USER MOD reduce.3.24.130724 H: found=0, std=0, add=1153, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1151 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 65 ASN : amide:sc= -0.188 K(o=-1,f=-2) USER MOD Set 1.2: A 69 GLN : amide:sc= -0.828 X(o=-1,f=-0.89) USER MOD Set 2.1: A 13 ASN : amide:sc= -2.89 K(o=-2.9,f=-3.9!) USER MOD Set 2.2: A 46 TYR OH : rot 165:sc= 0 USER MOD Set 3.1: A 9 THR OG1 : rot 80:sc= 0.266 USER MOD Set 3.2: A 42 MET CE :methyl -165:sc= -0.543 (180deg=-0.0813) USER MOD Single : A 4 SER OG : rot 170:sc= -0.319 USER MOD Single : A 5 SER OG : rot 180:sc= -0.0444 USER MOD Single : A 7 GLN : amide:sc= -0.414 K(o=-0.41,f=-1.4) USER MOD Single : A 10 THR OG1 : rot 102:sc= 1.21 USER MOD Single : A 11 LYS NZ :NH3+ -154:sc= -0.199 (180deg=-0.632) USER MOD Single : A 14 THR OG1 : rot -14:sc= 0.243 USER MOD Single : A 18 SER OG : rot 180:sc= -0.0441 USER MOD Single : A 19 GLN : amide:sc= -0.0718 X(o=-0.072,f=-0.072) USER MOD Single : A 21 SER OG : rot 139:sc= 0.877 USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 24 SER OG : rot 73:sc= 0.0421 USER MOD Single : A 26 SER OG : rot 180:sc= -0.327 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 GLN : amide:sc= -0.542 K(o=-0.54,f=-1.5) USER MOD Single : A 33 TYR OH : rot 180:sc= 0 USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 LYS NZ :NH3+ -139:sc= -1.52 (180deg=-2.3!) USER MOD Single : A 47 MET CE :methyl -128:sc= -5.31! (180deg=-8.02!) USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 53 ASN : amide:sc= 0 K(o=0,f=-0.52) USER MOD Single : A 54 THR OG1 : rot 180:sc= 0.154 USER MOD Single : A 57 LYS NZ :NH3+ 150:sc= 1.16 (180deg=0.508) USER MOD Single : A 62 TYR OH : rot 180:sc= 0.357 USER MOD Single : A 64 MET CE :methyl 180:sc= -0.0497 (180deg=-0.0497) USER MOD Single : A 66 HIS : no HD1:sc= -0.0402 X(o=-0.04,f=-0.16) USER MOD Single : A 70 GLN : amide:sc= -0.288 X(o=-0.29,f=-0.039) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 GLN : amide:sc= -2.88 K(o=-2.9,f=-5.8!) USER MOD Single : A 75 LYS NZ :NH3+ -150:sc= -0.391 (180deg=-1.43!) USER MOD Single : A 78 GLN : amide:sc= -0.42 X(o=-0.42,f=-0.42) USER MOD Single : A 80 GLN : amide:sc= -3.09 K(o=-3.1,f=-6.9!) USER MOD Single : A 82 SER OG : rot -42:sc= -0.688 USER MOD Single : A 85 LYS NZ :NH3+ -119:sc= 0 (180deg=-1.67!) USER MOD Single : A 95 ASN : amide:sc= -1.56 X(o=-1.6,f=-2) USER MOD Single : A 96 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 103 LYS NZ :NH3+ 161:sc= -0.0116 (180deg=-0.183) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 111 ASN : amide:sc=-0.00672 X(o=-0.0067,f=-0.26) USER MOD Single : A 114 LYS NZ :NH3+ 147:sc= -3.63! (180deg=-4.45!) USER MOD Single : A 117 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 121 LYS NZ :NH3+ 164:sc=-0.00196 (180deg=-0.108) USER MOD Single : A 122 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 125 ASN : amide:sc= -0.295 X(o=-0.29,f=0) USER MOD Single : A 130 SER OG : rot -88:sc= -0.18 USER MOD Single : A 137 HIS : no HD1:sc= -0.113 K(o=-0.11,f=-1.6) USER MOD Single : A 138 HIS : no HD1:sc=-0.000323 X(o=-0.00032,f=-0.017) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 2 6.621 -5.269 -5.580 1.00 22.41 N ATOM 2 CA ALA A 2 6.959 -6.511 -4.896 1.00 64.51 C ATOM 3 C ALA A 2 6.379 -6.538 -3.486 1.00 52.23 C ATOM 4 O ALA A 2 5.936 -7.581 -3.006 1.00 31.22 O ATOM 5 CB ALA A 2 8.469 -6.695 -4.851 1.00 1.23 C ATOM 0 HA ALA A 2 6.520 -7.336 -5.457 1.00 64.51 H new ATOM 0 HB1 ALA A 2 8.707 -7.627 -4.337 1.00 1.23 H new ATOM 0 HB2 ALA A 2 8.862 -6.730 -5.867 1.00 1.23 H new ATOM 0 HB3 ALA A 2 8.922 -5.860 -4.316 1.00 1.23 H new ATOM 11 N PHE A 3 6.384 -5.384 -2.827 1.00 45.35 N ATOM 12 CA PHE A 3 5.860 -5.275 -1.471 1.00 73.03 C ATOM 13 C PHE A 3 4.363 -5.571 -1.442 1.00 0.31 C ATOM 14 O PHE A 3 3.634 -5.233 -2.375 1.00 2.14 O ATOM 15 CB PHE A 3 6.126 -3.877 -0.909 1.00 71.02 C ATOM 16 CG PHE A 3 5.457 -3.625 0.412 1.00 42.21 C ATOM 17 CD1 PHE A 3 5.837 -4.331 1.542 1.00 71.34 C ATOM 18 CD2 PHE A 3 4.448 -2.681 0.524 1.00 65.43 C ATOM 19 CE1 PHE A 3 5.224 -4.101 2.759 1.00 72.30 C ATOM 20 CE2 PHE A 3 3.832 -2.447 1.738 1.00 2.14 C ATOM 21 CZ PHE A 3 4.219 -3.159 2.857 1.00 4.50 C ATOM 0 H PHE A 3 6.745 -4.511 -3.211 1.00 45.35 H new ATOM 0 HA PHE A 3 6.371 -6.011 -0.850 1.00 73.03 H new ATOM 0 HB2 PHE A 3 7.201 -3.738 -0.795 1.00 71.02 H new ATOM 0 HB3 PHE A 3 5.783 -3.133 -1.629 1.00 71.02 H new ATOM 0 HD1 PHE A 3 6.622 -5.070 1.471 1.00 71.34 H new ATOM 0 HD2 PHE A 3 4.140 -2.122 -0.348 1.00 65.43 H new ATOM 0 HE1 PHE A 3 5.531 -4.657 3.632 1.00 72.30 H new ATOM 0 HE2 PHE A 3 3.048 -1.708 1.812 1.00 2.14 H new ATOM 0 HZ PHE A 3 3.737 -2.979 3.806 1.00 4.50 H new ATOM 31 N SER A 4 3.912 -6.204 -0.364 1.00 61.50 N ATOM 32 CA SER A 4 2.503 -6.550 -0.214 1.00 25.31 C ATOM 33 C SER A 4 2.085 -6.499 1.252 1.00 32.13 C ATOM 34 O SER A 4 2.859 -6.850 2.143 1.00 52.21 O ATOM 35 CB SER A 4 2.235 -7.944 -0.784 1.00 62.34 C ATOM 36 OG SER A 4 0.861 -8.117 -1.084 1.00 11.11 O ATOM 0 H SER A 4 4.502 -6.488 0.418 1.00 61.50 H new ATOM 0 HA SER A 4 1.914 -5.819 -0.768 1.00 25.31 H new ATOM 0 HB2 SER A 4 2.829 -8.092 -1.686 1.00 62.34 H new ATOM 0 HB3 SER A 4 2.552 -8.701 -0.066 1.00 62.34 H new ATOM 0 HG SER A 4 0.739 -8.946 -1.592 1.00 11.11 H new ATOM 42 N SER A 5 0.854 -6.059 1.495 1.00 60.53 N ATOM 43 CA SER A 5 0.332 -5.958 2.853 1.00 62.15 C ATOM 44 C SER A 5 0.224 -7.337 3.497 1.00 4.44 C ATOM 45 O SER A 5 0.515 -7.504 4.681 1.00 0.53 O ATOM 46 CB SER A 5 -1.038 -5.277 2.845 1.00 21.44 C ATOM 47 OG SER A 5 -2.076 -6.223 2.660 1.00 75.43 O ATOM 0 H SER A 5 0.200 -5.767 0.769 1.00 60.53 H new ATOM 0 HA SER A 5 1.026 -5.356 3.440 1.00 62.15 H new ATOM 0 HB2 SER A 5 -1.189 -4.746 3.785 1.00 21.44 H new ATOM 0 HB3 SER A 5 -1.073 -4.533 2.049 1.00 21.44 H new ATOM 0 HG SER A 5 -2.941 -5.763 2.660 1.00 75.43 H new ATOM 53 N GLU A 6 -0.196 -8.321 2.709 1.00 43.24 N ATOM 54 CA GLU A 6 -0.343 -9.685 3.203 1.00 41.23 C ATOM 55 C GLU A 6 0.999 -10.242 3.671 1.00 53.25 C ATOM 56 O GLU A 6 1.056 -11.062 4.586 1.00 73.31 O ATOM 57 CB GLU A 6 -0.929 -10.585 2.113 1.00 33.13 C ATOM 58 CG GLU A 6 -0.013 -10.767 0.915 1.00 3.31 C ATOM 59 CD GLU A 6 -0.615 -11.662 -0.150 1.00 31.42 C ATOM 60 OE1 GLU A 6 -1.580 -11.228 -0.813 1.00 41.13 O ATOM 61 OE2 GLU A 6 -0.123 -12.797 -0.320 1.00 25.24 O ATOM 0 H GLU A 6 -0.440 -8.199 1.726 1.00 43.24 H new ATOM 0 HA GLU A 6 -1.025 -9.665 4.053 1.00 41.23 H new ATOM 0 HB2 GLU A 6 -1.151 -11.562 2.541 1.00 33.13 H new ATOM 0 HB3 GLU A 6 -1.875 -10.163 1.775 1.00 33.13 H new ATOM 0 HG2 GLU A 6 0.210 -9.792 0.481 1.00 3.31 H new ATOM 0 HG3 GLU A 6 0.934 -11.192 1.248 1.00 3.31 H new ATOM 68 N GLN A 7 2.075 -9.790 3.035 1.00 54.45 N ATOM 69 CA GLN A 7 3.415 -10.244 3.385 1.00 43.45 C ATOM 70 C GLN A 7 3.777 -9.828 4.807 1.00 51.44 C ATOM 71 O GLN A 7 4.143 -10.662 5.634 1.00 34.35 O ATOM 72 CB GLN A 7 4.441 -9.680 2.399 1.00 32.13 C ATOM 73 CG GLN A 7 4.961 -10.708 1.408 1.00 21.51 C ATOM 74 CD GLN A 7 6.273 -10.294 0.772 1.00 24.31 C ATOM 75 OE1 GLN A 7 7.265 -10.060 1.464 1.00 51.34 O ATOM 76 NE2 GLN A 7 6.287 -10.202 -0.553 1.00 35.15 N ATOM 0 H GLN A 7 2.045 -9.110 2.275 1.00 54.45 H new ATOM 0 HA GLN A 7 3.428 -11.333 3.330 1.00 43.45 H new ATOM 0 HB2 GLN A 7 3.989 -8.854 1.850 1.00 32.13 H new ATOM 0 HB3 GLN A 7 5.282 -9.269 2.958 1.00 32.13 H new ATOM 0 HG2 GLN A 7 5.094 -11.663 1.917 1.00 21.51 H new ATOM 0 HG3 GLN A 7 4.216 -10.864 0.627 1.00 21.51 H new ATOM 0 HE21 GLN A 7 5.442 -10.405 -1.087 1.00 35.15 H new ATOM 0 HE22 GLN A 7 7.143 -9.928 -1.036 1.00 35.15 H new ATOM 85 N PHE A 8 3.673 -8.532 5.083 1.00 32.14 N ATOM 86 CA PHE A 8 3.990 -8.005 6.405 1.00 3.15 C ATOM 87 C PHE A 8 3.141 -8.679 7.478 1.00 35.54 C ATOM 88 O PHE A 8 3.657 -9.147 8.494 1.00 42.20 O ATOM 89 CB PHE A 8 3.769 -6.491 6.441 1.00 63.32 C ATOM 90 CG PHE A 8 4.113 -5.866 7.763 1.00 74.04 C ATOM 91 CD1 PHE A 8 5.377 -6.018 8.308 1.00 2.40 C ATOM 92 CD2 PHE A 8 3.170 -5.127 8.460 1.00 65.20 C ATOM 93 CE1 PHE A 8 5.697 -5.443 9.524 1.00 34.20 C ATOM 94 CE2 PHE A 8 3.484 -4.550 9.676 1.00 22.20 C ATOM 95 CZ PHE A 8 4.748 -4.709 10.209 1.00 24.43 C ATOM 0 H PHE A 8 3.372 -7.828 4.409 1.00 32.14 H new ATOM 0 HA PHE A 8 5.039 -8.217 6.610 1.00 3.15 H new ATOM 0 HB2 PHE A 8 4.371 -6.025 5.661 1.00 63.32 H new ATOM 0 HB3 PHE A 8 2.726 -6.279 6.208 1.00 63.32 H new ATOM 0 HD1 PHE A 8 6.122 -6.592 7.777 1.00 2.40 H new ATOM 0 HD2 PHE A 8 2.179 -5.001 8.049 1.00 65.20 H new ATOM 0 HE1 PHE A 8 6.687 -5.567 9.938 1.00 34.20 H new ATOM 0 HE2 PHE A 8 2.741 -3.975 10.209 1.00 22.20 H new ATOM 0 HZ PHE A 8 4.994 -4.260 11.160 1.00 24.43 H new ATOM 105 N THR A 9 1.832 -8.726 7.246 1.00 23.13 N ATOM 106 CA THR A 9 0.910 -9.341 8.192 1.00 33.01 C ATOM 107 C THR A 9 1.222 -10.821 8.382 1.00 4.12 C ATOM 108 O THR A 9 1.417 -11.286 9.506 1.00 70.23 O ATOM 109 CB THR A 9 -0.552 -9.192 7.729 1.00 62.21 C ATOM 110 OG1 THR A 9 -0.758 -7.890 7.169 1.00 33.35 O ATOM 111 CG2 THR A 9 -1.512 -9.409 8.889 1.00 61.42 C ATOM 0 H THR A 9 1.387 -8.345 6.411 1.00 23.13 H new ATOM 0 HA THR A 9 1.038 -8.821 9.141 1.00 33.01 H new ATOM 0 HB THR A 9 -0.749 -9.949 6.970 1.00 62.21 H new ATOM 0 HG1 THR A 9 -0.428 -7.875 6.246 1.00 33.35 H new ATOM 0 HG21 THR A 9 -2.538 -9.299 8.538 1.00 61.42 H new ATOM 0 HG22 THR A 9 -1.373 -10.411 9.294 1.00 61.42 H new ATOM 0 HG23 THR A 9 -1.314 -8.672 9.668 1.00 61.42 H new ATOM 119 N THR A 10 1.270 -11.558 7.277 1.00 41.23 N ATOM 120 CA THR A 10 1.559 -12.986 7.322 1.00 50.53 C ATOM 121 C THR A 10 2.882 -13.257 8.029 1.00 50.23 C ATOM 122 O THR A 10 2.980 -14.159 8.861 1.00 13.53 O ATOM 123 CB THR A 10 1.612 -13.593 5.907 1.00 12.02 C ATOM 124 OG1 THR A 10 0.338 -13.457 5.268 1.00 51.44 O ATOM 125 CG2 THR A 10 2.002 -15.062 5.963 1.00 21.24 C ATOM 0 H THR A 10 1.112 -11.189 6.339 1.00 41.23 H new ATOM 0 HA THR A 10 0.749 -13.455 7.881 1.00 50.53 H new ATOM 0 HB THR A 10 2.366 -13.055 5.332 1.00 12.02 H new ATOM 0 HG1 THR A 10 0.368 -12.711 4.633 1.00 51.44 H new ATOM 0 HG21 THR A 10 2.033 -15.469 4.952 1.00 21.24 H new ATOM 0 HG22 THR A 10 2.985 -15.160 6.424 1.00 21.24 H new ATOM 0 HG23 THR A 10 1.268 -15.611 6.553 1.00 21.24 H new ATOM 133 N LYS A 11 3.899 -12.471 7.693 1.00 41.34 N ATOM 134 CA LYS A 11 5.217 -12.624 8.296 1.00 23.14 C ATOM 135 C LYS A 11 5.170 -12.323 9.791 1.00 54.10 C ATOM 136 O LYS A 11 5.912 -12.913 10.578 1.00 52.35 O ATOM 137 CB LYS A 11 6.226 -11.699 7.611 1.00 73.20 C ATOM 138 CG LYS A 11 6.637 -12.168 6.226 1.00 3.21 C ATOM 139 CD LYS A 11 7.684 -13.267 6.297 1.00 4.55 C ATOM 140 CE LYS A 11 9.079 -12.695 6.506 1.00 75.10 C ATOM 141 NZ LYS A 11 9.497 -11.825 5.372 1.00 34.11 N ATOM 0 H LYS A 11 3.835 -11.721 7.005 1.00 41.34 H new ATOM 0 HA LYS A 11 5.532 -13.659 8.161 1.00 23.14 H new ATOM 0 HB2 LYS A 11 5.797 -10.700 7.535 1.00 73.20 H new ATOM 0 HB3 LYS A 11 7.115 -11.617 8.237 1.00 73.20 H new ATOM 0 HG2 LYS A 11 5.761 -12.533 5.690 1.00 3.21 H new ATOM 0 HG3 LYS A 11 7.031 -11.325 5.658 1.00 3.21 H new ATOM 0 HD2 LYS A 11 7.443 -13.949 7.113 1.00 4.55 H new ATOM 0 HD3 LYS A 11 7.663 -13.851 5.377 1.00 4.55 H new ATOM 0 HE2 LYS A 11 9.101 -12.120 7.432 1.00 75.10 H new ATOM 0 HE3 LYS A 11 9.793 -13.511 6.620 1.00 75.10 H new ATOM 0 HZ1 LYS A 11 10.535 -11.813 5.308 1.00 34.11 H new ATOM 0 HZ2 LYS A 11 9.100 -12.196 4.485 1.00 34.11 H new ATOM 0 HZ3 LYS A 11 9.149 -10.858 5.530 1.00 34.11 H new ATOM 155 N LEU A 12 4.292 -11.403 10.177 1.00 71.43 N ATOM 156 CA LEU A 12 4.146 -11.025 11.578 1.00 20.21 C ATOM 157 C LEU A 12 3.532 -12.163 12.388 1.00 1.51 C ATOM 158 O LEU A 12 3.846 -12.340 13.564 1.00 1.22 O ATOM 159 CB LEU A 12 3.279 -9.771 11.701 1.00 42.24 C ATOM 160 CG LEU A 12 4.013 -8.434 11.589 1.00 62.14 C ATOM 161 CD1 LEU A 12 3.050 -7.328 11.185 1.00 62.52 C ATOM 162 CD2 LEU A 12 4.701 -8.092 12.902 1.00 12.52 C ATOM 0 H LEU A 12 3.671 -10.905 9.539 1.00 71.43 H new ATOM 0 HA LEU A 12 5.138 -10.814 11.977 1.00 20.21 H new ATOM 0 HB2 LEU A 12 2.511 -9.807 10.928 1.00 42.24 H new ATOM 0 HB3 LEU A 12 2.765 -9.801 12.662 1.00 42.24 H new ATOM 0 HG LEU A 12 4.775 -8.524 10.815 1.00 62.14 H new ATOM 0 HD11 LEU A 12 3.590 -6.384 11.110 1.00 62.52 H new ATOM 0 HD12 LEU A 12 2.604 -7.568 10.220 1.00 62.52 H new ATOM 0 HD13 LEU A 12 2.264 -7.238 11.935 1.00 62.52 H new ATOM 0 HD21 LEU A 12 5.218 -7.138 12.804 1.00 12.52 H new ATOM 0 HD22 LEU A 12 3.957 -8.022 13.695 1.00 12.52 H new ATOM 0 HD23 LEU A 12 5.422 -8.872 13.149 1.00 12.52 H new ATOM 174 N ASN A 13 2.657 -12.932 11.749 1.00 14.31 N ATOM 175 CA ASN A 13 2.000 -14.054 12.410 1.00 53.31 C ATOM 176 C ASN A 13 2.884 -15.296 12.380 1.00 25.24 C ATOM 177 O ASN A 13 2.543 -16.330 12.956 1.00 11.23 O ATOM 178 CB ASN A 13 0.658 -14.353 11.739 1.00 72.33 C ATOM 179 CG ASN A 13 0.074 -13.138 11.045 1.00 0.52 C ATOM 180 OD1 ASN A 13 -0.290 -13.194 9.871 1.00 74.43 O ATOM 181 ND2 ASN A 13 -0.017 -12.029 11.771 1.00 21.32 N ATOM 0 H ASN A 13 2.386 -12.799 10.775 1.00 14.31 H new ATOM 0 HA ASN A 13 1.825 -13.779 13.450 1.00 53.31 H new ATOM 0 HB2 ASN A 13 0.789 -15.155 11.012 1.00 72.33 H new ATOM 0 HB3 ASN A 13 -0.047 -14.714 12.488 1.00 72.33 H new ATOM 0 HD21 ASN A 13 -0.401 -11.179 11.358 1.00 21.32 H new ATOM 0 HD22 ASN A 13 0.297 -12.028 12.741 1.00 21.32 H new ATOM 188 N THR A 14 4.025 -15.188 11.705 1.00 32.34 N ATOM 189 CA THR A 14 4.959 -16.302 11.600 1.00 72.12 C ATOM 190 C THR A 14 6.220 -16.041 12.415 1.00 31.34 C ATOM 191 O THR A 14 6.799 -16.962 12.994 1.00 40.22 O ATOM 192 CB THR A 14 5.354 -16.567 10.135 1.00 42.33 C ATOM 193 OG1 THR A 14 6.017 -15.419 9.591 1.00 34.42 O ATOM 194 CG2 THR A 14 4.130 -16.897 9.295 1.00 54.22 C ATOM 0 H THR A 14 4.324 -14.340 11.223 1.00 32.34 H new ATOM 0 HA THR A 14 4.449 -17.180 11.996 1.00 72.12 H new ATOM 0 HB THR A 14 6.030 -17.421 10.113 1.00 42.33 H new ATOM 0 HG1 THR A 14 5.878 -14.650 10.183 1.00 34.42 H new ATOM 0 HG21 THR A 14 4.434 -17.080 8.265 1.00 54.22 H new ATOM 0 HG22 THR A 14 3.645 -17.788 9.694 1.00 54.22 H new ATOM 0 HG23 THR A 14 3.432 -16.060 9.324 1.00 54.22 H new ATOM 202 N LEU A 15 6.641 -14.782 12.459 1.00 72.12 N ATOM 203 CA LEU A 15 7.834 -14.400 13.205 1.00 3.44 C ATOM 204 C LEU A 15 7.732 -14.845 14.661 1.00 42.23 C ATOM 205 O LEU A 15 6.659 -14.797 15.260 1.00 74.11 O ATOM 206 CB LEU A 15 8.039 -12.885 13.137 1.00 64.34 C ATOM 207 CG LEU A 15 7.408 -12.070 14.266 1.00 74.43 C ATOM 208 CD1 LEU A 15 8.372 -11.940 15.434 1.00 3.11 C ATOM 209 CD2 LEU A 15 6.988 -10.697 13.762 1.00 22.10 C ATOM 0 H LEU A 15 6.174 -14.008 11.987 1.00 72.12 H new ATOM 0 HA LEU A 15 8.691 -14.898 12.751 1.00 3.44 H new ATOM 0 HB2 LEU A 15 9.110 -12.684 13.126 1.00 64.34 H new ATOM 0 HB3 LEU A 15 7.637 -12.527 12.189 1.00 64.34 H new ATOM 0 HG LEU A 15 6.518 -12.595 14.614 1.00 74.43 H new ATOM 0 HD11 LEU A 15 7.905 -11.357 16.228 1.00 3.11 H new ATOM 0 HD12 LEU A 15 8.622 -12.932 15.811 1.00 3.11 H new ATOM 0 HD13 LEU A 15 9.281 -11.438 15.102 1.00 3.11 H new ATOM 0 HD21 LEU A 15 6.541 -10.131 14.579 1.00 22.10 H new ATOM 0 HD22 LEU A 15 7.862 -10.164 13.387 1.00 22.10 H new ATOM 0 HD23 LEU A 15 6.260 -10.811 12.959 1.00 22.10 H new ATOM 221 N GLU A 16 8.857 -15.275 15.223 1.00 64.31 N ATOM 222 CA GLU A 16 8.894 -15.727 16.609 1.00 73.42 C ATOM 223 C GLU A 16 9.674 -14.748 17.480 1.00 3.34 C ATOM 224 O GLU A 16 10.182 -13.737 16.995 1.00 54.52 O ATOM 225 CB GLU A 16 9.523 -17.119 16.698 1.00 34.41 C ATOM 226 CG GLU A 16 8.508 -18.250 16.648 1.00 45.21 C ATOM 227 CD GLU A 16 9.149 -19.616 16.802 1.00 42.43 C ATOM 228 OE1 GLU A 16 9.986 -19.778 17.715 1.00 72.23 O ATOM 229 OE2 GLU A 16 8.815 -20.521 16.010 1.00 74.12 O ATOM 0 H GLU A 16 9.754 -15.320 14.740 1.00 64.31 H new ATOM 0 HA GLU A 16 7.869 -15.775 16.976 1.00 73.42 H new ATOM 0 HB2 GLU A 16 10.232 -17.241 15.879 1.00 34.41 H new ATOM 0 HB3 GLU A 16 10.092 -17.193 17.625 1.00 34.41 H new ATOM 0 HG2 GLU A 16 7.771 -18.107 17.439 1.00 45.21 H new ATOM 0 HG3 GLU A 16 7.971 -18.210 15.700 1.00 45.21 H new ATOM 236 N ASP A 17 9.765 -15.055 18.770 1.00 63.15 N ATOM 237 CA ASP A 17 10.484 -14.203 19.710 1.00 51.02 C ATOM 238 C ASP A 17 11.950 -14.615 19.805 1.00 13.25 C ATOM 239 O ASP A 17 12.327 -15.409 20.667 1.00 13.44 O ATOM 240 CB ASP A 17 9.832 -14.268 21.092 1.00 74.53 C ATOM 241 CG ASP A 17 10.524 -13.374 22.102 