USER MOD reduce.3.24.130724 H: found=0, std=0, add=1389, rem=0, adj=57 USER MOD reduce.3.24.130724 removed 1385 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 139 LYS NZ :NH3+ -177:sc= -6.65! (180deg=-7.7!) USER MOD Set 1.2: A 147 TYR OH : rot 180:sc= -0.845 USER MOD Set 2.1: A 142 MET CE :methyl 165:sc= -0.257 (180deg=-0.191) USER MOD Set 2.2: A 144 GLN : amide:sc= -2.55 K(o=-2.8,f=-3.8!) USER MOD Set 3.1: A 140 CYS SG : rot -82:sc= 0.084 USER MOD Set 3.2: A 148 SER OG : rot -102:sc= -2.46! USER MOD Set 4.1: A 125 GLN : amide:sc= -0.164 K(o=-0.28,f=-2.1!) USER MOD Set 4.2: A 138 TYR OH : rot -141:sc= -0.114 USER MOD Set 5.1: A 106 TYR OH : rot 180:sc= -1.53 USER MOD Set 5.2: A 160 GLN :FLIP amide:sc= -0.413 F(o=-3.6,f=-1.9) USER MOD Set 6.1: A 96 ASN :FLIP amide:sc= -1.17 F(o=-6.1!,f=-1.1) USER MOD Set 6.2: A 97 SER OG : rot 81:sc= 0.0687 USER MOD Set 7.1: A 93 THR OG1 : rot 180:sc= 0.0689 USER MOD Set 7.2: A 95 THR OG1 : rot 93:sc= 0.0719 USER MOD Set 8.1: A 69 LYS NZ :NH3+ -112:sc= -1.73! (180deg=-3.76!) USER MOD Set 8.2: A 70 ASN : amide:sc= -0.691 K(o=-2.4,f=-7.1!) USER MOD Set 9.1: A 4 MET CE :methyl 143:sc= 0 (180deg=-0.32) USER MOD Set 9.2: A 6 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 GLY N :NH3+ -106:sc= 0.101 (180deg=-0.0695) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 HIS : no HD1:sc= 0.576 K(o=0.58,f=-4.5!) USER MOD Single : A 11 SER OG : rot 1:sc= 1.13 USER MOD Single : A 16 MET CE :methyl -141:sc= -0.237 (180deg=-1.46!) USER MOD Single : A 20 ASN :FLIP amide:sc= -3.46! C(o=-13!,f=-3.5!) USER MOD Single : A 21 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 TYR OH : rot 50:sc= -0.762 USER MOD Single : A 24 GLN : amide:sc= -0.248 X(o=-0.25,f=0) USER MOD Single : A 25 LYS NZ :NH3+ 162:sc= -0.228 (180deg=-0.974) USER MOD Single : A 26 GLN : amide:sc= -0.15 K(o=-0.15,f=-2.6!) USER MOD Single : A 31 LYS NZ :NH3+ -109:sc= -1.51 (180deg=-4.14!) USER MOD Single : A 32 TYR OH : rot 30:sc= 0 USER MOD Single : A 33 GLN :FLIP amide:sc= -6.61! C(o=-10!,f=-6.6!) USER MOD Single : A 37 ASN : amide:sc= -0.897 X(o=-0.9,f=-1!) USER MOD Single : A 38 SER OG : rot -31:sc= 0.215 USER MOD Single : A 42 HIS : no HD1:sc= -5.01! C(o=-5!,f=-6.5!) USER MOD Single : A 47 THR OG1 : rot -50:sc= -2.91! USER MOD Single : A 49 GLN :FLIP amide:sc= -1.86 F(o=-7.7!,f=-1.9) USER MOD Single : A 64 SER OG : rot 68:sc= 0.509! USER MOD Single : A 65 LYS NZ :NH3+ -143:sc= -3.31 (180deg=-3.92!) USER MOD Single : A 66 LYS NZ :NH3+ -126:sc= -0.0142 (180deg=-0.421) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 ASN :FLIP amide:sc= -6.55! C(o=-8.9!,f=-6.5!) USER MOD Single : A 82 LYS NZ :NH3+ -118:sc= -1.72 (180deg=-4.11!) USER MOD Single : A 84 LYS NZ :NH3+ 140:sc= -0.583 (180deg=-1.8!) USER MOD Single : A 85 LYS NZ :NH3+ -147:sc= -0.353 (180deg=-1.67!) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 94 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 SER OG : rot -4:sc= 0.514! USER MOD Single : A 102 SER OG : rot 3:sc= 0.997 USER MOD Single : A 103 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 105 ASN : amide:sc= -0.1 K(o=-0.1,f=-1.5!) USER MOD Single : A 111 ASN : amide:sc= -0.245 X(o=-0.24,f=-0.21!) USER MOD Single : A 115 GLN : amide:sc= -2.53! C(o=-2.5!,f=-4.4!) USER MOD Single : A 116 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.0411) USER MOD Single : A 117 LYS NZ :NH3+ -123:sc= -1.01 (180deg=-2.74!) USER MOD Single : A 120 THR OG1 : rot 180:sc= -0.0597 USER MOD Single : A 122 ASN : amide:sc= -0.0554 X(o=-0.055,f=-0.055) USER MOD Single : A 123 TYR OH : rot 124:sc= -2.54 USER MOD Single : A 126 CYS SG : rot 180:sc= 0 USER MOD Single : A 128 SER OG : rot 180:sc= 0 USER MOD Single : A 131 HIS : no HD1:sc= -0.346 X(o=-0.35,f=-0.093) USER MOD Single : A 137 HIS :FLIP no HD1:sc= -0.631 F(o=-1.9!,f=-0.63) USER MOD Single : A 141 LYS NZ :NH3+ -111:sc= -0.0559 (180deg=-1.82!) USER MOD Single : A 145 LYS NZ :NH3+ 163:sc= -2.04! (180deg=-2.55) USER MOD Single : A 151 THR OG1 : rot 180:sc= -0.0133 USER MOD Single : A 153 SER OG : rot 180:sc= 0 USER MOD Single : A 154 THR OG1 : rot 180:sc= 1.02 USER MOD Single : A 155 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 156 GLN : amide:sc= -0.0432 K(o=-0.043,f=-2!) USER MOD Single : A 159 LYS NZ :NH3+ -167:sc= -0.0104 (180deg=-0.209) USER MOD Single : A 164 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 167 TYR OH : rot 180:sc= 0 USER MOD Single : A 169 GLN : amide:sc= -0.412 K(o=-0.41,f=-1.6!) USER MOD Single : A 172 SER OG : rot 79:sc= 0.0264 USER MOD Single : A 175 THR OG1 : rot 180:sc= -0.1 USER MOD Single : A 177 SER OG : rot 180:sc= -0.328 USER MOD Single : A 179 CYS SG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -49.912 53.650 35.239 1.00 7.70 N ATOM 2 CA GLY A 1 -51.070 52.968 35.891 1.00 7.07 C ATOM 3 C GLY A 1 -52.352 53.334 35.163 1.00 6.51 C ATOM 4 O GLY A 1 -52.414 54.314 34.448 1.00 6.76 O ATOM 0 H1 GLY A 1 -49.362 52.955 34.695 1.00 7.70 H new ATOM 0 H2 GLY A 1 -50.261 54.393 34.600 1.00 7.70 H new ATOM 0 H3 GLY A 1 -49.306 54.077 35.968 1.00 7.70 H new ATOM 0 HA2 GLY A 1 -50.926 51.888 35.874 1.00 7.07 H new ATOM 0 HA3 GLY A 1 -51.137 53.264 36.938 1.00 7.07 H new ATOM 10 N SER A 2 -53.379 52.547 35.335 1.00 6.07 N ATOM 11 CA SER A 2 -54.680 52.839 34.657 1.00 5.84 C ATOM 12 C SER A 2 -55.239 54.155 35.187 1.00 5.13 C ATOM 13 O SER A 2 -55.754 54.978 34.455 1.00 5.02 O ATOM 14 CB SER A 2 -55.672 51.712 34.965 1.00 6.37 C ATOM 15 OG SER A 2 -55.155 50.479 34.488 1.00 6.61 O ATOM 0 H SER A 2 -53.375 51.710 35.918 1.00 6.07 H new ATOM 0 HA SER A 2 -54.525 52.912 33.580 1.00 5.84 H new ATOM 0 HB2 SER A 2 -55.849 51.653 36.039 1.00 6.37 H new ATOM 0 HB3 SER A 2 -56.633 51.921 34.495 1.00 6.37 H new ATOM 0 HG SER A 2 -55.790 49.759 34.687 1.00 6.61 H new ATOM 21 N HIS A 3 -55.117 54.363 36.464 1.00 5.05 N ATOM 22 CA HIS A 3 -55.617 55.618 37.075 1.00 4.79 C ATOM 23 C HIS A 3 -54.849 56.799 36.485 1.00 4.42 C ATOM 24 O HIS A 3 -55.343 57.495 35.623 1.00 4.46 O ATOM 25 CB HIS A 3 -55.392 55.578 38.590 1.00 5.39 C ATOM 26 CG HIS A 3 -55.882 54.272 39.147 1.00 5.81 C ATOM 27 ND1 HIS A 3 -55.261 53.067 38.861 1.00 6.26 N ATOM 28 CD2 HIS A 3 -56.930 53.966 39.980 1.00 6.29 C ATOM 29 CE1 HIS A 3 -55.935 52.100 39.508 1.00 6.90 C ATOM 30 NE2 HIS A 3 -56.962 52.593 40.207 1.00 6.95 N ATOM 0 H HIS A 3 -54.687 53.708 37.117 1.00 5.05 H new ATOM 0 HA HIS A 3 -56.682 55.725 36.869 1.00 4.79 H new ATOM 0 HB2 HIS A 3 -54.332 55.703 38.812 1.00 5.39 H new ATOM 0 HB3 HIS A 3 -55.917 56.406 39.066 1.00 5.39 H new ATOM 0 HD2 HIS A 3 -57.624 54.682 40.396 1.00 6.29 H new ATOM 0 HE1 HIS A 3 -55.678 51.052 39.468 1.00 6.90 H new ATOM 0 HE2 HIS A 3 -57.626 52.075 40.783 1.00 6.95 H new ATOM 38 N MET A 4 -53.641 57.027 36.935 1.00 4.18 N ATOM 39 CA MET A 4 -52.855 58.158 36.389 1.00 4.04 C ATOM 40 C MET A 4 -52.797 58.051 34.866 1.00 3.74 C ATOM 41 O MET A 4 -53.396 57.177 34.272 1.00 3.84 O ATOM 42 CB MET A 4 -51.443 58.128 36.973 1.00 3.97 C ATOM 43 CG MET A 4 -50.756 56.809 36.616 1.00 4.33 C ATOM 44 SD MET A 4 -49.345 56.550 37.721 1.00 4.85 S ATOM 45 CE MET A 4 -48.095 57.360 36.693 1.00 5.34 C ATOM 0 H MET A 4 -53.172 56.477 37.655 1.00 4.18 H new ATOM 0 HA MET A 4 -53.331 59.100 36.661 1.00 4.04 H new ATOM 0 HB2 MET A 4 -50.863 58.966 36.586 1.00 3.97 H new ATOM 0 HB3 MET A 4 -51.486 58.243 38.056 1.00 3.97 H new ATOM 0 HG2 MET A 4 -51.461 55.982 36.708 1.00 4.33 H new ATOM 0 HG3 MET A 4 -50.421 56.829 35.579 1.00 4.33 H new ATOM 0 HE1 MET A 4 -47.392 57.896 37.330 1.00 5.34 H new ATOM 0 HE2 MET A 4 -47.559 56.609 36.112 1.00 5.34 H new ATOM 0 HE3 MET A 4 -48.580 58.063 36.017 1.00 5.34 H new ATOM 55 N GLU A 5 -52.089 58.940 34.226 1.00 3.54 N ATOM 56 CA GLU A 5 -52.005 58.895 32.741 1.00 3.40 C ATOM 57 C GLU A 5 -50.695 59.544 32.291 1.00 3.22 C ATOM 58 O GLU A 5 -50.659 60.326 31.362 1.00 3.41 O ATOM 59 CB GLU A 5 -53.196 59.658 32.156 1.00 3.82 C ATOM 60 CG GLU A 5 -53.452 59.212 30.716 1.00 3.88 C ATOM 61 CD GLU A 5 -54.392 60.214 30.042 1.00 4.31 C ATOM 62 OE1 GLU A 5 -54.739 61.193 30.684 1.00 4.62 O ATOM 63 OE2 GLU A 5 -54.750 59.987 28.899 1.00 4.63 O ATOM 0 H GLU A 5 -51.565 59.695 34.668 1.00 3.54 H new ATOM 0 HA GLU A 5 -52.029 57.862 32.393 1.00 3.40 H new ATOM 0 HB2 GLU A 5 -54.084 59.481 32.763 1.00 3.82 H new ATOM 0 HB3 GLU A 5 -53.000 60.730 32.183 1.00 3.82 H new ATOM 0 HG2 GLU A 5 -52.512 59.151 30.168 1.00 3.88 H new ATOM 0 HG3 GLU A 5 -53.893 58.215 30.704 1.00 3.88 H new ATOM 70 N MET A 6 -49.620 59.223 32.954 1.00 3.02 N ATOM 71 CA MET A 6 -48.302 59.809 32.589 1.00 3.02 C ATOM 72 C MET A 6 -47.210 58.783 32.883 1.00 2.79 C ATOM 73 O MET A 6 -47.391 57.885 33.681 1.00 3.01 O ATOM 74 CB MET A 6 -48.056 61.063 33.430 1.00 3.46 C ATOM 75 CG MET A 6 -48.139 60.697 34.913 1.00 3.58 C ATOM 76 SD MET A 6 -48.064 62.200 35.917 1.00 4.33 S ATOM 77 CE MET A 6 -48.462 61.425 37.504 1.00 4.68 C ATOM 0 H MET A 6 -49.599 58.574 33.740 1.00 3.02 H new ATOM 0 HA MET A 6 -48.291 60.073 31.531 1.00 3.02 H new ATOM 0 HB2 MET A 6 -47.077 61.483 33.201 1.00 3.46 H new ATOM 0 HB3 MET A 6 -48.795 61.828 33.190 1.00 3.46 H new ATOM 0 HG2 MET A 6 -49.066 60.160 35.114 1.00 3.58 H new ATOM 0 HG3 MET A 6 -47.320 60.029 35.179 1.00 3.58 H new ATOM 0 HE1 MET A 6 -48.471 62.183 38.287 1.00 4.68 H new ATOM 0 HE2 MET A 6 -49.443 60.954 37.443 1.00 4.68 H new ATOM 0 HE3 MET A 6 -47.711 60.670 37.739 1.00 4.68 H new ATOM 87 N ALA A 7 -46.078 58.907 32.254 1.00 2.70 N ATOM 88 CA ALA A 7 -44.981 57.935 32.512 1.00 2.68 C ATOM 89 C ALA A 7 -44.342 58.257 33.862 1.00 2.89 C ATOM 90 O ALA A 7 -43.279 57.769 34.191 1.00 3.39 O ATOM 91 CB ALA A 7 -43.927 58.045 31.408 1.00 3.04 C ATOM 0 H ALA A 7 -45.864 59.637 31.574 1.00 2.70 H new ATOM 0 HA ALA A 7 -45.382 56.921 32.524 1.00 2.68 H new ATOM 0 HB1 ALA A 7 -43.125 57.332 31.599 1.00 3.04 H new ATOM 0 HB2 ALA A 7 -44.386 57.825 30.444 1.00 3.04 H new ATOM 0 HB3 ALA A 7 -43.519 59.056 31.394 1.00 3.04 H new ATOM 97 N GLY A 8 -44.983 59.083 34.646 1.00 2.92 N ATOM 98 CA GLY A 8 -44.412 59.441 35.973 1.00 3.37 C ATOM 99 C GLY A 8 -42.962 59.884 35.789 1.00 3.20 C ATOM 100 O GLY A 8 -42.180 59.894 36.718 1.00 3.47 O ATOM 0 H GLY A 8 -45.876 59.524 34.423 1.00 2.92 H new ATOM 0 HA2 GLY A 8 -44.995 60.241 36.430 1.00 3.37 H new ATOM 0 HA3 GLY A 8 -44.461 58.586 36.647 1.00 3.37 H new ATOM 104 N ASP A 9 -42.598 60.246 34.589 1.00 2.88 N ATOM 105 CA ASP A 9 -41.199 60.684 34.330 1.00 2.77 C ATOM 106 C ASP A 9 -41.057 62.167 34.671 1.00 3.05 C ATOM 107 O ASP A 9 -42.026 62.850 34.940 1.00 3.41 O ATOM 108 CB ASP A 9 -40.866 60.469 32.853 1.00 2.55 C ATOM 109 CG ASP A 9 -39.397 60.809 32.603 1.00 3.03 C ATOM 110 OD1 ASP A 9 -38.561 60.310 33.337 1.00 3.59 O ATOM 111 OD2 ASP A 9 -39.134 61.563 31.680 1.00 3.45 O ATOM 0 H ASP A 9 -43.212 60.257 33.775 1.00 2.88 H new ATOM 0 HA ASP A 9 -40.515 60.102 34.948 1.00 2.77 H new ATOM 0 HB2 ASP A 9 -41.063 59.434 32.572 1.00 2.55 H new ATOM 0 HB3 ASP A 9 -41.505 61.095 32.231 1.00 2.55 H new ATOM 116 N LEU A 10 -39.854 62.668 34.663 1.00 3.09 N ATOM 117 CA LEU A 10 -39.640 64.105 34.987 1.00 3.52 C ATOM 118 C LEU A 10 -38.322 64.566 34.376 1.00 3.41 C ATOM 119 O LEU A 10 -37.997 65.736 34.371 1.00 3.76 O ATOM 120 CB LEU A 10 -39.602 64.290 36.509 1.00 4.09 C ATOM 121 CG LEU A 10 -38.350 63.621 37.093 1.00 4.11 C ATOM 122 CD1 LEU A 10 -38.312 63.850 38.605 1.00 4.77 C ATOM 123 CD2 LEU A 10 -38.384 62.114 36.810 1.00 3.95 C ATOM 0 H LEU A 10 -39.007 62.142 34.445 1.00 3.09 H new ATOM 0 HA LEU A 10 -40.457 64.699 34.577 1.00 3.52 H new ATOM 0 HB2 LEU A 10 -39.603 65.352 36.754 1.00 4.09 H new ATOM 0 HB3 LEU A 10 -40.497 63.858 36.958 1.00 4.09 H new ATOM 0 HG LEU A 10 -37.463 64.054 36.631 1.00 4.11 H new ATOM 0 HD11 LEU A 10 -37.424 63.376 39.023 1.00 4.77 H new ATOM 0 HD12 LEU A 10 -38.283 64.920 38.810 1.00 4.77 H new ATOM 0 HD13 LEU A 10 -39.203 63.417 39.061 1.00 4.77 H new ATOM 0 HD21 LEU A 10 -37.493 61.645 37.227 1.00 3.95 H new ATOM 0 HD22 LEU A 10 -39.272 61.678 37.268 1.00 3.95 H new ATOM 0 HD23 LEU A 10 -38.412 61.947 35.733 1.00 3.95 H new ATOM 135 N SER A 11 -37.568 63.649 33.853 1.00 3.01 N ATOM 136 CA SER A 11 -36.268 64.010 33.229 1.00 3.03 C ATOM 137 C SER A 11 -35.839 62.896 32.274 1.00 2.78 C ATOM 138 O SER A 11 -35.480 61.814 32.693 1.00 2.91 O ATOM 139 CB SER A 11 -35.207 64.193 34.313 1.00 3.25 C ATOM 140 OG SER A 11 -35.444 65.414 35.001 1.00 3.69 O ATOM 0 H SER A 11 -37.796 62.655 33.830 1.00 3.01 H new ATOM 0 HA SER A 11 -36.378 64.943 32.676 1.00 3.03 H new ATOM 0 HB2 SER A 11 -35.237 63.357 35.012 1.00 3.25 H new ATOM 0 HB3 SER A 11 -34.212 64.201 33.867 1.00 3.25 H new ATOM 0 HG SER A 11 -36.238 65.851 34.628 1.00 3.69 H new ATOM 146 N ALA A 12 -35.883 63.151 30.993 1.00 2.79 N ATOM 147 CA ALA A 12 -35.485 62.109 30.002 1.00 2.79 C ATOM 148 C ALA A 12 -36.642 61.120 29.837 1.00 2.33 C ATOM 149 O ALA A 12 -37.788 61.510 29.736 1.00 2.48 O ATOM 150 CB ALA A 12 -34.222 61.381 30.485 1.00 3.25 C ATOM 0 H ALA A 12 -36.179 64.040 30.589 1.00 2.79 H new ATOM 0 HA ALA A 12 -35.264 62.574 29.041 1.00 2.79 H new ATOM 0 HB1 ALA A 12 -33.938 60.622 29.756 1.00 3.25 H new ATOM 0 HB2 ALA A 12 -33.409 62.098 30.597 1.00 3.25 H new ATOM 0 HB3 ALA A 12 -34.421 60.905 31.445 1.00 3.25 H new ATOM 156 N GLY A 13 -36.356 59.844 29.818 1.00 2.12 N ATOM 157 CA GLY A 13 -37.443 58.829 29.668 1.00 1.97 C ATOM 158 C GLY A 13 -37.445 57.899 30.884 1.00 2.03 C ATOM 159 O GLY A 13 -37.437 58.340 32.017 1.00 2.34 O ATOM 0 H GLY A 13 -35.415 59.460 29.900 1.00 2.12 H new ATOM 0 HA2 GLY A 13 -38.409 59.326 29.575 1.00 1.97 H new ATOM 0 HA3 GLY A 13 -37.293 58.252 28.756 1.00 1.97 H new ATOM 163 N PHE A 14 -37.458 56.615 30.657 1.00 1.88 N ATOM 164 CA PHE A 14 -37.462 55.650 31.793 1.00 2.02 C ATOM 165 C PHE A 14 -37.066 54.275 31.274 1.00 1.94 C ATOM 166 O PHE A 14 -35.965 53.808 31.491 1.00 1.97 O ATOM 167 CB PHE A 14 -38.867 55.591 32.404 1.00 2.11 C ATOM 168 CG PHE A 14 -38.829 54.857 33.727 1.00 2.33 C ATOM 169 CD1 PHE A 14 -38.505 55.544 34.905 1.00 2.77 C ATOM 170 CD2 PHE A 14 -39.124 53.489 33.775 1.00 2.68 C ATOM 171 CE1 PHE A 14 -38.481 54.863 36.129 1.00 2.97 C ATOM 172 CE2 PHE A 14 -39.098 52.808 34.998 1.00 2.95 C ATOM 173 CZ PHE A 14 -38.775 53.494 36.174 1.00 2.84 C ATOM 0 H PHE A 14 -37.466 56.190 29.730 1.00 1.88 H new ATOM 0 HA PHE A 14 -36.753 55.969 32.557 1.00 2.02 H new ATOM 0 HB2 PHE A 14 -39.251 56.601 32.550 1.00 2.11 H new ATOM 0 HB3 PHE A 14 -39.549 55.087 31.719 1.00 2.11 H new ATOM 0 HD1 PHE A 14 -38.274 56.598 34.869 1.00 2.77 H new ATOM 0 HD2 PHE A 14 -39.372 52.959 32.867 1.00 2.68 H new ATOM 0 HE1 PHE A 14 -38.236 55.393 37.037 1.00 2.97 H new ATOM 0 HE2 PHE A 14 -39.327 51.753 35.034 1.00 2.95 H new ATOM 0 HZ PHE A 14 -38.752 52.968 37.117 1.00 2.84 H new ATOM 183 N PHE A 15 -37.945 53.636 30.567 1.00 1.86 N ATOM 184 CA PHE A 15 -37.621 52.308 30.004 1.00 1.83 C ATOM 185 C PHE A 15 -36.576 52.541 28.915 1.00 1.69 C ATOM 186 O PHE A 15 -35.868 51.648 28.498 1.00 1.69 O ATOM 187 CB PHE A 15 -38.900 51.693 29.408 1.00 1.80 C ATOM 188 CG PHE A 15 -38.985 50.225 29.752 1.00 1.88 C ATOM 189 CD1 PHE A 15 -37.841 49.433 29.686 1.00 2.02 C ATOM 190 CD2 PHE A 15 -40.208 49.660 30.129 1.00 1.99 C ATOM 191 CE1 PHE A 15 -37.911 48.069 29.997 1.00 2.12 C ATOM 192 CE2 PHE A 15 -40.283 48.297 30.442 1.00 2.11 C ATOM 193 CZ PHE A 15 -39.133 47.501 30.375 1.00 2.11 C ATOM 0 H PHE A 15 -38.881 53.980 30.354 1.00 1.86 H new ATOM 0 HA PHE A 15 -37.237 51.623 30.760 1.00 1.83 H new ATOM 0 HB2 PHE A 15 -39.776 52.215 29.793 1.00 1.80 H new ATOM 0 HB3 PHE A 15 -38.903 51.821 28.325 1.00 1.80 H new ATOM 0 HD1 PHE A 15 -36.898 49.872 29.394 1.00 2.02 H new ATOM 0 HD2 PHE A 15 -41.094 50.275 30.179 1.00 1.99 H new ATOM 0 HE1 PHE A 15 -37.023 47.456 29.945 1.00 2.12 H new ATOM 0 HE2 PHE A 15 -41.227 47.860 30.735 1.00 2.11 H new ATOM 0 HZ PHE A 15 -39.189 46.449 30.615 1.00 2.11 H new ATOM 203 N MET A 16 -36.468 53.767 28.482 1.00 1.62 N ATOM 204 CA MET A 16 -35.473 54.128 27.449 1.00 1.53 C ATOM 205 C MET A 16 -34.095 54.129 28.094 1.00 1.62 C ATOM 206 O MET A 16 -33.162 53.537 27.591 1.00 1.61 O ATOM 207 CB MET A 16 -35.795 55.524 26.921 1.00 1.50 C ATOM 208 CG MET A 16 -35.251 55.681 25.507 1.00 1.50 C ATOM 209 SD MET A 16 -33.446 55.526 25.526 1.00 2.33 S ATOM 210 CE MET A 16 -33.087 56.997 26.520 1.00 2.06 C ATOM 0 H MET A 16 -37.041 54.544 28.811 1.00 1.62 H new ATOM 0 HA MET A 16 -35.496 53.416 26.624 1.00 1.53 H new ATOM 0 HB2 MET A 16 -36.873 55.684 26.925 1.00 1.50 H new ATOM 0 HB3 MET A 16 -35.358 56.279 27.574 1.00 1.50 H new ATOM 0 HG2 MET A 16 -35.684 54.923 24.854 1.00 1.50 H new ATOM 0 HG3 MET A 16 -35.538 56.652 25.102 1.00 1.50 H new ATOM 0 HE1 MET A 16 -32.197 57.491 26.130 1.00 2.06 H new ATOM 0 HE2 MET A 16 -33.933 57.683 26.474 1.00 2.06 H new ATOM 0 HE3 MET A 16 -32.914 56.703 27.555 1.00 2.06 H new ATOM 220 N GLU A 17 -33.960 54.779 29.222 1.00 1.73 N ATOM 221 CA GLU A 17 -32.643 54.786 29.895 1.00 1.85 C ATOM 222 C GLU A 17 -32.273 53.338 30.186 1.00 1.92 C ATOM 223 O GLU A 17 -31.115 52.984 30.295 1.00 1.99 O ATOM 224 CB GLU A 17 -32.723 55.575 31.203 1.00 2.01 C ATOM 225 CG GLU A 17 -31.409 55.417 31.973 1.00 2.17 C ATOM 226 CD GLU A 17 -31.308 56.508 33.041 1.00 2.46 C ATOM 227 OE1 GLU A 17 -31.798 56.284 34.135 1.00 2.81 O ATOM 228 OE2 GLU A 17 -30.743 57.548 32.746 1.00 2.84 O ATOM 0 H GLU A 17 -34.700 55.297 29.695 1.00 1.73 H new ATOM 0 HA GLU A 17 -31.892 55.258 29.261 1.00 1.85 H new ATOM 0 HB2 GLU A 17 -32.911 56.628 30.994 1.00 2.01 H new ATOM 0 HB3 GLU A 17 -33.557 55.216 31.807 1.00 2.01 H new ATOM 0 HG2 GLU A 17 -31.364 54.432 32.439 1.00 2.17 H new ATOM 0 HG3 GLU A 17 -30.564 55.484 31.288 1.00 2.17 H new ATOM 235 N GLU A 18 -33.263 52.491 30.292 1.00 1.93 N ATOM 236 CA GLU A 18 -32.993 51.055 30.552 1.00 2.04 C ATOM 237 C GLU A 18 -32.670 50.386 29.221 1.00 1.96 C ATOM 238 O GLU A 18 -31.682 49.692 29.077 1.00 2.03 O ATOM 239 CB GLU A 18 -34.226 50.410 31.188 1.00 2.14 C ATOM 240 CG GLU A 18 -34.444 51.004 32.582 1.00 2.28 C ATOM 241 CD GLU A 18 -33.361 50.488 33.532 1.00 2.74 C ATOM 242 OE1 GLU A 18 -33.581 49.456 34.144 1.00 3.06 O ATOM 243 OE2 GLU A 18 -32.330 51.133 33.630 1.00 3.34 O ATOM 0 H GLU A 18 -34.249 52.737 30.209 1.00 1.93 H new ATOM 0 HA GLU A 18 -32.153 50.939 31.237 1.00 2.04 H new ATOM 0 HB2 GLU A 18 -35.104 50.583 30.565 1.00 2.14 H new ATOM 0 HB3 GLU A 18 -34.092 49.331 31.257 1.00 2.14 H new ATOM 0 HG2 GLU A 18 -34.412 52.092 32.534 1.00 2.28 H new ATOM 0 HG3 GLU A 18 -35.431 50.730 32.955 1.00 2.28 H new ATOM 250 N LEU A 19 -33.483 50.623 28.238 1.00 1.83 N ATOM 251 CA LEU A 19 -33.221 50.049 26.894 1.00 1.81 C ATOM 252 C LEU A 19 -31.829 50.511 26.460 1.00 1.78 C ATOM 253 O LEU A 19 -31.012 49.750 25.980 1.00 1.86 O ATOM 254 CB LEU A 19 -34.261 50.602 25.900 1.00 1.74 C ATOM 255 CG LEU A 19 -34.981 49.477 25.148 1.00 1.61 C ATOM 256 CD1 LEU A 19 -35.727 50.083 23.956 1.00 1.53 C ATOM 257 CD2 LEU A 19 -33.973 48.439 24.634 1.00 2.26 C ATOM 0 H LEU A 19 -34.325 51.194 28.307 1.00 1.83 H new ATOM 0 HA LEU A 19 -33.282 48.961 26.918 1.00 1.81 H new ATOM 0 HB2 LEU A 19 -34.992 51.207 26.437 1.00 1.74 H new ATOM 0 HB3 LEU A 19 -33.767 51.260 25.185 1.00 1.74 H new ATOM 0 HG LEU A 19 -35.677 48.983 25.826 1.00 1.61 H new ATOM 0 HD11 LEU A 19 -36.244 49.293 23.411 1.00 1.53 H new ATOM 0 HD12 LEU A 19 -36.453 50.813 24.314 1.00 1.53 H new ATOM 0 HD13 LEU A 19 -35.015 50.575 23.293 1.00 1.53 H new ATOM 0 HD21 LEU A 19 -34.503 47.649 24.103 1.00 2.26 H new ATOM 0 HD22 LEU A 19 -33.268 48.921 23.957 1.00 2.26 H new ATOM 0 HD23 LEU A 19 -33.431 48.010 25.477 1.00 2.26 H new ATOM 269 N ASN A 20 -31.584 51.781 26.627 1.00 1.71 N ATOM 270 CA ASN A 20 -30.279 52.380 26.235 1.00 1.74 C ATOM 271 C ASN A 20 -29.118 51.699 26.967 1.00 1.88 C ATOM 272 O ASN A 20 -27.988 51.743 26.520 1.00 1.95 O ATOM 273 CB ASN A 20 -30.302 53.864 26.607 1.00 1.71 C ATOM 274 CG ASN A 20 -28.902 54.464 26.459 1.00 1.82 C ATOM 275 OD1 ASN A 20 -28.484 54.824 25.278 1.00 2.05 O flip ATOM 276 ND2 ASN A 20 -28.185 54.611 27.430 1.00 