USER MOD reduce.3.24.130724 H: found=0, std=0, add=1056, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1056 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 120 SER OG : rot 28:sc= 0.21 USER MOD Set 1.2: A 124 GLN : amide:sc= -0.743 K(o=-0.53,f=-1.6) USER MOD Set 2.1: A 116 LYS NZ :NH3+ -125:sc= -4.39! (180deg=-1.62!) USER MOD Set 2.2: A 118 GLN :FLIP amide:sc= -5.9! C(o=-15!,f=-10!) USER MOD Set 3.1: A 13 MET CE :methyl 169:sc= -0.0219 (180deg=-0.2) USER MOD Set 3.2: A 32 THR OG1 : rot 130:sc= 0.903 USER MOD Single : A 10 TYR OH : rot 180:sc= 0 USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 SER OG : rot -94:sc= 0.994 USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 17 ASN : amide:sc= -0.0525 K(o=-0.052,f=-1.4) USER MOD Single : A 20 ASN : amide:sc= -0.769 K(o=-0.77,f=-1.8) USER MOD Single : A 24 SER OG : rot -148:sc= -4.01! USER MOD Single : A 25 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 26 GLN : amide:sc= -0.136 K(o=-0.14,f=-2!) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 SER OG : rot 150:sc= -1.32 USER MOD Single : A 33 THR OG1 : rot 180:sc= -1.1 USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 36 ASN : amide:sc= -9.38! C(o=-9.4!,f=-10!) USER MOD Single : A 39 LYS NZ :NH3+ -151:sc= -0.887 (180deg=-2.11!) USER MOD Single : A 41 ASN : amide:sc= -7.53! C(o=-7.5!,f=-12!) USER MOD Single : A 47 SER OG : rot 120:sc= 0.167 USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 57 GLN : amide:sc= -3.1! C(o=-3.1!,f=-3.3!) USER MOD Single : A 61 HIS : no HE2:sc= 0.178 K(o=0.18,f=-2.5!) USER MOD Single : A 63 GLN : amide:sc= -2.03 K(o=-2,f=-2.7!) USER MOD Single : A 66 SER OG : rot 108:sc= 0.857 USER MOD Single : A 68 MET CE :methyl 174:sc= -0.928 (180deg=-1.03) USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 76 LYS NZ :NH3+ -117:sc= -1.76 (180deg=-4.99!) USER MOD Single : A 77 SER OG : rot 180:sc=0.000314 USER MOD Single : A 78 GLN : amide:sc= -0.581 K(o=-0.58,f=-5.4!) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 102 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 105 HIS : no HE2:sc= -0.41 K(o=-0.41,f=-5.8!) USER MOD Single : A 106 HIS : no HD1:sc= -4.98! C(o=-5!,f=-7.9!) USER MOD Single : A 109 ASN : amide:sc= -1.62 K(o=-1.6,f=-5.9!) USER MOD Single : A 112 ASN :FLIP amide:sc= -0.514 F(o=-1,f=-0.51) USER MOD Single : A 114 ASN : amide:sc= -1.51 K(o=-1.5,f=-2) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 133 GLN :FLIP amide:sc= -2.23 F(o=-2.9!,f=-2.2) USER MOD Single : A 136 GLN : amide:sc= -2.19! C(o=-2.2!,f=-2.4!) USER MOD ----------------------------------------------------------------- ATOM 59 N GLY A 7 -14.406 -7.540 3.381 1.00 0.00 N ATOM 60 CA GLY A 7 -13.799 -7.150 2.122 1.00 0.00 C ATOM 61 C GLY A 7 -12.315 -6.872 2.254 1.00 0.00 C ATOM 62 O GLY A 7 -11.718 -7.135 3.299 1.00 0.00 O ATOM 0 HA2 GLY A 7 -13.953 -7.941 1.388 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -14.300 -6.260 1.741 1.00 0.00 H new ATOM 66 N VAL A 8 -11.716 -6.342 1.193 1.00 0.00 N ATOM 67 CA VAL A 8 -10.292 -6.029 1.195 1.00 0.00 C ATOM 68 C VAL A 8 -10.020 -4.711 1.911 1.00 0.00 C ATOM 69 O VAL A 8 -10.862 -3.812 1.920 1.00 0.00 O ATOM 70 CB VAL A 8 -9.734 -5.947 -0.238 1.00 0.00 C ATOM 71 CG1 VAL A 8 -10.683 -5.172 -1.138 1.00 0.00 C ATOM 72 CG2 VAL A 8 -8.351 -5.312 -0.235 1.00 0.00 C ATOM 0 H VAL A 8 -12.195 -6.120 0.320 1.00 0.00 H new ATOM 0 HA VAL A 8 -9.791 -6.838 1.727 1.00 0.00 H new ATOM 0 HB VAL A 8 -9.644 -6.959 -0.632 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -10.271 -5.125 -2.146 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -11.650 -5.673 -1.164 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -10.809 -4.161 -0.750 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -7.971 -5.262 -1.256 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -8.414 -4.306 