1.00 73.35 C ATOM 242 OD1 ASP A 17 11.657 -13.705 22.509 1.00 63.03 O ATOM 243 OD2 ASP A 17 9.932 -12.343 22.484 1.00 23.41 O ATOM 0 H ASP A 17 9.350 -15.888 19.188 1.00 63.15 H new ATOM 0 HA ASP A 17 10.437 -13.178 19.343 1.00 51.02 H new ATOM 0 HB2 ASP A 17 8.785 -13.976 21.010 1.00 74.53 H new ATOM 0 HB3 ASP A 17 9.849 -15.297 21.450 1.00 74.53 H new ATOM 248 N SER A 18 12.771 -14.071 18.914 1.00 45.43 N ATOM 249 CA SER A 18 14.195 -14.385 18.894 1.00 22.14 C ATOM 250 C SER A 18 15.004 -13.208 18.358 1.00 24.03 C ATOM 251 O SER A 18 14.470 -12.335 17.675 1.00 3.44 O ATOM 252 CB SER A 18 14.453 -15.627 18.040 1.00 61.45 C ATOM 253 OG SER A 18 15.682 -15.521 17.343 1.00 43.34 O ATOM 0 H SER A 18 12.475 -13.410 18.196 1.00 45.43 H new ATOM 0 HA SER A 18 14.512 -14.585 19.918 1.00 22.14 H new ATOM 0 HB2 SER A 18 14.467 -16.512 18.675 1.00 61.45 H new ATOM 0 HB3 SER A 18 13.638 -15.758 17.328 1.00 61.45 H new ATOM 0 HG SER A 18 15.824 -16.328 16.806 1.00 43.34 H new ATOM 259 N GLN A 19 16.295 -13.193 18.674 1.00 65.24 N ATOM 260 CA GLN A 19 17.179 -12.123 18.225 1.00 73.44 C ATOM 261 C GLN A 19 17.308 -12.126 16.705 1.00 63.30 C ATOM 262 O GLN A 19 17.297 -11.072 16.070 1.00 22.33 O ATOM 263 CB GLN A 19 18.559 -12.270 18.866 1.00 24.33 C ATOM 264 CG GLN A 19 19.497 -11.113 18.564 1.00 1.50 C ATOM 265 CD GLN A 19 19.024 -9.805 19.168 1.00 31.24 C ATOM 266 OE1 GLN A 19 19.193 -9.564 20.364 1.00 52.40 O ATOM 267 NE2 GLN A 19 18.427 -8.953 18.343 1.00 3.13 N ATOM 0 H GLN A 19 16.752 -13.909 19.239 1.00 65.24 H new ATOM 0 HA GLN A 19 16.743 -11.173 18.533 1.00 73.44 H new ATOM 0 HB2 GLN A 19 18.441 -12.359 19.946 1.00 24.33 H new ATOM 0 HB3 GLN A 19 19.015 -13.197 18.518 1.00 24.33 H new ATOM 0 HG2 GLN A 19 20.491 -11.347 18.946 1.00 1.50 H new ATOM 0 HG3 GLN A 19 19.590 -10.998 17.484 1.00 1.50 H new ATOM 0 HE21 GLN A 19 18.308 -9.194 17.359 1.00 3.13 H new ATOM 0 HE22 GLN A 19 18.087 -8.057 18.693 1.00 3.13 H new ATOM 276 N GLU A 20 17.431 -13.318 16.129 1.00 45.03 N ATOM 277 CA GLU A 20 17.564 -13.457 14.683 1.00 5.42 C ATOM 278 C GLU A 20 16.219 -13.258 13.991 1.00 32.55 C ATOM 279 O GLU A 20 16.147 -12.695 12.899 1.00 21.33 O ATOM 280 CB GLU A 20 18.134 -14.832 14.331 1.00 71.43 C ATOM 281 CG GLU A 20 19.569 -15.033 14.789 1.00 54.11 C ATOM 282 CD GLU A 20 19.659 -15.653 16.170 1.00 52.03 C ATOM 283 OE1 GLU A 20 19.327 -16.849 16.307 1.00 50.14 O ATOM 284 OE2 GLU A 20 20.062 -14.941 17.114 1.00 72.33 O ATOM 0 H GLU A 20 17.441 -14.200 16.641 1.00 45.03 H new ATOM 0 HA GLU A 20 18.250 -12.687 14.331 1.00 5.42 H new ATOM 0 HB2 GLU A 20 17.507 -15.602 14.781 1.00 71.43 H new ATOM 0 HB3 GLU A 20 18.084 -14.971 13.251 1.00 71.43 H new ATOM 0 HG2 GLU A 20 20.089 -15.671 14.074 1.00 54.11 H new ATOM 0 HG3 GLU A 20 20.084 -14.072 14.792 1.00 54.11 H new ATOM 291 N SER A 21 15.154 -13.726 14.636 1.00 64.43 N ATOM 292 CA SER A 21 13.811 -13.605 14.081 1.00 21.25 C ATOM 293 C SER A 21 13.468 -12.145 13.802 1.00 3.03 C ATOM 294 O SER A 21 13.023 -11.799 12.708 1.00 72.13 O ATOM 295 CB SER A 21 12.784 -14.207 15.042 1.00 31.32 C ATOM 296 OG SER A 21 12.627 -13.397 16.194 1.00 14.10 O ATOM 0 H SER A 21 15.196 -14.192 15.542 1.00 64.43 H new ATOM 0 HA SER A 21 13.783 -14.153 13.139 1.00 21.25 H new ATOM 0 HB2 SER A 21 11.825 -14.313 14.535 1.00 31.32 H new ATOM 0 HB3 SER A 21 13.100 -15.207 15.337 1.00 31.32 H new ATOM 0 HG SER A 21 11.678 -13.350 16.434 1.00 14.10 H new ATOM 302 N ILE A 22 13.679 -11.293 14.800 1.00 24.20 N ATOM 303 CA ILE A 22 13.394 -9.870 14.662 1.00 21.44 C ATOM 304 C ILE A 22 14.232 -9.247 13.551 1.00 13.21 C ATOM 305 O ILE A 22 13.783 -8.333 12.860 1.00 52.41 O ATOM 306 CB ILE A 22 13.660 -9.113 15.977 1.00 60.22 C ATOM 307 CG1 ILE A 22 12.766 -9.656 17.093 1.00 12.14 C ATOM 308 CG2 ILE A 22 13.430 -7.622 15.785 1.00 43.44 C ATOM 309 CD1 ILE A 22 11.291 -9.415 16.858 1.00 42.23 C ATOM 0 H ILE A 22 14.046 -11.563 15.712 1.00 24.20 H new ATOM 0 HA ILE A 22 12.337 -9.782 14.409 1.00 21.44 H new ATOM 0 HB ILE A 22 14.700 -9.266 16.264 1.00 60.22 H new ATOM 0 HG12 ILE A 22 12.939 -10.727 17.197 1.00 12.14 H new ATOM 0 HG13 ILE A 22 13.055 -9.194 18.037 1.00 12.14 H new ATOM 0 HG21 ILE A 22 13.622 -7.101 16.723 1.00 43.44 H new ATOM 0 HG22 ILE A 22 14.105 -7.246 15.016 1.00 43.44 H new ATOM 0 HG23 ILE A 22 12.398 -7.450 15.478 1.00 43.44 H new ATOM 0 HD11 ILE A 22 10.718 -9.826 17.689 1.00 42.23 H new ATOM 0 HD12 ILE A 22 11.105 -8.344 16.784 1.00 42.23 H new ATOM 0 HD13 ILE A 22 10.986 -9.901 15.931 1.00 42.23 H new ATOM 321 N SER A 23 15.451 -9.749 13.384 1.00 40.11 N ATOM 322 CA SER A 23 16.353 -9.240 12.357 1.00 1.14 C ATOM 323 C SER A 23 15.886 -9.660 10.967 1.00 0.30 C ATOM 324 O SER A 23 16.080 -8.936 9.990 1.00 34.13 O ATOM 325 CB SER A 23 17.776 -9.744 12.604 1.00 63.24 C ATOM 326 OG SER A 23 18.483 -9.891 11.384 1.00 23.44 O ATOM 0 H SER A 23 15.837 -10.507 13.946 1.00 40.11 H new ATOM 0 HA SER A 23 16.347 -8.151 12.409 1.00 1.14 H new ATOM 0 HB2 SER A 23 18.305 -9.046 13.253 1.00 63.24 H new ATOM 0 HB3 SER A 23 17.741 -10.700 13.126 1.00 63.24 H new ATOM 0 HG SER A 23 19.390 -10.213 11.568 1.00 23.44 H new ATOM 332 N SER A 24 15.270 -10.835 10.886 1.00 12.34 N ATOM 333 CA SER A 24 14.778 -11.354 9.616 1.00 71.32 C ATOM 334 C SER A 24 13.681 -10.457 9.050 1.00 32.44 C ATOM 335 O SER A 24 13.716 -10.078 7.880 1.00 35.32 O ATOM 336 CB SER A 24 14.247 -12.778 9.794 1.00 21.00 C ATOM 337 OG SER A 24 15.310 -13.702 9.953 1.00 34.21 O ATOM 0 H SER A 24 15.100 -11.445 11.685 1.00 12.34 H new ATOM 0 HA SER A 24 15.610 -11.369 8.912 1.00 71.32 H new ATOM 0 HB2 SER A 24 13.592 -12.819 10.664 1.00 21.00 H new ATOM 0 HB3 SER A 24 13.645 -13.056 8.929 1.00 21.00 H new ATOM 0 HG SER A 24 15.712 -13.589 10.840 1.00 34.21 H new ATOM 343 N ALA A 25 12.707 -10.122 9.891 1.00 65.30 N ATOM 344 CA ALA A 25 11.601 -9.269 9.477 1.00 52.20 C ATOM 345 C ALA A 25 12.039 -7.812 9.377 1.00 11.41 C ATOM 346 O ALA A 25 11.682 -7.110 8.431 1.00 44.23 O ATOM 347 CB ALA A 25 10.437 -9.407 10.447 1.00 54.31 C ATOM 0 H ALA A 25 12.662 -10.429 10.863 1.00 65.30 H new ATOM 0 HA ALA A 25 11.276 -9.592 8.488 1.00 52.20 H new ATOM 0 HB1 ALA A 25 9.617 -8.764 10.126 1.00 54.31 H new ATOM 0 HB2 ALA A 25 10.100 -10.443 10.465 1.00 54.31 H new ATOM 0 HB3 ALA A 25 10.759 -9.112 11.446 1.00 54.31 H new ATOM 353 N SER A 26 12.813 -7.363 10.360 1.00 42.42 N ATOM 354 CA SER A 26 13.296 -5.987 10.385 1.00 42.15 C ATOM 355 C SER A 26 14.010 -5.638 9.082 1.00 75.12 C ATOM 356 O SER A 26 13.745 -4.601 8.473 1.00 32.12 O ATOM 357 CB SER A 26 14.242 -5.777 11.569 1.00 73.31 C ATOM 358 OG SER A 26 14.759 -4.458 11.581 1.00 14.14 O ATOM 0 H SER A 26 13.119 -7.932 11.149 1.00 42.42 H new ATOM 0 HA SER A 26 12.435 -5.328 10.496 1.00 42.15 H new ATOM 0 HB2 SER A 26 13.712 -5.972 12.501 1.00 73.31 H new ATOM 0 HB3 SER A 26 15.063 -6.492 11.514 1.00 73.31 H new ATOM 0 HG SER A 26 15.359 -4.349 12.348 1.00 14.14 H new ATOM 364 N LYS A 27 14.917 -6.512 8.659 1.00 75.20 N ATOM 365 CA LYS A 27 15.669 -6.300 7.428 1.00 10.02 C ATOM 366 C LYS A 27 14.731 -6.026 6.257 1.00 34.22 C ATOM 367 O LYS A 27 14.993 -5.152 5.431 1.00 31.01 O ATOM 368 CB LYS A 27 16.541 -7.520 7.122 1.00 11.14 C ATOM 369 CG LYS A 27 18.004 -7.327 7.480 1.00 3.41 C ATOM 370 CD LYS A 27 18.199 -7.196 8.981 1.00 31.54 C ATOM 371 CE LYS A 27 19.526 -6.533 9.316 1.00 61.10 C ATOM 372 NZ LYS A 27 19.495 -5.871 10.649 1.00 14.34 N ATOM 0 H LYS A 27 15.149 -7.375 9.151 1.00 75.20 H new ATOM 0 HA LYS A 27 16.309 -5.429 7.569 1.00 10.02 H new ATOM 0 HB2 LYS A 27 16.152 -8.380 7.668 1.00 11.14 H new ATOM 0 HB3 LYS A 27 16.463 -7.755 6.060 1.00 11.14 H new ATOM 0 HG2 LYS A 27 18.585 -8.172 7.109 1.00 3.41 H new ATOM 0 HG3 LYS A 27 18.386 -6.435 6.983 1.00 3.41 H new ATOM 0 HD2 LYS A 27 17.382 -6.612 9.405 1.00 31.54 H new ATOM 0 HD3 LYS A 27 18.158 -8.183 9.442 1.00 31.54 H new ATOM 0 HE2 LYS A 27 20.319 -7.280 9.300 1.00 61.10 H new ATOM 0 HE3 LYS A 27 19.767 -5.796 8.550 1.00 61.10 H new ATOM 0 HZ1 LYS A 27 20.418 -5.431 10.840 1.00 14.34 H new ATOM 0 HZ2 LYS A 27 18.755 -5.140 10.657 1.00 14.34 H new ATOM 0 HZ3 LYS A 27 19.290 -6.578 11.383 1.00 14.34 H new ATOM 386 N TRP A 28 13.637 -6.777 6.193 1.00 22.15 N ATOM 387 CA TRP A 28 12.659 -6.614 5.124 1.00 42.42 C ATOM 388 C TRP A 28 11.952 -5.267 5.234 1.00 61.31 C ATOM 389 O TRP A 28 11.768 -4.568 4.237 1.00 44.13 O ATOM 390 CB TRP A 28 11.633 -7.747 5.165 1.00 23.31 C ATOM 391 CG TRP A 28 10.644 -7.695 4.040 1.00 4.21 C ATOM 392 CD1 TRP A 28 10.908 -7.848 2.709 1.00 64.20 C ATOM 393 CD2 TRP A 28 9.234 -7.472 4.148 1.00 3.43 C ATOM 394 NE1 TRP A 28 9.747 -7.734 1.983 1.00 3.22 N ATOM 395 CE2 TRP A 28 8.706 -7.503 2.843 1.00 61.51 C ATOM 396 CE3 TRP A 28 8.366 -7.250 5.221 1.00 63.02 C ATOM 397 CZ2 TRP A 28 7.350 -7.321 2.584 1.00 3.32 C ATOM 398 CZ3 TRP A 28 7.021 -7.069 4.962 1.00 0.54 C ATOM 399 CH2 TRP A 28 6.523 -7.105 3.653 1.00 23.50 C ATOM 0 H TRP A 28 13.405 -7.505 6.869 1.00 22.15 H new ATOM 0 HA TRP A 28 13.189 -6.649 4.172 1.00 42.42 H new ATOM 0 HB2 TRP A 28 12.156 -8.703 5.135 1.00 23.31 H new ATOM 0 HB3 TRP A 28 11.096 -7.707 6.113 1.00 23.31 H new ATOM 0 HD1 TRP A 28 11.886 -8.032 2.289 1.00 64.20 H new ATOM 0 HE1 TRP A 28 9.672 -7.809 0.969 1.00 3.22 H new ATOM 0 HE3 TRP A 28 8.740 -7.221 6.234 1.00 63.02 H new ATOM 0 HZ2 TRP A 28 6.965 -7.349 1.576 1.00 3.32 H new ATOM 0 HZ3 TRP A 28 6.341 -6.897 5.783 1.00 0.54 H new ATOM 0 HH2 TRP A 28 5.466 -6.960 3.484 1.00 23.50 H new ATOM 410 N LEU A 29 11.557 -4.909 6.451 1.00 64.13 N ATOM 411 CA LEU A 29 10.870 -3.645 6.691 1.00 41.12 C ATOM 412 C LEU A 29 11.770 -2.462 6.348 1.00 21.12 C ATOM 413 O LEU A 29 11.296 -1.415 5.906 1.00 52.05 O ATOM 414 CB LEU A 29 10.423 -3.554 8.151 1.00 61.21 C ATOM 415 CG LEU A 29 9.162 -4.337 8.517 1.00 74.14 C ATOM 416 CD1 LEU A 29 9.234 -4.824 9.956 1.00 53.33 C ATOM 417 CD2 LEU A 29 7.922 -3.481 8.303 1.00 72.14 C ATOM 0 H LEU A 29 11.701 -5.476 7.287 1.00 64.13 H new ATOM 0 HA LEU A 29 9.992 -3.609 6.046 1.00 41.12 H new ATOM 0 HB2 LEU A 29 11.240 -3.904 8.783 1.00 61.21 H new ATOM 0 HB3 LEU A 29 10.258 -2.504 8.395 1.00 61.21 H new ATOM 0 HG LEU A 29 9.096 -5.207 7.864 1.00 74.14 H new ATOM 0 HD11 LEU A 29 8.328 -5.379 10.198 1.00 53.33 H new ATOM 0 HD12 LEU A 29 10.101 -5.474 10.077 1.00 53.33 H new ATOM 0 HD13 LEU A 29 9.325 -3.969 10.625 1.00 53.33 H new ATOM 0 HD21 LEU A 29 7.034 -4.054 8.568 1.00 72.14 H new ATOM 0 HD22 LEU A 29 7.981 -2.592 8.931 1.00 72.14 H new ATOM 0 HD23 LEU A 29 7.862 -3.183 7.256 1.00 72.14 H new ATOM 429 N LEU A 30 13.071 -2.636 6.554 1.00 71.34 N ATOM 430 CA LEU A 30 14.039 -1.584 6.264 1.00 11.12 C ATOM 431 C LEU A 30 13.964 -1.163 4.800 1.00 24.10 C ATOM 432 O LEU A 30 14.272 -0.021 4.455 1.00 71.55 O ATOM 433 CB LEU A 30 15.454 -2.059 6.599 1.00 72.33 C ATOM 434 CG LEU A 30 16.035 -1.559 7.922 1.00 52.23 C ATOM 435 CD1 LEU A 30 16.050 -0.039 7.957 1.00 40.51 C ATOM 436 CD2 LEU A 30 15.242 -2.113 9.096 1.00 31.51 C ATOM 0 H LEU A 30 13.480 -3.496 6.921 1.00 71.34 H new ATOM 0 HA LEU A 30 13.796 -0.721 6.883 1.00 11.12 H new ATOM 0 HB2 LEU A 30 15.456 -3.149 6.613 1.00 72.33 H new ATOM 0 HB3 LEU A 30 16.120 -1.750 5.793 1.00 72.33 H new ATOM 0 HG LEU A 30 17.062 -1.914 8.003 1.00 52.23 H new ATOM 0 HD11 LEU A 30 16.467 0.299 8.906 1.00 40.51 H new ATOM 0 HD12 LEU A 30 16.662 0.338 7.137 1.00 40.51 H new ATOM 0 HD13 LEU A 30 15.032 0.337 7.853 1.00 40.51 H new ATOM 0 HD21 LEU A 30 15.670 -1.747 10.029 1.00 31.51 H new ATOM 0 HD22 LEU A 30 14.204 -1.788 9.020 1.00 31.51 H new ATOM 0 HD23 LEU A 30 15.283 -3.202 9.081 1.00 31.51 H new ATOM 448 N LEU A 31 13.552 -2.091 3.944 1.00 63.15 N ATOM 449 CA LEU A 31 13.435 -1.816 2.516 1.00 74.24 C ATOM 450 C LEU A 31 12.017 -1.380 2.160 1.00 11.22 C ATOM 451 O LEU A 31 11.638 -1.365 0.990 1.00 52.45 O ATOM 452 CB LEU A 31 13.818 -3.055 1.704 1.00 35.34 C ATOM 453 CG LEU A 31 15.315 -3.284 1.494 1.00 12.43 C ATOM 454 CD1 LEU A 31 15.978 -3.709 2.795 1.00 13.23 C ATOM 455 CD2 LEU A 31 15.548 -4.325 0.409 1.00 4.24 C ATOM 0 H LEU A 31 13.293 -3.040 4.213 1.00 63.15 H new ATOM 0 HA LEU A 31 14.118 -1.003 2.271 1.00 74.24 H new ATOM 0 HB2 LEU A 31 13.403 -3.932 2.200 1.00 35.34 H new ATOM 0 HB3 LEU A 31 13.341 -2.986 0.726 1.00 35.34 H new ATOM 0 HG LEU A 31 15.765 -2.345 1.171 1.00 12.43 H new ATOM 0 HD11 LEU A 31 17.043 -3.867 2.626 1.00 13.23 H new ATOM 0 HD12 LEU A 31 15.842 -2.929 3.544 1.00 13.23 H new ATOM 0 HD13 LEU A 31 15.525 -4.635 3.148 1.00 13.23 H new ATOM 0 HD21 LEU A 31 16.619 -4.475 0.273 1.00 4.24 H new ATOM 0 HD22 LEU A 31 15.084 -5.267 0.702 1.00 4.24 H new ATOM 0 HD23 LEU A 31 15.108 -3.980 -0.527 1.00 4.24 H new ATOM 467 N GLN A 32 11.240 -1.024 3.178 1.00 30.12 N ATOM 468 CA GLN A 32 9.865 -0.586 2.972 1.00 13.21 C ATOM 469 C GLN A 32 9.694 0.876 3.370 1.00 11.45 C ATOM 470 O GLN A 32 8.611 1.296 3.780 1.00 41.45 O ATOM 471 CB GLN A 32 8.902 -1.462 3.776 1.00 1.52 C ATOM 472 CG GLN A 32 8.964 -2.934 3.403 1.00 15.04 C ATOM 473 CD GLN A 32 9.037 -3.154 1.905 1.00 25.13 C ATOM 474 OE1 GLN A 32 8.350 -2.486 1.133 1.00 14.42 O ATOM 475 NE2 GLN A 32 9.875 -4.095 1.486 1.00 60.34 N ATOM 0 H GLN A 32 11.539 -1.030 4.153 1.00 30.12 H new ATOM 0 HA GLN A 32 9.634 -0.684 1.911 1.00 13.21 H new ATOM 0 HB2 GLN A 32 9.126 -1.355 4.837 1.00 1.52 H new ATOM 0 HB3 GLN A 32 7.885 -1.100 3.627 1.00 1.52 H new ATOM 0 HG2 GLN A 32 9.835 -3.388 3.876 1.00 15.04 H new ATOM 0 HG3 GLN A 32 8.085 -3.442 3.799 1.00 15.04 H new ATOM 0 HE21 GLN A 32 10.426 -4.625 2.161 1.00 60.34 H new ATOM 0 HE22 GLN A 32 9.968 -4.288 0.489 1.00 60.34 H new ATOM 484 N TYR A 33 10.769 1.647 3.249 1.00 60.13 N ATOM 485 CA TYR A 33 10.739 3.062 3.599 1.00 71.02 C ATOM 486 C TYR A 33 9.673 3.800 2.794 1.00 21.32 C ATOM 487 O TYR A 33 9.174 4.844 3.214 1.00 23.12 O ATOM 488 CB TYR A 33 12.109 3.698 3.356 1.00 15.31 C ATOM 489 CG TYR A 33 12.703 3.360 2.008 1.00 71.04 C ATOM 490 CD1 TYR A 33 12.200 3.927 0.843 1.00 2.40 C ATOM 491 CD2 TYR A 33 13.766 2.473 1.898 1.00 61.53 C ATOM 492 CE1 TYR A 33 12.740 3.621 -0.391 1.00 75.14 C ATOM 493 CE2 TYR A 33 14.313 2.161 0.668 1.00 54.42 C ATOM 494 CZ TYR A 33 13.796 2.738 -0.474 1.00 32.22 C ATOM 495 OH TYR A 33 14.337 2.429 -1.701 1.00 15.30 O ATOM 0 H TYR A 33 11.672 1.316 2.911 1.00 60.13 H new ATOM 0 HA TYR A 33 10.490 3.143 4.657 1.00 71.02 H new ATOM 0 HB2 TYR A 33 12.018 4.781 3.442 1.00 15.31 H new ATOM 0 HB3 TYR A 33 12.795 3.372 4.138 1.00 15.31 H new ATOM 0 HD1 TYR A 33 11.373 4.619 0.904 1.00 2.40 H new ATOM 0 HD2 TYR A 33 14.172 2.019 2.790 1.00 61.53 H new ATOM 0 HE1 TYR A 33 12.337 4.071 -1.286 1.00 75.14 H new ATOM 0 HE2 TYR A 33 15.140 1.470 0.601 1.00 54.42 H new ATOM 0 HH TYR A 33 15.073 1.793 -1.583 1.00 15.30 H new ATOM 505 N ARG A 34 9.329 3.248 1.635 1.00 12.11 N ATOM 506 CA ARG A 34 8.323 3.853 0.770 1.00 31.31 C ATOM 507 C ARG A 34 6.927 3.694 1.366 1.00 2.41 C ATOM 508 O ARG A 34 6.032 4.495 1.097 1.00 52.31 O ATOM 509 CB ARG A 34 8.370 3.220 -0.622 1.00 34.22 C ATOM 510 CG ARG A 34 8.194 1.710 -0.611 1.00 11.14 C ATOM 511 CD ARG A 34 8.113 1.148 -2.021 1.00 52.34 C ATOM 512 NE ARG A 34 7.026 1.751 -2.789 1.00 45.11 N ATOM 513 CZ ARG A 34 6.894 1.618 -4.104 1.00 42.52 C ATOM 514 NH1 ARG A 34 7.775 0.908 -4.794 1.00 65.40 N ATOM 515 NH2 ARG A 34 5.878 2.197 -4.732 1.00 4.33 N ATOM 0 H ARG A 34 9.732 2.383 1.273 1.00 12.11 H new ATOM 0 HA ARG A 34 8.544 4.917 0.686 1.00 31.31 H new ATOM 0 HB2 ARG A 34 7.590 3.664 -1.240 1.00 34.22 H new ATOM 0 HB3 ARG A 34 9.324 3.463 -1.090 1.00 34.22 H new ATOM 0 HG2 ARG A 34 9.028 1.249 -0.082 1.00 11.14 H new ATOM 0 HG3 ARG A 34 7.288 1.452 -0.063 1.00 11.14 H new ATOM 0 HD2 ARG A 34 9.059 1.320 -2.535 1.00 52.34 H new ATOM 0 HD3 ARG A 34 7.968 0.069 -1.973 1.00 52.34 H new ATOM 0 HE ARG A 34 6.331 2.304 -2.288 1.00 45.11 H new ATOM 0 HH11 ARG A 34 8.557 0.462 -4.315 1.00 65.40 H new ATOM 0 HH12 ARG A 34 7.671 0.808 -5.804 1.00 65.40 H new ATOM 0 HH21 ARG A 34 5.198 2.745 -4.205 1.00 4.33 H new ATOM 0 HH22 ARG A 34 5.777 2.094 -5.742 1.00 4.33 H new ATOM 529 N ASP A 35 6.750 2.656 2.176 1.00 11.40 N ATOM 530 CA ASP A 35 5.464 2.393 2.811 1.00 74.12 C ATOM 531 C ASP A 35 5.493 2.790 4.283 1.00 20.35 C ATOM 532 O ASP A 35 5.047 2.037 5.148 1.00 32.43 O ATOM 533 CB ASP A 35 5.097 0.914 2.675 1.00 5.14 C ATOM 