2.27 N flip ATOM 0 H ASN A 20 -32.249 52.442 27.028 1.00 1.71 H new ATOM 0 HA ASN A 20 -30.133 52.246 25.163 1.00 1.74 H new ATOM 0 HB2 ASN A 20 -31.004 54.397 25.966 1.00 1.71 H new ATOM 0 HB3 ASN A 20 -30.652 53.985 27.632 1.00 1.71 H new ATOM 0 HD21 ASN A 20 -28.513 54.329 28.354 1.00 2.27 H new ATOM 0 HD22 ASN A 20 -27.255 55.016 27.321 1.00 2.27 H new ATOM 283 N THR A 21 -29.367 51.095 28.095 1.00 1.97 N ATOM 284 CA THR A 21 -28.253 50.456 28.844 1.00 2.13 C ATOM 285 C THR A 21 -27.792 49.175 28.129 1.00 2.18 C ATOM 286 O THR A 21 -26.622 49.008 27.846 1.00 2.25 O ATOM 287 CB THR A 21 -28.716 50.153 30.281 1.00 2.26 C ATOM 288 OG1 THR A 21 -28.357 51.241 31.122 1.00 2.44 O ATOM 289 CG2 THR A 21 -28.058 48.874 30.807 1.00 2.60 C ATOM 0 H THR A 21 -30.288 51.017 28.527 1.00 1.97 H new ATOM 0 HA THR A 21 -27.402 51.136 28.884 1.00 2.13 H new ATOM 0 HB THR A 21 -29.797 50.013 30.279 1.00 2.26 H new ATOM 0 HG1 THR A 21 -28.650 51.056 32.039 1.00 2.44 H new ATOM 0 HG21 THR A 21 -28.400 48.680 31.824 1.00 2.60 H new ATOM 0 HG22 THR A 21 -28.330 48.035 30.167 1.00 2.60 H new ATOM 0 HG23 THR A 21 -26.975 48.995 30.806 1.00 2.60 H new ATOM 297 N TYR A 22 -28.683 48.271 27.831 1.00 2.18 N ATOM 298 CA TYR A 22 -28.258 47.019 27.135 1.00 2.28 C ATOM 299 C TYR A 22 -27.579 47.374 25.805 1.00 2.20 C ATOM 300 O TYR A 22 -26.474 46.962 25.517 1.00 2.30 O ATOM 301 CB TYR A 22 -29.497 46.131 26.896 1.00 2.33 C ATOM 302 CG TYR A 22 -29.858 46.077 25.424 1.00 2.23 C ATOM 303 CD1 TYR A 22 -29.022 45.412 24.523 1.00 2.21 C ATOM 304 CD2 TYR A 22 -31.038 46.675 24.968 1.00 2.22 C ATOM 305 CE1 TYR A 22 -29.362 45.338 23.168 1.00 2.20 C ATOM 306 CE2 TYR A 22 -31.377 46.606 23.609 1.00 2.21 C ATOM 307 CZ TYR A 22 -30.540 45.937 22.711 1.00 2.19 C ATOM 308 OH TYR A 22 -30.880 45.862 21.376 1.00 2.26 O ATOM 0 H TYR A 22 -29.680 48.341 28.036 1.00 2.18 H new ATOM 0 HA TYR A 22 -27.544 46.472 27.750 1.00 2.28 H new ATOM 0 HB2 TYR A 22 -29.301 45.123 27.262 1.00 2.33 H new ATOM 0 HB3 TYR A 22 -30.341 46.519 27.466 1.00 2.33 H new ATOM 0 HD1 TYR A 22 -28.110 44.953 24.874 1.00 2.21 H new ATOM 0 HD2 TYR A 22 -31.687 47.189 25.662 1.00 2.22 H new ATOM 0 HE1 TYR A 22 -28.716 44.819 22.476 1.00 2.20 H new ATOM 0 HE2 TYR A 22 -32.286 47.070 23.256 1.00 2.21 H new ATOM 0 HH TYR A 22 -30.820 44.931 21.075 1.00 2.26 H new ATOM 318 N ARG A 23 -28.263 48.120 24.999 1.00 2.06 N ATOM 319 CA ARG A 23 -27.739 48.526 23.662 1.00 2.03 C ATOM 320 C ARG A 23 -26.256 48.894 23.745 1.00 2.13 C ATOM 321 O ARG A 23 -25.502 48.685 22.816 1.00 2.20 O ATOM 322 CB ARG A 23 -28.580 49.720 23.147 1.00 1.91 C ATOM 323 CG ARG A 23 -27.771 51.030 23.174 1.00 1.95 C ATOM 324 CD ARG A 23 -28.626 52.184 22.625 1.00 1.95 C ATOM 325 NE ARG A 23 -28.129 53.484 23.165 1.00 2.48 N ATOM 326 CZ ARG A 23 -28.404 54.604 22.546 1.00 2.84 C ATOM 327 NH1 ARG A 23 -29.065 54.591 21.420 1.00 3.02 N ATOM 328 NH2 ARG A 23 -28.003 55.740 23.048 1.00 3.44 N ATOM 0 H ARG A 23 -29.193 48.480 25.211 1.00 2.06 H new ATOM 0 HA ARG A 23 -27.824 47.692 22.965 1.00 2.03 H new ATOM 0 HB2 ARG A 23 -28.916 49.519 22.130 1.00 1.91 H new ATOM 0 HB3 ARG A 23 -29.474 49.830 23.762 1.00 1.91 H new ATOM 0 HG2 ARG A 23 -27.456 51.252 24.194 1.00 1.95 H new ATOM 0 HG3 ARG A 23 -26.865 50.921 22.577 1.00 1.95 H new ATOM 0 HD2 ARG A 23 -28.585 52.193 21.536 1.00 1.95 H new ATOM 0 HD3 ARG A 23 -29.670 52.040 22.903 1.00 1.95 H new ATOM 0 HE ARG A 23 -27.573 53.499 24.020 1.00 2.48 H new ATOM 0 HH11 ARG A 23 -29.370 53.705 21.018 1.00 3.02 H new ATOM 0 HH12 ARG A 23 -29.276 55.467 20.942 1.00 3.02 H new ATOM 0 HH21 ARG A 23 -27.476 55.754 23.921 1.00 3.44 H new ATOM 0 HH22 ARG A 23 -28.216 56.614 22.567 1.00 3.44 H new ATOM 342 N GLN A 24 -25.831 49.438 24.841 1.00 2.18 N ATOM 343 CA GLN A 24 -24.401 49.816 24.973 1.00 2.31 C ATOM 344 C GLN A 24 -23.583 48.559 25.238 1.00 2.45 C ATOM 345 O GLN A 24 -22.398 48.506 24.974 1.00 2.56 O ATOM 346 CB GLN A 24 -24.223 50.800 26.133 1.00 2.37 C ATOM 347 CG GLN A 24 -24.617 52.206 25.678 1.00 2.33 C ATOM 348 CD GLN A 24 -24.583 53.159 26.873 1.00 2.46 C ATOM 349 OE1 GLN A 24 -23.896 54.161 26.846 1.00 2.79 O ATOM 350 NE2 GLN A 24 -25.300 52.888 27.929 1.00 2.74 N ATOM 0 H GLN A 24 -26.411 49.639 25.655 1.00 2.18 H new ATOM 0 HA GLN A 24 -24.063 50.293 24.053 1.00 2.31 H new ATOM 0 HB2 GLN A 24 -24.838 50.495 26.980 1.00 2.37 H new ATOM 0 HB3 GLN A 24 -23.187 50.794 26.473 1.00 2.37 H new ATOM 0 HG2 GLN A 24 -23.934 52.553 24.903 1.00 2.33 H new ATOM 0 HG3 GLN A 24 -25.615 52.191 25.240 1.00 2.33 H new ATOM 0 HE21 GLN A 24 -25.877 52.047 27.952 1.00 2.74 H new ATOM 0 HE22 GLN A 24 -25.284 53.517 28.732 1.00 2.74 H new ATOM 359 N LYS A 25 -24.212 47.547 25.765 1.00 2.46 N ATOM 360 CA LYS A 25 -23.479 46.290 26.057 1.00 2.61 C ATOM 361 C LYS A 25 -23.277 45.501 24.766 1.00 2.63 C ATOM 362 O LYS A 25 -22.436 44.627 24.691 1.00 2.78 O ATOM 363 CB LYS A 25 -24.283 45.456 27.057 1.00 2.65 C ATOM 364 CG LYS A 25 -23.603 44.102 27.283 1.00 2.83 C ATOM 365 CD LYS A 25 -24.269 43.403 28.472 1.00 3.13 C ATOM 366 CE LYS A 25 -23.651 42.018 28.679 1.00 3.55 C ATOM 367 NZ LYS A 25 -22.178 42.092 28.472 1.00 3.95 N ATOM 0 H LYS A 25 -25.203 47.538 26.006 1.00 2.46 H new ATOM 0 HA LYS A 25 -22.505 46.526 26.484 1.00 2.61 H new ATOM 0 HB2 LYS A 25 -24.368 45.991 28.003 1.00 2.65 H new ATOM 0 HB3 LYS A 25 -25.296 45.305 26.684 1.00 2.65 H new ATOM 0 HG2 LYS A 25 -23.686 43.485 26.388 1.00 2.83 H new ATOM 0 HG3 LYS A 25 -22.539 44.242 27.476 1.00 2.83 H new ATOM 0 HD2 LYS A 25 -24.146 44.004 29.373 1.00 3.13 H new ATOM 0 HD3 LYS A 25 -25.341 43.309 28.296 1.00 3.13 H new ATOM 0 HE2 LYS A 25 -23.869 41.658 29.684 1.00 3.55 H new ATOM 0 HE3 LYS A 25 -24.091 41.305 27.982 1.00 3.55 H new ATOM 0 HZ1 LYS A 25 -21.725 41.258 28.898 1.00 3.95 H new ATOM 0 HZ2 LYS A 25 -21.971 42.115 27.453 1.00 3.95 H new ATOM 0 HZ3 LYS A 25 -21.807 42.954 28.920 1.00 3.95 H new ATOM 381 N GLN A 26 -24.045 45.794 23.748 1.00 2.52 N ATOM 382 CA GLN A 26 -23.896 45.046 22.466 1.00 2.58 C ATOM 383 C GLN A 26 -23.209 45.917 21.420 1.00 2.61 C ATOM 384 O GLN A 26 -22.684 45.428 20.439 1.00 2.72 O ATOM 385 CB GLN A 26 -25.279 44.674 21.944 1.00 2.47 C ATOM 386 CG GLN A 26 -25.870 43.538 22.783 1.00 2.54 C ATOM 387 CD GLN A 26 -27.023 42.890 22.016 1.00 2.61 C ATOM 388 OE1 GLN A 26 -27.220 43.163 20.849 1.00 2.87 O ATOM 389 NE2 GLN A 26 -27.799 42.037 22.625 1.00 3.01 N ATOM 0 H GLN A 26 -24.766 46.516 23.750 1.00 2.52 H new ATOM 0 HA GLN A 26 -23.297 44.154 22.648 1.00 2.58 H new ATOM 0 HB2 GLN A 26 -25.936 45.543 21.980 1.00 2.47 H new ATOM 0 HB3 GLN A 26 -25.212 44.369 20.900 1.00 2.47 H new ATOM 0 HG2 GLN A 26 -25.102 42.796 23.004 1.00 2.54 H new ATOM 0 HG3 GLN A 26 -26.225 43.923 23.739 1.00 2.54 H new ATOM 0 HE21 GLN A 26 -27.634 41.807 23.605 1.00 3.01 H new ATOM 0 HE22 GLN A 26 -28.571 41.600 22.121 1.00 3.01 H new ATOM 398 N GLY A 27 -23.227 47.199 21.606 1.00 2.54 N ATOM 399 CA GLY A 27 -22.596 48.100 20.604 1.00 2.60 C ATOM 400 C GLY A 27 -23.569 48.299 19.445 1.00 2.51 C ATOM 401 O GLY A 27 -23.194 48.279 18.289 1.00 2.60 O ATOM 0 H GLY A 27 -23.650 47.667 22.407 1.00 2.54 H new ATOM 0 HA2 GLY A 27 -22.350 49.059 21.060 1.00 2.60 H new ATOM 0 HA3 GLY A 27 -21.662 47.669 20.244 1.00 2.60 H new ATOM 405 N VAL A 28 -24.824 48.490 19.754 1.00 2.34 N ATOM 406 CA VAL A 28 -25.848 48.689 18.703 1.00 2.26 C ATOM 407 C VAL A 28 -26.307 50.148 18.755 1.00 2.15 C ATOM 408 O VAL A 28 -25.690 50.965 19.409 1.00 2.16 O ATOM 409 CB VAL A 28 -27.022 47.755 18.990 1.00 2.16 C ATOM 410 CG1 VAL A 28 -26.510 46.331 19.224 1.00 2.31 C ATOM 411 CG2 VAL A 28 -27.773 48.241 20.229 1.00 2.00 C ATOM 0 H VAL A 28 -25.183 48.516 20.709 1.00 2.34 H new ATOM 0 HA VAL A 28 -25.448 48.469 17.713 1.00 2.26 H new ATOM 0 HB VAL A 28 -27.697 47.755 18.134 1.00 2.16 H new ATOM 0 HG11 VAL A 28 -27.353 45.670 19.428 1.00 2.31 H new ATOM 0 HG12 VAL A 28 -25.983 45.983 18.335 1.00 2.31 H new ATOM 0 HG13 VAL A 28 -25.829 46.324 20.075 1.00 2.31 H new ATOM 0 HG21 VAL A 28 -28.610 47.573 20.432 1.00 2.00 H new ATOM 0 HG22 VAL A 28 -27.098 48.247 21.085 1.00 2.00 H new ATOM 0 HG23 VAL A 28 -28.147 49.250 20.055 1.00 2.00 H new ATOM 421 N VAL A 29 -27.375 50.497 18.086 1.00 2.07 N ATOM 422 CA VAL A 29 -27.828 51.923 18.135 1.00 2.00 C ATOM 423 C VAL A 29 -29.353 51.989 18.075 1.00 1.83 C ATOM 424 O VAL A 29 -29.979 51.442 17.189 1.00 1.83 O ATOM 425 CB VAL A 29 -27.233 52.699 16.953 1.00 2.17 C ATOM 426 CG1 VAL A 29 -27.405 54.202 17.192 1.00 2.33 C ATOM 427 CG2 VAL A 29 -25.741 52.379 16.821 1.00 2.35 C ATOM 0 H VAL A 29 -27.945 49.871 17.517 1.00 2.07 H new ATOM 0 HA VAL A 29 -27.487 52.370 19.069 1.00 2.00 H new ATOM 0 HB VAL A 29 -27.749 52.409 16.038 1.00 2.17 H new ATOM 0 HG11 VAL A 29 -26.983 54.755 16.353 1.00 2.33 H new ATOM 0 HG12 VAL A 29 -28.465 54.437 17.284 1.00 2.33 H new ATOM 0 HG13 VAL A 29 -26.890 54.486 18.110 1.00 2.33 H new ATOM 0 HG21 VAL A 29 -25.323 52.933 15.980 1.00 2.35 H new ATOM 0 HG22 VAL A 29 -25.225 52.666 17.737 1.00 2.35 H new ATOM 0 HG23 VAL A 29 -25.612 51.310 16.652 1.00 2.35 H new ATOM 437 N LEU A 30 -29.951 52.661 19.022 1.00 1.71 N ATOM 438 CA LEU A 30 -31.432 52.775 19.045 1.00 1.56 C ATOM 439 C LEU A 30 -31.857 53.983 18.208 1.00 1.57 C ATOM 440 O LEU A 30 -31.550 55.112 18.537 1.00 1.68 O ATOM 441 CB LEU A 30 -31.898 52.986 20.494 1.00 1.48 C ATOM 442 CG LEU A 30 -32.393 51.667 21.097 1.00 1.51 C ATOM 443 CD1 LEU A 30 -32.674 51.868 22.593 1.00 1.62 C ATOM 444 CD2 LEU A 30 -33.685 51.215 20.391 1.00 1.47 C ATOM 0 H LEU A 30 -29.470 53.138 19.785 1.00 1.71 H new ATOM 0 HA LEU A 30 -31.876 51.866 18.639 1.00 1.56 H new ATOM 0 HB2 LEU A 30 -31.077 53.380 21.092 1.00 1.48 H new ATOM 0 HB3 LEU A 30 -32.697 53.727 20.521 1.00 1.48 H new ATOM 0 HG LEU A 30 -31.628 50.903 20.963 1.00 1.51 H new ATOM 0 HD11 LEU A 30 -33.026 50.932 23.026 1.00 1.62 H new ATOM 0 HD12 LEU A 30 -31.759 52.179 23.097 1.00 1.62 H new ATOM 0 HD13 LEU A 30 -33.437 52.636 22.720 1.00 1.62 H new ATOM 0 HD21 LEU A 30 -34.029 50.277 20.827 1.00 1.47 H new ATOM 0 HD22 LEU A 30 -34.454 51.977 20.517 1.00 1.47 H new ATOM 0 HD23 LEU A 30 -33.488 51.071 19.329 1.00 1.47 H new ATOM 456 N LYS A 31 -32.578 53.759 17.142 1.00 1.51 N ATOM 457 CA LYS A 31 -33.040 54.909 16.297 1.00 1.54 C ATOM 458 C LYS A 31 -34.563 55.022 16.416 1.00 1.43 C ATOM 459 O LYS A 31 -35.296 54.207 15.893 1.00 1.44 O ATOM 460 CB LYS A 31 -32.653 54.689 14.825 1.00 1.69 C ATOM 461 CG LYS A 31 -31.345 53.891 14.723 1.00 1.78 C ATOM 462 CD LYS A 31 -30.181 54.685 15.336 1.00 1.84 C ATOM 463 CE LYS A 31 -29.765 55.830 14.403 1.00 2.07 C ATOM 464 NZ LYS A 31 -30.657 57.004 14.622 1.00 2.36 N ATOM 0 H LYS A 31 -32.868 52.836 16.818 1.00 1.51 H new ATOM 0 HA LYS A 31 -32.563 55.826 16.644 1.00 1.54 H new ATOM 0 HB2 LYS A 31 -33.452 54.156 14.309 1.00 1.69 H new ATOM 0 HB3 LYS A 31 -32.538 55.651 14.326 1.00 1.69 H new ATOM 0 HG2 LYS A 31 -31.453 52.937 15.238 1.00 1.78 H new ATOM 0 HG3 LYS A 31 -31.130 53.667 13.678 1.00 1.78 H new ATOM 0 HD2 LYS A 31 -30.477 55.086 16.305 1.00 1.84 H new ATOM 0 HD3 LYS A 31 -29.333 54.023 15.510 1.00 1.84 H new ATOM 0 HE2 LYS A 31 -28.728 56.108 14.592 1.00 2.07 H new ATOM 0 HE3 LYS A 31 -29.823 55.505 13.364 1.00 2.07 H new ATOM 0 HZ1 LYS A 31 -31.284 57.122 13.801 1.00 2.36 H new ATOM 0 HZ2 LYS A 31 -31.230 56.850 15.476 1.00 2.36 H new ATOM 0 HZ3 LYS A 31 -30.080 57.861 14.742 1.00 2.36 H new ATOM 478 N TYR A 32 -35.046 56.019 17.111 1.00 1.42 N ATOM 479 CA TYR A 32 -36.516 56.172 17.280 1.00 1.35 C ATOM 480 C TYR A 32 -37.081 57.101 16.199 1.00 1.44 C ATOM 481 O TYR A 32 -36.589 58.192 15.988 1.00 1.54 O ATOM 482 CB TYR A 32 -36.792 56.793 18.651 1.00 1.32 C ATOM 483 CG TYR A 32 -36.666 55.750 19.740 1.00 1.30 C ATOM 484 CD1 TYR A 32 -37.780 54.985 20.114 1.00 1.67 C ATOM 485 CD2 TYR A 32 -35.439 55.562 20.393 1.00 1.33 C ATOM 486 CE1 TYR A 32 -37.665 54.031 21.132 1.00 1.90 C ATOM 487 CE2 TYR A 32 -35.328 54.611 21.414 1.00 1.32 C ATOM 488 CZ TYR A 32 -36.440 53.846 21.783 1.00 1.58 C ATOM 489 OH TYR A 32 -36.328 52.910 22.791 1.00 1.83 O ATOM 0 H TYR A 32 -34.481 56.734 17.569 1.00 1.42 H new ATOM 0 HA TYR A 32 -36.989 55.193 17.197 1.00 1.35 H new ATOM 0 HB2 TYR A 32 -36.091 57.607 18.836 1.00 1.32 H new ATOM 0 HB3 TYR A 32 -37.793 57.225 18.667 1.00 1.32 H new ATOM 0 HD1 TYR A 32 -38.727 55.132 19.616 1.00 1.67 H new ATOM 0 HD2 TYR A 32 -34.580 56.151 20.108 1.00 1.33 H new ATOM 0 HE1 TYR A 32 -38.522 53.438 21.415 1.00 1.90 H new ATOM 0 HE2 TYR A 32 -34.383 54.468 21.917 1.00 1.32 H new ATOM 0 HH TYR A 32 -36.957 52.176 22.627 1.00 1.83 H new ATOM 499 N GLN A 33 -38.122 56.679 15.526 1.00 1.44 N ATOM 500 CA GLN A 33 -38.742 57.537 14.468 1.00 1.56 C ATOM 501 C GLN A 33 -40.234 57.702 14.764 1.00 1.51 C ATOM 502 O GLN A 33 -41.013 56.777 14.641 1.00 1.55 O ATOM 503 CB GLN A 33 -38.556 56.876 13.109 1.00 1.68 C ATOM 504 CG GLN A 33 -37.102 57.029 12.677 1.00 2.20 C ATOM 505 CD GLN A 33 -36.208 56.173 13.576 1.00 2.68 C ATOM 506 OE1 GLN A 33 -34.968 56.529 13.771 1.00 2.97 O flip ATOM 507 NE2 GLN A 33 -36.642 55.170 14.107 1.00 3.34 N flip ATOM 0 H GLN A 33 -38.571 55.774 15.664 1.00 1.44 H new ATOM 0 HA GLN A 33 -38.264 58.517 14.459 1.00 1.56 H new ATOM 0 HB2 GLN A 33 -38.823 55.821 13.164 1.00 1.68 H new ATOM 0 HB3 GLN A 33 -39.217 57.334 12.374 1.00 1.68 H new ATOM 0 HG2 GLN A 33 -36.987 56.725 11.637 1.00 2.20 H new ATOM 0 HG3 GLN A 33 -36.802 58.075 12.738 1.00 2.20 H new ATOM 0 HE21 GLN A 33 -37.611 54.891 13.955 1.00 3.34 H new ATOM 0 HE22 GLN A 33 -36.037 54.607 14.705 1.00 3.34 H new ATOM 516 N GLU A 34 -40.626 58.873 15.179 1.00 1.55 N ATOM 517 CA GLU A 34 -42.054 59.123 15.523 1.00 1.55 C ATOM 518 C GLU A 34 -42.877 59.539 14.292 1.00 1.68 C ATOM 519 O GLU A 34 -42.548 60.484 13.603 1.00 1.84 O ATOM 520 CB GLU A 34 -42.114 60.236 16.570 1.00 1.65 C ATOM 521 CG GLU A 34 -41.104 61.331 16.222 1.00 2.04 C ATOM 522 CD GLU A 34 -41.275 62.506 17.186 1.00 2.28 C ATOM 523 OE1 GLU A 34 -42.378 63.021 17.273 1.00 2.67 O ATOM 524 OE2 GLU A 34 -40.301 62.870 17.824 1.00 2.63 O ATOM 0 H GLU A 34 -40.011 59.678 15.296 1.00 1.55 H new ATOM 0 HA GLU A 34 -42.482 58.198 15.909 1.00 1.55 H new ATOM 0 HB2 GLU A 34 -43.119 60.656 16.611 1.00 1.65 H new ATOM 0 HB3 GLU A 34 -41.898 59.830 17.558 1.00 1.65 H new ATOM 0 HG2 GLU A 34 -40.089 60.939 16.286 1.00 2.04 H new ATOM 0 HG3 GLU A 34 -41.252 61.665 15.195 1.00 2.04 H new ATOM 531 N LEU A 35 -43.964 58.844 14.037 1.00 1.68 N ATOM 532 CA LEU A 35 -44.860 59.185 12.885 1.00 1.86 C ATOM 533 C LEU A 35 -46.227 59.638 13.448 1.00 2.00 C ATOM 534 O LEU A 35 -47.125 58.827 13.561 1.00 2.04 O ATOM 535 CB LEU A 35 -45.106 57.929 12.035 1.00 1.95 C ATOM 536 CG LEU A 35 -43.911 57.594 11.126 1.00 2.00 C ATOM 537 CD1 LEU A 35 -43.994 58.404 9.830 1.00 2.52 C ATOM 538 CD2 LEU A 35 -42.581 57.891 11.825 1.00 1.90 C ATOM 0 H LEU A 35 -44.271 58.043 14.588 1.00 1.68 H new ATOM 0 HA LEU A 35 -44.396 59.966 12.283 1.00 1.86 H new ATOM 0 HB2 LEU A 35 -45.308 57.083 12.692 1.00 1.95 H new ATOM 0 HB3 LEU A 35 -45.995 58.077 11.422 1.00 1.95 H new ATOM 0 HG LEU A 35 -43.953 56.529 10.899 1.00 2.00 H new ATOM 0 HD11 LEU A 35 -43.144 58.160 9.193 1.00 2.52 H new ATOM 0 HD12 LEU A 35 -44.920 58.162 9.308 1.00 2.52 H new ATOM 0 HD13 LEU A 35 -43.978 59.468 10.064 1.00 2.52 H new ATOM 0 HD21 LEU A 35 -41.756 57.644 11.157 1.00 1.90 H new ATOM 0 HD22 LEU A 35 -42.534 58.949 12.084 1.00 1.90 H new ATOM 0 HD23 LEU A 35 -42.505 57.292 12.732 1.00 1.90 H new ATOM 550 N PRO A 36 -46.355 60.898 13.804 1.00 2.27 N ATOM 551 CA PRO A 36 -47.617 61.419 14.372 1.00 2.50 C ATOM 552 C PRO A 36 -48.721 61.434 13.305 1.00 2.42 C ATOM 553 O PRO A 36 -48.454 61.514 12.124 1.00 2.52 O ATOM 554 CB PRO A 36 -47.282 62.848 14.828 1.00 3.02 C ATOM 555 CG PRO A 36 -45.860 63.181 14.304 1.00 3.04 C ATOM 556 CD PRO A 36 -45.281 61.896 13.677 1.00 2.56 C ATOM 0 HA PRO A 36 -47.986 60.803 15.192 1.00 2.50 H new ATOM 0 HB2 PRO A 36 -48.011 63.557 14.436 1.00 3.02 H new ATOM 0 HB3 PRO A 36 -47.318 62.922 15.915 1.00 3.02 H new ATOM 0 HG2 PRO A 36 -45.902 63.982 13.566 1.00 3.04 H new ATOM 0 HG3 PRO A 36 -45.224 63.530 15.118 1.00 3.04 H new ATOM 0 HD2 PRO A 36 -45.009 62.053 12.633 1.00 2.56 H new ATOM 0 HD3 PRO A 36 -44.379 61.574 14.197 1.00 2.56 H new ATOM 564 N ASN A 37 -49.959 61.359 13.723 1.00 2.45 N ATOM 565 CA ASN A 37 -51.094 61.367 12.751 1.00 2.54 C ATOM 566 C ASN A 37 -50.772 60.449 11.581 1.00 2.46 C ATOM 567 O ASN A 37 -50.082 60.813 10.648 1.00 2.72 O ATOM 568 CB ASN A 37 -51.344 62.785 12.252 1.00 2.92 C ATOM 569 CG ASN A 37 -52.208 62.753 10.989 1.00 3.36 C ATOM 570 OD1 ASN A 37 -51.708 62.553 9.899 1.00 3.67 O ATOM 571 ND2 ASN A 37 -53.496 62.944 11.091 1.00 3.78 N ATOM 0 H ASN A 37 -50.234 61.292 14.703 1.00 2.45 H new ATOM 0 HA ASN A 37 -51.995 61.008 13.249 1.00 2.54 H new ATOM 0 HB2 ASN A 37 -51.840 63.369 13.027 1.00 2.92 H new ATOM 0 HB3 ASN A 37 -50.395 63.277 12.040 1.00 2.92 H new ATOM 0 HD21 ASN A 37 -54.082 62.925 10.256 1.00 3.78 H new ATOM 0 HD22 ASN A 37 -53.916 63.112 12.005 1.00 3.78 H new ATOM 578 N SER A 38 -51.272 59.256 11.640 1.00 2.33 N ATOM 579 CA SER A 38 -51.012 58.269 10.553 1.00 2.46 C ATOM 580 C SER A 38 -52.297 57.500 10.223 1.00 2.67 C ATOM 581 O SER A 38 -52.317 56.670 9.337 1.00 3.00 O ATOM 582 CB SER A 38 -49.935 57.296 11.022 1.00 2.41 C ATOM 583 OG SER A 38 -49.486 56.518 9.919 1.00 2.75 O ATOM 0 H SER A 38 -51.857 58.912 12.401 1.00 2.33 H new ATOM 0 HA SER A 38 -50.678 58.790 9.656 1.00 2.46 H new ATOM 0 HB2 SER A 38 -49.100 57.844 11.458 1.00 2.41 H new ATOM 0 HB3 SER A 38 -50.332 56.646 11.802 1.00 2.41 H new ATOM 0 HG SER A 38 -50.220 56.402 9.280 1.00 2.75 H new ATOM 589 N GLY A 39 -53.363 57.763 10.934 1.00 2.62 N ATOM 590 CA GLY A 39 -54.651 57.048 10.671 1.00 2.90 C ATOM 591 C GLY A 39 -55.656 58.010 10.007 1.00 3.05 C ATOM 592 O GLY A 39 -56.234 58.841 10.680 1.00 2.92 O ATOM 0 H GLY A 39 -53.398 58.446 11.690 1.00 2.62 H new ATOM 0 HA2 GLY A 39 -54.475 56.188 10.024 1.00 2.90 H new ATOM 0 HA3 GLY A 39 -55.062 56.665 11.605 1.00 2.90 H new ATOM 596 N PRO A 40 -55.840 57.877 8.708 1.00 3.39 N ATOM 597 CA PRO A 40 -56.776 58.743 7.961 1.00 3.62 C ATOM 598 C PRO A 40 -58.212 58.710 8.533 1.00 3.59 C ATOM 599 O PRO A 40 -58.833 59.750 8.640 1.00 3.60 O ATOM 600 CB PRO A 40 -56.737 58.214 6.516 1.00 4.03 C ATOM 601 CG PRO A 40 -55.626 57.133 6.444 1.00 4.04 C ATOM 602 CD PRO A 40 -55.128 56.881 7.877 1.00 3.64 C ATOM 0 HA PRO A 40 -56.479 59.789 8.031 1.00 3.62 H new ATOM 0 HB2 PRO A 40 -57.702 57.791 6.237 1.00 4.03 H new ATOM 0 HB3 PRO A 40 -56.529 59.024 5.817 1.00 4.03 H new ATOM 0 HG2 PRO A 40 -56.015 56.213 6.006 1.00 4.04 H new ATOM 0 HG3 PRO A 40 -54.807 57.468 5.807 1.00 4.04 H new ATOM 0 HD2 PRO A 40 -55.352 55.864 8.200 1.00 3.64 H new ATOM 0 HD3 PRO A 40 -54.048 57.007 7.948 1.00 3.64 H new ATOM 610 N PRO A 41 -58.719 57.543 8.875 1.00 3.63 N ATOM 611 CA PRO A 41 -60.093 57.432 9.407 1.00 3.66 C ATOM 612 C PRO A 41 -60.216 58.197 10.737 1.00 3.36 C ATOM 613 O PRO A 41 -60.508 57.631 11.772 1.00 3.26 O ATOM 614 CB PRO A 41 -60.325 55.922 9.600 1.00 3.82 C ATOM 615 CG PRO A 41 -59.017 55.193 9.192 1.00 3.84 C ATOM 616 CD PRO A 41 -57.997 56.261 8.759 1.00 3.71 C ATOM 0 HA PRO A 41 -60.836 57.866 8.738 1.00 3.66 H new ATOM 0 HB2 PRO A 41 -60.579 55.703 10.637 1.00 3.82 H new ATOM 0 HB3 PRO A 41 -61.161 55.581 8.989 1.00 3.82 H new ATOM 0 HG2 PRO A 41 -58.628 54.610 10.027 1.00 3.84 H new ATOM 0 HG3 PRO A 41 -59.207 54.494 8.377 1.00 3.84 H new ATOM 0 HD2 PRO A 41 -57.114 56.246 9.397 1.00 3.71 H new ATOM 0 HD3 PRO A 41 -57.656 56.091 7.738 1.00 3.71 H new ATOM 624 N HIS A 42 -60.000 59.485 10.702 1.00 3.29 N ATOM 625 CA HIS A 42 -60.105 60.317 11.939 1.00 3.09 C ATOM 626 C HIS A 42 -59.427 59.617 13.120 1.00 2.88 C ATOM 627 O HIS A 42 -59.622 59.987 14.260 1.00 2.79 O ATOM 628 CB HIS A 42 -61.578 60.582 12.272 1.00 3.18 C ATOM 629 CG HIS A 42 -62.270 59.292 12.615 1.00 3.23 C ATOM 630 ND1 HIS A 42 -62.901 58.517 11.656 1.00 3.49 N ATOM 631 CD2 HIS A 42 -62.446 58.632 13.807 1.00 3.44 