USER MOD reduce.3.24.130724 H: found=0, std=0, add=607, rem=0, adj=15 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 Set 1.1: A 38 TYR OH : rot 179:sc= 1.46 USER MOD Set 1.2: B 201 ASN : amide:sc= -0.238 K(o=1.2,f=-2.4!) USER MOD Set 2.1: A 12 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 16 LYS NZ :NH3+ -166:sc= 2.42 (180deg=2.26) USER MOD Set 3.1: A 15 ASN : amide:sc= 1.07 K(o=2.3,f=-9.7!) USER MOD Set 3.2: A 18 LYS NZ :NH3+ -128:sc= 1.19 (180deg=0) USER MOD Single : A 8 ASN : amide:sc= 0 K(o=0,f=-0.55) USER MOD Single : A 9 ASN : amide:sc= 0.865 K(o=0.86,f=0) USER MOD Single : A 13 TYR OH : rot 68:sc= 0.865 USER MOD Single : A 19 THR OG1 : rot 88:sc= 0.0111 USER MOD Single : A 24 HIS : no HD1:sc= 0 X(o=0,f=-0.06) USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 36 HIS :FLIP no HD1:sc= -0.533 F(o=-1.7,f=-0.53) USER MOD Single : A 37 THR OG1 : rot 180:sc= 0 USER MOD Single : A 39 GLN : amide:sc= 0 X(o=0,f=-0.00097) USER MOD Single : A 54 SER OG : rot 33:sc= 0.0162 USER MOD Single : A 60 THR OG1 : rot 180:sc= 0 USER MOD Single : A 64 ASN : amide:sc= -0.0077 X(o=-0.0077,f=-0.022) USER MOD Single : A 69 GLN : amide:sc= 1.36 K(o=1.4,f=0) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 78 GLN : amide:sc= 0 X(o=0,f=-0.053) USER MOD Single : B 203 GLN : amide:sc= -0.0109 X(o=-0.011,f=-0.28) USER MOD Single : B 204 MET CE :methyl -146:sc=-6.16e-05 (180deg=-0.696) USER MOD Single : B 211 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 52 N VAL A 5 34.612 44.417 39.183 1.00 0.00 N ATOM 53 CA VAL A 5 35.011 43.481 40.188 1.00 0.00 C ATOM 54 C VAL A 5 34.977 42.089 39.656 1.00 0.00 C ATOM 55 O VAL A 5 35.972 41.368 39.603 1.00 0.00 O ATOM 56 CB VAL A 5 34.118 43.581 41.389 1.00 0.00 C ATOM 57 CG1 VAL A 5 34.612 42.620 42.484 1.00 0.00 C ATOM 58 CG2 VAL A 5 34.108 45.033 41.895 1.00 0.00 C ATOM 0 HA VAL A 5 36.032 43.723 40.483 1.00 0.00 H new ATOM 0 HB VAL A 5 33.100 43.298 41.120 1.00 0.00 H new ATOM 0 HG11 VAL A 5 33.961 42.695 43.355 1.00 0.00 H new ATOM 0 HG12 VAL A 5 34.595 41.598 42.106 1.00 0.00 H new ATOM 0 HG13 VAL A 5 35.630 42.885 42.768 1.00 0.00 H new ATOM 0 HG21 VAL A 5 33.460 45.110 42.768 1.00 0.00 H new ATOM 0 HG22 VAL A 5 35.121 45.330 42.168 1.00 0.00 H new ATOM 0 HG23 VAL A 5 33.736 45.690 41.109 1.00 0.00 H new ATOM 68 N GLU A 6 33.780 41.630 39.248 1.00 0.00 N ATOM 69 CA GLU A 6 33.587 40.281 38.817 1.00 0.00 C ATOM 70 C GLU A 6 34.069 40.048 37.426 1.00 0.00 C ATOM 71 O GLU A 6 34.442 38.940 37.046 1.00 0.00 O ATOM 72 CB GLU A 6 32.120 39.864 39.023 1.00 0.00 C ATOM 73 CG GLU A 6 31.162 40.431 37.974 1.00 0.00 C ATOM 74 CD GLU A 6 29.754 40.603 38.522 1.00 0.00 C ATOM 75 OE1 GLU A 6 29.109 39.608 38.947 1.00 0.00 O ATOM 76 OE2 GLU A 6 29.280 41.771 38.557 1.00 0.00 O ATOM 0 H GLU A 6 32.936 42.202 39.217 1.00 0.00 H new ATOM 0 HA GLU A 6 34.206 39.635 39.440 1.00 0.00 H new ATOM 0 HB2 GLU A 6 32.056 38.776 39.009 1.00 0.00 H new ATOM 0 HB3 GLU A 6 31.795 40.189 40.011 1.00 0.00 H new ATOM 0 HG2 GLU A 6 31.535 41.394 37.625 1.00 0.00 H new ATOM 0 HG3 GLU A 6 31.136 39.767 37.110 1.00 0.00 H new ATOM 83 N PHE A 7 34.213 41.142 36.657 1.00 0.00 N ATOM 84 CA PHE A 7 35.004 41.169 35.466 1.00 0.00 C ATOM 85 C PHE A 7 36.421 40.781 35.712 1.00 0.00 C ATOM 86 O PHE A 7 36.964 39.952 34.983 1.00 0.00 O ATOM 87 CB PHE A 7 34.982 42.555 34.801 1.00 0.00 C ATOM 88 CG PHE A 7 34.322 42.544 33.465 1.00 0.00 C ATOM 89 CD1 PHE A 7 34.657 41.604 32.520 1.00 0.00 C ATOM 90 CD2 PHE A 7 33.390 43.505 33.152 1.00 0.00 C ATOM 91 CE1 PHE A 7 34.028 41.587 31.297 1.00 0.00 C ATOM 92 CE2 PHE A 7 32.775 43.508 31.923 1.00 0.00 C ATOM 93 CZ PHE A 7 33.085 42.542 30.995 1.00 0.00 C ATOM 0 H PHE A 7 33.766 42.034 36.870 1.00 0.00 H new ATOM 0 HA PHE A 7 34.551 40.435 34.799 1.00 0.00 H new ATOM 0 HB2 PHE A 7 34.462 43.257 35.452 1.00 0.00 H new ATOM 0 HB3 PHE A 7 36.004 42.918 34.693 1.00 0.00 H new ATOM 0 HD1 PHE A 7 35.421 40.873 32.740 1.00 0.00 H new ATOM 0 HD2 PHE A 7 33.139 44.264 33.878 1.00 0.00 H new ATOM 0 HE1 PHE A 7 34.274 40.824 30.574 1.00 0.00 H new ATOM 0 HE2 PHE A 7 32.047 44.270 31.686 1.00 0.00 H new ATOM 0 HZ PHE A 7 32.591 42.533 30.035 1.00 0.00 H new ATOM 103 N ASN A 8 37.055 41.288 36.785 1.00 0.00 N ATOM 104 CA ASN A 8 38.415 41.042 37.153 1.00 0.00 C ATOM 105 C ASN A 8 38.584 39.646 37.645 1.00 0.00 C ATOM 106 O ASN A 8 39.659 39.054 37.557 1.00 0.00 O ATOM 107 CB ASN A 8 38.827 42.090 38.200 1.00 0.00 C ATOM 108 CG ASN A 8 40.320 42.103 38.492 1.00 0.00 C ATOM 109 OD1 ASN A 8 41.158 41.845 37.629 1.00 0.00 O ATOM 110 ND2 ASN A 8 40.679 42.421 39.766 1.00 0.00 N ATOM 0 H ASN A 8 36.584 41.913 37.440 1.00 0.00 H new ATOM 0 HA ASN A 8 39.069 41.138 36.287 1.00 0.00 H new ATOM 0 HB2 ASN A 8 38.524 43.078 37.852 1.00 0.00 H new ATOM 0 HB3 ASN A 8 38.285 41.899 39.126 1.00 0.00 H new ATOM 0 HD21 ASN A 8 41.665 42.450 40.026 1.00 0.00 H new ATOM 0 HD22 ASN A 8 39.962 42.630 40.461 1.00 0.00 H new ATOM 117 N ASN A 9 37.497 39.013 38.119 1.00 0.00 N ATOM 118 CA ASN A 9 37.479 37.627 38.474 1.00 0.00 C ATOM 119 C ASN A 9 37.416 36.759 37.265 1.00 0.00 C ATOM 120 O ASN A 9 37.918 35.635 37.265 1.00 0.00 O ATOM 121 CB ASN A 9 36.331 37.309 39.447 1.00 0.00 C ATOM 122 CG ASN A 9 36.689 37.759 40.856 1.00 0.00 C ATOM 123 OD1 ASN A 9 37.118 36.945 41.671 1.00 0.00 O ATOM 124 ND2 ASN A 9 36.538 39.066 41.204 1.00 0.00 N ATOM 0 H ASN A 9 36.601 39.480 38.260 1.00 0.00 H new ATOM 0 HA ASN A 9 38.415 37.411 38.989 1.00 0.00 H new ATOM 0 HB2 ASN A 9 35.419 37.809 39.119 1.00 0.00 H new ATOM 0 HB3 ASN A 9 36.127 36.238 39.441 1.00 0.00 H new ATOM 0 HD21 ASN A 9 36.781 39.375 42.145 1.00 0.00 H new ATOM 0 HD22 ASN A 9 36.182 39.737 40.524 1.00 0.00 H new ATOM 131 N ALA A 10 36.858 37.251 36.145 1.00 0.00 N ATOM 132 CA ALA A 10 36.973 36.625 34.865 1.00 0.00 C ATOM 133 C ALA A 10 38.342 36.759 34.291 1.00 0.00 C ATOM 134 O ALA A 10 38.893 35.789 33.775 1.00 0.00 O ATOM 135 CB ALA A 10 35.874 37.135 33.917 1.00 0.00 C ATOM 0 H ALA A 10 36.310 38.111 36.130 1.00 0.00 H new ATOM 0 HA ALA A 10 36.819 35.554 34.997 1.00 0.00 H new ATOM 0 HB1 ALA A 10 35.976 36.649 32.947 1.00 0.00 H new ATOM 0 HB2 ALA A 10 34.895 36.905 34.337 1.00 0.00 H new ATOM 0 HB3 ALA A 10 35.971 38.214 33.794 1.00 0.00 H new ATOM 141 N ILE A 11 39.000 37.924 34.421 1.00 0.00 N ATOM 142 CA ILE A 11 40.356 38.144 34.026 1.00 0.00 C ATOM 143 C ILE A 11 41.309 37.212 34.689 1.00 0.00 C ATOM 144 O ILE A 11 42.150 36.589 34.041 1.00 0.00 O ATOM 145 CB ILE A 11 40.836 39.538 34.304 1.00 0.00 C ATOM 146 CG1 ILE A 11 39.889 40.647 33.818 1.00 0.00 C ATOM 147 CG2 ILE A 11 42.193 39.799 33.628 1.00 0.00 C ATOM 148 CD1 ILE A 11 39.391 40.508 32.380 1.00 0.00 C ATOM 0 H ILE A 11 38.564 38.754 34.822 1.00 0.00 H new ATOM 0 HA ILE A 11 40.342 37.967 32.951 1.00 0.00 H new ATOM 0 HB ILE A 11 40.898 39.582 35.391 1.00 0.00 H new ATOM 0 HG12 ILE A 11 39.025 40.678 34.481 1.00 0.00 H new ATOM 0 HG13 ILE A 11 40.400 41.605 33.915 1.00 0.00 H new ATOM 0 HG21 ILE A 11 42.518 40.816 33.845 1.00 0.00 H new ATOM 0 HG22 ILE A 11 42.931 39.093 34.009 1.00 0.00 H new ATOM 0 HG23 ILE A 11 42.093 39.673 32.550 1.00 0.00 H new ATOM 0 HD11 ILE A 11 38.731 41.342 32.141 1.00 0.00 H new ATOM 0 HD12 ILE A 11 40.242 40.512 31.698 1.00 0.00 H new ATOM 0 HD13 ILE A 11 38.845 39.571 32.273 1.00 0.00 H new ATOM 160 N SER A 12 41.147 37.041 36.014 1.00 0.00 N ATOM 161 CA SER A 12 41.829 36.103 36.851 1.00 0.00 C ATOM 162 C SER A 12 41.779 34.704 36.339 1.00 0.00 C ATOM 163 O SER A 12 42.730 33.931 36.439 1.00 0.00 O ATOM 164 CB SER A 12 41.244 36.102 38.273 1.00 0.00 C ATOM 165 OG SER A 12 41.901 35.211 39.163 1.00 0.00 O ATOM 0 H SER A 12 40.483 37.607 36.542 1.00 0.00 H new ATOM 0 HA SER A 12 42.868 36.433 36.856 1.00 0.00 H new ATOM 0 HB2 SER A 12 41.299 37.112 38.679 1.00 0.00 H new ATOM 0 HB3 SER A 12 40.188 35.836 38.221 1.00 0.00 H new ATOM 0 HG SER A 12 41.480 35.262 40.047 1.00 0.00 H new ATOM 171 N TYR A 13 40.636 34.318 35.744 1.00 0.00 N ATOM 172 CA TYR A 13 40.436 33.028 35.163 1.00 0.00 C ATOM 173 C TYR A 13 41.163 32.886 33.869 1.00 0.00 C ATOM 174 O TYR A 13 41.991 31.988 33.726 1.00 0.00 O ATOM 175 CB TYR A 13 38.926 32.762 35.041 1.00 0.00 C ATOM 176 CG TYR A 13 38.569 31.356 34.698 1.00 0.00 C ATOM 177 CD1 TYR A 13 39.325 30.270 35.071 1.00 0.00 C ATOM 178 CD2 TYR A 13 37.424 31.158 33.964 1.00 0.00 C ATOM 179 CE1 TYR A 13 38.973 29.006 34.661 1.00 0.00 C ATOM 180 CE2 TYR A 13 37.072 29.900 33.533 1.00 0.00 C ATOM 181 CZ TYR A 13 37.862 28.826 33.870 1.00 0.00 C ATOM 182 OH TYR A 13 37.565 27.523 33.419 1.00 0.00 O ATOM 0 H TYR A 13 39.822 34.927 35.665 1.00 0.00 H new ATOM 0 HA TYR A 13 40.862 32.264 35.814 1.00 0.00 H new ATOM 0 HB2 TYR A 13 38.447 33.025 35.984 1.00 0.00 H new ATOM 0 HB3 TYR A 13 38.514 33.424 34.279 1.00 0.00 H new ATOM 0 HD1 TYR A 13 40.199 30.411 35.689 1.00 0.00 