USER MOD reduce.3.24.130724 H: found=0, std=0, add=607, rem=0, adj=12 USER MOD reduce.3.24.130724 removed 610 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 Single : A 8 ASN : amide:sc=-0.00954 K(o=-0.0095,f=-0.8) USER MOD Single : A 9 ASN : amide:sc= 0.934 K(o=0.93,f=-0.01) USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 13 TYR OH : rot 29:sc= 1.11 USER MOD Single : A 15 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 LYS NZ :NH3+ -170:sc= 1.28 (180deg=1.12) USER MOD Single : A 19 THR OG1 : rot 90:sc= 1.24 USER MOD Single : A 24 HIS : no HD1:sc= 0 X(o=0,f=-0.022) USER MOD Single : A 28 TYR OH : rot 15:sc= 0 USER MOD Single : A 30 SER OG : rot 180:sc= 0.00422 USER MOD Single : A 36 HIS : no HD1:sc= -0.931 K(o=-0.93,f=-1.7!) USER MOD Single : A 37 THR OG1 : rot 180:sc= 0 USER MOD Single : A 38 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 GLN : amide:sc= -0.159 X(o=-0.16,f=-0.2) USER MOD Single : A 54 SER OG : rot 180:sc= -0.0745 USER MOD Single : A 60 THR OG1 : rot 180:sc= 0 USER MOD Single : A 64 ASN : amide:sc= -0.399 X(o=-0.4,f=-0.44) USER MOD Single : A 69 GLN : amide:sc= 0.765 K(o=0.77,f=-4.4!) USER MOD Single : A 74 SER OG : rot 72:sc= 0.871 USER MOD Single : A 78 GLN : amide:sc= 0.445 X(o=0.44,f=0) USER MOD Single : B 201 ASN : amide:sc= 0.0723 K(o=0.072,f=-5.5!) USER MOD Single : B 203 GLN : amide:sc= 0 K(o=0,f=-0.7) USER MOD Single : B 204 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 211 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 52 N VAL A 5 34.801 44.881 39.706 1.00 0.00 N ATOM 53 CA VAL A 5 35.374 43.784 40.423 1.00 0.00 C ATOM 54 C VAL A 5 35.204 42.467 39.746 1.00 0.00 C ATOM 55 O VAL A 5 36.161 41.740 39.482 1.00 0.00 O ATOM 56 CB VAL A 5 34.776 43.740 41.799 1.00 0.00 C ATOM 57 CG1 VAL A 5 35.295 42.529 42.593 1.00 0.00 C ATOM 58 CG2 VAL A 5 35.147 45.051 42.511 1.00 0.00 C ATOM 0 HA VAL A 5 36.449 43.956 40.469 1.00 0.00 H new ATOM 0 HB VAL A 5 33.693 43.635 41.730 1.00 0.00 H new ATOM 0 HG11 VAL A 5 34.844 42.524 43.585 1.00 0.00 H new ATOM 0 HG12 VAL A 5 35.030 41.610 42.070 1.00 0.00 H new ATOM 0 HG13 VAL A 5 36.379 42.593 42.687 1.00 0.00 H new ATOM 0 HG21 VAL A 5 34.726 45.051 43.517 1.00 0.00 H new ATOM 0 HG22 VAL A 5 36.232 45.138 42.572 1.00 0.00 H new ATOM 0 HG23 VAL A 5 34.746 45.896 41.950 1.00 0.00 H new ATOM 68 N GLU A 6 33.958 42.103 39.394 1.00 0.00 N ATOM 69 CA GLU A 6 33.650 40.848 38.782 1.00 0.00 C ATOM 70 C GLU A 6 34.103 40.729 37.367 1.00 0.00 C ATOM 71 O GLU A 6 34.305 39.623 36.867 1.00 0.00 O ATOM 72 CB GLU A 6 32.187 40.434 39.015 1.00 0.00 C ATOM 73 CG GLU A 6 32.070 39.650 40.324 1.00 0.00 C ATOM 74 CD GLU A 6 30.652 39.622 40.876 1.00 0.00 C ATOM 75 OE1 GLU A 6 29.683 39.356 40.114 1.00 0.00 O ATOM 76 OE2 GLU A 6 30.480 39.916 42.089 1.00 0.00 O ATOM 0 H GLU A 6 33.142 42.698 39.539 1.00 0.00 H new ATOM 0 HA GLU A 6 34.256 40.106 39.301 1.00 0.00 H new ATOM 0 HB2 GLU A 6 31.551 41.319 39.053 1.00 0.00 H new ATOM 0 HB3 GLU A 6 31.836 39.824 38.183 1.00 0.00 H new ATOM 0 HG2 GLU A 6 32.410 38.628 40.160 1.00 0.00 H new ATOM 0 HG3 GLU A 6 32.734 40.092 41.066 1.00 0.00 H new ATOM 83 N PHE A 7 34.377 41.865 36.699 1.00 0.00 N ATOM 84 CA PHE A 7 35.089 41.868 35.460 1.00 0.00 C ATOM 85 C PHE A 7 36.456 41.309 35.653 1.00 0.00 C ATOM 86 O PHE A 7 36.881 40.422 34.914 1.00 0.00 O ATOM 87 CB PHE A 7 35.128 43.288 34.870 1.00 0.00 C ATOM 88 CG PHE A 7 35.126 43.331 33.380 1.00 0.00 C ATOM 89 CD1 PHE A 7 36.142 42.772 32.642 1.00 0.00 C ATOM 90 CD2 PHE A 7 34.125 44.003 32.721 1.00 0.00 C ATOM 91 CE1 PHE A 7 36.155 42.864 31.270 1.00 0.00 C ATOM 92 CE2 PHE A 7 34.131 44.113 31.350 1.00 0.00 C ATOM 93 CZ PHE A 7 35.144 43.536 30.622 1.00 0.00 C ATOM 0 H PHE A 7 34.101 42.792 37.023 1.00 0.00 H new ATOM 0 HA PHE A 7 34.570 41.231 34.744 1.00 0.00 H new ATOM 0 HB2 PHE A 7 34.268 43.847 35.240 1.00 0.00 H new ATOM 0 HB3 PHE A 7 36.020 43.797 35.236 1.00 0.00 H new ATOM 0 HD1 PHE A 7 36.943 42.252 33.148 1.00 0.00 H new ATOM 0 HD2 PHE A 7 33.322 44.451 33.288 1.00 0.00 H new ATOM 0 HE1 PHE A 7 36.955 42.411 30.704 1.00 0.00 H new ATOM 0 HE2 PHE A 7 33.342 44.651 30.847 1.00 0.00 H new ATOM 0 HZ PHE A 7 35.147 43.610 29.545 1.00 0.00 H new ATOM 103 N ASN A 8 37.165 41.718 36.721 1.00 0.00 N ATOM 104 CA ASN A 8 38.500 41.327 37.052 1.00 0.00 C ATOM 105 C ASN A 8 38.578 39.915 37.521 1.00 0.00 C ATOM 106 O ASN A 8 39.597 39.243 37.366 1.00 0.00 O ATOM 107 CB ASN A 8 39.129 42.214 38.139 1.00 0.00 C ATOM 108 CG ASN A 8 38.961 43.695 37.833 1.00 0.00 C ATOM 109 OD1 ASN A 8 38.389 44.433 38.633 1.00 0.00 O ATOM 110 ND2 ASN A 8 39.472 44.162 36.661 1.00 0.00 N ATOM 0 H ASN A 8 36.775 42.370 37.402 1.00 0.00 H new ATOM 0 HA ASN A 8 39.056 41.442 36.121 1.00 0.00 H new ATOM 0 HB2 ASN A 8 38.670 41.988 39.102 1.00 0.00 H new ATOM 0 HB3 ASN A 8 40.190 41.980 38.229 1.00 0.00 H new ATOM 0 HD21 ASN A 8 39.386 45.151 36.425 1.00 0.00 H new ATOM 0 HD22 ASN A 8 39.941 43.523 36.019 1.00 0.00 H new ATOM 117 N ASN A 9 37.479 39.373 38.075 1.00 0.00 N ATOM 118 CA ASN A 9 37.383 38.001 38.468 1.00 0.00 C ATOM 119 C ASN A 9 37.343 37.116 37.270 1.00 0.00 C ATOM 120 O ASN A 9 37.914 36.027 37.265 1.00 0.00 O ATOM 121 CB ASN A 9 36.158 37.726 39.357 1.00 0.00 C ATOM 122 CG ASN A 9 36.355 38.179 40.798 1.00 0.00 C ATOM 123 OD1 ASN A 9 36.264 37.384 41.732 1.00 0.00 O ATOM 124 ND2 ASN A 9 36.604 39.493 41.042 1.00 0.00 N ATOM 0 H ASN A 9 36.629 39.907 38.256 1.00 0.00 H new ATOM 0 HA ASN A 9 38.273 37.782 39.058 1.00 0.00 H new ATOM 0 HB2 ASN A 9 35.290 38.235 38.937 1.00 0.00 H new ATOM 0 HB3 ASN A 9 35.939 36.658 39.344 1.00 0.00 H new ATOM 0 HD21 ASN A 9 36.716 39.821 42.001 1.00 0.00 H new ATOM 0 HD22 ASN A 9 36.679 40.151 40.266 1.00 0.00 H new ATOM 131 N ALA A 10 36.724 37.591 36.173 1.00 0.00 N ATOM 132 CA ALA A 10 36.786 36.961 34.891 1.00 0.00 C ATOM 133 C ALA A 10 38.154 37.022 34.304 1.00 0.00 C ATOM 134 O ALA A 10 38.672 36.003 33.850 1.00 0.00 O ATOM 135 CB ALA A 10 35.727 37.530 33.933 1.00 0.00 C ATOM 0 H ALA A 10 36.162 38.442 36.180 1.00 0.00 H new ATOM 0 HA ALA A 10 36.556 35.906 35.040 1.00 0.00 H new ATOM 0 HB1 ALA A 10 35.802 37.029 32.968 1.00 0.00 H new ATOM 0 HB2 ALA A 10 34.733 37.366 34.350 1.00 0.00 H new ATOM 0 HB3 ALA A 10 35.893 38.599 33.800 1.00 0.00 H new ATOM 141 N ILE A 11 38.840 38.179 34.342 1.00 0.00 N ATOM 142 CA ILE A 11 40.184 38.360 33.892 1.00 0.00 C ATOM 143 C ILE A 11 41.144 37.392 34.493 1.00 0.00 C ATOM 144 O ILE A 11 41.924 36.732 33.809 1.00 0.00 O ATOM 145 CB ILE A 11 40.724 39.729 34.181 1.00 0.00 C ATOM 146 CG1 ILE A 11 39.823 40.869 33.676 1.00 0.00 C ATOM 147 CG2 ILE A 11 42.099 39.964 33.535 1.00 0.00 C ATOM 148 CD1 ILE A 11 39.316 40.726 32.242 1.00 0.00 C ATOM 0 H ILE A 11 38.431 39.038 34.709 1.00 0.00 H new ATOM 0 HA ILE A 11 40.109 38.199 32.817 1.00 0.00 H new ATOM 0 HB ILE A 11 40.783 39.751 35.269 1.00 0.00 H new ATOM 0 HG12 ILE A 11 38.962 40.949 34.340 1.00 0.00 H new ATOM 0 HG13 ILE A 11 40.375 41.806 33.755 1.00 0.00 H new ATOM 0 HG21 ILE A 11 42.446 40.969 33.774 1.00 0.00 H new ATOM 0 HG22 ILE A 11 42.811 39.233 33.919 1.00 0.00 H new ATOM 0 HG23 ILE A 11 42.016 39.856 32.454 1.00 0.00 H new ATOM 0 HD11 ILE A 11 38.691 41.583 31.990 1.00 0.00 H new ATOM 0 HD12 ILE A 11 40.164 40.682 31.559 1.00 0.00 H new ATOM 0 HD13 ILE A 11 38.730 39.811 32.153 1.00 0.00 H new ATOM 160 N SER A 12 41.073 37.252 35.829 1.00 0.00 N ATOM 161 CA SER A 12 41.871 36.362 36.614 1.00 0.00 C ATOM 162 C SER A 12 41.763 34.930 36.216 1.00 0.00 C ATOM 163 O SER A 12 42.725 34.170 36.309 1.00 0.00 O ATOM 164 CB SER A 12 41.546 36.492 38.112 1.00 0.00 C ATOM 165 OG SER A 12 42.617 36.056 38.936 1.00 0.00 O ATOM 0 H SER A 12 40.419 37.793 36.394 1.00 0.00 H new ATOM 0 HA SER A 12 42.898 36.672 36.421 1.00 0.00 H new ATOM 0 HB2 SER A 12 41.314 37.532 38.342 1.00 0.00 H new ATOM 0 HB3 SER A 12 40.654 35.908 38.340 1.00 0.00 H new ATOM 0 HG SER A 12 42.367 36.158 39.878 1.00 0.00 H new ATOM 171 N TYR A 13 40.591 34.507 35.711 1.00 0.00 N ATOM 172 CA TYR A 13 40.365 33.209 35.154 1.00 0.00 C ATOM 173 C TYR A 13 41.062 33.034 33.849 1.00 0.00 C ATOM 174 O TYR A 13 41.881 32.131 33.683 1.00 0.00 O ATOM 175 CB TYR A 13 38.856 32.968 34.983 1.00 0.00 C ATOM 176 CG TYR A 13 38.508 31.576 34.581 1.00 0.00 C ATOM 177 CD1 TYR A 13 38.818 30.494 35.369 1.00 0.00 C ATOM 178 CD2 TYR A 13 37.849 31.374 33.391 1.00 0.00 C ATOM 179 CE1 TYR A 13 38.432 29.229 34.992 1.00 0.00 C ATOM 180 CE2 TYR A 13 37.457 30.114 33.005 1.00 0.00 C ATOM 181 CZ TYR A 13 37.748 29.041 33.814 1.00 0.00 C ATOM 182 OH TYR A 13 37.376 27.743 33.404 1.00 0.00 O ATOM 0 H TYR A 13 39.760 35.099 35.690 1.00 0.00 H new ATOM 0 HA TYR A 13 40.777 32.475 35.847 1.00 0.00 H new ATOM 0 HB2 TYR A 13 38.352 33.201 35.921 1.00 0.00 H new ATOM 0 HB3 TYR A 13 38.470 33.659 34.234 1.00 0.00 H new ATOM 0 HD1 TYR A 13 39.367 