C ATOM 632 CE1 HIS A 42 -63.423 57.445 12.280 1.00 3.52 C ATOM 633 NE2 HIS A 42 -63.175 57.466 13.592 1.00 3.46 N ATOM 0 H HIS A 42 -59.752 60.003 9.859 1.00 3.29 H new ATOM 0 HA HIS A 42 -59.600 61.266 11.758 1.00 3.09 H new ATOM 0 HB2 HIS A 42 -61.650 61.276 13.109 1.00 3.18 H new ATOM 0 HB3 HIS A 42 -62.072 61.054 11.423 1.00 3.18 H new ATOM 0 HD2 HIS A 42 -62.075 58.967 14.765 1.00 3.44 H new ATOM 0 HE1 HIS A 42 -63.975 56.663 11.780 1.00 3.52 H new ATOM 0 HE2 HIS A 42 -63.459 56.776 14.287 1.00 3.46 H new ATOM 641 N ASP A 43 -58.628 58.615 12.867 1.00 2.90 N ATOM 642 CA ASP A 43 -57.946 57.913 13.976 1.00 2.78 C ATOM 643 C ASP A 43 -56.583 58.558 14.220 1.00 2.62 C ATOM 644 O ASP A 43 -55.566 58.049 13.800 1.00 2.63 O ATOM 645 CB ASP A 43 -57.747 56.449 13.597 1.00 2.97 C ATOM 646 CG ASP A 43 -59.097 55.825 13.240 1.00 3.43 C ATOM 647 OD1 ASP A 43 -60.080 56.192 13.863 1.00 3.81 O ATOM 648 OD2 ASP A 43 -59.126 54.990 12.351 1.00 3.80 O ATOM 0 H ASP A 43 -58.422 58.256 11.935 1.00 2.90 H new ATOM 0 HA ASP A 43 -58.551 57.981 14.880 1.00 2.78 H new ATOM 0 HB2 ASP A 43 -57.064 56.371 12.751 1.00 2.97 H new ATOM 0 HB3 ASP A 43 -57.292 55.907 14.426 1.00 2.97 H new ATOM 653 N ARG A 44 -56.555 59.676 14.891 1.00 2.53 N ATOM 654 CA ARG A 44 -55.260 60.351 15.164 1.00 2.45 C ATOM 655 C ARG A 44 -54.385 59.443 16.034 1.00 2.31 C ATOM 656 O ARG A 44 -53.974 59.818 17.114 1.00 2.34 O ATOM 657 CB ARG A 44 -55.527 61.669 15.899 1.00 2.55 C ATOM 658 CG ARG A 44 -56.603 61.453 16.968 1.00 2.57 C ATOM 659 CD ARG A 44 -56.601 62.627 17.951 1.00 2.84 C ATOM 660 NE ARG A 44 -55.340 62.601 18.747 1.00 3.28 N ATOM 661 CZ ARG A 44 -55.008 63.628 19.483 1.00 3.57 C ATOM 662 NH1 ARG A 44 -55.792 64.671 19.540 1.00 3.58 N ATOM 663 NH2 ARG A 44 -53.898 63.609 20.167 1.00 4.33 N ATOM 0 H ARG A 44 -57.378 60.151 15.262 1.00 2.53 H new ATOM 0 HA ARG A 44 -54.744 60.554 14.226 1.00 2.45 H new ATOM 0 HB2 ARG A 44 -54.609 62.032 16.361 1.00 2.55 H new ATOM 0 HB3 ARG A 44 -55.851 62.432 15.192 1.00 2.55 H new ATOM 0 HG2 ARG A 44 -57.582 61.362 16.498 1.00 2.57 H new ATOM 0 HG3 ARG A 44 -56.417 60.520 17.501 1.00 2.57 H new ATOM 0 HD2 ARG A 44 -56.684 63.570 17.410 1.00 2.84 H new ATOM 0 HD3 ARG A 44 -57.464 62.563 18.613 1.00 2.84 H new ATOM 0 HE ARG A 44 -54.736 61.780 18.717 1.00 3.28 H new ATOM 0 HH11 ARG A 44 -56.663 64.684 19.010 1.00 3.58 H new ATOM 0 HH12 ARG A 44 -55.533 65.473 20.115 1.00 3.58 H new ATOM 0 HH21 ARG A 44 -53.289 62.792 20.128 1.00 4.33 H new ATOM 0 HH22 ARG A 44 -53.639 64.411 20.741 1.00 4.33 H new ATOM 677 N ARG A 45 -54.108 58.244 15.587 1.00 2.28 N ATOM 678 CA ARG A 45 -53.280 57.325 16.407 1.00 2.20 C ATOM 679 C ARG A 45 -51.805 57.672 16.272 1.00 2.09 C ATOM 680 O ARG A 45 -51.418 58.556 15.535 1.00 2.21 O ATOM 681 CB ARG A 45 -53.521 55.869 15.981 1.00 2.33 C ATOM 682 CG ARG A 45 -52.567 55.427 14.851 1.00 2.46 C ATOM 683 CD ARG A 45 -52.674 56.365 13.641 1.00 2.70 C ATOM 684 NE ARG A 45 -52.747 55.559 12.379 1.00 3.25 N ATOM 685 CZ ARG A 45 -51.948 54.542 12.175 1.00 3.74 C ATOM 686 NH1 ARG A 45 -51.013 54.250 13.036 1.00 3.96 N ATOM 687 NH2 ARG A 45 -52.074 53.825 11.092 1.00 4.29 N ATOM 0 H ARG A 45 -54.421 57.868 14.692 1.00 2.28 H new ATOM 0 HA ARG A 45 -53.570 57.439 17.452 1.00 2.20 H new ATOM 0 HB2 ARG A 45 -53.390 55.214 16.842 1.00 2.33 H new ATOM 0 HB3 ARG A 45 -54.553 55.755 15.648 1.00 2.33 H new ATOM 0 HG2 ARG A 45 -51.541 55.418 15.219 1.00 2.46 H new ATOM 0 HG3 ARG A 45 -52.805 54.408 14.547 1.00 2.46 H new ATOM 0 HD2 ARG A 45 -53.560 56.994 13.734 1.00 2.70 H new ATOM 0 HD3 ARG A 45 -51.812 57.031 13.608 1.00 2.70 H new ATOM 0 HE ARG A 45 -53.432 55.808 11.666 1.00 3.25 H new ATOM 0 HH11 ARG A 45 -50.899 54.816 13.877 1.00 3.96 H new ATOM 0 HH12 ARG A 45 -50.395 53.456 12.868 1.00 3.96 H new ATOM 0 HH21 ARG A 45 -52.793 54.057 10.407 1.00 4.29 H new ATOM 0 HH22 ARG A 45 -51.453 53.032 10.930 1.00 4.29 H new ATOM 701 N PHE A 46 -50.984 56.973 16.999 1.00 2.10 N ATOM 702 CA PHE A 46 -49.525 57.232 16.961 1.00 2.12 C ATOM 703 C PHE A 46 -48.811 55.984 16.447 1.00 1.99 C ATOM 704 O PHE A 46 -49.145 54.872 16.807 1.00 2.12 O ATOM 705 CB PHE A 46 -49.064 57.551 18.384 1.00 2.54 C ATOM 706 CG PHE A 46 -48.801 59.037 18.535 1.00 3.19 C ATOM 707 CD1 PHE A 46 -49.702 59.961 17.993 1.00 3.79 C ATOM 708 CD2 PHE A 46 -47.672 59.488 19.231 1.00 3.80 C ATOM 709 CE1 PHE A 46 -49.477 61.334 18.145 1.00 4.66 C ATOM 710 CE2 PHE A 46 -47.449 60.864 19.387 1.00 4.69 C ATOM 711 CZ PHE A 46 -48.352 61.786 18.842 1.00 5.01 C ATOM 0 H PHE A 46 -51.269 56.222 17.627 1.00 2.10 H new ATOM 0 HA PHE A 46 -49.295 58.068 16.300 1.00 2.12 H new ATOM 0 HB2 PHE A 46 -49.824 57.236 19.098 1.00 2.54 H new ATOM 0 HB3 PHE A 46 -48.158 56.990 18.614 1.00 2.54 H new ATOM 0 HD1 PHE A 46 -50.573 59.614 17.456 1.00 3.79 H new ATOM 0 HD2 PHE A 46 -46.974 58.777 19.647 1.00 3.80 H new ATOM 0 HE1 PHE A 46 -50.173 62.045 17.724 1.00 4.66 H new ATOM 0 HE2 PHE A 46 -46.581 61.213 19.927 1.00 4.69 H new ATOM 0 HZ PHE A 46 -48.179 62.846 18.960 1.00 5.01 H new ATOM 721 N THR A 47 -47.829 56.170 15.610 1.00 1.89 N ATOM 722 CA THR A 47 -47.073 55.009 15.056 1.00 1.89 C ATOM 723 C THR A 47 -45.580 55.253 15.257 1.00 1.71 C ATOM 724 O THR A 47 -44.935 55.886 14.450 1.00 1.73 O ATOM 725 CB THR A 47 -47.369 54.878 13.555 1.00 2.11 C ATOM 726 OG1 THR A 47 -48.681 54.372 13.377 1.00 2.56 O ATOM 727 CG2 THR A 47 -46.365 53.923 12.900 1.00 2.40 C ATOM 0 H THR A 47 -47.514 57.083 15.283 1.00 1.89 H new ATOM 0 HA THR A 47 -47.373 54.093 15.566 1.00 1.89 H new ATOM 0 HB THR A 47 -47.284 55.860 13.089 1.00 2.11 H new ATOM 0 HG1 THR A 47 -48.801 53.573 13.931 1.00 2.56 H new ATOM 0 HG21 THR A 47 -46.585 53.838 11.836 1.00 2.40 H new ATOM 0 HG22 THR A 47 -45.355 54.311 13.032 1.00 2.40 H new ATOM 0 HG23 THR A 47 -46.440 52.940 13.366 1.00 2.40 H new ATOM 735 N PHE A 48 -45.015 54.766 16.323 1.00 1.59 N ATOM 736 CA PHE A 48 -43.563 54.999 16.539 1.00 1.46 C ATOM 737 C PHE A 48 -42.769 53.827 15.972 1.00 1.50 C ATOM 738 O PHE A 48 -43.231 52.704 15.919 1.00 1.62 O ATOM 739 CB PHE A 48 -43.274 55.129 18.037 1.00 1.42 C ATOM 740 CG PHE A 48 -43.415 56.572 18.468 1.00 1.94 C ATOM 741 CD1 PHE A 48 -44.468 57.354 17.977 1.00 2.81 C ATOM 742 CD2 PHE A 48 -42.489 57.127 19.358 1.00 2.54 C ATOM 743 CE1 PHE A 48 -44.594 58.689 18.380 1.00 3.72 C ATOM 744 CE2 PHE A 48 -42.616 58.462 19.761 1.00 3.61 C ATOM 745 CZ PHE A 48 -43.667 59.244 19.270 1.00 4.04 C ATOM 0 H PHE A 48 -45.488 54.224 17.046 1.00 1.59 H new ATOM 0 HA PHE A 48 -43.270 55.919 16.034 1.00 1.46 H new ATOM 0 HB2 PHE A 48 -43.962 54.503 18.604 1.00 1.42 H new ATOM 0 HB3 PHE A 48 -42.267 54.773 18.254 1.00 1.42 H new ATOM 0 HD1 PHE A 48 -45.182 56.928 17.288 1.00 2.81 H new ATOM 0 HD2 PHE A 48 -41.675 56.525 19.735 1.00 2.54 H new ATOM 0 HE1 PHE A 48 -45.408 59.291 18.004 1.00 3.72 H new ATOM 0 HE2 PHE A 48 -41.903 58.888 20.451 1.00 3.61 H new ATOM 0 HZ PHE A 48 -43.763 60.275 19.577 1.00 4.04 H new ATOM 755 N GLN A 49 -41.566 54.096 15.567 1.00 1.46 N ATOM 756 CA GLN A 49 -40.683 53.036 15.007 1.00 1.56 C ATOM 757 C GLN A 49 -39.430 52.987 15.866 1.00 1.47 C ATOM 758 O GLN A 49 -39.139 53.911 16.598 1.00 1.44 O ATOM 759 CB GLN A 49 -40.310 53.394 13.563 1.00 1.72 C ATOM 760 CG GLN A 49 -41.100 52.525 12.583 1.00 2.09 C ATOM 761 CD GLN A 49 -40.404 51.173 12.388 1.00 2.36 C ATOM 762 OE1 GLN A 49 -39.324 50.897 13.067 1.00 2.80 O flip ATOM 763 NE2 GLN A 49 -40.852 50.358 11.606 1.00 2.67 N flip ATOM 0 H GLN A 49 -41.145 55.025 15.600 1.00 1.46 H new ATOM 0 HA GLN A 49 -41.186 52.069 15.007 1.00 1.56 H new ATOM 0 HB2 GLN A 49 -40.519 54.447 13.376 1.00 1.72 H new ATOM 0 HB3 GLN A 49 -39.241 53.249 13.409 1.00 1.72 H new ATOM 0 HG2 GLN A 49 -42.112 52.370 12.958 1.00 2.09 H new ATOM 0 HG3 GLN A 49 -41.190 53.036 11.625 1.00 2.09 H new ATOM 0 HE21 GLN A 49 -41.696 50.572 11.074 1.00 2.67 H new ATOM 0 HE22 GLN A 49 -40.384 49.460 11.481 1.00 2.67 H new ATOM 772 N VAL A 50 -38.687 51.926 15.807 1.00 1.49 N ATOM 773 CA VAL A 50 -37.473 51.867 16.659 1.00 1.43 C ATOM 774 C VAL A 50 -36.502 50.793 16.164 1.00 1.54 C ATOM 775 O VAL A 50 -36.845 49.634 16.050 1.00 1.63 O ATOM 776 CB VAL A 50 -37.899 51.560 18.094 1.00 1.36 C ATOM 777 CG1 VAL A 50 -38.556 50.180 18.156 1.00 2.15 C ATOM 778 CG2 VAL A 50 -36.677 51.589 19.014 1.00 1.55 C ATOM 0 H VAL A 50 -38.860 51.111 15.219 1.00 1.49 H new ATOM 0 HA VAL A 50 -36.959 52.827 16.613 1.00 1.43 H new ATOM 0 HB VAL A 50 -38.615 52.314 18.422 1.00 1.36 H new ATOM 0 HG11 VAL A 50 -38.858 49.966 19.181 1.00 2.15 H new ATOM 0 HG12 VAL A 50 -39.433 50.165 17.509 1.00 2.15 H new ATOM 0 HG13 VAL A 50 -37.846 49.424 17.822 1.00 2.15 H new ATOM 0 HG21 VAL A 50 -36.986 51.370 20.036 1.00 1.55 H new ATOM 0 HG22 VAL A 50 -35.956 50.841 18.684 1.00 1.55 H new ATOM 0 HG23 VAL A 50 -36.218 52.577 18.978 1.00 1.55 H new ATOM 788 N ILE A 51 -35.282 51.172 15.901 1.00 1.57 N ATOM 789 CA ILE A 51 -34.262 50.183 15.448 1.00 1.70 C ATOM 790 C ILE A 51 -33.368 49.873 16.646 1.00 1.65 C ATOM 791 O ILE A 51 -33.460 50.517 17.671 1.00 1.53 O ATOM 792 CB ILE A 51 -33.426 50.795 14.305 1.00 1.81 C ATOM 793 CG1 ILE A 51 -34.077 50.450 12.960 1.00 2.00 C ATOM 794 CG2 ILE A 51 -31.985 50.257 14.329 1.00 2.00 C ATOM 795 CD1 ILE A 51 -33.166 50.884 11.809 1.00 2.31 C ATOM 0 H ILE A 51 -34.945 52.131 15.981 1.00 1.57 H new ATOM 0 HA ILE A 51 -34.733 49.272 15.079 1.00 1.70 H new ATOM 0 HB ILE A 51 -33.393 51.876 14.439 1.00 1.81 H new ATOM 0 HG12 ILE A 51 -34.264 49.378 12.902 1.00 2.00 H new ATOM 0 HG13 ILE A 51 -35.043 50.947 12.877 1.00 2.00 H new ATOM 0 HG21 ILE A 51 -31.416 50.704 13.513 1.00 2.00 H new ATOM 0 HG22 ILE A 51 -31.517 50.512 15.280 1.00 2.00 H new ATOM 0 HG23 ILE A 51 -31.999 49.174 14.211 1.00 2.00 H new ATOM 0 HD11 ILE A 51 -33.637 50.635 10.858 1.00 2.31 H new ATOM 0 HD12 ILE A 51 -33.001 51.960 11.861 1.00 2.31 H new ATOM 0 HD13 ILE A 51 -32.210 50.367 11.887 1.00 2.31 H new ATOM 807 N ILE A 52 -32.497 48.910 16.531 1.00 1.77 N ATOM 808 CA ILE A 52 -31.597 48.592 17.675 1.00 1.77 C ATOM 809 C ILE A 52 -30.150 48.739 17.210 1.00 1.92 C ATOM 810 O ILE A 52 -29.313 49.279 17.899 1.00 1.93 O ATOM 811 CB ILE A 52 -31.852 47.152 18.166 1.00 1.81 C ATOM 812 CG1 ILE A 52 -32.695 46.386 17.140 1.00 1.95 C ATOM 813 CG2 ILE A 52 -32.601 47.178 19.502 1.00 1.71 C ATOM 814 CD1 ILE A 52 -32.714 44.896 17.504 1.00 2.17 C ATOM 0 H ILE A 52 -32.369 48.332 15.700 1.00 1.77 H new ATOM 0 HA ILE A 52 -31.792 49.276 18.501 1.00 1.77 H new ATOM 0 HB ILE A 52 -30.890 46.656 18.293 1.00 1.81 H new ATOM 0 HG12 ILE A 52 -33.711 46.780 17.122 1.00 1.95 H new ATOM 0 HG13 ILE A 52 -32.282 46.522 16.140 1.00 1.95 H new ATOM 0 HG21 ILE A 52 -32.777 46.157 19.841 1.00 1.71 H new ATOM 0 HG22 ILE A 52 -32.004 47.709 20.244 1.00 1.71 H new ATOM 0 HG23 ILE A 52 -33.556 47.687 19.374 1.00 1.71 H new ATOM 0 HD11 ILE A 52 -33.313 44.351 16.775 1.00 2.17 H new ATOM 0 HD12 ILE A 52 -31.696 44.507 17.500 1.00 2.17 H new ATOM 0 HD13 ILE A 52 -33.147 44.769 18.496 1.00 2.17 H new ATOM 826 N ASP A 53 -29.874 48.265 16.037 1.00 2.07 N ATOM 827 CA ASP A 53 -28.510 48.349 15.459 1.00 2.26 C ATOM 828 C ASP A 53 -28.564 49.157 14.166 1.00 2.32 C ATOM 829 O ASP A 53 -28.102 50.278 14.097 1.00 2.34 O ATOM 830 CB ASP A 53 -28.012 46.938 15.149 1.00 2.43 C ATOM 831 CG ASP A 53 -26.670 47.014 14.421 1.00 2.75 C ATOM 832 OD1 ASP A 53 -25.655 47.076 15.095 1.00 2.92 O ATOM 833 OD2 ASP A 53 -26.680 47.009 13.201 1.00 3.26 O ATOM 0 H ASP A 53 -30.558 47.808 15.434 1.00 2.07 H new ATOM 0 HA ASP A 53 -27.836 48.832 16.167 1.00 2.26 H new ATOM 0 HB2 ASP A 53 -27.904 46.369 16.072 1.00 2.43 H new ATOM 0 HB3 ASP A 53 -28.741 46.411 14.533 1.00 2.43 H new ATOM 838 N GLY A 54 -29.129 48.588 13.143 1.00 2.38 N ATOM 839 CA GLY A 54 -29.221 49.313 11.842 1.00 2.47 C ATOM 840 C GLY A 54 -29.769 48.382 10.756 1.00 2.58 C ATOM 841 O GLY A 54 -29.433 48.513 9.595 1.00 2.73 O ATOM 0 H GLY A 54 -29.533 47.651 13.147 1.00 2.38 H new ATOM 0 HA2 GLY A 54 -29.870 50.183 11.947 1.00 2.47 H new ATOM 0 HA3 GLY A 54 -28.237 49.682 11.553 1.00 2.47 H new ATOM 845 N ARG A 55 -30.604 47.440 11.113 1.00 2.53 N ATOM 846 CA ARG A 55 -31.150 46.512 10.075 1.00 2.66 C ATOM 847 C ARG A 55 -32.540 46.008 10.466 1.00 2.57 C ATOM 848 O ARG A 55 -33.234 45.402 9.673 1.00 2.69 O ATOM 849 CB ARG A 55 -30.207 45.319 9.928 1.00 2.86 C ATOM 850 CG ARG A 55 -30.872 44.237 9.071 1.00 2.98 C ATOM 851 CD ARG A 55 -29.813 43.249 8.581 1.00 3.21 C ATOM 852 NE ARG A 55 -28.858 43.952 7.681 1.00 3.71 N ATOM 853 CZ ARG A 55 -27.706 43.407 7.404 1.00 3.97 C ATOM 854 NH1 ARG A 55 -27.387 42.256 7.930 1.00 3.88 N ATOM 855 NH2 ARG A 55 -26.871 44.015 6.607 1.00 4.76 N ATOM 0 H ARG A 55 -30.929 47.273 12.065 1.00 2.53 H new ATOM 0 HA ARG A 55 -31.231 47.053 9.132 1.00 2.66 H new ATOM 0 HB2 ARG A 55 -29.272 45.637 9.468 1.00 2.86 H new ATOM 0 HB3 ARG A 55 -29.958 44.917 10.910 1.00 2.86 H new ATOM 0 HG2 ARG A 55 -31.631 43.714 9.652 1.00 2.98 H new ATOM 0 HG3 ARG A 55 -31.380 44.693 8.221 1.00 2.98 H new ATOM 0 HD2 ARG A 55 -29.281 42.819 9.430 1.00 3.21 H new ATOM 0 HD3 ARG A 55 -30.288 42.423 8.051 1.00 3.21 H new ATOM 0 HE ARG A 55 -29.104 44.858 7.282 1.00 3.71 H new ATOM 0 HH11 ARG A 55 -28.038 41.784 8.557 1.00 3.88 H new ATOM 0 HH12 ARG A 55 -26.486 41.829 7.714 1.00 3.88 H new ATOM 0 HH21 ARG A 55 -27.119 44.917 6.200 1.00 4.76 H new ATOM 0 HH22 ARG A 55 -25.970 43.588 6.391 1.00 4.76 H new ATOM 869 N GLU A 56 -32.946 46.232 11.676 1.00 2.40 N ATOM 870 CA GLU A 56 -34.273 45.749 12.120 1.00 2.34 C ATOM 871 C GLU A 56 -35.320 46.837 11.875 1.00 2.24 C ATOM 872 O GLU A 56 -35.007 47.907 11.394 1.00 2.25 O ATOM 873 CB GLU A 56 -34.175 45.438 13.609 1.00 2.23 C ATOM 874 CG GLU A 56 -32.794 44.846 13.912 1.00 2.53 C ATOM 875 CD GLU A 56 -32.500 43.699 12.941 1.00 2.85 C ATOM 876 OE1 GLU A 56 -33.351 42.837 12.799 1.00 3.28 O ATOM 877 OE2 GLU A 56 -31.429 43.702 12.357 1.00 3.17 O ATOM 0 H GLU A 56 -32.410 46.734 12.384 1.00 2.40 H new ATOM 0 HA GLU A 56 -34.569 44.857 11.567 1.00 2.34 H new ATOM 0 HB2 GLU A 56 -34.331 46.345 14.193 1.00 2.23 H new ATOM 0 HB3 GLU A 56 -34.956 44.735 13.898 1.00 2.23 H new ATOM 0 HG2 GLU A 56 -32.029 45.617 13.821 1.00 2.53 H new ATOM 0 HG3 GLU A 56 -32.761 44.483 14.939 1.00 2.53 H new ATOM 884 N PHE A 57 -36.565 46.579 12.181 1.00 2.24 N ATOM 885 CA PHE A 57 -37.599 47.615 11.940 1.00 2.17 C ATOM 886 C PHE A 57 -38.846 47.395 12.818 1.00 2.10 C ATOM 887 O PHE A 57 -39.951 47.587 12.351 1.00 2.13 O ATOM 888 CB PHE A 57 -38.009 47.550 10.472 1.00 2.36 C ATOM 889 CG PHE A 57 -36.922 48.152 9.613 1.00 2.48 C ATOM 890 CD1 PHE A 57 -36.816 49.543 9.492 1.00 2.48 C ATOM 891 CD2 PHE A 57 -36.021 47.319 8.940 1.00 3.11 C ATOM 892 CE1 PHE A 57 -35.809 50.101 8.694 1.00 2.59 C ATOM 893 CE2 PHE A 57 -35.014 47.877 8.142 1.00 3.28 C ATOM 894 CZ PHE A 57 -34.908 49.268 8.021 1.00 2.79 C ATOM 0 H PHE A 57 -36.903 45.704 12.583 1.00 2.24 H new ATOM 0 HA PHE A 57 -37.179 48.589 12.193 1.00 2.17 H new ATOM 0 HB2 PHE A 57 -38.186 46.515 10.179 1.00 2.36 H new ATOM 0 HB3 PHE A 57 -38.945 48.088 10.322 1.00 2.36 H new ATOM 0 HD1 PHE A 57 -37.510 50.185 10.014 1.00 2.48 H new ATOM 0 HD2 PHE A 57 -36.102 46.246 9.036 1.00 3.11 H new ATOM 0 HE1 PHE A 57 -35.728 51.174 8.598 1.00 2.59 H new ATOM 0 HE2 PHE A 57 -34.320 47.235 7.620 1.00 3.28 H new ATOM 0 HZ PHE A 57 -34.130 49.698 7.408 1.00 2.79 H new ATOM 904 N PRO A 58 -38.655 47.033 14.065 1.00 2.02 N ATOM 905 CA PRO A 58 -39.790 46.833 14.983 1.00 1.99 C ATOM 906 C PRO A 58 -40.626 48.118 15.034 1.00 1.86 C ATOM 907 O PRO A 58 -40.257 49.128 14.467 1.00 1.81 O ATOM 908 CB PRO A 58 -39.146 46.540 16.351 1.00 1.96 C ATOM 909 CG PRO A 58 -37.606 46.616 16.166 1.00 1.95 C ATOM 910 CD PRO A 58 -37.327 46.796 14.661 1.00 2.01 C ATOM 0 HA PRO A 58 -40.454 46.025 14.675 1.00 1.99 H new ATOM 0 HB2 PRO A 58 -39.479 47.264 17.095 1.00 1.96 H new ATOM 0 HB3 PRO A 58 -39.441 45.554 16.711 1.00 1.96 H new ATOM 0 HG2 PRO A 58 -37.192 47.449 16.735 1.00 1.95 H new ATOM 0 HG3 PRO A 58 -37.130 45.709 16.538 1.00 1.95 H new ATOM 0 HD2 PRO A 58 -36.655 47.635 14.479 1.00 2.01 H new ATOM 0 HD3 PRO A 58 -36.854 45.911 14.236 1.00 2.01 H new ATOM 918 N GLU A 59 -41.744 48.098 15.707 1.00 1.85 N ATOM 919 CA GLU A 59 -42.579 49.328 15.779 1.00 1.76 C ATOM 920 C GLU A 59 -43.762 49.104 16.721 1.00 1.83 C ATOM 921 O GLU A 59 -43.904 48.059 17.324 1.00 2.03 O ATOM 922 CB GLU A 59 -43.104 49.669 14.385 1.00 1.86 C ATOM 923 CG GLU A 59 -43.682 48.412 13.729 1.00 2.10 C ATOM 924 CD GLU A 59 -44.285 48.775 12.370 1.00 2.34 C ATOM 925 OE1 GLU A 59 -44.257 49.945 12.026 1.00 2.62 O ATOM 926 OE2 GLU A 59 -44.764 47.877 11.697 1.00 2.72 O ATOM 0 H GLU A 59 -42.113 47.289 16.207 1.00 1.85 H new ATOM 0 HA GLU A 59 -41.970 50.149 16.156 1.00 1.76 H new ATOM 0 HB2 GLU A 59 -43.871 50.440 14.453 1.00 1.86 H new ATOM 0 HB3 GLU A 59 -42.299 50.073 13.772 1.00 1.86 H new ATOM 0 HG2 GLU A 59 -42.900 47.663 13.603 1.00 2.10 H new ATOM 0 HG3 GLU A 59 -44.445 47.972 14.371 1.00 2.10 H new ATOM 933 N GLY A 60 -44.610 50.085 16.851 1.00 1.72 N ATOM 934 CA GLY A 60 -45.785 49.945 17.751 1.00 1.85 C ATOM 935 C GLY A 60 -46.562 51.261 17.767 1.00 1.77 C ATOM 936 O GLY A 60 -46.087 52.277 17.300 1.00 1.73 O ATOM 0 H GLY A 60 -44.538 50.982 16.370 1.00 1.72 H new ATOM 0 HA2 GLY A 60 -46.427 49.133 17.408 1.00 1.85 H new ATOM 0 HA3 GLY A 60 -45.458 49.689 18.759 1.00 1.85 H new ATOM 940 N GLU A 61 -47.751 51.253 18.304 1.00 1.85 N ATOM 941 CA GLU A 61 -48.562 52.502 18.356 1.00 1.80 C ATOM 942 C GLU A 61 -49.086 52.693 19.776 1.00 1.84 C ATOM 943 O GLU A 61 -48.904 51.849 20.630 1.00 1.99 O ATOM 944 CB GLU A 61 -49.739 52.390 17.386 1.00 2.05 C ATOM 945 CG GLU A 61 -50.358 50.995 17.495 1.00 2.47 C ATOM 946 CD GLU A 61 -49.517 49.996 16.697 1.00 2.81 C ATOM 947 OE1 GLU A 61 -49.455 50.137 15.487 1.00 3.20 O ATOM 948 OE2 GLU A 61 -48.948 49.107 17.310 1.00 3.27 O ATOM 0 H GLU A 61 -48.198 50.431 18.711 1.00 1.85 H new ATOM 0 HA GLU A 61 -47.945 53.355 18.072 1.00 1.80 H new ATOM 0 HB2 GLU A 61 -50.486 53.150 17.615 1.00 2.05 H new ATOM 0 HB3 GLU A 61 -49.402 52.571 16.365 1.00 2.05 H new ATOM 0 HG2 GLU A 61 -50.409 50.690 18.540 1.00 2.47 H new ATOM 0 HG3 GLU A 61 -51.380 51.009 17.117 1.00 2.47 H new ATOM 955 N GLY A 62 -49.734 53.791 20.040 1.00 1.84 N ATOM 956 CA GLY A 62 -50.260 54.010 21.420 1.00 2.03 C ATOM 957 C GLY A 62 -50.967 55.362 21.519 1.00 2.06 C ATOM 958 O GLY A 62 -51.021 55.965 22.571 1.00 2.50 O ATOM 0 H GLY A 62 -49.922 54.539 19.372 1.00 1.84 H new ATOM 0 HA2 GLY A 62 -50.954 53.211 21.681 1.00 2.03 H new ATOM 0 HA3 GLY A 62 -49.441 53.969 22.138 1.00 2.03 H new ATOM 962 N ARG A 63 -51.515 55.849 20.445 1.00 1.90 N ATOM 963 CA ARG A 63 -52.213 57.163 20.513 1.00 1.96 C ATOM 964 C ARG A 63 -51.185 58.257 20.824 1.00 1.90 C ATOM 965 O ARG A 63 -50.019 57.981 21.026 1.00 1.85 O ATOM 966 CB ARG A 63 -53.276 57.111 21.612 1.00 2.15 C ATOM 967 CG ARG A 63 -54.477 57.983 21.220 1.00 2.30 C ATOM 968 CD ARG A 63 -55.398 58.182 22.429 1.00 2.75 C ATOM 969 NE ARG A 63 -56.528 59.079 22.043 1.00 3.01 N ATOM 970 CZ ARG A 63 -57.580 59.186 22.813 1.00 3.51 C ATOM 971 NH1 ARG A 63 -57.654 58.501 23.921 1.00 3.80 N ATOM 972 NH2 ARG A 63 -58.560 59.979 22.473 1.00 4.12 N ATOM 0 H ARG A 63 -51.512 55.400 19.529 1.00 1.90 H new ATOM 0 HA ARG A 63 -52.696 57.383 19.561 1.00 1.96 H new ATOM 0 HB2 ARG A 63 -53.599 56.082 21.769 1.00 2.15 H new ATOM 0 HB3 ARG A 63 -52.854 57.460 22.555 1.00 2.15 H new ATOM 0 HG2 ARG A 63 -54.131 58.949 20.853 1.00 2.30 H new ATOM 0 HG3 ARG A 63 -55.028 57.512 20.406 1.00 2.30 H new ATOM 0 HD2 ARG A 63 -55.782 57.221 22.771 1.00 2.75 H new ATOM 0 HD3 ARG A 63 -54.840 58.616 23.259 1.00 2.75 H new ATOM 0 HE ARG A 63 -56.479 59.611 21.174 1.00 3.01 H new ATOM 0 HH11 ARG A 63 -56.890 57.880 24.189 1.00 3.80 H new ATOM 0 HH12 ARG A 63 -58.476 58.586 24.520 1.00 3.80 H new ATOM 0 HH21 ARG A 63 -58.505 60.515 21.607 1.00 4.12 H new ATOM 0 HH22 ARG A 63 -59.380 60.062 23.073 1.00 4.12 H new ATOM 986 N SER A 64 -51.587 59.494 20.839 1.00 1.99 N ATOM 987 