H new ATOM 0 HD2 TYR A 13 36.793 32.000 33.723 1.00 0.00 H new ATOM 0 HE1 TYR A 13 39.568 28.155 34.959 1.00 0.00 H new ATOM 0 HE2 TYR A 13 36.184 29.757 32.936 1.00 0.00 H new ATOM 0 HH TYR A 13 37.303 26.965 34.181 1.00 0.00 H new ATOM 192 N VAL A 14 40.940 33.785 32.894 1.00 0.00 N ATOM 193 CA VAL A 14 41.578 33.813 31.613 1.00 0.00 C ATOM 194 C VAL A 14 43.066 33.855 31.692 1.00 0.00 C ATOM 195 O VAL A 14 43.774 33.125 31.001 1.00 0.00 O ATOM 196 CB VAL A 14 41.133 34.992 30.801 1.00 0.00 C ATOM 197 CG1 VAL A 14 41.705 34.939 29.374 1.00 0.00 C ATOM 198 CG2 VAL A 14 39.602 34.931 30.655 1.00 0.00 C ATOM 0 H VAL A 14 40.268 34.544 33.009 1.00 0.00 H new ATOM 0 HA VAL A 14 41.278 32.880 31.136 1.00 0.00 H new ATOM 0 HB VAL A 14 41.475 35.895 31.306 1.00 0.00 H new ATOM 0 HG11 VAL A 14 41.363 35.808 28.812 1.00 0.00 H new ATOM 0 HG12 VAL A 14 42.794 34.941 29.418 1.00 0.00 H new ATOM 0 HG13 VAL A 14 41.364 34.030 28.879 1.00 0.00 H new ATOM 0 HG21 VAL A 14 39.258 35.782 30.066 1.00 0.00 H new ATOM 0 HG22 VAL A 14 39.321 34.005 30.153 1.00 0.00 H new ATOM 0 HG23 VAL A 14 39.141 34.963 31.642 1.00 0.00 H new ATOM 208 N ASN A 15 43.615 34.704 32.579 1.00 0.00 N ATOM 209 CA ASN A 15 45.027 34.773 32.795 1.00 0.00 C ATOM 210 C ASN A 15 45.655 33.519 33.301 1.00 0.00 C ATOM 211 O ASN A 15 46.730 33.137 32.843 1.00 0.00 O ATOM 212 CB ASN A 15 45.376 35.958 33.711 1.00 0.00 C ATOM 213 CG ASN A 15 46.713 36.560 33.303 1.00 0.00 C ATOM 214 OD1 ASN A 15 46.929 36.853 32.128 1.00 0.00 O ATOM 215 ND2 ASN A 15 47.644 36.757 34.274 1.00 0.00 N ATOM 0 H ASN A 15 43.073 35.350 33.153 1.00 0.00 H new ATOM 0 HA ASN A 15 45.456 34.923 31.804 1.00 0.00 H new ATOM 0 HB2 ASN A 15 44.594 36.715 33.652 1.00 0.00 H new ATOM 0 HB3 ASN A 15 45.420 35.625 34.748 1.00 0.00 H new ATOM 0 HD21 ASN A 15 48.551 37.158 34.037 1.00 0.00 H new ATOM 0 HD22 ASN A 15 47.435 36.504 35.240 1.00 0.00 H new ATOM 222 N LYS A 16 45.014 32.780 34.224 1.00 0.00 N ATOM 223 CA LYS A 16 45.467 31.492 34.648 1.00 0.00 C ATOM 224 C LYS A 16 45.423 30.464 33.570 1.00 0.00 C ATOM 225 O LYS A 16 46.316 29.626 33.455 1.00 0.00 O ATOM 226 CB LYS A 16 44.643 30.941 35.825 1.00 0.00 C ATOM 227 CG LYS A 16 44.998 31.561 37.178 1.00 0.00 C ATOM 228 CD LYS A 16 44.360 30.793 38.338 1.00 0.00 C ATOM 229 CE LYS A 16 42.832 30.842 38.411 1.00 0.00 C ATOM 230 NZ LYS A 16 42.346 32.216 38.670 1.00 0.00 N ATOM 0 H LYS A 16 44.158 33.086 34.687 1.00 0.00 H new ATOM 0 HA LYS A 16 46.501 31.664 34.947 1.00 0.00 H new ATOM 0 HB2 LYS A 16 43.585 31.111 35.625 1.00 0.00 H new ATOM 0 HB3 LYS A 16 44.787 29.862 35.882 1.00 0.00 H new ATOM 0 HG2 LYS A 16 46.081 31.571 37.301 1.00 0.00 H new ATOM 0 HG3 LYS A 16 44.665 32.599 37.201 1.00 0.00 H new ATOM 0 HD2 LYS A 16 44.668 29.750 38.271 1.00 0.00 H new ATOM 0 HD3 LYS A 16 44.762 31.185 39.272 1.00 0.00 H new ATOM 0 HE2 LYS A 16 42.410 30.476 37.475 1.00 0.00 H new ATOM 0 HE3 LYS A 16 42.483 30.176 39.200 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 41.344 32.183 38.948 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 42.904 32.643 39.437 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 42.448 32.789 37.808 1.00 0.00 H new ATOM 244 N ILE A 17 44.390 30.504 32.710 1.00 0.00 N ATOM 245 CA ILE A 17 44.220 29.668 31.562 1.00 0.00 C ATOM 246 C ILE A 17 45.327 29.903 30.592 1.00 0.00 C ATOM 247 O ILE A 17 45.990 28.969 30.146 1.00 0.00 O ATOM 248 CB ILE A 17 42.865 29.928 30.974 1.00 0.00 C ATOM 249 CG1 ILE A 17 41.762 29.318 31.855 1.00 0.00 C ATOM 250 CG2 ILE A 17 42.729 29.393 29.538 1.00 0.00 C ATOM 251 CD1 ILE A 17 40.361 29.786 31.462 1.00 0.00 C ATOM 0 H ILE A 17 43.622 31.165 32.825 1.00 0.00 H new ATOM 0 HA ILE A 17 44.268 28.615 31.838 1.00 0.00 H new ATOM 0 HB ILE A 17 42.750 31.011 30.937 1.00 0.00 H new ATOM 0 HG12 ILE A 17 41.809 28.231 31.787 1.00 0.00 H new ATOM 0 HG13 ILE A 17 41.949 29.581 32.896 1.00 0.00 H new ATOM 0 HG21 ILE A 17 41.729 29.609 29.163 1.00 0.00 H new ATOM 0 HG22 ILE A 17 43.468 29.875 28.899 1.00 0.00 H new ATOM 0 HG23 ILE A 17 42.893 28.315 29.534 1.00 0.00 H new ATOM 0 HD11 ILE A 17 39.625 29.322 32.119 1.00 0.00 H new ATOM 0 HD12 ILE A 17 40.300 30.870 31.556 1.00 0.00 H new ATOM 0 HD13 ILE A 17 40.158 29.500 30.430 1.00 0.00 H new ATOM 263 N LYS A 18 45.618 31.177 30.269 1.00 0.00 N ATOM 264 CA LYS A 18 46.659 31.571 29.372 1.00 0.00 C ATOM 265 C LYS A 18 48.026 31.196 29.831 1.00 0.00 C ATOM 266 O LYS A 18 48.851 30.763 29.027 1.00 0.00 O ATOM 267 CB LYS A 18 46.518 33.051 28.976 1.00 0.00 C ATOM 268 CG LYS A 18 47.534 34.074 29.485 1.00 0.00 C ATOM 269 CD LYS A 18 47.224 35.445 28.878 1.00 0.00 C ATOM 270 CE LYS A 18 48.379 36.447 28.830 1.00 0.00 C ATOM 271 NZ LYS A 18 48.736 36.937 30.180 1.00 0.00 N ATOM 0 H LYS A 18 45.102 31.969 30.652 1.00 0.00 H new ATOM 0 HA LYS A 18 46.528 30.987 28.461 1.00 0.00 H new ATOM 0 HB2 LYS A 18 46.527 33.098 27.887 1.00 0.00 H new ATOM 0 HB3 LYS A 18 45.532 33.382 29.302 1.00 0.00 H new ATOM 0 HG2 LYS A 18 47.497 34.129 30.573 1.00 0.00 H new ATOM 0 HG3 LYS A 18 48.544 33.765 29.216 1.00 0.00 H new ATOM 0 HD2 LYS A 18 46.861 35.294 27.861 1.00 0.00 H new ATOM 0 HD3 LYS A 18 46.408 35.892 29.445 1.00 0.00 H new ATOM 0 HE2 LYS A 18 49.249 35.977 28.372 1.00 0.00 H new ATOM 0 HE3 LYS A 18 48.102 37.291 28.198 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 48.747 37.977 30.180 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 48.035 36.598 30.869 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 49.678 36.581 30.441 1.00 0.00 H new ATOM 285 N THR A 19 48.303 31.300 31.143 1.00 0.00 N ATOM 286 CA THR A 19 49.516 30.875 31.770 1.00 0.00 C ATOM 287 C THR A 19 49.683 29.397 31.858 1.00 0.00 C ATOM 288 O THR A 19 50.791 28.895 31.673 1.00 0.00 O ATOM 289 CB THR A 19 49.641 31.489 33.133 1.00 0.00 C ATOM 290 OG1 THR A 19 49.902 32.882 33.042 1.00 0.00 O ATOM 291 CG2 THR A 19 50.809 30.933 33.964 1.00 0.00 C ATOM 0 H THR A 19 47.641 31.705 31.805 1.00 0.00 H new ATOM 0 HA THR A 19 50.318 31.226 31.120 1.00 0.00 H new ATOM 0 HB THR A 19 48.689 31.257 33.611 1.00 0.00 H new ATOM 0 HG1 THR A 19 49.054 33.371 32.988 1.00 0.00 H new ATOM 0 HG21 THR A 19 50.832 31.427 34.935 1.00 0.00 H new ATOM 0 HG22 THR A 19 50.677 29.860 34.105 1.00 0.00 H new ATOM 0 HG23 THR A 19 51.748 31.117 33.441 1.00 0.00 H new ATOM 299 N ARG A 20 48.649 28.581 32.132 1.00 0.00 N ATOM 300 CA ARG A 20 48.812 27.161 32.093 1.00 0.00 C ATOM 301 C ARG A 20 48.955 26.611 30.715 1.00 0.00 C ATOM 302 O ARG A 20 49.790 25.745 30.461 1.00 0.00 O ATOM 303 CB ARG A 20 47.688 26.435 32.851 1.00 0.00 C ATOM 304 CG ARG A 20 47.845 26.570 34.368 1.00 0.00 C ATOM 305 CD ARG A 20 46.887 25.679 35.160 1.00 0.00 C ATOM 306 NE ARG A 20 47.300 25.711 36.593 1.00 0.00 N ATOM 307 CZ ARG A 20 48.404 25.072 37.077 1.00 0.00 C ATOM 308 NH1 ARG A 20 49.035 24.077 36.387 1.00 0.00 N ATOM 309 NH2 ARG A 20 48.861 25.412 38.317 1.00 0.00 N ATOM 0 H ARG A 20 47.712 28.899 32.378 1.00 0.00 H new ATOM 0 HA ARG A 20 49.756 26.969 32.603 1.00 0.00 H new ATOM 0 HB2 ARG A 20 46.723 26.842 32.548 1.00 0.00 H new ATOM 0 HB3 ARG A 20 47.688 25.380 32.578 1.00 0.00 H new ATOM 0 HG2 ARG A 20 48.870 26.323 34.643 1.00 0.00 H new ATOM 0 HG3 ARG A 20 47.681 27.610 34.652 1.00 0.00 H new ATOM 0 HD2 ARG A 20 45.862 26.032 35.052 1.00 0.00 H new ATOM 0 HD3 ARG A 20 46.914 24.658 34.779 1.00 0.00 H new ATOM 0 HE ARG A 20 46.725 26.240 37.248 1.00 0.00 H new ATOM 0 HH11 ARG A 20 48.683 23.787 35.475 1.00 0.00 H new ATOM 0 HH12 ARG A 20 49.858 23.624 36.784 1.00 0.00 H new ATOM 0 HH21 ARG A 20 48.379 26.129 38.859 1.00 0.00 H new ATOM 0 HH22 ARG A 20 49.684 24.949 38.702 1.00 0.00 H new ATOM 323 N PHE A 21 48.181 27.124 29.743 1.00 0.00 N ATOM 324 CA PHE A 21 48.273 26.706 28.379 1.00 0.00 C ATOM 325 C PHE A 21 49.306 27.434 27.587 1.00 0.00 C ATOM 326 O PHE A 21 49.087 27.819 26.439 1.00 0.00 O ATOM 327 CB PHE A 21 46.912 26.808 27.671 1.00 0.00 C ATOM 328 CG PHE A 21 45.893 25.920 28.298 1.00 0.00 C ATOM 329 CD1 PHE A 21 46.126 24.582 28.515 1.00 0.00 C ATOM 330 CD2 PHE A 21 44.668 26.446 28.637 1.00 0.00 C ATOM 331 CE1 PHE A 21 45.157 23.783 29.074 1.00 0.00 C ATOM 332 CE2 PHE A 21 43.700 25.662 29.215 1.00 0.00 C ATOM 333 CZ PHE A 21 43.946 24.325 29.431 1.00 0.00 C ATOM 0 H PHE A 21 47.477 27.844 29.908 1.00 0.00 H new ATOM 0 HA PHE A 21 48.589 25.664 28.425 1.00 0.00 H new ATOM 0 HB2 PHE A 21 46.563 27.840 27.702 1.00 0.00 H new ATOM 0 HB3 PHE A 21 47.028 26.542 26.620 1.00 0.00 H new ATOM 0 HD1 PHE A 21 47.080 24.155 28.243 1.00 0.00 H new ATOM 0 HD2 PHE A 21 44.465 27.489 28.446 1.00 0.00 H new ATOM 0 HE1 PHE A 21 45.347 22.732 29.232 1.00 0.00 H new ATOM 0 HE2 PHE A 21 42.751 26.092 29.499 1.00 0.00 H new ATOM 0 HZ PHE A 21 43.187 23.702 29.881 1.00 0.00 H new ATOM 343 N LEU A 22 50.530 27.583 28.122 1.00 0.00 N ATOM 344 CA LEU A 22 51.681 28.014 27.391 1.00 