30.637 36.288 1.00 0.00 H new ATOM 0 HD2 TYR A 13 37.636 32.217 32.751 1.00 0.00 H new ATOM 0 HE1 TYR A 13 38.666 28.383 35.621 1.00 0.00 H new ATOM 0 HE2 TYR A 13 36.926 29.969 32.076 1.00 0.00 H new ATOM 0 HH TYR A 13 37.243 27.176 34.192 1.00 0.00 H new ATOM 192 N VAL A 14 40.786 33.903 32.860 1.00 0.00 N ATOM 193 CA VAL A 14 41.334 33.835 31.541 1.00 0.00 C ATOM 194 C VAL A 14 42.820 33.935 31.512 1.00 0.00 C ATOM 195 O VAL A 14 43.504 33.211 30.789 1.00 0.00 O ATOM 196 CB VAL A 14 40.762 34.888 30.639 1.00 0.00 C ATOM 197 CG1 VAL A 14 41.065 34.502 29.181 1.00 0.00 C ATOM 198 CG2 VAL A 14 39.230 34.932 30.762 1.00 0.00 C ATOM 0 H VAL A 14 40.150 34.691 32.987 1.00 0.00 H new ATOM 0 HA VAL A 14 41.052 32.847 31.176 1.00 0.00 H new ATOM 0 HB VAL A 14 41.196 35.849 30.916 1.00 0.00 H new ATOM 0 HG11 VAL A 14 40.655 35.258 28.512 1.00 0.00 H new ATOM 0 HG12 VAL A 14 42.144 34.437 29.038 1.00 0.00 H new ATOM 0 HG13 VAL A 14 40.611 33.536 28.958 1.00 0.00 H new ATOM 0 HG21 VAL A 14 38.834 35.702 30.100 1.00 0.00 H new ATOM 0 HG22 VAL A 14 38.815 33.964 30.482 1.00 0.00 H new ATOM 0 HG23 VAL A 14 38.954 35.161 31.791 1.00 0.00 H new ATOM 208 N ASN A 15 43.406 34.809 32.350 1.00 0.00 N ATOM 209 CA ASN A 15 44.819 34.861 32.558 1.00 0.00 C ATOM 210 C ASN A 15 45.442 33.583 33.007 1.00 0.00 C ATOM 211 O ASN A 15 46.516 33.216 32.534 1.00 0.00 O ATOM 212 CB ASN A 15 45.178 35.978 33.552 1.00 0.00 C ATOM 213 CG ASN A 15 46.678 36.223 33.629 1.00 0.00 C ATOM 214 OD1 ASN A 15 47.356 36.471 32.633 1.00 0.00 O ATOM 215 ND2 ASN A 15 47.240 36.116 34.863 1.00 0.00 N ATOM 0 H ASN A 15 42.885 35.495 32.896 1.00 0.00 H new ATOM 0 HA ASN A 15 45.234 35.067 31.571 1.00 0.00 H new ATOM 0 HB2 ASN A 15 44.676 36.899 33.256 1.00 0.00 H new ATOM 0 HB3 ASN A 15 44.804 35.715 34.541 1.00 0.00 H new ATOM 0 HD21 ASN A 15 48.246 36.242 34.978 1.00 0.00 H new ATOM 0 HD22 ASN A 15 46.656 35.910 35.673 1.00 0.00 H new ATOM 222 N LYS A 16 44.819 32.831 33.932 1.00 0.00 N ATOM 223 CA LYS A 16 45.292 31.565 34.399 1.00 0.00 C ATOM 224 C LYS A 16 45.299 30.512 33.345 1.00 0.00 C ATOM 225 O LYS A 16 46.227 29.713 33.234 1.00 0.00 O ATOM 226 CB LYS A 16 44.401 31.165 35.587 1.00 0.00 C ATOM 227 CG LYS A 16 45.041 30.083 36.461 1.00 0.00 C ATOM 228 CD LYS A 16 44.407 30.022 37.852 1.00 0.00 C ATOM 229 CE LYS A 16 45.259 29.229 38.845 1.00 0.00 C ATOM 230 NZ LYS A 16 44.886 29.548 40.241 1.00 0.00 N ATOM 0 H LYS A 16 43.946 33.119 34.374 1.00 0.00 H new ATOM 0 HA LYS A 16 46.335 31.659 34.700 1.00 0.00 H new ATOM 0 HB2 LYS A 16 44.196 32.045 36.196 1.00 0.00 H new ATOM 0 HB3 LYS A 16 43.442 30.806 35.213 1.00 0.00 H new ATOM 0 HG2 LYS A 16 44.938 29.114 35.973 1.00 0.00 H new ATOM 0 HG3 LYS A 16 46.109 30.279 36.557 1.00 0.00 H new ATOM 0 HD2 LYS A 16 44.263 31.035 38.228 1.00 0.00 H new ATOM 0 HD3 LYS A 16 43.420 29.566 37.779 1.00 0.00 H new ATOM 0 HE2 LYS A 16 45.132 28.161 38.666 1.00 0.00 H new ATOM 0 HE3 LYS A 16 46.313 29.455 38.686 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 45.479 28.997 40.893 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 45.030 30.563 40.416 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 43.886 29.309 40.396 1.00 0.00 H new ATOM 244 N ILE A 17 44.279 30.534 32.468 1.00 0.00 N ATOM 245 CA ILE A 17 44.136 29.711 31.306 1.00 0.00 C ATOM 246 C ILE A 17 45.200 30.013 30.308 1.00 0.00 C ATOM 247 O ILE A 17 45.906 29.122 29.838 1.00 0.00 O ATOM 248 CB ILE A 17 42.759 29.927 30.753 1.00 0.00 C ATOM 249 CG1 ILE A 17 41.751 29.299 31.730 1.00 0.00 C ATOM 250 CG2 ILE A 17 42.575 29.368 29.332 1.00 0.00 C ATOM 251 CD1 ILE A 17 40.291 29.426 31.298 1.00 0.00 C ATOM 0 H ILE A 17 43.495 31.177 32.581 1.00 0.00 H new ATOM 0 HA ILE A 17 44.255 28.659 31.565 1.00 0.00 H new ATOM 0 HB ILE A 17 42.591 31.000 30.659 1.00 0.00 H new ATOM 0 HG12 ILE A 17 41.991 28.243 31.851 1.00 0.00 H new ATOM 0 HG13 ILE A 17 41.870 29.767 32.707 1.00 0.00 H new ATOM 0 HG21 ILE A 17 41.556 29.559 28.995 1.00 0.00 H new ATOM 0 HG22 ILE A 17 43.278 29.854 28.656 1.00 0.00 H new ATOM 0 HG23 ILE A 17 42.760 28.294 29.337 1.00 0.00 H new ATOM 0 HD11 ILE A 17 39.649 28.957 32.043 1.00 0.00 H new ATOM 0 HD12 ILE A 17 40.029 30.480 31.205 1.00 0.00 H new ATOM 0 HD13 ILE A 17 40.152 28.932 30.337 1.00 0.00 H new ATOM 263 N LYS A 18 45.401 31.301 29.979 1.00 0.00 N ATOM 264 CA LYS A 18 46.403 31.761 29.067 1.00 0.00 C ATOM 265 C LYS A 18 47.787 31.422 29.503 1.00 0.00 C ATOM 266 O LYS A 18 48.629 31.043 28.690 1.00 0.00 O ATOM 267 CB LYS A 18 46.202 33.250 28.740 1.00 0.00 C ATOM 268 CG LYS A 18 47.236 34.263 29.235 1.00 0.00 C ATOM 269 CD LYS A 18 46.841 35.722 28.999 1.00 0.00 C ATOM 270 CE LYS A 18 46.456 36.124 27.573 1.00 0.00 C ATOM 271 NZ LYS A 18 47.592 36.019 26.630 1.00 0.00 N ATOM 0 H LYS A 18 44.838 32.058 30.367 1.00 0.00 H new ATOM 0 HA LYS A 18 46.276 31.215 28.132 1.00 0.00 H new ATOM 0 HB2 LYS A 18 46.142 33.344 27.656 1.00 0.00 H new ATOM 0 HB3 LYS A 18 45.232 33.547 29.140 1.00 0.00 H new ATOM 0 HG2 LYS A 18 47.398 34.109 30.302 1.00 0.00 H new ATOM 0 HG3 LYS A 18 48.186 34.070 28.737 1.00 0.00 H new ATOM 0 HD2 LYS A 18 46.001 35.954 29.653 1.00 0.00 H new ATOM 0 HD3 LYS A 18 47.673 36.352 29.314 1.00 0.00 H new ATOM 0 HE2 LYS A 18 45.641 35.489 27.227 1.00 0.00 H new ATOM 0 HE3 LYS A 18 46.083 37.148 27.575 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 47.333 36.458 25.724 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 48.419 36.508 27.027 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 47.823 35.017 26.475 1.00 0.00 H new ATOM 285 N THR A 19 48.055 31.496 30.818 1.00 0.00 N ATOM 286 CA THR A 19 49.307 31.184 31.434 1.00 0.00 C ATOM 287 C THR A 19 49.612 29.727 31.503 1.00 0.00 C ATOM 288 O THR A 19 50.754 29.336 31.267 1.00 0.00 O ATOM 289 CB THR A 19 49.377 31.780 32.809 1.00 0.00 C ATOM 290 OG1 THR A 19 49.220 33.189 32.714 1.00 0.00 O ATOM 291 CG2 THR A 19 50.739 31.534 33.479 1.00 0.00 C ATOM 0 H THR A 19 47.352 31.793 31.494 1.00 0.00 H new ATOM 0 HA THR A 19 50.066 31.624 30.787 1.00 0.00 H new ATOM 0 HB THR A 19 48.590 31.311 33.400 1.00 0.00 H new ATOM 0 HG1 THR A 19 48.269 33.417 32.781 1.00 0.00 H new ATOM 0 HG21 THR A 19 50.742 31.983 34.472 1.00 0.00 H new ATOM 0 HG22 THR A 19 50.914 30.462 33.565 1.00 0.00 H new ATOM 0 HG23 THR A 19 51.528 31.982 32.875 1.00 0.00 H new ATOM 299 N ARG A 20 48.665 28.823 31.813 1.00 0.00 N ATOM 300 CA ARG A 20 48.987 27.432 31.744 1.00 0.00 C ATOM 301 C ARG A 20 49.103 26.898 30.358 1.00 0.00 C ATOM 302 O ARG A 20 50.011 26.124 30.060 1.00 0.00 O ATOM 303 CB ARG A 20 47.915 26.623 32.495 1.00 0.00 C ATOM 304 CG ARG A 20 47.917 26.770 34.017 1.00 0.00 C ATOM 305 CD ARG A 20 46.754 25.970 34.607 1.00 0.00 C ATOM 306 NE ARG A 20 46.770 26.086 36.093 1.00 0.00 N ATOM 307 CZ ARG A 20 45.771 25.544 36.850 1.00 0.00 C ATOM 308 NH1 ARG A 20 44.727 24.862 36.297 1.00 0.00 N ATOM 309 NH2 ARG A 20 45.810 25.668 38.209 1.00 0.00 N ATOM 0 H ARG A 20 47.711 29.043 32.101 1.00 0.00 H new ATOM 0 HA ARG A 20 49.970 27.328 32.203 1.00 0.00 H new ATOM 0 HB2 ARG A 20 46.935 26.919 32.121 1.00 0.00 H new ATOM 0 HB3 ARG A 20 48.044 25.569 32.250 1.00 0.00 H new ATOM 0 HG2 ARG A 20 48.862 26.414 34.426 1.00 0.00 H new ATOM 0 HG3 ARG A 20 47.826 27.821 34.292 1.00 0.00 H new ATOM 0 HD2 ARG A 20 45.808 26.341 34.213 1.00 0.00 H new ATOM 0 HD3 ARG A 20 46.833 24.923 34.313 1.00 0.00 H new ATOM 0 HE ARG A 20 47.538 26.577 36.551 1.00 0.00 H new ATOM 0 HH11 ARG A 20 44.674 24.743 35.285 1.00 0.00 H new ATOM 0 HH12 ARG A 20 43.999 24.471 36.895 1.00 0.00 H new ATOM 0 HH21 ARG A 20 46.583 26.164 38.654 1.00 0.00 H new ATOM 0 HH22 ARG A 20 45.067 25.265 38.779 1.00 0.00 H new ATOM 323 N PHE A 21 48.215 27.309 29.434 1.00 0.00 N ATOM 324 CA PHE A 21 48.217 26.836 28.085 1.00 0.00 C ATOM 325 C PHE A 21 49.159 27.570 27.193 1.00 0.00 C ATOM 326 O PHE A 21 48.838 27.930 26.063 1.00 0.00 O ATOM 327 CB PHE A 21 46.807 26.888 27.471 1.00 0.00 C ATOM 328 CG PHE A 21 45.850 25.975 28.158 1.00 0.00 C ATOM 329 CD1 PHE A 21 46.133 24.642 28.345 1.00 0.00 C ATOM 330 CD2 PHE A 21 44.619 26.452 28.542 1.00 0.00 C ATOM 331 CE1 PHE A 21 45.209 23.805 28.924 1.00 0.00 C ATOM 332 CE2 PHE A 21 43.692 25.631 29.138 1.00 0.00 C ATOM 333 CZ PHE A 21 43.994 24.303 29.331 1.00 0.00 C ATOM 0 H PHE A 21 47.478 27.986 29.630 1.00 0.00 H new ATOM 0 HA PHE A 21 48.561 25.804 28.150 1.00 0.00 H new ATOM 0 HB2 PHE A 21 46.430 27.909 27.522 1.00 0.00 H new ATOM 0 HB3 PHE A 21 46.864 26.622 26.416 1.00 0.00 H new ATOM 0 HD1 PHE A 21 47.090 24.249 28.034 1.00 0.00 H new ATOM 0 HD2 PHE A 21 44.376 27.491 28.372 1.00 0.00 H new ATOM 0 HE1 PHE A 21 45.437 22.758 29.059 1.00 0.00 H new ATOM 0 HE2 PHE A 21 42.736 26.024 29.452 1.00 0.00 H new ATOM 0 HZ PHE A 21 43.275 23.650 29.803 1.00 0.00 H new ATOM 343 N LEU A 22 50.418 27.770 27.626 1.00 0.00 N ATOM 344 CA LEU A 22 