0.179 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -7.676 -5.913 0.374 1.00 0.00 H new ATOM 82 N ARG A 9 -8.839 -4.602 2.510 1.00 0.00 N ATOM 83 CA ARG A 9 -8.455 -3.393 3.229 1.00 0.00 C ATOM 84 C ARG A 9 -7.508 -2.539 2.391 1.00 0.00 C ATOM 85 O ARG A 9 -7.126 -2.921 1.285 1.00 0.00 O ATOM 86 CB ARG A 9 -7.792 -3.754 4.559 1.00 0.00 C ATOM 87 CG ARG A 9 -8.633 -4.675 5.428 1.00 0.00 C ATOM 88 CD ARG A 9 -9.540 -3.887 6.361 1.00 0.00 C ATOM 89 NE ARG A 9 -10.660 -4.690 6.843 1.00 0.00 N ATOM 90 CZ ARG A 9 -11.432 -4.337 7.865 1.00 0.00 C ATOM 91 NH1 ARG A 9 -11.204 -3.201 8.510 1.00 0.00 N ATOM 92 NH2 ARG A 9 -12.433 -5.121 8.244 1.00 0.00 N ATOM 0 H ARG A 9 -8.131 -5.336 2.512 1.00 0.00 H new ATOM 0 HA ARG A 9 -9.358 -2.816 3.426 1.00 0.00 H new ATOM 0 HB2 ARG A 9 -6.833 -4.232 4.359 1.00 0.00 H new ATOM 0 HB3 ARG A 9 -7.583 -2.838 5.111 1.00 0.00 H new ATOM 0 HG2 ARG A 9 -9.237 -5.324 4.794 1.00 0.00 H new ATOM 0 HG3 ARG A 9 -7.979 -5.321 6.014 1.00 0.00 H new ATOM 0 HD2 ARG A 9 -8.960 -3.526 7.211 1.00 0.00 H new ATOM 0 HD3 ARG A 9 -9.921 -3.009 5.840 1.00 0.00 H new ATOM 0 HE ARG A 9 -10.861 -5.571 6.369 1.00 0.00 H new ATOM 0 HH11 ARG A 9 -10.435 -2.596 8.222 1.00 0.00 H new ATOM 0 HH12 ARG A 9 -11.798 -2.932 9.294 1.00 0.00 H new ATOM 0 HH21 ARG A 9 -12.611 -5.996 7.751 1.00 0.00 H new ATOM 0 HH22 ARG A 9 -13.025 -4.849 9.029 1.00 0.00 H new ATOM 106 N TYR A 10 -7.133 -1.383 2.927 1.00 0.00 N ATOM 107 CA TYR A 10 -6.232 -0.473 2.228 1.00 0.00 C ATOM 108 C TYR A 10 -5.220 0.139 3.191 1.00 0.00 C ATOM 109 O TYR A 10 -5.558 0.495 4.321 1.00 0.00 O ATOM 110 CB TYR A 10 -7.028 0.634 1.535 1.00 0.00 C ATOM 111 CG TYR A 10 -8.053 0.118 0.550 1.00 0.00 C ATOM 112 CD1 TYR A 10 -9.177 -0.574 0.984 1.00 0.00 C ATOM 113 CD2 TYR A 10 -7.897 0.323 -0.816 1.00 0.00 C ATOM 114 CE1 TYR A 10 -10.115 -1.048 0.088 1.00 0.00 C ATOM 115 CE2 TYR A 10 -8.830 -0.147 -1.719 1.00 0.00 C ATOM 116 CZ TYR A 10 -9.937 -0.832 -1.263 1.00 0.00 C ATOM 117 OH TYR A 10 -10.870 -1.301 -2.159 1.00 0.00 O ATOM 0 H TYR A 10 -7.438 -1.054 3.843 1.00 0.00 H new ATOM 0 HA TYR A 10 -5.689 -1.046 1.476 1.00 0.00 H new ATOM 0 HB2 TYR A 10 -7.534 1.234 2.291 1.00 0.00 H new ATOM 0 HB3 TYR A 10 -6.336 1.295 1.013 1.00 0.00 H new ATOM 0 HD1 TYR A 10 -9.320 -0.744 2.041 1.00 0.00 H new ATOM 0 HD2 TYR A 10 -7.032 0.859 -1.177 1.00 0.00 H new ATOM 0 HE1 TYR A 10 -10.983 -1.585 0.443 1.00 0.00 H new ATOM 0 HE2 TYR A 10 -8.694 0.021 -2.777 1.00 0.00 H new ATOM 0 HH TYR A 10 -10.597 -1.065 -3.070 1.00 0.00 H new ATOM 127 N PHE A 11 -3.977 0.258 2.737 1.00 0.00 N ATOM 128 CA PHE A 11 -2.915 0.827 3.557 1.00 0.00 C ATOM 129 C PHE A 11 -1.977 1.686 2.714 1.00 0.00 C ATOM 130 O PHE A 11 -1.966 1.589 1.486 1.00 0.00 O ATOM 131 CB PHE A 11 -2.123 -0.286 4.248 1.00 0.00 C ATOM 132 CG PHE A 11 -2.990 -1.284 4.960 1.00 0.00 C ATOM 133 CD1 PHE A 11 -3.594 -2.319 4.263 1.00 0.00 C ATOM 134 CD2 PHE A 11 -3.201 -1.190 6.326 1.00 0.00 C ATOM 135 CE1 PHE A 11 -4.393 -3.239 4.915 1.00 0.00 C ATOM 136 CE2 PHE A 11 -3.998 -2.107 6.984 1.00 0.00 C ATOM 137 CZ PHE A 11 -4.594 -3.133 6.278 1.00 0.00 C ATOM 0 H PHE A 11 -3.681 -0.032 1.805 1.00 0.00 H new ATOM 0 HA PHE A 11 -3.376 1.460 4.315 1.00 0.00 H new ATOM 0 HB2 PHE A 11 -1.519 -0.806 3.505 1.00 0.00 H new ATOM 0 HB3 PHE A 11 -1.433 0.160 4.964 1.00 0.00 H new ATOM 0 HD1 PHE A 11 -3.438 -2.407 3.198 1.00 0.00 H new ATOM 0 HD2 PHE A 11 -2.737 -0.390 6.884 1.00 0.00 H new ATOM 0 HE1 PHE A 11 -4.860 -4.040 4.360 1.00 0.00 H new ATOM 0 HE2 PHE A 11 -4.155 -2.021 8.049 1.00 0.00 H new ATOM 0 HZ PHE A 11 -5.216 -3.852 6.790 1.00 0.00 H new ATOM 147 N ILE A 12 -1.191 2.524 3.381 1.00 0.00 N ATOM 148 CA ILE A 12 -0.250 3.399 2.693 1.00 0.00 C ATOM 149 C ILE A 12 1.189 3.065 3.074 1.00 0.00 C ATOM 150 O ILE A 12 1.575 3.173 4.237 1.00 0.00 O ATOM 151 CB ILE A 12 -0.522 