0.00 C ATOM 345 C LEU A 22 52.282 26.895 26.613 1.00 0.00 C ATOM 346 O LEU A 22 52.793 27.072 25.508 1.00 0.00 O ATOM 347 CB LEU A 22 52.745 28.656 28.297 1.00 0.00 C ATOM 348 CG LEU A 22 52.215 29.939 28.960 1.00 0.00 C ATOM 349 CD1 LEU A 22 53.220 30.389 30.033 1.00 0.00 C ATOM 350 CD2 LEU A 22 51.935 31.092 27.981 1.00 0.00 C ATOM 0 H LEU A 22 50.726 27.395 29.105 1.00 0.00 H new ATOM 0 HA LEU A 22 51.332 28.778 26.696 1.00 0.00 H new ATOM 0 HB2 LEU A 22 53.048 27.945 29.066 1.00 0.00 H new ATOM 0 HB3 LEU A 22 53.634 28.888 27.710 1.00 0.00 H new ATOM 0 HG LEU A 22 51.248 29.692 29.398 1.00 0.00 H new ATOM 0 HD11 LEU A 22 52.858 31.298 30.512 1.00 0.00 H new ATOM 0 HD12 LEU A 22 53.330 29.604 30.781 1.00 0.00 H new ATOM 0 HD13 LEU A 22 54.186 30.584 29.568 1.00 0.00 H new ATOM 0 HD21 LEU A 22 51.565 31.956 28.533 1.00 0.00 H new ATOM 0 HD22 LEU A 22 52.855 31.360 27.462 1.00 0.00 H new ATOM 0 HD23 LEU A 22 51.186 30.778 27.254 1.00 0.00 H new ATOM 362 N ASP A 23 52.180 25.671 27.162 1.00 0.00 N ATOM 363 CA ASP A 23 52.428 24.447 26.465 1.00 0.00 C ATOM 364 C ASP A 23 51.438 24.173 25.386 1.00 0.00 C ATOM 365 O ASP A 23 51.744 23.480 24.417 1.00 0.00 O ATOM 366 CB ASP A 23 52.396 23.263 27.445 1.00 0.00 C ATOM 367 CG ASP A 23 53.767 23.113 28.088 1.00 0.00 C ATOM 368 OD1 ASP A 23 54.700 22.645 27.382 1.00 0.00 O ATOM 369 OD2 ASP A 23 53.910 23.451 29.293 1.00 0.00 O ATOM 0 H ASP A 23 51.913 25.528 28.136 1.00 0.00 H new ATOM 0 HA ASP A 23 53.411 24.559 26.007 1.00 0.00 H new ATOM 0 HB2 ASP A 23 51.638 23.428 28.210 1.00 0.00 H new ATOM 0 HB3 ASP A 23 52.124 22.347 26.920 1.00 0.00 H new ATOM 374 N HIS A 24 50.203 24.694 25.498 1.00 0.00 N ATOM 375 CA HIS A 24 49.163 24.365 24.574 1.00 0.00 C ATOM 376 C HIS A 24 48.532 25.604 24.039 1.00 0.00 C ATOM 377 O HIS A 24 47.351 25.818 24.312 1.00 0.00 O ATOM 378 CB HIS A 24 48.112 23.446 25.220 1.00 0.00 C ATOM 379 CG HIS A 24 48.619 22.187 25.859 1.00 0.00 C ATOM 380 ND1 HIS A 24 49.606 21.391 25.342 1.00 0.00 N ATOM 381 CD2 HIS A 24 48.140 21.544 26.957 1.00 0.00 C ATOM 382 CE1 HIS A 24 49.736 20.317 26.098 1.00 0.00 C ATOM 383 NE2 HIS A 24 48.859 20.384 27.082 1.00 0.00 N ATOM 0 H HIS A 24 49.924 25.346 26.232 1.00 0.00 H new ATOM 0 HA HIS A 24 49.609 23.819 23.743 1.00 0.00 H new ATOM 0 HB2 HIS A 24 47.577 24.020 25.977 1.00 0.00 H new ATOM 0 HB3 HIS A 24 47.385 23.171 24.456 1.00 0.00 H new ATOM 0 HD2 HIS A 24 47.346 21.882 27.606 1.00 0.00 H new ATOM 0 HE1 HIS A 24 50.443 19.516 25.938 1.00 0.00 H new ATOM 0 HE2 HIS A 24 48.736 19.686 27.816 1.00 0.00 H new ATOM 392 N PRO A 25 49.144 26.462 23.280 1.00 0.00 N ATOM 393 CA PRO A 25 48.591 27.746 22.957 1.00 0.00 C ATOM 394 C PRO A 25 47.532 27.676 21.912 1.00 0.00 C ATOM 395 O PRO A 25 46.990 28.705 21.512 1.00 0.00 O ATOM 396 CB PRO A 25 49.803 28.545 22.485 1.00 0.00 C ATOM 397 CG PRO A 25 50.690 27.491 21.804 1.00 0.00 C ATOM 398 CD PRO A 25 50.467 26.267 22.707 1.00 0.00 C ATOM 0 HA PRO A 25 48.083 28.199 23.808 1.00 0.00 H new ATOM 0 HB2 PRO A 25 49.516 29.336 21.792 1.00 0.00 H new ATOM 0 HB3 PRO A 25 50.317 29.023 23.319 1.00 0.00 H new ATOM 0 HG2 PRO A 25 50.385 27.302 20.775 1.00 0.00 H new ATOM 0 HG3 PRO A 25 51.737 27.793 21.775 1.00 0.00 H new ATOM 0 HD2 PRO A 25 50.518 25.340 22.136 1.00 0.00 H new ATOM 0 HD3 PRO A 25 51.229 26.205 23.484 1.00 0.00 H new ATOM 406 N GLU A 26 47.158 26.465 21.462 1.00 0.00 N ATOM 407 CA GLU A 26 46.069 26.217 20.568 1.00 0.00 C ATOM 408 C GLU A 26 44.761 26.253 21.278 1.00 0.00 C ATOM 409 O GLU A 26 43.732 26.546 20.670 1.00 0.00 O ATOM 410 CB GLU A 26 46.276 24.894 19.811 1.00 0.00 C ATOM 411 CG GLU A 26 46.195 23.629 20.666 1.00 0.00 C ATOM 412 CD GLU A 26 46.536 22.379 19.868 1.00 0.00 C ATOM 413 OE1 GLU A 26 47.738 22.164 19.552 1.00 0.00 O ATOM 414 OE2 GLU A 26 45.620 21.564 19.576 1.00 0.00 O ATOM 0 H GLU A 26 47.643 25.611 21.738 1.00 0.00 H new ATOM 0 HA GLU A 26 46.048 27.019 19.830 1.00 0.00 H new ATOM 0 HB2 GLU A 26 45.528 24.826 19.021 1.00 0.00 H new ATOM 0 HB3 GLU A 26 47.251 24.922 19.325 1.00 0.00 H new ATOM 0 HG2 GLU A 26 46.879 23.718 21.510 1.00 0.00 H new ATOM 0 HG3 GLU A 26 45.190 23.533 21.078 1.00 0.00 H new ATOM 421 N ILE A 27 44.734 26.038 22.606 1.00 0.00 N ATOM 422 CA ILE A 27 43.541 26.045 23.392 1.00 0.00 C ATOM 423 C ILE A 27 42.904 27.392 23.364 1.00 0.00 C ATOM 424 O ILE A 27 41.689 27.509 23.219 1.00 0.00 O ATOM 425 CB ILE A 27 43.696 25.626 24.825 1.00 0.00 C ATOM 426 CG1 ILE A 27 44.599 24.418 25.129 1.00 0.00 C ATOM 427 CG2 ILE A 27 42.298 25.244 25.343 1.00 0.00 C ATOM 428 CD1 ILE A 27 44.675 23.341 24.048 1.00 0.00 C ATOM 0 H ILE A 27 45.575 25.852 23.152 1.00 0.00 H new ATOM 0 HA ILE A 27 42.916 25.287 22.920 1.00 0.00 H new ATOM 0 HB ILE A 27 44.177 26.480 25.301 1.00 0.00 H new ATOM 0 HG12 ILE A 27 45.608 24.784 25.319 1.00 0.00 H new ATOM 0 HG13 ILE A 27 44.250 23.953 26.051 1.00 0.00 H new ATOM 0 HG21 ILE A 27 42.369 24.933 26.385 1.00 0.00 H new ATOM 0 HG22 ILE A 27 41.634 26.105 25.266 1.00 0.00 H new ATOM 0 HG23 ILE A 27 41.900 24.424 24.745 1.00 0.00 H new ATOM 0 HD11 ILE A 27 45.340 22.543 24.376 1.00 0.00 H new ATOM 0 HD12 ILE A 27 43.680 22.934 23.870 1.00 0.00 H new ATOM 0 HD13 ILE A 27 45.059 23.777 23.126 1.00 0.00 H new ATOM 440 N TYR A 28 43.720 28.460 23.398 1.00 0.00 N ATOM 441 CA TYR A 28 43.318 29.831 23.326 1.00 0.00 C ATOM 442 C TYR A 28 42.511 30.166 22.120 1.00 0.00 C ATOM 443 O TYR A 28 41.665 31.059 22.141 1.00 0.00 O ATOM 444 CB TYR A 28 44.570 30.720 23.418 1.00 0.00 C ATOM 445 CG TYR A 28 44.315 31.978 24.175 1.00 0.00 C ATOM 446 CD1 TYR A 28 44.293 31.947 25.550 1.00 0.00 C ATOM 447 CD2 TYR A 28 44.132 33.179 23.530 1.00 0.00 C ATOM 448 CE1 TYR A 28 44.093 33.099 26.274 1.00 0.00 C ATOM 449 CE2 TYR A 28 43.955 34.338 24.247 1.00 0.00 C ATOM 450 CZ TYR A 28 43.934 34.299 25.621 1.00 0.00 C ATOM 451 OH TYR A 28 43.779 35.479 26.380 1.00 0.00 O ATOM 0 H TYR A 28 44.731 28.358 23.482 1.00 0.00 H new ATOM 0 HA TYR A 28 42.652 30.018 24.168 1.00 0.00 H new ATOM 0 HB2 TYR A 28 45.373 30.164 23.902 1.00 0.00 H new ATOM 0 HB3 TYR A 28 44.913 30.966 22.413 1.00 0.00 H new ATOM 0 HD1 TYR A 28 44.434 31.009 26.066 1.00 0.00 H new ATOM 0 HD2 TYR A 28 44.127 33.211 22.450 1.00 0.00 H new ATOM 0 HE1 TYR A 28 44.061 33.061 27.353 1.00 0.00 H new ATOM 0 HE2 TYR A 28 43.832 35.279 23.731 1.00 0.00 H new ATOM 0 HH TYR A 28 43.679 36.245 25.777 1.00 0.00 H new ATOM 461 N ARG A 29 42.705 29.432 21.009 1.00 0.00 N ATOM 462 CA ARG A 29 41.939 29.581 19.812 1.00 0.00 C ATOM 463 C ARG A 29 40.624 28.886 19.894 1.00 0.00 C ATOM 464 O ARG A 29 39.587 29.483 19.612 1.00 0.00 O ATOM 465 CB ARG A 29 42.715 29.084 18.580 1.00 0.00 C ATOM 466 CG ARG A 29 43.857 29.992 18.122 1.00 0.00 C ATOM 467 CD ARG A 29 45.126 30.001 18.977 1.00 0.00 C ATOM 468 NE ARG A 29 46.094 30.861 18.239 1.00 0.00 N ATOM 469 CZ ARG A 29 47.424 30.991 18.519 1.00 0.00 C ATOM 470 NH1 ARG A 29 48.027 30.410 19.597 1.00 0.00 N ATOM 471 NH2 ARG A 29 48.193 31.751 17.686 1.00 0.00 N ATOM 0 H ARG A 29 43.421 28.709 20.943 1.00 0.00 H new ATOM 0 HA ARG A 29 41.751 30.649 19.702 1.00 0.00 H new ATOM 0 HB2 ARG A 29 43.122 28.097 18.800 1.00 0.00 H new ATOM 0 HB3 ARG A 29 42.015 28.962 17.754 1.00 0.00 H new ATOM 0 HG2 ARG A 29 44.134 29.702 17.108 1.00 0.00 H new ATOM 0 HG3 ARG A 29 43.477 31.012 18.069 1.00 0.00 H new ATOM 0 HD2 ARG A 29 44.927 30.399 19.972 1.00 0.00 H new ATOM 0 HD3 ARG A 29 45.518 28.993 19.109 1.00 0.00 H new ATOM 0 HE ARG A 29 45.730 31.401 17.454 1.00 0.00 H new ATOM 0 HH11 ARG A 29 47.479 29.843 20.244 1.00 0.00 H new ATOM 0 HH12 ARG A 29 49.026 30.542 19.755 1.00 0.00 H new ATOM 0 HH21 ARG A 29 47.771 32.206 16.876 1.00 0.00 H new ATOM 0 HH22 ARG A 29 49.189 31.864 17.873 1.00 0.00 H new ATOM 485 N SER A 30 40.586 27.592 20.261 1.00 0.00 N ATOM 486 CA SER A 30 39.385 26.818 20.252 1.00 0.00 C ATOM 487 C SER A 30 38.494 27.022 21.428 1.00 0.00 C ATOM 488 O SER A 30 37.282 26.843 21.316 1.00 0.00 O ATOM 489 CB SER A 30 39.638 25.308 20.108 1.00 0.00 C ATOM 490 OG SER A 30 40.093 24.954 18.811 1.00 0.00 O ATOM 0 H SER A 30 41.408 27.073 20.570 1.00 0.00 H new ATOM 0 HA SER A 30 38.873 27.200 19.369 1.00 0.00 H new ATOM 0 HB2 SER A 30 40.376 24.995 20.846 1.00 0.00 H new ATOM 0 HB3 SER A 30 38.718 24.766 20.327 1.00 0.00 H new ATOM 0 HG SER A 30 40.241 23.986 18.769 1.00 0.00 H new ATOM 496 N PHE A 31 39.016 27.411 22.605 1.00 0.00 N ATOM 497 CA PHE A 31 38.266 27.711 23.785 1.00 0.00 C ATOM 498 C PHE A 31 37.204 28.736 23.580 1.00 0.00 C ATOM 499 O PHE A 31 36.023 28.508 23.837 1.00 0.00 O ATOM 500 CB PHE A 31 39.249 28.183 24.869 1.00 0.00 C ATOM 501 CG PHE A 31 38.675 28.623 26.172 1.00 0.00 C ATOM 502 CD1 PHE A 31 37.785 27.834 26.862 1.00 0.00 C ATOM 503 CD2 PHE A 31 39.067 29.817 26.730 1.00 0.00 C ATOM 504 CE1 PHE A 31 37.278 28.242 28.073 1.00 0.00 C ATOM 505 CE2 PHE A 31 38.620 