51.485 28.243 26.801 1.00 0.00 C ATOM 345 C LEU A 22 52.049 27.133 25.983 1.00 0.00 C ATOM 346 O LEU A 22 52.391 27.287 24.811 1.00 0.00 O ATOM 347 CB LEU A 22 52.601 28.920 27.614 1.00 0.00 C ATOM 348 CG LEU A 22 52.077 30.160 28.358 1.00 0.00 C ATOM 349 CD1 LEU A 22 53.176 30.646 29.319 1.00 0.00 C ATOM 350 CD2 LEU A 22 51.632 31.327 27.460 1.00 0.00 C ATOM 0 H LEU A 22 50.703 27.595 28.590 1.00 0.00 H new ATOM 0 HA LEU A 22 51.060 28.998 26.140 1.00 0.00 H new ATOM 0 HB2 LEU A 22 53.013 28.210 28.331 1.00 0.00 H new ATOM 0 HB3 LEU A 22 53.414 29.209 26.949 1.00 0.00 H new ATOM 0 HG LEU A 22 51.174 29.844 28.880 1.00 0.00 H new ATOM 0 HD11 LEU A 22 52.825 31.526 29.858 1.00 0.00 H new ATOM 0 HD12 LEU A 22 53.413 29.855 30.031 1.00 0.00 H new ATOM 0 HD13 LEU A 22 54.070 30.901 28.750 1.00 0.00 H new ATOM 0 HD21 LEU A 22 51.280 32.151 28.081 1.00 0.00 H new ATOM 0 HD22 LEU A 22 52.475 31.663 26.856 1.00 0.00 H new ATOM 0 HD23 LEU A 22 50.825 30.996 26.806 1.00 0.00 H new ATOM 362 N ASP A 23 52.091 25.929 26.581 1.00 0.00 N ATOM 363 CA ASP A 23 52.471 24.718 25.922 1.00 0.00 C ATOM 364 C ASP A 23 51.413 24.205 25.006 1.00 0.00 C ATOM 365 O ASP A 23 51.647 23.322 24.182 1.00 0.00 O ATOM 366 CB ASP A 23 52.834 23.656 26.973 1.00 0.00 C ATOM 367 CG ASP A 23 54.156 24.018 27.635 1.00 0.00 C ATOM 368 OD1 ASP A 23 54.209 24.981 28.445 1.00 0.00 O ATOM 369 OD2 ASP A 23 55.178 23.346 27.332 1.00 0.00 O ATOM 0 H ASP A 23 51.851 25.794 27.563 1.00 0.00 H new ATOM 0 HA ASP A 23 53.339 24.939 25.300 1.00 0.00 H new ATOM 0 HB2 ASP A 23 52.047 23.590 27.724 1.00 0.00 H new ATOM 0 HB3 ASP A 23 52.909 22.676 26.502 1.00 0.00 H new ATOM 374 N HIS A 24 50.189 24.758 25.082 1.00 0.00 N ATOM 375 CA HIS A 24 49.107 24.407 24.217 1.00 0.00 C ATOM 376 C HIS A 24 48.406 25.630 23.736 1.00 0.00 C ATOM 377 O HIS A 24 47.260 25.836 24.134 1.00 0.00 O ATOM 378 CB HIS A 24 48.120 23.451 24.911 1.00 0.00 C ATOM 379 CG HIS A 24 48.616 22.056 25.151 1.00 0.00 C ATOM 380 ND1 HIS A 24 49.027 21.612 26.380 1.00 0.00 N ATOM 381 CD2 HIS A 24 48.586 20.970 24.333 1.00 0.00 C ATOM 382 CE1 HIS A 24 49.231 20.309 26.324 1.00 0.00 C ATOM 383 NE2 HIS A 24 48.981 19.901 25.094 1.00 0.00 N ATOM 0 H HIS A 24 49.945 25.472 25.768 1.00 0.00 H new ATOM 0 HA HIS A 24 49.523 23.884 23.356 1.00 0.00 H new ATOM 0 HB2 HIS A 24 47.838 23.885 25.870 1.00 0.00 H new ATOM 0 HB3 HIS A 24 47.214 23.395 24.308 1.00 0.00 H new ATOM 0 HD2 HIS A 24 48.306 20.953 23.290 1.00 0.00 H new ATOM 0 HE1 HIS A 24 49.548 19.683 27.145 1.00 0.00 H new ATOM 0 HE2 HIS A 24 49.068 18.941 24.762 1.00 0.00 H new ATOM 392 N PRO A 25 48.928 26.465 22.887 1.00 0.00 N ATOM 393 CA PRO A 25 48.318 27.715 22.539 1.00 0.00 C ATOM 394 C PRO A 25 47.132 27.546 21.653 1.00 0.00 C ATOM 395 O PRO A 25 46.387 28.500 21.436 1.00 0.00 O ATOM 396 CB PRO A 25 49.427 28.474 21.814 1.00 0.00 C ATOM 397 CG PRO A 25 50.252 27.368 21.137 1.00 0.00 C ATOM 398 CD PRO A 25 50.193 26.257 22.197 1.00 0.00 C ATOM 0 HA PRO A 25 47.939 28.235 23.419 1.00 0.00 H new ATOM 0 HB2 PRO A 25 49.021 29.173 21.083 1.00 0.00 H new ATOM 0 HB3 PRO A 25 50.033 29.056 22.509 1.00 0.00 H new ATOM 0 HG2 PRO A 25 49.818 27.054 20.188 1.00 0.00 H new ATOM 0 HG3 PRO A 25 51.274 27.685 20.931 1.00 0.00 H new ATOM 0 HD2 PRO A 25 50.235 25.270 21.737 1.00 0.00 H new ATOM 0 HD3 PRO A 25 51.035 26.323 22.886 1.00 0.00 H new ATOM 406 N GLU A 26 46.891 26.322 21.152 1.00 0.00 N ATOM 407 CA GLU A 26 45.739 25.950 20.392 1.00 0.00 C ATOM 408 C GLU A 26 44.496 25.965 21.213 1.00 0.00 C ATOM 409 O GLU A 26 43.408 26.197 20.687 1.00 0.00 O ATOM 410 CB GLU A 26 45.957 24.594 19.697 1.00 0.00 C ATOM 411 CG GLU A 26 46.185 23.412 20.640 1.00 0.00 C ATOM 412 CD GLU A 26 46.368 22.095 19.898 1.00 0.00 C ATOM 413 OE1 GLU A 26 47.503 21.796 19.439 1.00 0.00 O ATOM 414 OE2 GLU A 26 45.366 21.336 19.807 1.00 0.00 O ATOM 0 H GLU A 26 47.540 25.546 21.286 1.00 0.00 H new ATOM 0 HA GLU A 26 45.600 26.702 19.615 1.00 0.00 H new ATOM 0 HB2 GLU A 26 45.089 24.379 19.073 1.00 0.00 H new ATOM 0 HB3 GLU A 26 46.816 24.678 19.031 1.00 0.00 H new ATOM 0 HG2 GLU A 26 47.066 23.605 21.252 1.00 0.00 H new ATOM 0 HG3 GLU A 26 45.338 23.326 21.320 1.00 0.00 H new ATOM 421 N ILE A 27 44.597 25.822 22.546 1.00 0.00 N ATOM 422 CA ILE A 27 43.496 25.886 23.457 1.00 0.00 C ATOM 423 C ILE A 27 42.921 27.260 23.457 1.00 0.00 C ATOM 424 O ILE A 27 41.707 27.451 23.401 1.00 0.00 O ATOM 425 CB ILE A 27 43.849 25.546 24.875 1.00 0.00 C ATOM 426 CG1 ILE A 27 44.639 24.255 25.146 1.00 0.00 C ATOM 427 CG2 ILE A 27 42.541 25.399 25.670 1.00 0.00 C ATOM 428 CD1 ILE A 27 44.621 23.175 24.064 1.00 0.00 C ATOM 0 H ILE A 27 45.489 25.654 23.011 1.00 0.00 H new ATOM 0 HA ILE A 27 42.786 25.139 23.103 1.00 0.00 H new ATOM 0 HB ILE A 27 44.509 26.363 25.166 1.00 0.00 H new ATOM 0 HG12 ILE A 27 45.678 24.529 25.330 1.00 0.00 H new ATOM 0 HG13 ILE A 27 44.257 23.814 26.067 1.00 0.00 H new ATOM 0 HG21 ILE A 27 42.771 25.151 26.706 1.00 0.00 H new ATOM 0 HG22 ILE A 27 41.987 26.337 25.635 1.00 0.00 H new ATOM 0 HG23 ILE A 27 41.937 24.604 25.233 1.00 0.00 H new ATOM 0 HD11 ILE A 27 45.218 22.324 24.390 1.00 0.00 H new ATOM 0 HD12 ILE A 27 43.595 22.852 23.889 1.00 0.00 H new ATOM 0 HD13 ILE A 27 45.037 23.578 23.141 1.00 0.00 H new ATOM 440 N TYR A 28 43.784 28.292 23.450 1.00 0.00 N ATOM 441 CA TYR A 28 43.429 29.677 23.439 1.00 0.00 C ATOM 442 C TYR A 28 42.715 30.082 22.195 1.00 0.00 C ATOM 443 O TYR A 28 42.057 31.121 22.134 1.00 0.00 O ATOM 444 CB TYR A 28 44.684 30.518 23.725 1.00 0.00 C ATOM 445 CG TYR A 28 44.330 31.808 24.382 1.00 0.00 C ATOM 446 CD1 TYR A 28 44.123 31.872 25.740 1.00 0.00 C ATOM 447 CD2 TYR A 28 44.172 32.949 23.632 1.00 0.00 C ATOM 448 CE1 TYR A 28 43.741 33.052 26.334 1.00 0.00 C ATOM 449 CE2 TYR A 28 43.783 34.134 24.212 1.00 0.00 C ATOM 450 CZ TYR A 28 43.570 34.183 25.569 1.00 0.00 C ATOM 451 OH TYR A 28 43.165 35.384 26.188 1.00 0.00 O ATOM 0 H TYR A 28 44.794 28.149 23.452 1.00 0.00 H new ATOM 0 HA TYR A 28 42.705 29.863 24.232 1.00 0.00 H new ATOM 0 HB2 TYR A 28 45.364 29.956 24.365 1.00 0.00 H new ATOM 0 HB3 TYR A 28 45.213 30.715 22.793 1.00 0.00 H new ATOM 0 HD1 TYR A 28 44.262 30.988 26.345 1.00 0.00 H new ATOM 0 HD2 TYR A 28 44.357 32.914 22.568 1.00 0.00 H new ATOM 0 HE1 TYR A 28 43.575 33.091 27.400 1.00 0.00 H new ATOM 0 HE2 TYR A 28 43.646 35.018 23.607 1.00 0.00 H new ATOM 0 HH TYR A 28 43.282 35.308 27.158 1.00 0.00 H new ATOM 461 N ARG A 29 42.834 29.291 21.115 1.00 0.00 N ATOM 462 CA ARG A 29 42.009 29.415 19.953 1.00 0.00 C ATOM 463 C ARG A 29 40.672 28.784 20.144 1.00 0.00 C ATOM 464 O ARG A 29 39.638 29.443 20.053 1.00 0.00 O ATOM 465 CB ARG A 29 42.704 28.819 18.717 1.00 0.00 C ATOM 466 CG ARG A 29 44.172 29.216 18.546 1.00 0.00 C ATOM 467 CD ARG A 29 44.422 30.712 18.344 1.00 0.00 C ATOM 468 NE ARG A 29 45.879 30.937 18.563 1.00 0.00 N ATOM 469 CZ ARG A 29 46.839 31.015 17.596 1.00 0.00 C ATOM 470 NH1 ARG A 29 46.601 30.783 16.272 1.00 0.00 N ATOM 471 NH2 ARG A 29 48.094 31.380 17.988 1.00 0.00 N ATOM 0 H ARG A 29 43.524 28.543 21.047 1.00 0.00 H new ATOM 0 HA ARG A 29 41.853 30.481 19.790 1.00 0.00 H new ATOM 0 HB2 ARG A 29 42.641 27.732 18.772 1.00 0.00 H new ATOM 0 HB3 ARG A 29 42.154 29.125 17.827 1.00 0.00 H new ATOM 0 HG2 ARG A 29 44.726 28.887 19.425 1.00 0.00 H new ATOM 0 HG3 ARG A 29 44.581 28.677 17.691 1.00 0.00 H new ATOM 0 HD2 ARG A 29 44.129 31.021 17.341 1.00 0.00 H new ATOM 0 HD3 ARG A 29 43.830 31.301 19.044 1.00 0.00 H new ATOM 0 HE ARG A 29 46.189 31.043 19.529 1.00 0.00 H new ATOM 0 HH11 ARG A 29 45.663 30.536 15.958 1.00 0.00 H new ATOM 0 HH12 ARG A 29 47.362 30.857 15.596 1.00 0.00 H new ATOM 0 HH21 ARG A 29 48.283 31.582 18.970 1.00 0.00 H new ATOM 0 HH22 ARG A 29 48.843 31.451 17.299 1.00 0.00 H new ATOM 485 N SER A 30 40.616 27.465 20.398 1.00 0.00 N ATOM 486 CA SER A 30 39.418 26.691 20.312 1.00 0.00 C ATOM 487 C SER A 30 38.498 26.801 21.478 1.00 0.00 C ATOM 488 O SER A 30 37.292 26.613 21.326 1.00 0.00 O ATOM 489 CB SER A 30 39.726 25.221 19.979 1.00 0.00 C ATOM 490 OG SER A 30 40.709 24.688 20.855 1.00 0.00 O ATOM 0 H SER A 30 41.433 26.919 20.673 1.00 0.00 H new ATOM 0 HA SER A 30 38.864 27.139 19.487 1.00 0.00 H new ATOM 0 HB2 SER A 30 38.813 24.630 20.052 1.00 0.00 H new ATOM 0 HB3 SER A 30 40.074 25.145 18.949 1.00 0.00 H new ATOM 0 HG SER A 30 40.883 23.753 20.621 1.00 0.00 H new ATOM 496 N PHE A 31 39.000 27.153 22.676 1.00 0.00 N ATOM 497 CA PHE A 31 38.230 27.449 23.844 1.00 0.00 C ATOM 498 C PHE A 31 37.187 28.487 23.612 1.00 0.00 C ATOM 499 O PHE A 31 36.004 28.308 23.895 1.00 0.00 O ATOM 500 CB PHE A 31 39.187 27.875 24.970 1.00 0.00 C ATOM 501 CG PHE A 31 38.611 28.355 26.257 1.00 0.00 C ATOM 502 CD1 PHE A 31 37.458 27.825 26.785 1.00 0.00 C ATOM 503 CD2 PHE A 31 39.252 29.349 26.958 1.00 0.00 C ATOM 504 CE1 PHE A 31 36.926 28.309 27.957 1.00 0.00 C ATOM 