534 CG ASP A 35 5.481 0.344 1.324 1.00 54.22 C ATOM 535 OD1 ASP A 35 4.750 0.599 0.344 1.00 11.41 O ATOM 536 OD2 ASP A 35 6.511 -0.358 1.246 1.00 53.10 O ATOM 0 H ASP A 35 7.481 1.983 2.408 1.00 11.40 H new ATOM 0 HA ASP A 35 4.708 2.995 2.307 1.00 74.12 H new ATOM 0 HB2 ASP A 35 5.595 0.345 3.461 1.00 5.14 H new ATOM 0 HB3 ASP A 35 4.024 0.794 2.825 1.00 5.14 H new ATOM 541 N ALA A 36 6.022 3.977 4.561 1.00 64.23 N ATOM 542 CA ALA A 36 6.109 4.474 5.928 1.00 23.12 C ATOM 543 C ALA A 36 4.735 4.505 6.589 1.00 4.03 C ATOM 544 O ALA A 36 4.492 3.847 7.601 1.00 13.42 O ATOM 545 CB ALA A 36 6.738 5.859 5.947 1.00 12.42 C ATOM 0 H ALA A 36 6.397 4.613 3.857 1.00 64.23 H new ATOM 0 HA ALA A 36 6.741 3.792 6.497 1.00 23.12 H new ATOM 0 HB1 ALA A 36 6.797 6.218 6.975 1.00 12.42 H new ATOM 0 HB2 ALA A 36 7.741 5.809 5.522 1.00 12.42 H new ATOM 0 HB3 ALA A 36 6.128 6.544 5.358 1.00 12.42 H new ATOM 551 N PRO A 37 3.815 5.287 6.006 1.00 11.33 N ATOM 552 CA PRO A 37 2.450 5.423 6.523 1.00 73.14 C ATOM 553 C PRO A 37 1.630 4.151 6.335 1.00 71.12 C ATOM 554 O PRO A 37 0.742 3.848 7.132 1.00 1.44 O ATOM 555 CB PRO A 37 1.866 6.564 5.686 1.00 73.22 C ATOM 556 CG PRO A 37 2.651 6.545 4.420 1.00 54.23 C ATOM 557 CD PRO A 37 4.036 6.099 4.798 1.00 51.22 C ATOM 0 HA PRO A 37 2.437 5.613 7.596 1.00 73.14 H new ATOM 0 HB2 PRO A 37 0.804 6.412 5.495 1.00 73.22 H new ATOM 0 HB3 PRO A 37 1.964 7.521 6.198 1.00 73.22 H new ATOM 0 HG2 PRO A 37 2.206 5.863 3.695 1.00 54.23 H new ATOM 0 HG3 PRO A 37 2.671 7.532 3.959 1.00 54.23 H new ATOM 0 HD2 PRO A 37 4.502 5.517 4.003 1.00 51.22 H new ATOM 0 HD3 PRO A 37 4.691 6.947 4.998 1.00 51.22 H new ATOM 565 N LYS A 38 1.933 3.408 5.275 1.00 0.25 N ATOM 566 CA LYS A 38 1.226 2.167 4.983 1.00 51.11 C ATOM 567 C LYS A 38 1.536 1.104 6.032 1.00 14.11 C ATOM 568 O LYS A 38 0.629 0.538 6.643 1.00 61.20 O ATOM 569 CB LYS A 38 1.608 1.654 3.593 1.00 63.40 C ATOM 570 CG LYS A 38 0.549 1.914 2.536 1.00 60.51 C ATOM 571 CD LYS A 38 -0.675 1.037 2.745 1.00 4.33 C ATOM 572 CE LYS A 38 -0.570 -0.263 1.963 1.00 43.32 C ATOM 573 NZ LYS A 38 -1.853 -1.018 1.967 1.00 31.05 N ATOM 0 H LYS A 38 2.664 3.644 4.604 1.00 0.25 H new ATOM 0 HA LYS A 38 0.156 2.373 5.006 1.00 51.11 H new ATOM 0 HB2 LYS A 38 2.541 2.126 3.284 1.00 63.40 H new ATOM 0 HB3 LYS A 38 1.797 0.582 3.650 1.00 63.40 H new ATOM 0 HG2 LYS A 38 0.255 2.963 2.565 1.00 60.51 H new ATOM 0 HG3 LYS A 38 0.967 1.727 1.547 1.00 60.51 H new ATOM 0 HD2 LYS A 38 -0.789 0.816 3.806 1.00 4.33 H new ATOM 0 HD3 LYS A 38 -1.569 1.578 2.435 1.00 4.33 H new ATOM 0 HE2 LYS A 38 -0.280 -0.046 0.935 1.00 43.32 H new ATOM 0 HE3 LYS A 38 0.217 -0.883 2.393 1.00 43.32 H new ATOM 0 HZ1 LYS A 38 -1.740 -1.898 1.424 1.00 31.05 H new ATOM 0 HZ2 LYS A 38 -2.118 -1.248 2.946 1.00 31.05 H new ATOM 0 HZ3 LYS A 38 -2.599 -0.437 1.534 1.00 31.05 H new ATOM 587 N VAL A 39 2.822 0.839 6.237 1.00 32.25 N ATOM 588 CA VAL A 39 3.251 -0.154 7.215 1.00 70.31 C ATOM 589 C VAL A 39 2.905 0.285 8.633 1.00 4.42 C ATOM 590 O VAL A 39 2.428 -0.510 9.442 1.00 71.14 O ATOM 591 CB VAL A 39 4.767 -0.412 7.124 1.00 33.53 C ATOM 592 CG1 VAL A 39 5.200 -1.424 8.174 1.00 31.22 C ATOM 593 CG2 VAL A 39 5.144 -0.886 5.729 1.00 54.35 C ATOM 0 H VAL A 39 3.585 1.298 5.739 1.00 32.25 H new ATOM 0 HA VAL A 39 2.718 -1.076 6.984 1.00 70.31 H new ATOM 0 HB VAL A 39 5.290 0.525 7.318 1.00 33.53 H new ATOM 0 HG11 VAL A 39 6.274 -1.594 8.095 1.00 31.22 H new ATOM 0 HG12 VAL A 39 4.966 -1.041 9.167 1.00 31.22 H new ATOM 0 HG13 VAL A 39 4.671 -2.364 8.014 1.00 31.22 H new ATOM 0 HG21 VAL A 39 6.218 -1.063 5.683 1.00 54.35 H new ATOM 0 HG22 VAL A 39 4.614 -1.811 5.503 1.00 54.35 H new ATOM 0 HG23 VAL A 39 4.871 -0.124 4.999 1.00 54.35 H new ATOM 603 N ALA A 40 3.150 1.558 8.928 1.00 14.03 N ATOM 604 CA ALA A 40 2.862 2.105 10.248 1.00 32.14 C ATOM 605 C ALA A 40 1.376 2.001 10.574 1.00 73.42 C ATOM 606 O ALA A 40 0.999 1.596 11.673 1.00 61.40 O ATOM 607 CB ALA A 40 3.322 3.553 10.332 1.00 61.33 C ATOM 0 H ALA A 40 3.547 2.229 8.271 1.00 14.03 H new ATOM 0 HA ALA A 40 3.411 1.517 10.984 1.00 32.14 H new ATOM 0 HB1 ALA A 40 3.100 3.948 11.323 1.00 61.33 H new ATOM 0 HB2 ALA A 40 4.396 3.605 10.152 1.00 61.33 H new ATOM 0 HB3 ALA A 40 2.800 4.145 9.580 1.00 61.33 H new ATOM 613 N GLU A 41 0.536 2.370 9.611 1.00 24.51 N ATOM 614 CA GLU A 41 -0.909 2.318 9.798 1.00 41.45 C ATOM 615 C GLU A 41 -1.382 0.880 9.990 1.00 51.40 C ATOM 616 O GLU A 41 -2.129 0.581 10.921 1.00 54.32 O ATOM 617 CB GLU A 41 -1.623 2.946 8.598 1.00 23.42 C ATOM 618 CG GLU A 41 -3.129 3.048 8.772 1.00 43.24 C ATOM 619 CD GLU A 41 -3.849 3.327 7.466 1.00 24.35 C ATOM 620 OE1 GLU A 41 -4.045 2.374 6.683 1.00 13.01 O ATOM 621 OE2 GLU A 41 -4.215 4.496 7.228 1.00 2.41 O ATOM 0 H GLU A 41 0.831 2.708 8.695 1.00 24.51 H new ATOM 0 HA GLU A 41 -1.154 2.885 10.696 1.00 41.45 H new ATOM 0 HB2 GLU A 41 -1.217 3.943 8.425 1.00 23.42 H new ATOM 0 HB3 GLU A 41 -1.408 2.355 7.708 1.00 23.42 H new ATOM 0 HG2 GLU A 41 -3.506 2.118 9.199 1.00 43.24 H new ATOM 0 HG3 GLU A 41 -3.356 3.841 9.485 1.00 43.24 H new ATOM 628 N MET A 42 -0.941 -0.005 9.102 1.00 34.14 N ATOM 629 CA MET A 42 -1.319 -1.412 9.175 1.00 50.24 C ATOM 630 C MET A 42 -0.857 -2.032 10.489 1.00 24.02 C ATOM 631 O MET A 42 -1.643 -2.656 11.202 1.00 2.21 O ATOM 632 CB MET A 42 -0.723 -2.183 7.996 1.00 62.23 C ATOM 633 CG MET A 42 -1.615 -3.306 7.490 1.00 3.34 C ATOM 634 SD MET A 42 -0.685 -4.785 7.047 1.00 62.44 S ATOM 635 CE MET A 42 -0.312 -5.450 8.668 1.00 40.24 C ATOM 0 H MET A 42 -0.323 0.226 8.325 1.00 34.14 H new ATOM 0 HA MET A 42 -2.406 -1.473 9.128 1.00 50.24 H new ATOM 0 HB2 MET A 42 -0.529 -1.488 7.179 1.00 62.23 H new ATOM 0 HB3 MET A 42 0.239 -2.600 8.294 1.00 62.23 H new ATOM 0 HG2 MET A 42 -2.346 -3.558 8.258 1.00 3.34 H new ATOM 0 HG3 MET A 42 -2.173 -2.958 6.620 1.00 3.34 H new ATOM 0 HE1 MET A 42 0.471 -6.203 8.581 1.00 40.24 H new ATOM 0 HE2 MET A 42 0.028 -4.647 9.321 1.00 40.24 H new ATOM 0 HE3 MET A 42 -1.208 -5.906 9.089 1.00 40.24 H new ATOM 645 N TRP A 43 0.422 -1.857 10.803 1.00 12.22 N ATOM 646 CA TRP A 43 0.988 -2.400 12.033 1.00 61.24 C ATOM 647 C TRP A 43 0.199 -1.931 13.250 1.00 54.15 C ATOM 648 O TRP A 43 -0.224 -2.738 14.078 1.00 65.23 O ATOM 649 CB TRP A 43 2.454 -1.986 12.170 1.00 62.25 C ATOM 650 CG TRP A 43 3.120 -2.553 13.386 1.00 24.35 C ATOM 651 CD1 TRP A 43 3.711 -3.779 13.501 1.00 32.42 C ATOM 652 CD2 TRP A 43 3.262 -1.917 14.661 1.00 0.30 C ATOM 653 NE1 TRP A 43 4.211 -3.943 14.771 1.00 60.45 N ATOM 654 CE2 TRP A 43 3.949 -2.815 15.501 1.00 4.41 C ATOM 655 CE3 TRP A 43 2.877 -0.675 15.174 1.00 62.12 C ATOM 656 CZ2 TRP A 43 4.257 -2.509 16.824 1.00 43.50 C ATOM 657 CZ3 TRP A 43 3.183 -0.373 16.487 1.00 2.01 C ATOM 658 CH2 TRP A 43 3.868 -1.286 17.300 1.00 43.11 C ATOM 0 H TRP A 43 1.086 -1.344 10.223 1.00 12.22 H new ATOM 0 HA TRP A 43 0.928 -3.487 11.982 1.00 61.24 H new ATOM 0 HB2 TRP A 43 2.999 -2.308 11.283 1.00 62.25 H new ATOM 0 HB3 TRP A 43 2.515 -0.898 12.205 1.00 62.25 H new ATOM 0 HD1 TRP A 43 3.776 -4.512 12.710 1.00 32.42 H new ATOM 0 HE1 TRP A 43 4.698 -4.771 15.114 1.00 60.45 H new ATOM 0 HE3 TRP A 43 2.350 0.036 14.555 1.00 62.12 H new ATOM 0 HZ2 TRP A 43 4.784 -3.212 17.452 1.00 43.50 H new ATOM 0 HZ3 TRP A 43 2.889 0.583 16.894 1.00 2.01 H new ATOM 0 HH2 TRP A 43 4.093 -1.019 18.322 1.00 43.11 H new ATOM 669 N LYS A 44 0.002 -0.621 13.353 1.00 51.15 N ATOM 670 CA LYS A 44 -0.739 -0.043 14.468 1.00 64.21 C ATOM 671 C LYS A 44 -2.117 -0.683 14.595 1.00 32.54 C ATOM 672 O LYS A 44 -2.442 -1.277 15.623 1.00 74.31 O ATOM 673 CB LYS A 44 -0.882 1.469 14.283 1.00 51.11 C ATOM 674 CG LYS A 44 -1.638 2.151 15.410 1.00 32.32 C ATOM 675 CD LYS A 44 -2.203 3.492 14.972 1.00 24.31 C ATOM 676 CE LYS A 44 -3.640 3.362 14.492 1.00 31.53 C ATOM 677 NZ LYS A 44 -4.588 3.177 15.625 1.00 35.34 N ATOM 0 H LYS A 44 0.346 0.061 12.677 1.00 51.15 H new ATOM 0 HA LYS A 44 -0.181 -0.239 15.383 1.00 64.21 H new ATOM 0 HB2 LYS A 44 0.111 1.912 14.202 1.00 51.11 H new ATOM 0 HB3 LYS A 44 -1.396 1.664 13.342 1.00 51.11 H new ATOM 0 HG2 LYS A 44 -2.449 1.506 15.747 1.00 32.32 H new ATOM 0 HG3 LYS A 44 -0.972 2.296 16.260 1.00 32.32 H new ATOM 0 HD2 LYS A 44 -2.158 4.196 15.803 1.00 24.31 H new ATOM 0 HD3 LYS A 44 -1.587 3.904 14.172 1.00 24.31 H new ATOM 0 HE2 LYS A 44 -3.917 4.253 13.929 1.00 31.53 H new ATOM 0 HE3 LYS A 44 -3.720 2.516 13.810 1.00 31.53 H new ATOM 0 HZ1 LYS A 44 -5.301 2.465 15.368 1.00 35.34 H new ATOM 0 HZ2 LYS A 44 -4.066 2.857 16.466 1.00 35.34 H new ATOM 0 HZ3 LYS A 44 -5.060 4.080 15.834 1.00 35.34 H new ATOM 691 N GLU A 45 -2.922 -0.559 13.545 1.00 70.33 N ATOM 692 CA GLU A 45 -4.265 -1.127 13.541 1.00 71.13 C ATOM 693 C GLU A 45 -4.229 -2.612 13.892 1.00 52.24 C ATOM 694 O GLU A 45 -5.169 -3.144 14.482 1.00 32.04 O ATOM 695 CB GLU A 45 -4.922 -0.931 12.173 1.00 42.14 C ATOM 696 CG GLU A 45 -5.588 0.424 12.006 1.00 10.51 C ATOM 697 CD GLU A 45 -6.943 0.496 12.683 1.00 21.32 C ATOM 698 OE1 GLU A 45 -7.243 -0.397 13.503 1.00 34.40 O ATOM 699 OE2 GLU A 45 -7.703 1.443 12.394 1.00 44.45 O ATOM 0 H GLU A 45 -2.668 -0.071 12.686 1.00 70.33 H new ATOM 0 HA GLU A 45 -4.854 -0.607 14.297 1.00 71.13 H new ATOM 0 HB2 GLU A 45 -4.167 -1.054 11.396 1.00 42.14 H new ATOM 0 HB3 GLU A 45 -5.666 -1.713 12.021 1.00 42.14 H new ATOM 0 HG2 GLU A 45 -4.939 1.197 12.418 1.00 10.51 H new ATOM 0 HG3 GLU A 45 -5.705 0.639 10.944 1.00 10.51 H new ATOM 706 N TYR A 46 -3.138 -3.274 13.523 1.00 35.31 N ATOM 707 CA TYR A 46 -2.980 -4.698 13.796 1.00 54.14 C ATOM 708 C TYR A 46 -2.681 -4.940 15.272 1.00 73.11 C ATOM 709 O TYR A 46 -3.095 -5.949 15.843 1.00 44.22 O ATOM 710 CB TYR A 46 -1.859 -5.282 12.934 1.00 34.02 C ATOM 711 CG TYR A 46 -1.427 -6.667 13.360 1.00 13.13 C ATOM 712 CD1 TYR A 46 -0.433 -6.843 14.314 1.00 5.44 C ATOM 713 CD2 TYR A 46 -2.013 -7.799 12.808 1.00 22.54 C ATOM 714 CE1 TYR A 46 -0.034 -8.106 14.706 1.00 1.15 C ATOM 715 CE2 TYR A 46 -1.622 -9.067 13.195 1.00 4.55 C ATOM 716 CZ TYR A 46 -0.632 -9.215 14.145 1.00 43.45 C ATOM 717 OH TYR A 46 -0.238 -10.475 14.532 1.00 72.13 O ATOM 0 H TYR A 46 -2.350 -2.848 13.034 1.00 35.31 H new ATOM 0 HA TYR A 46 -3.917 -5.196 13.548 1.00 54.14 H new ATOM 0 HB2 TYR A 46 -2.191 -5.317 11.896 1.00 34.02 H new ATOM 0 HB3 TYR A 46 -0.998 -4.614 12.971 1.00 34.02 H new ATOM 0 HD1 TYR A 46 0.036 -5.977 14.757 1.00 5.44 H new ATOM 0 HD2 TYR A 46 -2.787 -7.686 12.064 1.00 22.54 H new ATOM 0 HE1 TYR A 46 0.742 -8.224 15.448 1.00 1.15 H new ATOM 0 HE2 TYR A 46 -2.088 -9.937 12.757 1.00 4.55 H new ATOM 0 HH TYR A 46 -0.902 -11.131 14.233 1.00 72.13 H new ATOM 727 N MET A 47 -1.960 -4.006 15.884 1.00 74.23 N ATOM 728 CA MET A 47 -1.607 -4.116 17.294 1.00 21.23 C ATOM 729 C MET A 47 -2.783 -3.722 18.182 1.00 52.02 C ATOM 730 O MET A 47 -3.130 -4.436 19.123 1.00 33.34 O ATOM 731 CB MET A 47 -0.397 -3.234 17.609 1.00 32.22 C ATOM 732 CG MET A 47 0.852 -3.617 16.833 1.00 44.43 C ATOM 733 SD MET A 47 1.802 -4.919 17.642 1.00 54.32 S ATOM 734 CE MET A 47 2.504 -4.018 19.022 1.00 71.14 C ATOM 0 H MET A 47 -1.609 -3.165 15.425 1.00 74.23 H new ATOM 0 HA MET A 47 -1.353 -5.156 17.499 1.00 21.23 H new ATOM 0 HB2 MET A 47 -0.647 -2.196 17.389 1.00 32.22 H new ATOM 0 HB3 MET A 47 -0.184 -3.292 18.676 1.00 32.22 H new ATOM 0 HG2 MET A 47 0.567 -3.948 15.834 1.00 44.43 H new ATOM 0 HG3 MET A 47 1.482 -2.736 16.709 1.00 44.43 H new ATOM 0 HE1 MET A 47 3.583 -4.172 19.046 1.00 71.14 H new ATOM 0 HE2 MET A 47 2.291 -2.955 18.909 1.00 71.14 H new ATOM 0 HE3 MET A 47 2.066 -4.378 19.953 1.00 71.14 H new ATOM 744 N LEU A 48 -3.393 -2.582 17.877 1.00 43.24 N ATOM 745 CA LEU A 48 -4.531 -2.092 18.647 1.00 24.42 C ATOM 746 C LEU A 48 -5.636 -3.141 18.712 1.00 72.33 C ATOM 747 O LEU A 48 -6.435 -3.158 19.648 1.00 32.51 O ATOM 748 CB LEU A 48 -5.072 -0.801 18.030 1.00 20.55 C ATOM 749 CG LEU A 48 -4.563 0.502 18.647 1.00 63.11 C ATOM 750 CD1 LEU A 48 -3.143 0.792 18.185 1.00 53.25 C ATOM 751 CD2 LEU A 48 -5.488 1.657 18.292 1.00 22.11 C ATOM 0 H LEU A 48 -3.118 -1.979 17.101 1.00 43.24 H new ATOM 0 HA LEU A 48 -4.190 -1.887 19.662 1.00 24.42 H new ATOM 0 HB2 LEU A 48 -4.825 -0.798 16.968 1.00 20.55 H new ATOM 0 HB3 LEU A 48 -6.159 -0.814 18.104 1.00 20.55 H new ATOM 0 HG LEU A 48 -4.555 0.390 19.731 1.00 63.11 H new ATOM 0 HD11 LEU A 48 -2.797 1.723 18.634 1.00 53.25 H new ATOM 0 HD12 LEU A 48 -2.487 -0.024 18.490 1.00 53.25 H new ATOM 0 HD13 LEU A 48 -3.125 0.885 17.099 1.00 53.25 H new ATOM 0 HD21 LEU A 48 -5.110 2.576 18.740 1.00 22.11 H new ATOM 0 HD22 LEU A 48 -5.529 1.771 17.209 1.00 22.11 H new ATOM 0 HD23 LEU A 48 -6.488 1.452 18.673 1.00 22.11 H new ATOM 763 N ARG A 49 -5.674 -4.016 17.711 1.00 14.54 N ATOM 764 CA ARG A 49 -6.681 -5.069 17.655 1.00 11.51 C ATOM 765 C ARG A 49 -6.603 -5.962 18.890 1.00 54.41 C ATOM 766 O ARG A 49 -5.547 -6.488 19.240 1.00 61.00 O ATOM 767 CB ARG A 49 -6.499 -5.911 16.391 1.00 1.31 C ATOM 768 CG ARG A 49 -7.210 -5.343 15.174 1.00 73.55 C ATOM 769 CD ARG A 49 -6.663 -5.934 13.883 1.00 2.53 C ATOM 770 NE ARG A 49 -7.347 -7.170 13.513 1.00 2.33 N ATOM 771 CZ ARG A 49 -8.569 -7.206 12.994 1.00 21.30 C ATOM 772 NH1 ARG A 49 -9.238 -6.081 12.784 1.00 4.22 N ATOM 773 NH2 ARG A 49 -9.124 -8.371 12.683 1.00 13.50 N ATOM 0 H ARG A 49 -5.019 -4.016 16.929 1.00 14.54 H new ATOM 0 HA ARG A 49 -7.663 -4.597 17.631 1.00 11.51 H new ATOM 0 HB2 ARG A 49 -5.435 -5.997 16.172 1.00 1.31 H new ATOM 0 HB3 ARG A 49 -6.868 -6.919 16.580 1.00 1.31 H new ATOM 0 HG2 ARG A 49 -8.278 -5.549 15.246 1.00 73.55 H new ATOM 0 HG3 ARG A 49 -7.095 -4.259 15.157 1.00 73.55 H new ATOM 0 HD2 ARG A 49 -6.769 -5.207 13.078 1.00 2.53 H new ATOM 0 HD3 ARG A 49 -5.597 -6.130 13.997 1.00 2.53 H new ATOM 0 HE ARG A 49 -6.860 -8.054 13.661 1.00 2.33 H new ATOM 0 HH11 ARG A 49 -8.814 -5.184 13.021 1.00 4.22 H new ATOM 0 HH12 ARG A 49 -10.176 -6.112 12.385 1.00 4.22 H new ATOM 0 HH21 ARG A 49 -8.612 -9.239 12.843 1.00 13.50 H new ATOM 0 HH22 ARG A 49 -10.063 -8.399 12.284 1.00 13.50 H new ATOM 787 N PRO A 50 -7.748 -6.137 19.567 1.00 70.03 N ATOM 788 CA PRO A 50 -7.836 -6.966 20.773 1.00 44.05 C ATOM 789 C PRO A 50 -7.674 -8.451 20.468 1.00 62.31 C ATOM 790 O PRO A 50 -7.069 -9.191 21.244 1.00 70.44 O ATOM 791 CB PRO A 50 -9.244 -6.678 21.299 1.00 21.41 C ATOM 792 CG PRO A 50 -10.019 -6.259 20.098 1.00 72.40 C ATOM 793 CD PRO A 50 -9.045 -5.540 19.207 1.00 71.05 C ATOM 0 HA PRO A 50 -7.045 -6.735 21.486 1.00 44.05 H new ATOM 0 HB2 PRO A 50 -9.681 -7.562 21.764 1.00 21.41 H new ATOM 0 HB3 PRO A 50 -9.231 -5.893 22.055 1.00 21.41 H new ATOM 0 HG2 PRO A 50 -10.449 -7.122 19.590 1.00 72.40 H new ATOM 0 HG3 PRO A 50 -10.848 -5.608 20.376 1.00 72.40 H new ATOM 0 HD2 PRO A 50 -9.278 -5.691 18.153 1.00 71.05 H new ATOM 0 HD3 PRO A 50 -9.056 -4.465 19.385 1.00 71.05 H new ATOM 801 N SER A 51 -8.218 -8.881 19.334 1.00 44.23 N ATOM 802 CA SER A 51 -8.136 -10.279 18.928 1.00 32.23 C ATOM 803 C SER A 51 -6.689 -10.762 18.931 1.00 61.12 C ATOM 804 O SER A 51 -6.414 -11.935 19.184 1.00 30.02 O ATOM 805 CB SER A 51 -8.745 -10.465 17.537 1.00 34.33 C ATOM 806 OG SER A 51 -8.423 -11.738 17.005 1.00 24.44 O ATOM 0 H SER A 51 -8.720 -8.281 18.680 1.00 44.23 H new ATOM 0 HA SER A 51 -8.700 -10.874 19.646 1.00 32.23 H new ATOM 0 HB2 SER A 51 -9.828 -10.354 17.593 1.00 34.33 H new ATOM 0 HB3 SER A 51 -8.379 -9.685 16.869 1.00 34.33 H new ATOM 0 HG SER A 51 -8.825 -11.832 16.116 1.00 24.44 H new ATOM 812 N VAL A 52 -5.766 -9.848 18.647 1.00 73.34 N ATOM 813 CA VAL A 52 -4.347 -10.179 18.617 1.00 44.13 C ATOM 814 C VAL A 52 -3.849 -10.590 19.998 1.00 42.22 C ATOM 815 O VAL A 52 -3.951 -9.827 20.958 1.00 61.23 O ATOM 816 CB VAL A 52 -3.504 -8.992 18.112 1.00 75.33 C ATOM 817 CG1 VAL A 52 -2.028 -9.357 18.087 1.00 71.44 C ATOM 818 CG2 VAL A 52 -3.977 -8.552 16.734 1.00 22.32 C ATOM 0 H VAL A 52 -5.976 -8.873 18.435 1.00 73.34 H new ATOM 0 HA VAL A 52 -4.232 -11.016 17.928 1.00 44.13 H new ATOM 0 HB VAL A 52 -3.635 -8.157 18.800 1.00 75.33 H new ATOM 0 HG11 VAL A 52 -1.449 -8.506 17.728 1.00 71.44 H new ATOM 0 HG12 VAL A 52 -1.701 -9.620 19.093 1.00 71.44 H new ATOM 0 HG13 VAL A 52 -1.875 -10.207 17.422 1.00 71.44 H new ATOM 0 HG21 VAL A 52 -3.371 -7.713 16.392 1.00 22.32 H new ATOM 0 HG22 VAL A 52 -3.877 -9.381 16.033 1.00 22.32 H new ATOM 0 HG23 VAL A 52 -5.022 -8.247 16.788 1.00 22.32 