30.201 27.972 1.00 0.00 C ATOM 506 CZ PHE A 31 37.713 29.415 28.643 1.00 0.00 C ATOM 0 H PHE A 31 40.021 27.522 22.740 1.00 0.00 H new ATOM 0 HA PHE A 31 37.744 26.802 24.083 1.00 0.00 H new ATOM 0 HB2 PHE A 31 39.948 27.370 25.066 1.00 0.00 H new ATOM 0 HB3 PHE A 31 39.829 29.010 24.460 1.00 0.00 H new ATOM 0 HD1 PHE A 31 37.481 26.884 26.448 1.00 0.00 H new ATOM 0 HD2 PHE A 31 39.737 30.464 26.183 1.00 0.00 H new ATOM 0 HE1 PHE A 31 36.537 27.640 28.577 1.00 0.00 H new ATOM 0 HE2 PHE A 31 38.980 31.116 28.419 1.00 0.00 H new ATOM 0 HZ PHE A 31 37.344 29.717 29.612 1.00 0.00 H new ATOM 516 N LEU A 32 37.588 29.927 23.086 1.00 0.00 N ATOM 517 CA LEU A 32 36.704 31.041 22.940 1.00 0.00 C ATOM 518 C LEU A 32 35.753 30.854 21.808 1.00 0.00 C ATOM 519 O LEU A 32 34.608 31.300 21.861 1.00 0.00 O ATOM 520 CB LEU A 32 37.434 32.357 22.626 1.00 0.00 C ATOM 521 CG LEU A 32 38.838 32.488 23.241 1.00 0.00 C ATOM 522 CD1 LEU A 32 39.660 33.454 22.370 1.00 0.00 C ATOM 523 CD2 LEU A 32 38.756 32.906 24.719 1.00 0.00 C ATOM 0 H LEU A 32 38.541 30.120 22.779 1.00 0.00 H new ATOM 0 HA LEU A 32 36.196 31.095 23.903 1.00 0.00 H new ATOM 0 HB2 LEU A 32 37.517 32.459 21.544 1.00 0.00 H new ATOM 0 HB3 LEU A 32 36.821 33.187 22.978 1.00 0.00 H new ATOM 0 HG LEU A 32 39.349 31.525 23.247 1.00 0.00 H new ATOM 0 HD11 LEU A 32 40.660 33.561 22.790 1.00 0.00 H new ATOM 0 HD12 LEU A 32 39.732 33.059 21.357 1.00 0.00 H new ATOM 0 HD13 LEU A 32 39.171 34.428 22.346 1.00 0.00 H new ATOM 0 HD21 LEU A 32 39.762 32.991 25.129 1.00 0.00 H new ATOM 0 HD22 LEU A 32 38.249 33.868 24.798 1.00 0.00 H new ATOM 0 HD23 LEU A 32 38.198 32.155 25.279 1.00 0.00 H new ATOM 535 N GLU A 33 36.218 30.192 20.733 1.00 0.00 N ATOM 536 CA GLU A 33 35.422 29.661 19.670 1.00 0.00 C ATOM 537 C GLU A 33 34.154 28.999 20.087 1.00 0.00 C ATOM 538 O GLU A 33 33.074 29.355 19.616 1.00 0.00 O ATOM 539 CB GLU A 33 36.276 28.705 18.821 1.00 0.00 C ATOM 540 CG GLU A 33 35.803 28.673 17.365 1.00 0.00 C ATOM 541 CD GLU A 33 36.564 27.673 16.508 1.00 0.00 C ATOM 542 OE1 GLU A 33 37.768 27.895 16.214 1.00 0.00 O ATOM 543 OE2 GLU A 33 35.926 26.686 16.051 1.00 0.00 O ATOM 0 H GLU A 33 37.214 30.017 20.599 1.00 0.00 H new ATOM 0 HA GLU A 33 35.098 30.523 19.086 1.00 0.00 H new ATOM 0 HB2 GLU A 33 37.320 29.017 18.859 1.00 0.00 H new ATOM 0 HB3 GLU A 33 36.228 27.701 19.242 1.00 0.00 H new ATOM 0 HG2 GLU A 33 34.741 28.428 17.340 1.00 0.00 H new ATOM 0 HG3 GLU A 33 35.911 29.668 16.933 1.00 0.00 H new ATOM 550 N ILE A 34 34.217 28.075 21.061 1.00 0.00 N ATOM 551 CA ILE A 34 33.099 27.440 21.688 1.00 0.00 C ATOM 552 C ILE A 34 32.237 28.415 22.415 1.00 0.00 C ATOM 553 O ILE A 34 31.010 28.390 22.317 1.00 0.00 O ATOM 554 CB ILE A 34 33.574 26.335 22.582 1.00 0.00 C ATOM 555 CG1 ILE A 34 34.287 25.235 21.777 1.00 0.00 C ATOM 556 CG2 ILE A 34 32.409 25.724 23.379 1.00 0.00 C ATOM 557 CD1 ILE A 34 35.229 24.379 22.622 1.00 0.00 C ATOM 0 H ILE A 34 35.108 27.750 21.435 1.00 0.00 H new ATOM 0 HA ILE A 34 32.472 27.005 20.910 1.00 0.00 H new ATOM 0 HB ILE A 34 34.286 26.772 23.283 1.00 0.00 H new ATOM 0 HG12 ILE A 34 33.539 24.591 21.315 1.00 0.00 H new ATOM 0 HG13 ILE A 34 34.854 25.696 20.969 1.00 0.00 H new ATOM 0 HG21 ILE A 34 32.785 24.925 24.018 1.00 0.00 H new ATOM 0 HG22 ILE A 34 31.946 26.495 23.995 1.00 0.00 H new ATOM 0 HG23 ILE A 34 31.669 25.318 22.689 1.00 0.00 H new ATOM 0 HD11 ILE A 34 35.698 23.624 21.992 1.00 0.00 H new ATOM 0 HD12 ILE A 34 35.999 25.012 23.063 1.00 0.00 H new ATOM 0 HD13 ILE A 34 34.663 23.890 23.415 1.00 0.00 H new ATOM 569 N LEU A 35 32.779 29.388 23.169 1.00 0.00 N ATOM 570 CA LEU A 35 31.956 30.351 23.833 1.00 0.00 C ATOM 571 C LEU A 35 31.344 31.373 22.937 1.00 0.00 C ATOM 572 O LEU A 35 30.340 32.001 23.266 1.00 0.00 O ATOM 573 CB LEU A 35 32.754 31.070 24.933 1.00 0.00 C ATOM 574 CG LEU A 35 33.703 30.181 25.755 1.00 0.00 C ATOM 575 CD1 LEU A 35 34.000 30.961 27.047 1.00 0.00 C ATOM 576 CD2 LEU A 35 33.182 28.833 26.283 1.00 0.00 C ATOM 0 H LEU A 35 33.781 29.508 23.319 1.00 0.00 H new ATOM 0 HA LEU A 35 31.133 29.773 24.254 1.00 0.00 H new ATOM 0 HB2 LEU A 35 33.339 31.865 24.471 1.00 0.00 H new ATOM 0 HB3 LEU A 35 32.050 31.547 25.615 1.00 0.00 H new ATOM 0 HG LEU A 35 34.516 29.958 25.063 1.00 0.00 H new ATOM 0 HD11 LEU A 35 34.673 30.379 27.677 1.00 0.00 H new ATOM 0 HD12 LEU A 35 34.469 31.913 26.798 1.00 0.00 H new ATOM 0 HD13 LEU A 35 33.069 31.145 27.583 1.00 0.00 H new ATOM 0 HD21 LEU A 35 33.972 28.331 26.841 1.00 0.00 H new ATOM 0 HD22 LEU A 35 32.328 29.004 26.938 1.00 0.00 H new ATOM 0 HD23 LEU A 35 32.876 28.208 25.444 1.00 0.00 H new ATOM 588 N HIS A 36 31.883 31.573 21.721 1.00 0.00 N ATOM 589 CA HIS A 36 31.307 32.382 20.693 1.00 0.00 C ATOM 590 C HIS A 36 30.116 31.742 20.067 1.00 0.00 C ATOM 591 O HIS A 36 29.248 32.430 19.531 1.00 0.00 O ATOM 592 CB HIS A 36 32.293 32.732 19.565 1.00 0.00 C ATOM 593 CG HIS A 36 33.456 33.592 19.964 1.00 0.00 C ATOM 594 ND1 HIS A 36 34.788 33.405 19.764 1.00 0.00 N flip ATOM 595 CD2 HIS A 36 33.310 34.862 20.457 1.00 0.00 C flip ATOM 596 CE1 HIS A 36 35.409 34.565 20.142 1.00 0.00 C flip ATOM 597 NE2 HIS A 36 34.498 35.432 20.542 1.00 0.00 N flip ATOM 0 H HIS A 36 32.767 31.148 21.441 1.00 0.00 H new ATOM 0 HA HIS A 36 31.016 33.296 21.210 1.00 0.00 H new ATOM 0 HB2 HIS A 36 32.678 31.804 19.143 1.00 0.00 H new ATOM 0 HB3 HIS A 36 31.744 33.239 18.772 1.00 0.00 H new ATOM 0 HD2 HIS A 36 32.373 35.323 20.732 1.00 0.00 H new ATOM 0 HE1 HIS A 36 36.474 34.742 20.117 1.00 0.00 H new ATOM 0 HE2 HIS A 36 34.681 36.383 20.863 1.00 0.00 H new ATOM 606 N THR A 37 29.973 30.407 20.129 1.00 0.00 N ATOM 607 CA THR A 37 28.783 29.678 19.818 1.00 0.00 C ATOM 608 C THR A 37 27.654 30.076 20.707 1.00 0.00 C ATOM 609 O THR A 37 26.497 30.141 20.293 1.00 0.00 O ATOM 610 CB THR A 37 29.025 28.206 19.982 1.00 0.00 C ATOM 611 OG1 THR A 37 30.110 27.780 19.171 1.00 0.00 O ATOM 612 CG2 THR A 37 27.821 27.326 19.607 1.00 0.00 C ATOM 0 H THR A 37 30.739 29.797 20.415 1.00 0.00 H new ATOM 0 HA THR A 37 28.519 29.906 18.785 1.00 0.00 H new ATOM 0 HB THR A 37 29.232 28.081 21.045 1.00 0.00 H new ATOM 0 HG1 THR A 37 30.252 26.818 19.294 1.00 0.00 H new ATOM 0 HG21 THR A 37 28.078 26.277 19.753 1.00 0.00 H new ATOM 0 HG22 THR A 37 26.971 27.583 20.239 1.00 0.00 H new ATOM 0 HG23 THR A 37 27.560 27.493 18.562 1.00 0.00 H new ATOM 620 N TYR A 38 27.978 30.379 21.975 1.00 0.00 N ATOM 621 CA TYR A 38 27.069 30.814 22.991 1.00 0.00 C ATOM 622 C TYR A 38 26.684 32.250 22.900 1.00 0.00 C ATOM 623 O TYR A 38 25.511 32.566 22.708 1.00 0.00 O ATOM 624 CB TYR A 38 27.714 30.507 24.353 1.00 0.00 C ATOM 625 CG TYR A 38 26.854 30.743 25.546 1.00 0.00 C ATOM 626 CD1 TYR A 38 26.864 31.968 26.169 1.00 0.00 C ATOM 627 CD2 TYR A 38 26.074 29.729 26.052 1.00 0.00 C ATOM 628 CE1 TYR A 38 26.066 32.198 27.265 1.00 0.00 C ATOM 629 CE2 TYR A 38 25.245 29.967 27.123 1.00 0.00 C ATOM 630 CZ TYR A 38 25.238 31.202 27.726 1.00 0.00 C ATOM 631 OH TYR A 38 24.376 31.466 28.812 1.00 0.00 O ATOM 0 H TYR A 38 28.938 30.316 22.314 1.00 0.00 H new ATOM 0 HA TYR A 38 26.133 30.272 22.856 1.00 0.00 H new ATOM 0 HB2 TYR A 38 28.030 29.464 24.357 1.00 0.00 H new ATOM 0 HB3 TYR A 38 28.614 31.113 24.452 1.00 0.00 H new ATOM 0 HD1 TYR A 38 27.503 32.755 25.795 1.00 0.00 H new ATOM 0 HD2 TYR A 38 26.113 28.745 25.608 1.00 0.00 H new ATOM 0 HE1 TYR A 38 26.090 33.157 27.761 1.00 0.00 H new ATOM 0 HE2 TYR A 38 24.599 29.183 27.490 1.00 0.00 H new ATOM 0 HH TYR A 38 23.843 30.667 29.008 1.00 0.00 H new ATOM 641 N GLN A 39 27.662 33.165 23.032 1.00 0.00 N ATOM 642 CA GLN A 39 27.477 34.567 23.243 1.00 0.00 C ATOM 643 C GLN A 39 26.703 35.260 22.176 1.00 0.00 C ATOM 644 O GLN A 39 25.899 36.157 22.426 1.00 0.00 O ATOM 645 CB GLN A 39 28.884 35.158 23.440 1.00 0.00 C ATOM 646 CG GLN A 39 28.947 36.403 24.327 1.00 0.00 C ATOM 647 CD GLN A 39 28.712 37.691 23.551 1.00 0.00 C ATOM 648 OE1 GLN A 39 29.512 38.072 22.697 1.00 0.00 O ATOM 649 NE2 GLN A 39 27.606 38.420 23.858 1.00 0.00 N ATOM 0 H GLN A 39 28.648 32.906 22.988 1.00 0.00 H new ATOM 0 HA GLN A 39 26.851 34.724 24.122 1.00 0.00 H new ATOM 0 HB2 GLN A 39 29.526 34.390 23.872 1.00 0.00 H new ATOM 0 HB3 GLN A 39 29.297 35.406 22.462 1.00 0.00 H new ATOM 0 HG2 GLN A 39 28.201 36.319 25.117 1.00 0.00 H new ATOM 0 HG3 GLN A 39 29.922 36.449 24.812 1.00 0.00 H new ATOM 0 HE21 GLN A 39 26.956 38.085 24.569 1.00 0.00 H new ATOM 0 HE22 GLN A 39 27.426 39.301 23.377 1.00 0.00 H new ATOM 898 N SER A 54 22.232 25.525 25.147 1.00 0.00 N ATOM 899 CA SER A 54 22.239 25.542 26.577 1.00 0.00 C ATOM 900 C SER A 54 23.640 25.548 27.086 1.00 0.00 C ATOM 901 O SER A 54 24.544 24.970 26.485 1.00 0.00 O ATOM 902 CB SER A 54 21.535 24.351 27.246 1.00 0.00 C ATOM 903 OG SER A 54 20.187 24.217 26.818 1.00 0.00 O ATOM 0 HA SER A 54 21.688 26.446 26.835 1.00 0.00 H new ATOM 0 HB2 SER A 54 