505 CE2 PHE A 31 38.733 29.840 28.132 1.00 0.00 C ATOM 506 CZ PHE A 31 37.563 29.320 28.636 1.00 0.00 C ATOM 0 H PHE A 31 40.004 27.236 22.838 1.00 0.00 H new ATOM 0 HA PHE A 31 37.688 26.547 24.127 1.00 0.00 H new ATOM 0 HB2 PHE A 31 39.833 27.026 25.194 1.00 0.00 H new ATOM 0 HB3 PHE A 31 39.826 28.667 24.579 1.00 0.00 H new ATOM 0 HD1 PHE A 31 36.962 27.015 26.271 1.00 0.00 H new ATOM 0 HD2 PHE A 31 40.180 29.751 26.579 1.00 0.00 H new ATOM 0 HE1 PHE A 31 36.007 27.894 28.344 1.00 0.00 H new ATOM 0 HE2 PHE A 31 39.243 30.633 28.658 1.00 0.00 H new ATOM 0 HZ PHE A 31 37.149 29.703 29.557 1.00 0.00 H new ATOM 516 N LEU A 32 37.582 29.646 23.054 1.00 0.00 N ATOM 517 CA LEU A 32 36.705 30.763 22.891 1.00 0.00 C ATOM 518 C LEU A 32 35.734 30.574 21.776 1.00 0.00 C ATOM 519 O LEU A 32 34.608 31.066 21.829 1.00 0.00 O ATOM 520 CB LEU A 32 37.420 32.078 22.541 1.00 0.00 C ATOM 521 CG LEU A 32 38.863 32.219 23.053 1.00 0.00 C ATOM 522 CD1 LEU A 32 39.621 33.151 22.092 1.00 0.00 C ATOM 523 CD2 LEU A 32 38.882 32.715 24.508 1.00 0.00 C ATOM 0 H LEU A 32 38.528 29.810 22.710 1.00 0.00 H new ATOM 0 HA LEU A 32 36.222 30.823 23.866 1.00 0.00 H new ATOM 0 HB2 LEU A 32 37.428 32.186 21.456 1.00 0.00 H new ATOM 0 HB3 LEU A 32 36.832 32.905 22.939 1.00 0.00 H new ATOM 0 HG LEU A 32 39.364 31.251 23.066 1.00 0.00 H new ATOM 0 HD11 LEU A 32 40.649 33.268 22.434 1.00 0.00 H new ATOM 0 HD12 LEU A 32 39.618 32.721 21.090 1.00 0.00 H new ATOM 0 HD13 LEU A 32 39.133 34.126 22.070 1.00 0.00 H new ATOM 0 HD21 LEU A 32 39.914 32.807 24.848 1.00 0.00 H new ATOM 0 HD22 LEU A 32 38.393 33.687 24.567 1.00 0.00 H new ATOM 0 HD23 LEU A 32 38.353 32.003 25.142 1.00 0.00 H new ATOM 535 N GLU A 33 36.154 29.888 20.698 1.00 0.00 N ATOM 536 CA GLU A 33 35.314 29.489 19.614 1.00 0.00 C ATOM 537 C GLU A 33 34.070 28.775 20.020 1.00 0.00 C ATOM 538 O GLU A 33 32.990 29.039 19.493 1.00 0.00 O ATOM 539 CB GLU A 33 36.086 28.648 18.583 1.00 0.00 C ATOM 540 CG GLU A 33 37.116 29.453 17.788 1.00 0.00 C ATOM 541 CD GLU A 33 36.520 30.244 16.632 1.00 0.00 C ATOM 542 OE1 GLU A 33 35.508 30.972 16.806 1.00 0.00 O ATOM 543 OE2 GLU A 33 37.079 30.154 15.506 1.00 0.00 O ATOM 0 H GLU A 33 37.125 29.599 20.578 1.00 0.00 H new ATOM 0 HA GLU A 33 34.993 30.427 19.160 1.00 0.00 H new ATOM 0 HB2 GLU A 33 36.593 27.832 19.098 1.00 0.00 H new ATOM 0 HB3 GLU A 33 35.376 28.196 17.890 1.00 0.00 H new ATOM 0 HG2 GLU A 33 37.624 30.142 18.463 1.00 0.00 H new ATOM 0 HG3 GLU A 33 37.873 28.772 17.398 1.00 0.00 H new ATOM 550 N ILE A 34 34.148 27.900 21.038 1.00 0.00 N ATOM 551 CA ILE A 34 33.042 27.266 21.685 1.00 0.00 C ATOM 552 C ILE A 34 32.182 28.253 22.398 1.00 0.00 C ATOM 553 O ILE A 34 30.969 28.288 22.201 1.00 0.00 O ATOM 554 CB ILE A 34 33.572 26.172 22.565 1.00 0.00 C ATOM 555 CG1 ILE A 34 34.148 25.027 21.717 1.00 0.00 C ATOM 556 CG2 ILE A 34 32.495 25.632 23.521 1.00 0.00 C ATOM 557 CD1 ILE A 34 35.163 24.173 22.475 1.00 0.00 C ATOM 0 H ILE A 34 35.044 27.617 21.435 1.00 0.00 H new ATOM 0 HA ILE A 34 32.380 26.812 20.948 1.00 0.00 H new ATOM 0 HB ILE A 34 34.369 26.603 23.171 1.00 0.00 H new ATOM 0 HG12 ILE A 34 33.332 24.391 21.373 1.00 0.00 H new ATOM 0 HG13 ILE A 34 34.624 25.444 20.829 1.00 0.00 H new ATOM 0 HG21 ILE A 34 32.921 24.842 24.140 1.00 0.00 H new ATOM 0 HG22 ILE A 34 32.137 26.440 24.159 1.00 0.00 H new ATOM 0 HG23 ILE A 34 31.663 25.231 22.942 1.00 0.00 H new ATOM 0 HD11 ILE A 34 35.533 23.382 21.822 1.00 0.00 H new ATOM 0 HD12 ILE A 34 35.997 24.798 22.796 1.00 0.00 H new ATOM 0 HD13 ILE A 34 34.685 23.729 23.348 1.00 0.00 H new ATOM 569 N LEU A 35 32.723 29.144 23.249 1.00 0.00 N ATOM 570 CA LEU A 35 31.941 30.135 23.921 1.00 0.00 C ATOM 571 C LEU A 35 31.358 31.174 23.027 1.00 0.00 C ATOM 572 O LEU A 35 30.387 31.850 23.364 1.00 0.00 O ATOM 573 CB LEU A 35 32.766 30.861 24.998 1.00 0.00 C ATOM 574 CG LEU A 35 33.664 29.982 25.887 1.00 0.00 C ATOM 575 CD1 LEU A 35 33.905 30.767 27.187 1.00 0.00 C ATOM 576 CD2 LEU A 35 33.076 28.655 26.395 1.00 0.00 C ATOM 0 H LEU A 35 33.717 29.177 23.474 1.00 0.00 H new ATOM 0 HA LEU A 35 31.120 29.569 24.361 1.00 0.00 H new ATOM 0 HB2 LEU A 35 33.396 31.601 24.504 1.00 0.00 H new ATOM 0 HB3 LEU A 35 32.078 31.408 25.643 1.00 0.00 H new ATOM 0 HG LEU A 35 34.520 29.751 25.254 1.00 0.00 H new ATOM 0 HD11 LEU A 35 34.540 30.182 27.853 1.00 0.00 H new ATOM 0 HD12 LEU A 35 34.396 31.712 26.956 1.00 0.00 H new ATOM 0 HD13 LEU A 35 32.951 30.964 27.675 1.00 0.00 H new ATOM 0 HD21 LEU A 35 33.816 28.140 27.008 1.00 0.00 H new ATOM 0 HD22 LEU A 35 32.187 28.856 26.992 1.00 0.00 H new ATOM 0 HD23 LEU A 35 32.808 28.027 25.545 1.00 0.00 H new ATOM 588 N HIS A 36 31.925 31.393 21.827 1.00 0.00 N ATOM 589 CA HIS A 36 31.399 32.249 20.809 1.00 0.00 C ATOM 590 C HIS A 36 30.157 31.713 20.183 1.00 0.00 C ATOM 591 O HIS A 36 29.278 32.488 19.812 1.00 0.00 O ATOM 592 CB HIS A 36 32.424 32.553 19.704 1.00 0.00 C ATOM 593 CG HIS A 36 33.356 33.669 20.076 1.00 0.00 C ATOM 594 ND1 HIS A 36 32.890 34.948 20.230 1.00 0.00 N ATOM 595 CD2 HIS A 36 34.694 33.706 20.315 1.00 0.00 C ATOM 596 CE1 HIS A 36 33.899 35.738 20.550 1.00 0.00 C ATOM 597 NE2 HIS A 36 34.996 35.008 20.615 1.00 0.00 N ATOM 0 H HIS A 36 32.800 30.947 21.552 1.00 0.00 H new ATOM 0 HA HIS A 36 31.154 33.175 21.329 1.00 0.00 H new ATOM 0 HB2 HIS A 36 33.004 31.654 19.494 1.00 0.00 H new ATOM 0 HB3 HIS A 36 31.897 32.814 18.786 1.00 0.00 H new ATOM 0 HD2 HIS A 36 35.382 32.874 20.276 1.00 0.00 H new ATOM 0 HE1 HIS A 36 33.837 36.801 20.728 1.00 0.00 H new ATOM 0 HE2 HIS A 36 35.924 35.358 20.852 1.00 0.00 H new ATOM 606 N THR A 37 30.009 30.378 20.117 1.00 0.00 N ATOM 607 CA THR A 37 28.801 29.693 19.774 1.00 0.00 C ATOM 608 C THR A 37 27.701 30.036 20.720 1.00 0.00 C ATOM 609 O THR A 37 26.555 30.239 20.324 1.00 0.00 O ATOM 610 CB THR A 37 29.034 28.223 19.591 1.00 0.00 C ATOM 611 OG1 THR A 37 28.977 27.885 18.213 1.00 0.00 O ATOM 612 CG2 THR A 37 28.036 27.289 20.295 1.00 0.00 C ATOM 0 H THR A 37 30.779 29.739 20.315 1.00 0.00 H new ATOM 0 HA THR A 37 28.462 30.044 18.800 1.00 0.00 H new ATOM 0 HB THR A 37 30.013 28.067 20.044 1.00 0.00 H new ATOM 0 HG1 THR A 37 29.132 26.923 18.105 1.00 0.00 H new ATOM 0 HG21 THR A 37 28.303 26.252 20.092 1.00 0.00 H new ATOM 0 HG22 THR A 37 28.066 27.468 21.370 1.00 0.00 H new ATOM 0 HG23 THR A 37 27.030 27.484 19.923 1.00 0.00 H new ATOM 620 N TYR A 38 28.021 30.217 22.014 1.00 0.00 N ATOM 621 CA TYR A 38 27.133 30.671 23.039 1.00 0.00 C ATOM 622 C TYR A 38 26.803 32.122 22.973 1.00 0.00 C ATOM 623 O TYR A 38 25.640 32.522 22.978 1.00 0.00 O ATOM 624 CB TYR A 38 27.803 30.319 24.378 1.00 0.00 C ATOM 625 CG TYR A 38 26.929 30.456 25.577 1.00 0.00 C ATOM 626 CD1 TYR A 38 26.095 29.429 25.951 1.00 0.00 C ATOM 627 CD2 TYR A 38 27.018 31.583 26.359 1.00 0.00 C ATOM 628 CE1 TYR A 38 25.331 29.543 27.088 1.00 0.00 C ATOM 629 CE2 TYR A 38 26.279 31.688 27.514 1.00 0.00 C ATOM 630 CZ TYR A 38 25.424 30.672 27.869 1.00 0.00 C ATOM 631 OH TYR A 38 24.628 30.780 29.029 1.00 0.00 O ATOM 0 H TYR A 38 28.961 30.034 22.366 1.00 0.00 H new ATOM 0 HA TYR A 38 26.169 30.177 22.913 1.00 0.00 H new ATOM 0 HB2 TYR A 38 28.165 29.292 24.327 1.00 0.00 H new ATOM 0 HB3 TYR A 38 28.676 30.958 24.509 1.00 0.00 H new ATOM 0 HD1 TYR A 38 26.040 28.532 25.351 1.00 0.00 H new ATOM 0 HD2 TYR A 38 27.672 32.391 26.065 1.00 0.00 H new ATOM 0 HE1 TYR A 38 24.658 28.746 27.368 1.00 0.00 H new ATOM 0 HE2 TYR A 38 26.370 32.564 28.139 1.00 0.00 H new ATOM 0 HH TYR A 38 24.810 31.635 29.472 1.00 0.00 H new ATOM 641 N GLN A 39 27.831 32.990 22.938 1.00 0.00 N ATOM 642 CA GLN A 39 27.740 34.416 22.982 1.00 0.00 C ATOM 643 C GLN A 39 27.141 35.074 21.788 1.00 0.00 C ATOM 644 O GLN A 39 26.724 36.231 21.844 1.00 0.00 O ATOM 645 CB GLN A 39 29.107 35.012 23.354 1.00 0.00 C ATOM 646 CG GLN A 39 29.073 36.075 24.454 1.00 0.00 C ATOM 647 CD GLN A 39 28.295 37.349 24.155 1.00 0.00 C ATOM 648 OE1 GLN A 39 27.101 37.448 24.432 1.00 0.00 O ATOM 649 NE2 GLN A 39 28.988 38.404 23.652 1.00 0.00 N ATOM 0 H GLN A 39 28.797 32.669 22.874 1.00 0.00 H new ATOM 0 HA GLN A 39 27.012 34.638 23.762 1.00 0.00 H new ATOM 0 HB2 GLN A 39 29.764 34.203 23.672 1.00 0.00 H new ATOM 0 HB3 GLN A 39 29.550 35.450 22.460 1.00 0.00 H new ATOM 0 HG2 GLN A 39 28.651 35.622 25.351 1.00 0.00 H new ATOM 0 HG3 GLN A 39 30.100 36.352 24.690 1.00 0.00 H new ATOM 0 HE21 GLN A 39 29.978 38.304 23.428 1.00 0.00 H new ATOM 0 HE22 GLN A 39 28.518 39.296 23.499 1.00 0.00 H new ATOM 898 N SER A 54 22.532 24.779 25.088 1.00 0.00 N ATOM 899 CA SER A 54 22.690 24.428 26.466 1.00 0.00 C ATOM 900 C SER A 54 23.977 24.969 26.989 1.00 0.00 C ATOM 901 O SER A 54 25.036 24.870 26.374 1.00 0.00 O ATOM 902 CB SER A 54 22.584 22.913 26.706 1.00 0.00 C ATOM 903 OG SER A 54 23.611 22.154 26.085 1.00 0.00 O ATOM 0 HA SER A 54 21.866 24.882 27.016 1.00 0.00 H new ATOM 0 HB2 SER A 