CA SER A 64 -50.598 60.578 21.094 1.00 2.00 C ATOM 988 C SER A 64 -50.250 60.685 22.581 1.00 2.08 C ATOM 989 O SER A 64 -50.880 61.407 23.326 1.00 2.57 O ATOM 990 CB SER A 64 -51.178 61.909 20.608 1.00 2.17 C ATOM 991 OG SER A 64 -52.169 62.355 21.524 1.00 2.39 O ATOM 0 H SER A 64 -52.548 59.802 20.688 1.00 1.99 H new ATOM 0 HA SER A 64 -49.682 60.341 20.552 1.00 2.00 H new ATOM 0 HB2 SER A 64 -50.386 62.653 20.521 1.00 2.17 H new ATOM 0 HB3 SER A 64 -51.612 61.788 19.616 1.00 2.17 H new ATOM 0 HG SER A 64 -51.745 62.591 22.376 1.00 2.39 H new ATOM 997 N LYS A 65 -49.211 59.995 22.998 1.00 1.89 N ATOM 998 CA LYS A 65 -48.757 60.073 24.422 1.00 1.98 C ATOM 999 C LYS A 65 -47.670 59.018 24.707 1.00 1.83 C ATOM 1000 O LYS A 65 -47.084 58.431 23.811 1.00 1.68 O ATOM 1001 CB LYS A 65 -49.928 59.900 25.400 1.00 2.15 C ATOM 1002 CG LYS A 65 -50.769 58.681 25.033 1.00 2.27 C ATOM 1003 CD LYS A 65 -51.952 58.578 26.003 1.00 2.49 C ATOM 1004 CE LYS A 65 -51.437 58.378 27.436 1.00 2.43 C ATOM 1005 NZ LYS A 65 -51.206 59.706 28.076 1.00 2.75 N ATOM 0 H LYS A 65 -48.656 59.377 22.406 1.00 1.89 H new ATOM 0 HA LYS A 65 -48.335 61.066 24.574 1.00 1.98 H new ATOM 0 HB2 LYS A 65 -49.546 59.791 26.415 1.00 2.15 H new ATOM 0 HB3 LYS A 65 -50.552 60.794 25.388 1.00 2.15 H new ATOM 0 HG2 LYS A 65 -51.129 58.768 24.008 1.00 2.27 H new ATOM 0 HG3 LYS A 65 -50.162 57.777 25.082 1.00 2.27 H new ATOM 0 HD2 LYS A 65 -52.558 59.482 25.948 1.00 2.49 H new ATOM 0 HD3 LYS A 65 -52.595 57.745 25.719 1.00 2.49 H new ATOM 0 HE2 LYS A 65 -52.160 57.805 28.016 1.00 2.43 H new ATOM 0 HE3 LYS A 65 -50.511 57.803 27.423 1.00 2.43 H new ATOM 0 HZ1 LYS A 65 -50.361 59.658 28.681 1.00 2.75 H new ATOM 0 HZ2 LYS A 65 -51.063 60.426 27.339 1.00 2.75 H new ATOM 0 HZ3 LYS A 65 -52.032 59.961 28.654 1.00 2.75 H new ATOM 1019 N LYS A 66 -47.368 58.826 25.962 1.00 1.93 N ATOM 1020 CA LYS A 66 -46.289 57.877 26.374 1.00 1.87 C ATOM 1021 C LYS A 66 -46.452 56.460 25.796 1.00 1.71 C ATOM 1022 O LYS A 66 -45.517 55.907 25.252 1.00 1.60 O ATOM 1023 CB LYS A 66 -46.264 57.798 27.902 1.00 2.08 C ATOM 1024 CG LYS A 66 -47.693 57.725 28.452 1.00 2.16 C ATOM 1025 CD LYS A 66 -47.669 57.072 29.836 1.00 2.61 C ATOM 1026 CE LYS A 66 -49.059 57.155 30.469 1.00 2.80 C ATOM 1027 NZ LYS A 66 -49.980 56.216 29.770 1.00 3.33 N ATOM 0 H LYS A 66 -47.833 59.297 26.738 1.00 1.93 H new ATOM 0 HA LYS A 66 -45.353 58.266 25.973 1.00 1.87 H new ATOM 0 HB2 LYS A 66 -45.699 56.921 28.219 1.00 2.08 H new ATOM 0 HB3 LYS A 66 -45.754 58.670 28.310 1.00 2.08 H new ATOM 0 HG2 LYS A 66 -48.122 58.725 28.516 1.00 2.16 H new ATOM 0 HG3 LYS A 66 -48.326 57.150 27.777 1.00 2.16 H new ATOM 0 HD2 LYS A 66 -47.359 56.031 29.752 1.00 2.61 H new ATOM 0 HD3 LYS A 66 -46.939 57.572 30.472 1.00 2.61 H new ATOM 0 HE2 LYS A 66 -49.003 56.905 31.529 1.00 2.80 H new ATOM 0 HE3 LYS A 66 -49.441 58.174 30.401 1.00 2.80 H new ATOM 0 HZ1 LYS A 66 -50.822 56.733 29.445 1.00 3.33 H new ATOM 0 HZ2 LYS A 66 -49.494 55.798 28.951 1.00 3.33 H new ATOM 0 HZ3 LYS A 66 -50.268 55.461 30.424 1.00 3.33 H new ATOM 1041 N GLU A 67 -47.588 55.837 25.950 1.00 1.74 N ATOM 1042 CA GLU A 67 -47.721 54.435 25.445 1.00 1.69 C ATOM 1043 C GLU A 67 -47.196 54.329 24.013 1.00 1.49 C ATOM 1044 O GLU A 67 -46.933 53.249 23.525 1.00 1.43 O ATOM 1045 CB GLU A 67 -49.180 53.969 25.507 1.00 1.85 C ATOM 1046 CG GLU A 67 -50.116 55.132 25.185 1.00 2.07 C ATOM 1047 CD GLU A 67 -51.482 54.586 24.758 1.00 2.56 C ATOM 1048 OE1 GLU A 67 -51.577 53.391 24.528 1.00 2.94 O ATOM 1049 OE2 GLU A 67 -52.411 55.372 24.669 1.00 3.11 O ATOM 0 H GLU A 67 -48.419 56.227 26.395 1.00 1.74 H new ATOM 0 HA GLU A 67 -47.124 53.787 26.087 1.00 1.69 H new ATOM 0 HB2 GLU A 67 -49.341 53.156 24.799 1.00 1.85 H new ATOM 0 HB3 GLU A 67 -49.403 53.577 26.499 1.00 1.85 H new ATOM 0 HG2 GLU A 67 -50.227 55.776 26.058 1.00 2.07 H new ATOM 0 HG3 GLU A 67 -49.692 55.744 24.389 1.00 2.07 H new ATOM 1056 N ALA A 68 -47.004 55.429 23.343 1.00 1.45 N ATOM 1057 CA ALA A 68 -46.454 55.352 21.960 1.00 1.33 C ATOM 1058 C ALA A 68 -44.958 55.059 22.066 1.00 1.25 C ATOM 1059 O ALA A 68 -44.491 53.996 21.708 1.00 1.21 O ATOM 1060 CB ALA A 68 -46.667 56.682 21.233 1.00 1.38 C ATOM 0 H ALA A 68 -47.201 56.369 23.687 1.00 1.45 H new ATOM 0 HA ALA A 68 -46.961 54.568 21.398 1.00 1.33 H new ATOM 0 HB1 ALA A 68 -46.261 56.614 20.224 1.00 1.38 H new ATOM 0 HB2 ALA A 68 -47.733 56.902 21.181 1.00 1.38 H new ATOM 0 HB3 ALA A 68 -46.158 57.479 21.776 1.00 1.38 H new ATOM 1066 N LYS A 69 -44.207 55.996 22.578 1.00 1.30 N ATOM 1067 CA LYS A 69 -42.745 55.789 22.740 1.00 1.29 C ATOM 1068 C LYS A 69 -42.502 54.572 23.636 1.00 1.30 C ATOM 1069 O LYS A 69 -41.611 53.782 23.394 1.00 1.27 O ATOM 1070 CB LYS A 69 -42.162 57.064 23.366 1.00 1.46 C ATOM 1071 CG LYS A 69 -40.813 56.787 24.042 1.00 1.64 C ATOM 1072 CD LYS A 69 -41.010 56.594 25.554 1.00 1.86 C ATOM 1073 CE LYS A 69 -41.342 57.936 26.226 1.00 2.20 C ATOM 1074 NZ LYS A 69 -42.822 58.098 26.319 1.00 2.82 N ATOM 0 H LYS A 69 -44.550 56.903 22.893 1.00 1.30 H new ATOM 0 HA LYS A 69 -42.262 55.600 21.782 1.00 1.29 H new ATOM 0 HB2 LYS A 69 -42.036 57.825 22.596 1.00 1.46 H new ATOM 0 HB3 LYS A 69 -42.863 57.465 24.098 1.00 1.46 H new ATOM 0 HG2 LYS A 69 -40.357 55.896 23.610 1.00 1.64 H new ATOM 0 HG3 LYS A 69 -40.129 57.616 23.859 1.00 1.64 H new ATOM 0 HD2 LYS A 69 -41.814 55.881 25.734 1.00 1.86 H new ATOM 0 HD3 LYS A 69 -40.106 56.173 25.994 1.00 1.86 H new ATOM 0 HE2 LYS A 69 -40.899 57.975 27.221 1.00 2.20 H new ATOM 0 HE3 LYS A 69 -40.912 58.757 25.653 1.00 2.20 H new ATOM 0 HZ1 LYS A 69 -43.127 58.868 25.689 1.00 2.82 H new ATOM 0 HZ2 LYS A 69 -43.287 57.212 26.034 1.00 2.82 H new ATOM 0 HZ3 LYS A 69 -43.085 58.327 27.299 1.00 2.82 H new ATOM 1088 N ASN A 70 -43.285 54.409 24.665 1.00 1.40 N ATOM 1089 CA ASN A 70 -43.090 53.241 25.560 1.00 1.50 C ATOM 1090 C ASN A 70 -43.414 51.960 24.784 1.00 1.43 C ATOM 1091 O ASN A 70 -42.761 50.951 24.940 1.00 1.47 O ATOM 1092 CB ASN A 70 -44.017 53.372 26.777 1.00 1.68 C ATOM 1093 CG ASN A 70 -43.268 54.052 27.927 1.00 1.91 C ATOM 1094 OD1 ASN A 70 -42.564 55.019 27.720 1.00 2.11 O ATOM 1095 ND2 ASN A 70 -43.393 53.587 29.140 1.00 2.47 N ATOM 0 H ASN A 70 -44.049 55.034 24.923 1.00 1.40 H new ATOM 0 HA ASN A 70 -42.057 53.201 25.906 1.00 1.50 H new ATOM 0 HB2 ASN A 70 -44.901 53.953 26.512 1.00 1.68 H new ATOM 0 HB3 ASN A 70 -44.365 52.387 27.089 1.00 1.68 H new ATOM 0 HD21 ASN A 70 -42.900 54.036 29.912 1.00 2.47 H new ATOM 0 HD22 ASN A 70 -43.984 52.775 29.316 1.00 2.47 H new ATOM 1102 N ALA A 71 -44.407 51.996 23.937 1.00 1.39 N ATOM 1103 CA ALA A 71 -44.756 50.780 23.142 1.00 1.39 C ATOM 1104 C ALA A 71 -43.567 50.411 22.263 1.00 1.33 C ATOM 1105 O ALA A 71 -43.140 49.276 22.222 1.00 1.42 O ATOM 1106 CB ALA A 71 -45.966 51.079 22.251 1.00 1.38 C ATOM 0 H ALA A 71 -44.992 52.813 23.760 1.00 1.39 H new ATOM 0 HA ALA A 71 -44.997 49.957 23.814 1.00 1.39 H new ATOM 0 HB1 ALA A 71 -46.219 50.191 21.672 1.00 1.38 H new ATOM 0 HB2 ALA A 71 -46.815 51.361 22.873 1.00 1.38 H new ATOM 0 HB3 ALA A 71 -45.725 51.898 21.573 1.00 1.38 H new ATOM 1112 N ALA A 72 -43.028 51.365 21.563 1.00 1.22 N ATOM 1113 CA ALA A 72 -41.865 51.079 20.688 1.00 1.22 C ATOM 1114 C ALA A 72 -40.720 50.546 21.540 1.00 1.25 C ATOM 1115 O ALA A 72 -40.089 49.561 21.212 1.00 1.33 O ATOM 1116 CB ALA A 72 -41.433 52.363 19.978 1.00 1.22 C ATOM 0 H ALA A 72 -43.345 52.334 21.560 1.00 1.22 H new ATOM 0 HA ALA A 72 -42.138 50.334 19.940 1.00 1.22 H new ATOM 0 HB1 ALA A 72 -40.578 52.153 19.335 1.00 1.22 H new ATOM 0 HB2 ALA A 72 -42.258 52.740 19.374 1.00 1.22 H new ATOM 0 HB3 ALA A 72 -41.154 53.112 20.719 1.00 1.22 H new ATOM 1122 N ALA A 73 -40.456 51.188 22.638 1.00 1.25 N ATOM 1123 CA ALA A 73 -39.357 50.720 23.528 1.00 1.34 C ATOM 1124 C ALA A 73 -39.779 49.416 24.205 1.00 1.46 C ATOM 1125 O ALA A 73 -38.992 48.510 24.383 1.00 1.56 O ATOM 1126 CB ALA A 73 -39.092 51.776 24.604 1.00 1.39 C ATOM 0 H ALA A 73 -40.953 52.018 22.961 1.00 1.25 H new ATOM 0 HA ALA A 73 -38.454 50.558 22.939 1.00 1.34 H new ATOM 0 HB1 ALA A 73 -38.288 51.436 25.257 1.00 1.39 H new ATOM 0 HB2 ALA A 73 -38.803 52.714 24.130 1.00 1.39 H new ATOM 0 HB3 ALA A 73 -39.996 51.931 25.192 1.00 1.39 H new ATOM 1132 N LYS A 74 -41.021 49.328 24.587 1.00 1.48 N ATOM 1133 CA LYS A 74 -41.530 48.107 25.266 1.00 1.65 C ATOM 1134 C LYS A 74 -41.235 46.858 24.436 1.00 1.69 C ATOM 1135 O LYS A 74 -40.477 45.993 24.829 1.00 1.82 O ATOM 1136 CB LYS A 74 -43.046 48.237 25.409 1.00 1.71 C ATOM 1137 CG LYS A 74 -43.408 49.093 26.636 1.00 2.09 C ATOM 1138 CD LYS A 74 -43.952 48.196 27.749 1.00 2.10 C ATOM 1139 CE LYS A 74 -42.841 47.278 28.258 1.00 2.34 C ATOM 1140 NZ LYS A 74 -43.259 46.668 29.549 1.00 2.86 N ATOM 0 H LYS A 74 -41.716 50.063 24.455 1.00 1.48 H new ATOM 0 HA LYS A 74 -41.041 48.012 26.236 1.00 1.65 H new ATOM 0 HB2 LYS A 74 -43.463 48.689 24.509 1.00 1.71 H new ATOM 0 HB3 LYS A 74 -43.493 47.248 25.506 1.00 1.71 H new ATOM 0 HG2 LYS A 74 -42.528 49.632 26.988 1.00 2.09 H new ATOM 0 HG3 LYS A 74 -44.152 49.841 26.363 1.00 2.09 H new ATOM 0 HD2 LYS A 74 -44.336 48.806 28.566 1.00 2.10 H new ATOM 0 HD3 LYS A 74 -44.786 47.602 27.376 1.00 2.10 H new ATOM 0 HE2 LYS A 74 -42.633 46.499 27.525 1.00 2.34 H new ATOM 0 HE3 LYS A 74 -41.919 47.844 28.392 1.00 2.34 H new ATOM 0 HZ1 LYS A 74 -42.505 46.043 29.898 1.00 2.86 H new ATOM 0 HZ2 LYS A 74 -43.436 47.419 30.246 1.00 2.86 H new ATOM 0 HZ3 LYS A 74 -44.128 46.115 29.406 1.00 2.86 H new ATOM 1154 N LEU A 75 -41.878 46.741 23.312 1.00 1.63 N ATOM 1155 CA LEU A 75 -41.706 45.537 22.459 1.00 1.72 C ATOM 1156 C LEU A 75 -40.274 45.391 21.950 1.00 1.71 C ATOM 1157 O LEU A 75 -39.826 44.304 21.655 1.00 1.84 O ATOM 1158 CB LEU A 75 -42.653 45.660 21.275 1.00 1.71 C ATOM 1159 CG LEU A 75 -42.409 46.985 20.526 1.00 1.70 C ATOM 1160 CD1 LEU A 75 -41.615 46.724 19.243 1.00 1.75 C ATOM 1161 CD2 LEU A 75 -43.758 47.616 20.161 1.00 2.18 C ATOM 0 H LEU A 75 -42.525 47.438 22.943 1.00 1.63 H new ATOM 0 HA LEU A 75 -41.928 44.653 23.056 1.00 1.72 H new ATOM 0 HB2 LEU A 75 -42.508 44.819 20.596 1.00 1.71 H new ATOM 0 HB3 LEU A 75 -43.686 45.616 21.621 1.00 1.71 H new ATOM 0 HG LEU A 75 -41.843 47.659 21.169 1.00 1.70 H new ATOM 0 HD11 LEU A 75 -41.448 47.666 18.721 1.00 1.75 H new ATOM 0 HD12 LEU A 75 -40.655 46.273 19.495 1.00 1.75 H new ATOM 0 HD13 LEU A 75 -42.176 46.047 18.599 1.00 1.75 H new ATOM 0 HD21 LEU A 75 -43.590 48.554 19.631 1.00 2.18 H new ATOM 0 HD22 LEU A 75 -44.318 46.933 19.522 1.00 2.18 H new ATOM 0 HD23 LEU A 75 -44.327 47.810 21.070 1.00 2.18 H new ATOM 1173 N ALA A 76 -39.551 46.454 21.836 1.00 1.57 N ATOM 1174 CA ALA A 76 -38.153 46.326 21.334 1.00 1.58 C ATOM 1175 C ALA A 76 -37.395 45.342 22.234 1.00 1.71 C ATOM 1176 O ALA A 76 -36.737 44.421 21.774 1.00 1.81 O ATOM 1177 CB ALA A 76 -37.473 47.701 21.364 1.00 1.46 C ATOM 0 H ALA A 76 -39.854 47.401 22.063 1.00 1.57 H new ATOM 0 HA ALA A 76 -38.153 45.956 20.309 1.00 1.58 H new ATOM 0 HB1 ALA A 76 -36.451 47.609 20.997 1.00 1.46 H new ATOM 0 HB2 ALA A 76 -38.025 48.394 20.729 1.00 1.46 H new ATOM 0 HB3 ALA A 76 -37.459 48.078 22.387 1.00 1.46 H new ATOM 1183 N VAL A 77 -37.498 45.524 23.514 1.00 1.75 N ATOM 1184 CA VAL A 77 -36.806 44.607 24.462 1.00 1.91 C ATOM 1185 C VAL A 77 -37.377 43.189 24.334 1.00 2.07 C ATOM 1186 O VAL A 77 -36.667 42.211 24.446 1.00 2.21 O ATOM 1187 CB VAL A 77 -37.017 45.099 25.901 1.00 1.99 C ATOM 1188 CG1 VAL A 77 -35.735 44.884 26.711 1.00 2.08 C ATOM 1189 CG2 VAL A 77 -37.371 46.589 25.901 1.00 1.95 C ATOM 0 H VAL A 77 -38.035 46.273 23.952 1.00 1.75 H new ATOM 0 HA VAL A 77 -35.742 44.594 24.225 1.00 1.91 H new ATOM 0 HB VAL A 77 -37.835 44.536 26.350 1.00 1.99 H new ATOM 0 HG11 VAL A 77 -35.887 45.234 27.732 1.00 2.08 H new ATOM 0 HG12 VAL A 77 -35.487 43.823 26.724 1.00 2.08 H new ATOM 0 HG13 VAL A 77 -34.918 45.442 26.254 1.00 2.08 H new ATOM 0 HG21 VAL A 77 -37.519 46.928 26.926 1.00 1.95 H new ATOM 0 HG22 VAL A 77 -36.559 47.156 25.445 1.00 1.95 H new ATOM 0 HG23 VAL A 77 -38.287 46.745 25.332 1.00 1.95 H new ATOM 1199 N GLU A 78 -38.663 43.075 24.135 1.00 2.08 N ATOM 1200 CA GLU A 78 -39.293 41.729 24.040 1.00 2.25 C ATOM 1201 C GLU A 78 -38.671 40.921 22.893 1.00 2.27 C ATOM 1202 O GLU A 78 -38.805 39.717 22.828 1.00 2.44 O ATOM 1203 CB GLU A 78 -40.815 41.897 23.837 1.00 2.31 C ATOM 1204 CG GLU A 78 -41.203 41.711 22.360 1.00 2.60 C ATOM 1205 CD GLU A 78 -41.304 40.218 22.034 1.00 3.03 C ATOM 1206 OE1 GLU A 78 -41.221 39.422 22.955 1.00 3.35 O ATOM 1207 OE2 GLU A 78 -41.463 39.896 20.869 1.00 3.50 O ATOM 0 H GLU A 78 -39.306 43.861 24.034 1.00 2.08 H new ATOM 0 HA GLU A 78 -39.115 41.178 24.964 1.00 2.25 H new ATOM 0 HB2 GLU A 78 -41.349 41.171 24.450 1.00 2.31 H new ATOM 0 HB3 GLU A 78 -41.123 42.887 24.175 1.00 2.31 H new ATOM 0 HG2 GLU A 78 -42.156 42.201 22.160 1.00 2.60 H new ATOM 0 HG3 GLU A 78 -40.460 42.184 21.717 1.00 2.60 H new ATOM 1214 N ILE A 79 -38.001 41.576 21.988 1.00 2.14 N ATOM 1215 CA ILE A 79 -37.377 40.851 20.841 1.00 2.21 C ATOM 1216 C ILE A 79 -36.088 40.163 21.283 1.00 2.28 C ATOM 1217 O ILE A 79 -35.956 38.952 21.199 1.00 2.43 O ATOM 1218 CB ILE A 79 -37.078 41.838 19.709 1.00 2.13 C ATOM 1219 CG1 ILE A 79 -38.356 42.069 18.902 1.00 2.30 C ATOM 1220 CG2 ILE A 79 -35.993 41.266 18.791 1.00 2.64 C ATOM 1221 CD1 ILE A 79 -38.187 43.302 18.015 1.00 2.86 C ATOM 0 H ILE A 79 -37.857 42.586 21.991 1.00 2.14 H new ATOM 0 HA ILE A 79 -38.073 40.091 20.485 1.00 2.21 H new ATOM 0 HB ILE A 79 -36.727 42.780 20.130 1.00 2.13 H new ATOM 0 HG12 ILE A 79 -38.574 41.195 18.289 1.00 2.30 H new ATOM 0 HG13 ILE A 79 -39.203 42.206 19.574 1.00 2.30 H new ATOM 0 HG21 ILE A 79 -35.786 41.973 17.988 1.00 2.64 H new ATOM 0 HG22 ILE A 79 -35.084 41.093 19.366 1.00 2.64 H new ATOM 0 HG23 ILE A 79 -36.337 40.324 18.364 1.00 2.64 H new ATOM 0 HD11 ILE A 79 -39.099 43.465 17.441 1.00 2.86 H new ATOM 0 HD12 ILE A 79 -37.990 44.174 18.638 1.00 2.86 H new ATOM 0 HD13 ILE A 79 -37.351 43.147 17.333 1.00 2.86 H new ATOM 1233 N LEU A 80 -35.127 40.919 21.745 1.00 2.21 N ATOM 1234 CA LEU A 80 -33.859 40.280 22.174 1.00 2.33 C ATOM 1235 C LEU A 80 -34.198 39.269 23.254 1.00 2.47 C ATOM 1236 O LEU A 80 -33.610 38.206 23.350 1.00 2.61 O ATOM 1237 CB LEU A 80 -32.880 41.329 22.729 1.00 2.30 C ATOM 1238 CG LEU A 80 -33.588 42.665 22.981 1.00 2.13 C ATOM 1239 CD1 LEU A 80 -32.781 43.479 23.996 1.00 2.16 C ATOM 1240 CD2 LEU A 80 -33.684 43.454 21.671 1.00 2.09 C ATOM 0 H LEU A 80 -35.167 41.934 21.841 1.00 2.21 H new ATOM 0 HA LEU A 80 -33.379 39.795 21.324 1.00 2.33 H new ATOM 0 HB2 LEU A 80 -32.441 40.966 23.658 1.00 2.30 H new ATOM 0 HB3 LEU A 80 -32.061 41.475 22.025 1.00 2.30 H new ATOM 0 HG LEU A 80 -34.590 42.476 23.366 1.00 2.13 H new ATOM 0 HD11 LEU A 80 -33.280 44.430 24.179 1.00 2.16 H new ATOM 0 HD12 LEU A 80 -32.706 42.923 24.931 1.00 2.16 H new ATOM 0 HD13 LEU A 80 -31.782 43.664 23.602 1.00 2.16 H new ATOM 0 HD21 LEU A 80 -34.188 44.403 21.854 1.00 2.09 H new ATOM 0 HD22 LEU A 80 -32.682 43.643 21.286 1.00 2.09 H new ATOM 0 HD23 LEU A 80 -34.251 42.878 20.940 1.00 2.09 H new ATOM 1252 N ASN A 81 -35.173 39.590 24.047 1.00 2.46 N ATOM 1253 CA ASN A 81 -35.590 38.658 25.128 1.00 2.65 C ATOM 1254 C ASN A 81 -35.753 37.270 24.514 1.00 2.78 C ATOM 1255 O ASN A 81 -35.181 36.302 24.973 1.00 2.93 O ATOM 1256 CB ASN A 81 -36.913 39.157 25.743 1.00 2.62 C ATOM 1257 CG ASN A 81 -38.051 38.156 25.501 1.00 2.83 C ATOM 1258 OD1 ASN A 81 -39.191 38.589 25.036 1.00 3.18 O flip ATOM 1259 ND2 ASN A 81 -37.907 36.975 25.749 1.00 3.04 N flip ATOM 0 H ASN A 81 -35.703 40.460 23.995 1.00 2.46 H new ATOM 0 HA ASN A 81 -34.845 38.613 25.923 1.00 2.65 H new ATOM 0 HB2 ASN A 81 -36.783 39.312 26.814 1.00 2.62 H new ATOM 0 HB3 ASN A 81 -37.176 40.122 25.311 1.00 2.62 H new ATOM 0 HD21 ASN A 81 -37.017 36.635 26.112 1.00 3.04 H new ATOM 0 HD22 ASN A 81 -38.676 36.324 25.594 1.00 3.04 H new ATOM 1266 N LYS A 82 -36.502 37.175 23.457 1.00 2.74 N ATOM 1267 CA LYS A 82 -36.673 35.869 22.790 1.00 2.90 C ATOM 1268 C LYS A 82 -35.400 35.565 22.002 1.00 2.92 C ATOM 1269 O LYS A 82 -34.306 35.653 22.524 1.00 3.03 O ATOM 1270 CB LYS A 82 -37.880 35.934 21.854 1.00 2.92 C ATOM 1271 CG LYS A 82 -39.078 36.467 22.643 1.00 2.90 C ATOM 1272 CD LYS A 82 -40.330 36.497 21.762 1.00 3.08 C ATOM 1273 CE LYS A 82 -40.056 37.313 20.496 1.00 3.24 C ATOM 1274 NZ LYS A 82 -39.434 36.433 19.468 1.00 3.71 N ATOM 0 H LYS A 82 -37.004 37.952 23.027 1.00 2.74 H new ATOM 0 HA LYS A 82 -36.846 35.080 23.522 1.00 2.90 H new ATOM 0 HB2 LYS A 82 -37.666 36.583 21.005 1.00 2.92 H new ATOM 0 HB3 LYS A 82 -38.101 34.945 21.452 1.00 2.92 H new ATOM 0 HG2 LYS A 82 -39.255 35.838 23.516 1.00 2.90 H new ATOM 0 HG3 LYS A 82 -38.861 37.470 23.011 1.00 2.90 H new ATOM 0 HD2 LYS A 82 -40.622 35.481 21.495 1.00 3.08 H new ATOM 0 HD3 LYS A 82 -41.163 36.933 22.313 1.00 3.08 H new ATOM 0 HE2 LYS A 82 -40.985 37.737 20.115 1.00 3.24 H new ATOM 0 HE3 LYS A 82 -39.395 38.149 20.724 1.00 3.24 H new ATOM 0 HZ1 LYS A 82 -38.483 36.786 19.238 1.00 3.71 H new ATOM 0 HZ2 LYS A 82 -39.363 35.464 19.838 1.00 3.71 H new ATOM 0 HZ3 LYS A 82 -40.021 36.433 18.609 1.00 3.71 H new ATOM 1288 N GLU A 83 -35.526 35.196 20.761 1.00 2.91 N ATOM 1289 CA GLU A 83 -34.318 34.863 19.950 1.00 2.99 C ATOM 1290 C GLU A 83 -33.429 33.910 20.751 1.00 3.16 C ATOM 1291 O GLU A 83 -32.325 33.585 20.360 1.00 3.28 O ATOM 1292 CB GLU A 83 -33.560 36.147 19.612 1.00 2.99 C ATOM 1293 CG GLU A 83 -34.268 36.851 18.449 1.00 2.99 C ATOM 1294 CD GLU A 83 -33.880 36.177 17.131 1.00 3.40 C ATOM 1295 OE1 GLU A 83 -32.707 35.890 16.958 1.00 4.02 O ATOM 1296 OE2 GLU A 83 -34.763 35.960 16.318 1.00 3.58 O ATOM 0 H GLU A 83 -36.415 35.109 20.269 1.00 2.91 H new ATOM 0 HA GLU A 83 -34.613 34.379 19.019 1.00 2.99 H new ATOM 0 HB2 GLU A 83 -33.522 36.802 20.482 1.00 2.99 H new ATOM 0 HB3 GLU A 83 -32.530 35.916 19.342 1.00 2.99 H new ATOM 0 HG2 GLU A 83 -35.348 36.808 18.587 1.00 2.99 H new ATOM 0 HG3 GLU A 83 -33.992 37.905 18.426 1.00 2.99 H new ATOM 1303 N LYS A 84 -33.922 33.451 21.868 1.00 3.26 N ATOM 1304 CA LYS A 84 -33.154 32.506 22.710 1.00 3.56 C ATOM 1305 C LYS A 84 -33.246 31.113 22.089 1.00 3.71 C ATOM 1306 O LYS A 84 -32.801 30.135 22.657 1.00 3.98 O ATOM 1307 CB LYS A 84 -33.766 32.484 24.113 1.00 3.73 C ATOM 1308 CG LYS A 84 -35.219 32.008 24.020 1.00 3.75 C ATOM 1309 CD LYS A 84 -35.977 32.392 25.293 1.00 3.90 C ATOM 1310 CE LYS A 84 -37.408 31.857 25.210 1.00 4.18 C ATOM 1311 NZ LYS A 84 -38.167 32.625 24.182 1.00 4.74 N ATOM 0 H LYS A 84 -34.841 33.698 22.235 1.00 3.26 H new ATOM 0 HA LYS A 84 -32.110 32.813 22.773 1.00 3.56 H new ATOM 0 HB2 LYS A 84 -33.194 31.821 24.762 1.00 3.73 H new ATOM 0 HB3 LYS A 84 -33.724 33.479 24.557 1.00 3.73 H new ATOM 0 HG2 LYS A 84 -35.702 32.454 23.151 1.00 3.75 H new ATOM 0 HG3 LYS A 84 -35.248 30.927 23.881 1.00 3.75 H new ATOM 0 HD2 LYS A 84 -35.473 31.981 26.168 1.00 3.90 H new ATOM 0 HD3 LYS A 84 -35.988 33.476 25.411 1.00 3.90 H new ATOM 0 HE2 LYS A 84 -37.397 30.798 24.953 1.00 4.18 H new ATOM 0 HE3 LYS A 84 -37.897 31.945 26.180 1.00 4.18 H new ATOM 0 HZ1 LYS A 84 -38.774 31.976 23.642 1.00 4.74 H new ATOM 0 HZ2 LYS A 84 -38.757 33.342 24.650 1.00 4.74 H new ATOM 0 HZ3 LYS A 84 -37.500 33.094 23.536 1.00 4.74 H new ATOM 1325 N LYS A 85 -33.850 31.017 20.935 1.00 3.63 N ATOM 1326 CA LYS A 85 -34.009 29.693 20.277 1.00 3.87 C ATOM 1327 C LYS A 85 -32.692 29.233 19.659 1.00 3.88 C ATOM 1328 O LYS A 85 -31.768 29.999 19.478 1.00 3.70 O ATOM 1329 CB LYS A 85 -35.056 29.801 19.172 1.00 3.94 C ATOM 1330 CG LYS A 85 -36.449 29.837 19.791 1.00 3.78 C ATOM 1331 CD LYS A 85 -36.553 31.023 20.756 1.00 3.61 C ATOM 1332 CE LYS A 85 -38.024 31.373 20.994 1.00 3.66 C ATOM 1333 NZ LYS A 85 -38.704 31.599 19.687 1.00 4.08 N ATOM 0 H LYS A 85 -34.241 31.805 20.419 1.00 3.63 H new ATOM 0 HA LYS A 85 -34.321 28.969 21.030 1.00 3.87 H new ATOM 0 HB2 LYS A 85 -34.886 30.702 18.582 1.00 3.94 H new ATOM 0 HB3 LYS A 85 -34.971 28.953 18.492 1.00 3.94 H new ATOM 0 HG2 LYS A 85 -37.203 29.924 19.009 1.00 3.78 H new