4.881 3.012 1.00 0.00 C ATOM 152 CG1 ILE A 12 -1.917 5.282 2.525 1.00 0.00 C ATOM 153 CG2 ILE A 12 0.541 5.764 2.376 1.00 0.00 C ATOM 154 CD1 ILE A 12 -2.025 5.384 1.020 1.00 0.00 C ATOM 0 H ILE A 12 -1.187 2.616 4.397 1.00 0.00 H new ATOM 0 HA ILE A 12 -0.389 3.235 1.625 1.00 0.00 H new ATOM 0 HB ILE A 12 -0.481 5.018 4.093 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -2.642 4.552 2.885 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -2.185 6.242 2.966 1.00 0.00 H new ATOM 0 HG21 ILE A 12 0.335 6.808 2.611 1.00 0.00 H new ATOM 0 HG22 ILE A 12 1.522 5.491 2.766 1.00 0.00 H new ATOM 0 HG23 ILE A 12 0.529 5.626 1.295 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -3.040 5.672 0.747 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -1.324 6.135 0.655 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -1.789 4.419 0.572 1.00 0.00 H new ATOM 166 N MET A 13 1.978 2.662 2.084 1.00 0.00 N ATOM 167 CA MET A 13 3.376 2.315 2.314 1.00 0.00 C ATOM 168 C MET A 13 4.303 3.375 1.727 1.00 0.00 C ATOM 169 O MET A 13 4.428 3.500 0.509 1.00 0.00 O ATOM 170 CB MET A 13 3.693 0.949 1.703 1.00 0.00 C ATOM 171 CG MET A 13 3.471 -0.211 2.659 1.00 0.00 C ATOM 172 SD MET A 13 4.302 0.025 4.242 1.00 0.00 S ATOM 173 CE MET A 13 3.006 -0.454 5.380 1.00 0.00 C ATOM 0 H MET A 13 1.674 2.568 1.115 1.00 0.00 H new ATOM 0 HA MET A 13 3.540 2.270 3.391 1.00 0.00 H new ATOM 0 HB2 MET A 13 3.073 0.803 0.818 1.00 0.00 H new ATOM 0 HB3 MET A 13 4.731 0.941 1.370 1.00 0.00 H new ATOM 0 HG2 MET A 13 2.402 -0.337 2.830 1.00 0.00 H new ATOM 0 HG3 MET A 13 3.831 -1.131 2.198 1.00 0.00 H new ATOM 0 HE1 MET A 13 3.420 -0.550 6.384 1.00 0.00 H new ATOM 0 HE2 MET A 13 2.224 0.305 5.381 1.00 0.00 H new ATOM 0 HE3 MET A 13 2.583 -1.409 5.069 1.00 0.00 H new ATOM 183 N LYS A 14 4.950 4.138 2.601 1.00 0.00 N ATOM 184 CA LYS A 14 5.867 5.187 2.171 1.00 0.00 C ATOM 185 C LYS A 14 7.285 4.645 2.025 1.00 0.00 C ATOM 186 O LYS A 14 7.796 3.968 2.917 1.00 0.00 O ATOM 187 CB LYS A 14 5.853 6.346 3.170 1.00 0.00 C ATOM 188 CG LYS A 14 4.456 6.815 3.538 1.00 0.00 C ATOM 189 CD LYS A 14 3.748 7.444 2.350 1.00 0.00 C ATOM 190 CE LYS A 14 4.426 8.734 1.915 1.00 0.00 C ATOM 191 NZ LYS A 14 3.525 9.584 1.089 1.00 0.00 N ATOM 0 H LYS A 14 4.856 4.049 3.613 1.00 0.00 H new ATOM 0 HA LYS A 14 5.534 5.549 1.198 1.00 0.00 H new ATOM 0 HB2 LYS A 14 6.375 6.040 4.077 1.00 0.00 H new ATOM 0 HB3 LYS A 14 6.409 7.184 2.750 1.00 0.00 H new ATOM 0 HG2 LYS A 14 3.873 5.971 3.905 1.00 0.00 H new ATOM 0 HG3 LYS A 14 4.516 7.538 4.351 1.00 0.00 H new ATOM 0 HD2 LYS A 14 3.736 6.740 1.518 1.00 0.00 H new ATOM 0 HD3 LYS A 14 2.709 7.648 2.610 1.00 0.00 H new ATOM 0 HE2 LYS A 14 4.744 9.292 2.796 1.00 0.00 H new ATOM 0 HE3 LYS A 14 5.325 8.497 1.345 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 4.025 10.453 0.813 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 3.241 9.062 0.236 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 2.679 9.831 1.641 1.00 0.00 H new ATOM 205 N SER A 15 7.916 4.947 0.894 1.00 0.00 N ATOM 206 CA SER A 15 9.275 4.488 0.631 1.00 0.00 C ATOM 207 C SER A 15 10.208 5.668 0.380 1.00 0.00 C ATOM 208 O SER A 15 10.001 6.452 -0.546 1.00 0.00 O ATOM 209 CB SER A 15 9.292 3.544 -0.573 1.00 0.00 C ATOM 210 OG SER A 15 10.619 3.191 -0.925 1.00 0.00 O ATOM 0 H SER A 15 7.508 5.507 0.146 1.00 0.00 H new ATOM 0 HA SER A 15 9.628 3.950 1.511 1.00 0.00 H new ATOM 0 HB2 SER A 15 8.722 2.644 -0.342 1.00 0.00 H new ATOM 0 HB3 SER A 15 8.802 4.022 -1.421 1.00 0.00 H new ATOM 0 HG SER A 15 10.944 3.796 -1.624 1.00 0.00 H new ATOM 216 N SER A 16 11.237 5.788 1.213 1.00 0.00 N ATOM 217 CA SER A 16 12.201 6.875 1.086 1.00 0.00 C ATOM 218 C SER A 16 12.864 6.854 -0.289 1.00 0.00 C ATOM 219 O SER A 16 12.852 7.851 -1.009 1.00 0.00 O ATOM 220 CB SER A 16 13.266 6.771 2.179 1.00 0.00 C ATOM 221 OG