54 22.606 22.724 27.779 1.00 0.00 H new ATOM 0 HB3 SER A 54 21.618 22.565 26.340 1.00 0.00 H new ATOM 0 HG SER A 54 23.480 21.203 26.282 1.00 0.00 H new ATOM 909 N GLU A 55 23.956 25.535 28.209 1.00 0.00 N ATOM 910 CA GLU A 55 25.125 25.918 28.938 1.00 0.00 C ATOM 911 C GLU A 55 25.975 24.741 29.273 1.00 0.00 C ATOM 912 O GLU A 55 27.196 24.801 29.402 1.00 0.00 O ATOM 913 CB GLU A 55 24.720 26.645 30.231 1.00 0.00 C ATOM 914 CG GLU A 55 23.988 25.772 31.251 1.00 0.00 C ATOM 915 CD GLU A 55 23.661 26.528 32.531 1.00 0.00 C ATOM 916 OE1 GLU A 55 22.815 27.460 32.480 1.00 0.00 O ATOM 917 OE2 GLU A 55 24.156 26.111 33.612 1.00 0.00 O ATOM 0 H GLU A 55 23.089 25.734 28.708 1.00 0.00 H new ATOM 0 HA GLU A 55 25.708 26.586 28.303 1.00 0.00 H new ATOM 0 HB2 GLU A 55 25.616 27.053 30.699 1.00 0.00 H new ATOM 0 HB3 GLU A 55 24.082 27.490 29.972 1.00 0.00 H new ATOM 0 HG2 GLU A 55 23.066 25.396 30.808 1.00 0.00 H new ATOM 0 HG3 GLU A 55 24.603 24.905 31.491 1.00 0.00 H new ATOM 924 N GLU A 56 25.319 23.568 29.343 1.00 0.00 N ATOM 925 CA GLU A 56 25.886 22.270 29.539 1.00 0.00 C ATOM 926 C GLU A 56 26.798 21.845 28.440 1.00 0.00 C ATOM 927 O GLU A 56 27.754 21.120 28.706 1.00 0.00 O ATOM 928 CB GLU A 56 24.725 21.273 29.691 1.00 0.00 C ATOM 929 CG GLU A 56 23.830 21.571 30.897 1.00 0.00 C ATOM 930 CD GLU A 56 22.611 20.662 30.930 1.00 0.00 C ATOM 931 OE1 GLU A 56 21.698 20.827 30.076 1.00 0.00 O ATOM 932 OE2 GLU A 56 22.547 19.784 31.830 1.00 0.00 O ATOM 0 H GLU A 56 24.304 23.527 29.254 1.00 0.00 H new ATOM 0 HA GLU A 56 26.508 22.300 30.434 1.00 0.00 H new ATOM 0 HB2 GLU A 56 24.120 21.289 28.785 1.00 0.00 H new ATOM 0 HB3 GLU A 56 25.130 20.265 29.787 1.00 0.00 H new ATOM 0 HG2 GLU A 56 24.403 21.445 31.816 1.00 0.00 H new ATOM 0 HG3 GLU A 56 23.507 22.612 30.863 1.00 0.00 H new ATOM 939 N GLU A 57 26.601 22.271 27.179 1.00 0.00 N ATOM 940 CA GLU A 57 27.409 21.780 26.106 1.00 0.00 C ATOM 941 C GLU A 57 28.667 22.578 26.064 1.00 0.00 C ATOM 942 O GLU A 57 29.763 22.070 25.832 1.00 0.00 O ATOM 943 CB GLU A 57 26.773 21.688 24.708 1.00 0.00 C ATOM 944 CG GLU A 57 27.122 22.804 23.722 1.00 0.00 C ATOM 945 CD GLU A 57 26.715 22.444 22.300 1.00 0.00 C ATOM 946 OE1 GLU A 57 25.498 22.348 21.989 1.00 0.00 O ATOM 947 OE2 GLU A 57 27.641 22.204 21.481 1.00 0.00 O ATOM 0 H GLU A 57 25.890 22.948 26.904 1.00 0.00 H new ATOM 0 HA GLU A 57 27.581 20.731 26.345 1.00 0.00 H new ATOM 0 HB2 GLU A 57 27.065 20.737 24.263 1.00 0.00 H new ATOM 0 HB3 GLU A 57 25.690 21.665 24.827 1.00 0.00 H new ATOM 0 HG2 GLU A 57 26.622 23.725 24.022 1.00 0.00 H new ATOM 0 HG3 GLU A 57 28.194 22.998 23.756 1.00 0.00 H new ATOM 954 N VAL A 58 28.540 23.894 26.310 1.00 0.00 N ATOM 955 CA VAL A 58 29.625 24.824 26.256 1.00 0.00 C ATOM 956 C VAL A 58 30.629 24.492 27.305 1.00 0.00 C ATOM 957 O VAL A 58 31.832 24.404 27.063 1.00 0.00 O ATOM 958 CB VAL A 58 29.040 26.206 26.228 1.00 0.00 C ATOM 959 CG1 VAL A 58 29.062 26.952 27.573 1.00 0.00 C ATOM 960 CG2 VAL A 58 29.825 27.093 25.246 1.00 0.00 C ATOM 0 H VAL A 58 27.649 24.326 26.555 1.00 0.00 H new ATOM 0 HA VAL A 58 30.222 24.764 25.346 1.00 0.00 H new ATOM 0 HB VAL A 58 28.001 26.046 25.939 1.00 0.00 H new ATOM 0 HG11 VAL A 58 28.618 27.940 27.449 1.00 0.00 H new ATOM 0 HG12 VAL A 58 28.492 26.388 28.311 1.00 0.00 H new ATOM 0 HG13 VAL A 58 30.092 27.058 27.914 1.00 0.00 H new ATOM 0 HG21 VAL A 58 29.392 28.093 25.233 1.00 0.00 H new ATOM 0 HG22 VAL A 58 30.867 27.152 25.562 1.00 0.00 H new ATOM 0 HG23 VAL A 58 29.773 26.663 24.246 1.00 0.00 H new ATOM 970 N PHE A 59 30.103 24.111 28.482 1.00 0.00 N ATOM 971 CA PHE A 59 30.753 23.378 29.524 1.00 0.00 C ATOM 972 C PHE A 59 31.375 22.089 29.109 1.00 0.00 C ATOM 973 O PHE A 59 32.577 21.900 29.288 1.00 0.00 O ATOM 974 CB PHE A 59 29.750 23.210 30.678 1.00 0.00 C ATOM 975 CG PHE A 59 30.195 22.389 31.840 1.00 0.00 C ATOM 976 CD1 PHE A 59 31.400 22.622 32.459 1.00 0.00 C ATOM 977 CD2 PHE A 59 29.391 21.373 32.300 1.00 0.00 C ATOM 978 CE1 PHE A 59 31.808 21.837 33.512 1.00 0.00 C ATOM 979 CE2 PHE A 59 29.787 20.591 33.360 1.00 0.00 C ATOM 980 CZ PHE A 59 31.000 20.821 33.965 1.00 0.00 C ATOM 0 H PHE A 59 29.138 24.336 28.724 1.00 0.00 H new ATOM 0 HA PHE A 59 31.618 23.958 29.846 1.00 0.00 H new ATOM 0 HB2 PHE A 59 29.484 24.202 31.044 1.00 0.00 H new ATOM 0 HB3 PHE A 59 28.840 22.764 30.276 1.00 0.00 H new ATOM 0 HD1 PHE A 59 32.032 23.428 32.116 1.00 0.00 H new ATOM 0 HD2 PHE A 59 28.439 21.187 31.824 1.00 0.00 H new ATOM 0 HE1 PHE A 59 32.763 22.019 33.983 1.00 0.00 H new ATOM 0 HE2 PHE A 59 29.146 19.798 33.716 1.00 0.00 H new ATOM 0 HZ PHE A 59 31.317 20.205 34.794 1.00 0.00 H new ATOM 990 N THR A 60 30.619 21.137 28.532 1.00 0.00 N ATOM 991 CA THR A 60 31.078 19.867 28.062 1.00 0.00 C ATOM 992 C THR A 60 32.239 19.923 27.129 1.00 0.00 C ATOM 993 O THR A 60 33.160 19.111 27.197 1.00 0.00 O ATOM 994 CB THR A 60 30.001 18.983 27.507 1.00 0.00 C ATOM 995 OG1 THR A 60 30.077 17.682 28.071 1.00 0.00 O ATOM 996 CG2 THR A 60 30.020 18.782 25.983 1.00 0.00 C ATOM 0 H THR A 60 29.618 21.265 28.384 1.00 0.00 H new ATOM 0 HA THR A 60 31.436 19.404 28.981 1.00 0.00 H new ATOM 0 HB THR A 60 29.087 19.516 27.768 1.00 0.00 H new ATOM 0 HG1 THR A 60 29.365 17.121 27.697 1.00 0.00 H new ATOM 0 HG21 THR A 60 29.199 18.127 25.692 1.00 0.00 H new ATOM 0 HG22 THR A 60 29.908 19.746 25.487 1.00 0.00 H new ATOM 0 HG23 THR A 60 30.967 18.330 25.687 1.00 0.00 H new ATOM 1004 N GLU A 61 32.233 20.917 26.223 1.00 0.00 N ATOM 1005 CA GLU A 61 33.265 21.168 25.265 1.00 0.00 C ATOM 1006 C GLU A 61 34.502 21.648 25.941 1.00 0.00 C ATOM 1007 O GLU A 61 35.521 20.964 25.849 1.00 0.00 O ATOM 1008 CB GLU A 61 32.757 22.072 24.128 1.00 0.00 C ATOM 1009 CG GLU A 61 31.678 21.467 23.229 1.00 0.00 C ATOM 1010 CD GLU A 61 32.105 20.169 22.558 1.00 0.00 C ATOM 1011 OE1 GLU A 61 33.273 20.048 22.099 1.00 0.00 O ATOM 1012 OE2 GLU A 61 31.271 19.228 22.471 1.00 0.00 O ATOM 0 H GLU A 61 31.464 21.583 26.156 1.00 0.00 H new ATOM 0 HA GLU A 61 33.546 20.235 24.776 1.00 0.00 H new ATOM 0 HB2 GLU A 61 32.365 22.990 24.566 1.00 0.00 H new ATOM 0 HB3 GLU A 61 33.606 22.353 23.506 1.00 0.00 H new ATOM 0 HG2 GLU A 61 30.783 21.282 23.823 1.00 0.00 H new ATOM 0 HG3 GLU A 61 31.407 22.192 22.461 1.00 0.00 H new ATOM 1019 N VAL A 62 34.472 22.734 26.735 1.00 0.00 N ATOM 1020 CA VAL A 62 35.565 23.288 27.470 1.00 0.00 C ATOM 1021 C VAL A 62 36.338 22.327 28.307 1.00 0.00 C ATOM 1022 O VAL A 62 37.555 22.411 28.464 1.00 0.00 O ATOM 1023 CB VAL A 62 35.054 24.407 28.330 1.00 0.00 C ATOM 1024 CG1 VAL A 62 36.132 24.989 29.259 1.00 0.00 C ATOM 1025 CG2 VAL A 62 34.600 25.519 27.369 1.00 0.00 C ATOM 0 H VAL A 62 33.612 23.266 26.872 1.00 0.00 H new ATOM 0 HA VAL A 62 36.275 23.635 26.719 1.00 0.00 H new ATOM 0 HB VAL A 62 34.255 24.026 28.966 1.00 0.00 H new ATOM 0 HG11 VAL A 62 35.702 25.794 29.855 1.00 0.00 H new ATOM 0 HG12 VAL A 62 36.504 24.206 29.920 1.00 0.00 H new ATOM 0 HG13 VAL A 62 36.955 25.380 28.661 1.00 0.00 H new ATOM 0 HG21 VAL A 62 34.217 26.362 27.943 1.00 0.00 H new ATOM 0 HG22 VAL A 62 35.446 25.846 26.765 1.00 0.00 H new ATOM 0 HG23 VAL A 62 33.814 25.138 26.717 1.00 0.00 H new ATOM 1035 N ALA A 63 35.650 21.298 28.832 1.00 0.00 N ATOM 1036 CA ALA A 63 36.232 20.236 29.593 1.00 0.00 C ATOM 1037 C ALA A 63 37.236 19.456 28.818 1.00 0.00 C ATOM 1038 O ALA A 63 38.295 19.089 29.325 1.00 0.00 O ATOM 1039 CB ALA A 63 35.137 19.265 30.067 1.00 0.00 C ATOM 0 H ALA A 63 34.641 21.202 28.721 1.00 0.00 H new ATOM 0 HA ALA A 63 36.737 20.704 30.438 1.00 0.00 H new ATOM 0 HB1 ALA A 63 35.590 18.460 30.645 1.00 0.00 H new ATOM 0 HB2 ALA A 63 34.421 19.801 30.690 1.00 0.00 H new ATOM 0 HB3 ALA A 63 34.623 18.846 29.202 1.00 0.00 H new ATOM 1045 N ASN A 64 36.951 19.195 27.529 1.00 0.00 N ATOM 1046 CA ASN A 64 37.784 18.355 26.725 1.00 0.00 C ATOM 1047 C ASN A 64 39.056 19.012 26.312 1.00 0.00 C ATOM 1048 O ASN A 64 40.075 18.353 26.107 1.00 0.00 O ATOM 1049 CB ASN A 64 37.048 17.682 25.554 1.00 0.00 C ATOM 1050 CG ASN A 64 36.841 18.515 24.296 1.00 0.00 C ATOM 1051 OD1 ASN A 64 37.774 18.843 23.566 1.00 0.00 O ATOM 1052 ND2 ASN A 64 35.560 18.844 23.976 1.00 0.00 N ATOM 0 H ASN A 64 36.137 19.569 27.041 1.00 0.00 H new ATOM 0 HA ASN A 64 38.071 17.537 27.385 1.00 0.00 H new ATOM 0 HB2 ASN A 64 37.601 16.784 25.278 1.00 0.00 H new ATOM 0 HB3 ASN A 64 36.070 17.358 25.910 1.00 0.00 H new ATOM 0 HD21 ASN A 64 35.366 19.368 23.123 1.00 0.00 H new ATOM 0 HD22 ASN A 64 34.794 18.566 24.589 1.00 0.00 H new ATOM 1059 N LEU A 65 39.048 20.351 26.195 1.00 0.00 N ATOM 1060 CA LEU A 65 40.189 21.175 25.937 1.00 0.00 C ATOM 1061 C LEU A 65 41.260 21.013 26.960 1.00 0.00 C ATOM 1062 O LEU A 65 42.452 20.953 26.661 1.00 0.00 O ATOM 1063 CB LEU A 65 39.840 22.672 25.987 1.00 0.00 C ATOM 1064 CG LEU A 65 39.028 23.250 24.816 1.00 0.00 C ATOM 1065 CD1 LEU A 65 39.783 23.361 