ATOM 0 HG3 LYS A 85 -36.646 28.905 20.321 1.00 3.78 H new ATOM 0 HD2 LYS A 85 -36.071 30.777 21.702 1.00 3.61 H new ATOM 0 HD3 LYS A 85 -36.027 31.885 20.345 1.00 3.61 H new ATOM 0 HE2 LYS A 85 -38.517 30.566 21.537 1.00 3.66 H new ATOM 0 HE3 LYS A 85 -38.100 32.267 21.614 1.00 3.66 H new ATOM 0 HZ1 LYS A 85 -39.440 32.325 19.800 1.00 4.08 H new ATOM 0 HZ2 LYS A 85 -38.007 31.919 18.984 1.00 4.08 H new ATOM 0 HZ3 LYS A 85 -39.139 30.711 19.364 1.00 4.08 H new ATOM 1347 N ALA A 86 -32.615 27.974 19.332 1.00 4.24 N ATOM 1348 CA ALA A 86 -31.377 27.428 18.716 1.00 4.33 C ATOM 1349 C ALA A 86 -31.399 27.677 17.206 1.00 4.37 C ATOM 1350 O ALA A 86 -32.015 26.940 16.460 1.00 4.82 O ATOM 1351 CB ALA A 86 -31.296 25.923 18.981 1.00 4.90 C ATOM 0 H ALA A 86 -33.364 27.295 19.467 1.00 4.24 H new ATOM 0 HA ALA A 86 -30.509 27.923 19.152 1.00 4.33 H new ATOM 0 HB1 ALA A 86 -30.388 25.522 18.529 1.00 4.90 H new ATOM 0 HB2 ALA A 86 -31.276 25.743 20.056 1.00 4.90 H new ATOM 0 HB3 ALA A 86 -32.166 25.430 18.547 1.00 4.90 H new ATOM 1357 N VAL A 87 -30.737 28.705 16.744 1.00 4.21 N ATOM 1358 CA VAL A 87 -30.725 28.994 15.297 1.00 4.55 C ATOM 1359 C VAL A 87 -29.321 29.452 14.889 1.00 4.69 C ATOM 1360 O VAL A 87 -28.376 28.691 14.916 1.00 5.25 O ATOM 1361 CB VAL A 87 -31.735 30.103 15.013 1.00 4.76 C ATOM 1362 CG1 VAL A 87 -33.150 29.520 14.985 1.00 5.03 C ATOM 1363 CG2 VAL A 87 -31.649 31.166 16.111 1.00 5.08 C ATOM 0 H VAL A 87 -30.203 29.356 17.319 1.00 4.21 H new ATOM 0 HA VAL A 87 -30.990 28.102 14.729 1.00 4.55 H new ATOM 0 HB VAL A 87 -31.509 30.554 14.047 1.00 4.76 H new ATOM 0 HG11 VAL A 87 -33.867 30.315 14.782 1.00 5.03 H new ATOM 0 HG12 VAL A 87 -33.216 28.763 14.203 1.00 5.03 H new ATOM 0 HG13 VAL A 87 -33.375 29.066 15.950 1.00 5.03 H new ATOM 0 HG21 VAL A 87 -32.370 31.958 15.908 1.00 5.08 H new ATOM 0 HG22 VAL A 87 -31.872 30.711 17.076 1.00 5.08 H new ATOM 0 HG23 VAL A 87 -30.644 31.587 16.132 1.00 5.08 H new ATOM 1373 N SER A 88 -29.186 30.692 14.514 1.00 4.52 N ATOM 1374 CA SER A 88 -27.853 31.225 14.106 1.00 4.88 C ATOM 1375 C SER A 88 -27.186 31.912 15.310 1.00 5.14 C ATOM 1376 O SER A 88 -27.666 32.936 15.752 1.00 5.21 O ATOM 1377 CB SER A 88 -28.050 32.259 12.996 1.00 5.04 C ATOM 1378 OG SER A 88 -28.546 31.611 11.833 1.00 5.33 O ATOM 0 H SER A 88 -29.949 31.368 14.472 1.00 4.52 H new ATOM 0 HA SER A 88 -27.225 30.407 13.753 1.00 4.88 H new ATOM 0 HB2 SER A 88 -28.748 33.031 13.322 1.00 5.04 H new ATOM 0 HB3 SER A 88 -27.106 32.756 12.774 1.00 5.04 H new ATOM 0 HG SER A 88 -28.675 32.271 11.120 1.00 5.33 H new ATOM 1384 N PRO A 89 -26.101 31.361 15.814 1.00 5.66 N ATOM 1385 CA PRO A 89 -25.409 31.972 16.963 1.00 6.24 C ATOM 1386 C PRO A 89 -24.851 33.338 16.543 1.00 6.24 C ATOM 1387 O PRO A 89 -25.363 33.975 15.646 1.00 6.04 O ATOM 1388 CB PRO A 89 -24.273 30.992 17.312 1.00 6.93 C ATOM 1389 CG PRO A 89 -24.299 29.851 16.261 1.00 6.82 C ATOM 1390 CD PRO A 89 -25.485 30.115 15.311 1.00 6.07 C ATOM 0 HA PRO A 89 -26.063 32.138 17.819 1.00 6.24 H new ATOM 0 HB2 PRO A 89 -23.310 31.502 17.300 1.00 6.93 H new ATOM 0 HB3 PRO A 89 -24.408 30.591 18.316 1.00 6.93 H new ATOM 0 HG2 PRO A 89 -23.362 29.822 15.704 1.00 6.82 H new ATOM 0 HG3 PRO A 89 -24.409 28.883 16.750 1.00 6.82 H new ATOM 0 HD2 PRO A 89 -25.149 30.228 14.280 1.00 6.07 H new ATOM 0 HD3 PRO A 89 -26.195 29.288 15.326 1.00 6.07 H new ATOM 1398 N LEU A 90 -23.804 33.790 17.174 1.00 6.73 N ATOM 1399 CA LEU A 90 -23.225 35.107 16.791 1.00 7.04 C ATOM 1400 C LEU A 90 -22.273 34.904 15.610 1.00 6.74 C ATOM 1401 O LEU A 90 -22.687 34.543 14.527 1.00 6.83 O ATOM 1402 CB LEU A 90 -22.459 35.705 17.975 1.00 7.94 C ATOM 1403 CG LEU A 90 -21.582 34.625 18.631 1.00 8.13 C ATOM 1404 CD1 LEU A 90 -20.342 35.278 19.254 1.00 8.66 C ATOM 1405 CD2 LEU A 90 -22.379 33.896 19.726 1.00 8.75 C ATOM 0 H LEU A 90 -23.326 33.307 17.935 1.00 6.73 H new ATOM 0 HA LEU A 90 -24.025 35.791 16.509 1.00 7.04 H new ATOM 0 HB2 LEU A 90 -21.838 36.534 17.636 1.00 7.94 H new ATOM 0 HB3 LEU A 90 -23.160 36.110 18.705 1.00 7.94 H new ATOM 0 HG LEU A 90 -21.275 33.907 17.871 1.00 8.13 H new ATOM 0 HD11 LEU A 90 -19.722 34.511 19.718 1.00 8.66 H new ATOM 0 HD12 LEU A 90 -19.770 35.787 18.478 1.00 8.66 H new ATOM 0 HD13 LEU A 90 -20.652 36.001 20.009 1.00 8.66 H new ATOM 0 HD21 LEU A 90 -21.751 33.133 20.186 1.00 8.75 H new ATOM 0 HD22 LEU A 90 -22.694 34.612 20.485 1.00 8.75 H new ATOM 0 HD23 LEU A 90 -23.258 33.426 19.284 1.00 8.75 H new ATOM 1417 N LEU A 91 -21.002 35.125 15.805 1.00 6.73 N ATOM 1418 CA LEU A 91 -20.033 34.935 14.687 1.00 6.85 C ATOM 1419 C LEU A 91 -19.525 33.489 14.708 1.00 6.40 C ATOM 1420 O LEU A 91 -18.888 33.062 15.651 1.00 6.29 O ATOM 1421 CB LEU A 91 -18.858 35.903 14.866 1.00 7.49 C ATOM 1422 CG LEU A 91 -19.384 37.270 15.315 1.00 8.19 C ATOM 1423 CD1 LEU A 91 -18.224 38.264 15.399 1.00 8.51 C ATOM 1424 CD2 LEU A 91 -20.414 37.779 14.303 1.00 8.84 C ATOM 0 H LEU A 91 -20.592 35.428 16.688 1.00 6.73 H new ATOM 0 HA LEU A 91 -20.519 35.135 13.732 1.00 6.85 H new ATOM 0 HB2 LEU A 91 -18.159 35.510 15.605 1.00 7.49 H new ATOM 0 HB3 LEU A 91 -18.309 36.003 13.929 1.00 7.49 H new ATOM 0 HG LEU A 91 -19.851 37.172 16.295 1.00 8.19 H new ATOM 0 HD11 LEU A 91 -18.600 39.236 15.719 1.00 8.51 H new ATOM 0 HD12 LEU A 91 -17.489 37.905 16.119 1.00 8.51 H new ATOM 0 HD13 LEU A 91 -17.756 38.360 14.419 1.00 8.51 H new ATOM 0 HD21 LEU A 91 -20.788 38.752 14.623 1.00 8.84 H new ATOM 0 HD22 LEU A 91 -19.945 37.874 13.324 1.00 8.84 H new ATOM 0 HD23 LEU A 91 -21.243 37.074 14.241 1.00 8.84 H new ATOM 1436 N LEU A 92 -19.811 32.722 13.685 1.00 6.46 N ATOM 1437 CA LEU A 92 -19.348 31.301 13.673 1.00 6.35 C ATOM 1438 C LEU A 92 -17.916 31.215 13.137 1.00 6.11 C ATOM 1439 O LEU A 92 -17.437 32.103 12.460 1.00 6.21 O ATOM 1440 CB LEU A 92 -20.305 30.429 12.831 1.00 6.92 C ATOM 1441 CG LEU A 92 -20.183 30.715 11.319 1.00 7.68 C ATOM 1442 CD1 LEU A 92 -20.251 32.221 11.048 1.00 8.46 C ATOM 1443 CD2 LEU A 92 -18.868 30.143 10.759 1.00 8.01 C ATOM 0 H LEU A 92 -20.341 33.016 12.864 1.00 6.46 H new ATOM 0 HA LEU A 92 -19.354 30.921 14.695 1.00 6.35 H new ATOM 0 HB2 LEU A 92 -20.092 29.376 13.017 1.00 6.92 H new ATOM 0 HB3 LEU A 92 -21.332 30.608 13.150 1.00 6.92 H new ATOM 0 HG LEU A 92 -21.019 30.227 10.817 1.00 7.68 H new ATOM 0 HD11 LEU A 92 -20.163 32.402 9.977 1.00 8.46 H new ATOM 0 HD12 LEU A 92 -21.203 32.612 11.405 1.00 8.46 H new ATOM 0 HD13 LEU A 92 -19.435 32.722 11.569 1.00 8.46 H new ATOM 0 HD21 LEU A 92 -18.804 30.356 9.692 1.00 8.01 H new ATOM 0 HD22 LEU A 92 -18.023 30.602 11.273 1.00 8.01 H new ATOM 0 HD23 LEU A 92 -18.845 29.065 10.915 1.00 8.01 H new ATOM 1455 N THR A 93 -17.223 30.151 13.457 1.00 6.15 N ATOM 1456 CA THR A 93 -15.814 29.989 12.987 1.00 6.33 C ATOM 1457 C THR A 93 -15.657 28.645 12.272 1.00 6.29 C ATOM 1458 O THR A 93 -16.223 27.647 12.675 1.00 6.42 O ATOM 1459 CB THR A 93 -14.873 30.035 14.192 1.00 6.90 C ATOM 1460 OG1 THR A 93 -13.530 29.900 13.747 1.00 7.13 O ATOM 1461 CG2 THR A 93 -15.212 28.895 15.154 1.00 7.34 C ATOM 0 H THR A 93 -17.576 29.383 14.028 1.00 6.15 H new ATOM 0 HA THR A 93 -15.569 30.795 12.295 1.00 6.33 H new ATOM 0 HB THR A 93 -14.991 30.987 14.709 1.00 6.90 H new ATOM 0 HG1 THR A 93 -12.925 29.931 14.518 1.00 7.13 H new ATOM 0 HG21 THR A 93 -14.540 28.930 16.011 1.00 7.34 H new ATOM 0 HG22 THR A 93 -16.242 29.001 15.495 1.00 7.34 H new ATOM 0 HG23 THR A 93 -15.096 27.940 14.642 1.00 7.34 H new ATOM 1469 N THR A 94 -14.886 28.608 11.217 1.00 6.42 N ATOM 1470 CA THR A 94 -14.686 27.331 10.481 1.00 6.64 C ATOM 1471 C THR A 94 -13.403 26.663 10.978 1.00 6.71 C ATOM 1472 O THR A 94 -12.610 26.158 10.208 1.00 7.12 O ATOM 1473 CB THR A 94 -14.574 27.615 8.980 1.00 7.22 C ATOM 1474 OG1 THR A 94 -15.570 28.556 8.605 1.00 7.69 O ATOM 1475 CG2 THR A 94 -14.775 26.319 8.191 1.00 7.73 C ATOM 0 H THR A 94 -14.386 29.411 10.835 1.00 6.42 H new ATOM 0 HA THR A 94 -15.534 26.669 10.656 1.00 6.64 H new ATOM 0 HB THR A 94 -13.585 28.019 8.761 1.00 7.22 H new ATOM 0 HG1 THR A 94 -15.500 28.741 7.645 1.00 7.69 H new ATOM 0 HG21 THR A 94 -14.694 26.526 7.124 1.00 7.73 H new ATOM 0 HG22 THR A 94 -14.012 25.596 8.479 1.00 7.73 H new ATOM 0 HG23 THR A 94 -15.762 25.911 8.408 1.00 7.73 H new ATOM 1483 N THR A 95 -13.201 26.661 12.268 1.00 6.66 N ATOM 1484 CA THR A 95 -11.979 26.031 12.849 1.00 7.10 C ATOM 1485 C THR A 95 -12.372 24.732 13.556 1.00 7.36 C ATOM 1486 O THR A 95 -11.557 23.859 13.778 1.00 7.85 O ATOM 1487 CB THR A 95 -11.355 26.990 13.867 1.00 7.36 C ATOM 1488 OG1 THR A 95 -10.904 28.160 13.200 1.00 7.43 O ATOM 1489 CG2 THR A 95 -10.174 26.309 14.562 1.00 7.82 C ATOM 0 H THR A 95 -13.836 27.073 12.951 1.00 6.66 H new ATOM 0 HA THR A 95 -11.261 25.817 12.057 1.00 7.10 H new ATOM 0 HB THR A 95 -12.102 27.261 14.613 1.00 7.36 H new ATOM 0 HG1 THR A 95 -11.608 28.841 13.223 1.00 7.43 H new ATOM 0 HG21 THR A 95 -9.733 26.995 15.285 1.00 7.82 H new ATOM 0 HG22 THR A 95 -10.522 25.413 15.076 1.00 7.82 H new ATOM 0 HG23 THR A 95 -9.425 26.033 13.820 1.00 7.82 H new ATOM 1497 N ASN A 96 -13.620 24.605 13.918 1.00 7.25 N ATOM 1498 CA ASN A 96 -14.078 23.373 14.619 1.00 7.71 C ATOM 1499 C ASN A 96 -14.295 22.245 13.608 1.00 7.28 C ATOM 1500 O ASN A 96 -13.581 22.123 12.633 1.00 6.95 O ATOM 1501 CB ASN A 96 -15.396 23.666 15.339 1.00 8.41 C ATOM 1502 CG ASN A 96 -16.490 23.939 14.305 1.00 8.88 C ATOM 1503 OD1 ASN A 96 -16.153 24.296 13.095 1.00 9.17 O flip ATOM 1504 ND2 ASN A 96 -17.664 23.825 14.599 1.00 9.22 N flip ATOM 0 H ASN A 96 -14.344 25.305 13.757 1.00 7.25 H new ATOM 0 HA ASN A 96 -13.320 23.066 15.339 1.00 7.71 H new ATOM 0 HB2 ASN A 96 -15.676 22.820 15.966 1.00 8.41 H new ATOM 0 HB3 ASN A 96 -15.280 24.527 15.998 1.00 8.41 H new ATOM 0 HD21 ASN A 96 -17.928 23.546 15.544 1.00 9.22 H new ATOM 0 HD22 ASN A 96 -18.385 24.008 13.901 1.00 9.22 H new ATOM 1511 N SER A 97 -15.278 21.416 13.841 1.00 7.55 N ATOM 1512 CA SER A 97 -15.546 20.291 12.902 1.00 7.50 C ATOM 1513 C SER A 97 -14.249 19.521 12.654 1.00 7.18 C ATOM 1514 O SER A 97 -13.558 19.137 13.577 1.00 7.40 O ATOM 1515 CB SER A 97 -16.077 20.842 11.578 1.00 7.57 C ATOM 1516 OG SER A 97 -17.277 21.566 11.817 1.00 8.11 O ATOM 0 H SER A 97 -15.907 21.471 14.642 1.00 7.55 H new ATOM 0 HA SER A 97 -16.290 19.623 13.336 1.00 7.50 H new ATOM 0 HB2 SER A 97 -15.333 21.491 11.117 1.00 7.57 H new ATOM 0 HB3 SER A 97 -16.264 20.026 10.880 1.00 7.57 H new ATOM 0 HG SER A 97 -17.058 22.464 12.141 1.00 8.11 H new ATOM 1522 N SER A 98 -13.911 19.295 11.415 1.00 6.97 N ATOM 1523 CA SER A 98 -12.657 18.552 11.111 1.00 6.99 C ATOM 1524 C SER A 98 -11.500 19.161 11.903 1.00 6.52 C ATOM 1525 O SER A 98 -11.247 20.348 11.838 1.00 6.22 O ATOM 1526 CB SER A 98 -12.358 18.652 9.615 1.00 7.43 C ATOM 1527 OG SER A 98 -11.834 19.942 9.327 1.00 7.59 O ATOM 0 H SER A 98 -14.449 19.592 10.601 1.00 6.97 H new ATOM 0 HA SER A 98 -12.777 17.505 11.390 1.00 6.99 H new ATOM 0 HB2 SER A 98 -11.643 17.883 9.323 1.00 7.43 H new ATOM 0 HB3 SER A 98 -13.266 18.479 9.038 1.00 7.43 H new ATOM 0 HG SER A 98 -11.844 20.488 10.140 1.00 7.59 H new ATOM 1533 N GLU A 99 -10.790 18.359 12.648 1.00 6.76 N ATOM 1534 CA GLU A 99 -9.652 18.888 13.438 1.00 6.64 C ATOM 1535 C GLU A 99 -8.454 19.100 12.510 1.00 6.10 C ATOM 1536 O GLU A 99 -8.330 18.456 11.488 1.00 6.24 O ATOM 1537 CB GLU A 99 -9.287 17.872 14.518 1.00 7.47 C ATOM 1538 CG GLU A 99 -9.255 16.468 13.909 1.00 7.90 C ATOM 1539 CD GLU A 99 -8.476 15.528 14.830 1.00 8.78 C ATOM 1540 OE1 GLU A 99 -7.439 15.939 15.325 1.00 9.25 O ATOM 1541 OE2 GLU A 99 -8.929 14.412 15.025 1.00 9.17 O ATOM 0 H GLU A 99 -10.953 17.356 12.741 1.00 6.76 H new ATOM 0 HA GLU A 99 -9.925 19.836 13.901 1.00 6.64 H new ATOM 0 HB2 GLU A 99 -8.315 18.116 14.948 1.00 7.47 H new ATOM 0 HB3 GLU A 99 -10.014 17.911 15.330 1.00 7.47 H new ATOM 0 HG2 GLU A 99 -10.271 16.098 13.769 1.00 7.90 H new ATOM 0 HG3 GLU A 99 -8.789 16.498 12.924 1.00 7.90 H new ATOM 1548 N GLY A 100 -7.572 19.997 12.854 1.00 5.79 N ATOM 1549 CA GLY A 100 -6.387 20.241 11.985 1.00 5.46 C ATOM 1550 C GLY A 100 -5.526 18.979 11.938 1.00 5.22 C ATOM 1551 O GLY A 100 -6.029 17.879 11.821 1.00 5.32 O ATOM 0 H GLY A 100 -7.620 20.570 13.697 1.00 5.79 H new ATOM 0 HA2 GLY A 100 -6.709 20.513 10.980 1.00 5.46 H new ATOM 0 HA3 GLY A 100 -5.805 21.078 12.371 1.00 5.46 H new ATOM 1555 N LEU A 101 -4.233 19.125 12.034 1.00 5.32 N ATOM 1556 CA LEU A 101 -3.345 17.930 12.000 1.00 5.57 C ATOM 1557 C LEU A 101 -3.661 17.089 10.761 1.00 5.15 C ATOM 1558 O LEU A 101 -4.629 16.356 10.726 1.00 5.20 O ATOM 1559 CB LEU A 101 -3.577 17.094 13.261 1.00 6.30 C ATOM 1560 CG LEU A 101 -3.714 18.026 14.468 1.00 6.95 C ATOM 1561 CD1 LEU A 101 -3.804 17.196 15.749 1.00 7.72 C ATOM 1562 CD2 LEU A 101 -2.492 18.945 14.540 1.00 7.60 C ATOM 0 H LEU A 101 -3.754 20.020 12.134 1.00 5.32 H new ATOM 0 HA LEU A 101 -2.304 18.250 11.960 1.00 5.57 H new ATOM 0 HB2 LEU A 101 -4.477 16.489 13.150 1.00 6.30 H new ATOM 0 HB3 LEU A 101 -2.746 16.404 13.412 1.00 6.30 H new ATOM 0 HG LEU A 101 -4.617 18.627 14.363 1.00 6.95 H new ATOM 0 HD11 LEU A 101 -3.901 17.861 16.607 1.00 7.72 H new ATOM 0 HD12 LEU A 101 -4.673 16.540 15.697 1.00 7.72 H new ATOM 0 HD13 LEU A 101 -2.902 16.594 15.857 1.00 7.72 H new ATOM 0 HD21 LEU A 101 -2.587 19.610 15.399 1.00 7.60 H new ATOM 0 HD22 LEU A 101 -1.590 18.343 14.645 1.00 7.60 H new ATOM 0 HD23 LEU A 101 -2.428 19.538 13.627 1.00 7.60 H new ATOM 1574 N SER A 102 -2.850 17.188 9.742 1.00 5.13 N ATOM 1575 CA SER A 102 -3.108 16.393 8.509 1.00 5.09 C ATOM 1576 C SER A 102 -1.802 16.215 7.730 1.00 4.49 C ATOM 1577 O SER A 102 -1.391 17.077 6.979 1.00 4.44 O ATOM 1578 CB SER A 102 -4.130 17.122 7.637 1.00 5.80 C ATOM 1579 OG SER A 102 -5.411 17.038 8.248 1.00 6.19 O ATOM 0 H SER A 102 -2.022 17.784 9.711 1.00 5.13 H new ATOM 0 HA SER A 102 -3.500 15.414 8.784 1.00 5.09 H new ATOM 0 HB2 SER A 102 -3.841 18.166 7.513 1.00 5.80 H new ATOM 0 HB3 SER A 102 -4.159 16.678 6.642 1.00 5.80 H new ATOM 0 HG SER A 102 -5.333 16.579 9.110 1.00 6.19 H new ATOM 1585 N MET A 103 -1.152 15.097 7.903 1.00 4.46 N ATOM 1586 CA MET A 103 0.125 14.845 7.177 1.00 4.32 C ATOM 1587 C MET A 103 0.439 13.350 7.233 1.00 3.96 C ATOM 1588 O MET A 103 -0.143 12.556 6.522 1.00 4.13 O ATOM 1589 CB MET A 103 1.258 15.636 7.839 1.00 4.99 C ATOM 1590 CG MET A 103 1.052 15.657 9.354 1.00 5.59 C ATOM 1591 SD MET A 103 2.592 16.157 10.164 1.00 6.60 S ATOM 1592 CE MET A 103 2.034 15.939 11.871 1.00 7.33 C ATOM 0 H MET A 103 -1.453 14.342 8.520 1.00 4.46 H new ATOM 0 HA MET A 103 0.029 15.163 6.139 1.00 4.32 H new ATOM 0 HB2 MET A 103 2.220 15.183 7.599 1.00 4.99 H new ATOM 0 HB3 MET A 103 1.279 16.654 7.451 1.00 4.99 H new ATOM 0 HG2 MET A 103 0.251 16.349 9.613 1.00 5.59 H new ATOM 0 HG3 MET A 103 0.748 14.671 9.704 1.00 5.59 H new ATOM 0 HE1 MET A 103 2.843 16.197 12.554 1.00 7.33 H new ATOM 0 HE2 MET A 103 1.179 16.588 12.060 1.00 7.33 H new ATOM 0 HE3 MET A 103 1.743 14.900 12.029 1.00 7.33 H new ATOM 1602 N GLY A 104 1.346 12.961 8.081 1.00 3.97 N ATOM 1603 CA GLY A 104 1.684 11.514 8.192 1.00 4.08 C ATOM 1604 C GLY A 104 0.487 10.772 8.785 1.00 3.63 C ATOM 1605 O GLY A 104 0.525 10.309 9.908 1.00 3.99 O ATOM 0 H GLY A 104 1.868 13.579 8.702 1.00 3.97 H new ATOM 0 HA2 GLY A 104 1.931 11.108 7.211 1.00 4.08 H new ATOM 0 HA3 GLY A 104 2.562 11.379 8.823 1.00 4.08 H new ATOM 1609 N ASN A 105 -0.583 10.668 8.044 1.00 3.31 N ATOM 1610 CA ASN A 105 -1.788 9.969 8.572 1.00 3.42 C ATOM 1611 C ASN A 105 -2.687 9.541 7.415 1.00 3.11 C ATOM 1612 O ASN A 105 -3.451 10.326 6.890 1.00 3.34 O ATOM 1613 CB ASN A 105 -2.565 10.926 9.476 1.00 4.04 C ATOM 1614 CG ASN A 105 -3.502 10.133 10.391 1.00 4.35 C ATOM 1615 OD1 ASN A 105 -4.301 9.345 9.925 1.00 4.62 O ATOM 1616 ND2 ASN A 105 -3.439 10.310 11.683 1.00 4.78 N ATOM 0 H ASN A 105 -0.674 11.037 7.097 1.00 3.31 H new ATOM 0 HA ASN A 105 -1.477 9.089 9.135 1.00 3.42 H new ATOM 0 HB2 ASN A 105 -1.872 11.517 10.075 1.00 4.04 H new ATOM 0 HB3 ASN A 105 -3.141 11.626 8.870 1.00 4.04 H new ATOM 0 HD21 ASN A 105 -4.060 9.787 12.300 1.00 4.78 H new ATOM 0 HD22 ASN A 105 -2.769 10.971 12.075 1.00 4.78 H new ATOM 1623 N TYR A 106 -2.620 8.302 7.021 1.00 2.92 N ATOM 1624 CA TYR A 106 -3.495 7.841 5.909 1.00 2.63 C ATOM 1625 C TYR A 106 -3.346 6.328 5.704 1.00 2.41 C ATOM 1626 O TYR A 106 -4.211 5.687 5.144 1.00 2.37 O ATOM 1627 CB TYR A 106 -3.168 8.615 4.617 1.00 2.58 C ATOM 1628 CG TYR A 106 -1.797 9.248 4.702 1.00 2.66 C ATOM 1629 CD1 TYR A 106 -0.715 8.536 5.229 1.00 2.89 C ATOM 1630 CD2 TYR A 106 -1.613 10.557 4.240 1.00 2.93 C ATOM 1631 CE1 TYR A 106 0.551 9.133 5.295 1.00 2.99 C ATOM 1632 CE2 TYR A 106 -0.351 11.154 4.306 1.00 3.08 C ATOM 1633 CZ TYR A 106 0.732 10.443 4.833 1.00 2.93 C ATOM 1634 OH TYR A 106 1.978 11.033 4.893 1.00 3.12 O ATOM 0 H TYR A 106 -2.003 7.593 7.417 1.00 2.92 H new ATOM 0 HA TYR A 106 -4.534 8.043 6.169 1.00 2.63 H new ATOM 0 HB2 TYR A 106 -3.209 7.939 3.763 1.00 2.58 H new ATOM 0 HB3 TYR A 106 -3.920 9.386 4.450 1.00 2.58 H new ATOM 0 HD1 TYR A 106 -0.855 7.526 5.585 1.00 2.89 H new ATOM 0 HD2 TYR A 106 -2.448 11.107 3.832 1.00 2.93 H new ATOM 0 HE1 TYR A 106 1.387 8.583 5.702 1.00 2.99 H new ATOM 0 HE2 TYR A 106 -0.212 12.164 3.950 1.00 3.08 H new ATOM 0 HH TYR A 106 1.927 11.942 4.531 1.00 3.12 H new ATOM 1644 N ILE A 107 -2.285 5.737 6.176 1.00 2.32 N ATOM 1645 CA ILE A 107 -2.146 4.262 6.023 1.00 2.17 C ATOM 1646 C ILE A 107 -3.381 3.598 6.655 1.00 2.36 C ATOM 1647 O ILE A 107 -3.780 2.502 6.297 1.00 2.30 O ATOM 1648 CB ILE A 107 -0.884 3.792 6.760 1.00 2.18 C ATOM 1649 CG1 ILE A 107 0.358 4.520 6.221 1.00 1.93 C ATOM 1650 CG2 ILE A 107 -0.711 2.280 6.599 1.00 2.51 C ATOM 1651 CD1 ILE A 107 0.796 3.936 4.871 1.00 1.75 C ATOM 0 H ILE A 107 -1.516 6.204 6.656 1.00 2.32 H new ATOM 0 HA ILE A 107 -2.067 3.994 4.969 1.00 2.17 H new ATOM 0 HB ILE A 107 -0.996 4.028 7.818 1.00 2.18 H new ATOM 0 HG12 ILE A 107 0.141 5.582 6.108 1.00 1.93 H new ATOM 0 HG13 ILE A 107 1.173 4.436 6.939 1.00 1.93 H new ATOM 0 HG21 ILE A 107 0.187 1.958 7.126 1.00 2.51 H new ATOM 0 HG22 ILE A 107 -1.579 1.768 7.015 1.00 2.51 H new ATOM 0 HG23 ILE A 107 -0.618 2.035 5.541 1.00 2.51 H new ATOM 0 HD11 ILE A 107 1.676 4.469 4.512 1.00 1.75 H new ATOM 0 HD12 ILE A 107 1.036 2.880 4.992 1.00 1.75 H new ATOM 0 HD13 ILE A 107 -0.013 4.044 4.148 1.00 1.75 H new ATOM 1663 N GLY A 108 -3.978 4.263 7.612 1.00 2.64 N ATOM 1664 CA GLY A 108 -5.169 3.692 8.308 1.00 2.89 C ATOM 1665 C GLY A 108 -6.448 3.859 7.476 1.00 2.87 C ATOM 1666 O GLY A 108 -7.306 3.000 7.490 1.00 2.92 O ATOM 0 H GLY A 108 -3.688 5.183 7.942 1.00 2.64 H new ATOM 0 HA2 GLY A 108 -5.001 2.634 8.508 1.00 2.89 H new ATOM 0 HA3 GLY A 108 -5.296 4.183 9.273 1.00 2.89 H new ATOM 1670 N LEU A 109 -6.609 4.949 6.769 1.00 2.85 N ATOM 1671 CA LEU A 109 -7.857 5.120 5.976 1.00 2.88 C ATOM 1672 C LEU A 109 -7.883 4.081 4.866 1.00 2.64 C ATOM 1673 O LEU A 109 -8.915 3.790 4.297 1.00 2.69 O ATOM 1674 CB LEU A 109 -7.922 6.536 5.389 1.00 2.97 C ATOM 1675 CG LEU A 109 -7.112 6.627 4.085 1.00 2.80 C ATOM 1676 CD1 LEU A 109 -7.921 6.057 2.904 1.00 2.59 C ATOM 1677 CD2 LEU A 109 -6.780 8.095 3.806 1.00 3.00 C ATOM 0 H LEU A 109 -5.939 5.716 6.708 1.00 2.85 H new ATOM 0 HA LEU A 109 -8.724 4.981 6.622 1.00 2.88 H new ATOM 0 HB2 LEU A 109 -8.960 6.807 5.197 1.00 2.97 H new ATOM 0 HB3 LEU A 109 -7.534 7.252 6.113 1.00 2.97 H new ATOM 0 HG LEU A 109 -6.196 6.046 4.196 1.00 2.80 H new ATOM 0 HD11 LEU A 109 -7.331 6.130 1.990 1.00 2.59 H new ATOM 0 HD12 LEU A 109 -8.161 5.012 3.098 1.00 2.59 H new ATOM 0 HD13 LEU A 109 -8.844 6.625 2.787 1.00 2.59 H new ATOM 0 HD21 LEU A 109 -6.205 8.169 2.883 1.00 3.00 H new ATOM 0 HD22 LEU A 109 -7.704 8.664 3.705 1.00 3.00 H new ATOM 0 HD23 LEU A 109 -6.194 8.499 4.631 1.00 3.00 H new ATOM 1689 N ILE A 110 -6.761 3.505 4.562 1.00 2.40 N ATOM 1690 CA ILE A 110 -6.740 2.473 3.510 1.00 2.21 C ATOM 1691 C ILE A 110 -7.531 1.282 4.035 1.00 2.35 C ATOM 1692 O ILE A 110 -8.241 0.610 3.315 1.00 2.36 O ATOM 1693 CB ILE A 110 -5.278 2.116 3.203 1.00 1.99 C ATOM 1694 CG1 ILE A 110 -5.147 1.733 1.733 1.00 