H new ATOM 828 N ASN A 53 -3.309 -11.801 20.090 1.00 11.11 N ATOM 829 CA ASN A 53 -2.795 -12.314 21.355 1.00 62.13 C ATOM 830 C ASN A 53 -1.607 -11.486 21.835 1.00 13.43 C ATOM 831 O ASN A 53 -0.910 -10.858 21.038 1.00 63.03 O ATOM 832 CB ASN A 53 -2.381 -13.779 21.204 1.00 71.42 C ATOM 833 CG ASN A 53 -3.561 -14.686 20.910 1.00 23.03 C ATOM 834 OD1 ASN A 53 -3.769 -15.103 19.771 1.00 64.41 O ATOM 835 ND2 ASN A 53 -4.340 -14.995 21.940 1.00 11.32 N ATOM 0 H ASN A 53 -3.216 -12.445 19.304 1.00 11.11 H new ATOM 0 HA ASN A 53 -3.590 -12.242 22.098 1.00 62.13 H new ATOM 0 HB2 ASN A 53 -1.650 -13.866 20.400 1.00 71.42 H new ATOM 0 HB3 ASN A 53 -1.890 -14.111 22.119 1.00 71.42 H new ATOM 0 HD21 ASN A 53 -5.149 -15.601 21.804 1.00 11.32 H new ATOM 0 HD22 ASN A 53 -4.129 -14.626 22.867 1.00 11.32 H new ATOM 842 N THR A 54 -1.382 -11.488 23.146 1.00 72.54 N ATOM 843 CA THR A 54 -0.280 -10.738 23.733 1.00 11.54 C ATOM 844 C THR A 54 1.035 -11.049 23.028 1.00 0.51 C ATOM 845 O THR A 54 1.817 -10.147 22.727 1.00 41.31 O ATOM 846 CB THR A 54 -0.129 -11.044 25.235 1.00 32.33 C ATOM 847 OG1 THR A 54 -1.260 -11.790 25.699 1.00 15.42 O ATOM 848 CG2 THR A 54 0.003 -9.760 26.039 1.00 13.25 C ATOM 0 H THR A 54 -1.949 -12.001 23.821 1.00 72.54 H new ATOM 0 HA THR A 54 -0.515 -9.681 23.607 1.00 11.54 H new ATOM 0 HB THR A 54 0.777 -11.634 25.373 1.00 32.33 H new ATOM 0 HG1 THR A 54 -1.156 -11.982 26.654 1.00 15.42 H new ATOM 0 HG21 THR A 54 0.108 -10.002 27.097 1.00 13.25 H new ATOM 0 HG22 THR A 54 0.882 -9.209 25.703 1.00 13.25 H new ATOM 0 HG23 THR A 54 -0.886 -9.147 25.894 1.00 13.25 H new ATOM 856 N ARG A 55 1.272 -12.330 22.767 1.00 45.21 N ATOM 857 CA ARG A 55 2.494 -12.759 22.097 1.00 61.30 C ATOM 858 C ARG A 55 2.704 -11.983 20.800 1.00 64.50 C ATOM 859 O ARG A 55 3.760 -11.387 20.586 1.00 30.11 O ATOM 860 CB ARG A 55 2.439 -14.260 21.803 1.00 4.42 C ATOM 861 CG ARG A 55 3.761 -14.974 22.033 1.00 2.25 C ATOM 862 CD ARG A 55 3.894 -15.450 23.472 1.00 42.43 C ATOM 863 NE ARG A 55 2.901 -16.467 23.806 1.00 51.32 N ATOM 864 CZ ARG A 55 2.858 -17.096 24.975 1.00 52.30 C ATOM 865 NH1 ARG A 55 3.747 -16.813 25.917 1.00 41.02 N ATOM 866 NH2 ARG A 55 1.923 -18.009 25.204 1.00 22.41 N ATOM 0 H ARG A 55 0.635 -13.089 23.009 1.00 45.21 H new ATOM 0 HA ARG A 55 3.334 -12.556 22.761 1.00 61.30 H new ATOM 0 HB2 ARG A 55 1.675 -14.717 22.431 1.00 4.42 H new ATOM 0 HB3 ARG A 55 2.131 -14.408 20.768 1.00 4.42 H new ATOM 0 HG2 ARG A 55 3.838 -15.826 21.358 1.00 2.25 H new ATOM 0 HG3 ARG A 55 4.585 -14.302 21.793 1.00 2.25 H new ATOM 0 HD2 ARG A 55 4.894 -15.854 23.629 1.00 42.43 H new ATOM 0 HD3 ARG A 55 3.784 -14.601 24.146 1.00 42.43 H new ATOM 0 HE ARG A 55 2.202 -16.708 23.103 1.00 51.32 H new ATOM 0 HH11 ARG A 55 4.466 -16.111 25.745 1.00 41.02 H new ATOM 0 HH12 ARG A 55 3.712 -17.298 26.814 1.00 41.02 H new ATOM 0 HH21 ARG A 55 1.237 -18.228 24.482 1.00 22.41 H new ATOM 0 HH22 ARG A 55 1.891 -18.492 26.102 1.00 22.41 H new ATOM 880 N ARG A 56 1.693 -11.997 19.938 1.00 40.31 N ATOM 881 CA ARG A 56 1.768 -11.296 18.662 1.00 72.25 C ATOM 882 C ARG A 56 2.144 -9.832 18.866 1.00 15.54 C ATOM 883 O ARG A 56 3.036 -9.309 18.199 1.00 5.11 O ATOM 884 CB ARG A 56 0.431 -11.392 17.924 1.00 63.54 C ATOM 885 CG ARG A 56 0.252 -12.692 17.156 1.00 74.00 C ATOM 886 CD ARG A 56 -1.209 -12.939 16.813 1.00 51.01 C ATOM 887 NE ARG A 56 -1.549 -14.359 16.857 1.00 13.42 N ATOM 888 CZ ARG A 56 -1.121 -15.245 15.965 1.00 31.15 C ATOM 889 NH1 ARG A 56 -0.340 -14.860 14.966 1.00 71.34 N ATOM 890 NH2 ARG A 56 -1.474 -16.520 16.073 1.00 2.32 N ATOM 0 H ARG A 56 0.813 -12.486 20.100 1.00 40.31 H new ATOM 0 HA ARG A 56 2.543 -11.771 18.061 1.00 72.25 H new ATOM 0 HB2 ARG A 56 -0.380 -11.291 18.645 1.00 63.54 H new ATOM 0 HB3 ARG A 56 0.347 -10.555 17.230 1.00 63.54 H new ATOM 0 HG2 ARG A 56 0.842 -12.659 16.240 1.00 74.00 H new ATOM 0 HG3 ARG A 56 0.633 -13.523 17.750 1.00 74.00 H new ATOM 0 HD2 ARG A 56 -1.843 -12.393 17.512 1.00 51.01 H new ATOM 0 HD3 ARG A 56 -1.419 -12.547 15.818 1.00 51.01 H new ATOM 0 HE ARG A 56 -2.148 -14.688 17.614 1.00 13.42 H new ATOM 0 HH11 ARG A 56 -0.066 -13.881 14.881 1.00 71.34 H new ATOM 0 HH12 ARG A 56 -0.013 -15.543 14.282 1.00 71.34 H new ATOM 0 HH21 ARG A 56 -2.074 -16.820 16.841 1.00 2.32 H new ATOM 0 HH22 ARG A 56 -1.145 -17.200 15.388 1.00 2.32 H new ATOM 904 N LYS A 57 1.456 -9.174 19.794 1.00 54.24 N ATOM 905 CA LYS A 57 1.716 -7.770 20.088 1.00 2.21 C ATOM 906 C LYS A 57 3.182 -7.552 20.448 1.00 65.42 C ATOM 907 O LYS A 57 3.865 -6.725 19.842 1.00 70.22 O ATOM 908 CB LYS A 57 0.823 -7.294 21.236 1.00 54.34 C ATOM 909 CG LYS A 57 -0.541 -6.802 20.781 1.00 21.51 C ATOM 910 CD LYS A 57 -1.563 -6.876 21.903 1.00 22.43 C ATOM 911 CE LYS A 57 -2.978 -6.679 21.382 1.00 31.32 C ATOM 912 NZ LYS A 57 -3.987 -7.345 22.252 1.00 51.02 N ATOM 0 H LYS A 57 0.714 -9.592 20.355 1.00 54.24 H new ATOM 0 HA LYS A 57 1.489 -7.190 19.194 1.00 2.21 H new ATOM 0 HB2 LYS A 57 0.688 -8.112 21.943 1.00 54.34 H new ATOM 0 HB3 LYS A 57 1.330 -6.491 21.771 1.00 54.34 H new ATOM 0 HG2 LYS A 57 -0.459 -5.774 20.429 1.00 21.51 H new ATOM 0 HG3 LYS A 57 -0.882 -7.401 19.937 1.00 21.51 H new ATOM 0 HD2 LYS A 57 -1.489 -7.843 22.401 1.00 22.43 H new ATOM 0 HD3 LYS A 57 -1.340 -6.115 22.650 1.00 22.43 H new ATOM 0 HE2 LYS A 57 -3.198 -5.613 21.321 1.00 31.32 H new ATOM 0 HE3 LYS A 57 -3.051 -7.078 20.370 1.00 31.32 H new ATOM 0 HZ1 LYS A 57 -4.884 -6.820 22.209 1.00 51.02 H new ATOM 0 HZ2 LYS A 57 -4.140 -8.319 21.923 1.00 51.02 H new ATOM 0 HZ3 LYS A 57 -3.643 -7.361 23.233 1.00 51.02 H new ATOM 926 N LEU A 58 3.662 -8.300 21.436 1.00 74.34 N ATOM 927 CA LEU A 58 5.048 -8.190 21.875 1.00 24.41 C ATOM 928 C LEU A 58 6.004 -8.289 20.691 1.00 43.35 C ATOM 929 O LEU A 58 6.880 -7.441 20.514 1.00 43.11 O ATOM 930 CB LEU A 58 5.369 -9.284 22.896 1.00 53.14 C ATOM 931 CG LEU A 58 6.838 -9.418 23.297 1.00 1.42 C ATOM 932 CD1 LEU A 58 7.043 -8.957 24.732 1.00 64.01 C ATOM 933 CD2 LEU A 58 7.310 -10.854 23.124 1.00 52.15 C ATOM 0 H LEU A 58 3.111 -8.989 21.948 1.00 74.34 H new ATOM 0 HA LEU A 58 5.178 -7.214 22.343 1.00 24.41 H new ATOM 0 HB2 LEU A 58 4.783 -9.096 23.796 1.00 53.14 H new ATOM 0 HB3 LEU A 58 5.035 -10.240 22.492 1.00 53.14 H new ATOM 0 HG LEU A 58 7.433 -8.780 22.643 1.00 1.42 H new ATOM 0 HD11 LEU A 58 8.094 -9.059 25.000 1.00 64.01 H new ATOM 0 HD12 LEU A 58 6.745 -7.913 24.825 1.00 64.01 H new ATOM 0 HD13 LEU A 58 6.437 -9.568 25.401 1.00 64.01 H new ATOM 0 HD21 LEU A 58 8.358 -10.930 23.414 1.00 52.15 H new ATOM 0 HD22 LEU A 58 6.711 -11.512 23.753 1.00 52.15 H new ATOM 0 HD23 LEU A 58 7.200 -11.150 22.081 1.00 52.15 H new ATOM 945 N LEU A 59 5.829 -9.327 19.880 1.00 3.33 N ATOM 946 CA LEU A 59 6.675 -9.535 18.710 1.00 20.01 C ATOM 947 C LEU A 59 6.701 -8.291 17.828 1.00 12.44 C ATOM 948 O LEU A 59 7.766 -7.819 17.433 1.00 23.24 O ATOM 949 CB LEU A 59 6.177 -10.735 17.903 1.00 34.33 C ATOM 950 CG LEU A 59 6.431 -12.111 18.520 1.00 22.13 C ATOM 951 CD1 LEU A 59 5.985 -13.213 17.571 1.00 3.51 C ATOM 952 CD2 LEU A 59 7.902 -12.273 18.874 1.00 3.24 C ATOM 0 H LEU A 59 5.109 -10.037 20.011 1.00 3.33 H new ATOM 0 HA LEU A 59 7.689 -9.733 19.057 1.00 20.01 H new ATOM 0 HB2 LEU A 59 5.104 -10.622 17.746 1.00 34.33 H new ATOM 0 HB3 LEU A 59 6.648 -10.707 16.920 1.00 34.33 H new ATOM 0 HG LEU A 59 5.846 -12.190 19.436 1.00 22.13 H new ATOM 0 HD11 LEU A 59 6.174 -14.185 18.027 1.00 3.51 H new ATOM 0 HD12 LEU A 59 4.919 -13.109 17.367 1.00 3.51 H new ATOM 0 HD13 LEU A 59 6.542 -13.136 16.637 1.00 3.51 H new ATOM 0 HD21 LEU A 59 8.065 -13.258 19.312 1.00 3.24 H new ATOM 0 HD22 LEU A 59 8.506 -12.172 17.973 1.00 3.24 H new ATOM 0 HD23 LEU A 59 8.190 -11.505 19.592 1.00 3.24 H new ATOM 964 N GLY A 60 5.519 -7.762 17.525 1.00 2.41 N ATOM 965 CA GLY A 60 5.429 -6.575 16.694 1.00 33.31 C ATOM 966 C GLY A 60 6.157 -5.389 17.295 1.00 34.44 C ATOM 967 O GLY A 60 6.702 -4.555 16.573 1.00 44.35 O ATOM 0 H GLY A 60 4.623 -8.134 17.840 1.00 2.41 H new ATOM 0 HA2 GLY A 60 5.845 -6.792 15.710 1.00 33.31 H new ATOM 0 HA3 GLY A 60 4.380 -6.317 16.547 1.00 33.31 H new ATOM 971 N LEU A 61 6.164 -5.312 18.622 1.00 62.54 N ATOM 972 CA LEU A 61 6.829 -4.218 19.321 1.00 63.43 C ATOM 973 C LEU A 61 8.342 -4.294 19.136 1.00 14.23 C ATOM 974 O LEU A 61 8.990 -3.294 18.826 1.00 71.35 O ATOM 975 CB LEU A 61 6.483 -4.254 20.810 1.00 2.33 C ATOM 976 CG LEU A 61 6.502 -2.908 21.536 1.00 43.21 C ATOM 977 CD1 LEU A 61 7.900 -2.309 21.514 1.00 23.40 C ATOM 978 CD2 LEU A 61 5.500 -1.950 20.909 1.00 42.42 C ATOM 0 H LEU A 61 5.717 -5.994 19.235 1.00 62.54 H new ATOM 0 HA LEU A 61 6.476 -3.279 18.895 1.00 63.43 H new ATOM 0 HB2 LEU A 61 5.490 -4.690 20.921 1.00 2.33 H new ATOM 0 HB3 LEU A 61 7.183 -4.923 21.309 1.00 2.33 H new ATOM 0 HG LEU A 61 6.216 -3.073 22.575 1.00 43.21 H new ATOM 0 HD11 LEU A 61 7.894 -1.352 22.035 1.00 23.40 H new ATOM 0 HD12 LEU A 61 8.594 -2.988 22.009 1.00 23.40 H new ATOM 0 HD13 LEU A 61 8.215 -2.158 20.481 1.00 23.40 H new ATOM 0 HD21 LEU A 61 5.527 -0.997 21.438 1.00 42.42 H new ATOM 0 HD22 LEU A 61 5.755 -1.791 19.861 1.00 42.42 H new ATOM 0 HD23 LEU A 61 4.499 -2.375 20.978 1.00 42.42 H new ATOM 990 N TYR A 62 8.897 -5.485 19.328 1.00 72.21 N ATOM 991 CA TYR A 62 10.333 -5.691 19.183 1.00 31.40 C ATOM 992 C TYR A 62 10.770 -5.484 17.736 1.00 32.20 C ATOM 993 O TYR A 62 11.861 -4.979 17.471 1.00 43.24 O ATOM 994 CB TYR A 62 10.717 -7.097 19.647 1.00 31.41 C ATOM 995 CG TYR A 62 11.020 -7.185 21.126 1.00 64.22 C ATOM 996 CD1 TYR A 62 12.044 -6.435 21.691 1.00 41.11 C ATOM 997 CD2 TYR A 62 10.282 -8.018 21.958 1.00 64.11 C ATOM 998 CE1 TYR A 62 12.325 -6.513 23.041 1.00 1.31 C ATOM 999 CE2 TYR A 62 10.555 -8.101 23.310 1.00 65.13 C ATOM 1000 CZ TYR A 62 11.578 -7.347 23.846 1.00 0.03 C ATOM 1001 OH TYR A 62 11.854 -7.426 25.192 1.00 30.21 O ATOM 0 H TYR A 62 8.374 -6.323 19.584 1.00 72.21 H new ATOM 0 HA TYR A 62 10.844 -4.957 19.806 1.00 31.40 H new ATOM 0 HB2 TYR A 62 9.904 -7.783 19.410 1.00 31.41 H new ATOM 0 HB3 TYR A 62 11.590 -7.430 19.085 1.00 31.41 H new ATOM 0 HD1 TYR A 62 12.630 -5.780 21.064 1.00 41.11 H new ATOM 0 HD2 TYR A 62 9.481 -8.611 21.541 1.00 64.11 H new ATOM 0 HE1 TYR A 62 13.125 -5.924 23.464 1.00 1.31 H new ATOM 0 HE2 TYR A 62 9.971 -8.752 23.943 1.00 65.13 H new ATOM 0 HH TYR A 62 11.236 -8.057 25.616 1.00 30.21 H new ATOM 1011 N LEU A 63 9.910 -5.878 16.803 1.00 14.24 N ATOM 1012 CA LEU A 63 10.204 -5.735 15.382 1.00 64.53 C ATOM 1013 C LEU A 63 10.256 -4.265 14.981 1.00 44.30 C ATOM 1014 O LEU A 63 11.253 -3.796 14.432 1.00 50.12 O ATOM 1015 CB LEU A 63 9.151 -6.466 14.547 1.00 64.42 C ATOM 1016 CG LEU A 63 9.305 -6.358 13.029 1.00 32.52 C ATOM 1017 CD1 LEU A 63 10.668 -6.872 12.593 1.00 42.43 C ATOM 1018 CD2 LEU A 63 8.194 -7.124 12.325 1.00 22.42 C ATOM 0 H LEU A 63 9.003 -6.299 17.006 1.00 14.24 H new ATOM 0 HA LEU A 63 11.182 -6.179 15.193 1.00 64.53 H new ATOM 0 HB2 LEU A 63 9.168 -7.521 14.820 1.00 64.42 H new ATOM 0 HB3 LEU A 63 8.168 -6.082 14.821 1.00 64.42 H new ATOM 0 HG LEU A 63 9.229 -5.307 12.749 1.00 32.52 H new ATOM 0 HD11 LEU A 63 10.759 -6.787 11.510 1.00 42.43 H new ATOM 0 HD12 LEU A 63 11.450 -6.281 13.070 1.00 42.43 H new ATOM 0 HD13 LEU A 63 10.773 -7.917 12.885 1.00 42.43 H new ATOM 0 HD21 LEU A 63 8.319 -7.036 11.246 1.00 22.42 H new ATOM 0 HD22 LEU A 63 8.239 -8.175 12.611 1.00 22.42 H new ATOM 0 HD23 LEU A 63 7.228 -6.710 12.613 1.00 22.42 H new ATOM 1030 N MET A 64 9.177 -3.542 15.262 1.00 42.34 N ATOM 1031 CA MET A 64 9.102 -2.123 14.933 1.00 12.23 C ATOM 1032 C MET A 64 10.186 -1.337 15.665 1.00 73.24 C ATOM 1033 O MET A 64 10.668 -0.319 15.170 1.00 32.30 O ATOM 1034 CB MET A 64 7.722 -1.567 15.292 1.00 5.14 C ATOM 1035 CG MET A 64 7.581 -1.192 16.759 1.00 43.02 C ATOM 1036 SD MET A 64 7.942 0.547 17.069 1.00 55.44 S ATOM 1037 CE MET A 64 7.342 0.723 18.747 1.00 0.42 C ATOM 0 H MET A 64 8.343 -3.915 15.716 1.00 42.34 H new ATOM 0 HA MET A 64 9.262 -2.015 13.860 1.00 12.23 H new ATOM 0 HB2 MET A 64 7.523 -0.687 14.680 1.00 5.14 H new ATOM 0 HB3 MET A 64 6.964 -2.309 15.040 1.00 5.14 H new ATOM 0 HG2 MET A 64 6.567 -1.413 17.091 1.00 43.02 H new ATOM 0 HG3 MET A 64 8.253 -1.810 17.354 1.00 43.02 H new ATOM 0 HE1 MET A 64 7.496 1.749 19.083 1.00 0.42 H new ATOM 0 HE2 MET A 64 6.279 0.486 18.780 1.00 0.42 H new ATOM 0 HE3 MET A 64 7.886 0.042 19.401 1.00 0.42 H new ATOM 1047 N ASN A 65 10.564 -1.817 16.845 1.00 34.10 N ATOM 1048 CA ASN A 65 11.590 -1.159 17.645 1.00 42.53 C ATOM 1049 C ASN A 65 12.962 -1.300 16.992 1.00 20.02 C ATOM 1050 O ASN A 65 13.710 -0.329 16.878 1.00 42.44 O ATOM 1051 CB ASN A 65 11.622 -1.747 19.057 1.00 54.42 C ATOM 1052 CG ASN A 65 12.452 -0.912 20.012 1.00 25.23 C ATOM 1053 OD1 ASN A 65 12.484 0.315 19.916 1.00 34.25 O ATOM 1054 ND2 ASN A 65 13.131 -1.576 20.941 1.00 64.24 N ATOM 0 H ASN A 65 10.175 -2.660 17.268 1.00 34.10 H new ATOM 0 HA ASN A 65 11.343 -0.099 17.706 1.00 42.53 H new ATOM 0 HB2 ASN A 65 10.604 -1.825 19.438 1.00 54.42 H new ATOM 0 HB3 ASN A 65 12.026 -2.758 19.017 1.00 54.42 H new ATOM 0 HD21 ASN A 65 13.708 -1.068 21.611 1.00 64.24 H new ATOM 0 HD22 ASN A 65 13.075 -2.594 20.984 1.00 64.24 H new ATOM 1061 N HIS A 66 13.286 -2.517 16.565 1.00 13.44 N ATOM 1062 CA HIS A 66 14.567 -2.786 15.923 1.00 42.42 C ATOM 1063 C HIS A 66 14.645 -2.104 14.560 1.00 4.11 C ATOM 1064 O HIS A 66 15.718 -1.686 14.124 1.00 2.12 O ATOM 1065 CB HIS A 66 14.776 -4.292 15.765 1.00 4.03 C ATOM 1066 CG HIS A 66 16.210 -4.681 15.571 1.00 12.53 C ATOM 1067 ND1 HIS A 66 17.228 -4.233 16.386 1.00 11.34 N ATOM 1068 CD2 HIS A 66 16.793 -5.481 14.649 1.00 31.51 C ATOM 1069 CE1 HIS A 66 18.375 -4.740 15.973 1.00 45.12 C ATOM 1070 NE2 HIS A 66 18.139 -5.502 14.920 1.00 10.21 N ATOM 0 H HIS A 66 12.679 -3.332 16.652 1.00 13.44 H new ATOM 0 HA HIS A 66 15.356 -2.382 16.558 1.00 42.42 H new ATOM 0 HB2 HIS A 66 14.387 -4.799 16.648 1.00 4.03 H new ATOM 0 HB3 HIS A 66 14.194 -4.644 14.913 1.00 4.03 H new ATOM 0 HD2 HIS A 66 16.293 -6.006 13.848 1.00 31.51 H new ATOM 0 HE1 HIS A 66 19.342 -4.562 16.420 1.00 45.12 H new ATOM 0 HE2 HIS A 66 18.842 -6.021 14.394 1.00 10.21 H new ATOM 1078 N VAL A 67 13.502 -1.996 13.891 1.00 13.23 N ATOM 1079 CA VAL A 67 13.441 -1.365 12.578 1.00 14.23 C ATOM 1080 C VAL A 67 13.681 0.137 12.679 1.00 54.41 C ATOM 1081 O VAL A 67 14.505 0.695 11.955 1.00 41.24 O ATOM 1082 CB VAL A 67 12.080 -1.612 11.900 1.00 42.14 C ATOM 1083 CG1 VAL A 67 12.003 -0.872 10.573 1.00 12.31 C ATOM 1084 CG2 VAL A 67 11.847 -3.102 11.702 1.00 34.14 C ATOM 0 H VAL A 67 12.605 -2.337 14.237 1.00 13.23 H new ATOM 0 HA VAL A 67 14.227 -1.816 11.973 1.00 14.23 H new ATOM 0 HB VAL A 67 11.294 -1.227 12.550 1.00 42.14 H new ATOM 0 HG11 VAL A 67 11.035 -1.058 10.108 1.00 12.31 H new ATOM 0 HG12 VAL A 67 12.123 0.198 10.745 1.00 12.31 H new ATOM 0 HG13 VAL A 67 12.796 -1.225 9.913 1.00 12.31 H new ATOM 0 HG21 VAL A 67 10.881 -3.259 11.222 1.00 34.14 H new ATOM 0 HG22 VAL A 67 12.636 -3.513 11.072 1.00 34.14 H new ATOM 0 HG23 VAL A 67 11.857 -3.604 12.670 1.00 34.14 H new ATOM 1094 N VAL A 68 12.955 0.788 13.583 1.00 74.04 N ATOM 1095 CA VAL A 68 13.089 2.226 13.780 1.00 44.32 C ATOM 1096 C VAL A 68 14.449 2.574 14.376 1.00 15.33 C ATOM 1097 O VAL A 68 15.015 3.626 14.082 1.00 12.50 O ATOM 1098 CB VAL A 68 11.982 2.773 14.700 1.00 31.34 C ATOM 1099 CG1 VAL A 68 10.608 2.441 14.138 1.00 0.20 C ATOM 1100 CG2 VAL A 68 12.139 2.219 16.108 1.00 34.24 C ATOM 0 H VAL A 68 12.268 0.342 14.190 1.00 74.04 H new ATOM 0 HA VAL A 68 12.996 2.690 12.798 1.00 44.32 H new ATOM 0 HB VAL A 68 12.076 3.858 14.748 1.00 31.34 H new ATOM 0 HG11 VAL A 68 9.838 2.835 14.802 1.00 0.20 H new ATOM 0 HG12 VAL A 68 10.501 2.890 13.151 1.00 0.20 H new ATOM 0 HG13 VAL A 68 10.499 1.359 14.059 1.00 0.20 H new ATOM 0 HG21 VAL A 68 11.349 2.616 16.745 1.00 34.24 H new ATOM 0 HG22 VAL A 68 12.072 1.131 16.081 1.00 34.24 H new ATOM 0 HG23 VAL A 68 13.109 2.512 16.508 1.00 34.24 H new ATOM 1110 N GLN A 69 14.966 1.683 15.215 1.00 21.14 N ATOM 1111 CA GLN A 69 16.260 1.896 15.854 1.00 54.44 C ATOM 1112 C GLN A 69 17.398 1.695 14.858 1.00 35.45 C ATOM 1113 O GLN A 69 18.339 2.486 14.810 1.00 54.14 O ATOM 1114 CB GLN A 69 16.430 0.946 17.040 1.00 15.33 C ATOM 1115 CG GLN A 69 15.791 1.454 18.323 1.00 52.32 C ATOM 1116 CD GLN A 69 16.150 