23.481 1.00 0.00 C ATOM 1066 CD2 LEU A 65 37.662 22.561 24.663 1.00 0.00 C ATOM 0 H LEU A 65 38.189 20.893 26.287 1.00 0.00 H new ATOM 0 HA LEU A 65 40.524 20.858 24.950 1.00 0.00 H new ATOM 0 HB2 LEU A 65 39.284 22.857 26.906 1.00 0.00 H new ATOM 0 HB3 LEU A 65 40.772 23.233 26.060 1.00 0.00 H new ATOM 0 HG LEU A 65 38.848 24.287 25.100 1.00 0.00 H new ATOM 0 HD11 LEU A 65 39.121 23.780 22.723 1.00 0.00 H new ATOM 0 HD12 LEU A 65 40.649 24.011 23.606 1.00 0.00 H new ATOM 0 HD13 LEU A 65 40.114 22.371 23.167 1.00 0.00 H new ATOM 0 HD21 LEU A 65 37.124 23.002 23.824 1.00 0.00 H new ATOM 0 HD22 LEU A 65 37.810 21.497 24.480 1.00 0.00 H new ATOM 0 HD23 LEU A 65 37.082 22.695 25.576 1.00 0.00 H new ATOM 1078 N PHE A 66 40.818 21.010 28.230 1.00 0.00 N ATOM 1079 CA PHE A 66 41.606 21.288 29.391 1.00 0.00 C ATOM 1080 C PHE A 66 42.044 20.017 30.033 1.00 0.00 C ATOM 1081 O PHE A 66 43.162 19.903 30.533 1.00 0.00 O ATOM 1082 CB PHE A 66 40.812 22.089 30.435 1.00 0.00 C ATOM 1083 CG PHE A 66 40.402 23.471 30.056 1.00 0.00 C ATOM 1084 CD1 PHE A 66 40.753 24.096 28.882 1.00 0.00 C ATOM 1085 CD2 PHE A 66 39.632 24.171 30.955 1.00 0.00 C ATOM 1086 CE1 PHE A 66 40.318 25.367 28.588 1.00 0.00 C ATOM 1087 CE2 PHE A 66 39.220 25.457 30.696 1.00 0.00 C ATOM 1088 CZ PHE A 66 39.559 26.054 29.505 1.00 0.00 C ATOM 0 H PHE A 66 39.847 20.800 28.460 1.00 0.00 H new ATOM 0 HA PHE A 66 42.465 21.872 29.060 1.00 0.00 H new ATOM 0 HB2 PHE A 66 39.913 21.525 30.684 1.00 0.00 H new ATOM 0 HB3 PHE A 66 41.411 22.150 31.343 1.00 0.00 H new ATOM 0 HD1 PHE A 66 41.384 23.577 28.176 1.00 0.00 H new ATOM 0 HD2 PHE A 66 39.345 23.701 31.884 1.00 0.00 H new ATOM 0 HE1 PHE A 66 40.571 25.823 27.642 1.00 0.00 H new ATOM 0 HE2 PHE A 66 38.633 25.996 31.425 1.00 0.00 H new ATOM 0 HZ PHE A 66 39.230 27.060 29.291 1.00 0.00 H new ATOM 1098 N ARG A 67 41.128 19.032 30.015 1.00 0.00 N ATOM 1099 CA ARG A 67 41.237 17.653 30.378 1.00 0.00 C ATOM 1100 C ARG A 67 42.256 17.202 31.367 1.00 0.00 C ATOM 1101 O ARG A 67 43.427 16.948 31.087 1.00 0.00 O ATOM 1102 CB ARG A 67 41.185 16.805 29.096 1.00 0.00 C ATOM 1103 CG ARG A 67 42.375 16.981 28.150 1.00 0.00 C ATOM 1104 CD ARG A 67 42.514 15.862 27.117 1.00 0.00 C ATOM 1105 NE ARG A 67 43.770 16.121 26.359 1.00 0.00 N ATOM 1106 CZ ARG A 67 45.024 15.875 26.837 1.00 0.00 C ATOM 1107 NH1 ARG A 67 45.264 15.225 28.014 1.00 0.00 N ATOM 1108 NH2 ARG A 67 46.098 16.283 26.101 1.00 0.00 N ATOM 0 H ARG A 67 40.180 19.238 29.701 1.00 0.00 H new ATOM 0 HA ARG A 67 40.370 17.487 31.018 1.00 0.00 H new ATOM 0 HB2 ARG A 67 41.117 15.754 29.377 1.00 0.00 H new ATOM 0 HB3 ARG A 67 40.271 17.050 28.554 1.00 0.00 H new ATOM 0 HG2 ARG A 67 42.275 17.933 27.629 1.00 0.00 H new ATOM 0 HG3 ARG A 67 43.291 17.035 28.739 1.00 0.00 H new ATOM 0 HD2 ARG A 67 42.553 14.889 27.606 1.00 0.00 H new ATOM 0 HD3 ARG A 67 41.655 15.848 26.446 1.00 0.00 H new ATOM 0 HE ARG A 67 43.687 16.508 25.419 1.00 0.00 H new ATOM 0 HH11 ARG A 67 44.484 14.897 28.583 1.00 0.00 H new ATOM 0 HH12 ARG A 67 46.223 15.068 28.324 1.00 0.00 H new ATOM 0 HH21 ARG A 67 45.955 16.762 25.212 1.00 0.00 H new ATOM 0 HH22 ARG A 67 47.044 16.109 26.440 1.00 0.00 H new ATOM 1122 N GLY A 68 41.816 17.095 32.634 1.00 0.00 N ATOM 1123 CA GLY A 68 42.635 16.724 33.746 1.00 0.00 C ATOM 1124 C GLY A 68 42.644 17.833 34.742 1.00 0.00 C ATOM 1125 O GLY A 68 42.821 17.616 35.939 1.00 0.00 O ATOM 0 H GLY A 68 40.846 17.275 32.894 1.00 0.00 H new ATOM 0 HA2 GLY A 68 42.254 15.811 34.204 1.00 0.00 H new ATOM 0 HA3 GLY A 68 43.650 16.513 33.410 1.00 0.00 H new ATOM 1129 N GLN A 69 42.436 19.072 34.263 1.00 0.00 N ATOM 1130 CA GLN A 69 42.380 20.242 35.083 1.00 0.00 C ATOM 1131 C GLN A 69 40.984 20.504 35.536 1.00 0.00 C ATOM 1132 O GLN A 69 40.148 21.037 34.809 1.00 0.00 O ATOM 1133 CB GLN A 69 42.906 21.485 34.346 1.00 0.00 C ATOM 1134 CG GLN A 69 44.346 21.313 33.858 1.00 0.00 C ATOM 1135 CD GLN A 69 44.815 22.582 33.161 1.00 0.00 C ATOM 1136 OE1 GLN A 69 44.667 23.688 33.679 1.00 0.00 O ATOM 1137 NE2 GLN A 69 45.370 22.435 31.929 1.00 0.00 N ATOM 0 H GLN A 69 42.302 19.266 33.271 1.00 0.00 H new ATOM 0 HA GLN A 69 43.019 20.051 35.945 1.00 0.00 H new ATOM 0 HB2 GLN A 69 42.260 21.698 33.494 1.00 0.00 H new ATOM 0 HB3 GLN A 69 42.852 22.347 35.011 1.00 0.00 H new ATOM 0 HG2 GLN A 69 45.000 21.088 34.701 1.00 0.00 H new ATOM 0 HG3 GLN A 69 44.408 20.468 33.173 1.00 0.00 H new ATOM 0 HE21 GLN A 69 45.479 21.504 31.527 1.00 0.00 H new ATOM 0 HE22 GLN A 69 45.677 23.256 31.407 1.00 0.00 H new ATOM 1146 N GLU A 70 40.672 20.089 36.777 1.00 0.00 N ATOM 1147 CA GLU A 70 39.393 20.214 37.403 1.00 0.00 C ATOM 1148 C GLU A 70 39.145 21.562 37.990 1.00 0.00 C ATOM 1149 O GLU A 70 38.006 22.000 38.137 1.00 0.00 O ATOM 1150 CB GLU A 70 39.252 19.150 38.504 1.00 0.00 C ATOM 1151 CG GLU A 70 39.412 17.722 37.980 1.00 0.00 C ATOM 1152 CD GLU A 70 39.240 16.661 39.058 1.00 0.00 C ATOM 1153 OE1 GLU A 70 39.078 17.003 40.259 1.00 0.00 O ATOM 1154 OE2 GLU A 70 39.246 15.449 38.711 1.00 0.00 O ATOM 0 H GLU A 70 41.358 19.637 37.381 1.00 0.00 H new ATOM 0 HA GLU A 70 38.650 20.069 36.619 1.00 0.00 H new ATOM 0 HB2 GLU A 70 39.999 19.333 39.276 1.00 0.00 H new ATOM 0 HB3 GLU A 70 38.274 19.251 38.976 1.00 0.00 H new ATOM 0 HG2 GLU A 70 38.682 17.549 37.190 1.00 0.00 H new ATOM 0 HG3 GLU A 70 40.399 17.616 37.530 1.00 0.00 H new ATOM 1161 N ASP A 71 40.211 22.297 38.354 1.00 0.00 N ATOM 1162 CA ASP A 71 40.125 23.551 39.036 1.00 0.00 C ATOM 1163 C ASP A 71 39.607 24.643 38.164 1.00 0.00 C ATOM 1164 O ASP A 71 38.836 25.496 38.601 1.00 0.00 O ATOM 1165 CB ASP A 71 41.446 23.928 39.728 1.00 0.00 C ATOM 1166 CG ASP A 71 42.674 24.036 38.835 1.00 0.00 C ATOM 1167 OD1 ASP A 71 42.683 23.588 37.656 1.00 0.00 O ATOM 1168 OD2 ASP A 71 43.696 24.565 39.346 1.00 0.00 O ATOM 0 H ASP A 71 41.170 22.006 38.166 1.00 0.00 H new ATOM 0 HA ASP A 71 39.387 23.421 39.827 1.00 0.00 H new ATOM 0 HB2 ASP A 71 41.306 24.884 40.233 1.00 0.00 H new ATOM 0 HB3 ASP A 71 41.650 23.187 40.501 1.00 0.00 H new ATOM 1173 N LEU A 72 39.950 24.646 36.863 1.00 0.00 N ATOM 1174 CA LEU A 72 39.378 25.568 35.932 1.00 0.00 C ATOM 1175 C LEU A 72 37.910 25.398 35.739 1.00 0.00 C ATOM 1176 O LEU A 72 37.178 26.386 35.703 1.00 0.00 O ATOM 1177 CB LEU A 72 40.109 25.541 34.580 1.00 0.00 C ATOM 1178 CG LEU A 72 41.624 25.805 34.629 1.00 0.00 C ATOM 1179 CD1 LEU A 72 42.149 25.742 33.184 1.00 0.00 C ATOM 1180 CD2 LEU A 72 42.067 27.156 35.216 1.00 0.00 C ATOM 0 H LEU A 72 40.629 24.004 36.454 1.00 0.00 H new ATOM 0 HA LEU A 72 39.516 26.550 36.384 1.00 0.00 H new ATOM 0 HB2 LEU A 72 39.944 24.567 34.119 1.00 0.00 H new ATOM 0 HB3 LEU A 72 39.651 26.284 33.927 1.00 0.00 H new ATOM 0 HG LEU A 72 42.029 25.047 35.300 1.00 0.00 H new ATOM 0 HD11 LEU A 72 43.224 25.925 33.179 1.00 0.00 H new ATOM 0 HD12 LEU A 72 41.947 24.756 32.766 1.00 0.00 H new ATOM 0 HD13 LEU A 72 41.649 26.501 32.582 1.00 0.00 H new ATOM 0 HD21 LEU A 72 43.155 27.222 35.196 1.00 0.00 H new ATOM 0 HD22 LEU A 72 41.643 27.967 34.624 1.00 0.00 H new ATOM 0 HD23 LEU A 72 41.718 27.238 36.245 1.00 0.00 H new ATOM 1192 N LEU A 73 37.360 24.174 35.650 1.00 0.00 N ATOM 1193 CA LEU A 73 35.959 23.954 35.468 1.00 0.00 C ATOM 1194 C LEU A 73 35.149 24.224 36.689 1.00 0.00 C ATOM 1195 O LEU A 73 33.958 24.529 36.649 1.00 0.00 O ATOM 1196 CB LEU A 73 35.620 22.521 35.025 1.00 0.00 C ATOM 1197 CG LEU A 73 35.924 22.192 33.554 1.00 0.00 C ATOM 1198 CD1 LEU A 73 35.350 23.225 32.570 1.00 0.00 C ATOM 1199 CD2 LEU A 73 37.434 21.975 33.353 1.00 0.00 C ATOM 0 H LEU A 73 37.905 23.313 35.706 1.00 0.00 H new ATOM 0 HA LEU A 73 35.702 24.665 34.683 1.00 0.00 H new ATOM 0 HB2 LEU A 73 36.172 21.824 35.656 1.00 0.00 H new ATOM 0 HB3 LEU A 73 34.560 22.345 35.207 1.00 0.00 H new ATOM 0 HG LEU A 73 35.410 21.259 33.321 1.00 0.00 H new ATOM 0 HD11 LEU A 73 35.600 22.934 31.550 1.00 0.00 H new ATOM 0 HD12 LEU A 73 34.266 23.269 32.680 1.00 0.00 H new ATOM 0 HD13 LEU A 73 35.776 24.206 32.782 1.00 0.00 H new ATOM 0 HD21 LEU A 73 37.632 21.743 32.307 1.00 0.00 H new ATOM 0 HD22 LEU A 73 37.972 22.881 33.632 1.00 0.00 H new ATOM 0 HD23 LEU A 73 37.769 21.147 33.978 1.00 0.00 H new ATOM 1211 N SER A 74 35.810 24.155 37.859 1.00 0.00 N ATOM 1212 CA SER A 74 35.247 24.488 39.131 1.00 0.00 C ATOM 1213 C SER A 74 34.956 25.946 39.225 1.00 0.00 C ATOM 1214 O SER A 74 33.872 26.374 39.623 1.00 0.00 O ATOM 1215 CB SER A 74 36.137 24.067 40.312 1.00 0.00 C ATOM 1216 OG SER A 74 36.296 22.657 40.334 1.00 0.00 O ATOM 0 H SER A 74 36.782 23.853 37.921 1.00 0.00 H new ATOM 0 HA SER A 74 34.317 23.923 39.201 1.00 0.00 H new ATOM 0 HB2 SER A 74 37.112 24.548 40.230 1.00 0.00 H new ATOM 0 HB3 SER A 74 35.693 24.404 41.249 1.00 0.00 H new ATOM 0 HG SER A 74 36.877 22.382 39.594 1.00 0.00 H new ATOM 1222 N GLU A 75 35.906 26.789 38.781 1.00 0.00 N ATOM 1223 CA GLU A 75 35.767 