SER A 16 12.758 7.203 3.429 1.00 0.00 O ATOM 0 H SER A 16 11.425 5.146 1.983 1.00 0.00 H new ATOM 0 HA SER A 16 11.666 7.818 1.199 1.00 0.00 H new ATOM 0 HB2 SER A 16 13.609 5.740 2.259 1.00 0.00 H new ATOM 0 HB3 SER A 16 14.131 7.375 1.906 1.00 0.00 H new ATOM 0 HG SER A 16 13.457 7.125 4.111 1.00 0.00 H new ATOM 227 N ASN A 17 13.440 5.711 -0.644 1.00 0.00 N ATOM 228 CA ASN A 17 14.109 5.560 -1.931 1.00 0.00 C ATOM 229 C ASN A 17 13.293 4.672 -2.866 1.00 0.00 C ATOM 230 O ASN A 17 12.575 3.776 -2.421 1.00 0.00 O ATOM 231 CB ASN A 17 15.506 4.967 -1.737 1.00 0.00 C ATOM 232 CG ASN A 17 16.323 5.735 -0.717 1.00 0.00 C ATOM 233 OD1 ASN A 17 16.027 6.890 -0.410 1.00 0.00 O ATOM 234 ND2 ASN A 17 17.358 5.095 -0.184 1.00 0.00 N ATOM 0 H ASN A 17 13.457 4.876 -0.059 1.00 0.00 H new ATOM 0 HA ASN A 17 14.201 6.548 -2.383 1.00 0.00 H new ATOM 0 HB2 ASN A 17 15.416 3.928 -1.419 1.00 0.00 H new ATOM 0 HB3 ASN A 17 16.032 4.963 -2.692 1.00 0.00 H new ATOM 0 HD21 ASN A 17 17.944 5.561 0.509 1.00 0.00 H new ATOM 0 HD22 ASN A 17 17.567 4.138 -0.468 1.00 0.00 H new ATOM 241 N LEU A 18 13.409 4.927 -4.165 1.00 0.00 N ATOM 242 CA LEU A 18 12.683 4.151 -5.165 1.00 0.00 C ATOM 243 C LEU A 18 13.223 2.726 -5.246 1.00 0.00 C ATOM 244 O LEU A 18 12.458 1.762 -5.257 1.00 0.00 O ATOM 245 CB LEU A 18 12.783 4.825 -6.534 1.00 0.00 C ATOM 246 CG LEU A 18 11.758 4.380 -7.578 1.00 0.00 C ATOM 247 CD1 LEU A 18 11.277 2.968 -7.285 1.00 0.00 C ATOM 248 CD2 LEU A 18 10.585 5.348 -7.619 1.00 0.00 C ATOM 0 H LEU A 18 13.999 5.665 -4.550 1.00 0.00 H new ATOM 0 HA LEU A 18 11.636 4.107 -4.865 1.00 0.00 H new ATOM 0 HB2 LEU A 18 12.686 5.902 -6.395 1.00 0.00 H new ATOM 0 HB3 LEU A 18 13.781 4.644 -6.934 1.00 0.00 H new ATOM 0 HG LEU A 18 12.239 4.382 -8.556 1.00 0.00 H new ATOM 0 HD11 LEU A 18 10.548 2.668 -8.038 1.00 0.00 H new ATOM 0 HD12 LEU A 18 12.125 2.283 -7.307 1.00 0.00 H new ATOM 0 HD13 LEU A 18 10.813 2.939 -6.299 1.00 0.00 H new ATOM 0 HD21 LEU A 18 9.865 5.016 -8.367 1.00 0.00 H new ATOM 0 HD22 LEU A 18 10.104 5.378 -6.641 1.00 0.00 H new ATOM 0 HD23 LEU A 18 10.944 6.344 -7.878 1.00 0.00 H new ATOM 260 N ARG A 19 14.545 2.603 -5.300 1.00 0.00 N ATOM 261 CA ARG A 19 15.187 1.296 -5.378 1.00 0.00 C ATOM 262 C ARG A 19 14.524 0.306 -4.425 1.00 0.00 C ATOM 263 O ARG A 19 14.148 -0.796 -4.822 1.00 0.00 O ATOM 264 CB ARG A 19 16.677 1.416 -5.051 1.00 0.00 C ATOM 265 CG ARG A 19 17.350 0.080 -4.781 1.00 0.00 C ATOM 266 CD ARG A 19 17.476 -0.747 -6.051 1.00 0.00 C ATOM 267 NE ARG A 19 18.622 -1.651 -6.004 1.00 0.00 N ATOM 268 CZ ARG A 19 19.203 -2.159 -7.085 1.00 0.00 C ATOM 269 NH1 ARG A 19 18.747 -1.853 -8.292 1.00 0.00 N ATOM 270 NH2 ARG A 19 20.242 -2.975 -6.961 1.00 0.00 N ATOM 0 H ARG A 19 15.192 3.391 -5.291 1.00 0.00 H new ATOM 0 HA ARG A 19 15.074 0.924 -6.396 1.00 0.00 H new ATOM 0 HB2 ARG A 19 17.184 1.908 -5.881 1.00 0.00 H new ATOM 0 HB3 ARG A 19 16.798 2.058 -4.178 1.00 0.00 H new ATOM 0 HG2 ARG A 19 18.339 0.249 -4.356 1.00 0.00 H new ATOM 0 HG3 ARG A 19 16.775 -0.475 -4.040 1.00 0.00 H new ATOM 0 HD2 ARG A 19 16.564 -1.325 -6.199 1.00 0.00 H new ATOM 0 HD3 ARG A 19 17.574 -0.082 -6.909 1.00 0.00 H new ATOM 0 HE ARG A 19 18.997 -1.906 -5.090 1.00 0.00 H new ATOM 0 HH11 ARG A 19 17.948 -1.226 -8.392 1.00 0.00 H new ATOM 0 HH12 ARG A 19 19.195 -2.244 -9.121 1.00 0.00 H new ATOM 0 HH21 ARG A 19 20.596 -3.213 -6.034 1.00 0.00 H new ATOM 0 HH22 ARG A 19 20.687 -3.364 -7.792 1.00 0.00 H new ATOM 284 N ASN A 20 14.385 0.708 -3.166 1.00 0.00 N ATOM 285 CA ASN A 20 13.768 -0.145 -2.156 1.00 0.00 C ATOM 286 C ASN A 20 12.482 -0.772 -2.684 1.00 0.00 C ATOM 287 O ASN A 20 12.178 -1.929 -2.394 1.00 0.00 O ATOM 288 CB ASN A 20 13.473 0.662 -0.889 1.00 0.00 C ATOM 289 CG ASN A 20 14.668 1.473 -0.429 1.00 0.00 C ATOM 290 OD1 ASN A 20 15.802 1.215 -0.835 1.00 0.00 O ATOM 291 ND2 ASN A 20 