1.86 C ATOM 1695 CG2 ILE A 110 -4.804 0.953 4.079 1.00 1.96 C ATOM 1696 CD1 ILE A 110 -3.765 1.120 1.471 1.00 1.65 C ATOM 0 H ILE A 110 -5.861 3.706 4.998 1.00 2.40 H new ATOM 0 HA ILE A 110 -7.193 2.814 2.579 1.00 2.21 H new ATOM 0 HB ILE A 110 -4.657 2.985 3.418 1.00 1.99 H new ATOM 0 HG12 ILE A 110 -5.927 1.021 1.464 1.00 1.86 H new ATOM 0 HG13 ILE A 110 -5.288 2.613 1.106 1.00 1.86 H new ATOM 0 HG21 ILE A 110 -3.766 0.719 3.843 1.00 1.96 H new ATOM 0 HG22 ILE A 110 -4.883 1.233 5.129 1.00 1.96 H new ATOM 0 HG23 ILE A 110 -5.425 0.078 3.889 1.00 1.96 H new ATOM 0 HD11 ILE A 110 -3.681 0.849 0.418 1.00 1.65 H new ATOM 0 HD12 ILE A 110 -2.992 1.846 1.722 1.00 1.65 H new ATOM 0 HD13 ILE A 110 -3.640 0.229 2.086 1.00 1.65 H new ATOM 1708 N ASN A 111 -7.443 1.061 5.307 1.00 2.50 N ATOM 1709 CA ASN A 111 -8.222 -0.034 5.936 1.00 2.70 C ATOM 1710 C ASN A 111 -9.705 0.344 5.899 1.00 2.92 C ATOM 1711 O ASN A 111 -10.577 -0.488 6.052 1.00 3.07 O ATOM 1712 CB ASN A 111 -7.778 -0.208 7.394 1.00 2.85 C ATOM 1713 CG ASN A 111 -8.166 -1.600 7.902 1.00 3.01 C ATOM 1714 OD1 ASN A 111 -9.065 -2.225 7.375 1.00 3.17 O ATOM 1715 ND2 ASN A 111 -7.520 -2.113 8.915 1.00 3.37 N ATOM 0 H ASN A 111 -6.858 1.597 5.948 1.00 2.50 H new ATOM 0 HA ASN A 111 -8.057 -0.967 5.398 1.00 2.70 H new ATOM 0 HB2 ASN A 111 -6.699 -0.072 7.472 1.00 2.85 H new ATOM 0 HB3 ASN A 111 -8.242 0.557 8.017 1.00 2.85 H new ATOM 0 HD21 ASN A 111 -7.770 -3.038 9.264 1.00 3.37 H new ATOM 0 HD22 ASN A 111 -6.765 -1.588 9.357 1.00 3.37 H new ATOM 1722 N ARG A 112 -9.990 1.607 5.708 1.00 2.96 N ATOM 1723 CA ARG A 112 -11.400 2.066 5.673 1.00 3.19 C ATOM 1724 C ARG A 112 -12.029 1.682 4.343 1.00 3.11 C ATOM 1725 O ARG A 112 -13.066 1.053 4.287 1.00 3.24 O ATOM 1726 CB ARG A 112 -11.431 3.584 5.834 1.00 3.30 C ATOM 1727 CG ARG A 112 -12.812 4.022 6.312 1.00 3.58 C ATOM 1728 CD ARG A 112 -12.938 5.542 6.183 1.00 3.80 C ATOM 1729 NE ARG A 112 -13.144 5.901 4.752 1.00 4.16 N ATOM 1730 CZ ARG A 112 -13.546 7.100 4.431 1.00 4.64 C ATOM 1731 NH1 ARG A 112 -13.758 7.987 5.364 1.00 4.99 N ATOM 1732 NH2 ARG A 112 -13.730 7.413 3.178 1.00 4.98 N ATOM 0 H ARG A 112 -9.296 2.342 5.574 1.00 2.96 H new ATOM 0 HA ARG A 112 -11.960 1.597 6.482 1.00 3.19 H new ATOM 0 HB2 ARG A 112 -10.671 3.899 6.549 1.00 3.30 H new ATOM 0 HB3 ARG A 112 -11.195 4.065 4.885 1.00 3.30 H new ATOM 0 HG2 ARG A 112 -13.586 3.531 5.722 1.00 3.58 H new ATOM 0 HG3 ARG A 112 -12.962 3.721 7.349 1.00 3.58 H new ATOM 0 HD2 ARG A 112 -13.774 5.901 6.784 1.00 3.80 H new ATOM 0 HD3 ARG A 112 -12.039 6.026 6.565 1.00 3.80 H new ATOM 0 HE ARG A 112 -12.971 5.209 4.023 1.00 4.16 H new ATOM 0 HH11 ARG A 112 -13.609 7.743 6.343 1.00 4.99 H new ATOM 0 HH12 ARG A 112 -14.072 8.925 5.114 1.00 4.99 H new ATOM 0 HH21 ARG A 112 -13.560 6.720 2.449 1.00 4.98 H new ATOM 0 HH22 ARG A 112 -14.044 8.350 2.927 1.00 4.98 H new ATOM 1746 N ILE A 113 -11.401 2.047 3.265 1.00 2.92 N ATOM 1747 CA ILE A 113 -11.962 1.687 1.942 1.00 2.88 C ATOM 1748 C ILE A 113 -11.966 0.167 1.854 1.00 2.82 C ATOM 1749 O ILE A 113 -12.766 -0.435 1.168 1.00 2.89 O ATOM 1750 CB ILE A 113 -11.100 2.290 0.821 1.00 2.70 C ATOM 1751 CG1 ILE A 113 -9.777 2.808 1.401 1.00 2.57 C ATOM 1752 CG2 ILE A 113 -11.850 3.451 0.161 1.00 2.98 C ATOM 1753 CD1 ILE A 113 -8.892 3.371 0.282 1.00 2.77 C ATOM 0 H ILE A 113 -10.529 2.576 3.244 1.00 2.92 H new ATOM 0 HA ILE A 113 -12.973 2.079 1.828 1.00 2.88 H new ATOM 0 HB ILE A 113 -10.893 1.519 0.079 1.00 2.70 H new ATOM 0 HG12 ILE A 113 -9.975 3.582 2.142 1.00 2.57 H new ATOM 0 HG13 ILE A 113 -9.256 2.000 1.915 1.00 2.57 H new ATOM 0 HG21 ILE A 113 -11.236 3.876 -0.633 1.00 2.98 H new ATOM 0 HG22 ILE A 113 -12.787 3.086 -0.260 1.00 2.98 H new ATOM 0 HG23 ILE A 113 -12.062 4.218 0.906 1.00 2.98 H new ATOM 0 HD11 ILE A 113 -7.956 3.735 0.706 1.00 2.77 H new ATOM 0 HD12 ILE A 113 -8.680 2.586 -0.444 1.00 2.77 H new ATOM 0 HD13 ILE A 113 -9.410 4.192 -0.213 1.00 2.77 H new ATOM 1765 N ALA A 114 -11.084 -0.449 2.580 1.00 2.73 N ATOM 1766 CA ALA A 114 -11.021 -1.930 2.595 1.00 2.73 C ATOM 1767 C ALA A 114 -12.354 -2.473 3.102 1.00 2.99 C ATOM 1768 O ALA A 114 -13.097 -3.113 2.385 1.00 3.02 O ATOM 1769 CB ALA A 114 -9.897 -2.377 3.531 1.00 2.68 C ATOM 0 H ALA A 114 -10.395 0.016 3.171 1.00 2.73 H new ATOM 0 HA ALA A 114 -10.826 -2.307 1.591 1.00 2.73 H new ATOM 0 HB1 ALA A 114 -9.847 -3.466 3.545 1.00 2.68 H new ATOM 0 HB2 ALA A 114 -8.948 -1.975 3.178 1.00 2.68 H new ATOM 0 HB3 ALA A 114 -10.094 -2.010 4.538 1.00 2.68 H new ATOM 1775 N GLN A 115 -12.653 -2.217 4.344 1.00 3.20 N ATOM 1776 CA GLN A 115 -13.929 -2.707 4.926 1.00 3.48 C ATOM 1777 C GLN A 115 -15.104 -2.012 4.238 1.00 3.57 C ATOM 1778 O GLN A 115 -16.236 -2.436 4.351 1.00 3.76 O ATOM 1779 CB GLN A 115 -13.963 -2.434 6.437 1.00 3.71 C ATOM 1780 CG GLN A 115 -13.961 -0.925 6.703 1.00 3.73 C ATOM 1781 CD GLN A 115 -15.385 -0.375 6.582 1.00 4.00 C ATOM 1782 OE1 GLN A 115 -16.341 -1.065 6.875 1.00 4.25 O ATOM 1783 NE2 GLN A 115 -15.566 0.845 6.159 1.00 4.33 N ATOM 0 H GLN A 115 -12.063 -1.685 4.984 1.00 3.20 H new ATOM 0 HA GLN A 115 -14.005 -3.783 4.767 1.00 3.48 H new ATOM 0 HB2 GLN A 115 -14.852 -2.887 6.876 1.00 3.71 H new ATOM 0 HB3 GLN A 115 -13.100 -2.896 6.917 1.00 3.71 H new ATOM 0 HG2 GLN A 115 -13.567 -0.723 7.699 1.00 3.73 H new ATOM 0 HG3 GLN A 115 -13.305 -0.422 5.992 1.00 3.73 H new ATOM 0 HE21 GLN A 115 -14.763 1.424 5.913 1.00 4.33 H new ATOM 0 HE22 GLN A 115 -16.511 1.220 6.074 1.00 4.33 H new ATOM 1792 N LYS A 116 -14.848 -0.959 3.506 1.00 3.47 N ATOM 1793 CA LYS A 116 -15.962 -0.272 2.797 1.00 3.61 C ATOM 1794 C LYS A 116 -16.443 -1.188 1.683 1.00 3.57 C ATOM 1795 O LYS A 116 -17.506 -1.774 1.749 1.00 3.74 O ATOM 1796 CB LYS A 116 -15.463 1.040 2.190 1.00 3.53 C ATOM 1797 CG LYS A 116 -16.645 1.842 1.633 1.00 3.67 C ATOM 1798 CD LYS A 116 -17.243 2.708 2.742 1.00 4.07 C ATOM 1799 CE LYS A 116 -18.581 3.288 2.277 1.00 4.16 C ATOM 1800 NZ LYS A 116 -19.643 2.251 2.399 1.00 4.45 N ATOM 0 H LYS A 116 -13.924 -0.550 3.371 1.00 3.47 H new ATOM 0 HA LYS A 116 -16.771 -0.052 3.494 1.00 3.61 H new ATOM 0 HB2 LYS A 116 -14.940 1.625 2.947 1.00 3.53 H new ATOM 0 HB3 LYS A 116 -14.746 0.833 1.395 1.00 3.53 H new ATOM 0 HG2 LYS A 116 -16.314 2.470 0.806 1.00 3.67 H new ATOM 0 HG3 LYS A 116 -17.403 1.166 1.237 1.00 3.67 H new ATOM 0 HD2 LYS A 116 -17.387 2.113 3.644 1.00 4.07 H new ATOM 0 HD3 LYS A 116 -16.555 3.514 2.998 1.00 4.07 H new ATOM 0 HE2 LYS A 116 -18.839 4.160 2.877 1.00 4.16 H new ATOM 0 HE3 LYS A 116 -18.504 3.624 1.243 1.00 4.16 H new ATOM 0 HZ1 LYS A 116 -20.574 2.688 2.247 1.00 4.45 H new ATOM 0 HZ2 LYS A 116 -19.488 1.510 1.686 1.00 4.45 H new ATOM 0 HZ3 LYS A 116 -19.609 1.830 3.349 1.00 4.45 H new ATOM 1814 N LYS A 117 -15.643 -1.336 0.671 1.00 3.38 N ATOM 1815 CA LYS A 117 -16.001 -2.226 -0.444 1.00 3.38 C ATOM 1816 C LYS A 117 -15.401 -3.599 -0.140 1.00 3.32 C ATOM 1817 O LYS A 117 -14.877 -4.284 -0.996 1.00 3.22 O ATOM 1818 CB LYS A 117 -15.448 -1.650 -1.742 1.00 3.24 C ATOM 1819 CG LYS A 117 -13.980 -1.277 -1.568 1.00 3.05 C ATOM 1820 CD LYS A 117 -13.433 -0.731 -2.893 1.00 2.99 C ATOM 1821 CE LYS A 117 -13.567 -1.790 -3.998 1.00 3.31 C ATOM 1822 NZ LYS A 117 -14.867 -1.613 -4.706 1.00 3.69 N ATOM 0 H LYS A 117 -14.742 -0.867 0.574 1.00 3.38 H new ATOM 0 HA LYS A 117 -17.081 -2.318 -0.558 1.00 3.38 H new ATOM 0 HB2 LYS A 117 -15.553 -2.379 -2.546 1.00 3.24 H new ATOM 0 HB3 LYS A 117 -16.023 -0.770 -2.032 1.00 3.24 H new ATOM 0 HG2 LYS A 117 -13.874 -0.529 -0.782 1.00 3.05 H new ATOM 0 HG3 LYS A 117 -13.406 -2.150 -1.257 1.00 3.05 H new ATOM 0 HD2 LYS A 117 -13.976 0.171 -3.175 1.00 2.99 H new ATOM 0 HD3 LYS A 117 -12.387 -0.449 -2.774 1.00 2.99 H new ATOM 0 HE2 LYS A 117 -12.742 -1.700 -4.704 1.00 3.31 H new ATOM 0 HE3 LYS A 117 -13.509 -2.789 -3.567 1.00 3.31 H new ATOM 0 HZ1 LYS A 117 -15.413 -2.496 -4.654 1.00 3.69 H new ATOM 0 HZ2 LYS A 117 -15.406 -0.846 -4.256 1.00 3.69 H new ATOM 0 HZ3 LYS A 117 -14.690 -1.373 -5.702 1.00 3.69 H new ATOM 1836 N ARG A 118 -15.481 -3.965 1.109 1.00 3.44 N ATOM 1837 CA ARG A 118 -14.949 -5.267 1.614 1.00 3.46 C ATOM 1838 C ARG A 118 -13.715 -5.745 0.835 1.00 3.25 C ATOM 1839 O ARG A 118 -13.817 -6.322 -0.229 1.00 3.26 O ATOM 1840 CB ARG A 118 -16.046 -6.347 1.573 1.00 3.71 C ATOM 1841 CG ARG A 118 -16.796 -6.322 0.232 1.00 3.73 C ATOM 1842 CD ARG A 118 -17.960 -5.320 0.291 1.00 3.83 C ATOM 1843 NE ARG A 118 -19.220 -6.041 0.639 1.00 4.34 N ATOM 1844 CZ ARG A 118 -20.278 -5.368 1.010 1.00 4.73 C ATOM 1845 NH1 ARG A 118 -20.236 -4.065 1.066 1.00 4.83 N ATOM 1846 NH2 ARG A 118 -21.379 -5.997 1.321 1.00 5.37 N ATOM 0 H ARG A 118 -15.912 -3.390 1.833 1.00 3.44 H new ATOM 0 HA ARG A 118 -14.636 -5.100 2.645 1.00 3.46 H new ATOM 0 HB2 ARG A 118 -15.599 -7.330 1.725 1.00 3.71 H new ATOM 0 HB3 ARG A 118 -16.750 -6.187 2.390 1.00 3.71 H new ATOM 0 HG2 ARG A 118 -16.111 -6.048 -0.570 1.00 3.73 H new ATOM 0 HG3 ARG A 118 -17.175 -7.317 0.001 1.00 3.73 H new ATOM 0 HD2 ARG A 118 -17.753 -4.549 1.033 1.00 3.83 H new ATOM 0 HD3 ARG A 118 -18.070 -4.817 -0.670 1.00 3.83 H new ATOM 0 HE ARG A 118 -19.256 -7.059 0.587 1.00 4.34 H new ATOM 0 HH11 ARG A 118 -19.378 -3.571 0.820 1.00 4.83 H new ATOM 0 HH12 ARG A 118 -21.061 -3.540 1.355 1.00 4.83 H new ATOM 0 HH21 ARG A 118 -21.415 -7.015 1.275 1.00 5.37 H new ATOM 0 HH22 ARG A 118 -22.203 -5.470 1.610 1.00 5.37 H new ATOM 1860 N LEU A 119 -12.549 -5.549 1.409 1.00 3.11 N ATOM 1861 CA LEU A 119 -11.273 -6.028 0.778 1.00 2.94 C ATOM 1862 C LEU A 119 -10.270 -6.325 1.893 1.00 2.91 C ATOM 1863 O LEU A 119 -10.534 -6.102 3.058 1.00 3.02 O ATOM 1864 CB LEU A 119 -10.616 -4.970 -0.123 1.00 2.80 C ATOM 1865 CG LEU A 119 -11.621 -4.312 -1.068 1.00 2.79 C ATOM 1866 CD1 LEU A 119 -11.011 -3.015 -1.613 1.00 2.70 C ATOM 1867 CD2 LEU A 119 -11.916 -5.258 -2.234 1.00 2.87 C ATOM 0 H LEU A 119 -12.425 -5.070 2.301 1.00 3.11 H new ATOM 0 HA LEU A 119 -11.524 -6.900 0.174 1.00 2.94 H new ATOM 0 HB2 LEU A 119 -10.149 -4.205 0.498 1.00 2.80 H new ATOM 0 HB3 LEU A 119 -9.822 -5.435 -0.707 1.00 2.80 H new ATOM 0 HG LEU A 119 -12.545 -4.095 -0.533 1.00 2.79 H new ATOM 0 HD11 LEU A 119 -11.719 -2.536 -2.289 1.00 2.70 H new ATOM 0 HD12 LEU A 119 -10.788 -2.342 -0.785 1.00 2.70 H new ATOM 0 HD13 LEU A 119 -10.092 -3.244 -2.153 1.00 2.70 H new ATOM 0 HD21 LEU A 119 -12.633 -4.791 -2.909 1.00 2.87 H new ATOM 0 HD22 LEU A 119 -10.993 -5.469 -2.774 1.00 2.87 H new ATOM 0 HD23 LEU A 119 -12.333 -6.189 -1.850 1.00 2.87 H new ATOM 1879 N THR A 120 -9.103 -6.787 1.533 1.00 2.82 N ATOM 1880 CA THR A 120 -8.048 -7.062 2.553 1.00 2.82 C ATOM 1881 C THR A 120 -6.990 -5.966 2.452 1.00 2.56 C ATOM 1882 O THR A 120 -6.848 -5.326 1.428 1.00 2.47 O ATOM 1883 CB THR A 120 -7.398 -8.429 2.306 1.00 2.96 C ATOM 1884 OG1 THR A 120 -6.146 -8.479 2.977 1.00 3.07 O ATOM 1885 CG2 THR A 120 -7.177 -8.642 0.811 1.00 3.29 C ATOM 0 H THR A 120 -8.833 -6.987 0.570 1.00 2.82 H new ATOM 0 HA THR A 120 -8.496 -7.074 3.547 1.00 2.82 H new ATOM 0 HB THR A 120 -8.055 -9.212 2.684 1.00 2.96 H new ATOM 0 HG1 THR A 120 -5.727 -9.352 2.824 1.00 3.07 H new ATOM 0 HG21 THR A 120 -6.715 -9.615 0.647 1.00 3.29 H new ATOM 0 HG22 THR A 120 -8.135 -8.603 0.292 1.00 3.29 H new ATOM 0 HG23 THR A 120 -6.523 -7.860 0.425 1.00 3.29 H new ATOM 1893 N VAL A 121 -6.254 -5.733 3.500 1.00 2.53 N ATOM 1894 CA VAL A 121 -5.214 -4.666 3.458 1.00 2.33 C ATOM 1895 C VAL A 121 -3.948 -5.166 4.164 1.00 2.28 C ATOM 1896 O VAL A 121 -3.959 -5.428 5.350 1.00 2.47 O ATOM 1897 CB VAL A 121 -5.774 -3.419 4.166 1.00 2.54 C ATOM 1898 CG1 VAL A 121 -4.662 -2.665 4.901 1.00 3.27 C ATOM 1899 CG2 VAL A 121 -6.414 -2.489 3.130 1.00 2.33 C ATOM 0 H VAL A 121 -6.326 -6.235 4.385 1.00 2.53 H new ATOM 0 HA VAL A 121 -4.958 -4.414 2.429 1.00 2.33 H new ATOM 0 HB VAL A 121 -6.519 -3.740 4.894 1.00 2.54 H new ATOM 0 HG11 VAL A 121 -5.081 -1.788 5.394 1.00 3.27 H new ATOM 0 HG12 VAL A 121 -4.211 -3.319 5.647 1.00 3.27 H new ATOM 0 HG13 VAL A 121 -3.901 -2.351 4.186 1.00 3.27 H new ATOM 0 HG21 VAL A 121 -6.811 -1.606 3.630 1.00 2.33 H new ATOM 0 HG22 VAL A 121 -5.663 -2.186 2.400 1.00 2.33 H new ATOM 0 HG23 VAL A 121 -7.224 -3.013 2.622 1.00 2.33 H new ATOM 1909 N ASN A 122 -2.855 -5.305 3.454 1.00 2.11 N ATOM 1910 CA ASN A 122 -1.605 -5.791 4.125 1.00 2.16 C ATOM 1911 C ASN A 122 -0.385 -5.073 3.549 1.00 1.94 C ATOM 1912 O ASN A 122 -0.309 -4.806 2.366 1.00 1.79 O ATOM 1913 CB ASN A 122 -1.470 -7.298 3.916 1.00 2.38 C ATOM 1914 CG ASN A 122 -0.086 -7.765 4.375 1.00 2.53 C ATOM 1915 OD1 ASN A 122 0.260 -7.632 5.532 1.00 2.63 O ATOM 1916 ND2 ASN A 122 0.724 -8.316 3.512 1.00 3.03 N ATOM 0 H ASN A 122 -2.772 -5.108 2.457 1.00 2.11 H new ATOM 0 HA ASN A 122 -1.664 -5.577 5.192 1.00 2.16 H new ATOM 0 HB2 ASN A 122 -2.245 -7.822 4.475 1.00 2.38 H new ATOM 0 HB3 ASN A 122 -1.616 -7.543 2.864 1.00 2.38 H new ATOM 0 HD21 ASN A 122 1.646 -8.634 3.809 1.00 3.03 H new ATOM 0 HD22 ASN A 122 0.435 -8.428 2.540 1.00 3.03 H new ATOM 1923 N TYR A 123 0.567 -4.747 4.387 1.00 2.02 N ATOM 1924 CA TYR A 123 1.781 -4.025 3.904 1.00 1.88 C ATOM 1925 C TYR A 123 3.058 -4.835 4.150 1.00 2.04 C ATOM 1926 O TYR A 123 3.292 -5.338 5.232 1.00 2.32 O ATOM 1927 CB TYR A 123 1.916 -2.696 4.649 1.00 1.96 C ATOM 1928 CG TYR A 123 0.560 -2.113 4.930 1.00 1.91 C ATOM 1929 CD1 TYR A 123 -0.237 -2.693 5.907 1.00 2.06 C ATOM 1930 CD2 TYR A 123 0.113 -0.986 4.233 1.00 2.23 C ATOM 1931 CE1 TYR A 123 -1.494 -2.153 6.201 1.00 2.11 C ATOM 1932 CE2 TYR A 123 -1.144 -0.443 4.518 1.00 2.48 C ATOM 1933 CZ TYR A 123 -1.949 -1.027 5.505 1.00 2.24 C ATOM 1934 OH TYR A 123 -3.185 -0.490 5.797 1.00 2.55 O ATOM 0 H TYR A 123 0.555 -4.951 5.386 1.00 2.02 H new ATOM 0 HA TYR A 123 1.661 -3.867 2.832 1.00 1.88 H new ATOM 0 HB2 TYR A 123 2.454 -2.849 5.585 1.00 1.96 H new ATOM 0 HB3 TYR A 123 2.504 -1.996 4.054 1.00 1.96 H new ATOM 0 HD1 TYR A 123 0.114 -3.563 6.442 1.00 2.06 H new ATOM 0 HD2 TYR A 123 0.738 -0.536 3.476 1.00 2.23 H new ATOM 0 HE1 TYR A 123 -2.112 -2.604 6.963 1.00 2.11 H new ATOM 0 HE2 TYR A 123 -1.493 0.425 3.978 1.00 2.48 H new ATOM 0 HH TYR A 123 -3.083 0.455 6.036 1.00 2.55 H new ATOM 1944 N GLU A 124 3.908 -4.907 3.159 1.00 1.95 N ATOM 1945 CA GLU A 124 5.209 -5.615 3.317 1.00 2.18 C ATOM 1946 C GLU A 124 6.310 -4.573 3.094 1.00 2.09 C ATOM 1947 O GLU A 124 6.031 -3.391 2.999 1.00 1.94 O ATOM 1948 CB GLU A 124 5.315 -6.739 2.285 1.00 2.36 C ATOM 1949 CG GLU A 124 6.242 -7.842 2.804 1.00 2.78 C ATOM 1950 CD GLU A 124 6.082 -9.092 1.937 1.00 3.17 C ATOM 1951 OE1 GLU A 124 5.076 -9.767 2.085 1.00 3.62 O ATOM 1952 OE2 GLU A 124 6.967 -9.351 1.138 1.00 3.41 O ATOM 0 H GLU A 124 3.752 -4.500 2.237 1.00 1.95 H new ATOM 0 HA GLU A 124 5.300 -6.064 4.306 1.00 2.18 H new ATOM 0 HB2 GLU A 124 4.326 -7.150 2.080 1.00 2.36 H new ATOM 0 HB3 GLU A 124 5.697 -6.344 1.344 1.00 2.36 H new ATOM 0 HG2 GLU A 124 7.277 -7.502 2.783 1.00 2.78 H new ATOM 0 HG3 GLU A 124 6.004 -8.073 3.842 1.00 2.78 H new ATOM 1959 N GLN A 125 7.551 -4.960 3.005 1.00 2.27 N ATOM 1960 CA GLN A 125 8.595 -3.907 2.808 1.00 2.22 C ATOM 1961 C GLN A 125 9.964 -4.495 2.444 1.00 2.48 C ATOM 1962 O GLN A 125 10.475 -5.386 3.095 1.00 2.84 O ATOM 1963 CB GLN A 125 8.729 -3.101 4.102 1.00 2.35 C ATOM 1964 CG GLN A 125 8.700 -4.047 5.307 1.00 2.56 C ATOM 1965 CD GLN A 125 9.256 -3.326 6.538 1.00 2.87 C ATOM 1966 OE1 GLN A 125 9.899 -2.302 6.417 1.00 3.05 O ATOM 1967 NE2 GLN A 125 9.033 -3.817 7.727 1.00 3.41 N ATOM 0 H GLN A 125 7.884 -5.923 3.057 1.00 2.27 H new ATOM 0 HA GLN A 125 8.278 -3.277 1.977 1.00 2.22 H new ATOM 0 HB2 GLN A 125 9.661 -2.535 4.094 1.00 2.35 H new ATOM 0 HB3 GLN A 125 7.917 -2.377 4.176 1.00 2.35 H new ATOM 0 HG2 GLN A 125 7.679 -4.379 5.497 1.00 2.56 H new ATOM 0 HG3 GLN A 125 9.291 -4.938 5.097 1.00 2.56 H new ATOM 0 HE21 GLN A 125 8.494 -4.676 7.831 1.00 3.41 H new ATOM 0 HE22 GLN A 125 9.398 -3.341 8.552 1.00 3.41 H new ATOM 1976 N CYS A 126 10.563 -3.960 1.404 1.00 2.42 N ATOM 1977 CA CYS A 126 11.914 -4.423 0.963 1.00 2.74 C ATOM 1978 C CYS A 126 12.854 -3.211 0.893 1.00 2.69 C ATOM 1979 O CYS A 126 12.499 -2.113 1.280 1.00 2.83 O ATOM 1980 CB CYS A 126 11.813 -5.060 -0.423 1.00 2.93 C ATOM 1981 SG CYS A 126 10.815 -6.565 -0.325 1.00 3.58 S ATOM 0 H CYS A 126 10.165 -3.212 0.836 1.00 2.42 H new ATOM 0 HA CYS A 126 12.299 -5.158 1.670 1.00 2.74 H new ATOM 0 HB2 CYS A 126 11.363 -4.358 -1.125 1.00 2.93 H new ATOM 0 HB3 CYS A 126 12.808 -5.295 -0.800 1.00 2.93 H new ATOM 0 HG CYS A 126 10.728 -7.105 -1.504 1.00 3.58 H new ATOM 1987 N ALA A 127 14.048 -3.386 0.398 1.00 2.81 N ATOM 1988 CA ALA A 127 14.983 -2.227 0.323 1.00 2.83 C ATOM 1989 C ALA A 127 16.128 -2.530 -0.644 1.00 2.98 C ATOM 1990 O ALA A 127 16.847 -3.498 -0.487 1.00 3.17 O ATOM 1991 CB ALA A 127 15.562 -1.953 1.713 1.00 3.11 C ATOM 0 H ALA A 127 14.414 -4.270 0.046 1.00 2.81 H new ATOM 0 HA ALA A 127 14.435 -1.355 -0.034 1.00 2.83 H new ATOM 0 HB1 ALA A 127 16.246 -1.106 1.662 1.00 3.11 H new ATOM 0 HB2 ALA A 127 14.752 -1.724 2.406 1.00 3.11 H new ATOM 0 HB3 ALA A 127 16.101 -2.834 2.063 1.00 3.11 H new ATOM 1997 N SER A 128 16.308 -1.701 -1.641 1.00 3.01 N ATOM 1998 CA SER A 128 17.411 -1.929 -2.616 1.00 3.26 C ATOM 1999 C SER A 128 18.593 -1.031 -2.248 1.00 3.31 C ATOM 2000 O SER A 128 18.822 -0.002 -2.859 1.00 3.21 O ATOM 2001 CB SER A 128 16.925 -1.589 -4.025 1.00 3.38 C ATOM 2002 OG SER A 128 15.613 -2.108 -4.205 1.00 3.55 O ATOM 0 H SER A 128 15.736 -0.875 -1.820 1.00 3.01 H new ATOM 0 HA SER A 128 17.721 -2.974 -2.587 1.00 3.26 H new ATOM 0 HB2 SER A 128 16.925 -0.509 -4.172 1.00 3.38 H new ATOM 0 HB3 SER A 128 17.601 -2.012 -4.768 1.00 3.38 H new ATOM 0 HG SER A 128 15.296 -1.891 -5.107 1.00 3.55 H new ATOM 2008 N GLY A 129 19.342 -1.412 -1.245 1.00 3.58 N ATOM 2009 CA GLY A 129 20.511 -0.589 -0.821 1.00 3.75 C ATOM 2010 C GLY A 129 21.799 -1.215 -1.357 1.00 3.95 C ATOM 2011 O GLY A 129 22.802 -1.273 -0.676 1.00 4.16 O ATOM 0 H GLY A 129 19.192 -2.261 -0.700 1.00 3.58 H new ATOM 0 HA2 GLY A 129 20.407 0.430 -1.195 1.00 3.75 H new ATOM 0 HA3 GLY A 129 20.550 -0.527 0.267 1.00 3.75 H new ATOM 2015 N VAL A 130 21.778 -1.685 -2.574 1.00 4.09 N ATOM 2016 CA VAL A 130 23.001 -2.309 -3.153 1.00 4.47 C ATOM 2017 C VAL A 130 24.131 -1.280 -3.204 1.00 4.46 C ATOM 2018 O VAL A 130 25.036 -1.294 -2.393 1.00 4.59 O ATOM 2019 CB VAL A 130 22.706 -2.794 -4.573 1.00 4.84 C ATOM 2020 CG1 VAL A 130 23.914 -3.566 -5.105 1.00 5.35 C ATOM 2021 CG2 VAL A 130 21.480 -3.708 -4.559 1.00 5.03 C ATOM 0 H VAL A 130 20.967 -1.664 -3.192 1.00 4.09 H new ATOM 0 HA VAL A 130 23.300 -3.152 -2.529 1.00 4.47 H new ATOM 0 HB VAL A 130 22.508 -1.937 -5.217 1.00 4.84 H new ATOM 0 HG11 VAL A 130 23.707 -3.913 -6.117 1.00 5.35 H new ATOM 0 HG12 VAL A 130 24.787 -2.913 -5.117 1.00 5.35 H new ATOM 0 HG13 VAL A 130 24.111 -4.423 -4.461 1.00 5.35 H new ATOM 0 HG21 VAL A 130 21.271 -4.053 -5.572 1.00 5.03 H new ATOM 0 HG22 VAL A 130 21.674 -4.567 -3.916 1.00 5.03 H new ATOM 0 HG23 VAL A 130 20.620 -3.157 -4.179 1.00 5.03 H new ATOM 2031 N HIS A 131 24.090 -0.393 -4.160 1.00 4.48 N ATOM 2032 CA HIS A 131 25.155 0.624 -4.286 1.00 4.70 C ATOM 2033 C HIS A 131 24.911 1.758 -3.294 1.00 4.61 C ATOM 2034 O HIS A 131 25.707 2.009 -2.411 1.00 4.88 O ATOM 2035 CB HIS A 131 25.134 1.175 -5.711 1.00 5.06 C ATOM 2036 CG HIS A 131 24.923 0.047 -6.682 1.00 5.36 C ATOM 2037 ND1 HIS A 131 25.964 -0.755 -7.122 1.00 5.95 N ATOM 2038 CD2 HIS A 131 23.796 -0.426 -7.307 1.00 5.42 C ATOM 2039 CE1 HIS A 131 25.448 -1.658 -7.975 1.00 6.25 C ATOM 2040 NE2 HIS A 131 24.130 -1.502 -8.124 1.00 5.97 N ATOM 0 H HIS A 131 23.354 -0.334 -4.863 1.00 4.48 H new ATOM 0 HA HIS A 131 26.124 0.174 -4.072 1.00 4.70 H new ATOM 0 HB2 HIS A 131 24.338 1.912 -5.815 1.00 5.06 H new ATOM 0 HB3 HIS A 131 26.072 1.686 -5.929 1.00 5.06 H new ATOM 0 HD2 HIS A 131 22.801 -0.024 -7.183 1.00 5.42 H new ATOM 0 HE1 HIS A 131 26.029 -2.417 -8.478 1.00 6.25 H new ATOM 0 HE2 HIS A 131 23.503 -2.053 -8.710 1.00 5.97 H new ATOM 2048 N GLY A 132 23.818 2.445 -3.433 1.00 4.43 N ATOM 2049 CA GLY A 132 23.521 3.567 -2.498 1.00 4.60 C ATOM 2050 C GLY A 132 22.507 4.519 -3.128 1.00 4.49 C ATOM 2051 O GLY A 132 21.391 4.626 -2.660 1.00 4.14 O ATOM 0 H GLY A 132 23.114 2.281 -4.153 1.00 4.43 H new ATOM 0 HA2 GLY A 132 23.129 3.175 -1.559 1.00 4.60 H new ATOM 0 HA3 GLY A 132 24.438 4.105 -2.260 1.00 4.60 H new ATOM 2055 N PRO A 133 22.923 5.191 -4.169 1.00 4.99 N ATOM 2056 CA PRO A 133 22.054 6.147 -4.869 1.00 5.13 C ATOM 2057 C PRO A 133 20.832 5.426 -5.448 1.00 4.60 C ATOM 2058 O PRO A 133 19.962 6.035 -6.039 1.00 4.68 O ATOM 2059 CB PRO A 133 22.933 6.725 -5.986 1.00 6.02 C ATOM 2060 CG PRO A 133 24.285 5.964 -5.966 1.00 6.33 C ATOM 2061 CD PRO A 133 24.281 5.051 -4.730 1.00 5.65 C ATOM 0 HA PRO A 133 21.670 6.926 -4.210 1.00 5.13 H new ATOM 0 HB2 PRO A 133 22.445 6.611 -6.954 1.00 6.02 H new ATOM 0 HB3 PRO A 133 23.093 7.792 -5.833 1.00 6.02 H new ATOM 0 HG2 PRO A 133 24.408 5.377 -6.876 1.00 6.33 H new ATOM 0 HG3 PRO A 133 25.119 6.664 -5.923 1.00 6.33 H new ATOM 0 HD2 PRO A 133 24.494 4.017 -5.000 1.00 5.65 H new ATOM 0 HD3 PRO A 133 25.041 5.355 -4.010 1.00 5.65 H new ATOM 2069 N GLU A 134 20.760 4.136 -5.277 1.00 4.25 N ATOM 2070 CA GLU A 134 19.593 3.379 -5.811 1.00 4.06 C ATOM 2071 C GLU A 134 18.323 3.872 -5.114 1.00 3.60 C ATOM 2072 O GLU A 134 17.756 4.876 -5.494 1.00 3.72 O ATOM 2073 CB GLU A 134 19.789 1.883 -5.550 1.00 4.06 C ATOM 2074 CG GLU A 134 18.691 1.086 -6.260 1.00 4.23 C ATOM 2075 CD GLU A 134 19.110 -0.382 -6.360 1.00 4.74 C ATOM 2076 OE1 GLU A 134 20.076 -0.748 -5.709 1.00 5.18 O ATOM 2077 OE2 GLU A 134 18.459 -1.116 -7.085 1.00 5.06 O ATOM 0 H GLU A 134 21.458 3.573 -4.791 1.00 4.25 H new ATOM 0 HA GLU A 134 19.504 3.539 -6.885 1.00 4.06 H new ATOM 0 HB2 GLU A 134 20.769 1.567 -5.907 1.00 4.06 H new ATOM 0 HB3 GLU A 134 19.761 1.684 -4.479 1.00 4.06 H new ATOM 0 HG2 GLU A 134 17.753 1.171 -5.712 1.00 4.23 H new ATOM 0 HG3 GLU A 134 18.516 1.494 -7.256 1.00 4.23 H new ATOM 2084 N GLY A 135 17.870 3.194 -4.091 1.00 3.26 N ATOM 2085 CA GLY A 135 16.641 3.671 -3.392 1.00 3.16 C ATOM 2086 C GLY A 135 16.072 2.571 -2.491 1.00 2.93 C ATOM 2087 O GLY A 135 16.667 1.524 -2.308 1.00 3.05 O ATOM 0 H GLY A 135 18.290 2.344 -3.715 1.00 3.26 H new ATOM 0 HA2 GLY A 135 16.875 4.553 -2.795 1.00 3.16 H new ATOM 0 HA3 GLY A 135 15.893 3.971 -4.125 1.00 3.16 H new ATOM 2091 N PHE A 136 14.916 2.806 -1.925 1.00 2.69 N ATOM 2092 CA PHE A 136 14.290 1.798 -1.036 1.00 2.57 C ATOM 2093 C PHE A 136 13.042 1.259 -1.730 1.00 2.49 C ATOM 2094 O PHE A 136 12.399 1.959 -2.488 1.00 2.49 O ATOM 2095 CB PHE A 136 13.919 2.476 0.281 1.00 2.50 C ATOM 2096 CG PHE A 136 15.157 2.597 1.141 1.00 2.82 C ATOM 2097 CD1 PHE A 136 15.521 1.553 1.999 1.00 3.24 C ATOM 2098 CD2 PHE A 136 15.943 3.754 1.074 1.00 2.92 C ATOM 2099 CE1 PHE A 136 16.673 1.664 2.788 1.00 3.76 C ATOM 2100 CE2 PHE A 136 17.094 3.865 1.862 1.00 3.37 C ATOM 2101 CZ PHE A 136 17.459 2.821 2.720 1.00 3.80 C ATOM 0 H PHE A 136 14.378 3.664 -2.046 1.00 2.69 H new ATOM 0 HA PHE A 136 14.973 0.974 -0.831 1.00 2.57 H new ATOM 0 HB2 PHE A 136 13.496 3.462 0.090 1.00 2.50 H new ATOM 0 HB3 PHE A 136 13.156 1.897 0.800 1.00 2.50 H new ATOM 0 HD1 PHE A 136 14.914 0.662 2.053 1.00 3.24 H new ATOM 0 HD2 PHE A 136 15.661 4.561 0.414 1.00 2.92 H new ATOM 0 HE1 PHE A 136 16.955 0.857 3.449 1.00 3.76 H new ATOM 0 HE2 PHE A 136 17.701 4.757 1.808 1.00 3.37 H new ATOM 0 HZ PHE A 136 18.346 2.908 3.329 1.00 3.80 H new ATOM 2111 N HIS A 137 12.704 0.018 -1.502 1.00 2.52 N ATOM 2112 CA HIS A 137 11.514 -0.566 -2.184 1.00 2.51 C ATOM 2113 C HIS A 137 10.507 -1.045 -1.144 1.00 2.41 C ATOM 2114 O HIS A 137 10.811 -1.878 -0.315 1.00 2.64 O ATOM 2115 CB HIS A 137 11.980 -1.751 -3.039 1.00 2.76 C ATOM 2116 CG HIS A 137 10.798 -2.448 -3.656 1.00 2.87 C ATOM 2117 ND1 HIS A 137 9.732 -3.111 -3.103 1.00 3.09 N flip ATOM 2118 CD2 HIS A 137 10.632 -2.540 -5.030 1.00 3.04 C flip ATOM 2119 CE1 HIS A 137 8.913 -3.607 -4.115 1.00 3.20 C flip ATOM 2120 NE2 HIS A 137 9.502 -3.236 -5.255 1.00 3.22 N flip ATOM 0 H HIS A 137 13.200 -0.615 -0.874 1.00 2.52 H new ATOM 0 HA HIS A 137 11.037 0.185 -2.813 1.00 2.51 H new ATOM 0 HB2 HIS A 137 12.653 -1.401 -3.821 1.00 2.76 H new ATOM 0 HB3 HIS A 137 12.544 -2.452 -2.424 1.00 2.76 H new ATOM 0 HD2 HIS A 137 11.289 -2.128 -5.782 1.00 3.04 H new ATOM 0 HE1 HIS A 137 7.999 -4.170 -4.002 1.00 3.20 H new ATOM 0 HE2 HIS A 137 9.140 -3.454 -6.183 1.00 3.22 H new ATOM 2128 N TYR A 138 9.302 -0.542 -1.191 1.00 2.23 N ATOM 2129 CA TYR A 138 8.273 -0.983 -0.222 1.00 2.23 C ATOM 2130 C TYR A 138 7.067 -1.421 -1.022 1.00 2.05 C ATOM 2131 O TYR A 138 6.990 -1.182 -2.209 1.00 2.22 O ATOM 2132 CB TYR A 138 7.876 0.173 0.689 1.00 2.58 C ATOM 2133 CG TYR A 138 8.802 0.226 1.884 1.00 3.11 C ATOM 2134 CD1 TYR A 138 10.156 0.539 1.708 1.00 3.58 C ATOM 2135 CD2 TYR A 138 8.308 -0.041 3.167 1.00 3.64 C ATOM 2136 CE1 TYR A 138 11.015 0.582 2.814 1.00 4.18 C ATOM 2137 CE2 TYR A 138 9.167 0.001 4.271 1.00 4.23 C ATOM 2138 CZ TYR A 138 10.520 0.314 4.095 1.00 4.35 C ATOM 2139 OH TYR A 138 11.366 0.354 5.185 1.00 5.03 O ATOM 0 H TYR A 138 8.991 0.158 -1.864 1.00 2.23 H new ATOM 0 HA TYR A 138 8.657 -1.793 0.398 1.00 2.23 H new ATOM 0 HB2 TYR A 138 7.922 1.113 0.140 1.00 2.58 H new ATOM 0 HB3 TYR A 138 6.845 0.049 1.021 1.00 2.58 H new ATOM 0 HD1 TYR A 138 10.538 0.747 0.719 1.00 3.58 H new ATOM 0 HD2 TYR A 138 7.264 -0.279 3.304 1.00 3.64 H new ATOM 0 HE1 TYR A 138 12.059 0.822 2.678 1.00 4.18 H new ATOM 0 HE2 TYR A 138 8.786 -0.208 5.260 1.00 4.23 H new ATOM 0 HH TYR A 138 11.142 -0.376 5.800 1.00 5.03 H new ATOM 2149 N LYS A 139 6.130 -2.075 -0.417 1.00 1.91 N ATOM 2150 CA LYS A 139 4.969 -2.516 -1.223 1.00 1.98 C ATOM 2151 C LYS A 139 3.712 -2.637 -0.377 1.00 1.75 C ATOM 2152 O LYS A 139 3.750 -2.620 0.837 1.00 1.71 O ATOM 2153 CB LYS A 139 5.306 -3.863 -1.840 1.00 2.50 C ATOM 2154 CG LYS A 139 5.579 -4.868 -0.725 1.00 2.78 C ATOM 2155 CD LYS A 139 6.197 -6.145 -1.310 1.00 3.42 C ATOM 2156 CE LYS A 139 5.095 -7.174 -1.576 1.00 4.10 C ATOM 2157 NZ LYS A 139 4.528 -7.640 -0.280 1.00 4.66 N ATOM 0 H LYS A 139 6.112 -2.320 0.573 1.00 1.91 H new ATOM 0 HA LYS A 139 4.770 -1.773 -1.995 1.00 1.98 H new ATOM 0 HB2 LYS A 139 4.481 -4.208 -2.464 1.00 2.50 H new ATOM 0 HB3 LYS A 139 6.179 -3.773 -2.487 1.00 2.50 H new ATOM 0 HG2 LYS A 139 6.254 -4.432 0.012 1.00 2.78 H new ATOM 0 HG3 LYS A 139 4.651 -5.108 -0.205 1.00 2.78 H new ATOM 0 HD2 LYS A 139 6.724 -5.915 -2.236 1.00 3.42 H new ATOM 0 HD3 LYS A 139 6.932 -6.555 -0.618 1.00 3.42 H new ATOM 0 HE2 LYS A 139 4.311 -6.732 -2.190 1.00 4.10 H new ATOM 0 HE3 LYS A 139 5.499 -8.019 -2.134 1.00 4.10 H new ATOM 0 HZ1 LYS A 139 3.815 -8.376 -0.458 1.00 4.66 H new ATOM 0 HZ2 LYS A 139 5.289 -8.031 0.311 1.00 4.66 H new ATOM 0 HZ3 LYS A 139 4.083 -6.839 0.212 1.00 4.66 H new ATOM 2171 N CYS A 140 2.592 -2.771 -1.028 1.00 1.70 N ATOM 2172 CA CYS A 140 1.311 -2.907 -0.297 1.00 1.60 C ATOM 2173 C CYS A 140 0.305 -3.609 -1.201 1.00 1.70 C ATOM 2174 O CYS A 140 0.252 -3.372 -2.392 1.00 1.84 O ATOM 2175 CB CYS A 140 0.794 -1.528 0.087 1.00 1.48 C ATOM 2176 SG CYS A 140 -0.954 -1.629 0.544 1.00 2.11 S ATOM 0 H CYS A 140 2.512 -2.792 -2.045 1.00 1.70 H new ATOM 0 HA CYS A 140 1.458 -3.492 0.611 1.00 1.60 H new ATOM 0 HB2 CYS A 140 1.374 -1.132 0.920 1.00 1.48 H new ATOM 0 HB3 CYS A 140 0.921 -0.837 -0.747 1.00 1.48 H new ATOM 0 HG CYS A 140 -1.685 -1.620 -0.531 1.00 2.11 H new ATOM 2182 N LYS A 141 -0.470 -4.490 -0.647 1.00 1.75 N ATOM 2183 CA LYS A 141 -1.455 -5.250 -1.470 1.00 1.92 C ATOM 2184 C LYS A 141 -2.887 -4.893 -1.082 1.00 1.87 C ATOM 2185 O LYS A 141 -3.143 -4.363 -0.014 1.00 1.90 O ATOM 2186 CB LYS A 141 -1.241 -6.737 -1.202 1.00 2.34 C ATOM 2187 CG LYS A 141 -1.644 -7.055 0.250 1.00 2.66 C ATOM 2188 CD LYS A 141 -3.053 -7.659 0.290 1.00 2.86 C ATOM 2189 CE LYS A 141 -2.983 -9.154 -0.027 1.00 3.15 C ATOM 2190 NZ LYS A 141 -4.314 -9.617 -0.510 1.00 3.80 N ATOM 0 H LYS A 141 -0.467 -4.721 0.346 1.00 1.75 H new ATOM 0 HA LYS A 141 -1.307 -5.003 -2.521 1.00 1.92 H new ATOM 0 HB2 LYS A 141 -1.835 -7.332 -1.895 1.00 2.34 H new ATOM 0 HB3 LYS A 141 -0.197 -7.002 -1.368 1.00 2.34 H new ATOM 0 HG2 LYS A 141 -0.930 -7.752 0.689 1.00 2.66 H new ATOM 0 HG3 LYS A 141 -1.613 -6.146 0.851 1.00 2.66 H new ATOM 0 HD2 LYS A 141 -3.497 -7.507 1.274 1.00 2.86 H new ATOM 0 HD3 LYS A 141 -3.696 -7.154 -0.431 1.00 2.86 H new ATOM 0 HE2 LYS A 141 -2.223 -9.342 -0.785 1.00 3.15 H new ATOM 0 HE3 LYS A 141 -2.691 -9.713 0.862 1.00 3.15 H new ATOM 0 HZ1 LYS A 141 -4.742 -10.244 0.201 1.00 3.80 H new ATOM 0 HZ2 LYS A 141 -4.933 -8.795 -0.664 1.00 3.80 H new ATOM 0 HZ3 LYS A 141 -4.198 -10.135 -1.404 1.00 3.80 H new ATOM 2204 N MET A 142 -3.830 -5.229 -1.932 1.00 1.98 N ATOM 2205 CA MET A 142 -5.261 -4.961 -1.615 1.00 2.20 C ATOM 2206 C MET A 142 -6.068 -6.225 -1.923 1.00 2.50 C ATOM 2207 O MET A 142 -5.569 -7.158 -2.520 1.00 2.79 O ATOM 2208 CB MET A 142 -5.785 -3.808 -2.474 1.00 2.46 C ATOM 2209 CG MET A 142 -4.854 -2.602 -2.351 1.00 2.93 C ATOM 2210 SD MET A 142 -3.446 -2.814 -3.467 1.00 3.58 S ATOM 2211 CE MET A 142 -4.233 -2.145 -4.953 1.00 4.28 C ATOM 0 H MET A 142 -3.665 -5.678 -2.833 1.00 1.98 H new ATOM 0 HA MET A 142 -5.359 -4.689 -0.564 1.00 2.20 H new ATOM 0 HB2 MET A 142 -5.853 -4.121 -3.516 1.00 2.46 H new ATOM 0 HB3 MET A 142 -6.792 -3.535 -2.157 1.00 2.46 H new ATOM 0 HG2 MET A 142 -5.392 -1.687 -2.597 1.00 2.93 H new ATOM 0 HG3 MET A 142 -4.506 -2.501 -1.323 1.00 2.93 H new ATOM 0 HE1 MET A 142 -3.472 -1.931 -5.703 1.00 4.28 H new ATOM 0 HE2 MET A 142 -4.939 -2.874 -5.351 1.00 4.28 H new ATOM 0 HE3 MET A 142 -4.763 -1.226 -4.702 1.00 4.28 H new ATOM 2221 N GLY A 143 -7.305 -6.272 -1.516 1.00 2.61 N ATOM 2222 CA GLY A 143 -8.132 -7.485 -1.782 1.00 3.08 C ATOM 2223 C GLY A 143 -8.831 -7.361 -3.132 1.00 2.86 C ATOM 2224 O GLY A 143 -9.271 -8.340 -3.702 1.00 3.09 O ATOM 0 H GLY A 143 -7.781 -5.524 -1.011 1.00 2.61 H new ATOM 0 HA2 GLY A 143 -7.501 -8.374 -1.771 1.00 3.08 H new ATOM 0 HA3 GLY A 143 -8.872 -7.610 -0.991 1.00 3.08 H new ATOM 2228 N GLN A 144 -8.956 -6.169 -3.642 1.00 2.87 N ATOM 2229 CA GLN A 144 -9.650 -5.999 -4.945 1.00 3.05 C ATOM 2230 C GLN A 144 -8.964 -6.841 -6.019 1.00 3.10 C ATOM 2231 O GLN A 144 -9.204 -8.028 -6.129 1.00 3.34 O ATOM 2232 CB GLN A 144 -9.661 -4.522 -5.353 1.00 3.33 C ATOM 2233 CG GLN A 144 -8.339 -3.859 -4.969 1.00 3.62 C ATOM 2234 CD GLN A 144 -8.211 -2.533 -5.720 1.00 4.01 C ATOM 2235 OE1 GLN A 144 -7.196 -2.260 -6.329 1.00 4.27 O ATOM 2236 NE2 GLN A 144 -9.211 -1.694 -5.706 1.00 4.40 N ATOM 0 H GLN A 144 -8.609 -5.310 -3.215 1.00 2.87 H new ATOM 0 HA GLN A 144 -10.681 -6.337 -4.840 1.00 3.05 H new ATOM 0 HB2 GLN A 144 -9.821 -4.435 -6.428 1.00 3.33 H new ATOM 0 HB3 GLN A 144 -10.489 -4.008 -4.865 1.00 3.33 H new ATOM 0 HG2 GLN A 144 -8.302 -3.688 -3.893 1.00 3.62 H new ATOM 0 HG3 GLN A 144 -7.503 -4.514 -5.216 1.00 3.62 H new ATOM 0 HE21 GLN A 144 -10.063 -1.924 -5.194 1.00 4.40 H new ATOM 0 HE22 GLN A 144 -9.141 -0.808 -6.207 1.00 4.40 H new ATOM 2245 N LYS A 145 -8.148 -6.246 -6.841 1.00 2.96 N ATOM 2246 CA LYS A 145 -7.504 -7.042 -7.925 1.00 3.09 C ATOM 2247 C LYS A 145 -6.120 -6.472 -8.302 1.00 2.95 C ATOM 2248 O LYS A 145 -5.575 -6.796 -9.338 1.00 3.16 O ATOM 2249 CB LYS A 145 -8.465 -7.010 -9.123 1.00 3.38 C ATOM 2250 CG LYS A 145 -7.810 -7.579 -10.387 1.00 3.35 C ATOM 2251 CD LYS A 145 -7.205 -6.439 -11.226 1.00 3.56 C ATOM 2252 CE LYS A 145 -8.196 -6.012 -12.312 1.00 3.85 C ATOM 2253 NZ LYS A 145 -9.582 -6.013 -11.757 1.00 4.30 N ATOM 0 H LYS A 145 -7.900 -5.257 -6.813 1.00 2.96 H new ATOM 0 HA LYS A 145 -7.326 -8.066 -7.596 1.00 3.09 H new ATOM 0 HB2 LYS A 145 -9.361 -7.584 -8.887 1.00 3.38 H new ATOM 0 HB3 LYS A 145 -8.783 -5.984 -9.308 1.00 3.38 H new ATOM 0 HG2 LYS A 145 -7.033 -8.292 -10.114 1.00 3.35 H new ATOM 0 HG3 LYS A 145 -8.549 -8.122 -10.976 1.00 3.35 H new ATOM 0 HD2 LYS A 145 -6.966 -5.591 -10.585 1.00 3.56 H new ATOM 0 HD3 LYS A 145 -6.271 -6.767 -11.682 1.00 3.56 H new ATOM 0 HE2 LYS A 145 -7.942 -5.018 -12.679 1.00 3.85 H new ATOM 0 HE3 LYS A 145 -8.134 -6.691 -13.162 1.00 3.85 H new ATOM 0 HZ1 LYS A 145 -10.206 -5.462 -12.380 1.00 4.30 H new ATOM 0 HZ2 LYS A 145 -9.931 -6.991 -11.696 1.00 4.30 H new ATOM 0 HZ3 LYS A 145 -9.576 -5.587 -10.808 1.00 4.30 H new ATOM 2267 N GLU A 146 -5.533 -5.634 -7.481 1.00 2.70 N ATOM 2268 CA GLU A 146 -4.189 -5.069 -7.844 1.00 2.62 C ATOM 2269 C GLU A 146 -3.243 -5.058 -6.638 1.00 2.39 C ATOM 2270 O GLU A 146 -3.648 -5.010 -5.487 1.00 2.38 O ATOM 2271 CB GLU A 146 -4.363 -3.630 -8.366 1.00 2.76 C ATOM 2272 CG GLU A 146 -4.492 -3.628 -9.898 1.00 3.32 C ATOM 2273 CD GLU A 146 -3.101 -3.539 -10.534 1.00 3.87 C ATOM 2274 OE1 GLU A 146 -2.191 -4.158 -10.009 1.00 4.28 O ATOM 2275 OE2 GLU A 146 -2.972 -2.853 -11.536 1.00 4.30 O ATOM 0 H GLU A 146 -5.916 -5.319 -6.590 1.00 2.70 H new ATOM 0 HA GLU A 146 -3.752 -5.702 -8.616 1.00 2.62 H new ATOM 0 HB2 GLU A 146 -5.249 -3.179 -7.919 1.00 2.76 H new ATOM 0 HB3 GLU A 146 -3.510 -3.022 -8.066 1.00 2.76 H new ATOM 0 HG2 GLU A 146 -4.997 -4.535 -10.231 1.00 3.32 H new ATOM 0 HG3 GLU A 146 -5.104 -2.785 -10.220 1.00 3.32 H new ATOM 2282 N TYR A 147 -1.971 -5.104 -6.929 1.00 2.41 N ATOM 2283 CA TYR A 147 -0.924 -5.101 -5.870 1.00 2.39 C ATOM 2284 C TYR A 147 -0.291 -3.704 -5.798 1.00 2.21 C ATOM 2285 O TYR A 147 0.598 -3.379 -6.559 1.00 2.39 O ATOM 2286 CB TYR A 147 0.139 -6.126 -6.269 1.00 2.85 C ATOM 2287 CG TYR A 147 0.789 -6.740 -5.053 1.00 3.14 C ATOM 2288 CD1 TYR A 147 1.098 -5.964 -3.922 1.00 2.88 C ATOM 2289 CD2 TYR A 147 1.107 -8.098 -5.076 1.00 3.80 C ATOM 2290 CE1 TYR A 147 1.717 -6.561 -2.818 1.00 3.27 C ATOM 2291 CE2 TYR A 147 1.732 -8.693 -3.976 1.00 4.24 C ATOM 2292 CZ TYR A 147 2.037 -7.925 -2.846 1.00 3.98 C ATOM 2293 OH TYR A 147 2.662 -8.511 -1.763 1.00 4.49 O ATOM 0 H TYR A 147 -1.606 -5.145 -7.881 1.00 2.41 H new ATOM 0 HA TYR A 147 -1.349 -5.351 -4.898 1.00 2.39 H new ATOM 0 HB2 TYR A 147 -0.316 -6.909 -6.875 1.00 2.85 H new ATOM 0 HB3 TYR A 147 0.898 -5.645 -6.887 1.00 2.85 H new ATOM 0 HD1 TYR A 147 0.859 -4.911 -3.905 1.00 2.88 H new ATOM 0 HD2 TYR A 147 0.870 -8.692 -5.946 1.00 3.80 H new ATOM 0 HE1 TYR A 147 1.948 -5.970 -1.944 1.00 3.27 H new ATOM 0 HE2 TYR A 147 1.979 -9.744 -3.998 1.00 4.24 H new ATOM 0 HH TYR A 147 2.811 -9.462 -1.946 1.00 4.49 H new ATOM 2303 N SER A 148 -0.748 -2.872 -4.904 1.00 1.96 N ATOM 2304 CA SER A 148 -0.174 -1.498 -4.801 1.00 1.87 C ATOM 2305 C SER A 148 1.307 -1.551 -4.401 1.00 1.80 C ATOM 2306 O SER A 148 1.710 -0.976 -3.409 1.00 1.67 O ATOM 2307 CB SER A 148 -0.957 -0.695 -3.766 1.00 1.82 C ATOM 2308 OG SER A 148 -1.233 -1.516 -2.640 1.00 2.11 O ATOM 0 H SER A 148 -1.493 -3.082 -4.240 1.00 1.96 H new ATOM 0 HA SER A 148 -0.249 -1.017 -5.776 1.00 1.87 H new ATOM 0 HB2 SER A 148 -0.384 0.180 -3.460 1.00 1.82 H new ATOM 0 HB3 SER A 148 -1.888 -0.331 -4.201 1.00 1.82 H new ATOM 0 HG SER A 148 -2.166 -1.815 -2.674 1.00 2.11 H new ATOM 2314 N ILE A 149 2.125 -2.218 -5.166 1.00 2.05 N ATOM 2315 CA ILE A 149 3.576 -2.275 -4.826 1.00 2.16 C ATOM 2316 C ILE A 149 4.207 -0.918 -5.166 1.00 2.12 C ATOM 2317 O ILE A 149 4.057 -0.425 -6.268 1.00 2.34 O ATOM 2318 CB ILE A 149 4.239 -3.398 -5.631 1.00 2.59 C ATOM 2319 CG1 ILE A 149 3.430 -4.684 -5.432 1.00 2.92 C ATOM 2320 CG2 ILE A 149 5.680 -3.616 -5.141 1.00 2.69 C ATOM 2321 CD1 ILE A 149 3.936 -5.771 -6.380 1.00 3.22 C ATOM 0 H ILE A 149 1.854 -2.725 -6.009 1.00 2.05 H new ATOM 0 HA ILE A 149 3.717 -2.481 -3.765 1.00 2.16 H new ATOM 0 HB ILE A 149 4.264 -3.129 -6.687 1.00 2.59 H new ATOM 0 HG12 ILE A 149 3.516 -5.022 -4.399 1.00 2.92 H new ATOM 0 HG13 ILE A 149 2.373 -4.491 -5.617 1.00 2.92 H new ATOM 0 HG21 ILE A 149 6.144 -4.416 -5.718 1.00 2.69 H new ATOM 0 HG22 ILE A 149 6.251 -2.697 -5.270 1.00 2.69 H new ATOM 0 HG23 ILE A 149 5.668 -3.890 -4.086 1.00 2.69 H new ATOM 0 HD11 ILE A 149 3.356 -6.682 -6.232 1.00 3.22 H new ATOM 0 HD12 ILE A 149 3.827 -5.434 -7.411 1.00 3.22 H new ATOM 0 HD13 ILE A 149 4.987 -5.973 -6.174 1.00 3.22 H new ATOM 2333 N GLY A 150 4.885 -0.286 -4.231 1.00 1.97 N ATOM 2334 CA GLY A 150 5.475 1.059 -4.528 1.00 2.09 C ATOM 2335 C GLY A 150 6.967 1.121 -4.181 1.00 2.12 C ATOM 2336 O GLY A 150 7.610 0.130 -3.887 1.00 2.30 O ATOM 0 H GLY A 150 5.052 -0.639 -3.289 1.00 1.97 H new ATOM 0 HA2 GLY A 150 5.339 1.289 -5.585 1.00 2.09 H new ATOM 0 HA3 GLY A 150 4.939 1.822 -3.964 1.00 2.09 H new ATOM 2340 N THR A 151 7.511 2.306 -4.226 1.00 2.11 N ATOM 2341 CA THR A 151 8.954 2.508 -3.919 1.00 2.21 C ATOM 2342 C THR A 151 9.108 3.854 -3.207 1.00 2.28 C ATOM 2343 O THR A 151 8.325 4.756 -3.417 1.00 2.46 O ATOM 2344 CB THR A 151 9.741 2.526 -5.232 1.00 2.49 C ATOM 2345 OG1 THR A 151 9.425 1.363 -5.984 1.00 2.63 O ATOM 2346 CG2 THR A 151 11.243 2.556 -4.945 1.00 2.65 C ATOM 0 H THR A 151 7.006 3.158 -4.467 1.00 2.11 H new ATOM 0 HA THR A 151 9.330 1.706 -3.284 1.00 2.21 H new ATOM 0 HB THR A 151 9.471 3.417 -5.799 1.00 2.49 H new ATOM 0 HG1 THR A 151 9.926 1.372 -6.826 1.00 2.63 H new ATOM 0 HG21 THR A 151 11.793 2.569 -5.886 1.00 2.65 H new ATOM 0 HG22 THR A 151 11.486 3.450 -4.371 1.00 2.65 H new ATOM 0 HG23 THR A 151 11.522 1.671 -4.374 1.00 2.65 H new ATOM 2354 N GLY A 152 10.097 4.009 -2.364 1.00 2.29 N ATOM 2355 CA GLY A 152 10.255 5.315 -1.653 1.00 2.45 C ATOM 2356 C GLY A 152 11.734 5.683 -1.523 1.00 2.53 C ATOM 2357 O GLY A 152 12.601 4.830 -1.491 1.00 2.53 O ATOM 0 H GLY A 152 10.794 3.299 -2.139 1.00 2.29 H new ATOM 0 HA2 GLY A 152 9.727 6.098 -2.197 1.00 2.45 H new ATOM 0 HA3 GLY A 152 9.802 5.253 -0.664 1.00 2.45 H new ATOM 2361 N SER A 153 12.023 6.956 -1.437 1.00 2.66 N ATOM 2362 CA SER A 153 13.438 7.395 -1.293 1.00 2.79 C ATOM 2363 C SER A 153 13.898 7.115 0.134 1.00 2.71 C ATOM 2364 O SER A 153 15.058 6.861 0.389 1.00 2.79 O ATOM 2365 CB SER A 153 13.546 8.894 -1.578 1.00 3.02 C ATOM 2366 OG SER A 153 13.124 9.149 -2.911 1.00 3.11 O ATOM 0 H SER A 153 11.336 7.710 -1.461 1.00 2.66 H new ATOM 0 HA SER A 153 14.065 6.852 -2.000 1.00 2.79 H new ATOM 0 HB2 SER A 153 12.930 9.455 -0.875 1.00 3.02 H new ATOM 0 HB3 SER A 153 14.574 9.229 -1.439 1.00 3.02 H new ATOM 0 HG SER A 153 13.190 10.109 -3.097 1.00 3.11 H new ATOM 2372 N THR A 154 12.984 7.148 1.062 1.00 2.58 N ATOM 2373 CA THR A 154 13.333 6.875 2.481 1.00 2.55 C ATOM 2374 C THR A 154 12.342 5.853 3.027 1.00 2.37 C ATOM 2375 O THR A 154 11.216 5.766 2.578 1.00 2.38 O ATOM 2376 CB THR A 154 13.233 8.169 3.294 1.00 2.70 C ATOM 2377 OG1 THR A 154 11.886 8.370 3.698 1.00 2.94 O ATOM 2378 CG2 THR A 154 13.693 9.353 2.441 1.00 2.84 C ATOM 0 H THR A 154 11.999 7.355 0.895 1.00 2.58 H new ATOM 0 HA THR A 154 14.351 6.491 2.551 1.00 2.55 H new ATOM 0 HB THR A 154 13.871 8.092 4.175 1.00 2.70 H new ATOM 0 HG1 THR A 154 11.821 9.197 4.220 1.00 2.94 H new ATOM 0 HG21 THR A 154 13.620 10.271 3.024 1.00 2.84 H new ATOM 0 HG22 THR A 154 14.727 9.200 2.133 1.00 2.84 H new ATOM 0 HG23 THR A 154 13.060 9.433 1.557 1.00 2.84 H new ATOM 2386 N LYS A 155 12.743 5.078 3.989 1.00 2.29 N ATOM 2387 CA LYS A 155 11.822 4.066 4.553 1.00 2.18 C ATOM 2388 C LYS A 155 10.494 4.731 4.901 1.00 2.12 C ATOM 2389 O LYS A 155 9.445 4.117 4.861 1.00 1.98 O ATOM 2390 CB LYS A 155 12.447 3.502 5.833 1.00 2.31 C ATOM 2391 CG LYS A 155 13.505 2.432 5.503 1.00 2.42 C ATOM 2392 CD LYS A 155 14.901 3.073 5.466 1.00 2.69 C ATOM 2393 CE LYS A 155 15.333 3.486 6.884 1.00 2.84 C ATOM 2394 NZ LYS A 155 16.589 2.772 7.250 1.00 3.15 N ATOM 0 H LYS A 155 13.672 5.103 4.409 1.00 2.29 H new ATOM 0 HA LYS A 155 11.653 3.269 3.829 1.00 2.18 H new ATOM 0 HB2 LYS A 155 12.906 4.309 6.404 1.00 2.31 H new ATOM 0 HB3 LYS A 155 11.669 3.068 6.462 1.00 2.31 H new ATOM 0 HG2 LYS A 155 13.479 1.639 6.250 1.00 2.42 H new ATOM 0 HG3 LYS A 155 13.281 1.971 4.541 1.00 2.42 H new ATOM 0 HD2 LYS A 155 15.621 2.369 5.049 1.00 2.69 H new ATOM 0 HD3 LYS A 155 14.892 3.945 4.812 1.00 2.69 H new ATOM 0 HE2 LYS A 155 15.489 4.564 6.928 1.00 2.84 H new ATOM 0 HE3 LYS A 155 14.546 3.248 7.599 1.00 2.84 H new ATOM 0 HZ1 LYS A 155 16.881 3.051 8.208 1.00 3.15 H new ATOM 0 HZ2 LYS A 155 16.425 1.745 7.224 1.00 3.15 H new ATOM 0 HZ3 LYS A 155 17.339 3.020 6.574 1.00 3.15 H new ATOM 2408 N GLN