28.209 38.690 1.00 0.00 C ATOM 1224 C GLU A 75 34.974 28.670 37.515 1.00 0.00 C ATOM 1225 O GLU A 75 34.449 29.781 37.515 1.00 0.00 O ATOM 1226 CB GLU A 75 37.129 28.906 38.838 1.00 0.00 C ATOM 1227 CG GLU A 75 37.804 28.452 40.135 1.00 0.00 C ATOM 1228 CD GLU A 75 38.951 29.331 40.613 1.00 0.00 C ATOM 1229 OE1 GLU A 75 39.794 29.757 39.779 1.00 0.00 O ATOM 1230 OE2 GLU A 75 39.052 29.534 41.851 1.00 0.00 O ATOM 0 H GLU A 75 36.820 26.461 38.469 1.00 0.00 H new ATOM 0 HA GLU A 75 35.158 28.520 39.538 1.00 0.00 H new ATOM 0 HB2 GLU A 75 37.764 28.669 37.984 1.00 0.00 H new ATOM 0 HB3 GLU A 75 36.996 29.988 38.846 1.00 0.00 H new ATOM 0 HG2 GLU A 75 37.050 28.407 40.921 1.00 0.00 H new ATOM 0 HG3 GLU A 75 38.179 27.438 39.995 1.00 0.00 H new ATOM 1237 N PHE A 76 34.785 27.823 36.487 1.00 0.00 N ATOM 1238 CA PHE A 76 33.876 28.022 35.401 1.00 0.00 C ATOM 1239 C PHE A 76 32.450 28.056 35.831 1.00 0.00 C ATOM 1240 O PHE A 76 31.577 28.605 35.161 1.00 0.00 O ATOM 1241 CB PHE A 76 34.085 26.899 34.371 1.00 0.00 C ATOM 1242 CG PHE A 76 33.600 27.161 32.987 1.00 0.00 C ATOM 1243 CD1 PHE A 76 34.257 28.056 32.176 1.00 0.00 C ATOM 1244 CD2 PHE A 76 32.576 26.410 32.460 1.00 0.00 C ATOM 1245 CE1 PHE A 76 33.921 28.177 30.848 1.00 0.00 C ATOM 1246 CE2 PHE A 76 32.221 26.541 31.139 1.00 0.00 C ATOM 1247 CZ PHE A 76 32.900 27.418 30.326 1.00 0.00 C ATOM 0 H PHE A 76 35.299 26.945 36.410 1.00 0.00 H new ATOM 0 HA PHE A 76 34.090 28.998 34.965 1.00 0.00 H new ATOM 0 HB2 PHE A 76 35.151 26.677 34.322 1.00 0.00 H new ATOM 0 HB3 PHE A 76 33.589 26.002 34.741 1.00 0.00 H new ATOM 0 HD1 PHE A 76 35.045 28.670 32.586 1.00 0.00 H new ATOM 0 HD2 PHE A 76 32.046 25.711 33.090 1.00 0.00 H new ATOM 0 HE1 PHE A 76 34.459 28.868 30.215 1.00 0.00 H new ATOM 0 HE2 PHE A 76 31.407 25.954 30.739 1.00 0.00 H new ATOM 0 HZ PHE A 76 32.633 27.510 29.284 1.00 0.00 H new ATOM 1257 N GLY A 77 32.176 27.500 37.025 1.00 0.00 N ATOM 1258 CA GLY A 77 30.963 27.480 37.782 1.00 0.00 C ATOM 1259 C GLY A 77 30.496 28.793 38.308 1.00 0.00 C ATOM 1260 O GLY A 77 29.354 28.883 38.757 1.00 0.00 O ATOM 0 H GLY A 77 32.910 26.997 37.523 1.00 0.00 H new ATOM 0 HA2 GLY A 77 30.175 27.062 37.156 1.00 0.00 H new ATOM 0 HA3 GLY A 77 31.096 26.801 38.624 1.00 0.00 H new ATOM 1264 N GLN A 78 31.352 29.830 38.337 1.00 0.00 N ATOM 1265 CA GLN A 78 31.154 31.132 38.895 1.00 0.00 C ATOM 1266 C GLN A 78 29.818 31.738 38.629 1.00 0.00 C ATOM 1267 O GLN A 78 29.145 32.231 39.532 1.00 0.00 O ATOM 1268 CB GLN A 78 32.285 32.063 38.427 1.00 0.00 C ATOM 1269 CG GLN A 78 32.418 32.233 36.913 1.00 0.00 C ATOM 1270 CD GLN A 78 33.623 33.040 36.454 1.00 0.00 C ATOM 1271 OE1 GLN A 78 33.489 34.022 35.725 1.00 0.00 O ATOM 1272 NE2 GLN A 78 34.846 32.578 36.827 1.00 0.00 N ATOM 0 H GLN A 78 32.281 29.744 37.925 1.00 0.00 H new ATOM 0 HA GLN A 78 31.182 31.006 39.977 1.00 0.00 H new ATOM 0 HB2 GLN A 78 32.130 33.046 38.873 1.00 0.00 H new ATOM 0 HB3 GLN A 78 33.229 31.682 38.816 1.00 0.00 H new ATOM 0 HG2 GLN A 78 32.467 31.245 36.456 1.00 0.00 H new ATOM 0 HG3 GLN A 78 31.515 32.713 36.537 1.00 0.00 H new ATOM 0 HE21 GLN A 78 34.919 31.761 37.433 1.00 0.00 H new ATOM 0 HE22 GLN A 78 35.690 33.049 36.501 1.00 0.00 H new ATOM 1466 N ASN B 201 28.480 36.118 33.679 1.00 0.00 N ATOM 1467 CA ASN B 201 27.876 35.298 32.674 1.00 0.00 C ATOM 1468 C ASN B 201 29.043 34.622 32.041 1.00 0.00 C ATOM 1469 O ASN B 201 30.181 34.879 32.429 1.00 0.00 O ATOM 1470 CB ASN B 201 27.058 36.128 31.670 1.00 0.00 C ATOM 1471 CG ASN B 201 26.121 35.283 30.818 1.00 0.00 C ATOM 1472 OD1 ASN B 201 26.510 34.807 29.753 1.00 0.00 O ATOM 1473 ND2 ASN B 201 24.864 35.080 31.294 1.00 0.00 N ATOM 0 HA ASN B 201 27.152 34.590 33.077 1.00 0.00 H new ATOM 0 HB2 ASN B 201 26.474 36.871 32.213 1.00 0.00 H new ATOM 0 HB3 ASN B 201 27.740 36.673 31.018 1.00 0.00 H new ATOM 0 HD21 ASN B 201 24.203 34.514 30.762 1.00 0.00 H new ATOM 0 HD22 ASN B 201 24.582 35.494 32.183 1.00 0.00 H new ATOM 1480 N ILE B 202 28.852 33.775 31.014 1.00 0.00 N ATOM 1481 CA ILE B 202 29.909 33.299 30.177 1.00 0.00 C ATOM 1482 C ILE B 202 30.330 34.355 29.215 1.00 0.00 C ATOM 1483 O ILE B 202 31.470 34.375 28.754 1.00 0.00 O ATOM 1484 CB ILE B 202 29.613 31.957 29.575 1.00 0.00 C ATOM 1485 CG1 ILE B 202 30.233 30.899 30.504 1.00 0.00 C ATOM 1486 CG2 ILE B 202 30.077 31.811 28.116 1.00 0.00 C ATOM 1487 CD1 ILE B 202 30.161 29.448 30.029 1.00 0.00 C ATOM 0 H ILE B 202 27.934 33.410 30.758 1.00 0.00 H new ATOM 0 HA ILE B 202 30.785 33.101 30.795 1.00 0.00 H new ATOM 0 HB ILE B 202 28.533 31.823 29.507 1.00 0.00 H new ATOM 0 HG12 ILE B 202 31.281 31.155 30.661 1.00 0.00 H new ATOM 0 HG13 ILE B 202 29.740 30.965 31.474 1.00 0.00 H new ATOM 0 HG21 ILE B 202 29.827 30.814 27.753 1.00 0.00 H new ATOM 0 HG22 ILE B 202 29.577 32.558 27.499 1.00 0.00 H new ATOM 0 HG23 ILE B 202 31.156 31.958 28.061 1.00 0.00 H new ATOM 0 HD11 ILE B 202 30.631 28.799 30.768 1.00 0.00 H new ATOM 0 HD12 ILE B 202 29.118 29.158 29.902 1.00 0.00 H new ATOM 0 HD13 ILE B 202 30.683 29.350 29.077 1.00 0.00 H new ATOM 1499 N GLN B 203 29.461 35.337 28.914 1.00 0.00 N ATOM 1500 CA GLN B 203 29.731 36.440 28.045 1.00 0.00 C ATOM 1501 C GLN B 203 30.959 37.234 28.329 1.00 0.00 C ATOM 1502 O GLN B 203 31.649 37.682 27.414 1.00 0.00 O ATOM 1503 CB GLN B 203 28.496 37.347 27.898 1.00 0.00 C ATOM 1504 CG GLN B 203 28.327 38.482 28.910 1.00 0.00 C ATOM 1505 CD GLN B 203 26.897 39.002 28.912 1.00 0.00 C ATOM 1506 OE1 GLN B 203 25.948 38.277 29.205 1.00 0.00 O ATOM 1507 NE2 GLN B 203 26.714 40.306 28.568 1.00 0.00 N ATOM 0 H GLN B 203 28.517 35.362 29.299 1.00 0.00 H new ATOM 0 HA GLN B 203 29.957 35.964 27.091 1.00 0.00 H new ATOM 0 HB2 GLN B 203 28.519 37.786 26.901 1.00 0.00 H new ATOM 0 HB3 GLN B 203 27.608 36.717 27.949 1.00 0.00 H new ATOM 0 HG2 GLN B 203 28.590 38.128 29.907 1.00 0.00 H new ATOM 0 HG3 GLN B 203 29.013 39.294 28.669 1.00 0.00 H new ATOM 0 HE21 GLN B 203 27.517 40.888 28.329 1.00 0.00 H new ATOM 0 HE22 GLN B 203 25.774 40.701 28.549 1.00 0.00 H new ATOM 1516 N MET B 204 31.329 37.363 29.615 1.00 0.00 N ATOM 1517 CA MET B 204 32.556 37.933 30.078 1.00 0.00 C ATOM 1518 C MET B 204 33.789 37.300 29.534 1.00 0.00 C ATOM 1519 O MET B 204 34.816 37.960 29.378 1.00 0.00 O ATOM 1520 CB MET B 204 32.654 37.843 31.611 1.00 0.00 C ATOM 1521 CG MET B 204 31.761 38.824 32.373 1.00 0.00 C ATOM 1522 SD MET B 204 32.042 38.722 34.166 1.00 0.00 S ATOM 1523 CE MET B 204 31.617 40.444 34.552 1.00 0.00 C ATOM 0 H MET B 204 30.732 37.049 30.380 1.00 0.00 H new ATOM 0 HA MET B 204 32.517 38.962 29.720 1.00 0.00 H new ATOM 0 HB2 MET B 204 32.399 36.829 31.918 1.00 0.00 H new ATOM 0 HB3 MET B 204 33.690 38.014 31.905 1.00 0.00 H new ATOM 0 HG2 MET B 204 31.958 39.840 32.030 1.00 0.00 H new ATOM 0 HG3 MET B 204 30.715 38.611 32.155 1.00 0.00 H new ATOM 0 HE1 MET B 204 31.721 40.613 35.624 1.00 0.00 H new ATOM 0 HE2 MET B 204 32.287 41.114 34.012 1.00 0.00 H new ATOM 0 HE3 MET B 204 30.588 40.641 34.252 1.00 0.00 H new ATOM 1533 N LEU B 205 33.775 35.993 29.217 1.00 0.00 N ATOM 1534 CA LEU B 205 34.952 35.256 28.877 1.00 0.00 C ATOM 1535 C LEU B 205 35.560 35.590 27.558 1.00 0.00 C ATOM 1536 O LEU B 205 36.771 35.493 27.368 1.00 0.00 O ATOM 1537 CB LEU B 205 34.721 33.738 28.962 1.00 0.00 C ATOM 1538 CG LEU B 205 34.476 33.206 30.384 1.00 0.00 C ATOM 1539 CD1 LEU B 205 34.081 31.720 30.349 1.00 0.00 C ATOM 1540 CD2 LEU B 205 35.718 33.418 31.267 1.00 0.00 C ATOM 0 H LEU B 205 32.922 35.434 29.197 1.00 0.00 H new ATOM 0 HA LEU B 205 35.673 35.571 29.631 1.00 0.00 H new ATOM 0 HB2 LEU B 205 33.865 33.479 28.339 1.00 0.00 H new ATOM 0 HB3 LEU B 205 35.588 33.228 28.542 1.00 0.00 H new ATOM 0 HG LEU B 205 33.649 33.768 30.819 1.00 0.00 H new ATOM 0 HD11 LEU B 205 33.912 31.364 31.365 1.00 0.00 H new ATOM 0 HD12 LEU B 205 33.168 31.600 29.766 1.00 0.00 H new ATOM 0 HD13 LEU B 205 34.883 31.141 29.890 1.00 0.00 H new ATOM 0 HD21 LEU B 205 35.522 33.034 32.268 1.00 0.00 H new ATOM 0 HD22 LEU B 205 36.567 32.888 30.835 1.00 0.00 H new ATOM 0 HD23 LEU B 205 35.946 34.482 31.324 1.00 0.00 H new ATOM 1552 N LEU B 206 34.722 36.054 26.613 1.00 0.00 N ATOM 1553 CA LEU B 206 35.110 36.488 25.306 1.00 0.00 C ATOM 1554 C LEU B 206 35.667 37.868 25.373 1.00 0.00 C ATOM 1555 O LEU B 206 36.546 38.255 24.605 1.00 0.00 O ATOM 1556 CB LEU B 206 33.840 36.425 24.442 1.00 0.00 C ATOM 1557 CG LEU B 206 33.222 35.023 24.310 1.00 0.00 C ATOM 1558 CD1 LEU B 206 34.293 33.996 23.902 1.00 0.00 C ATOM 1559 CD2 LEU B 206 32.399 34.510 25.504 1.00 0.00 C ATOM 0 H LEU B 206 33.717 36.130 26.770 1.00 0.00 H new ATOM 0 HA LEU B 206 35.891 35.860 24.878 1.00 0.00 H new ATOM 0 HB2 LEU B 206 33.094 37.097 24.866 1.00 0.00 H new ATOM 0 HB3 LEU B 206 34.076 36.799 23.446 1.00 0.00 H new ATOM 0 HG LEU B 206 32.479 35.141 23.522 1.00 0.00 H new ATOM 0 HD11 LEU B 206 33.837 33.010 23.814 