14.420 2.461 0.424 1.00 0.00 N ATOM 0 H ASN A 20 14.691 1.618 -2.821 1.00 0.00 H new ATOM 0 HA ASN A 20 14.468 -0.945 -1.915 1.00 0.00 H new ATOM 0 HB2 ASN A 20 12.633 1.331 -1.075 1.00 0.00 H new ATOM 0 HB3 ASN A 20 13.169 -0.017 -0.092 1.00 0.00 H new ATOM 0 HD21 ASN A 20 15.185 3.041 0.769 1.00 0.00 H new ATOM 0 HD22 ASN A 20 13.465 2.639 0.734 1.00 0.00 H new ATOM 298 N LEU A 21 11.730 0.000 -3.462 1.00 0.00 N ATOM 299 CA LEU A 21 10.476 -0.479 -4.032 1.00 0.00 C ATOM 300 C LEU A 21 10.735 -1.492 -5.143 1.00 0.00 C ATOM 301 O LEU A 21 9.994 -2.462 -5.295 1.00 0.00 O ATOM 302 CB LEU A 21 9.660 0.694 -4.577 1.00 0.00 C ATOM 303 CG LEU A 21 8.176 0.421 -4.827 1.00 0.00 C ATOM 304 CD1 LEU A 21 7.410 0.395 -3.514 1.00 0.00 C ATOM 305 CD2 LEU A 21 7.592 1.466 -5.767 1.00 0.00 C ATOM 0 H LEU A 21 11.967 0.960 -3.712 1.00 0.00 H new ATOM 0 HA LEU A 21 9.910 -0.971 -3.241 1.00 0.00 H new ATOM 0 HB2 LEU A 21 9.743 1.525 -3.876 1.00 0.00 H new ATOM 0 HB3 LEU A 21 10.112 1.021 -5.514 1.00 0.00 H new ATOM 0 HG LEU A 21 8.081 -0.557 -5.299 1.00 0.00 H new ATOM 0 HD11 LEU A 21 6.356 0.200 -3.711 1.00 0.00 H new ATOM 0 HD12 LEU A 21 7.811 -0.391 -2.874 1.00 0.00 H new ATOM 0 HD13 LEU A 21 7.513 1.358 -3.014 1.00 0.00 H new ATOM 0 HD21 LEU A 21 6.535 1.256 -5.933 1.00 0.00 H new ATOM 0 HD22 LEU A 21 7.700 2.456 -5.323 1.00 0.00 H new ATOM 0 HD23 LEU A 21 8.122 1.436 -6.719 1.00 0.00 H new ATOM 317 N GLU A 22 11.793 -1.261 -5.913 1.00 0.00 N ATOM 318 CA GLU A 22 12.150 -2.155 -7.009 1.00 0.00 C ATOM 319 C GLU A 22 12.179 -3.606 -6.539 1.00 0.00 C ATOM 320 O GLU A 22 11.725 -4.507 -7.244 1.00 0.00 O ATOM 321 CB GLU A 22 13.512 -1.768 -7.589 1.00 0.00 C ATOM 322 CG GLU A 22 13.541 -0.377 -8.200 1.00 0.00 C ATOM 323 CD GLU A 22 14.824 -0.099 -8.959 1.00 0.00 C ATOM 324 OE1 GLU A 22 15.910 -0.237 -8.357 1.00 0.00 O ATOM 325 OE2 GLU A 22 14.742 0.256 -10.153 1.00 0.00 O ATOM 0 H GLU A 22 12.418 -0.463 -5.799 1.00 0.00 H new ATOM 0 HA GLU A 22 11.392 -2.058 -7.786 1.00 0.00 H new ATOM 0 HB2 GLU A 22 14.263 -1.825 -6.801 1.00 0.00 H new ATOM 0 HB3 GLU A 22 13.793 -2.496 -8.350 1.00 0.00 H new ATOM 0 HG2 GLU A 22 12.692 -0.263 -8.875 1.00 0.00 H new ATOM 0 HG3 GLU A 22 13.423 0.365 -7.410 1.00 0.00 H new ATOM 332 N ILE A 23 12.717 -3.824 -5.343 1.00 0.00 N ATOM 333 CA ILE A 23 12.805 -5.165 -4.779 1.00 0.00 C ATOM 334 C ILE A 23 11.449 -5.863 -4.806 1.00 0.00 C ATOM 335 O ILE A 23 11.364 -7.065 -5.060 1.00 0.00 O ATOM 336 CB ILE A 23 13.323 -5.133 -3.329 1.00 0.00 C ATOM 337 CG1 ILE A 23 14.804 -4.748 -3.302 1.00 0.00 C ATOM 338 CG2 ILE A 23 13.108 -6.482 -2.659 1.00 0.00 C ATOM 339 CD1 ILE A 23 15.050 -3.276 -3.545 1.00 0.00 C ATOM 0 H ILE A 23 13.098 -3.089 -4.747 1.00 0.00 H new ATOM 0 HA ILE A 23 13.510 -5.721 -5.397 1.00 0.00 H new ATOM 0 HB ILE A 23 12.761 -4.381 -2.775 1.00 0.00 H new ATOM 0 HG12 ILE A 23 15.225 -5.024 -2.335 1.00 0.00 H new ATOM 0 HG13 ILE A 23 15.335 -5.326 -4.058 1.00 0.00 H new ATOM 0 HG21 ILE A 23 13.479 -6.443 -1.635 1.00 0.00 H new ATOM 0 HG22 ILE A 23 12.044 -6.719 -2.650 1.00 0.00 H new ATOM 0 HG23 ILE A 23 13.646 -7.252 -3.211 1.00 0.00 H new ATOM 0 HD11 ILE A 23 16.121 -3.076 -3.512 1.00 0.00 H new ATOM 0 HD12 ILE A 23 14.659 -2.999 -4.524 1.00 0.00 H new ATOM 0 HD13 ILE A 23 14.547 -2.691 -2.775 1.00 0.00 H new ATOM 351 N SER A 24 10.392 -5.101 -4.546 1.00 0.00 N ATOM 352 CA SER A 24 9.039 -5.647 -4.540 1.00 0.00 C ATOM 353 C SER A 24 8.537 -5.871 -5.963 1.00 0.00 C ATOM 354 O SER A 24 7.567 -6.595 -6.182 1.00 0.00 O ATOM 355 CB SER A 24 8.091 -4.706 -3.794 1.00 0.00 C ATOM 356 OG SER A 24 6.866 -5.351 -3.492 1.00 0.00 O ATOM 0 H SER A 24 10.446 -4.104 -4.337 1.00 0.00 H new ATOM 0 HA SER A 24 9.063 -6.609 -4.027 1.00 0.00 H new ATOM 0 HB2 SER A 24 8.563 -4.365 -2.873 1.00 0.00 H new ATOM 0 HB3 SER A 24 7.900 -3.821 -4.401 1.00 0.00 H new ATOM 