22.080 23.435 27.019 1.00 0.00 H new ATOM 0 HB3 SER A 54 21.560 24.477 28.328 1.00 0.00 H new ATOM 0 HG SER A 54 20.108 24.514 25.888 1.00 0.00 H new ATOM 909 N GLU A 55 23.845 26.171 28.260 1.00 0.00 N ATOM 910 CA GLU A 55 25.047 26.360 29.012 1.00 0.00 C ATOM 911 C GLU A 55 25.902 25.150 29.170 1.00 0.00 C ATOM 912 O GLU A 55 27.127 25.215 29.093 1.00 0.00 O ATOM 913 CB GLU A 55 24.679 26.882 30.411 1.00 0.00 C ATOM 914 CG GLU A 55 24.109 28.300 30.471 1.00 0.00 C ATOM 915 CD GLU A 55 22.761 28.516 29.799 1.00 0.00 C ATOM 916 OE1 GLU A 55 21.949 27.556 29.704 1.00 0.00 O ATOM 917 OE2 GLU A 55 22.522 29.666 29.342 1.00 0.00 O ATOM 0 H GLU A 55 23.056 26.599 28.744 1.00 0.00 H new ATOM 0 HA GLU A 55 25.641 27.070 28.437 1.00 0.00 H new ATOM 0 HB2 GLU A 55 23.951 26.201 30.851 1.00 0.00 H new ATOM 0 HB3 GLU A 55 25.570 26.844 31.037 1.00 0.00 H new ATOM 0 HG2 GLU A 55 24.019 28.588 31.518 1.00 0.00 H new ATOM 0 HG3 GLU A 55 24.831 28.978 30.015 1.00 0.00 H new ATOM 924 N GLU A 56 25.295 23.963 29.353 1.00 0.00 N ATOM 925 CA GLU A 56 25.991 22.722 29.487 1.00 0.00 C ATOM 926 C GLU A 56 26.933 22.370 28.388 1.00 0.00 C ATOM 927 O GLU A 56 27.961 21.745 28.642 1.00 0.00 O ATOM 928 CB GLU A 56 24.988 21.565 29.643 1.00 0.00 C ATOM 929 CG GLU A 56 24.124 21.686 30.900 1.00 0.00 C ATOM 930 CD GLU A 56 23.220 20.470 31.046 1.00 0.00 C ATOM 931 OE1 GLU A 56 23.746 19.330 31.144 1.00 0.00 O ATOM 932 OE2 GLU A 56 21.971 20.642 31.065 1.00 0.00 O ATOM 0 H GLU A 56 24.281 23.865 29.410 1.00 0.00 H new ATOM 0 HA GLU A 56 26.607 22.867 30.375 1.00 0.00 H new ATOM 0 HB2 GLU A 56 24.341 21.532 28.766 1.00 0.00 H new ATOM 0 HB3 GLU A 56 25.533 20.621 29.673 1.00 0.00 H new ATOM 0 HG2 GLU A 56 24.762 21.780 31.779 1.00 0.00 H new ATOM 0 HG3 GLU A 56 23.519 22.591 30.847 1.00 0.00 H new ATOM 939 N GLU A 57 26.663 22.744 27.124 1.00 0.00 N ATOM 940 CA GLU A 57 27.463 22.268 26.039 1.00 0.00 C ATOM 941 C GLU A 57 28.687 23.100 25.873 1.00 0.00 C ATOM 942 O GLU A 57 29.749 22.651 25.446 1.00 0.00 O ATOM 943 CB GLU A 57 26.754 22.045 24.692 1.00 0.00 C ATOM 944 CG GLU A 57 26.774 23.205 23.694 1.00 0.00 C ATOM 945 CD GLU A 57 26.005 22.803 22.444 1.00 0.00 C ATOM 946 OE1 GLU A 57 24.756 22.652 22.514 1.00 0.00 O ATOM 947 OE2 GLU A 57 26.642 22.649 21.367 1.00 0.00 O ATOM 0 H GLU A 57 25.902 23.367 26.856 1.00 0.00 H new ATOM 0 HA GLU A 57 27.732 21.258 26.348 1.00 0.00 H new ATOM 0 HB2 GLU A 57 27.206 21.177 24.211 1.00 0.00 H new ATOM 0 HB3 GLU A 57 25.714 21.791 24.895 1.00 0.00 H new ATOM 0 HG2 GLU A 57 26.327 24.093 24.141 1.00 0.00 H new ATOM 0 HG3 GLU A 57 27.802 23.461 23.437 1.00 0.00 H new ATOM 954 N VAL A 58 28.575 24.384 26.260 1.00 0.00 N ATOM 955 CA VAL A 58 29.641 25.326 26.124 1.00 0.00 C ATOM 956 C VAL A 58 30.721 25.068 27.118 1.00 0.00 C ATOM 957 O VAL A 58 31.914 25.236 26.870 1.00 0.00 O ATOM 958 CB VAL A 58 29.024 26.694 26.142 1.00 0.00 C ATOM 959 CG1 VAL A 58 29.066 27.403 27.507 1.00 0.00 C ATOM 960 CG2 VAL A 58 29.823 27.557 25.152 1.00 0.00 C ATOM 0 H VAL A 58 27.729 24.774 26.675 1.00 0.00 H new ATOM 0 HA VAL A 58 30.170 25.229 25.176 1.00 0.00 H new ATOM 0 HB VAL A 58 27.971 26.572 25.888 1.00 0.00 H new ATOM 0 HG11 VAL A 58 28.598 28.384 27.422 1.00 0.00 H new ATOM 0 HG12 VAL A 58 28.528 26.806 28.244 1.00 0.00 H new ATOM 0 HG13 VAL A 58 30.102 27.522 27.823 1.00 0.00 H new ATOM 0 HG21 VAL A 58 29.409 28.565 25.131 1.00 0.00 H new ATOM 0 HG22 VAL A 58 30.866 27.600 25.466 1.00 0.00 H new ATOM 0 HG23 VAL A 58 29.762 27.119 24.156 1.00 0.00 H new ATOM 970 N PHE A 59 30.285 24.523 28.269 1.00 0.00 N ATOM 971 CA PHE A 59 31.073 23.817 29.231 1.00 0.00 C ATOM 972 C PHE A 59 31.645 22.557 28.676 1.00 0.00 C ATOM 973 O PHE A 59 32.853 22.329 28.725 1.00 0.00 O ATOM 974 CB PHE A 59 30.201 23.558 30.471 1.00 0.00 C ATOM 975 CG PHE A 59 30.875 22.862 31.603 1.00 0.00 C ATOM 976 CD1 PHE A 59 30.925 21.488 31.656 1.00 0.00 C ATOM 977 CD2 PHE A 59 31.420 23.581 32.641 1.00 0.00 C ATOM 978 CE1 PHE A 59 31.538 20.844 32.704 1.00 0.00 C ATOM 979 CE2 PHE A 59 32.023 22.949 33.701 1.00 0.00 C ATOM 980 CZ PHE A 59 32.092 21.575 33.729 1.00 0.00 C ATOM 0 H PHE A 59 29.305 24.582 28.546 1.00 0.00 H new ATOM 0 HA PHE A 59 31.933 24.426 29.510 1.00 0.00 H new ATOM 0 HB2 PHE A 59 29.821 24.514 30.831 1.00 0.00 H new ATOM 0 HB3 PHE A 59 29.337 22.966 30.168 1.00 0.00 H new ATOM 0 HD1 PHE A 59 30.476 20.908 30.863 1.00 0.00 H new ATOM 0 HD2 PHE A 59 31.373 24.660 32.622 1.00 0.00 H new ATOM 0 HE1 PHE A 59 31.585 19.765 32.723 1.00 0.00 H new ATOM 0 HE2 PHE A 59 32.442 23.529 34.510 1.00 0.00 H new ATOM 0 HZ PHE A 59 32.579 21.073 34.552 1.00 0.00 H new ATOM 990 N THR A 60 30.812 21.664 28.113 1.00 0.00 N ATOM 991 CA THR A 60 31.164 20.370 27.616 1.00 0.00 C ATOM 992 C THR A 60 32.255 20.312 26.604 1.00 0.00 C ATOM 993 O THR A 60 33.120 19.439 26.664 1.00 0.00 O ATOM 994 CB THR A 60 29.975 19.560 27.190 1.00 0.00 C ATOM 995 OG1 THR A 60 29.969 18.284 27.813 1.00 0.00 O ATOM 996 CG2 THR A 60 29.811 19.333 25.678 1.00 0.00 C ATOM 0 H THR A 60 29.818 21.863 27.997 1.00 0.00 H new ATOM 0 HA THR A 60 31.602 19.903 28.498 1.00 0.00 H new ATOM 0 HB THR A 60 29.139 20.181 27.510 1.00 0.00 H new ATOM 0 HG1 THR A 60 29.182 17.780 27.518 1.00 0.00 H new ATOM 0 HG21 THR A 60 28.918 18.735 25.495 1.00 0.00 H new ATOM 0 HG22 THR A 60 29.714 20.295 25.174 1.00 0.00 H new ATOM 0 HG23 THR A 60 30.685 18.808 25.292 1.00 0.00 H new ATOM 1004 N GLU A 61 32.278 21.233 25.625 1.00 0.00 N ATOM 1005 CA GLU A 61 33.304 21.255 24.628 1.00 0.00 C ATOM 1006 C GLU A 61 34.611 21.723 25.168 1.00 0.00 C ATOM 1007 O GLU A 61 35.627 21.073 24.930 1.00 0.00 O ATOM 1008 CB GLU A 61 32.868 21.925 23.314 1.00 0.00 C ATOM 1009 CG GLU A 61 31.529 21.407 22.786 1.00 0.00 C ATOM 1010 CD GLU A 61 31.302 21.651 21.301 1.00 0.00 C ATOM 1011 OE1 GLU A 61 31.588 22.754 20.763 1.00 0.00 O ATOM 1012 OE2 GLU A 61 30.804 20.702 20.640 1.00 0.00 O ATOM 0 H GLU A 61 31.579 21.969 25.523 1.00 0.00 H new ATOM 0 HA GLU A 61 33.478 20.219 24.339 1.00 0.00 H new ATOM 0 HB2 GLU A 61 32.798 23.002 23.469 1.00 0.00 H new ATOM 0 HB3 GLU A 61 33.636 21.761 22.558 1.00 0.00 H new ATOM 0 HG2 GLU A 61 31.466 20.336 22.980 1.00 0.00 H new ATOM 0 HG3 GLU A 61 30.723 21.881 23.347 1.00 0.00 H new ATOM 1019 N VAL A 62 34.637 22.780 26.001 1.00 0.00 N ATOM 1020 CA VAL A 62 35.765 23.289 26.717 1.00 0.00 C ATOM 1021 C VAL A 62 36.460 22.277 27.561 1.00 0.00 C ATOM 1022 O VAL A 62 37.684 22.230 27.680 1.00 0.00 O ATOM 1023 CB VAL A 62 35.303 24.411 27.600 1.00 0.00 C ATOM 1024 CG1 VAL A 62 36.353 24.863 28.629 1.00 0.00 C ATOM 1025 CG2 VAL A 62 34.928 25.571 26.662 1.00 0.00 C ATOM 0 H VAL A 62 33.794 23.324 26.188 1.00 0.00 H new ATOM 0 HA VAL A 62 36.486 23.618 25.969 1.00 0.00 H new ATOM 0 HB VAL A 62 34.458 24.071 28.199 1.00 0.00 H new ATOM 0 HG11 VAL A 62 35.947 25.676 29.230 1.00 0.00 H new ATOM 0 HG12 VAL A 62 36.611 24.026 29.278 1.00 0.00 H new ATOM 0 HG13 VAL A 62 37.247 25.208 28.109 1.00 0.00 H new ATOM 0 HG21 VAL A 62 34.583 26.420 27.253 1.00 0.00 H new ATOM 0 HG22 VAL A 62 35.801 25.865 26.080 1.00 0.00 H new ATOM 0 HG23 VAL A 62 34.134 25.251 25.988 1.00 0.00 H new ATOM 1035 N ALA A 63 35.659 21.375 28.157 1.00 0.00 N ATOM 1036 CA ALA A 63 36.074 20.381 29.098 1.00 0.00 C ATOM 1037 C ALA A 63 37.045 19.413 28.515 1.00 0.00 C ATOM 1038 O ALA A 63 37.926 18.912 29.213 1.00 0.00 O ATOM 1039 CB ALA A 63 34.873 19.573 29.619 1.00 0.00 C ATOM 0 H ALA A 63 34.657 21.339 27.969 1.00 0.00 H new ATOM 0 HA ALA A 63 36.553 20.929 29.909 1.00 0.00 H new ATOM 0 HB1 ALA A 63 35.219 18.825 30.332 1.00 0.00 H new ATOM 0 HB2 ALA A 63 34.169 20.244 30.110 1.00 0.00 H new ATOM 0 HB3 ALA A 63 34.379 19.076 28.784 1.00 0.00 H new ATOM 1045 N ASN A 64 36.953 19.137 27.202 1.00 0.00 N ATOM 1046 CA ASN A 64 37.889 18.241 26.598 1.00 0.00 C ATOM 1047 C ASN A 64 39.222 18.879 26.407 1.00 0.00 C ATOM 1048 O ASN A 64 40.256 18.216 26.466 1.00 0.00 O ATOM 1049 CB ASN A 64 37.500 17.690 25.216 1.00 0.00 C ATOM 1050 CG ASN A 64 36.013 17.367 25.167 1.00 0.00 C ATOM 1051 OD1 ASN A 64 35.503 16.395 25.721 1.00 0.00 O ATOM 1052 ND2 ASN A 64 35.306 18.291 24.463 1.00 0.00 N ATOM 0 H ASN A 64 36.250 19.523 26.572 1.00 0.00 H new ATOM 0 HA ASN A 64 37.905 17.418 27.312 1.00 0.00 H new ATOM 0 HB2 ASN A 64 37.744 18.421 24.445 1.00 0.00 H new ATOM 0 HB3 ASN A 64 38.080 16.793 25.000 1.00 0.00 H new ATOM 0 HD21 ASN A 64 34.294 18.198 24.372 1.00 0.00 H new ATOM 0 HD22 ASN A 64 35.787 19.077 24.026 1.00 0.00 H new ATOM 1059 N LEU A 65 39.258 20.204 26.174 1.00 0.00 N ATOM 1060 CA LEU A 65 40.483 20.912 25.962 1.00 0.00 C ATOM 1061 C LEU A 65 41.249 21.092 27.226 1.00 0.00 C ATOM 1062 O LEU A 65 42.476 21.184 27.248 1.00 0.00 O ATOM 1063 CB LEU A 65 40.305 22.289 25.302 1.00 0.00 C ATOM 1064 CG LEU A 65 39.537 22.259 23.969 1.00 0.00 C ATOM 1065 CD1 LEU A 65 38.060 22.606 