0.609 19.529 1.00 64.24 C ATOM 1117 OE1 GLN A 69 17.281 0.138 19.656 1.00 1.35 O ATOM 1118 NE2 GLN A 69 15.188 0.411 20.422 1.00 53.23 N ATOM 0 H GLN A 69 14.509 0.807 15.468 1.00 21.14 H new ATOM 0 HA GLN A 69 16.294 2.924 16.214 1.00 54.44 H new ATOM 0 HB2 GLN A 69 15.996 -0.021 16.786 1.00 15.33 H new ATOM 0 HB3 GLN A 69 17.493 0.782 17.214 1.00 15.33 H new ATOM 0 HG2 GLN A 69 16.106 2.483 18.498 1.00 52.32 H new ATOM 0 HG3 GLN A 69 14.708 1.468 18.204 1.00 52.32 H new ATOM 0 HE21 GLN A 69 14.265 0.820 20.277 1.00 53.23 H new ATOM 0 HE22 GLN A 69 15.372 -0.150 21.254 1.00 53.23 H new ATOM 1127 N GLN A 70 17.304 0.630 14.068 1.00 50.31 N ATOM 1128 CA GLN A 70 18.327 0.325 13.075 1.00 71.32 C ATOM 1129 C GLN A 70 18.232 1.274 11.885 1.00 14.32 C ATOM 1130 O GLN A 70 19.235 1.583 11.243 1.00 71.21 O ATOM 1131 CB GLN A 70 18.190 -1.123 12.599 1.00 11.34 C ATOM 1132 CG GLN A 70 18.554 -2.149 13.660 1.00 0.44 C ATOM 1133 CD GLN A 70 20.033 -2.481 13.668 1.00 42.32 C ATOM 1134 OE1 GLN A 70 20.693 -2.405 14.705 1.00 70.33 O ATOM 1135 NE2 GLN A 70 20.563 -2.851 12.508 1.00 72.22 N ATOM 0 H GLN A 70 16.531 -0.035 14.096 1.00 50.31 H new ATOM 0 HA GLN A 70 19.302 0.456 13.544 1.00 71.32 H new ATOM 0 HB2 GLN A 70 17.163 -1.295 12.276 1.00 11.34 H new ATOM 0 HB3 GLN A 70 18.827 -1.272 11.727 1.00 11.34 H new ATOM 0 HG2 GLN A 70 18.265 -1.770 14.640 1.00 0.44 H new ATOM 0 HG3 GLN A 70 17.982 -3.061 13.490 1.00 0.44 H new ATOM 0 HE21 GLN A 70 19.979 -2.900 11.673 1.00 72.22 H new ATOM 0 HE22 GLN A 70 21.554 -3.086 12.452 1.00 72.22 H new ATOM 1144 N ALA A 71 17.018 1.734 11.597 1.00 3.01 N ATOM 1145 CA ALA A 71 16.792 2.650 10.486 1.00 64.32 C ATOM 1146 C ALA A 71 17.747 3.837 10.550 1.00 13.43 C ATOM 1147 O ALA A 71 18.156 4.375 9.521 1.00 11.21 O ATOM 1148 CB ALA A 71 15.349 3.130 10.483 1.00 73.24 C ATOM 0 H ALA A 71 16.177 1.487 12.118 1.00 3.01 H new ATOM 0 HA ALA A 71 16.986 2.112 9.558 1.00 64.32 H new ATOM 0 HB1 ALA A 71 15.195 3.813 9.648 1.00 73.24 H new ATOM 0 HB2 ALA A 71 14.681 2.275 10.380 1.00 73.24 H new ATOM 0 HB3 ALA A 71 15.135 3.647 11.419 1.00 73.24 H new ATOM 1154 N LYS A 72 18.098 4.243 11.766 1.00 54.01 N ATOM 1155 CA LYS A 72 19.004 5.367 11.966 1.00 45.12 C ATOM 1156 C LYS A 72 20.315 5.148 11.217 1.00 4.43 C ATOM 1157 O LYS A 72 20.951 6.101 10.768 1.00 61.13 O ATOM 1158 CB LYS A 72 19.284 5.565 13.458 1.00 75.25 C ATOM 1159 CG LYS A 72 18.353 6.563 14.123 1.00 14.34 C ATOM 1160 CD LYS A 72 18.833 6.930 15.517 1.00 21.15 C ATOM 1161 CE LYS A 72 19.859 8.052 15.476 1.00 25.43 C ATOM 1162 NZ LYS A 72 19.215 9.394 15.480 1.00 33.12 N ATOM 0 H LYS A 72 17.768 3.809 12.628 1.00 54.01 H new ATOM 0 HA LYS A 72 18.524 6.263 11.571 1.00 45.12 H new ATOM 0 HB2 LYS A 72 19.197 4.605 13.966 1.00 75.25 H new ATOM 0 HB3 LYS A 72 20.313 5.900 13.585 1.00 75.25 H new ATOM 0 HG2 LYS A 72 18.286 7.463 13.512 1.00 14.34 H new ATOM 0 HG3 LYS A 72 17.349 6.142 14.182 1.00 14.34 H new ATOM 0 HD2 LYS A 72 17.983 7.235 16.127 1.00 21.15 H new ATOM 0 HD3 LYS A 72 19.270 6.053 15.995 1.00 21.15 H new ATOM 0 HE2 LYS A 72 20.525 7.966 16.335 1.00 25.43 H new ATOM 0 HE3 LYS A 72 20.475 7.948 14.583 1.00 25.43 H new ATOM 0 HZ1 LYS A 72 19.948 10.131 15.451 1.00 33.12 H new ATOM 0 HZ2 LYS A 72 18.599 9.486 14.647 1.00 33.12 H new ATOM 0 HZ3 LYS A 72 18.647 9.504 16.344 1.00 33.12 H new ATOM 1176 N GLY A 73 20.714 3.887 11.086 1.00 75.40 N ATOM 1177 CA GLY A 73 21.946 3.566 10.390 1.00 51.21 C ATOM 1178 C GLY A 73 21.764 3.506 8.886 1.00 34.23 C ATOM 1179 O GLY A 73 22.727 3.643 8.133 1.00 72.54 O ATOM 0 H GLY A 73 20.205 3.081 11.450 1.00 75.40 H new ATOM 0 HA2 GLY A 73 22.702 4.313 10.632 1.00 51.21 H new ATOM 0 HA3 GLY A 73 22.321 2.607 10.746 1.00 51.21 H new ATOM 1183 N GLN A 74 20.525 3.299 8.450 1.00 65.13 N ATOM 1184 CA GLN A 74 20.222 3.218 7.026 1.00 55.21 C ATOM 1185 C GLN A 74 19.673 4.545 6.510 1.00 31.44 C ATOM 1186 O GLN A 74 19.029 4.597 5.463 1.00 54.24 O ATOM 1187 CB GLN A 74 19.214 2.098 6.761 1.00 52.44 C ATOM 1188 CG GLN A 74 19.861 0.755 6.464 1.00 0.14 C ATOM 1189 CD GLN A 74 19.112 -0.404 7.091 1.00 22.42 C ATOM 1190 OE1 GLN A 74 18.515 -1.223 6.392 1.00 32.21 O ATOM 1191 NE2 GLN A 74 19.140 -0.480 8.417 1.00 64.43 N ATOM 0 H GLN A 74 19.717 3.185 9.061 1.00 65.13 H new ATOM 0 HA GLN A 74 21.148 2.997 6.495 1.00 55.21 H new ATOM 0 HB2 GLN A 74 18.563 1.994 7.629 1.00 52.44 H new ATOM 0 HB3 GLN A 74 18.582 2.381 5.920 1.00 52.44 H new ATOM 0 HG2 GLN A 74 19.910 0.610 5.385 1.00 0.14 H new ATOM 0 HG3 GLN A 74 20.887 0.761 6.831 1.00 0.14 H new ATOM 0 HE21 GLN A 74 19.647 0.221 8.957 1.00 64.43 H new ATOM 0 HE22 GLN A 74 18.654 -1.239 8.895 1.00 64.43 H new ATOM 1200 N LYS A 75 19.932 5.615 7.253 1.00 1.24 N ATOM 1201 CA LYS A 75 19.466 6.943 6.872 1.00 33.01 C ATOM 1202 C LYS A 75 17.971 6.928 6.569 1.00 12.31 C ATOM 1203 O LYS A 75 17.550 7.258 5.460 1.00 71.01 O ATOM 1204 CB LYS A 75 20.239 7.447 5.652 1.00 64.24 C ATOM 1205 CG LYS A 75 21.643 7.927 5.977 1.00 0.21 C ATOM 1206 CD LYS A 75 22.649 6.790 5.921 1.00 32.41 C ATOM 1207 CE LYS A 75 23.178 6.582 4.510 1.00 11.33 C ATOM 1208 NZ LYS A 75 22.293 5.689 3.712 1.00 44.01 N ATOM 0 H LYS A 75 20.463 5.589 8.124 1.00 1.24 H new ATOM 0 HA LYS A 75 19.643 7.617 7.710 1.00 33.01 H new ATOM 0 HB2 LYS A 75 20.299 6.647 4.915 1.00 64.24 H new ATOM 0 HB3 LYS A 75 19.682 8.263 5.192 1.00 64.24 H new ATOM 0 HG2 LYS A 75 21.934 8.706 5.273 1.00 0.21 H new ATOM 0 HG3 LYS A 75 21.654 8.375 6.971 1.00 0.21 H new ATOM 0 HD2 LYS A 75 23.479 7.004 6.594 1.00 32.41 H new ATOM 0 HD3 LYS A 75 22.181 5.871 6.274 1.00 32.41 H new ATOM 0 HE2 LYS A 75 23.267 7.546 4.010 1.00 11.33 H new ATOM 0 HE3 LYS A 75 24.179 6.154 4.557 1.00 11.33 H new ATOM 0 HZ1 LYS A 75 22.862 5.170 3.013 1.00 44.01 H new ATOM 0 HZ2 LYS A 75 21.821 5.012 4.345 1.00 44.01 H new ATOM 0 HZ3 LYS A 75 21.577 6.260 3.220 1.00 44.01 H new ATOM 1222 N ILE A 76 17.174 6.546 7.561 1.00 24.34 N ATOM 1223 CA ILE A 76 15.727 6.491 7.401 1.00 53.24 C ATOM 1224 C ILE A 76 15.020 7.243 8.524 1.00 62.13 C ATOM 1225 O ILE A 76 15.204 6.935 9.702 1.00 50.13 O ATOM 1226 CB ILE A 76 15.218 5.038 7.371 1.00 32.14 C ATOM 1227 CG1 ILE A 76 16.152 4.164 6.532 1.00 5.14 C ATOM 1228 CG2 ILE A 76 13.800 4.984 6.823 1.00 14.23 C ATOM 1229 CD1 ILE A 76 15.688 2.730 6.406 1.00 14.11 C ATOM 0 H ILE A 76 17.507 6.270 8.485 1.00 24.34 H new ATOM 0 HA ILE A 76 15.497 6.967 6.448 1.00 53.24 H new ATOM 0 HB ILE A 76 15.208 4.652 8.390 1.00 32.14 H new ATOM 0 HG12 ILE A 76 16.243 4.597 5.536 1.00 5.14 H new ATOM 0 HG13 ILE A 76 17.147 4.178 6.978 1.00 5.14 H new ATOM 0 HG21 ILE A 76 13.455 3.950 6.808 1.00 14.23 H new ATOM 0 HG22 ILE A 76 13.142 5.577 7.458 1.00 14.23 H new ATOM 0 HG23 ILE A 76 13.786 5.386 5.810 1.00 14.23 H new ATOM 0 HD11 ILE A 76 16.398 2.170 5.798 1.00 14.11 H new ATOM 0 HD12 ILE A 76 15.624 2.280 7.397 1.00 14.11 H new ATOM 0 HD13 ILE A 76 14.707 2.705 5.932 1.00 14.11 H new ATOM 1241 N ILE A 77 14.211 8.228 8.151 1.00 54.33 N ATOM 1242 CA ILE A 77 13.474 9.022 9.126 1.00 30.15 C ATOM 1243 C ILE A 77 11.969 8.863 8.941 1.00 72.04 C ATOM 1244 O ILE A 77 11.199 8.995 9.892 1.00 43.42 O ATOM 1245 CB ILE A 77 13.837 10.515 9.027 1.00 3.22 C ATOM 1246 CG1 ILE A 77 15.357 10.693 9.011 1.00 70.33 C ATOM 1247 CG2 ILE A 77 13.221 11.288 10.183 1.00 12.34 C ATOM 1248 CD1 ILE A 77 16.040 10.168 10.254 1.00 62.31 C ATOM 0 H ILE A 77 14.049 8.496 7.180 1.00 54.33 H new ATOM 0 HA ILE A 77 13.757 8.652 10.111 1.00 30.15 H new ATOM 0 HB ILE A 77 13.433 10.910 8.095 1.00 3.22 H new ATOM 0 HG12 ILE A 77 15.765 10.182 8.139 1.00 70.33 H new ATOM 0 HG13 ILE A 77 15.589 11.752 8.898 1.00 70.33 H new ATOM 0 HG21 ILE A 77 13.487 12.342 10.099 1.00 12.34 H new ATOM 0 HG22 ILE A 77 12.136 11.184 10.153 1.00 12.34 H new ATOM 0 HG23 ILE A 77 13.598 10.893 11.127 1.00 12.34 H new ATOM 0 HD11 ILE A 77 17.115 10.327 10.173 1.00 62.31 H new ATOM 0 HD12 ILE A 77 15.660 10.696 11.129 1.00 62.31 H new ATOM 0 HD13 ILE A 77 15.838 9.102 10.357 1.00 62.31 H new ATOM 1260 N GLN A 78 11.557 8.577 7.710 1.00 61.33 N ATOM 1261 CA GLN A 78 10.143 8.398 7.400 1.00 45.42 C ATOM 1262 C GLN A 78 9.521 7.331 8.293 1.00 33.22 C ATOM 1263 O GLN A 78 8.389 7.476 8.755 1.00 12.23 O ATOM 1264 CB GLN A 78 9.966 8.016 5.929 1.00 4.52 C ATOM 1265 CG GLN A 78 10.246 9.159 4.966 1.00 74.10 C ATOM 1266 CD GLN A 78 11.714 9.276 4.609 1.00 63.50 C ATOM 1267 OE1 GLN A 78 12.271 8.410 3.933 1.00 25.24 O ATOM 1268 NE2 GLN A 78 12.350 10.350 5.062 1.00 64.44 N ATOM 0 H GLN A 78 12.182 8.464 6.912 1.00 61.33 H new ATOM 0 HA GLN A 78 9.634 9.343 7.586 1.00 45.42 H new ATOM 0 HB2 GLN A 78 10.631 7.184 5.696 1.00 4.52 H new ATOM 0 HB3 GLN A 78 8.947 7.663 5.774 1.00 4.52 H new ATOM 0 HG2 GLN A 78 9.665 9.012 4.055 1.00 74.10 H new ATOM 0 HG3 GLN A 78 9.909 10.095 5.411 1.00 74.10 H new ATOM 0 HE21 GLN A 78 11.849 11.042 5.619 1.00 64.44 H new ATOM 0 HE22 GLN A 78 13.340 10.483 4.853 1.00 64.44 H new ATOM 1277 N PHE A 79 10.267 6.257 8.532 1.00 11.54 N ATOM 1278 CA PHE A 79 9.787 5.164 9.370 1.00 44.13 C ATOM 1279 C PHE A 79 9.727 5.587 10.835 1.00 60.15 C ATOM 1280 O PHE A 79 8.828 5.181 11.571 1.00 4.41 O ATOM 1281 CB PHE A 79 10.694 3.941 9.217 1.00 2.21 C ATOM 1282 CG PHE A 79 10.087 2.844 8.390 1.00 0.12 C ATOM 1283 CD1 PHE A 79 8.843 2.324 8.711 1.00 43.34 C ATOM 1284 CD2 PHE A 79 10.760 2.332 7.293 1.00 43.34 C ATOM 1285 CE1 PHE A 79 8.282 1.315 7.952 1.00 75.14 C ATOM 1286 CE2 PHE A 79 10.203 1.323 6.530 1.00 44.43 C ATOM 1287 CZ PHE A 79 8.963 0.813 6.860 1.00 1.22 C ATOM 0 H PHE A 79 11.206 6.120 8.157 1.00 11.54 H new ATOM 0 HA PHE A 79 8.780 4.904 9.044 1.00 44.13 H new ATOM 0 HB2 PHE A 79 11.634 4.251 8.761 1.00 2.21 H new ATOM 0 HB3 PHE A 79 10.933 3.550 10.206 1.00 2.21 H new ATOM 0 HD1 PHE A 79 8.306 2.712 9.564 1.00 43.34 H new ATOM 0 HD2 PHE A 79 11.731 2.726 7.031 1.00 43.34 H new ATOM 0 HE1 PHE A 79 7.312 0.919 8.212 1.00 75.14 H new ATOM 0 HE2 PHE A 79 10.737 0.934 5.676 1.00 44.43 H new ATOM 0 HZ PHE A 79 8.527 0.024 6.266 1.00 1.22 H new ATOM 1297 N GLN A 80 10.690 6.404 11.249 1.00 64.44 N ATOM 1298 CA GLN A 80 10.748 6.880 12.625 1.00 13.44 C ATOM 1299 C GLN A 80 9.476 7.638 12.992 1.00 1.34 C ATOM 1300 O GLN A 80 8.852 7.364 14.018 1.00 43.13 O ATOM 1301 CB GLN A 80 11.968 7.781 12.825 1.00 30.22 C ATOM 1302 CG GLN A 80 13.292 7.074 12.584 1.00 71.30 C ATOM 1303 CD GLN A 80 14.480 8.011 12.675 1.00 15.44 C ATOM 1304 OE1 GLN A 80 14.354 9.215 12.445 1.00 23.44 O ATOM 1305 NE2 GLN A 80 15.641 7.464 13.013 1.00 45.41 N ATOM 0 H GLN A 80 11.440 6.750 10.651 1.00 64.44 H new ATOM 0 HA GLN A 80 10.835 6.013 13.280 1.00 13.44 H new ATOM 0 HB2 GLN A 80 11.893 8.635 12.151 1.00 30.22 H new ATOM 0 HB3 GLN A 80 11.956 8.175 13.841 1.00 30.22 H new ATOM 0 HG2 GLN A 80 13.410 6.273 13.314 1.00 71.30 H new ATOM 0 HG3 GLN A 80 13.276 6.608 11.599 1.00 71.30 H new ATOM 0 HE21 GLN A 80 15.699 6.462 13.195 1.00 45.41 H new ATOM 0 HE22 GLN A 80 16.475 8.046 13.091 1.00 45.41 H new ATOM 1314 N ASP A 81 9.098 8.592 12.149 1.00 50.41 N ATOM 1315 CA ASP A 81 7.900 9.390 12.384 1.00 10.01 C ATOM 1316 C ASP A 81 6.642 8.545 12.210 1.00 12.20 C ATOM 1317 O ASP A 81 5.692 8.661 12.984 1.00 11.53 O ATOM 1318 CB ASP A 81 7.862 10.586 11.431 1.00 23.31 C ATOM 1319 CG ASP A 81 6.484 11.211 11.341 1.00 61.11 C ATOM 1320 OD1 ASP A 81 5.681 10.759 10.497 1.00 3.13 O ATOM 1321 OD2 ASP A 81 6.208 12.151 12.114 1.00 10.43 O ATOM 0 H ASP A 81 9.604 8.832 11.296 1.00 50.41 H new ATOM 0 HA ASP A 81 7.932 9.755 13.411 1.00 10.01 H new ATOM 0 HB2 ASP A 81 8.577 11.337 11.767 1.00 23.31 H new ATOM 0 HB3 ASP A 81 8.178 10.266 10.438 1.00 23.31 H new ATOM 1326 N SER A 82 6.642 7.696 11.188 1.00 62.33 N ATOM 1327 CA SER A 82 5.499 6.835 10.909 1.00 71.33 C ATOM 1328 C SER A 82 5.216 5.908 12.087 1.00 3.14 C ATOM 1329 O SER A 82 4.072 5.764 12.518 1.00 20.21 O ATOM 1330 CB SER A 82 5.751 6.009 9.646 1.00 43.34 C ATOM 1331 OG SER A 82 6.658 4.951 9.901 1.00 61.42 O ATOM 0 H SER A 82 7.421 7.586 10.539 1.00 62.33 H new ATOM 0 HA SER A 82 4.628 7.471 10.751 1.00 71.33 H new ATOM 0 HB2 SER A 82 4.808 5.603 9.279 1.00 43.34 H new ATOM 0 HB3 SER A 82 6.149 6.652 8.861 1.00 43.34 H new ATOM 0 HG SER A 82 7.386 5.275 10.471 1.00 61.42 H new ATOM 1337 N PHE A 83 6.268 5.282 12.605 1.00 70.43 N ATOM 1338 CA PHE A 83 6.134 4.368 13.733 1.00 25.50 C ATOM 1339 C PHE A 83 5.992 5.137 15.043 1.00 44.42 C ATOM 1340 O PHE A 83 5.439 4.630 16.017 1.00 23.53 O ATOM 1341 CB PHE A 83 7.344 3.434 13.806 1.00 63.40 C ATOM 1342 CG PHE A 83 7.174 2.169 13.014 1.00 33.21 C ATOM 1343 CD1 PHE A 83 6.062 1.363 13.202 1.00 64.15 C ATOM 1344 CD2 PHE A 83 8.125 1.785 12.083 1.00 42.44 C ATOM 1345 CE1 PHE A 83 5.902 0.198 12.474 1.00 2.52 C ATOM 1346 CE2 PHE A 83 7.970 0.622 11.352 1.00 2.51 C ATOM 1347 CZ PHE A 83 6.858 -0.173 11.549 1.00 10.40 C ATOM 0 H PHE A 83 7.222 5.391 12.262 1.00 70.43 H new ATOM 0 HA PHE A 83 5.233 3.774 13.582 1.00 25.50 H new ATOM 0 HB2 PHE A 83 8.225 3.964 13.444 1.00 63.40 H new ATOM 0 HB3 PHE A 83 7.533 3.178 14.849 1.00 63.40 H new ATOM 0 HD1 PHE A 83 5.312 1.648 13.925 1.00 64.15 H new ATOM 0 HD2 PHE A 83 8.998 2.401 11.926 1.00 42.44 H new ATOM 0 HE1 PHE A 83 5.031 -0.421 12.629 1.00 2.52 H new ATOM 0 HE2 PHE A 83 8.718 0.335 10.627 1.00 2.51 H new ATOM 0 HZ PHE A 83 6.736 -1.083 10.981 1.00 10.40 H new ATOM 1357 N GLY A 84 6.497 6.367 15.057 1.00 3.43 N ATOM 1358 CA GLY A 84 6.418 7.188 16.252 1.00 73.13 C ATOM 1359 C GLY A 84 5.044 7.799 16.445 1.00 41.02 C ATOM 1360 O GLY A 84 4.601 8.006 17.575 1.00 63.02 O ATOM 0 H GLY A 84 6.959 6.810 14.263 1.00 3.43 H new ATOM 0 HA2 GLY A 84 6.669 6.582 17.123 1.00 73.13 H new ATOM 0 HA3 GLY A 84 7.161 7.983 16.193 1.00 73.13 H new ATOM 1364 N LYS A 85 4.367 8.091 15.339 1.00 23.22 N ATOM 1365 CA LYS A 85 3.036 8.683 15.390 1.00 33.44 C ATOM 1366 C LYS A 85 1.994 7.645 15.796 1.00 62.41 C ATOM 1367 O LYS A 85 0.855 7.985 16.116 1.00 42.43 O ATOM 1368 CB LYS A 85 2.670 9.284 14.031 1.00 32.25 C ATOM 1369 CG LYS A 85 2.547 8.252 12.923 1.00 13.43 C ATOM 1370 CD LYS A 85 1.729 8.782 11.757 1.00 34.53 C ATOM 1371 CE LYS A 85 0.246 8.834 12.095 1.00 44.02 C ATOM 1372 NZ LYS A 85 -0.428 7.532 11.836 1.00 23.43 N ATOM 0 H LYS A 85 4.719 7.927 14.396 1.00 23.22 H new ATOM 0 HA LYS A 85 3.046 9.474 16.139 1.00 33.44 H new ATOM 0 HB2 LYS A 85 1.726 9.821 14.123 1.00 32.25 H new ATOM 0 HB3 LYS A 85 3.427 10.017 13.751 1.00 32.25 H new ATOM 0 HG2 LYS A 85 3.541 7.971 12.574 1.00 13.43 H new ATOM 0 HG3 LYS A 85 2.080 7.349 13.316 1.00 13.43 H new ATOM 0 HD2 LYS A 85 2.078 9.780 11.490 1.00 34.53 H new ATOM 0 HD3 LYS A 85 1.883 8.147 10.885 1.00 34.53 H new ATOM 0 HE2 LYS A 85 0.122 9.105 13.143 1.00 44.02 H new ATOM 0 HE3 LYS A 85 -0.234 9.615 11.505 1.00 44.02 H new ATOM 0 HZ1 LYS A 85 -1.172 7.662 11.121 1.00 23.43 H new ATOM 0 HZ2 LYS A 85 0.269 6.843 11.489 1.00 23.43 H new ATOM 0 HZ3 LYS A 85 -0.853 7.180 12.717 1.00 23.43 H new ATOM 1386 N VAL A 86 2.392 6.376 15.782 1.00 44.40 N ATOM 1387 CA VAL A 86 1.494 5.289 16.151 1.00 61.12 C ATOM 1388 C VAL A 86 2.049 4.493 17.327 1.00 72.23 C ATOM 1389 O VAL A 86 1.373 3.621 17.873 1.00 4.32 O ATOM 1390 CB VAL A 86 1.253 4.334 14.967 1.00 70.13 C ATOM 1391 CG1 VAL A 86 0.709 5.096 13.768 1.00 41.20 C ATOM 1392 CG2 VAL A 86 2.535 3.600 14.605 1.00 24.10 C ATOM 0 H VAL A 86 3.331 6.076 15.519 1.00 44.40 H new ATOM 0 HA VAL A 86 0.547 5.745 16.439 1.00 61.12 H new ATOM 0 HB VAL A 86 0.510 3.595 15.265 1.00 70.13 H new ATOM 0 HG11 VAL A 86 0.545 4.405 12.941 1.00 41.20 H new ATOM 0 HG12 VAL A 86 -0.235 5.571 14.036 1.00 41.20 H new ATOM 0 HG13 VAL A 86 1.426 5.859 13.466 1.00 41.20 H new ATOM 0 HG21 VAL A 86 2.346 2.930 13.767 1.00 24.10 H new ATOM 0 HG22 VAL A 86 3.302 4.323 14.326 1.00 24.10 H new ATOM 0 HG23 VAL A 86 2.877 3.021 15.463 1.00 24.10 H new ATOM 1402 N ALA A 87 3.284 4.799 17.711 1.00 34.25 N ATOM 1403 CA ALA A 87 3.929 4.114 18.825 1.00 72.35 C ATOM 1404 C ALA A 87 3.230 4.429 20.143 1.00 50.23 C ATOM 1405 O ALA A 87 2.899 3.527 20.912 1.00 50.51 O ATOM 1406 CB ALA A 87 5.399 4.497 18.899 1.00 2.34 C ATOM 0 H ALA A 87 3.858 5.516 17.267 1.00 34.25 H new ATOM 0 HA ALA A 87 3.853 3.040 18.653 1.00 72.35 H new ATOM 0 HB1 ALA A 87 5.868 3.979 19.735 1.00 2.34 H new ATOM 0 HB2 ALA A 87 5.896 4.214 17.971 1.00 