 -1.771 11.716 -10.847 1.00 20.00 O HETATM 2620 O2 ACD A 300 -1.762 9.550 -10.331 1.00 20.00 O HETATM 0 H203 ACD A 300 1.211 10.274 -4.686 1.00 20.00 H new HETATM 0 H202 ACD A 300 2.306 11.520 -4.041 1.00 20.00 H new HETATM 0 H201 ACD A 300 2.905 10.335 -5.226 1.00 20.00 H new HETATM 0 H192 ACD A 300 3.663 9.739 -2.943 1.00 20.00 H new HETATM 0 H191 ACD A 300 2.585 8.512 -3.579 1.00 20.00 H new HETATM 0 H182 ACD A 300 0.661 9.719 -2.368 1.00 20.00 H new HETATM 0 H181 ACD A 300 1.870 10.725 -1.595 1.00 20.00 H new HETATM 0 H172 ACD A 300 2.902 8.827 -0.498 1.00 20.00 H new HETATM 0 H171 ACD A 300 2.062 7.678 -1.520 1.00 20.00 H new HETATM 0 H162 ACD A 300 -0.142 8.531 -0.551 1.00 20.00 H new HETATM 0 H161 ACD A 300 0.782 9.521 0.561 1.00 20.00 H new HETATM 0 H132 ACD A 300 1.081 4.830 -1.447 1.00 20.00 H new HETATM 0 H131 ACD A 300 0.902 6.554 -1.708 1.00 20.00 H new HETATM 0 H102 ACD A 300 -1.319 6.402 -4.635 1.00 20.00 H new HETATM 0 H101 ACD A 300 0.152 6.102 -3.731 1.00 20.00 H new HETATM 0 HO2 ACD A 300 -2.292 9.700 -9.520 1.00 20.00 H new HETATM 0 H9 ACD A 300 -0.582 8.457 -2.419 1.00 20.00 H new HETATM 0 H8 ACD A 300 -0.518 10.129 -4.419 1.00 20.00 H new HETATM 0 H72 ACD A 300 -1.038 9.387 -6.709 1.00 20.00 H new HETATM 0 H71 ACD A 300 -1.541 7.814 -6.123 1.00 20.00 H new HETATM 0 H6 ACD A 300 1.039 7.163 -5.941 1.00 20.00 H new HETATM 0 H5 ACD A 300 2.212 8.056 -8.102 1.00 20.00 H new HETATM 0 H42 ACD A 300 1.022 10.580 -8.268 1.00 20.00 H new HETATM 0 H41 ACD A 300 -0.448 9.638 -8.422 1.00 20.00 H new HETATM 0 H32 ACD A 300 0.496 8.463 -10.417 1.00 20.00 H new HETATM 0 H31 ACD A 300 1.992 9.361 -10.252 1.00 20.00 H new HETATM 0 H22 ACD A 300 0.532 10.438 -11.944 1.00 20.00 H new HETATM 0 H21 ACD A 300 0.762 11.509 -10.576 1.00 20.00 H new HETATM 0 H15 ACD A 300 1.160 7.564 1.980 1.00 20.00 H new HETATM 0 H14 ACD A 300 0.948 5.128 1.062 1.00 20.00 H new HETATM 0 H12 ACD A 300 -1.542 5.107 -0.433 1.00 20.00 H new HETATM 0 H11 ACD A 300 -2.728 5.848 -2.653 1.00 20.00 H new