1.00 0.00 H new ATOM 0 HD12 LEU B 206 34.726 34.283 22.944 1.00 0.00 H new ATOM 0 HD13 LEU B 206 35.076 33.967 24.659 1.00 0.00 H new ATOM 0 HD21 LEU B 206 32.020 33.512 25.283 1.00 0.00 H new ATOM 0 HD22 LEU B 206 33.031 34.470 26.391 1.00 0.00 H new ATOM 0 HD23 LEU B 206 31.562 35.184 25.685 1.00 0.00 H new ATOM 1571 N GLU B 207 35.202 38.644 26.370 1.00 0.00 N ATOM 1572 CA GLU B 207 35.569 40.012 26.566 1.00 0.00 C ATOM 1573 C GLU B 207 36.875 40.112 27.274 1.00 0.00 C ATOM 1574 O GLU B 207 37.764 40.869 26.887 1.00 0.00 O ATOM 1575 CB GLU B 207 34.478 40.756 27.355 1.00 0.00 C ATOM 1576 CG GLU B 207 33.141 40.836 26.617 1.00 0.00 C ATOM 1577 CD GLU B 207 33.147 41.873 25.503 1.00 0.00 C ATOM 1578 OE1 GLU B 207 32.788 43.048 25.784 1.00 0.00 O ATOM 1579 OE2 GLU B 207 33.440 41.515 24.332 1.00 0.00 O ATOM 0 H GLU B 207 34.542 38.302 27.069 1.00 0.00 H new ATOM 0 HA GLU B 207 35.671 40.479 25.586 1.00 0.00 H new ATOM 0 HB2 GLU B 207 34.327 40.256 28.312 1.00 0.00 H new ATOM 0 HB3 GLU B 207 34.824 41.766 27.575 1.00 0.00 H new ATOM 0 HG2 GLU B 207 32.903 39.859 26.197 1.00 0.00 H new ATOM 0 HG3 GLU B 207 32.352 41.078 27.329 1.00 0.00 H new ATOM 1586 N ALA B 208 37.041 39.309 28.341 1.00 0.00 N ATOM 1587 CA ALA B 208 38.235 39.168 29.114 1.00 0.00 C ATOM 1588 C ALA B 208 39.385 38.634 28.331 1.00 0.00 C ATOM 1589 O ALA B 208 40.517 39.086 28.495 1.00 0.00 O ATOM 1590 CB ALA B 208 37.944 38.268 30.327 1.00 0.00 C ATOM 0 H ALA B 208 36.286 38.717 28.686 1.00 0.00 H new ATOM 0 HA ALA B 208 38.533 40.164 29.441 1.00 0.00 H new ATOM 0 HB1 ALA B 208 38.850 38.155 30.922 1.00 0.00 H new ATOM 0 HB2 ALA B 208 37.163 38.721 30.937 1.00 0.00 H new ATOM 0 HB3 ALA B 208 37.612 37.289 29.982 1.00 0.00 H new ATOM 1596 N ALA B 209 39.141 37.687 27.407 1.00 0.00 N ATOM 1597 CA ALA B 209 40.133 37.163 26.519 1.00 0.00 C ATOM 1598 C ALA B 209 40.704 38.171 25.583 1.00 0.00 C ATOM 1599 O ALA B 209 41.919 38.255 25.411 1.00 0.00 O ATOM 1600 CB ALA B 209 39.540 36.002 25.704 1.00 0.00 C ATOM 0 H ALA B 209 38.219 37.271 27.273 1.00 0.00 H new ATOM 0 HA ALA B 209 40.952 36.824 27.153 1.00 0.00 H new ATOM 0 HB1 ALA B 209 40.299 35.606 25.029 1.00 0.00 H new ATOM 0 HB2 ALA B 209 39.210 35.214 26.381 1.00 0.00 H new ATOM 0 HB3 ALA B 209 38.690 36.362 25.123 1.00 0.00 H new ATOM 1606 N ASP B 210 39.837 38.998 24.970 1.00 0.00 N ATOM 1607 CA ASP B 210 40.179 40.042 24.054 1.00 0.00 C ATOM 1608 C ASP B 210 40.987 41.112 24.704 1.00 0.00 C ATOM 1609 O ASP B 210 42.048 41.509 24.224 1.00 0.00 O ATOM 1610 CB ASP B 210 38.839 40.554 23.500 1.00 0.00 C ATOM 1611 CG ASP B 210 38.983 41.349 22.209 1.00 0.00 C ATOM 1612 OD1 ASP B 210 39.437 42.523 22.257 1.00 0.00 O ATOM 1613 OD2 ASP B 210 38.627 40.806 21.130 1.00 0.00 O ATOM 0 H ASP B 210 38.831 38.932 25.125 1.00 0.00 H new ATOM 0 HA ASP B 210 40.818 39.681 23.248 1.00 0.00 H new ATOM 0 HB2 ASP B 210 38.179 39.705 23.323 1.00 0.00 H new ATOM 0 HB3 ASP B 210 38.359 41.180 24.252 1.00 0.00 H new ATOM 1618 N TYR B 211 40.529 41.566 25.885 1.00 0.00 N ATOM 1619 CA TYR B 211 41.165 42.468 26.794 1.00 0.00 C ATOM 1620 C TYR B 211 42.546 42.063 27.181 1.00 0.00 C ATOM 1621 O TYR B 211 43.495 42.841 27.091 1.00 0.00 O ATOM 1622 CB TYR B 211 40.206 42.555 27.994 1.00 0.00 C ATOM 1623 CG TYR B 211 40.644 43.314 29.198 1.00 0.00 C ATOM 1624 CD1 TYR B 211 41.337 42.657 30.188 1.00 0.00 C ATOM 1625 CD2 TYR B 211 40.232 44.608 29.410 1.00 0.00 C ATOM 1626 CE1 TYR B 211 41.607 43.278 31.385 1.00 0.00 C ATOM 1627 CE2 TYR B 211 40.480 45.231 30.611 1.00 0.00 C ATOM 1628 CZ TYR B 211 41.158 44.560 31.601 1.00 0.00 C ATOM 1629 OH TYR B 211 41.370 45.178 32.852 1.00 0.00 O ATOM 0 H TYR B 211 39.619 41.268 26.236 1.00 0.00 H new ATOM 0 HA TYR B 211 41.328 43.441 26.330 1.00 0.00 H new ATOM 0 HB2 TYR B 211 39.274 42.999 27.643 1.00 0.00 H new ATOM 0 HB3 TYR B 211 39.975 41.537 28.309 1.00 0.00 H new ATOM 0 HD1 TYR B 211 41.672 41.644 30.024 1.00 0.00 H new ATOM 0 HD2 TYR B 211 39.710 45.139 28.628 1.00 0.00 H new ATOM 0 HE1 TYR B 211 42.168 42.762 32.150 1.00 0.00 H new ATOM 0 HE2 TYR B 211 40.143 46.244 30.776 1.00 0.00 H new ATOM 0 HH TYR B 211 40.993 46.082 32.838 1.00 0.00 H new ATOM 1639 N LEU B 212 42.750 40.807 27.616 1.00 0.00 N ATOM 1640 CA LEU B 212 44.027 40.329 28.050 1.00 0.00 C ATOM 1641 C LEU B 212 45.038 40.155 26.969 1.00 0.00 C ATOM 1642 O LEU B 212 46.238 40.240 27.223 1.00 0.00 O ATOM 1643 CB LEU B 212 43.851 39.019 28.836 1.00 0.00 C ATOM 1644 CG LEU B 212 43.775 39.205 30.362 1.00 0.00 C ATOM 1645 CD1 LEU B 212 43.224 37.892 30.946 1.00 0.00 C ATOM 1646 CD2 LEU B 212 45.129 39.568 30.993 1.00 0.00 C ATOM 0 H LEU B 212 42.010 40.107 27.668 1.00 0.00 H new ATOM 0 HA LEU B 212 44.433 41.113 28.689 1.00 0.00 H new ATOM 0 HB2 LEU B 212 42.942 38.523 28.496 1.00 0.00 H new ATOM 0 HB3 LEU B 212 44.683 38.354 28.603 1.00 0.00 H new ATOM 0 HG LEU B 212 43.122 40.047 30.592 1.00 0.00 H new ATOM 0 HD11 LEU B 212 43.153 37.978 32.030 1.00 0.00 H new ATOM 0 HD12 LEU B 212 42.235 37.696 30.532 1.00 0.00 H new ATOM 0 HD13 LEU B 212 43.894 37.071 30.690 1.00 0.00 H new ATOM 0 HD21 LEU B 212 45.009 39.686 32.070 1.00 0.00 H new ATOM 0 HD22 LEU B 212 45.848 38.774 30.793 1.00 0.00 H new ATOM 0 HD23 LEU B 212 45.491 40.502 30.564 1.00 0.00 H new ATOM 1658 N GLU B 213 44.604 39.937 25.715 1.00 0.00 N ATOM 1659 CA GLU B 213 45.440 39.950 24.556 1.00 0.00 C ATOM 1660 C GLU B 213 45.908 41.310 24.167 1.00 0.00 C ATOM 1661 O GLU B 213 46.971 41.464 23.569 1.00 0.00 O ATOM 1662 CB GLU B 213 44.730 39.294 23.358 1.00 0.00 C ATOM 1663 CG GLU B 213 44.612 37.774 23.479 1.00 0.00 C ATOM 1664 CD GLU B 213 45.926 37.050 23.223 1.00 0.00 C ATOM 1665 OE1 GLU B 213 46.252 36.794 22.033 1.00 0.00 O ATOM 1666 OE2 GLU B 213 46.636 36.692 24.201 1.00 0.00 O ATOM 0 H GLU B 213 43.626 39.743 25.500 1.00 0.00 H new ATOM 0 HA GLU B 213 46.323 39.374 24.831 1.00 0.00 H new ATOM 0 HB2 GLU B 213 43.732 39.721 23.258 1.00 0.00 H new ATOM 0 HB3 GLU B 213 45.274 39.537 22.445 1.00 0.00 H new ATOM 0 HG2 GLU B 213 44.254 37.522 24.477 1.00 0.00 H new ATOM 0 HG3 GLU B 213 43.863 37.416 22.772 1.00 0.00 H new ATOM 1673 N ARG B 214 45.162 42.371 24.523 1.00 0.00 N ATOM 1674 CA ARG B 214 45.599 43.727 24.402 1.00 0.00 C ATOM 1675 C ARG B 214 46.597 44.101 25.444 1.00 0.00 C ATOM 1676 O ARG B 214 47.570 44.799 25.163 1.00 0.00 O ATOM 1677 CB ARG B 214 44.439 44.736 24.429 1.00 0.00 C ATOM 1678 CG ARG B 214 43.620 44.703 23.137 1.00 0.00 C ATOM 1679 CD ARG B 214 42.602 45.841 23.050 1.00 0.00 C ATOM 1680 NE ARG B 214 42.084 45.892 21.653 1.00 0.00 N ATOM 1681 CZ ARG B 214 41.195 46.833 21.221 1.00 0.00 C ATOM 1682 NH1 ARG B 214 40.607 47.714 22.083 1.00 0.00 N ATOM 1683 NH2 ARG B 214 40.921 46.913 19.887 1.00 0.00 N ATOM 0 H ARG B 214 44.222 42.282 24.908 1.00 0.00 H new ATOM 0 HA ARG B 214 46.076 43.777 23.423 1.00 0.00 H new ATOM 0 HB2 ARG B 214 43.789 44.518 25.276 1.00 0.00 H new ATOM 0 HB3 ARG B 214 44.835 45.740 24.581 1.00 0.00 H new ATOM 0 HG2 ARG B 214 44.295 44.760 22.283 1.00 0.00 H new ATOM 0 HG3 ARG B 214 43.098 43.749 23.068 1.00 0.00 H new ATOM 0 HD2 ARG B 214 41.786 45.676 23.753 1.00 0.00 H new ATOM 0 HD3 ARG B 214 43.067 46.789 23.319 1.00 0.00 H new ATOM 0 HE ARG B 214 42.410 45.190 20.988 1.00 0.00 H new ATOM 0 HH11 ARG B 214 40.829 47.679 23.078 1.00 0.00 H new ATOM 0 HH12 ARG B 214 39.946 48.407 21.732 1.00 0.00 H new ATOM 0 HH21 ARG B 214 41.378 46.277 19.234 1.00 0.00 H new ATOM 0 HH22 ARG B 214 40.260 47.609 19.543 1.00 0.00 H new ATOM 1697 N ARG B 215 46.437 43.591 26.678 1.00 0.00 N ATOM 1698 CA ARG B 215 47.386 43.748 27.738 1.00 0.00 C ATOM 1699 C ARG B 215 48.760 43.256 27.440 1.00 0.00 C ATOM 1700 O ARG B 215 49.728 43.780 27.988 1.00 0.00 O ATOM 1701 CB ARG B 215 46.900 43.142 29.065 1.00 0.00 C ATOM 1702 CG ARG B 215 45.816 43.986 29.738 1.00 0.00 C ATOM 1703 CD ARG B 215 45.653 43.670 31.226 1.00 0.00 C ATOM 1704 NE ARG B 215 44.776 44.725 31.808 1.00 0.00 N ATOM 1705 CZ ARG B 215 44.834 45.113 33.115 1.00 0.00 C ATOM 1706 NH1 ARG B 215 45.553 44.442 34.061 1.00 0.00 N ATOM 1707 NH2 ARG B 215 44.156 46.224 33.524 1.00 0.00 N ATOM 0 H ARG B 215 45.616 43.049 26.949 1.00 0.00 H new ATOM 0 HA ARG B 215 47.460 44.831 27.839 1.00 0.00 H new ATOM 0 HB2 ARG B 215 46.513 42.140 28.882 1.00 0.00 H new ATOM 0 HB3 ARG B 215 47.747 43.037 29.743 1.00 0.00 H new ATOM 0 HG2 ARG B 215 46.060 45.042 29.621 1.00 0.00 H new ATOM 0 HG3 ARG B 215 44.866 43.820 29.230 1.00 0.00 H new ATOM 0 HD2 ARG B 215 45.211 42.683 31.363 1.00 0.00 H new ATOM 0 HD3 ARG B 215 46.622 43.657 31.725 1.00 0.00 H new ATOM 0 HE ARG B 215 44.097 45.181 31.198 1.00 0.00 H new ATOM 0 HH11 ARG B 215 46.081 43.608 33.804 1.00 0.00 H new ATOM 0 HH12 ARG B 215 45.563 44.775 35.025 1.00 0.00 H new ATOM 0 HH21 ARG B 215 43.607 46.762 32.853 1.00 0.00 H new ATOM 0 HH22 ARG B 215 44.198 46.516 34.500 1.00 0.00 H new