2.34 H new ATOM 0 HB3 ALA A 87 5.488 5.574 19.044 1.00 2.34 H new ATOM 1412 N ALA A 88 3.009 5.715 20.397 1.00 23.22 N ATOM 1413 CA ALA A 88 2.349 6.149 21.622 1.00 73.41 C ATOM 1414 C ALA A 88 0.940 5.573 21.720 1.00 61.35 C ATOM 1415 O ALA A 88 0.435 5.329 22.814 1.00 35.15 O ATOM 1416 CB ALA A 88 2.306 7.668 21.689 1.00 54.14 C ATOM 0 H ALA A 88 3.277 6.474 19.771 1.00 23.22 H new ATOM 0 HA ALA A 88 2.926 5.775 22.468 1.00 73.41 H new ATOM 0 HB1 ALA A 88 1.810 7.978 22.609 1.00 54.14 H new ATOM 0 HB2 ALA A 88 3.322 8.062 21.674 1.00 54.14 H new ATOM 0 HB3 ALA A 88 1.754 8.055 20.832 1.00 54.14 H new ATOM 1422 N GLU A 89 0.312 5.359 20.568 1.00 60.34 N ATOM 1423 CA GLU A 89 -1.039 4.813 20.525 1.00 34.21 C ATOM 1424 C GLU A 89 -1.031 3.315 20.817 1.00 4.01 C ATOM 1425 O GLU A 89 -1.861 2.814 21.576 1.00 41.15 O ATOM 1426 CB GLU A 89 -1.676 5.073 19.158 1.00 2.32 C ATOM 1427 CG GLU A 89 -3.190 4.942 19.157 1.00 44.13 C ATOM 1428 CD GLU A 89 -3.876 6.102 19.851 1.00 55.44 C ATOM 1429 OE1 GLU A 89 -3.775 7.240 19.344 1.00 20.44 O ATOM 1430 OE2 GLU A 89 -4.515 5.874 20.899 1.00 23.40 O ATOM 0 H GLU A 89 0.717 5.555 19.653 1.00 60.34 H new ATOM 0 HA GLU A 89 -1.629 5.313 21.294 1.00 34.21 H new ATOM 0 HB2 GLU A 89 -1.406 6.075 18.826 1.00 2.32 H new ATOM 0 HB3 GLU A 89 -1.259 4.374 18.433 1.00 2.32 H new ATOM 0 HG2 GLU A 89 -3.545 4.878 18.128 1.00 44.13 H new ATOM 0 HG3 GLU A 89 -3.471 4.011 19.650 1.00 44.13 H new ATOM 1437 N VAL A 90 -0.086 2.605 20.209 1.00 62.04 N ATOM 1438 CA VAL A 90 0.033 1.165 20.403 1.00 74.22 C ATOM 1439 C VAL A 90 0.568 0.840 21.793 1.00 60.13 C ATOM 1440 O VAL A 90 -0.070 0.122 22.564 1.00 61.43 O ATOM 1441 CB VAL A 90 0.957 0.530 19.347 1.00 3.31 C ATOM 1442 CG1 VAL A 90 1.111 -0.962 19.599 1.00 12.11 C ATOM 1443 CG2 VAL A 90 0.424 0.791 17.947 1.00 73.45 C ATOM 0 H VAL A 90 0.609 3.004 19.578 1.00 62.04 H new ATOM 0 HA VAL A 90 -0.968 0.748 20.296 1.00 74.22 H new ATOM 0 HB VAL A 90 1.942 0.990 19.427 1.00 3.31 H new ATOM 0 HG11 VAL A 90 1.767 -1.393 18.843 1.00 12.11 H new ATOM 0 HG12 VAL A 90 1.542 -1.121 20.587 1.00 12.11 H new ATOM 0 HG13 VAL A 90 0.134 -1.442 19.548 1.00 12.11 H new ATOM 0 HG21 VAL A 90 1.089 0.335 17.214 1.00 73.45 H new ATOM 0 HG22 VAL A 90 -0.572 0.360 17.851 1.00 73.45 H new ATOM 0 HG23 VAL A 90 0.373 1.866 17.772 1.00 73.45 H new ATOM 1453 N LEU A 91 1.743 1.373 22.107 1.00 2.44 N ATOM 1454 CA LEU A 91 2.366 1.141 23.406 1.00 13.01 C ATOM 1455 C LEU A 91 1.388 1.434 24.539 1.00 13.52 C ATOM 1456 O LEU A 91 1.402 0.769 25.574 1.00 62.44 O ATOM 1457 CB LEU A 91 3.615 2.010 23.558 1.00 42.44 C ATOM 1458 CG LEU A 91 4.908 1.435 22.978 1.00 32.43 C ATOM 1459 CD1 LEU A 91 4.879 1.482 21.458 1.00 20.35 C ATOM 1460 CD2 LEU A 91 6.115 2.190 23.514 1.00 23.23 C ATOM 0 H LEU A 91 2.284 1.969 21.480 1.00 2.44 H new ATOM 0 HA LEU A 91 2.653 0.091 23.461 1.00 13.01 H new ATOM 0 HB2 LEU A 91 3.424 2.972 23.083 1.00 42.44 H new ATOM 0 HB3 LEU A 91 3.771 2.204 24.619 1.00 42.44 H new ATOM 0 HG LEU A 91 4.990 0.393 23.287 1.00 32.43 H new ATOM 0 HD11 LEU A 91 5.807 1.069 21.063 1.00 20.35 H new ATOM 0 HD12 LEU A 91 4.036 0.896 21.092 1.00 20.35 H new ATOM 0 HD13 LEU A 91 4.773 2.515 21.128 1.00 20.35 H new ATOM 0 HD21 LEU A 91 7.026 1.767 23.091 1.00 23.23 H new ATOM 0 HD22 LEU A 91 6.039 3.241 23.236 1.00 23.23 H new ATOM 0 HD23 LEU A 91 6.145 2.103 24.600 1.00 23.23 H new ATOM 1472 N GLY A 92 0.536 2.436 24.335 1.00 25.53 N ATOM 1473 CA GLY A 92 -0.438 2.798 25.347 1.00 13.23 C ATOM 1474 C GLY A 92 -1.539 1.766 25.489 1.00 60.55 C ATOM 1475 O GLY A 92 -2.043 1.532 26.587 1.00 25.43 O ATOM 0 H GLY A 92 0.504 3.002 23.487 1.00 25.53 H new ATOM 0 HA2 GLY A 92 0.067 2.920 26.305 1.00 13.23 H new ATOM 0 HA3 GLY A 92 -0.879 3.762 25.094 1.00 13.23 H new ATOM 1479 N ARG A 93 -1.915 1.147 24.374 1.00 43.23 N ATOM 1480 CA ARG A 93 -2.965 0.136 24.378 1.00 50.13 C ATOM 1481 C ARG A 93 -2.422 -1.210 24.847 1.00 63.43 C ATOM 1482 O ARG A 93 -2.942 -1.806 25.791 1.00 5.40 O ATOM 1483 CB ARG A 93 -3.572 -0.005 22.980 1.00 24.34 C ATOM 1484 CG ARG A 93 -4.796 0.867 22.757 1.00 51.01 C ATOM 1485 CD ARG A 93 -6.078 0.127 23.104 1.00 72.20 C ATOM 1486 NE ARG A 93 -7.218 1.032 23.220 1.00 34.14 N ATOM 1487 CZ ARG A 93 -8.409 0.660 23.678 1.00 63.51 C ATOM 1488 NH1 ARG A 93 -8.613 -0.593 24.060 1.00 33.42 N ATOM 1489 NH2 ARG A 93 -9.397 1.541 23.754 1.00 11.51 N ATOM 0 H ARG A 93 -1.508 1.328 23.457 1.00 43.23 H new ATOM 0 HA ARG A 93 -3.741 0.457 25.073 1.00 50.13 H new ATOM 0 HB2 ARG A 93 -2.815 0.249 22.237 1.00 24.34 H new ATOM 0 HB3 ARG A 93 -3.844 -1.047 22.815 1.00 24.34 H new ATOM 0 HG2 ARG A 93 -4.718 1.768 23.366 1.00 51.01 H new ATOM 0 HG3 ARG A 93 -4.830 1.188 21.716 1.00 51.01 H new ATOM 0 HD2 ARG A 93 -6.284 -0.620 22.337 1.00 72.20 H new ATOM 0 HD3 ARG A 93 -5.944 -0.409 24.043 1.00 72.20 H new ATOM 0 HE ARG A 93 -7.094 2.003 22.934 1.00 34.14 H new ATOM 0 HH11 ARG A 93 -7.855 -1.273 24.003 1.00 33.42 H new ATOM 0 HH12 ARG A 93 -9.528 -0.877 24.411 1.00 33.42 H new ATOM 0 HH21 ARG A 93 -9.244 2.506 23.461 1.00 11.51 H new ATOM 0 HH22 ARG A 93 -10.310 1.254 24.106 1.00 11.51 H new ATOM 1503 N ILE A 94 -1.374 -1.684 24.181 1.00 72.35 N ATOM 1504 CA ILE A 94 -0.761 -2.960 24.530 1.00 42.44 C ATOM 1505 C ILE A 94 -0.321 -2.977 25.990 1.00 41.44 C ATOM 1506 O ILE A 94 -0.231 -4.036 26.609 1.00 53.31 O ATOM 1507 CB ILE A 94 0.456 -3.263 23.635 1.00 13.20 C ATOM 1508 CG1 ILE A 94 1.600 -2.296 23.948 1.00 73.04 C ATOM 1509 CG2 ILE A 94 0.068 -3.176 22.166 1.00 11.15 C ATOM 1510 CD1 ILE A 94 2.827 -2.515 23.091 1.00 51.12 C ATOM 0 H ILE A 94 -0.932 -1.204 23.397 1.00 72.35 H new ATOM 0 HA ILE A 94 -1.518 -3.728 24.372 1.00 42.44 H new ATOM 0 HB ILE A 94 0.797 -4.278 23.841 1.00 13.20 H new ATOM 0 HG12 ILE A 94 1.249 -1.273 23.811 1.00 73.04 H new ATOM 0 HG13 ILE A 94 1.876 -2.400 24.997 1.00 73.04 H new ATOM 0 HG21 ILE A 94 0.938 -3.393 21.546 1.00 11.15 H new ATOM 0 HG22 ILE A 94 -0.718 -3.901 21.954 1.00 11.15 H new ATOM 0 HG23 ILE A 94 -0.295 -2.172 21.944 1.00 11.15 H new ATOM 0 HD11 ILE A 94 3.597 -1.795 23.367 1.00 51.12 H new ATOM 0 HD12 ILE A 94 3.203 -3.526 23.246 1.00 51.12 H new ATOM 0 HD13 ILE A 94 2.566 -2.382 22.041 1.00 51.12 H new ATOM 1522 N ASN A 95 -0.049 -1.795 26.534 1.00 51.12 N ATOM 1523 CA ASN A 95 0.380 -1.674 27.922 1.00 4.53 C ATOM 1524 C ASN A 95 -0.736 -2.091 28.875 1.00 4.33 C ATOM 1525 O ASN A 95 -0.476 -2.598 29.966 1.00 5.31 O ATOM 1526 CB ASN A 95 0.811 -0.236 28.221 1.00 15.10 C ATOM 1527 CG ASN A 95 1.012 0.011 29.704 1.00 54.13 C ATOM 1528 OD1 ASN A 95 2.026 -0.385 30.278 1.00 12.14 O ATOM 1529 ND2 ASN A 95 0.043 0.669 30.330 1.00 20.35 N ATOM 0 H ASN A 95 -0.118 -0.908 26.035 1.00 51.12 H new ATOM 0 HA ASN A 95 1.230 -2.340 28.073 1.00 4.53 H new ATOM 0 HB2 ASN A 95 1.738 -0.020 27.690 1.00 15.10 H new ATOM 0 HB3 ASN A 95 0.057 0.453 27.840 1.00 15.10 H new ATOM 0 HD21 ASN A 95 0.122 0.865 31.328 1.00 20.35 H new ATOM 0 HD22 ASN A 95 -0.780 0.978 29.813 1.00 20.35 H new ATOM 1536 N GLN A 96 -1.978 -1.874 28.455 1.00 45.14 N ATOM 1537 CA GLN A 96 -3.133 -2.227 29.271 1.00 62.41 C ATOM 1538 C GLN A 96 -3.385 -3.731 29.235 1.00 30.11 C ATOM 1539 O GLN A 96 -3.639 -4.352 30.267 1.00 52.52 O ATOM 1540 CB GLN A 96 -4.375 -1.478 28.786 1.00 71.21 C ATOM 1541 CG GLN A 96 -4.236 0.034 28.849 1.00 55.35 C ATOM 1542 CD GLN A 96 -5.570 0.747 28.742 1.00 40.51 C ATOM 1543 OE1 GLN A 96 -6.266 0.940 29.740 1.00 45.14 O ATOM 1544 NE2 GLN A 96 -5.934 1.144 27.528 1.00 11.11 N ATOM 0 H GLN A 96 -2.210 -1.455 27.554 1.00 45.14 H new ATOM 0 HA GLN A 96 -2.922 -1.937 30.300 1.00 62.41 H new ATOM 0 HB2 GLN A 96 -4.589 -1.772 27.759 1.00 71.21 H new ATOM 0 HB3 GLN A 96 -5.231 -1.781 29.389 1.00 71.21 H new ATOM 0 HG2 GLN A 96 -3.754 0.312 29.786 1.00 55.35 H new ATOM 0 HG3 GLN A 96 -3.583 0.369 28.043 1.00 55.35 H new ATOM 0 HE21 GLN A 96 -5.326 0.963 26.729 1.00 11.11 H new ATOM 0 HE22 GLN A 96 -6.821 1.630 27.395 1.00 11.11 H new ATOM 1553 N GLU A 97 -3.313 -4.310 28.040 1.00 32.05 N ATOM 1554 CA GLU A 97 -3.535 -5.741 27.871 1.00 33.24 C ATOM 1555 C GLU A 97 -2.357 -6.543 28.417 1.00 41.21 C ATOM 1556 O GLU A 97 -2.529 -7.646 28.935 1.00 32.25 O ATOM 1557 CB GLU A 97 -3.753 -6.075 26.394 1.00 30.01 C ATOM 1558 CG GLU A 97 -4.937 -5.351 25.775 1.00 61.53 C ATOM 1559 CD GLU A 97 -6.236 -6.117 25.933 1.00 14.34 C ATOM 1560 OE1 GLU A 97 -6.867 -5.997 27.005 1.00 73.43 O ATOM 1561 OE2 GLU A 97 -6.622 -6.835 24.987 1.00 12.54 O ATOM 0 H GLU A 97 -3.103 -3.810 27.176 1.00 32.05 H new ATOM 0 HA GLU A 97 -4.429 -6.013 28.433 1.00 33.24 H new ATOM 0 HB2 GLU A 97 -2.851 -5.823 25.836 1.00 30.01 H new ATOM 0 HB3 GLU A 97 -3.901 -7.150 26.291 1.00 30.01 H new ATOM 0 HG2 GLU A 97 -5.040 -4.369 26.237 1.00 61.53 H new ATOM 0 HG3 GLU A 97 -4.743 -5.186 24.715 1.00 61.53 H new ATOM 1568 N PHE A 98 -1.159 -5.980 28.295 1.00 32.14 N ATOM 1569 CA PHE A 98 0.049 -6.642 28.774 1.00 14.04 C ATOM 1570 C PHE A 98 0.013 -6.808 30.291 1.00 40.21 C ATOM 1571 O PHE A 98 -0.301 -5.879 31.035 1.00 12.31 O ATOM 1572 CB PHE A 98 1.289 -5.844 28.366 1.00 31.33 C ATOM 1573 CG PHE A 98 1.811 -6.203 27.004 1.00 14.42 C ATOM 1574 CD1 PHE A 98 0.945 -6.608 26.001 1.00 24.40 C ATOM 1575 CD2 PHE A 98 3.167 -6.134 26.727 1.00 34.22 C ATOM 1576 CE1 PHE A 98 1.422 -6.939 24.746 1.00 2.53 C ATOM 1577 CE2 PHE A 98 3.649 -6.463 25.474 1.00 0.44 C ATOM 1578 CZ PHE A 98 2.776 -6.866 24.483 1.00 20.41 C ATOM 0 H PHE A 98 -0.999 -5.067 27.869 1.00 32.14 H new ATOM 0 HA PHE A 98 0.096 -7.631 28.319 1.00 14.04 H new ATOM 0 HB2 PHE A 98 1.050 -4.781 28.386 1.00 31.33 H new ATOM 0 HB3 PHE A 98 2.075 -6.008 29.103 1.00 31.33 H new ATOM 0 HD1 PHE A 98 -0.115 -6.666 26.202 1.00 24.40 H new ATOM 0 HD2 PHE A 98 3.855 -5.820 27.498 1.00 34.22 H new ATOM 0 HE1 PHE A 98 0.737 -7.254 23.973 1.00 2.53 H new ATOM 0 HE2 PHE A 98 4.708 -6.405 25.270 1.00 0.44 H new ATOM 0 HZ PHE A 98 3.151 -7.124 23.504 1.00 20.41 H new ATOM 1588 N PRO A 99 0.342 -8.020 30.761 1.00 63.21 N ATOM 1589 CA PRO A 99 0.356 -8.338 32.192 1.00 52.51 C ATOM 1590 C PRO A 99 1.490 -7.635 32.931 1.00 73.12 C ATOM 1591 O PRO A 99 2.304 -6.941 32.322 1.00 53.32 O ATOM 1592 CB PRO A 99 0.560 -9.854 32.217 1.00 71.30 C ATOM 1593 CG PRO A 99 1.251 -10.165 30.934 1.00 1.33 C ATOM 1594 CD PRO A 99 0.727 -9.174 29.931 1.00 23.34 C ATOM 0 HA PRO A 99 -0.555 -8.009 32.691 1.00 52.51 H new ATOM 0 HB2 PRO A 99 1.161 -10.158 33.074 1.00 71.30 H new ATOM 0 HB3 PRO A 99 -0.392 -10.380 32.292 1.00 71.30 H new ATOM 0 HG2 PRO A 99 2.332 -10.077 31.042 1.00 1.33 H new ATOM 0 HG3 PRO A 99 1.044 -11.187 30.617 1.00 1.33 H new ATOM 0 HD2 PRO A 99 1.487 -8.905 29.197 1.00 23.34 H new ATOM 0 HD3 PRO A 99 -0.123 -9.573 29.378 1.00 23.34 H new ATOM 1602 N ARG A 100 1.537 -7.821 34.246 1.00 42.40 N ATOM 1603 CA ARG A 100 2.572 -7.204 35.068 1.00 55.33 C ATOM 1604 C ARG A 100 3.952 -7.739 34.697 1.00 54.10 C ATOM 1605 O ARG A 100 4.967 -7.089 34.943 1.00 4.54 O ATOM 1606 CB ARG A 100 2.295 -7.459 36.550 1.00 31.53 C ATOM 1607 CG ARG A 100 3.344 -6.867 37.477 1.00 40.43 C ATOM 1608 CD ARG A 100 2.857 -6.827 38.917 1.00 62.32 C ATOM 1609 NE ARG A 100 3.964 -6.773 39.868 1.00 65.24 N ATOM 1610 CZ ARG A 100 3.818 -6.946 41.176 1.00 23.35 C ATOM 1611 NH1 ARG A 100 2.618 -7.184 41.687 1.00 1.22 N ATOM 1612 NH2 ARG A 100 4.874 -6.882 41.977 1.00 24.54 N ATOM 0 H ARG A 100 0.871 -8.393 34.765 1.00 42.40 H new ATOM 0 HA ARG A 100 2.556 -6.130 34.882 1.00 55.33 H new ATOM 0 HB2 ARG A 100 1.320 -7.043 36.805 1.00 31.53 H new ATOM 0 HB3 ARG A 100 2.237 -8.534 36.720 1.00 31.53 H new ATOM 0 HG2 ARG A 100 4.258 -7.457 37.417 1.00 40.43 H new ATOM 0 HG3 ARG A 100 3.594 -5.858 37.148 1.00 40.43 H new ATOM 0 HD2 ARG A 100 2.215 -5.958 39.058 1.00 62.32 H new ATOM 0 HD3 ARG A 100 2.249 -7.709 39.119 1.00 62.32 H new ATOM 0 HE ARG A 100 4.901 -6.592 39.507 1.00 65.24 H new ATOM 0 HH11 ARG A 100 1.804 -7.235 41.075 1.00 1.22 H new ATOM 0 HH12 ARG A 100 2.509 -7.317 42.692 1.00 1.22 H new ATOM 0 HH21 ARG A 100 5.799 -6.700 41.588 1.00 24.54 H new ATOM 0 HH22 ARG A 100 4.761 -7.015 42.982 1.00 24.54 H new ATOM 1626 N ASP A 101 3.980 -8.928 34.104 1.00 13.54 N ATOM 1627 CA ASP A 101 5.235 -9.550 33.699 1.00 35.31 C ATOM 1628 C ASP A 101 5.793 -8.883 32.446 1.00 55.10 C ATOM 1629 O ASP A 101 6.966 -8.512 32.397 1.00 21.03 O ATOM 1630 CB ASP A 101 5.029 -11.045 33.448 1.00 51.15 C ATOM 1631 CG ASP A 101 4.815 -11.824 34.730 1.00 13.24 C ATOM 1632 OD1 ASP A 101 3.742 -11.663 35.350 1.00 22.43 O ATOM 1633 OD2 ASP A 101 5.719 -12.595 35.114 1.00 50.40 O ATOM 0 H ASP A 101 3.148 -9.480 33.893 1.00 13.54 H new ATOM 0 HA ASP A 101 5.954 -9.421 34.508 1.00 35.31 H new ATOM 0 HB2 ASP A 101 4.169 -11.185 32.793 1.00 51.15 H new ATOM 0 HB3 ASP A 101 5.897 -11.445 32.924 1.00 51.15 H new ATOM 1638 N LEU A 102 4.945 -8.734 31.434 1.00 31.00 N ATOM 1639 CA LEU A 102 5.353 -8.112 30.179 1.00 23.12 C ATOM 1640 C LEU A 102 5.588 -6.616 30.364 1.00 64.30 C ATOM 1641 O LEU A 102 6.432 -6.022 29.693 1.00 53.55 O ATOM 1642 CB LEU A 102 4.291 -8.344 29.103 1.00 42.20 C ATOM 1643 CG LEU A 102 4.170 -9.774 28.576 1.00 23.23 C ATOM 1644 CD1 LEU A 102 3.132 -9.849 27.467 1.00 2.15 C ATOM 1645 CD2 LEU A 102 5.519 -10.276 28.081 1.00 30.03 C ATOM 0 H LEU A 102 3.971 -9.035 31.458 1.00 31.00 H new ATOM 0 HA LEU A 102 6.289 -8.572 29.862 1.00 23.12 H new ATOM 0 HB2 LEU A 102 3.324 -8.043 29.505 1.00 42.20 H new ATOM 0 HB3 LEU A 102 4.505 -7.685 28.262 1.00 42.20 H new ATOM 0 HG LEU A 102 3.844 -10.416 29.395 1.00 23.23 H new ATOM 0 HD11 LEU A 102 3.060 -10.874 27.105 1.00 2.15 H new ATOM 0 HD12 LEU A 102 2.163 -9.532 27.853 1.00 2.15 H new ATOM 0 HD13 LEU A 102 3.428 -9.194 26.647 1.00 2.15 H new ATOM 0 HD21 LEU A 102 5.414 -11.295 27.710 1.00 30.03 H new ATOM 0 HD22 LEU A 102 5.874 -9.632 27.277 1.00 30.03 H new ATOM 0 HD23 LEU A 102 6.236 -10.261 28.902 1.00 30.03 H new ATOM 1657 N LYS A 103 4.839 -6.014 31.280 1.00 15.35 N ATOM 1658 CA LYS A 103 4.967 -4.588 31.558 1.00 54.14 C ATOM 1659 C LYS A 103 6.421 -4.214 31.824 1.00 42.23 C ATOM 1660 O LYS A 103 6.941 -3.254 31.254 1.00 14.21 O ATOM 1661 CB LYS A 103 4.101 -4.201 32.759 1.00 24.23 C ATOM 1662 CG LYS A 103 2.656 -3.906 32.398 1.00 10.21 C ATOM 1663 CD LYS A 103 2.197 -2.578 32.977 1.00 35.45 C ATOM 1664 CE LYS A 103 0.684 -2.531 33.132 1.00 61.21 C ATOM 1665 NZ LYS A 103 0.212 -3.411 34.237 1.00 73.05 N ATOM 0 H LYS A 103 4.136 -6.491 31.844 1.00 15.35 H new ATOM 0 HA LYS A 103 4.624 -4.040 30.680 1.00 54.14 H new ATOM 0 HB2 LYS A 103 4.126 -5.009 33.490 1.00 24.23 H new ATOM 0 HB3 LYS A 103 4.533 -3.323 33.240 1.00 24.23 H new ATOM 0 HG2 LYS A 103 2.547 -3.888 31.314 1.00 10.21 H new ATOM 0 HG3 LYS A 103 2.016 -4.707 32.770 1.00 10.21 H new ATOM 0 HD2 LYS A 103 2.668 -2.420 33.947 1.00 35.45 H new ATOM 0 HD3 LYS A 103 2.523 -1.765 32.328 1.00 35.45 H new ATOM 0 HE2 LYS A 103 0.370 -1.505 33.326 1.00 61.21 H new ATOM 0 HE3 LYS A 103 0.214 -2.837 32.198 1.00 61.21 H new ATOM 0 HZ1 LYS A 103 -0.745 -3.123 34.526 1.00 73.05 H new ATOM 0 HZ2 LYS A 103 0.193 -4.398 33.910 1.00 73.05 H new ATOM 0 HZ3 LYS A 103 0.858 -3.327 35.048 1.00 73.05 H new ATOM 1679 N LYS A 104 7.075 -4.979 32.692 1.00 53.33 N ATOM 1680 CA LYS A 104 8.471 -4.730 33.032 1.00 74.02 C ATOM 1681 C LYS A 104 9.342 -4.720 31.780 1.00 21.00 C ATOM 1682 O LYS A 104 10.311 -3.965 31.691 1.00 33.11 O ATOM 1683 CB LYS A 104 8.976 -5.793 34.009 1.00 31.45 C ATOM 1684 CG LYS A 104 8.265 -5.773 35.352 1.00 41.34 C ATOM 1685 CD LYS A 104 9.138 -6.348 36.454 1.00 61.40 C ATOM 1686 CE LYS A 104 10.001 -5.275 37.100 1.00 54.21 C ATOM 1687 NZ LYS A 104 11.060 -5.861 37.967 1.00 72.53 N ATOM 0 H LYS A 104 6.660 -5.777 33.173 1.00 53.33 H new ATOM 0 HA LYS A 104 8.535 -3.750 33.506 1.00 74.02 H new ATOM 0 HB2 LYS A 104 8.853 -6.777 33.557 1.00 31.45 H new ATOM 0 HB3 LYS A 104 10.044 -5.648 34.171 1.00 31.45 H new ATOM 0 HG2 LYS A 104 7.988 -4.749 35.603 1.00 41.34 H new ATOM 0 HG3 LYS A 104 7.340 -6.345 35.283 1.00 41.34 H new ATOM 0 HD2 LYS A 104 8.509 -6.815 37.212 1.00 61.40 H new ATOM 0 HD3 LYS A 104 9.776 -7.131 36.043 1.00 61.40 H new ATOM 0 HE2 LYS A 104 10.464 -4.665 36.324 1.00 54.21 H new ATOM 0 HE3 LYS A 104 9.372 -4.612 37.694 1.00 54.21 H new ATOM 0 HZ1 LYS A 104 11.626 -5.097 38.388 1.00 72.53 H new ATOM 0 HZ2 