24.224 1.00 0.00 C ATOM 1066 CD2 LEU A 65 40.131 23.227 22.933 1.00 0.00 C ATOM 0 H LEU A 65 38.426 20.792 26.132 1.00 0.00 H new ATOM 0 HA LEU A 65 41.039 20.278 25.272 1.00 0.00 H new ATOM 0 HB2 LEU A 65 39.780 22.946 25.995 1.00 0.00 H new ATOM 0 HB3 LEU A 65 41.289 22.727 25.131 1.00 0.00 H new ATOM 0 HG LEU A 65 39.623 21.253 23.557 1.00 0.00 H new ATOM 0 HD11 LEU A 65 37.513 22.586 23.281 1.00 0.00 H new ATOM 0 HD12 LEU A 65 37.628 21.877 24.910 1.00 0.00 H new ATOM 0 HD13 LEU A 65 37.991 23.602 24.662 1.00 0.00 H new ATOM 0 HD21 LEU A 65 39.555 23.170 22.009 1.00 0.00 H new ATOM 0 HD22 LEU A 65 40.093 24.245 23.322 1.00 0.00 H new ATOM 0 HD23 LEU A 65 41.167 22.954 22.732 1.00 0.00 H new ATOM 1078 N PHE A 66 40.511 21.167 28.348 1.00 0.00 N ATOM 1079 CA PHE A 66 41.002 21.518 29.645 1.00 0.00 C ATOM 1080 C PHE A 66 41.198 20.306 30.489 1.00 0.00 C ATOM 1081 O PHE A 66 41.634 20.398 31.635 1.00 0.00 O ATOM 1082 CB PHE A 66 40.010 22.438 30.374 1.00 0.00 C ATOM 1083 CG PHE A 66 40.007 23.874 29.973 1.00 0.00 C ATOM 1084 CD1 PHE A 66 40.388 24.342 28.738 1.00 0.00 C ATOM 1085 CD2 PHE A 66 39.560 24.783 30.902 1.00 0.00 C ATOM 1086 CE1 PHE A 66 40.333 25.681 28.434 1.00 0.00 C ATOM 1087 CE2 PHE A 66 39.514 26.128 30.623 1.00 0.00 C ATOM 1088 CZ PHE A 66 39.909 26.579 29.386 1.00 0.00 C ATOM 0 H PHE A 66 39.510 20.970 28.349 1.00 0.00 H new ATOM 0 HA PHE A 66 41.953 22.029 29.496 1.00 0.00 H new ATOM 0 HB2 PHE A 66 39.006 22.041 30.225 1.00 0.00 H new ATOM 0 HB3 PHE A 66 40.218 22.384 31.443 1.00 0.00 H new ATOM 0 HD1 PHE A 66 40.737 23.644 27.992 1.00 0.00 H new ATOM 0 HD2 PHE A 66 39.238 24.433 31.872 1.00 0.00 H new ATOM 0 HE1 PHE A 66 40.621 26.027 27.452 1.00 0.00 H new ATOM 0 HE2 PHE A 66 39.170 26.826 31.371 1.00 0.00 H new ATOM 0 HZ PHE A 66 39.887 27.635 29.162 1.00 0.00 H new ATOM 1098 N ARG A 67 40.870 19.119 29.948 1.00 0.00 N ATOM 1099 CA ARG A 67 40.671 17.870 30.616 1.00 0.00 C ATOM 1100 C ARG A 67 41.661 17.442 31.643 1.00 0.00 C ATOM 1101 O ARG A 67 42.876 17.470 31.455 1.00 0.00 O ATOM 1102 CB ARG A 67 40.518 16.808 29.514 1.00 0.00 C ATOM 1103 CG ARG A 67 39.756 15.530 29.875 1.00 0.00 C ATOM 1104 CD ARG A 67 40.595 14.342 30.350 1.00 0.00 C ATOM 1105 NE ARG A 67 40.327 14.060 31.787 1.00 0.00 N ATOM 1106 CZ ARG A 67 39.218 13.409 32.247 1.00 0.00 C ATOM 1107 NH1 ARG A 67 38.163 13.083 31.443 1.00 0.00 N ATOM 1108 NH2 ARG A 67 39.157 13.000 33.548 1.00 0.00 N ATOM 0 H ARG A 67 40.731 19.028 28.942 1.00 0.00 H new ATOM 0 HA ARG A 67 39.785 18.002 31.237 1.00 0.00 H new ATOM 0 HB2 ARG A 67 40.016 17.272 28.665 1.00 0.00 H new ATOM 0 HB3 ARG A 67 41.515 16.523 29.178 1.00 0.00 H new ATOM 0 HG2 ARG A 67 39.036 15.772 30.656 1.00 0.00 H new ATOM 0 HG3 ARG A 67 39.185 15.216 29.001 1.00 0.00 H new ATOM 0 HD2 ARG A 67 40.363 13.462 29.751 1.00 0.00 H new ATOM 0 HD3 ARG A 67 41.654 14.556 30.206 1.00 0.00 H new ATOM 0 HE ARG A 67 41.015 14.373 32.472 1.00 0.00 H new ATOM 0 HH11 ARG A 67 38.182 13.326 30.453 1.00 0.00 H new ATOM 0 HH12 ARG A 67 37.356 12.596 31.833 1.00 0.00 H new ATOM 0 HH21 ARG A 67 39.940 13.181 34.177 1.00 0.00 H new ATOM 0 HH22 ARG A 67 38.329 12.514 33.891 1.00 0.00 H new ATOM 1122 N GLY A 68 41.135 17.049 32.817 1.00 0.00 N ATOM 1123 CA GLY A 68 41.897 16.676 33.968 1.00 0.00 C ATOM 1124 C GLY A 68 42.021 17.795 34.945 1.00 0.00 C ATOM 1125 O GLY A 68 42.123 17.575 36.150 1.00 0.00 O ATOM 0 H GLY A 68 40.128 16.989 32.971 1.00 0.00 H new ATOM 0 HA2 GLY A 68 41.425 15.822 34.454 1.00 0.00 H new ATOM 0 HA3 GLY A 68 42.891 16.356 33.656 1.00 0.00 H new ATOM 1129 N GLN A 69 42.024 19.051 34.462 1.00 0.00 N ATOM 1130 CA GLN A 69 42.292 20.207 35.259 1.00 0.00 C ATOM 1131 C GLN A 69 41.049 20.807 35.817 1.00 0.00 C ATOM 1132 O GLN A 69 40.487 21.795 35.346 1.00 0.00 O ATOM 1133 CB GLN A 69 43.082 21.257 34.459 1.00 0.00 C ATOM 1134 CG GLN A 69 44.356 20.678 33.838 1.00 0.00 C ATOM 1135 CD GLN A 69 44.954 21.605 32.790 1.00 0.00 C ATOM 1136 OE1 GLN A 69 46.079 22.091 32.907 1.00 0.00 O ATOM 1137 NE2 GLN A 69 44.176 21.846 31.702 1.00 0.00 N ATOM 0 H GLN A 69 41.833 19.268 33.484 1.00 0.00 H new ATOM 0 HA GLN A 69 42.901 19.876 36.100 1.00 0.00 H new ATOM 0 HB2 GLN A 69 42.448 21.662 33.670 1.00 0.00 H new ATOM 0 HB3 GLN A 69 43.345 22.087 35.114 1.00 0.00 H new ATOM 0 HG2 GLN A 69 45.091 20.496 34.622 1.00 0.00 H new ATOM 0 HG3 GLN A 69 44.131 19.714 33.382 1.00 0.00 H new ATOM 0 HE21 GLN A 69 43.248 21.428 31.636 1.00 0.00 H new ATOM 0 HE22 GLN A 69 44.520 22.445 30.952 1.00 0.00 H new ATOM 1146 N GLU A 70 40.568 20.162 36.895 1.00 0.00 N ATOM 1147 CA GLU A 70 39.333 20.393 37.579 1.00 0.00 C ATOM 1148 C GLU A 70 39.246 21.722 38.246 1.00 0.00 C ATOM 1149 O GLU A 70 38.162 22.291 38.361 1.00 0.00 O ATOM 1150 CB GLU A 70 39.097 19.259 38.592 1.00 0.00 C ATOM 1151 CG GLU A 70 38.956 17.895 37.914 1.00 0.00 C ATOM 1152 CD GLU A 70 38.991 16.729 38.892 1.00 0.00 C ATOM 1153 OE1 GLU A 70 40.042 16.541 39.561 1.00 0.00 O ATOM 1154 OE2 GLU A 70 38.005 15.946 38.929 1.00 0.00 O ATOM 0 H GLU A 70 41.097 19.405 37.328 1.00 0.00 H new ATOM 0 HA GLU A 70 38.548 20.400 36.823 1.00 0.00 H new ATOM 0 HB2 GLU A 70 39.927 19.227 39.298 1.00 0.00 H new ATOM 0 HB3 GLU A 70 38.196 19.471 39.168 1.00 0.00 H new ATOM 0 HG2 GLU A 70 38.017 17.868 37.360 1.00 0.00 H new ATOM 0 HG3 GLU A 70 39.759 17.774 37.187 1.00 0.00 H new ATOM 1161 N ASP A 71 40.381 22.324 38.647 1.00 0.00 N ATOM 1162 CA ASP A 71 40.434 23.626 39.236 1.00 0.00 C ATOM 1163 C ASP A 71 39.924 24.690 38.327 1.00 0.00 C ATOM 1164 O ASP A 71 39.323 25.674 38.757 1.00 0.00 O ATOM 1165 CB ASP A 71 41.866 24.008 39.646 1.00 0.00 C ATOM 1166 CG ASP A 71 42.433 23.136 40.757 1.00 0.00 C ATOM 1167 OD1 ASP A 71 41.777 22.965 41.819 1.00 0.00 O ATOM 1168 OD2 ASP A 71 43.585 22.649 40.604 1.00 0.00 O ATOM 0 H ASP A 71 41.298 21.886 38.557 1.00 0.00 H new ATOM 0 HA ASP A 71 39.792 23.565 40.115 1.00 0.00 H new ATOM 0 HB2 ASP A 71 42.516 23.939 38.774 1.00 0.00 H new ATOM 0 HB3 ASP A 71 41.877 25.049 39.970 1.00 0.00 H new ATOM 1173 N LEU A 72 40.116 24.529 37.005 1.00 0.00 N ATOM 1174 CA LEU A 72 39.640 25.457 36.026 1.00 0.00 C ATOM 1175 C LEU A 72 38.168 25.378 35.817 1.00 0.00 C ATOM 1176 O LEU A 72 37.488 26.403 35.825 1.00 0.00 O ATOM 1177 CB LEU A 72 40.414 25.295 34.706 1.00 0.00 C ATOM 1178 CG LEU A 72 41.937 25.464 34.834 1.00 0.00 C ATOM 1179 CD1 LEU A 72 42.592 25.231 33.462 1.00 0.00 C ATOM 1180 CD2 LEU A 72 42.378 26.833 35.379 1.00 0.00 C ATOM 0 H LEU A 72 40.615 23.733 36.607 1.00 0.00 H new ATOM 0 HA LEU A 72 39.830 26.457 36.415 1.00 0.00 H new ATOM 0 HB2 LEU A 72 40.204 24.307 34.296 1.00 0.00 H new ATOM 0 HB3 LEU A 72 40.039 26.025 33.988 1.00 0.00 H new ATOM 0 HG LEU A 72 42.264 24.724 35.565 1.00 0.00 H new ATOM 0 HD11 LEU A 72 43.672 25.350 33.549 1.00 0.00 H new ATOM 0 HD12 LEU A 72 42.365 24.222 33.117 1.00 0.00 H new ATOM 0 HD13 LEU A 72 42.204 25.955 32.746 1.00 0.00 H new ATOM 0 HD21 LEU A 72 43.466 26.868 35.437 1.00 0.00 H new ATOM 0 HD22 LEU A 72 42.025 27.621 34.713 1.00 0.00 H new ATOM 0 HD23 LEU A 72 41.956 26.982 36.373 1.00 0.00 H new ATOM 1192 N LEU A 73 37.557 24.192 35.636 1.00 0.00 N ATOM 1193 CA LEU A 73 36.153 24.059 35.403 1.00 0.00 C ATOM 1194 C LEU A 73 35.323 24.345 36.607 1.00 0.00 C ATOM 1195 O LEU A 73 34.139 24.671 36.540 1.00 0.00 O ATOM 1196 CB LEU A 73 35.758 22.657 34.910 1.00 0.00 C ATOM 1197 CG LEU A 73 36.143 22.321 33.459 1.00 0.00 C ATOM 1198 CD1 LEU A 73 35.615 23.348 32.443 1.00 0.00 C ATOM 1199 CD2 LEU A 73 37.659 22.094 33.329 1.00 0.00 C ATOM 0 H LEU A 73 38.054 23.302 35.652 1.00 0.00 H new ATOM 0 HA LEU A 73 35.953 24.803 34.631 1.00 0.00 H new ATOM 0 HB2 LEU A 73 36.218 21.919 35.567 1.00 0.00 H new ATOM 0 HB3 LEU A 73 34.678 22.548 35.014 1.00 0.00 H new ATOM 0 HG LEU A 73 35.646 21.384 33.208 1.00 0.00 H new ATOM 0 HD11 LEU A 73 35.920 23.055 31.438 1.00 0.00 H new ATOM 0 HD12 LEU A 73 34.527 23.386 32.496 1.00 0.00 H new ATOM 0 HD13 LEU A 73 36.024 24.332 32.674 1.00 0.00 H new ATOM 0 HD21 LEU A 73 37.904 21.858 32.293 1.00 0.00 H new ATOM 0 HD22 LEU A 73 38.189 22.997 33.631 1.00 0.00 H new ATOM 0 HD23 LEU A 73 37.959 21.266 33.971 1.00 0.00 H new ATOM 1211 N SER A 74 35.965 24.274 37.786 1.00 0.00 N ATOM 1212 CA SER A 74 35.443 24.700 39.048 1.00 0.00 C ATOM 1213 C SER A 74 35.199 26.170 39.047 1.00 0.00 C ATOM 1214 O SER A 74 34.093 26.643 39.301 1.00 0.00 O ATOM 1215 CB SER A 74 36.348 24.297 40.225 1.00 0.00 C ATOM 1216 OG SER A 74 35.785 24.621 41.488 1.00 0.00 O ATOM 0 H SER A 74 36.909 23.895 37.863 1.00 0.00 H new ATOM 0 HA SER A 74 34.492 24.186 39.190 1.00 0.00 H new ATOM 0 HB2 SER A 74 36.537 23.224 40.181 1.00 0.00 H new ATOM 0 HB3 SER A 74 37.312 24.795 40.123 1.00 0.00 H new ATOM 0 HG SER A 74 36.398 24.343 42.200 1.00 0.00 H new ATOM 1222 N GLU A 75 36.223 26.961 38.679 1.00 0.00 N ATOM 1223 CA GLU A 75 36.172 