A 156 10.539 5.976 5.261 1.00 2.27 N ATOM 2409 CA GLN A 156 9.300 6.692 5.637 1.00 2.32 C ATOM 2410 C GLN A 156 8.538 7.139 4.388 1.00 2.28 C ATOM 2411 O GLN A 156 7.373 6.840 4.230 1.00 2.21 O ATOM 2412 CB GLN A 156 9.677 7.899 6.497 1.00 2.57 C ATOM 2413 CG GLN A 156 9.630 7.509 7.977 1.00 2.70 C ATOM 2414 CD GLN A 156 10.317 8.588 8.814 1.00 3.00 C ATOM 2415 OE1 GLN A 156 11.119 9.348 8.307 1.00 3.45 O ATOM 2416 NE2 GLN A 156 10.035 8.689 10.083 1.00 3.19 N ATOM 0 H GLN A 156 11.391 6.534 5.311 1.00 2.27 H new ATOM 0 HA GLN A 156 8.648 6.027 6.203 1.00 2.32 H new ATOM 0 HB2 GLN A 156 10.675 8.248 6.234 1.00 2.57 H new ATOM 0 HB3 GLN A 156 8.990 8.724 6.306 1.00 2.57 H new ATOM 0 HG2 GLN A 156 8.596 7.388 8.299 1.00 2.70 H new ATOM 0 HG3 GLN A 156 10.124 6.549 8.126 1.00 2.70 H new ATOM 0 HE21 GLN A 156 9.362 8.051 10.508 1.00 3.19 H new ATOM 0 HE22 GLN A 156 10.487 9.406 10.650 1.00 3.19 H new ATOM 2425 N GLU A 157 9.173 7.850 3.496 1.00 2.36 N ATOM 2426 CA GLU A 157 8.451 8.298 2.279 1.00 2.40 C ATOM 2427 C GLU A 157 7.804 7.087 1.623 1.00 2.16 C ATOM 2428 O GLU A 157 6.772 7.183 0.989 1.00 2.14 O ATOM 2429 CB GLU A 157 9.440 8.932 1.301 1.00 2.57 C ATOM 2430 CG GLU A 157 9.877 10.301 1.826 1.00 2.87 C ATOM 2431 CD GLU A 157 10.861 10.938 0.842 1.00 3.12 C ATOM 2432 OE1 GLU A 157 10.775 10.628 -0.335 1.00 3.62 O ATOM 2433 OE2 GLU A 157 11.683 11.725 1.282 1.00 3.35 O ATOM 0 H GLU A 157 10.150 8.136 3.559 1.00 2.36 H new ATOM 0 HA GLU A 157 7.691 9.031 2.548 1.00 2.40 H new ATOM 0 HB2 GLU A 157 10.308 8.285 1.176 1.00 2.57 H new ATOM 0 HB3 GLU A 157 8.978 9.038 0.319 1.00 2.57 H new ATOM 0 HG2 GLU A 157 9.008 10.946 1.956 1.00 2.87 H new ATOM 0 HG3 GLU A 157 10.344 10.194 2.805 1.00 2.87 H new ATOM 2440 N ALA A 158 8.408 5.943 1.770 1.00 2.01 N ATOM 2441 CA ALA A 158 7.834 4.719 1.157 1.00 1.82 C ATOM 2442 C ALA A 158 6.483 4.385 1.810 1.00 1.67 C ATOM 2443 O ALA A 158 5.462 4.307 1.156 1.00 1.60 O ATOM 2444 CB ALA A 158 8.818 3.556 1.346 1.00 1.84 C ATOM 0 H ALA A 158 9.275 5.804 2.289 1.00 2.01 H new ATOM 0 HA ALA A 158 7.669 4.886 0.092 1.00 1.82 H new ATOM 0 HB1 ALA A 158 8.404 2.653 0.898 1.00 1.84 H new ATOM 0 HB2 ALA A 158 9.765 3.799 0.864 1.00 1.84 H new ATOM 0 HB3 ALA A 158 8.985 3.390 2.410 1.00 1.84 H new ATOM 2450 N LYS A 159 6.487 4.159 3.094 1.00 1.70 N ATOM 2451 CA LYS A 159 5.237 3.792 3.822 1.00 1.68 C ATOM 2452 C LYS A 159 4.088 4.770 3.547 1.00 1.74 C ATOM 2453 O LYS A 159 3.017 4.375 3.137 1.00 1.67 O ATOM 2454 CB LYS A 159 5.542 3.791 5.326 1.00 1.89 C ATOM 2455 CG LYS A 159 4.966 2.537 5.991 1.00 1.92 C ATOM 2456 CD LYS A 159 5.908 1.348 5.772 1.00 2.22 C ATOM 2457 CE LYS A 159 5.260 0.074 6.318 1.00 2.66 C ATOM 2458 NZ LYS A 159 5.159 0.162 7.804 1.00 3.21 N ATOM 0 H LYS A 159 7.319 4.214 3.682 1.00 1.70 H new ATOM 0 HA LYS A 159 4.918 2.810 3.474 1.00 1.68 H new ATOM 0 HB2 LYS A 159 6.620 3.831 5.484 1.00 1.89 H new ATOM 0 HB3 LYS A 159 5.119 4.682 5.789 1.00 1.89 H new ATOM 0 HG2 LYS A 159 4.829 2.711 7.058 1.00 1.92 H new ATOM 0 HG3 LYS A 159 3.983 2.314 5.576 1.00 1.92 H new ATOM 0 HD2 LYS A 159 6.123 1.232 4.710 1.00 2.22 H new ATOM 0 HD3 LYS A 159 6.860 1.528 6.272 1.00 2.22 H new ATOM 0 HE2 LYS A 159 4.269 -0.057 5.883 1.00 2.66 H new ATOM 0 HE3 LYS A 159 5.851 -0.797 6.034 1.00 2.66 H new ATOM 0 HZ1 LYS A 159 4.928 -0.775 8.192 1.00 3.21 H new ATOM 0 HZ2 LYS A 159 6.067 0.485 8.195 1.00 3.21 H new ATOM 0 HZ3 LYS A 159 4.411 0.837 8.062 1.00 3.21 H new ATOM 2472 N GLN A 160 4.278 6.028 3.824 1.00 1.95 N ATOM 2473 CA GLN A 160 3.179 7.008 3.631 1.00 2.14 C ATOM 2474 C GLN A 160 2.582 6.893 2.236 1.00 2.04 C ATOM 2475 O GLN A 160 1.397 6.669 2.071 1.00 2.06 O ATOM 2476 CB GLN A 160 3.728 8.414 3.835 1.00 2.42 C ATOM 2477 CG GLN A 160 4.688 8.420 5.030 1.00 2.85 C ATOM 2478 CD GLN A 160 4.627 9.777 5.739 1.00 3.24 C ATOM 2479 OE1 GLN A 160 4.575 10.869 5.027 1.00 3.80 O flip ATOM 2480 NE2 GLN A 160 4.629 9.843 6.952 1.00 3.32 N flip ATOM 0 H GLN A 160 5.151 6.420 4.177 1.00 1.95 H new ATOM 0 HA GLN A 160 2.392 6.800 4.356 1.00 2.14 H new ATOM 0 HB2 GLN A 160 4.247 8.747 2.936 1.00 2.42 H new ATOM 0 HB3 GLN A 160 2.910 9.114 4.008 1.00 2.42 H new ATOM 0 HG2 GLN A 160 4.422 7.624 5.725 1.00 2.85 H new ATOM 0 HG3 GLN A 160 5.705 8.222 4.692 1.00 2.85 H new ATOM 0 HE21 GLN A 160 4.670 8.990 7.509 1.00 3.32 H new ATOM 0 HE22 GLN A 160 4.590 10.752 7.413 1.00 3.32 H new ATOM 2489 N LEU A 161 3.379 7.063 1.231 1.00 2.01 N ATOM 2490 CA LEU A 161 2.841 6.984 -0.138 1.00 2.03 C ATOM 2491 C LEU A 161 2.321 5.570 -0.392 1.00 1.77 C ATOM 2492 O LEU A 161 1.504 5.352 -1.266 1.00 1.77 O ATOM 2493 CB LEU A 161 3.931 7.363 -1.156 1.00 2.16 C ATOM 2494 CG LEU A 161 4.648 6.110 -1.687 1.00 2.01 C ATOM 2495 CD1 LEU A 161 3.783 5.411 -2.753 1.00 1.98 C ATOM 2496 CD2 LEU A 161 5.983 6.527 -2.313 1.00 2.22 C ATOM 0 H LEU A 161 4.379 7.253 1.300 1.00 2.01 H new ATOM 0 HA LEU A 161 2.016 7.688 -0.252 1.00 2.03 H new ATOM 0 HB2 LEU A 161 3.484 7.910 -1.986 1.00 2.16 H new ATOM 0 HB3 LEU A 161 4.655 8.030 -0.688 1.00 2.16 H new ATOM 0 HG LEU A 161 4.819 5.419 -0.862 1.00 2.01 H new ATOM 0 HD11 LEU A 161 4.303 4.526 -3.120 1.00 1.98 H new ATOM 0 HD12 LEU A 161 2.831 5.116 -2.313 1.00 1.98 H new ATOM 0 HD13 LEU A 161 3.603 6.096 -3.582 1.00 1.98 H new ATOM 0 HD21 LEU A 161 6.498 5.645 -2.692 1.00 2.22 H new ATOM 0 HD22 LEU A 161 5.799 7.221 -3.134 1.00 2.22 H new ATOM 0 HD23 LEU A 161 6.602 7.013 -1.559 1.00 2.22 H new ATOM 2508 N ALA A 162 2.758 4.600 0.372 1.00 1.60 N ATOM 2509 CA ALA A 162 2.240 3.227 0.145 1.00 1.41 C ATOM 2510 C ALA A 162 0.716 3.306 0.144 1.00 1.41 C ATOM 2511 O ALA A 162 0.064 2.832 -0.766 1.00 1.38 O ATOM 2512 CB ALA A 162 2.726 2.281 1.246 1.00 1.35 C ATOM 0 H ALA A 162 3.437 4.700 1.127 1.00 1.60 H new ATOM 0 HA ALA A 162 2.603 2.836 -0.806 1.00 1.41 H new ATOM 0 HB1 ALA A 162 2.337 1.279 1.063 1.00 1.35 H new ATOM 0 HB2 ALA A 162 3.816 2.252 1.246 1.00 1.35 H new ATOM 0 HB3 ALA A 162 2.372 2.637 2.214 1.00 1.35 H new ATOM 2518 N ALA A 163 0.136 3.943 1.132 1.00 1.55 N ATOM 2519 CA ALA A 163 -1.342 4.083 1.133 1.00 1.66 C ATOM 2520 C ALA A 163 -1.736 4.813 -0.152 1.00 1.75 C ATOM 2521 O ALA A 163 -2.428 4.283 -0.994 1.00 1.71 O ATOM 2522 CB ALA A 163 -1.780 4.909 2.349 1.00 1.89 C ATOM 0 H ALA A 163 0.619 4.365 1.925 1.00 1.55 H new ATOM 0 HA ALA A 163 -1.822 3.106 1.184 1.00 1.66 H new ATOM 0 HB1 ALA A 163 -2.865 5.011 2.348 1.00 1.89 H new ATOM 0 HB2 ALA A 163 -1.463 4.407 3.263 1.00 1.89 H new ATOM 0 HB3 ALA A 163 -1.323 5.897 2.301 1.00 1.89 H new ATOM 2528 N LYS A 164 -1.278 6.028 -0.300 1.00 1.91 N ATOM 2529 CA LYS A 164 -1.589 6.826 -1.521 1.00 2.08 C ATOM 2530 C LYS A 164 -1.544 5.934 -2.773 1.00 1.97 C ATOM 2531 O LYS A 164 -2.370 6.045 -3.657 1.00 2.05 O ATOM 2532 CB LYS A 164 -0.535 7.928 -1.670 1.00 2.23 C ATOM 2533 CG LYS A 164 -0.510 8.806 -0.416 1.00 2.54 C ATOM 2534 CD LYS A 164 -1.769 9.679 -0.360 1.00 2.78 C ATOM 2535 CE LYS A 164 -1.535 10.847 0.599 1.00 3.40 C ATOM 2536 NZ LYS A 164 -2.732 11.734 0.606 1.00 3.92 N ATOM 0 H LYS A 164 -0.693 6.508 0.384 1.00 1.91 H new ATOM 0 HA LYS A 164 -2.587 7.253 -1.421 1.00 2.08 H new ATOM 0 HB2 LYS A 164 0.447 7.483 -1.831 1.00 2.23 H new ATOM 0 HB3 LYS A 164 -0.757 8.538 -2.546 1.00 2.23 H new ATOM 0 HG2 LYS A 164 -0.452 8.180 0.475 1.00 2.54 H new ATOM 0 HG3 LYS A 164 0.379 9.436 -0.421 1.00 2.54 H new ATOM 0 HD2 LYS A 164 -2.010 10.054 -1.355 1.00 2.78 H new ATOM 0 HD3 LYS A 164 -2.621 9.086 -0.028 1.00 2.78 H new ATOM 0 HE2 LYS A 164 -1.341 10.472 1.604 1.00 3.40 H new ATOM 0 HE3 LYS A 164 -0.654 11.411 0.294 1.00 3.40 H new ATOM 0 HZ1 LYS A 164 -2.572 12.528 1.258 1.00 3.92 H new ATOM 0 HZ2 LYS A 164 -2.897 12.102 -0.353 1.00 3.92 H new ATOM 0 HZ3 LYS A 164 -3.564 11.192 0.917 1.00 3.92 H new ATOM 2550 N LEU A 165 -0.570 5.065 -2.857 1.00 1.86 N ATOM 2551 CA LEU A 165 -0.436 4.175 -4.054 1.00 1.84 C ATOM 2552 C LEU A 165 -1.744 3.403 -4.272 1.00 1.79 C ATOM 2553 O LEU A 165 -2.400 3.543 -5.284 1.00 1.94 O ATOM 2554 CB LEU A 165 0.721 3.189 -3.798 1.00 1.79 C ATOM 2555 CG LEU A 165 1.296 2.629 -5.115 1.00 1.81 C ATOM 2556 CD1 LEU A 165 0.171 2.159 -6.038 1.00 2.10 C ATOM 2557 CD2 LEU A 165 2.130 3.702 -5.829 1.00 2.29 C ATOM 0 H LEU A 165 0.145 4.931 -2.142 1.00 1.86 H new ATOM 0 HA LEU A 165 -0.229 4.768 -4.945 1.00 1.84 H new ATOM 0 HB2 LEU A 165 1.511 3.692 -3.241 1.00 1.79 H new ATOM 0 HB3 LEU A 165 0.367 2.366 -3.177 1.00 1.79 H new ATOM 0 HG LEU A 165 1.933 1.778 -4.873 1.00 1.81 H new ATOM 0 HD11 LEU A 165 0.598 1.768 -6.961 1.00 2.10 H new ATOM 0 HD12 LEU A 165 -0.403 1.376 -5.543 1.00 2.10 H new ATOM 0 HD13 LEU A 165 -0.485 2.998 -6.269 1.00 2.10 H new ATOM 0 HD21 LEU A 165 2.530 3.294 -6.757 1.00 2.29 H new ATOM 0 HD22 LEU A 165 1.500 4.563 -6.053 1.00 2.29 H new ATOM 0 HD23 LEU A 165 2.953 4.012 -5.185 1.00 2.29 H new ATOM 2569 N ALA A 166 -2.119 2.593 -3.328 1.00 1.64 N ATOM 2570 CA ALA A 166 -3.382 1.801 -3.455 1.00 1.66 C ATOM 2571 C ALA A 166 -4.592 2.711 -3.304 1.00 1.80 C ATOM 2572 O ALA A 166 -5.492 2.730 -4.118 1.00 1.96 O ATOM 2573 CB ALA A 166 -3.409 0.721 -2.364 1.00 1.56 C ATOM 0 H ALA A 166 -1.603 2.440 -2.462 1.00 1.64 H new ATOM 0 HA ALA A 166 -3.416 1.334 -4.439 1.00 1.66 H new ATOM 0 HB1 ALA A 166 -4.327 0.140 -2.450 1.00 1.56 H new ATOM 0 HB2 ALA A 166 -2.549 0.062 -2.483 1.00 1.56 H new ATOM 0 HB3 ALA A 166 -3.370 1.194 -1.383 1.00 1.56 H new ATOM 2579 N TYR A 167 -4.613 3.445 -2.249 1.00 1.81 N ATOM 2580 CA TYR A 167 -5.743 4.355 -1.970 1.00 2.02 C ATOM 2581 C TYR A 167 -6.169 5.095 -3.244 1.00 2.20 C ATOM 2582 O TYR A 167 -7.300 4.989 -3.675 1.00 2.32 O ATOM 2583 CB TYR A 167 -5.248 5.312 -0.894 1.00 2.08 C ATOM 2584 CG TYR A 167 -6.098 6.558 -0.793 1.00 2.37 C ATOM 2585 CD1 TYR A 167 -7.465 6.535 -1.108 1.00 2.53 C ATOM 2586 CD2 TYR A 167 -5.500 7.748 -0.364 1.00 2.51 C ATOM 2587 CE1 TYR A 167 -8.227 7.706 -0.992 1.00 2.81 C ATOM 2588 CE2 TYR A 167 -6.262 8.918 -0.250 1.00 2.81 C ATOM 2589 CZ TYR A 167 -7.626 8.897 -0.563 1.00 2.95 C ATOM 2590 OH TYR A 167 -8.379 10.048 -0.448 1.00 3.25 O ATOM 0 H TYR A 167 -3.875 3.456 -1.545 1.00 1.81 H new ATOM 0 HA TYR A 167 -6.627 3.816 -1.629 1.00 2.02 H new ATOM 0 HB2 TYR A 167 -5.243 4.800 0.068 1.00 2.08 H new ATOM 0 HB3 TYR A 167 -4.218 5.595 -1.110 1.00 2.08 H new ATOM 0 HD1 TYR A 167 -7.929 5.618 -1.439 1.00 2.53 H new ATOM 0 HD2 TYR A 167 -4.448 7.765 -0.120 1.00 2.51 H new ATOM 0 HE1 TYR A 167 -9.279 7.690 -1.234 1.00 2.81 H new ATOM 0 HE2 TYR A 167 -5.797 9.836 0.079 1.00 2.81 H new ATOM 0 HH TYR A 167 -7.809 10.782 -0.137 1.00 3.25 H new ATOM 2600 N LEU A 168 -5.286 5.830 -3.857 1.00 2.27 N ATOM 2601 CA LEU A 168 -5.658 6.560 -5.099 1.00 2.50 C ATOM 2602 C LEU A 168 -5.931 5.574 -6.239 1.00 2.48 C ATOM 2603 O LEU A 168 -6.461 5.935 -7.271 1.00 2.68 O ATOM 2604 CB LEU A 168 -4.497 7.457 -5.510 1.00 2.60 C ATOM 2605 CG LEU A 168 -4.143 8.417 -4.375 1.00 2.75 C ATOM 2606 CD1 LEU A 168 -2.925 9.248 -4.785 1.00 2.87 C ATOM 2607 CD2 LEU A 168 -5.329 9.349 -4.095 1.00 2.99 C ATOM 0 H LEU A 168 -4.321 5.957 -3.551 1.00 2.27 H new ATOM 0 HA LEU A 168 -6.556 7.147 -4.906 1.00 2.50 H new ATOM 0 HB2 LEU A 168 -3.630 6.848 -5.764 1.00 2.60 H new ATOM 0 HB3 LEU A 168 -4.763 8.022 -6.404 1.00 2.60 H new ATOM 0 HG LEU A 168 -3.916 7.848 -3.473 1.00 2.75 H new ATOM 0 HD11 LEU A 168 -2.666 9.936 -3.980 1.00 2.87 H new ATOM 0 HD12 LEU A 168 -2.082 8.586 -4.981 1.00 2.87 H new ATOM 0 HD13 LEU A 168 -3.158 9.815 -5.686 1.00 2.87 H new ATOM 0 HD21 LEU A 168 -5.072 10.032 -3.285 1.00 2.99 H new ATOM 0 HD22 LEU A 168 -5.561 9.922 -4.993 1.00 2.99 H new ATOM 0 HD23 LEU A 168 -6.198 8.756 -3.808 1.00 2.99 H new ATOM 2619 N GLN A 169 -5.559 4.340 -6.068 1.00 2.29 N ATOM 2620 CA GLN A 169 -5.775 3.333 -7.148 1.00 2.34 C ATOM 2621 C GLN A 169 -7.191 2.797 -7.073 1.00 2.38 C ATOM 2622 O GLN A 169 -7.860 2.631 -8.069 1.00 2.60 O ATOM 2623 CB GLN A 169 -4.789 2.176 -6.986 1.00 2.18 C ATOM 2624 CG GLN A 169 -4.970 1.195 -8.146 1.00 2.34 C ATOM 2625 CD GLN A 169 -3.797 0.213 -8.181 1.00 2.55 C ATOM 2626 OE1 GLN A 169 -2.942 0.236 -7.319 1.00 2.98 O ATOM 2627 NE2 GLN A 169 -3.721 -0.655 -9.154 1.00 2.89 N ATOM 0 H GLN A 169 -5.112 3.980 -5.224 1.00 2.29 H new ATOM 0 HA GLN A 169 -5.616 3.812 -8.114 1.00 2.34 H new ATOM 0 HB2 GLN A 169 -3.767 2.553 -6.969 1.00 2.18 H new ATOM 0 HB3 GLN A 169 -4.957 1.669 -6.036 1.00 2.18 H new ATOM 0 HG2 GLN A 169 -5.908 0.652 -8.032 1.00 2.34 H new ATOM 0 HG3 GLN A 169 -5.029 1.739 -9.089 1.00 2.34 H new ATOM 0 HE21 GLN A 169 -4.439 -0.674 -9.878 1.00 2.89 H new ATOM 0 HE22 GLN A 169 -2.943 -1.314 -9.190 1.00 2.89 H new ATOM 2636 N ILE A 170 -7.650 2.536 -5.896 1.00 2.23 N ATOM 2637 CA ILE A 170 -9.032 2.028 -5.738 1.00 2.33 C ATOM 2638 C ILE A 170 -9.964 3.032 -6.396 1.00 2.58 C ATOM 2639 O ILE A 170 -10.988 2.688 -6.951 1.00 2.77 O ATOM 2640 CB ILE A 170 -9.388 1.945 -4.250 1.00 2.22 C ATOM 2641 CG1 ILE A 170 -8.618 0.801 -3.579 1.00 2.31 C ATOM 2642 CG2 ILE A 170 -10.891 1.701 -4.099 1.00 2.65 C ATOM 2643 CD1 ILE A 170 -8.501 1.088 -2.084 1.00 2.64 C ATOM 0 H ILE A 170 -7.127 2.652 -5.028 1.00 2.23 H new ATOM 0 HA ILE A 170 -9.123 1.039 -6.187 1.00 2.33 H new ATOM 0 HB ILE A 170 -9.114 2.885 -3.770 1.00 2.22 H new ATOM 0 HG12 ILE A 170 -9.134 -0.145 -3.741 1.00 2.31 H new ATOM 0 HG13 ILE A 170 -7.627 0.704 -4.022 1.00 2.31 H new ATOM 0 HG21 ILE A 170 -11.145 1.642 -3.041 1.00 2.65 H new ATOM 0 HG22 ILE A 170 -11.441 2.522 -4.559 1.00 2.65 H new ATOM 0 HG23 ILE A 170 -11.159 0.765 -4.589 1.00 2.65 H new ATOM 0 HD11 ILE A 170 -7.955 0.279 -1.600 1.00 2.64 H new ATOM 0 HD12 ILE A 170 -7.967 2.027 -1.934 1.00 2.64 H new ATOM 0 HD13 ILE A 170 -9.498 1.164 -1.649 1.00 2.64 H new ATOM 2655 N LEU A 171 -9.600 4.283 -6.338 1.00 2.64 N ATOM 2656 CA LEU A 171 -10.453 5.327 -6.959 1.00 2.93 C ATOM 2657 C LEU A 171 -10.461 5.097 -8.458 1.00 3.08 C ATOM 2658 O LEU A 171 -11.477 5.179 -9.120 1.00 3.31 O ATOM 2659 CB LEU A 171 -9.907 6.725 -6.649 1.00 3.03 C ATOM 2660 CG LEU A 171 -9.554 6.831 -5.164 1.00 2.95 C ATOM 2661 CD1 LEU A 171 -9.124 8.264 -4.846 1.00 3.36 C ATOM 2662 CD2 LEU A 171 -10.774 6.468 -4.313 1.00 2.98 C ATOM 0 H LEU A 171 -8.751 4.624 -5.888 1.00 2.64 H new ATOM 0 HA LEU A 171 -11.464 5.264 -6.557 1.00 2.93 H new ATOM 0 HB2 LEU A 171 -9.024 6.922 -7.256 1.00 3.03 H new ATOM 0 HB3 LEU A 171 -10.648 7.480 -6.910 1.00 3.03 H new ATOM 0 HG LEU A 171 -8.739 6.143 -4.938 1.00 2.95 H new ATOM 0 HD11 LEU A 171 -8.872 8.342 -3.788 1.00 3.36 H new ATOM 0 HD12 LEU A 171 -8.253 8.524 -5.447 1.00 3.36 H new ATOM 0 HD13 LEU A 171 -9.941 8.948 -5.076 1.00 3.36 H new ATOM 0 HD21 LEU A 171 -10.517 6.545 -3.257 1.00 2.98 H new ATOM 0 HD22 LEU A 171 -11.592 7.153 -4.538 1.00 2.98 H new ATOM 0 HD23 LEU A 171 -11.083 5.447 -4.537 1.00 2.98 H new ATOM 2674 N SER A 172 -9.317 4.795 -8.984 1.00 2.99 N ATOM 2675 CA SER A 172 -9.196 4.533 -10.437 1.00 3.19 C ATOM 2676 C SER A 172 -9.748 3.143 -10.746 1.00 3.19 C ATOM 2677 O SER A 172 -10.097 2.844 -11.871 1.00 3.45 O ATOM 2678 CB SER A 172 -7.723 4.595 -10.840 1.00 3.17 C ATOM 2679 OG SER A 172 -7.191 5.862 -10.480 1.00 3.48 O ATOM 0 H SER A 172 -8.445 4.717 -8.461 1.00 2.99 H new ATOM 0 HA SER A 172 -9.759 5.282 -10.994 1.00 3.19 H new ATOM 0 HB2 SER A 172 -7.165 3.800 -10.346 1.00 3.17 H new ATOM 0 HB3 SER A 172 -7.621 4.436 -11.914 1.00 3.17 H new ATOM 0 HG SER A 172 -6.995 5.874 -9.520 1.00 3.48 H new ATOM 2685 N GLU A 173 -9.826 2.279 -9.765 1.00 2.93 N ATOM 2686 CA GLU A 173 -10.351 0.912 -10.046 1.00 3.00 C ATOM 2687 C GLU A 173 -11.862 0.975 -10.291 1.00 3.18 C ATOM 2688 O GLU A 173 -12.641 1.187 -9.382 1.00 3.13 O ATOM 2689 CB GLU A 173 -10.069 -0.014 -8.861 1.00 2.75 C ATOM 2690 CG GLU A 173 -8.562 -0.285 -8.761 1.00 2.73 C ATOM 2691 CD GLU A 173 -8.189 -1.473 -9.651 1.00 3.16 C ATOM 2692 OE1 GLU A 173 -8.844 -1.657 -10.664 1.00 3.58 O ATOM 2693 OE2 GLU A 173 -7.254 -2.177 -9.306 1.00 3.49 O ATOM 0 H GLU A 173 -9.554 2.458 -8.798 1.00 2.93 H new ATOM 0 HA GLU A 173 -9.854 0.522 -10.934 1.00 3.00 H new ATOM 0 HB2 GLU A 173 -10.428 0.442 -7.938 1.00 2.75 H new ATOM 0 HB3 GLU A 173 -10.609 -0.953 -8.984 1.00 2.75 H new ATOM 0 HG2 GLU A 173 -8.003 0.600 -9.066 1.00 2.73 H new ATOM 0 HG3 GLU A 173 -8.288 -0.494 -7.727 1.00 2.73 H new ATOM 2700 N GLU A 174 -12.282 0.787 -11.515 1.00 3.45 N ATOM 2701 CA GLU A 174 -13.736 0.829 -11.826 1.00 3.69 C ATOM 2702 C GLU A 174 -14.359 -0.534 -11.521 1.00 3.70 C ATOM 2703 O GLU A 174 -15.552 -0.727 -11.650 1.00 3.93 O ATOM 2704 CB GLU A 174 -13.933 1.155 -13.309 1.00 4.04 C ATOM 2705 CG GLU A 174 -13.048 0.236 -14.154 1.00 4.03 C ATOM 2706 CD GLU A 174 -13.421 0.378 -15.631 1.00 4.45 C ATOM 2707 OE1 GLU A 174 -13.275 1.469 -16.157 1.00 4.90 O ATOM 2708 OE2 GLU A 174 -13.845 -0.608 -16.212 1.00 4.62 O ATOM 0 H GLU A 174 -11.675 0.606 -12.314 1.00 3.45 H new ATOM 0 HA GLU A 174 -14.215 1.596 -11.218 1.00 3.69 H new ATOM 0 HB2 GLU A 174 -14.979 1.025 -13.585 1.00 4.04 H new ATOM 0 HB3 GLU A 174 -13.680 2.198 -13.500 1.00 4.04 H new ATOM 0 HG2 GLU A 174 -11.998 0.491 -14.008 1.00 4.03 H new ATOM 0 HG3 GLU A 174 -13.172 -0.799 -13.835 1.00 4.03 H new ATOM 2715 N THR A 175 -13.557 -1.483 -11.120 1.00 3.52 N ATOM 2716 CA THR A 175 -14.093 -2.840 -10.809 1.00 3.60 C ATOM 2717 C THR A 175 -14.566 -2.883 -9.353 1.00 3.47 C ATOM 2718 O THR A 175 -14.181 -2.065 -8.540 1.00 3.36 O ATOM 2719 CB THR A 175 -12.989 -3.884 -11.010 1.00 3.66 C ATOM 2720 OG1 THR A 175 -13.459 -5.154 -10.582 1.00 3.75 O ATOM 2721 CG2 THR A 175 -11.760 -3.489 -10.191 1.00 4.09 C ATOM 0 H THR A 175 -12.550 -1.377 -10.994 1.00 3.52 H new ATOM 0 HA THR A 175 -14.930 -3.058 -11.473 1.00 3.60 H new ATOM 0 HB THR A 175 -12.719 -3.933 -12.065 1.00 3.66 H new ATOM 0 HG1 THR A 175 -12.755 -5.824 -10.711 1.00 3.75 H new ATOM 0 HG21 THR A 175 -10.974 -4.231 -10.333 1.00 4.09 H new ATOM 0 HG22 THR A 175 -11.402 -2.513 -10.520 1.00 4.09 H new ATOM 0 HG23 THR A 175 -12.027 -3.441 -9.135 1.00 4.09 H new ATOM 2729 N GLY A 176 -15.396 -3.833 -9.017 1.00 3.72 N ATOM 2730 CA GLY A 176 -15.891 -3.932 -7.614 1.00 3.90 C ATOM 2731 C GLY A 176 -16.834 -2.765 -7.321 1.00 4.17 C ATOM 2732 O GLY A 176 -17.194 -2.515 -6.187 1.00 4.56 O ATOM 0 H GLY A 176 -15.753 -4.545 -9.654 1.00 3.72 H new ATOM 0 HA2 GLY A 176 -16.411 -4.879 -7.467 1.00 3.90 H new ATOM 0 HA3 GLY A 176 -15.051 -3.918 -6.919 1.00 3.90 H new ATOM 2736 N SER A 177 -17.236 -2.047 -8.335 1.00 4.28 N ATOM 2737 CA SER A 177 -18.156 -0.893 -8.122 1.00 4.82 C ATOM 2738 C SER A 177 -19.588 -1.311 -8.460 1.00 4.92 C ATOM 2739 O SER A 177 -20.323 -1.786 -7.617 1.00 5.47 O ATOM 2740 CB SER A 177 -17.737 0.261 -9.032 1.00 5.26 C ATOM 2741 OG SER A 177 -18.824 1.166 -9.173 1.00 5.66 O ATOM 0 H SER A 177 -16.966 -2.211 -9.305 1.00 4.28 H new ATOM 0 HA SER A 177 -18.107 -0.576 -7.080 1.00 4.82 H new ATOM 0 HB2 SER A 177 -16.873 0.775 -8.612 1.00 5.26 H new ATOM 0 HB3 SER A 177 -17.437 -0.121 -10.008 1.00 5.26 H new ATOM 0 HG SER A 177 -18.558 1.908 -9.755 1.00 5.66 H new ATOM 2747 N GLY A 178 -19.989 -1.137 -9.690 1.00 4.65 N ATOM 2748 CA GLY A 178 -21.373 -1.523 -10.085 1.00 5.04 C ATOM 2749 C GLY A 178 -21.441 -3.037 -10.280 1.00 5.29 C ATOM 2750 O GLY A 178 -22.479 -3.586 -10.595 1.00 5.76 O ATOM 0 H GLY A 178 -19.418 -0.744 -10.438 1.00 4.65 H new ATOM 0 HA2 GLY A 178 -22.082 -1.212 -9.318 1.00 5.04 H new ATOM 0 HA3 GLY A 178 -21.656 -1.013 -11.006 1.00 5.04 H new ATOM 2754 N CYS A 179 -20.340 -3.716 -10.093 1.00 5.26 N ATOM 2755 CA CYS A 179 -20.328 -5.199 -10.263 1.00 5.96 C ATOM 2756 C CYS A 179 -19.965 -5.859 -8.932 1.00 6.17 C ATOM 2757 O CYS A 179 -20.764 -6.641 -8.444 1.00 6.41 O ATOM 2758 CB CYS A 179 -19.291 -5.580 -11.320 1.00 6.31 C ATOM 2759 SG CYS A 179 -19.464 -7.335 -11.726 1.00 6.84 S ATOM 2760 OXT CYS A 179 -18.894 -5.571 -8.423 1.00 6.39 O ATOM 0 H CYS A 179 -19.445 -3.305 -9.829 1.00 5.26 H new ATOM 0 HA CYS A 179 -21.314 -5.539 -10.581 1.00 5.96 H new ATOM 0 HB2 CYS A 179 -19.428 -4.973 -12.215 1.00 6.31 H new ATOM 0 HB3 CYS A 179 -18.286 -5.379 -10.949 1.00 6.31 H new ATOM 0 HG CYS A 179 -18.585 -7.661 -12.626 1.00 6.84 H new TER 2766 CYS A 179