LYS A 104 10.618 -6.422 38.723 1.00 72.53 H new ATOM 0 HZ3 LYS A 104 11.676 -6.474 37.396 1.00 72.53 H new ATOM 1701 N LYS A 105 8.991 -5.562 30.814 1.00 43.23 N ATOM 1702 CA LYS A 105 9.739 -5.649 29.565 1.00 2.50 C ATOM 1703 C LYS A 105 9.459 -4.439 28.678 1.00 25.42 C ATOM 1704 O LYS A 105 10.326 -3.997 27.923 1.00 70.14 O ATOM 1705 CB LYS A 105 9.379 -6.936 28.819 1.00 2.53 C ATOM 1706 CG LYS A 105 9.572 -8.193 29.649 1.00 64.34 C ATOM 1707 CD LYS A 105 9.056 -9.424 28.923 1.00 63.52 C ATOM 1708 CE LYS A 105 8.674 -10.527 29.898 1.00 23.22 C ATOM 1709 NZ LYS A 105 9.872 -11.227 30.441 1.00 75.13 N ATOM 0 H LYS A 105 8.193 -6.194 30.872 1.00 43.23 H new ATOM 0 HA LYS A 105 10.802 -5.662 29.807 1.00 2.50 H new ATOM 0 HB2 LYS A 105 8.340 -6.880 28.495 1.00 2.53 H new ATOM 0 HB3 LYS A 105 9.990 -7.007 27.919 1.00 2.53 H new ATOM 0 HG2 LYS A 105 10.630 -8.321 29.877 1.00 64.34 H new ATOM 0 HG3 LYS A 105 9.051 -8.086 30.601 1.00 64.34 H new ATOM 0 HD2 LYS A 105 8.190 -9.155 28.319 1.00 63.52 H new ATOM 0 HD3 LYS A 105 9.821 -9.791 28.238 1.00 63.52 H new ATOM 0 HE2 LYS A 105 8.098 -10.102 30.720 1.00 23.22 H new ATOM 0 HE3 LYS A 105 8.029 -11.248 29.396 1.00 23.22 H new ATOM 0 HZ1 LYS A 105 9.570 -11.971 31.101 1.00 75.13 H new ATOM 0 HZ2 LYS A 105 10.408 -11.655 29.659 1.00 75.13 H new ATOM 0 HZ3 LYS A 105 10.476 -10.544 30.942 1.00 75.13 H new ATOM 1723 N LEU A 106 8.246 -3.908 28.776 1.00 71.23 N ATOM 1724 CA LEU A 106 7.852 -2.748 27.983 1.00 24.32 C ATOM 1725 C LEU A 106 8.392 -1.461 28.597 1.00 10.45 C ATOM 1726 O LEU A 106 8.708 -0.507 27.886 1.00 4.14 O ATOM 1727 CB LEU A 106 6.329 -2.675 27.873 1.00 55.44 C ATOM 1728 CG LEU A 106 5.769 -1.482 27.096 1.00 72.53 C ATOM 1729 CD1 LEU A 106 4.456 -1.852 26.424 1.00 74.33 C ATOM 1730 CD2 LEU A 106 5.580 -0.286 28.017 1.00 21.44 C ATOM 0 H LEU A 106 7.518 -4.262 29.396 1.00 71.23 H new ATOM 0 HA LEU A 106 8.277 -2.859 26.985 1.00 24.32 H new ATOM 0 HB2 LEU A 106 5.975 -3.590 27.399 1.00 55.44 H new ATOM 0 HB3 LEU A 106 5.912 -2.655 28.880 1.00 55.44 H new ATOM 0 HG LEU A 106 6.486 -1.209 26.322 1.00 72.53 H new ATOM 0 HD11 LEU A 106 4.073 -0.991 25.876 1.00 74.33 H new ATOM 0 HD12 LEU A 106 4.621 -2.678 25.732 1.00 74.33 H new ATOM 0 HD13 LEU A 106 3.732 -2.152 27.181 1.00 74.33 H new ATOM 0 HD21 LEU A 106 5.181 0.553 27.447 1.00 21.44 H new ATOM 0 HD22 LEU A 106 4.884 -0.547 28.814 1.00 21.44 H new ATOM 0 HD23 LEU A 106 6.540 -0.006 28.451 1.00 21.44 H new ATOM 1742 N SER A 107 8.496 -1.441 29.922 1.00 21.44 N ATOM 1743 CA SER A 107 8.996 -0.270 30.633 1.00 22.30 C ATOM 1744 C SER A 107 10.487 -0.075 30.376 1.00 3.04 C ATOM 1745 O SER A 107 10.990 1.049 30.398 1.00 70.32 O ATOM 1746 CB SER A 107 8.740 -0.411 32.135 1.00 54.33 C ATOM 1747 OG SER A 107 9.130 0.761 32.830 1.00 32.44 O ATOM 0 H SER A 107 8.241 -2.223 30.525 1.00 21.44 H new ATOM 0 HA SER A 107 8.463 0.605 30.262 1.00 22.30 H new ATOM 0 HB2 SER A 107 7.682 -0.607 32.310 1.00 54.33 H new ATOM 0 HB3 SER A 107 9.291 -1.268 32.522 1.00 54.33 H new ATOM 0 HG SER A 107 8.955 0.647 33.788 1.00 32.44 H new ATOM 1753 N ARG A 108 11.189 -1.177 30.134 1.00 20.30 N ATOM 1754 CA ARG A 108 12.623 -1.129 29.874 1.00 12.35 C ATOM 1755 C ARG A 108 12.899 -0.792 28.412 1.00 25.40 C ATOM 1756 O ARG A 108 13.926 -0.197 28.084 1.00 11.24 O ATOM 1757 CB ARG A 108 13.273 -2.466 30.233 1.00 23.03 C ATOM 1758 CG ARG A 108 12.776 -3.630 29.392 1.00 34.35 C ATOM 1759 CD ARG A 108 13.663 -4.855 29.556 1.00 54.31 C ATOM 1760 NE ARG A 108 13.554 -5.765 28.419 1.00 44.32 N ATOM 1761 CZ ARG A 108 14.154 -6.949 28.365 1.00 0.25 C ATOM 1762 NH1 ARG A 108 14.900 -7.364 29.380 1.00 61.02 N ATOM 1763 NH2 ARG A 108 14.008 -7.720 27.296 1.00 35.50 N ATOM 0 H ARG A 108 10.788 -2.115 30.113 1.00 20.30 H new ATOM 0 HA ARG A 108 13.054 -0.345 30.497 1.00 12.35 H new ATOM 0 HB2 ARG A 108 14.353 -2.379 30.115 1.00 23.03 H new ATOM 0 HB3 ARG A 108 13.084 -2.682 31.285 1.00 23.03 H new ATOM 0 HG2 ARG A 108 11.754 -3.878 29.680 1.00 34.35 H new ATOM 0 HG3 ARG A 108 12.749 -3.337 28.343 1.00 34.35 H new ATOM 0 HD2 ARG A 108 14.700 -4.539 29.670 1.00 54.31 H new ATOM 0 HD3 ARG A 108 13.388 -5.382 30.470 1.00 54.31 H new ATOM 0 HE ARG A 108 12.986 -5.476 27.623 1.00 44.32 H new ATOM 0 HH11 ARG A 108 15.014 -6.774 30.204 1.00 61.02 H new ATOM 0 HH12 ARG A 108 15.360 -8.273 29.337 1.00 61.02 H new ATOM 0 HH21 ARG A 108 13.434 -7.404 26.514 1.00 35.50 H new ATOM 0 HH22 ARG A 108 14.469 -8.629 27.256 1.00 35.50 H new ATOM 1777 N VAL A 109 11.977 -1.179 27.537 1.00 51.15 N ATOM 1778 CA VAL A 109 12.121 -0.918 26.109 1.00 33.22 C ATOM 1779 C VAL A 109 11.794 0.534 25.780 1.00 3.22 C ATOM 1780 O VAL A 109 12.501 1.181 25.007 1.00 4.14 O ATOM 1781 CB VAL A 109 11.210 -1.839 25.276 1.00 73.11 C ATOM 1782 CG1 VAL A 109 11.246 -1.441 23.808 1.00 2.34 C ATOM 1783 CG2 VAL A 109 11.619 -3.294 25.452 1.00 14.33 C ATOM 0 H VAL A 109 11.122 -1.674 27.791 1.00 51.15 H new ATOM 0 HA VAL A 109 13.161 -1.120 25.854 1.00 33.22 H new ATOM 0 HB VAL A 109 10.186 -1.727 25.633 1.00 73.11 H new ATOM 0 HG11 VAL A 109 10.596 -2.103 23.235 1.00 2.34 H new ATOM 0 HG12 VAL A 109 10.901 -0.413 23.701 1.00 2.34 H new ATOM 0 HG13 VAL A 109 12.267 -1.522 23.434 1.00 2.34 H new ATOM 0 HG21 VAL A 109 10.965 -3.930 24.856 1.00 14.33 H new ATOM 0 HG22 VAL A 109 12.650 -3.425 25.123 1.00 14.33 H new ATOM 0 HG23 VAL A 109 11.536 -3.571 26.503 1.00 14.33 H new ATOM 1793 N VAL A 110 10.718 1.042 26.373 1.00 41.04 N ATOM 1794 CA VAL A 110 10.298 2.419 26.144 1.00 10.41 C ATOM 1795 C VAL A 110 11.429 3.396 26.447 1.00 53.24 C ATOM 1796 O VAL A 110 11.567 4.425 25.787 1.00 71.05 O ATOM 1797 CB VAL A 110 9.075 2.784 27.007 1.00 61.43 C ATOM 1798 CG1 VAL A 110 9.361 2.521 28.477 1.00 23.53 C ATOM 1799 CG2 VAL A 110 8.680 4.235 26.783 1.00 15.45 C ATOM 0 H VAL A 110 10.122 0.520 27.015 1.00 41.04 H new ATOM 0 HA VAL A 110 10.027 2.496 25.091 1.00 10.41 H new ATOM 0 HB VAL A 110 8.238 2.153 26.707 1.00 61.43 H new ATOM 0 HG11 VAL A 110 8.486 2.785 29.071 1.00 23.53 H new ATOM 0 HG12 VAL A 110 9.592 1.465 28.620 1.00 23.53 H new ATOM 0 HG13 VAL A 110 10.211 3.124 28.796 1.00 23.53 H new ATOM 0 HG21 VAL A 110 7.815 4.476 27.400 1.00 15.45 H new ATOM 0 HG22 VAL A 110 9.512 4.885 27.055 1.00 15.45 H new ATOM 0 HG23 VAL A 110 8.430 4.386 25.733 1.00 15.45 H new ATOM 1809 N ASN A 111 12.236 3.066 27.450 1.00 50.05 N ATOM 1810 CA ASN A 111 13.356 3.915 27.840 1.00 31.43 C ATOM 1811 C ASN A 111 14.427 3.936 26.754 1.00 0.10 C ATOM 1812 O ASN A 111 15.070 4.961 26.522 1.00 33.43 O ATOM 1813 CB ASN A 111 13.959 3.424 29.158 1.00 64.43 C ATOM 1814 CG ASN A 111 13.274 4.027 30.368 1.00 12.42 C ATOM 1815 OD1 ASN A 111 13.097 5.243 30.453 1.00 34.33 O ATOM 1816 ND2 ASN A 111 12.885 3.178 31.312 1.00 13.32 N ATOM 0 H ASN A 111 12.136 2.218 28.007 1.00 50.05 H new ATOM 0 HA ASN A 111 12.981 4.930 27.975 1.00 31.43 H new ATOM 0 HB2 ASN A 111 13.885 2.338 29.206 1.00 64.43 H new ATOM 0 HB3 ASN A 111 15.020 3.672 29.184 1.00 64.43 H new ATOM 0 HD21 ASN A 111 12.419 3.526 32.150 1.00 13.32 H new ATOM 0 HD22 ASN A 111 13.052 2.178 31.199 1.00 13.32 H new ATOM 1823 N ILE A 112 14.613 2.799 26.091 1.00 13.54 N ATOM 1824 CA ILE A 112 15.604 2.689 25.029 1.00 62.52 C ATOM 1825 C ILE A 112 15.436 3.803 24.002 1.00 44.22 C ATOM 1826 O ILE A 112 16.417 4.370 23.519 1.00 45.40 O ATOM 1827 CB ILE A 112 15.512 1.328 24.313 1.00 43.01 C ATOM 1828 CG1 ILE A 112 15.726 0.187 25.310 1.00 52.13 C ATOM 1829 CG2 ILE A 112 16.532 1.252 23.186 1.00 1.34 C ATOM 1830 CD1 ILE A 112 15.492 -1.185 24.717 1.00 12.21 C ATOM 0 H ILE A 112 14.090 1.942 26.271 1.00 13.54 H new ATOM 0 HA ILE A 112 16.583 2.778 25.500 1.00 62.52 H new ATOM 0 HB ILE A 112 14.516 1.227 23.883 1.00 43.01 H new ATOM 0 HG12 ILE A 112 16.744 0.238 25.696 1.00 52.13 H new ATOM 0 HG13 ILE A 112 15.056 0.326 26.159 1.00 52.13 H new ATOM 0 HG21 ILE A 112 16.455 0.285 22.690 1.00 1.34 H new ATOM 0 HG22 ILE A 112 16.338 2.046 22.465 1.00 1.34 H new ATOM 0 HG23 ILE A 112 17.535 1.371 23.595 1.00 1.34 H new ATOM 0 HD11 ILE A 112 15.662 -1.945 25.480 1.00 12.21 H new ATOM 0 HD12 ILE A 112 14.466 -1.255 24.357 1.00 12.21 H new ATOM 0 HD13 ILE A 112 16.180 -1.345 23.887 1.00 12.21 H new ATOM 1842 N LEU A 113 14.187 4.114 23.673 1.00 64.21 N ATOM 1843 CA LEU A 113 13.890 5.163 22.704 1.00 32.00 C ATOM 1844 C LEU A 113 14.617 6.456 23.061 1.00 74.34 C ATOM 1845 O LEU A 113 14.994 7.232 22.182 1.00 35.32 O ATOM 1846 CB LEU A 113 12.382 5.413 22.641 1.00 50.14 C ATOM 1847 CG LEU A 113 11.581 4.462 21.751 1.00 34.44 C ATOM 1848 CD1 LEU A 113 11.973 4.637 20.293 1.00 62.54 C ATOM 1849 CD2 LEU A 113 11.786 3.020 22.192 1.00 64.42 C ATOM 0 H LEU A 113 13.364 3.655 24.063 1.00 64.21 H new ATOM 0 HA LEU A 113 14.239 4.830 21.726 1.00 32.00 H new ATOM 0 HB2 LEU A 113 11.982 5.355 23.653 1.00 50.14 H new ATOM 0 HB3 LEU A 113 12.217 6.432 22.291 1.00 50.14 H new ATOM 0 HG LEU A 113 10.523 4.705 21.852 1.00 34.44 H new ATOM 0 HD11 LEU A 113 11.392 3.952 19.675 1.00 62.54 H new ATOM 0 HD12 LEU A 113 11.773 5.663 19.983 1.00 62.54 H new ATOM 0 HD13 LEU A 113 13.035 4.422 20.173 1.00 62.54 H new ATOM 0 HD21 LEU A 113 11.209 2.357 21.548 1.00 64.42 H new ATOM 0 HD22 LEU A 113 12.843 2.765 22.121 1.00 64.42 H new ATOM 0 HD23 LEU A 113 11.453 2.904 23.223 1.00 64.42 H new ATOM 1861 N LYS A 114 14.812 6.680 24.355 1.00 4.45 N ATOM 1862 CA LYS A 114 15.497 7.877 24.830 1.00 64.11 C ATOM 1863 C LYS A 114 16.993 7.798 24.541 1.00 51.55 C ATOM 1864 O LYS A 114 17.621 8.800 24.201 1.00 4.53 O ATOM 1865 CB LYS A 114 15.267 8.060 26.332 1.00 54.03 C ATOM 1866 CG LYS A 114 13.808 7.949 26.741 1.00 61.20 C ATOM 1867 CD LYS A 114 13.502 8.812 27.954 1.00 70.53 C ATOM 1868 CE LYS A 114 13.500 10.291 27.599 1.00 20.34 C ATOM 1869 NZ LYS A 114 12.169 10.741 27.105 1.00 23.04 N ATOM 0 H LYS A 114 14.505 6.048 25.095 1.00 4.45 H new ATOM 0 HA LYS A 114 15.086 8.735 24.298 1.00 64.11 H new ATOM 0 HB2 LYS A 114 15.846 7.312 26.874 1.00 54.03 H new ATOM 0 HB3 LYS A 114 15.647 9.036 26.633 1.00 54.03 H new ATOM 0 HG2 LYS A 114 13.172 8.251 25.909 1.00 61.20 H new ATOM 0 HG3 LYS A 114 13.570 6.909 26.964 1.00 61.20 H new ATOM 0 HD2 LYS A 114 12.531 8.534 28.364 1.00 70.53 H new ATOM 0 HD3 LYS A 114 14.242 8.624 28.732 1.00 70.53 H new ATOM 0 HE2 LYS A 114 13.778 10.875 28.476 1.00 20.34 H new ATOM 0 HE3 LYS A 114 14.254 10.482 26.836 1.00 20.34 H new ATOM 0 HZ1 LYS A 114 12.007 11.727 27.392 1.00 23.04 H new ATOM 0 HZ2 LYS A 114 12.143 10.674 26.068 1.00 23.04 H new ATOM 0 HZ3 LYS A 114 11.426 10.136 27.510 1.00 23.04 H new ATOM 1883 N GLU A 115 17.555 6.602 24.676 1.00 64.42 N ATOM 1884 CA GLU A 115 18.977 6.394 24.428 1.00 43.13 C ATOM 1885 C GLU A 115 19.308 6.601 22.952 1.00 20.34 C ATOM 1886 O GLU A 115 20.226 7.346 22.610 1.00 54.44 O ATOM 1887 CB GLU A 115 19.394 4.987 24.863 1.00 53.51 C ATOM 1888 CG GLU A 115 19.509 4.826 26.369 1.00 24.33 C ATOM 1889 CD GLU A 115 20.144 3.507 26.767 1.00 13.14 C ATOM 1890 OE1 GLU A 115 21.295 3.254 26.355 1.00 32.44 O ATOM 1891 OE2 GLU A 115 19.488 2.729 27.492 1.00 62.14 O ATOM 0 H GLU A 115 17.048 5.762 24.956 1.00 64.42 H new ATOM 0 HA GLU A 115 19.532 7.127 25.014 1.00 43.13 H new ATOM 0 HB2 GLU A 115 18.668 4.268 24.483 1.00 53.51 H new ATOM 0 HB3 GLU A 115 20.353 4.743 24.406 1.00 53.51 H new ATOM 0 HG2 GLU A 115 20.100 5.647 26.774 1.00 24.33 H new ATOM 0 HG3 GLU A 115 18.517 4.897 26.815 1.00 24.33 H new ATOM 1898 N ARG A 116 18.554 5.934 22.084 1.00 2.31 N ATOM 1899 CA ARG A 116 18.768 6.043 20.646 1.00 33.20 C ATOM 1900 C ARG A 116 18.197 7.352 20.109 1.00 75.22 C ATOM 1901 O ARG A 116 18.536 7.783 19.008 1.00 71.12 O ATOM 1902 CB ARG A 116 18.124 4.858 19.923 1.00 44.34 C ATOM 1903 CG ARG A 116 18.435 3.514 20.560 1.00 62.23 C ATOM 1904 CD ARG A 116 19.934 3.279 20.663 1.00 1.51 C ATOM 1905 NE ARG A 116 20.591 3.355 19.361 1.00 70.21 N ATOM 1906 CZ ARG A 116 21.888 3.133 19.178 1.00 72.50 C ATOM 1907 NH1 ARG A 116 22.662 2.822 20.208 1.00 4.23 N ATOM 1908 NH2 ARG A 116 22.412 3.220 17.962 1.00 1.02 N ATOM 0 H ARG A 116 17.790 5.313 22.351 1.00 2.31 H new ATOM 0 HA ARG A 116 19.842 6.033 20.461 1.00 33.20 H new ATOM 0 HB2 ARG A 116 17.043 4.999 19.903 1.00 44.34 H new ATOM 0 HB3 ARG A 116 18.464 4.847 18.887 1.00 44.34 H new ATOM 0 HG2 ARG A 116 17.990 3.470 21.554 1.00 62.23 H new ATOM 0 HG3 ARG A 116 17.980 2.717 19.971 1.00 62.23 H new ATOM 0 HD2 ARG A 116 20.372 4.019 21.333 1.00 1.51 H new ATOM 0 HD3 ARG A 116 20.118 2.300 21.105 1.00 1.51 H new ATOM 0 HE ARG A 116 20.023 3.591 18.547 1.00 70.21 H new ATOM 0 HH11 ARG A 116 22.262 2.753 21.144 1.00 4.23 H new ATOM 0 HH12 ARG A 116 23.657 2.652 20.065 1.00 4.23 H new ATOM 0 HH21 ARG A 116 21.819 3.458 17.167 1.00 1.02 H new ATOM 0 HH22 ARG A 116 23.408 3.049 17.822 1.00 1.02 H new ATOM 1922 N ASN A 117 17.327 7.979 20.895 1.00 60.33 N ATOM 1923 CA ASN A 117 16.708 9.238 20.498 1.00 73.15 C ATOM 1924 C ASN A 117 15.964 9.085 19.175 1.00 75.35 C ATOM 1925 O ASN A 117 16.110 9.907 18.270 1.00 70.03 O ATOM 1926 CB ASN A 117 17.767 10.335 20.376 1.00 40.24 C ATOM 1927 CG ASN A 117 17.179 11.725 20.524 1.00 4.33 C ATOM 1928 OD1 ASN A 117 17.059 12.468 19.550 1.00 71.22 O ATOM 1929 ND2 ASN A 117 16.811 12.084 21.749 1.00 74.44 N ATOM 0 H ASN A 117 17.035 7.636 21.810 1.00 60.33 H new ATOM 0 HA ASN A 117 15.990 9.520 21.268 1.00 73.15 H new ATOM 0 HB2 ASN A 117 18.532 10.184 21.138 1.00 40.24 H new ATOM 0 HB3 ASN A 117 18.261 10.254 19.408 1.00 40.24 H new ATOM 0 HD21 ASN A 117 16.411 13.008 21.911 1.00 74.44 H new ATOM 0 HD22 ASN A 117 16.929 11.436 22.527 1.00 74.44 H new ATOM 1936 N ILE A 118 15.165 8.028 19.070 1.00 22.31 N ATOM 1937 CA ILE A 118 14.397 7.768 17.859 1.00 60.11 C ATOM 1938 C ILE A 118 13.270 8.782 17.695 1.00 71.22 C ATOM 1939 O ILE A 118 13.302 9.622 16.796 1.00 42.15 O ATOM 1940 CB ILE A 118 13.799 6.349 17.865 1.00 32.32 C ATOM 1941 CG1 ILE A 118 14.870 5.322 18.238 1.00 20.13 C ATOM 1942 CG2 ILE A 118 13.195 6.023 16.507 1.00 32.45 C ATOM 1943 CD1 ILE A 118 16.026 5.274 17.264 1.00 24.13 C ATOM 0 H ILE A 118 15.033 7.338 19.809 1.00 22.31 H new ATOM 0 HA ILE A 118 15.089 7.858 17.021 1.00 60.11 H new ATOM 0 HB ILE A 118 13.007 6.308 18.613 1.00 32.32 H new ATOM 0 HG12 ILE A 118 15.252 5.553 19.232 1.00 20.13 H new ATOM 0 HG13 ILE A 118 14.411 4.335 18.294 1.00 20.13 H new ATOM 0 HG21 ILE A 118 12.776 5.017 16.527 1.00 32.45 H new ATOM 0 HG22 ILE A 118 12.406 6.740 16.278 1.00 32.45 H new ATOM 0 HG23 ILE A 118 13.969 6.079 15.742 1.00 32.45 H new ATOM 0 HD11 ILE A 118 16.747 4.524 17.591 1.00 24.13 H new ATOM 0 HD12 ILE A 118 15.656 5.013 16.273 1.00 24.13 H new ATOM 0 HD13 ILE A 118 16.510 6.250 17.225 1.00 24.13 H new ATOM 1955 N PHE A 119 12.274 8.698 18.571 1.00 41.32 N ATOM 1956 CA PHE A 119 11.136 9.609 18.524 1.00 3.21 C ATOM 1957 C PHE A 119 11.479 10.941 19.185 1.00 54.43 C ATOM 1958 O PHE A 119 12.465 11.050 19.913 1.00 42.13 O ATOM 1959 CB PHE A 119 9.924 8.981 19.215 1.00 22.10 C ATOM 1960 CG PHE A 119 9.613 7.592 18.735 1.00 44.24 C ATOM 1961 CD1 PHE A 119 9.605 7.299 17.380 1.00 2.14 C ATOM 1962 CD2 PHE A 119 9.330 6.580 19.637 1.00 21.11 C ATOM 1963 CE1 PHE A 119 9.319 6.022 16.936 1.00 53.22 C ATOM 1964 CE2 PHE A 119 9.043 5.301 19.198 1.00 23.24 C ATOM 1965 CZ PHE A 119 9.039 5.022 17.846 1.00 74.41 C ATOM 0 H PHE A 119 12.232 8.009 19.322 1.00 41.32 H new ATOM 0 HA PHE A 119 10.893 9.794 17.478 1.00 3.21 H new ATOM 0 HB2 PHE A 119 10.102 8.954 20.290 1.00 22.10 H new ATOM 0 HB3 PHE A 119 9.053 9.616 19.052 1.00 22.10 H new ATOM 0 HD1 PHE A 119 9.825 8.077 16.664 1.00 2.14 H new ATOM 0 HD2 PHE A 119 9.334 6.793 20.696 1.00 21.11 H new ATOM 0 HE1 PHE A 119 9.314 5.806 15.878 1.00 53.22 H new ATOM 0 HE2 PHE A 119 8.822 4.521 19.912 1.00 23.24 H new ATOM 0 HZ PHE A 119 8.817 4.023 17.501 1.00 74.41 H new ATOM 1975 N SER A 120 10.656 11.953 18.924 1.00 22.35 N ATOM 1976 CA SER A 120 10.873 13.279 19.490 1.00 43.35 C ATOM 1977 C SER A 120 10.194 13.409 20.849 1.00 34.53 C ATOM 1978 O SER A 120 9.592 12.458 21.349 1.00 74.22 O ATOM 1979 CB SER A 120 10.345 14.355 18.538 1.00 31.33 C ATOM 1980 OG SER A 120 11.130 14.425 17.361 1.00 62.42 O ATOM 0 H SER A 120 9.834 11.879 18.325 1.00 22.35 H new ATOM 0 HA SER A 120 11.946 13.417 19.626 1.00 43.35 H new ATOM 0 HB2 SER A 120 9.310 14.137 