28.381 38.526 1.00 0.00 C ATOM 1224 C GLU A 75 35.333 28.858 37.390 1.00 0.00 C ATOM 1225 O GLU A 75 34.830 29.981 37.417 1.00 0.00 O ATOM 1226 CB GLU A 75 37.627 28.868 38.428 1.00 0.00 C ATOM 1227 CG GLU A 75 37.792 30.323 38.872 1.00 0.00 C ATOM 1228 CD GLU A 75 39.237 30.731 39.121 1.00 0.00 C ATOM 1229 OE1 GLU A 75 39.917 30.045 39.931 1.00 0.00 O ATOM 1230 OE2 GLU A 75 39.699 31.765 38.568 1.00 0.00 O ATOM 0 H GLU A 75 37.148 26.582 38.475 1.00 0.00 H new ATOM 0 HA GLU A 75 35.667 28.811 39.391 1.00 0.00 H new ATOM 0 HB2 GLU A 75 38.262 28.230 39.043 1.00 0.00 H new ATOM 0 HB3 GLU A 75 37.972 28.765 37.399 1.00 0.00 H new ATOM 0 HG2 GLU A 75 37.366 30.976 38.110 1.00 0.00 H new ATOM 0 HG3 GLU A 75 37.217 30.482 39.785 1.00 0.00 H new ATOM 1237 N PHE A 76 35.059 28.001 36.390 1.00 0.00 N ATOM 1238 CA PHE A 76 34.119 28.246 35.341 1.00 0.00 C ATOM 1239 C PHE A 76 32.722 28.328 35.852 1.00 0.00 C ATOM 1240 O PHE A 76 31.856 29.005 35.298 1.00 0.00 O ATOM 1241 CB PHE A 76 34.232 27.115 34.304 1.00 0.00 C ATOM 1242 CG PHE A 76 33.687 27.364 32.941 1.00 0.00 C ATOM 1243 CD1 PHE A 76 32.368 27.095 32.659 1.00 0.00 C ATOM 1244 CD2 PHE A 76 34.522 27.695 31.899 1.00 0.00 C ATOM 1245 CE1 PHE A 76 31.905 27.108 31.364 1.00 0.00 C ATOM 1246 CE2 PHE A 76 34.065 27.747 30.604 1.00 0.00 C ATOM 1247 CZ PHE A 76 32.753 27.431 30.332 1.00 0.00 C ATOM 0 H PHE A 76 35.516 27.093 36.310 1.00 0.00 H new ATOM 0 HA PHE A 76 34.353 29.208 34.886 1.00 0.00 H new ATOM 0 HB2 PHE A 76 35.287 26.859 34.201 1.00 0.00 H new ATOM 0 HB3 PHE A 76 33.729 26.237 34.710 1.00 0.00 H new ATOM 0 HD1 PHE A 76 31.686 26.870 33.466 1.00 0.00 H new ATOM 0 HD2 PHE A 76 35.559 27.919 32.103 1.00 0.00 H new ATOM 0 HE1 PHE A 76 30.873 26.864 31.158 1.00 0.00 H new ATOM 0 HE2 PHE A 76 34.731 28.034 29.804 1.00 0.00 H new ATOM 0 HZ PHE A 76 32.392 27.437 29.314 1.00 0.00 H new ATOM 1257 N GLY A 77 32.443 27.641 36.974 1.00 0.00 N ATOM 1258 CA GLY A 77 31.140 27.418 37.519 1.00 0.00 C ATOM 1259 C GLY A 77 30.504 28.576 38.207 1.00 0.00 C ATOM 1260 O GLY A 77 29.281 28.595 38.334 1.00 0.00 O ATOM 0 H GLY A 77 33.178 27.213 37.537 1.00 0.00 H new ATOM 0 HA2 GLY A 77 30.482 27.097 36.712 1.00 0.00 H new ATOM 0 HA3 GLY A 77 31.202 26.592 38.227 1.00 0.00 H new ATOM 1264 N GLN A 78 31.266 29.581 38.672 1.00 0.00 N ATOM 1265 CA GLN A 78 30.704 30.699 39.364 1.00 0.00 C ATOM 1266 C GLN A 78 30.022 31.659 38.449 1.00 0.00 C ATOM 1267 O GLN A 78 29.151 32.433 38.841 1.00 0.00 O ATOM 1268 CB GLN A 78 31.778 31.432 40.184 1.00 0.00 C ATOM 1269 CG GLN A 78 32.893 32.108 39.384 1.00 0.00 C ATOM 1270 CD GLN A 78 33.987 32.689 40.268 1.00 0.00 C ATOM 1271 OE1 GLN A 78 33.758 33.258 41.334 1.00 0.00 O ATOM 1272 NE2 GLN A 78 35.254 32.563 39.791 1.00 0.00 N ATOM 0 H GLN A 78 32.280 29.619 38.568 1.00 0.00 H new ATOM 0 HA GLN A 78 29.947 30.295 40.037 1.00 0.00 H new ATOM 0 HB2 GLN A 78 31.286 32.190 40.794 1.00 0.00 H new ATOM 0 HB3 GLN A 78 32.233 30.717 40.870 1.00 0.00 H new ATOM 0 HG2 GLN A 78 33.333 31.383 38.699 1.00 0.00 H new ATOM 0 HG3 GLN A 78 32.465 32.903 38.774 1.00 0.00 H new ATOM 0 HE21 GLN A 78 35.420 32.087 38.904 1.00 0.00 H new ATOM 0 HE22 GLN A 78 36.038 32.944 40.320 1.00 0.00 H new ATOM 1466 N ASN B 201 27.962 35.979 33.338 1.00 0.00 N ATOM 1467 CA ASN B 201 27.502 34.897 32.525 1.00 0.00 C ATOM 1468 C ASN B 201 28.736 34.481 31.800 1.00 0.00 C ATOM 1469 O ASN B 201 29.821 34.972 32.111 1.00 0.00 O ATOM 1470 CB ASN B 201 26.330 35.241 31.590 1.00 0.00 C ATOM 1471 CG ASN B 201 25.623 34.010 31.043 1.00 0.00 C ATOM 1472 OD1 ASN B 201 25.960 32.871 31.362 1.00 0.00 O ATOM 1473 ND2 ASN B 201 24.627 34.225 30.142 1.00 0.00 N ATOM 0 HA ASN B 201 27.061 34.099 33.123 1.00 0.00 H new ATOM 0 HB2 ASN B 201 25.610 35.856 32.130 1.00 0.00 H new ATOM 0 HB3 ASN B 201 26.700 35.840 30.758 1.00 0.00 H new ATOM 0 HD21 ASN B 201 24.144 33.433 29.717 1.00 0.00 H new ATOM 0 HD22 ASN B 201 24.363 35.178 29.891 1.00 0.00 H new ATOM 1480 N ILE B 202 28.658 33.598 30.788 1.00 0.00 N ATOM 1481 CA ILE B 202 29.733 33.194 29.936 1.00 0.00 C ATOM 1482 C ILE B 202 30.319 34.304 29.133 1.00 0.00 C ATOM 1483 O ILE B 202 31.506 34.301 28.807 1.00 0.00 O ATOM 1484 CB ILE B 202 29.368 31.982 29.133 1.00 0.00 C ATOM 1485 CG1 ILE B 202 29.640 30.705 29.946 1.00 0.00 C ATOM 1486 CG2 ILE B 202 29.993 31.922 27.729 1.00 0.00 C ATOM 1487 CD1 ILE B 202 31.103 30.310 30.141 1.00 0.00 C ATOM 0 H ILE B 202 27.781 33.135 30.550 1.00 0.00 H new ATOM 0 HA ILE B 202 30.554 32.896 30.589 1.00 0.00 H new ATOM 0 HB ILE B 202 28.299 32.061 28.937 1.00 0.00 H new ATOM 0 HG12 ILE B 202 29.187 30.826 30.930 1.00 0.00 H new ATOM 0 HG13 ILE B 202 29.127 29.876 29.458 1.00 0.00 H new ATOM 0 HG21 ILE B 202 29.671 31.010 27.226 1.00 0.00 H new ATOM 0 HG22 ILE B 202 29.672 32.788 27.151 1.00 0.00 H new ATOM 0 HG23 ILE B 202 31.080 31.925 27.814 1.00 0.00 H new ATOM 0 HD11 ILE B 202 31.157 29.394 30.730 1.00 0.00 H new ATOM 0 HD12 ILE B 202 31.568 30.145 29.169 1.00 0.00 H new ATOM 0 HD13 ILE B 202 31.629 31.109 30.663 1.00 0.00 H new ATOM 1499 N GLN B 203 29.528 35.351 28.836 1.00 0.00 N ATOM 1500 CA GLN B 203 29.902 36.519 28.102 1.00 0.00 C ATOM 1501 C GLN B 203 31.164 37.204 28.498 1.00 0.00 C ATOM 1502 O GLN B 203 31.910 37.692 27.650 1.00 0.00 O ATOM 1503 CB GLN B 203 28.741 37.526 28.064 1.00 0.00 C ATOM 1504 CG GLN B 203 28.348 38.176 29.392 1.00 0.00 C ATOM 1505 CD GLN B 203 27.082 38.994 29.182 1.00 0.00 C ATOM 1506 OE1 GLN B 203 26.089 38.482 28.667 1.00 0.00 O ATOM 1507 NE2 GLN B 203 27.098 40.300 29.561 1.00 0.00 N ATOM 0 H GLN B 203 28.553 35.381 29.133 1.00 0.00 H new ATOM 0 HA GLN B 203 30.125 36.127 27.110 1.00 0.00 H new ATOM 0 HB2 GLN B 203 29.001 38.318 27.362 1.00 0.00 H new ATOM 0 HB3 GLN B 203 27.864 37.019 27.661 1.00 0.00 H new ATOM 0 HG2 GLN B 203 28.182 37.412 30.152 1.00 0.00 H new ATOM 0 HG3 GLN B 203 29.154 38.814 29.753 1.00 0.00 H new ATOM 0 HE21 GLN B 203 27.936 40.698 29.986 1.00 0.00 H new ATOM 0 HE22 GLN B 203 26.272 40.882 29.421 1.00 0.00 H new ATOM 1516 N MET B 204 31.483 37.197 29.805 1.00 0.00 N ATOM 1517 CA MET B 204 32.716 37.618 30.395 1.00 0.00 C ATOM 1518 C MET B 204 33.952 37.133 29.720 1.00 0.00 C ATOM 1519 O MET B 204 34.909 37.887 29.547 1.00 0.00 O ATOM 1520 CB MET B 204 32.753 37.134 31.854 1.00 0.00 C ATOM 1521 CG MET B 204 32.557 38.250 32.883 1.00 0.00 C ATOM 1522 SD MET B 204 30.893 38.980 32.937 1.00 0.00 S ATOM 1523 CE MET B 204 31.398 40.127 34.252 1.00 0.00 C ATOM 0 H MET B 204 30.820 36.868 30.507 1.00 0.00 H new ATOM 0 HA MET B 204 32.726 38.704 30.298 1.00 0.00 H new ATOM 0 HB2 MET B 204 31.977 36.381 31.997 1.00 0.00 H new ATOM 0 HB3 MET B 204 33.709 36.645 32.040 1.00 0.00 H new ATOM 0 HG2 MET B 204 32.794 37.855 33.871 1.00 0.00 H new ATOM 0 HG3 MET B 204 33.276 39.042 32.675 1.00 0.00 H new ATOM 0 HE1 MET B 204 30.558 40.302 34.924 1.00 0.00 H new ATOM 0 HE2 MET B 204 32.228 39.696 34.812 1.00 0.00 H new ATOM 0 HE3 MET B 204 31.712 41.072 33.809 1.00 0.00 H new ATOM 1533 N LEU B 205 34.001 35.854 29.308 1.00 0.00 N ATOM 1534 CA LEU B 205 35.192 35.241 28.808 1.00 0.00 C ATOM 1535 C LEU B 205 35.672 35.726 27.483 1.00 0.00 C ATOM 1536 O LEU B 205 36.871 35.744 27.209 1.00 0.00 O ATOM 1537 CB LEU B 205 35.083 33.707 28.794 1.00 0.00 C ATOM 1538 CG LEU B 205 35.230 33.038 30.170 1.00 0.00 C ATOM 1539 CD1 LEU B 205 34.999 31.521 30.073 1.00 0.00 C ATOM 1540 CD2 LEU B 205 36.607 33.311 30.798 1.00 0.00 C ATOM 0 H LEU B 205 33.194 35.231 29.323 1.00 0.00 H new ATOM 0 HA LEU B 205 35.951 35.558 29.523 1.00 0.00 H new ATOM 0 HB2 LEU B 205 34.117 33.429 28.372 1.00 0.00 H new ATOM 0 HB3 LEU B 205 35.848 33.308 28.128 1.00 0.00 H new ATOM 0 HG LEU B 205 34.468 33.476 30.815 1.00 0.00 H new ATOM 0 HD11 LEU B 205 35.109 31.072 31.060 1.00 0.00 H new ATOM 0 HD12 LEU B 205 33.994 31.329 29.697 1.00 0.00 H new ATOM 0 HD13 LEU B 205 35.730 31.084 29.393 1.00 0.00 H new ATOM 0 HD21 LEU B 205 36.668 32.820 31.769 1.00 0.00 H new ATOM 0 HD22 LEU B 205 37.388 32.922 30.145 1.00 0.00 H new ATOM 0 HD23 LEU B 205 36.742 34.385 30.925 1.00 0.00 H new ATOM 1552 N LEU B 206 34.736 36.185 26.633 1.00 0.00 N ATOM 1553 CA LEU B 206 35.007 36.734 25.342 1.00 0.00 C ATOM 1554 C LEU B 206 35.506 38.133 25.465 1.00 0.00 C ATOM 1555 O LEU B 206 36.267 38.621 24.630 1.00 0.00 O ATOM 1556 CB LEU B 206 33.695 36.665 24.542 1.00 0.00 C ATOM 1557 CG LEU B 206 33.139 35.244 24.352 1.00 0.00 C ATOM 1558 CD1 LEU B 206 34.241 34.292 23.858 1.00 0.00 C ATOM 1559 CD2 LEU B 206 32.377 34.643 25.545 1.00 0.00 C ATOM 0 H LEU B 206 33.741 36.172 26.858 1.00 0.00 H new ATOM 0 HA LEU B 206 35.787 36.172 24.828 1.00 0.00 H new ATOM 0 HB2 LEU B 206 32.943 37.271 25.048 1.00 0.00 H new ATOM 0 HB3 LEU B 206 33.858 37.112 23.561 1.00 0.00 H new ATOM 0 HG LEU B 206 32.369 35.357 23.589 1.00 0.00 H new ATOM 0 HD11 LEU B 206 33.827 33.292 23.730 1.00 