18.276 1.00 31.33 H new ATOM 0 HB3 SER A 120 10.349 15.323 19.040 1.00 31.33 H new ATOM 0 HG SER A 120 10.771 15.119 16.769 1.00 62.42 H new ATOM 1986 N LYS A 121 10.294 14.592 21.444 1.00 44.51 N ATOM 1987 CA LYS A 121 9.689 14.850 22.745 1.00 25.44 C ATOM 1988 C LYS A 121 8.168 14.774 22.663 1.00 42.13 C ATOM 1989 O LYS A 121 7.517 14.223 23.550 1.00 53.15 O ATOM 1990 CB LYS A 121 10.115 16.224 23.266 1.00 51.41 C ATOM 1991 CG LYS A 121 10.096 16.334 24.781 1.00 71.23 C ATOM 1992 CD LYS A 121 11.117 17.342 25.280 1.00 42.12 C ATOM 1993 CE LYS A 121 10.516 18.734 25.395 1.00 54.30 C ATOM 1994 NZ LYS A 121 9.587 18.843 26.554 1.00 1.22 N ATOM 0 H LYS A 121 10.790 15.389 21.045 1.00 44.51 H new ATOM 0 HA LYS A 121 10.036 14.083 23.437 1.00 25.44 H new ATOM 0 HB2 LYS A 121 11.121 16.443 22.907 1.00 51.41 H new ATOM 0 HB3 LYS A 121 9.454 16.983 22.847 1.00 51.41 H new ATOM 0 HG2 LYS A 121 9.100 16.629 25.113 1.00 71.23 H new ATOM 0 HG3 LYS A 121 10.302 15.358 25.220 1.00 71.23 H new ATOM 0 HD2 LYS A 121 11.496 17.027 26.252 1.00 42.12 H new ATOM 0 HD3 LYS A 121 11.968 17.367 24.599 1.00 42.12 H new ATOM 0 HE2 LYS A 121 11.316 19.467 25.500 1.00 54.30 H new ATOM 0 HE3 LYS A 121 9.981 18.976 24.477 1.00 54.30 H new ATOM 0 HZ1 LYS A 121 9.411 19.846 26.765 1.00 1.22 H new ATOM 0 HZ2 LYS A 121 8.688 18.374 26.323 1.00 1.22 H new ATOM 0 HZ3 LYS A 121 10.013 18.385 27.385 1.00 1.22 H new ATOM 2008 N GLN A 122 7.610 15.330 21.592 1.00 30.31 N ATOM 2009 CA GLN A 122 6.165 15.324 21.395 1.00 63.23 C ATOM 2010 C GLN A 122 5.623 13.898 21.385 1.00 40.41 C ATOM 2011 O GLN A 122 4.503 13.646 21.828 1.00 15.32 O ATOM 2012 CB GLN A 122 5.805 16.028 20.085 1.00 5.03 C ATOM 2013 CG GLN A 122 5.923 17.542 20.157 1.00 74.04 C ATOM 2014 CD GLN A 122 5.686 18.209 18.816 1.00 5.41 C ATOM 2015 OE1 GLN A 122 6.566 18.886 18.283 1.00 64.22 O ATOM 2016 NE2 GLN A 122 4.494 18.022 18.263 1.00 12.21 N ATOM 0 H GLN A 122 8.136 15.790 20.849 1.00 30.31 H new ATOM 0 HA GLN A 122 5.708 15.861 22.226 1.00 63.23 H new ATOM 0 HB2 GLN A 122 6.456 15.658 19.293 1.00 5.03 H new ATOM 0 HB3 GLN A 122 4.784 15.764 19.809 1.00 5.03 H new ATOM 0 HG2 GLN A 122 5.204 17.925 20.881 1.00 74.04 H new ATOM 0 HG3 GLN A 122 6.915 17.809 20.521 1.00 74.04 H new ATOM 0 HE21 GLN A 122 3.794 17.453 18.740 1.00 12.21 H new ATOM 0 HE22 GLN A 122 4.278 18.447 17.361 1.00 12.21 H new ATOM 2025 N VAL A 123 6.425 12.969 20.876 1.00 64.30 N ATOM 2026 CA VAL A 123 6.026 11.568 20.809 1.00 64.11 C ATOM 2027 C VAL A 123 6.189 10.885 22.162 1.00 25.30 C ATOM 2028 O VAL A 123 5.252 10.277 22.680 1.00 64.02 O ATOM 2029 CB VAL A 123 6.848 10.800 19.756 1.00 14.22 C ATOM 2030 CG1 VAL A 123 6.432 9.338 19.717 1.00 31.51 C ATOM 2031 CG2 VAL A 123 6.692 11.444 18.387 1.00 62.14 C ATOM 0 H VAL A 123 7.355 13.161 20.504 1.00 64.30 H new ATOM 0 HA VAL A 123 4.975 11.552 20.521 1.00 64.11 H new ATOM 0 HB VAL A 123 7.900 10.846 20.036 1.00 14.22 H new ATOM 0 HG11 VAL A 123 7.023 8.811 18.968 1.00 31.51 H new ATOM 0 HG12 VAL A 123 6.599 8.886 20.695 1.00 31.51 H new ATOM 0 HG13 VAL A 123 5.375 9.267 19.461 1.00 31.51 H new ATOM 0 HG21 VAL A 123 7.279 10.889 17.655 1.00 62.14 H new ATOM 0 HG22 VAL A 123 5.642 11.430 18.096 1.00 62.14 H new ATOM 0 HG23 VAL A 123 7.043 12.475 18.428 1.00 62.14 H new ATOM 2041 N VAL A 124 7.386 10.989 22.731 1.00 23.00 N ATOM 2042 CA VAL A 124 7.673 10.383 24.026 1.00 72.54 C ATOM 2043 C VAL A 124 6.693 10.867 25.088 1.00 31.03 C ATOM 2044 O VAL A 124 6.103 10.067 25.813 1.00 12.54 O ATOM 2045 CB VAL A 124 9.109 10.695 24.486 1.00 12.24 C ATOM 2046 CG1 VAL A 124 9.374 10.089 25.856 1.00 63.11 C ATOM 2047 CG2 VAL A 124 10.117 10.190 23.466 1.00 64.21 C ATOM 0 H VAL A 124 8.173 11.487 22.315 1.00 23.00 H new ATOM 0 HA VAL A 124 7.566 9.305 23.902 1.00 72.54 H new ATOM 0 HB VAL A 124 9.220 11.776 24.566 1.00 12.24 H new ATOM 0 HG11 VAL A 124 10.394 10.320 26.165 1.00 63.11 H new ATOM 0 HG12 VAL A 124 8.673 10.505 26.580 1.00 63.11 H new ATOM 0 HG13 VAL A 124 9.246 9.008 25.807 1.00 63.11 H new ATOM 0 HG21 VAL A 124 11.126 10.419 23.808 1.00 64.21 H new ATOM 0 HG22 VAL A 124 10.009 9.111 23.351 1.00 64.21 H new ATOM 0 HG23 VAL A 124 9.939 10.677 22.507 1.00 64.21 H new ATOM 2057 N ASN A 125 6.524 12.183 25.174 1.00 23.41 N ATOM 2058 CA ASN A 125 5.615 12.775 26.149 1.00 62.42 C ATOM 2059 C ASN A 125 4.208 12.204 25.997 1.00 25.24 C ATOM 2060 O ASN A 125 3.449 12.133 26.964 1.00 52.23 O ATOM 2061 CB ASN A 125 5.581 14.296 25.987 1.00 73.32 C ATOM 2062 CG ASN A 125 6.670 14.987 26.784 1.00 31.12 C ATOM 2063 OD1 ASN A 125 6.399 15.902 27.562 1.00 24.00 O ATOM 2064 ND2 ASN A 125 7.910 14.551 26.594 1.00 73.14 N ATOM 0 H ASN A 125 7.004 12.859 24.580 1.00 23.41 H new ATOM 0 HA ASN A 125 5.981 12.531 27.146 1.00 62.42 H new ATOM 0 HB2 ASN A 125 5.691 14.549 24.932 1.00 73.32 H new ATOM 0 HB3 ASN A 125 4.608 14.671 26.305 1.00 73.32 H new ATOM 0 HD21 ASN A 125 8.684 14.977 27.103 1.00 73.14 H new ATOM 0 HD22 ASN A 125 8.088 13.790 25.939 1.00 73.14 H new ATOM 2071 N ASP A 126 3.869 11.797 24.779 1.00 10.51 N ATOM 2072 CA ASP A 126 2.554 11.231 24.501 1.00 43.02 C ATOM 2073 C ASP A 126 2.453 9.805 25.033 1.00 23.01 C ATOM 2074 O ASP A 126 1.431 9.414 25.598 1.00 62.13 O ATOM 2075 CB ASP A 126 2.276 11.248 22.997 1.00 40.21 C ATOM 2076 CG ASP A 126 1.409 12.420 22.582 1.00 53.31 C ATOM 2077 OD1 ASP A 126 1.581 13.518 23.153 1.00 31.20 O ATOM 2078 OD2 ASP A 126 0.558 12.241 21.686 1.00 64.55 O ATOM 0 H ASP A 126 4.486 11.848 23.969 1.00 10.51 H new ATOM 0 HA ASP A 126 1.808 11.843 25.008 1.00 43.02 H new ATOM 0 HB2 ASP A 126 3.221 11.290 22.456 1.00 40.21 H new ATOM 0 HB3 ASP A 126 1.786 10.318 22.711 1.00 40.21 H new ATOM 2083 N ILE A 127 3.519 9.033 24.848 1.00 11.14 N ATOM 2084 CA ILE A 127 3.550 7.651 25.310 1.00 34.11 C ATOM 2085 C ILE A 127 3.211 7.559 26.794 1.00 12.41 C ATOM 2086 O ILE A 127 2.458 6.682 27.215 1.00 21.15 O ATOM 2087 CB ILE A 127 4.928 7.007 25.069 1.00 12.31 C ATOM 2088 CG1 ILE A 127 5.273 7.032 23.579 1.00 73.24 C ATOM 2089 CG2 ILE A 127 4.947 5.581 25.599 1.00 15.42 C ATOM 2090 CD1 ILE A 127 6.756 6.924 23.300 1.00 54.13 C ATOM 0 H ILE A 127 4.372 9.341 24.382 1.00 11.14 H new ATOM 0 HA ILE A 127 2.799 7.110 24.734 1.00 34.11 H new ATOM 0 HB ILE A 127 5.681 7.583 25.607 1.00 12.31 H new ATOM 0 HG12 ILE A 127 4.757 6.211 23.081 1.00 73.24 H new ATOM 0 HG13 ILE A 127 4.896 7.957 23.142 1.00 73.24 H new ATOM 0 HG21 ILE A 127 5.928 5.140 25.421 1.00 15.42 H new ATOM 0 HG22 ILE A 127 4.741 5.588 26.669 1.00 15.42 H new ATOM 0 HG23 ILE A 127 4.186 4.992 25.087 1.00 15.42 H new ATOM 0 HD11 ILE A 127 6.926 6.948 22.224 1.00 54.13 H new ATOM 0 HD12 ILE A 127 7.276 7.759 23.769 1.00 54.13 H new ATOM 0 HD13 ILE A 127 7.135 5.986 23.706 1.00 54.13 H new ATOM 2102 N GLU A 128 3.771 8.473 27.581 1.00 72.01 N ATOM 2103 CA GLU A 128 3.527 8.495 29.018 1.00 14.33 C ATOM 2104 C GLU A 128 2.053 8.757 29.316 1.00 70.21 C ATOM 2105 O GLU A 128 1.443 8.069 30.135 1.00 54.34 O ATOM 2106 CB GLU A 128 4.391 9.565 29.688 1.00 3.24 C ATOM 2107 CG GLU A 128 5.872 9.437 29.372 1.00 11.21 C ATOM 2108 CD GLU A 128 6.748 10.153 30.382 1.00 61.31 C ATOM 2109 OE1 GLU A 128 6.643 11.393 30.484 1.00 43.13 O ATOM 2110 OE2 GLU A 128 7.538 9.473 31.070 1.00 43.24 O ATOM 0 H GLU A 128 4.396 9.207 27.248 1.00 72.01 H new ATOM 0 HA GLU A 128 3.794 7.518 29.421 1.00 14.33 H new ATOM 0 HB2 GLU A 128 4.045 10.549 29.373 1.00 3.24 H new ATOM 0 HB3 GLU A 128 4.252 9.509 30.768 1.00 3.24 H new ATOM 0 HG2 GLU A 128 6.144 8.382 29.344 1.00 11.21 H new ATOM 0 HG3 GLU A 128 6.064 9.842 28.378 1.00 11.21 H new ATOM 2117 N ARG A 129 1.488 9.756 28.645 1.00 23.33 N ATOM 2118 CA ARG A 129 0.087 10.110 28.839 1.00 63.14 C ATOM 2119 C ARG A 129 -0.816 8.901 28.611 1.00 25.00 C ATOM 2120 O ARG A 129 -1.756 8.665 29.369 1.00 74.11 O ATOM 2121 CB ARG A 129 -0.310 11.242 27.890 1.00 10.40 C ATOM 2122 CG ARG A 129 0.433 12.543 28.149 1.00 34.14 C ATOM 2123 CD ARG A 129 -0.476 13.749 27.970 1.00 35.23 C ATOM 2124 NE ARG A 129 0.033 14.927 28.668 1.00 71.44 N ATOM 2125 CZ ARG A 129 -0.647 16.062 28.786 1.00 64.15 C ATOM 2126 NH1 ARG A 129 -1.857 16.172 28.256 1.00 41.14 N ATOM 2127 NH2 ARG A 129 -0.116 17.090 29.435 1.00 24.11 N ATOM 0 H ARG A 129 1.979 10.334 27.963 1.00 23.33 H new ATOM 0 HA ARG A 129 -0.038 10.446 29.868 1.00 63.14 H new ATOM 0 HB2 ARG A 129 -0.125 10.926 26.863 1.00 10.40 H new ATOM 0 HB3 ARG A 129 -1.381 11.421 27.980 1.00 10.40 H new ATOM 0 HG2 ARG A 129 0.837 12.537 29.162 1.00 34.14 H new ATOM 0 HG3 ARG A 129 1.281 12.621 27.468 1.00 34.14 H new ATOM 0 HD2 ARG A 129 -0.577 13.972 26.908 1.00 35.23 H new ATOM 0 HD3 ARG A 129 -1.473 13.510 28.341 1.00 35.23 H new ATOM 0 HE ARG A 129 0.961 14.875 29.088 1.00 71.44 H new ATOM 0 HH11 ARG A 129 -2.268 15.384 27.756 1.00 41.14 H new ATOM 0 HH12 ARG A 129 -2.377 17.045 28.348 1.00 41.14 H new ATOM 0 HH21 ARG A 129 0.815 17.009 29.844 1.00 24.11 H new ATOM 0 HH22 ARG A 129 -0.639 17.961 29.525 1.00 24.11 H new ATOM 2141 N SER A 130 -0.522 8.139 27.562 1.00 14.10 N ATOM 2142 CA SER A 130 -1.310 6.957 27.232 1.00 50.22 C ATOM 2143 C SER A 130 -1.448 6.041 28.444 1.00 72.54 C ATOM 2144 O SER A 130 -2.520 5.490 28.702 1.00 44.41 O ATOM 2145 CB SER A 130 -0.664 6.195 26.073 1.00 52.41 C ATOM 2146 OG SER A 130 0.349 5.321 26.539 1.00 41.32 O ATOM 0 H SER A 130 0.255 8.319 26.927 1.00 14.10 H new ATOM 0 HA SER A 130 -2.305 7.286 26.932 1.00 50.22 H new ATOM 0 HB2 SER A 130 -1.424 5.624 25.540 1.00 52.41 H new ATOM 0 HB3 SER A 130 -0.239 6.902 25.361 1.00 52.41 H new ATOM 0 HG SER A 130 1.203 5.801 26.578 1.00 41.32 H new ATOM 2152 N LEU A 131 -0.357 5.881 29.184 1.00 63.32 N ATOM 2153 CA LEU A 131 -0.354 5.031 30.369 1.00 31.35 C ATOM 2154 C LEU A 131 -1.029 5.732 31.544 1.00 43.31 C ATOM 2155 O LEU A 131 -1.673 5.093 32.375 1.00 62.21 O ATOM 2156 CB LEU A 131 1.079 4.648 30.744 1.00 51.42 C ATOM 2157 CG LEU A 131 2.029 4.380 29.576 1.00 11.10 C ATOM 2158 CD1 LEU A 131 3.374 3.885 30.085 1.00 72.12 C ATOM 2159 CD2 LEU A 131 1.418 3.374 28.612 1.00 71.31 C ATOM 0 H LEU A 131 0.537 6.329 28.984 1.00 63.32 H new ATOM 0 HA LEU A 131 -0.916 4.126 30.137 1.00 31.35 H new ATOM 0 HB2 LEU A 131 1.500 5.448 31.353 1.00 51.42 H new ATOM 0 HB3 LEU A 131 1.044 3.756 31.370 1.00 51.42 H new ATOM 0 HG LEU A 131 2.189 5.316 29.040 1.00 11.10 H new ATOM 0 HD11 LEU A 131 4.037 3.700 29.240 1.00 72.12 H new ATOM 0 HD12 LEU A 131 3.817 4.639 30.735 1.00 72.12 H new ATOM 0 HD13 LEU A 131 3.233 2.961 30.645 1.00 72.12 H new ATOM 0 HD21 LEU A 131 2.108 3.195 27.787 1.00 71.31 H new ATOM 0 HD22 LEU A 131 1.228 2.437 29.136 1.00 71.31 H new ATOM 0 HD23 LEU A 131 0.480 3.768 28.222 1.00 71.31 H new ATOM 2171 N ALA A 132 -0.878 7.051 31.605 1.00 44.34 N ATOM 2172 CA ALA A 132 -1.476 7.840 32.674 1.00 5.34 C ATOM 2173 C ALA A 132 -2.991 7.672 32.700 1.00 61.14 C ATOM 2174 O ALA A 132 -3.612 7.716 33.761 1.00 52.21 O ATOM 2175 CB ALA A 132 -1.108 9.308 32.516 1.00 13.31 C ATOM 0 H ALA A 132 -0.346 7.596 30.926 1.00 44.34 H new ATOM 0 HA ALA A 132 -1.081 7.478 33.623 1.00 5.34 H new ATOM 0 HB1 ALA A 132 -1.562 9.886 33.321 1.00 13.31 H new ATOM 0 HB2 ALA A 132 -0.024 9.418 32.556 1.00 13.31 H new ATOM 0 HB3 ALA A 132 -1.474 9.674 31.557 1.00 13.31 H new ATOM 2181 N ALA A 133 -3.580 7.479 31.524 1.00 42.32 N ATOM 2182 CA ALA A 133 -5.022 7.303 31.412 1.00 74.02 C ATOM 2183 C ALA A 133 -5.451 5.938 31.938 1.00 31.52 C ATOM 2184 O ALA A 133 -6.552 5.783 32.465 1.00 33.22 O ATOM 2185 CB ALA A 133 -5.465 7.476 29.966 1.00 4.23 C ATOM 0 H ALA A 133 -3.080 7.441 30.636 1.00 42.32 H new ATOM 0 HA ALA A 133 -5.504 8.067 32.022 1.00 74.02 H new ATOM 0 HB1 ALA A 133 -6.545 7.342 29.898 1.00 4.23 H new ATOM 0 HB2 ALA A 133 -5.201 8.476 29.622 1.00 4.23 H new ATOM 0 HB3 ALA A 133 -4.967 6.734 29.342 1.00 4.23 H new ATOM 2191 N ALA A 134 -4.574 4.950 31.791 1.00 72.21 N ATOM 2192 CA ALA A 134 -4.862 3.598 32.253 1.00 70.42 C ATOM 2193 C ALA A 134 -4.922 3.539 33.775 1.00 23.44 C ATOM 2194 O ALA A 134 -5.529 2.633 34.349 1.00 51.24 O ATOM 2195 CB ALA A 134 -3.816 2.626 31.726 1.00 54.13 C ATOM 0 H ALA A 134 -3.658 5.061 31.356 1.00 72.21 H new ATOM 0 HA ALA A 134 -5.839 3.309 31.866 1.00 70.42 H new ATOM 0 HB1 ALA A 134 -4.044 1.620 32.079 1.00 54.13 H new ATOM 0 HB2 ALA A 134 -3.824 2.639 30.636 1.00 54.13 H new ATOM 0 HB3 ALA A 134 -2.830 2.922 32.085 1.00 54.13 H new ATOM 2201 N LEU A 135 -4.288 4.508 34.426 1.00 43.14 N ATOM 2202 CA LEU A 135 -4.268 4.566 35.883 1.00 11.31 C ATOM 2203 C LEU A 135 -5.681 4.476 36.451 1.00 60.23 C ATOM 2204 O LEU A 135 -5.901 3.872 37.500 1.00 25.21 O ATOM 2205 CB LEU A 135 -3.599 5.859 36.353 1.00 55.53 C ATOM 2206 CG LEU A 135 -2.830 5.777 37.671 1.00 25.41 C ATOM 2207 CD1 LEU A 135 -3.754 5.360 38.804 1.00 15.02 C ATOM 2208 CD2 LEU A 135 -1.664 4.806 37.548 1.00 43.41 C ATOM 0 H LEU A 135 -3.781 5.265 33.967 1.00 43.14 H new ATOM 0 HA LEU A 135 -3.694 3.714 36.248 1.00 11.31 H new ATOM 0 HB2 LEU A 135 -2.912 6.192 35.575 1.00 55.53 H new ATOM 0 HB3 LEU A 135 -4.367 6.627 36.451 1.00 55.53 H new ATOM 0 HG LEU A 135 -2.432 6.766 37.899 1.00 25.41 H new ATOM 0 HD11 LEU A 135 -3.188 5.307 39.734 1.00 15.02 H new ATOM 0 HD12 LEU A 135 -4.555 6.091 38.908 1.00 15.02 H new ATOM 0 HD13 LEU A 135 -4.182 4.382 38.583 1.00 15.02 H new ATOM 0 HD21 LEU A 135 -1.127 4.760 38.496 1.00 43.41 H new ATOM 0 HD22 LEU A 135 -2.041 3.815 37.296 1.00 43.41 H new ATOM 0 HD23 LEU A 135 -0.988 5.147 36.764 1.00 43.41 H new ATOM 2220 N GLU A 136 -6.635 5.079 35.748 1.00 32.53 N ATOM 2221 CA GLU A 136 -8.027 5.064 36.182 1.00 12.15 C ATOM 2222 C GLU A 136 -8.151 5.533 37.630 1.00 64.45 C ATOM 2223 O GLU A 136 -8.881 4.941 38.425 1.00 0.03 O ATOM 2224 CB GLU A 136 -8.615 3.659 36.038 1.00 72.11 C ATOM 2225 CG GLU A 136 -8.966 3.290 34.606 1.00 4.12 C ATOM 2226 CD GLU A 136 -10.404 3.616 34.255 1.00 13.21 C ATOM 2227 OE1 GLU A 136 -11.306 3.224 35.026 1.00 43.14 O ATOM 2228 OE2 GLU A 136 -10.629 4.263 33.211 1.00 61.22 O ATOM 0 H GLU A 136 -6.470 5.583 34.877 1.00 32.53 H new ATOM 0 HA GLU A 136 -8.586 5.751 35.546 1.00 12.15 H new ATOM 0 HB2 GLU A 136 -7.900 2.934 36.426 1.00 72.11 H new ATOM 0 HB3 GLU A 136 -9.511 3.584 36.654 1.00 72.11 H new ATOM 0 HG2 GLU A 136 -8.301 3.820 33.925 1.00 4.12 H new ATOM 0 HG3 GLU A 136 -8.792 2.224 34.456 1.00 4.12 H new ATOM 2235 N HIS A 137 -7.431 6.599 37.964 1.00 63.04 N ATOM 2236 CA HIS A 137 -7.459 7.148 39.315 1.00 60.23 C ATOM 2237 C HIS A 137 -8.893 7.403 39.767 1.00 14.25 C ATOM 2238 O HIS A 137 -9.632 8.155 39.130 1.00 71.50 O ATOM 2239 CB HIS A 137 -6.653 8.446 39.378 1.00 73.33 C ATOM 2240 CG HIS A 137 -6.154 8.775 40.751 1.00 74.01 C ATOM 2241 ND1 HIS A 137 -6.855 8.472 41.899 1.00 32.41 N ATOM 2242 CD2 HIS A 137 -5.015 9.384 41.157 1.00 75.52 C ATOM 2243 CE1 HIS A 137 -6.170 8.881 42.952 1.00 62.23 C ATOM 2244 NE2 HIS A 137 -5.049 9.437 42.529 1.00 51.34 N ATOM 0 H HIS A 137 -6.821 7.100 37.318 1.00 63.04 H new ATOM 0 HA HIS A 137 -7.009 6.418 39.987 1.00 60.23 H new ATOM 0 HB2 HIS A 137 -5.803 8.369 38.700 1.00 73.33 H new ATOM 0 HB3 HIS A 137 -7.274 9.267 39.019 1.00 73.33 H new ATOM 0 HD2 HIS A 137 -4.227 9.758 40.521 1.00 75.52 H new ATOM 0 HE1 HIS A 137 -6.475 8.778 43.983 1.00 62.23 H new ATOM 0 HE2 HIS A 137 -4.326 9.840 43.125 1.00 51.34 H new ATOM 2252 N HIS A 138 -9.282 6.773 40.871 1.00 23.44 N ATOM 2253 CA HIS A 138 -10.628 6.932 41.409 1.00 31.43 C ATOM 2254 C HIS A 138 -10.763 8.258 42.152 1.00 74.52 C ATOM 2255 O HIS A 138 -11.867 8.782 42.309 1.00 24.22 O ATOM 2256 CB HIS A 138 -10.966 5.772 42.347 1.00 62.13 C ATOM 2257 CG HIS A 138 -12.433 5.622 42.610 1.00 44.02 C ATOM 2258 ND1 HIS A 138 -12.974 5.625 43.878 1.00 21.30 N ATOM 2259 CD2 HIS A 138 -13.473 5.466 41.758 1.00 14.15 C ATOM 2260 CE1 HIS A 138 -14.284 5.475 43.796 1.00 41.15 C ATOM 2261 NE2 HIS A 138 -14.613 5.377 42.520 1.00 4.00 N ATOM 0 H HIS A 138 -8.684 6.147 41.411 1.00 23.44 H new ATOM 0 HA HIS A 138 -11.329 6.930 40.574 1.00 31.43 H new ATOM 0 HB2 HIS A 138 -10.586 4.845 41.917 1.00 62.13 H new ATOM 0 HB3 HIS A 138 -10.449 5.919 43.295 1.00 62.13 H new ATOM 0 HD2 HIS A 138 -13.417 5.420 40.680 1.00 14.15 H new ATOM 0 HE1 HIS A 138 -14.969 5.439 44.630 1.00 41.15 H new ATOM 0 HE2 HIS A 138 -15.559 5.255 42.159 1.00 4.00 H new TER 2269 HIS A 138