0.00 H new ATOM 0 HD12 LEU B 206 34.629 34.649 22.904 1.00 0.00 H new ATOM 0 HD13 LEU B 206 35.049 34.260 24.589 1.00 0.00 H new ATOM 0 HD21 LEU B 206 32.035 33.640 25.290 1.00 0.00 H new ATOM 0 HD22 LEU B 206 33.038 34.592 26.410 1.00 0.00 H new ATOM 0 HD23 LEU B 206 31.518 35.271 25.781 1.00 0.00 H new ATOM 1571 N GLU B 207 35.124 38.827 26.551 1.00 0.00 N ATOM 1572 CA GLU B 207 35.552 40.164 26.829 1.00 0.00 C ATOM 1573 C GLU B 207 36.908 40.143 27.448 1.00 0.00 C ATOM 1574 O GLU B 207 37.828 40.827 27.004 1.00 0.00 O ATOM 1575 CB GLU B 207 34.565 40.864 27.778 1.00 0.00 C ATOM 1576 CG GLU B 207 33.305 41.423 27.113 1.00 0.00 C ATOM 1577 CD GLU B 207 33.539 42.760 26.427 1.00 0.00 C ATOM 1578 OE1 GLU B 207 34.187 43.652 27.037 1.00 0.00 O ATOM 1579 OE2 GLU B 207 33.053 42.963 25.282 1.00 0.00 O ATOM 0 H GLU B 207 34.497 38.446 27.259 1.00 0.00 H new ATOM 0 HA GLU B 207 35.587 40.716 25.890 1.00 0.00 H new ATOM 0 HB2 GLU B 207 34.265 40.156 28.551 1.00 0.00 H new ATOM 0 HB3 GLU B 207 35.085 41.681 28.279 1.00 0.00 H new ATOM 0 HG2 GLU B 207 32.938 40.704 26.380 1.00 0.00 H new ATOM 0 HG3 GLU B 207 32.524 41.538 27.865 1.00 0.00 H new ATOM 1586 N ALA B 208 37.084 39.314 28.492 1.00 0.00 N ATOM 1587 CA ALA B 208 38.306 39.118 29.208 1.00 0.00 C ATOM 1588 C ALA B 208 39.445 38.670 28.358 1.00 0.00 C ATOM 1589 O ALA B 208 40.566 39.147 28.526 1.00 0.00 O ATOM 1590 CB ALA B 208 38.061 38.130 30.362 1.00 0.00 C ATOM 0 H ALA B 208 36.322 38.744 28.859 1.00 0.00 H new ATOM 0 HA ALA B 208 38.607 40.091 29.596 1.00 0.00 H new ATOM 0 HB1 ALA B 208 38.989 37.976 30.912 1.00 0.00 H new ATOM 0 HB2 ALA B 208 37.304 38.535 31.033 1.00 0.00 H new ATOM 0 HB3 ALA B 208 37.716 37.178 29.959 1.00 0.00 H new ATOM 1596 N ALA B 209 39.201 37.783 27.377 1.00 0.00 N ATOM 1597 CA ALA B 209 40.170 37.388 26.402 1.00 0.00 C ATOM 1598 C ALA B 209 40.624 38.489 25.505 1.00 0.00 C ATOM 1599 O ALA B 209 41.825 38.725 25.381 1.00 0.00 O ATOM 1600 CB ALA B 209 39.604 36.245 25.544 1.00 0.00 C ATOM 0 H ALA B 209 38.298 37.325 27.258 1.00 0.00 H new ATOM 0 HA ALA B 209 41.046 37.068 26.967 1.00 0.00 H new ATOM 0 HB1 ALA B 209 40.344 35.946 24.802 1.00 0.00 H new ATOM 0 HB2 ALA B 209 39.366 35.394 26.182 1.00 0.00 H new ATOM 0 HB3 ALA B 209 38.700 36.583 25.038 1.00 0.00 H new ATOM 1606 N ASP B 210 39.707 39.243 24.875 1.00 0.00 N ATOM 1607 CA ASP B 210 40.038 40.339 24.018 1.00 0.00 C ATOM 1608 C ASP B 210 40.766 41.426 24.729 1.00 0.00 C ATOM 1609 O ASP B 210 41.717 42.004 24.202 1.00 0.00 O ATOM 1610 CB ASP B 210 38.772 40.907 23.355 1.00 0.00 C ATOM 1611 CG ASP B 210 38.354 40.212 22.067 1.00 0.00 C ATOM 1612 OD1 ASP B 210 39.173 39.503 21.425 1.00 0.00 O ATOM 1613 OD2 ASP B 210 37.185 40.424 21.646 1.00 0.00 O ATOM 0 H ASP B 210 38.703 39.086 24.964 1.00 0.00 H new ATOM 0 HA ASP B 210 40.708 39.945 23.254 1.00 0.00 H new ATOM 0 HB2 ASP B 210 37.949 40.846 24.067 1.00 0.00 H new ATOM 0 HB3 ASP B 210 38.934 41.964 23.144 1.00 0.00 H new ATOM 1618 N TYR B 211 40.384 41.721 25.985 1.00 0.00 N ATOM 1619 CA TYR B 211 41.065 42.579 26.904 1.00 0.00 C ATOM 1620 C TYR B 211 42.469 42.162 27.177 1.00 0.00 C ATOM 1621 O TYR B 211 43.407 42.944 27.031 1.00 0.00 O ATOM 1622 CB TYR B 211 40.212 42.634 28.182 1.00 0.00 C ATOM 1623 CG TYR B 211 40.837 43.308 29.354 1.00 0.00 C ATOM 1624 CD1 TYR B 211 40.906 44.679 29.440 1.00 0.00 C ATOM 1625 CD2 TYR B 211 41.347 42.541 30.375 1.00 0.00 C ATOM 1626 CE1 TYR B 211 41.451 45.277 30.553 1.00 0.00 C ATOM 1627 CE2 TYR B 211 41.869 43.134 31.501 1.00 0.00 C ATOM 1628 CZ TYR B 211 41.912 44.505 31.593 1.00 0.00 C ATOM 1629 OH TYR B 211 42.415 45.132 32.753 1.00 0.00 O ATOM 0 H TYR B 211 39.533 41.328 26.387 1.00 0.00 H new ATOM 0 HA TYR B 211 41.169 43.572 26.467 1.00 0.00 H new ATOM 0 HB2 TYR B 211 39.277 43.145 27.950 1.00 0.00 H new ATOM 0 HB3 TYR B 211 39.955 41.614 28.468 1.00 0.00 H new ATOM 0 HD1 TYR B 211 40.531 45.288 28.631 1.00 0.00 H new ATOM 0 HD2 TYR B 211 41.338 41.464 30.292 1.00 0.00 H new ATOM 0 HE1 TYR B 211 41.517 46.354 30.610 1.00 0.00 H new ATOM 0 HE2 TYR B 211 42.244 42.525 32.310 1.00 0.00 H new ATOM 0 HH TYR B 211 42.700 44.450 33.396 1.00 0.00 H new ATOM 1639 N LEU B 212 42.706 40.903 27.585 1.00 0.00 N ATOM 1640 CA LEU B 212 44.009 40.422 27.926 1.00 0.00 C ATOM 1641 C LEU B 212 44.962 40.344 26.783 1.00 0.00 C ATOM 1642 O LEU B 212 46.156 40.586 26.954 1.00 0.00 O ATOM 1643 CB LEU B 212 43.905 39.090 28.686 1.00 0.00 C ATOM 1644 CG LEU B 212 43.987 39.233 30.216 1.00 0.00 C ATOM 1645 CD1 LEU B 212 43.540 37.896 30.830 1.00 0.00 C ATOM 1646 CD2 LEU B 212 45.383 39.640 30.715 1.00 0.00 C ATOM 0 H LEU B 212 41.973 40.201 27.680 1.00 0.00 H new ATOM 0 HA LEU B 212 44.446 41.173 28.584 1.00 0.00 H new ATOM 0 HB2 LEU B 212 42.962 38.608 28.427 1.00 0.00 H new ATOM 0 HB3 LEU B 212 44.704 38.429 28.350 1.00 0.00 H new ATOM 0 HG LEU B 212 43.331 40.045 30.530 1.00 0.00 H new ATOM 0 HD11 LEU B 212 43.586 37.961 31.917 1.00 0.00 H new ATOM 0 HD12 LEU B 212 42.517 37.678 30.522 1.00 0.00 H new ATOM 0 HD13 LEU B 212 44.200 37.099 30.486 1.00 0.00 H new ATOM 0 HD21 LEU B 212 45.371 39.723 31.802 1.00 0.00 H new ATOM 0 HD22 LEU B 212 46.110 38.885 30.417 1.00 0.00 H new ATOM 0 HD23 LEU B 212 45.659 40.601 30.281 1.00 0.00 H new ATOM 1658 N GLU B 213 44.485 40.095 25.550 1.00 0.00 N ATOM 1659 CA GLU B 213 45.284 40.206 24.369 1.00 0.00 C ATOM 1660 C GLU B 213 45.803 41.576 24.100 1.00 0.00 C ATOM 1661 O GLU B 213 46.856 41.740 23.485 1.00 0.00 O ATOM 1662 CB GLU B 213 44.586 39.716 23.090 1.00 0.00 C ATOM 1663 CG GLU B 213 44.291 38.215 23.049 1.00 0.00 C ATOM 1664 CD GLU B 213 44.095 37.699 21.630 1.00 0.00 C ATOM 1665 OE1 GLU B 213 43.467 38.408 20.800 1.00 0.00 O ATOM 1666 OE2 GLU B 213 44.585 36.582 21.313 1.00 0.00 O ATOM 0 H GLU B 213 43.522 39.810 25.370 1.00 0.00 H new ATOM 0 HA GLU B 213 46.120 39.547 24.604 1.00 0.00 H new ATOM 0 HB2 GLU B 213 43.648 40.259 22.975 1.00 0.00 H new ATOM 0 HB3 GLU B 213 45.209 39.972 22.233 1.00 0.00 H new ATOM 0 HG2 GLU B 213 45.112 37.673 23.519 1.00 0.00 H new ATOM 0 HG3 GLU B 213 43.395 38.008 23.635 1.00 0.00 H new ATOM 1673 N ARG B 214 45.118 42.640 24.557 1.00 0.00 N ATOM 1674 CA ARG B 214 45.597 43.984 24.466 1.00 0.00 C ATOM 1675 C ARG B 214 46.759 44.215 25.370 1.00 0.00 C ATOM 1676 O ARG B 214 47.744 44.841 24.984 1.00 0.00 O ATOM 1677 CB ARG B 214 44.511 45.026 24.780 1.00 0.00 C ATOM 1678 CG ARG B 214 43.338 45.009 23.799 1.00 0.00 C ATOM 1679 CD ARG B 214 42.098 45.757 24.294 1.00 0.00 C ATOM 1680 NE ARG B 214 42.438 47.205 24.366 1.00 0.00 N ATOM 1681 CZ ARG B 214 41.655 48.153 24.960 1.00 0.00 C ATOM 1682 NH1 ARG B 214 40.405 47.896 25.446 1.00 0.00 N ATOM 1683 NH2 ARG B 214 42.141 49.424 25.062 1.00 0.00 N ATOM 0 H ARG B 214 44.204 42.563 25.003 1.00 0.00 H new ATOM 0 HA ARG B 214 45.907 44.111 23.429 1.00 0.00 H new ATOM 0 HB2 ARG B 214 44.133 44.851 25.787 1.00 0.00 H new ATOM 0 HB3 ARG B 214 44.961 46.019 24.777 1.00 0.00 H new ATOM 0 HG2 ARG B 214 43.661 45.448 22.855 1.00 0.00 H new ATOM 0 HG3 ARG B 214 43.066 43.974 23.592 1.00 0.00 H new ATOM 0 HD2 ARG B 214 41.259 45.595 23.618 1.00 0.00 H new ATOM 0 HD3 ARG B 214 41.794 45.387 25.273 1.00 0.00 H new ATOM 0 HE ARG B 214 43.315 47.509 23.943 1.00 0.00 H new ATOM 0 HH11 ARG B 214 40.013 46.957 25.374 1.00 0.00 H new ATOM 0 HH12 ARG B 214 39.863 48.643 25.881 1.00 0.00 H new ATOM 0 HH21 ARG B 214 43.068 49.646 24.699 1.00 0.00 H new ATOM 0 HH22 ARG B 214 41.577 50.152 25.501 1.00 0.00 H new ATOM 1697 N ARG B 215 46.715 43.673 26.601 1.00 0.00 N ATOM 1698 CA ARG B 215 47.754 43.787 27.576 1.00 0.00 C ATOM 1699 C ARG B 215 49.048 43.177 27.164 1.00 0.00 C ATOM 1700 O ARG B 215 50.117 43.664 27.530 1.00 0.00 O ATOM 1701 CB ARG B 215 47.328 43.249 28.954 1.00 0.00 C ATOM 1702 CG ARG B 215 46.033 43.868 29.485 1.00 0.00 C ATOM 1703 CD ARG B 215 45.879 43.862 31.008 1.00 0.00 C ATOM 1704 NE ARG B 215 46.808 44.898 31.540 1.00 0.00 N ATOM 1705 CZ ARG B 215 46.655 45.562 32.722 1.00 0.00 C ATOM 1706 NH1 ARG B 215 45.749 45.191 33.673 1.00 0.00 N ATOM 1707 NH2 ARG B 215 47.458 46.642 32.955 1.00 0.00 N ATOM 0 H ARG B 215 45.917 43.130 26.931 1.00 0.00 H new ATOM 0 HA ARG B 215 47.926 44.860 27.658 1.00 0.00 H new ATOM 0 HB2 ARG B 215 47.203 42.168 28.889 1.00 0.00 H new ATOM 0 HB3 ARG B 215 48.129 43.435 29.670 1.00 0.00 H new ATOM 0 HG2 ARG B 215 45.972 44.898 29.135 1.00 0.00 H new ATOM 0 HG3 ARG B 215 45.189 43.333 29.049 1.00 0.00 H new ATOM 0 HD2 ARG B 215 44.850 44.082 31.293 1.00 0.00 H new ATOM 0 HD3 ARG B 215 46.120 42.881 31.417 1.00 0.00 H new ATOM 0 HE ARG B 215 47.625 45.130 30.975 1.00 0.00 H new ATOM 0 HH11 ARG B 215 45.147 44.383 33.516 1.00 0.00 H new ATOM 0 HH12 ARG B 215 45.674 45.722 34.541 1.00 0.00 H new ATOM 0 HH21 ARG B 215 48.144 46.928 32.256 1.00 0.00 H new ATOM 0 HH22 ARG B 215 47.372 47.163 33.828 1.00 0.00 H new