0 HG SER A 24 6.139 -4.694 -3.503 1.00 0.00 H new ATOM 362 N GLN A 25 9.206 -5.244 -6.925 1.00 0.00 N ATOM 363 CA GLN A 25 8.827 -5.374 -8.327 1.00 0.00 C ATOM 364 C GLN A 25 9.536 -6.558 -8.975 1.00 0.00 C ATOM 365 O GLN A 25 8.968 -7.245 -9.824 1.00 0.00 O ATOM 366 CB GLN A 25 9.156 -4.088 -9.088 1.00 0.00 C ATOM 367 CG GLN A 25 8.153 -2.970 -8.857 1.00 0.00 C ATOM 368 CD GLN A 25 8.405 -1.767 -9.743 1.00 0.00 C ATOM 369 OE1 GLN A 25 8.981 -1.888 -10.825 1.00 0.00 O ATOM 370 NE2 GLN A 25 7.974 -0.596 -9.289 1.00 0.00 N ATOM 0 H GLN A 25 10.012 -4.642 -6.760 1.00 0.00 H new ATOM 0 HA GLN A 25 7.752 -5.549 -8.372 1.00 0.00 H new ATOM 0 HB2 GLN A 25 10.146 -3.743 -8.791 1.00 0.00 H new ATOM 0 HB3 GLN A 25 9.202 -4.309 -10.154 1.00 0.00 H new ATOM 0 HG2 GLN A 25 7.147 -3.347 -9.040 1.00 0.00 H new ATOM 0 HG3 GLN A 25 8.193 -2.662 -7.812 1.00 0.00 H new ATOM 0 HE21 GLN A 25 7.501 -0.541 -8.387 1.00 0.00 H new ATOM 0 HE22 GLN A 25 8.115 0.249 -9.843 1.00 0.00 H new ATOM 379 N GLN A 26 10.781 -6.791 -8.569 1.00 0.00 N ATOM 380 CA GLN A 26 11.568 -7.892 -9.112 1.00 0.00 C ATOM 381 C GLN A 26 11.444 -9.133 -8.235 1.00 0.00 C ATOM 382 O GLN A 26 11.058 -10.204 -8.706 1.00 0.00 O ATOM 383 CB GLN A 26 13.037 -7.484 -9.235 1.00 0.00 C ATOM 384 CG GLN A 26 13.245 -6.177 -9.983 1.00 0.00 C ATOM 385 CD GLN A 26 13.393 -6.378 -11.478 1.00 0.00 C ATOM 386 OE1 GLN A 26 13.790 -7.449 -11.936 1.00 0.00 O ATOM 387 NE2 GLN A 26 13.073 -5.345 -12.249 1.00 0.00 N ATOM 0 H GLN A 26 11.265 -6.232 -7.867 1.00 0.00 H new ATOM 0 HA GLN A 26 11.180 -8.129 -10.103 1.00 0.00 H new ATOM 0 HB2 GLN A 26 13.465 -7.394 -8.237 1.00 0.00 H new ATOM 0 HB3 GLN A 26 13.584 -8.276 -9.746 1.00 0.00 H new ATOM 0 HG2 GLN A 26 12.401 -5.515 -9.791 1.00 0.00 H new ATOM 0 HG3 GLN A 26 14.135 -5.680 -9.597 1.00 0.00 H new ATOM 0 HE21 GLN A 26 12.748 -4.475 -11.827 1.00 0.00 H new ATOM 0 HE22 GLN A 26 13.152 -5.422 -13.263 1.00 0.00 H new ATOM 396 N LYS A 27 11.773 -8.984 -6.957 1.00 0.00 N ATOM 397 CA LYS A 27 11.698 -10.092 -6.012 1.00 0.00 C ATOM 398 C LYS A 27 10.248 -10.476 -5.737 1.00 0.00 C ATOM 399 O LYS A 27 9.942 -11.638 -5.474 1.00 0.00 O ATOM 400 CB LYS A 27 12.396 -9.720 -4.702 1.00 0.00 C ATOM 401 CG LYS A 27 13.688 -8.947 -4.899 1.00 0.00 C ATOM 402 CD LYS A 27 14.651 -9.692 -5.807 1.00 0.00 C ATOM 403 CE LYS A 27 16.071 -9.165 -5.667 1.00 0.00 C ATOM 404 NZ LYS A 27 17.085 -10.221 -5.939 1.00 0.00 N ATOM 0 H LYS A 27 12.095 -8.105 -6.551 1.00 0.00 H new ATOM 0 HA LYS A 27 12.204 -10.950 -6.455 1.00 0.00 H new ATOM 0 HB2 LYS A 27 11.715 -9.124 -4.094 1.00 0.00 H new ATOM 0 HB3 LYS A 27 12.609 -10.631 -4.142 1.00 0.00 H new ATOM 0 HG2 LYS A 27 13.466 -7.969 -5.327 1.00 0.00 H new ATOM 0 HG3 LYS A 27 14.160 -8.773 -3.932 1.00 0.00 H new ATOM 0 HD2 LYS A 27 14.631 -10.755 -5.566 1.00 0.00 H new ATOM 0 HD3 LYS A 27 14.326 -9.594 -6.843 1.00 0.00 H new ATOM 0 HE2 LYS A 27 16.219 -8.334 -6.356 1.00 0.00 H new ATOM 0 HE3 LYS A 27 16.215 -8.774 -4.660 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 18.039 -9.821 -5.833 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 16.961 -11.004 -5.265 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 16.964 -10.577 -6.909 1.00 0.00 H new ATOM 418 N GLY A 28 9.357 -9.490 -5.801 1.00 0.00 N ATOM 419 CA GLY A 28 7.950 -9.746 -5.558 1.00 0.00 C ATOM 420 C GLY A 28 7.615 -9.789 -4.080 1.00 0.00 C ATOM 421 O GLY A 28 6.691 -10.489 -3.666 1.00 0.00 O ATOM 0 H GLY A 28 9.585 -8.520 -6.017 1.00 0.00 H new ATOM 0 HA2 GLY A 28 7.354 -8.971 -6.040 1.00 0.00 H new ATOM 0 HA3 GLY A 28 7.672 -10.694 -6.018 1.00 0.00 H new ATOM 425 N ILE A 29 8.369 -9.040 -3.282 1.00 0.00 N ATOM 426 CA ILE A 29 8.147 -8.996 -1.842 1.00 0.00 C ATOM 427 C ILE A 29 8.408 -7.599 -1.288 1.00 0.00 C ATOM 428 O ILE A 29 9.198 -6.837 -1.845 1.00 0.00 O ATOM 429 CB ILE A 29 9.046 -10.005 -1.104 1.00 0.00 C ATOM 430 CG1 ILE A 29 10.451 -10.008 -1.708 1.00 0.00 C ATOM 431 CG2 ILE A 29 8.437 -11.398 -1.160 1.00 0.00 C ATOM 432 CD1 ILE A 29 11.238 -8.749 -1.416 1.00 0.00 C ATOM 0 H ILE A 29 9.139 -8.456 -3.608 1.00 0.00 H new ATOM 0 HA ILE A 29 7.103 -9.261 -1.675 1.00 0.00 H new ATOM 0 HB ILE A 29 9.121 -9.704 -0.059 1.00 0.00 H new ATOM 0 HG12 ILE A 29 11.001 -10.867 -1.324 1.00 0.00 H new ATOM 0 HG13 ILE A 29 10.373 -10.136 -2.788 1.00 0.00 H new ATOM 0 HG21 ILE A 29 9.084 -12.100 -0.634 1.00 0.00 H new ATOM 0 HG22 ILE A 29 7.455 -11.385 -0.687 1.00 0.00 H new ATOM 0 HG23 ILE A 29 8.334 -11.709 -2.200 1.00 0.00 H new ATOM 0 HD11 ILE A 29 12.224 -8.822 -1.875 1.00 0.00 H new ATOM 0 HD12 ILE A 29 10.710 -7.887 -1.824 1.00 0.00 H new ATOM 0 HD13 ILE A 29 11.348 -8.630 -0.338 1.00 0.00 H new ATOM 444 N TRP A 30 7.740 -7.271 -0.188 1.00 0.00 N ATOM 445 CA TRP A 30 7.900 -5.966 0.443 1.00 0.00 C ATOM 446 C TRP A 30 8.262 -6.115 1.916 1.00 0.00 C ATOM 447 O TRP A 30 7.660 -6.914 2.635 1.00 0.00 O ATOM 448 CB TRP A 30 6.617 -5.146 0.300 1.00 0.00 C ATOM 449 CG TRP A 30 6.722 -3.771 0.886 1.00 0.00 C ATOM 450 CD1 TRP A 30 5.962 -3.249 1.892 1.00 0.00 C ATOM 451 CD2 TRP A 30 7.641 -2.743 0.499 1.00 0.00 C ATOM 452 NE1 TRP A 30 6.352 -1.957 2.155 1.00 0.00 N ATOM 453 CE2 TRP A 30 7.381 -1.624 1.314 1.00 0.00 C ATOM 454 CE3 TRP A 30 8.658 -2.659 -0.455 1.00 0.00 C ATOM 455 CZ2 TRP A 30 8.101 -0.438 1.202 1.00 0.00 C ATOM 456 CZ3 TRP A 30 9.372 -1.481 -0.566 1.00 0.00 C ATOM 457 CH2 TRP A 30 9.092 -0.384 0.259 1.00 0.00 C ATOM 0 H TRP A 30 7.082 -7.891 0.285 1.00 0.00 H new ATOM 0 HA TRP A 30 8.714 -5.444 -0.061 1.00 0.00 H new ATOM 0 HB2 TRP A 30 6.363 -5.064 -0.757 1.00 0.00 H new ATOM 0 HB3 TRP A 30 5.798 -5.678 0.785 1.00 0.00 H new ATOM 0 HD1 TRP A 30 5.170 -3.774 2.406 1.00 0.00 H new ATOM 0 HE1 TRP A 30 5.942 -1.346 2.861 1.00 0.00 H new ATOM 0 HE3 TRP A 30 8.882 -3.500 -1.095 1.00 0.00 H new ATOM 0 HZ2 TRP A 30 7.886 0.409 1.836 1.00 0.00 H new ATOM 0 HZ3 TRP A 30 10.159 -1.405 -1.301 1.00 0.00 H new ATOM 0 HH2 TRP A 30 9.669 0.522 0.149 1.00 0.00 H new ATOM 468 N SER A 31 9.247 -5.342 2.361 1.00 0.00 N ATOM 469 CA SER A 31 9.690 -5.391 3.749 1.00 0.00 C ATOM 470 C SER A 31 9.359 -4.088 4.471 1.00 0.00 C ATOM 471 O SER A 31 9.928 -3.037 4.174 1.00 0.00 O ATOM 472 CB SER A 31 11.196 -5.656 3.817 1.00 0.00 C ATOM 473 OG SER A 31 11.578 -6.099 5.107 1.00 0.00 O ATOM 0 H SER A 31 9.754 -4.674 1.780 1.00 0.00 H new ATOM 0 HA SER A 31 9.162 -6.206 4.245 1.00 0.00 H new ATOM 0 HB2 SER A 31 11.470 -6.406 3.075 1.00 0.00 H new ATOM 0 HB3 SER A 31 11.740 -4.746 3.566 1.00 0.00 H new ATOM 0 HG SER A 31 12.354 -6.692 5.033 1.00 0.00 H new ATOM 479 N THR A 32 8.434 -4.165 5.423 1.00 0.00 N ATOM 480 CA THR A 32 8.025 -2.994 6.188 1.00 0.00 C ATOM 481 C THR A 32 8.403 -3.138 7.658 1.00 0.00 C ATOM 482 O THR A 32 8.828 -4.206 8.100 1.00 0.00 O ATOM 483 CB THR A 32 6.507 -2.755 6.081 1.00 0.00 C ATOM 484 OG1 THR A 32 6.190 -1.423 6.498 1.00 0.00 O ATOM 485 CG2 THR A 32 5.741 -3.755 6.934 1.00 0.00 C ATOM 0 H THR A 32 7.954 -5.027 5.682 1.00 0.00 H new ATOM 0 HA THR A 32 8.551 -2.139 5.763 1.00 0.00 H new ATOM 0 HB THR A 32 6.213 -2.888 5.040 1.00 0.00 H new ATOM 0 HG1 THR A 32 5.627 -0.993 5.820 1.00 0.00 H new ATOM 0 HG21 THR A 32 4.671 -3.567 6.843 1.00 0.00 H new ATOM 0 HG22 THR A 32 5.962 -4.767 6.595 1.00 0.00 H new ATOM 0 HG23 THR A 32 6.040 -3.649 7.977 1.00 0.00 H new ATOM 493 N THR A 33 8.246 -2.055 8.413 1.00 0.00 N ATOM 494 CA THR A 33 8.571 -2.061 9.834 1.00 0.00 C ATOM 495 C THR A 33 7.770 -3.123 10.577 1.00 0.00 C ATOM 496 O THR A 33 6.592 -3.353 10.302 1.00 0.00 O ATOM 497 CB THR A 33 8.302 -0.687 10.477 1.00 0.00 C ATOM 498 OG1 THR A 33 8.972 -0.598 11.739 1.00 0.00 O ATOM 499 CG2 THR A 33 6.810 -0.465 10.673 1.00 0.00 C ATOM 0 H THR A 33 7.896 -1.163 8.064 1.00 0.00 H new ATOM 0 HA THR A 33 9.634 -2.290 9.914 1.00 0.00 H new ATOM 0 HB THR A 33 8.684 0.084 9.808 1.00 0.00 H new ATOM 0 HG1 THR A 33 8.798 0.279 12.141 1.00 0.00 H new ATOM 0 HG21 THR A 33 6.644 0.511 11.128 1.00 0.00 H new ATOM 0 HG22 THR A 33 6.306 -0.505 9.707 1.00 0.00 H new ATOM 0 HG23 THR A 33 6.409 -1.242 11.324 1.00 0.00 H new ATOM 507 N PRO A 34 8.420 -3.788 11.544 1.00 0.00 N ATOM 508 CA PRO A 34 7.786 -4.837 12.348 1.00 0.00 C ATOM 509 C PRO A 34 6.735 -4.280 13.303 1.00 0.00 C ATOM 510 O PRO A 34 6.163 -5.014 14.108 1.00 0.00 O ATOM 511 CB PRO A 34 8.955 -5.439 13.132 1.00 0.00 C ATOM 512 CG PRO A 34 9.965 -4.346 13.205 1.00 0.00 C ATOM 513 CD PRO A 34 9.825 -3.566 11.926 1.00 0.00 C ATOM 0 HA PRO A 34 7.254 -5.559 11.729 1.00 0.00 H new ATOM 0 HB2 PRO A 34 8.643 -5.757 14.127 1.00 0.00 H new ATOM 0 HB3 PRO A 34 9.358 -6.318 12.629 1.00 0.00 H new ATOM 0 HG2 PRO A 34 9.789 -3.709 14.072 1.00 0.00 H new ATOM 0 HG3 PRO A 34 10.972 -4.751 13.307 1.00 0.00 H new ATOM 0 HD2 PRO A 34 10.039 -2.508 12.075 1.00 0.00 H new ATOM 0 HD3 PRO A 34 10.512 -3.925 11.159 1.00 0.00 H new ATOM 521 N SER A 35 6.486 -2.978 13.207 1.00 0.00 N ATOM 522 CA SER A 35 5.506 -2.322 14.065 1.00 0.00 C ATOM 523 C SER A 35 4.199 -2.086 13.314 1.00 0.00 C ATOM 524 O SER A 35 3.227 -1.587 13.880 1.00 0.00 O ATOM 525 CB SER A 35 6.058 -0.992 14.581 1.00 0.00 C ATOM 526 OG SER A 35 6.952 -1.195 15.662 1.00 0.00 O ATOM 0 H SER A 35 6.949 -2.357 12.544 1.00 0.00 H new ATOM 0 HA SER A 35 5.305 -2.977 14.913 1.00 0.00 H new ATOM 0 HB2 SER A 35 6.572 -0.470 13.774 1.00 0.00 H new ATOM 0 HB3 SER A 35 5.235 -0.353 14.901 1.00 0.00 H new ATOM 0 HG SER A 35 7.292 -0.330 15.972 1.00 0.00 H new ATOM 532 N ASN A 36 4.184 -2.449 12.036 1.00 0.00 N ATOM 533 CA ASN A 36 2.997 -2.277 11.207 1.00 0.00 C ATOM 534 C ASN A 36 2.671 -3.561 10.450 1.00 0.00 C ATOM 535 O ASN A 36 1.766 -3.589 9.617 1.00 0.00 O ATOM 536 CB ASN A 36 3.202 -1.127 10.218 1.00 0.00 C ATOM 537 CG ASN A 36 3.913 0.055 10.847 1.00 0.00 C ATOM 538 OD1 ASN A 36 3.956 0.190 12.070 1.00 0.00 O ATOM 539 ND2 ASN A 36 4.476 0.920 10.011 1.00 0.00 N ATOM 0 H ASN A 36 4.980 -2.864 11.552 1.00 0.00 H new ATOM 0 HA ASN A 36 2.159 -2.039 11.862 1.00 0.00 H new ATOM 0 HB2 ASN A 36 3.780 -1.483 9.365 1.00 0.00 H new ATOM 0 HB3 ASN A 36 2.234 -0.804 9.835 1.00 0.00 H new ATOM 0 HD21 ASN A 36 4.968 1.735 10.376 1.00 0.00 H new ATOM 0 HD22 ASN A 36 4.416 0.769 9.004 1.00 0.00 H new ATOM 546 N GLU A 37 3.416 -4.622 10.746 1.00 0.00 N ATOM 547 CA GLU A 37 3.207 -5.909 10.093 1.00 0.00 C ATOM 548 C GLU A 37 1.889 -6.537 10.539 1.00 0.00 C ATOM 549 O GLU A 37 1.132 -7.061 9.723 1.00 0.00 O ATOM 550 CB GLU A 37 4.367 -6.857 10.401 1.00 0.00 C ATOM 551 CG GLU A 37 5.688 -6.422 9.789 1.00 0.00 C ATOM 552 CD GLU A 37 5.730 -6.626 8.287 1.00 0.00 C ATOM 553 OE1 GLU A 37 4.766 -6.219 7.605 1.00 0.00 O ATOM 554 OE2 GLU A 37 6.728 -7.192 7.794 1.00 0.00 O ATOM 0 H GLU A 37 4.169 -4.615 11.434 1.00 0.00 H new ATOM 0 HA GLU A 37 3.163 -5.739 9.017 1.00 0.00 H new ATOM 0 HB2 GLU A 37 4.485 -6.934 11.482 1.00 0.00 H new ATOM 0 HB3 GLU A 37 4.118 -7.853 10.036 1.00 0.00 H new ATOM 0 HG2 GLU A 37 5.859 -5.369 10.014 1.00 0.00 H new ATOM 0 HG3 GLU A 37 6.500 -6.983 10.251 1.00 0.00 H new ATOM 561 N ARG A 38 1.625 -6.480 11.841 1.00 0.00 N ATOM 562 CA ARG A 38 0.401 -7.045 12.396 1.00 0.00 C ATOM 563 C ARG A 38 -0.769 -6.863 11.433 1.00 0.00 C ATOM 564 O ARG A 38 -1.228 -7.819 10.809 1.00 0.00 O ATOM 565 CB ARG A 38 0.076 -6.389 13.740 1.00 0.00 C ATOM 566 CG ARG A 38 -1.311 -6.728 14.263 1.00 0.00 C ATOM 567 CD ARG A 38 -1.898 -5.579 15.069 1.00 0.00 C ATOM 568 NE ARG A 38 -1.269 -5.454 16.381 1.00 0.00 N ATOM 569 CZ ARG A 38 -1.794 -4.760 17.385 1.00 0.00 C ATOM 570 NH1 ARG A 38 -2.952 -4.133 17.227 1.00 0.00 N ATOM 571 NH2 ARG A 38 -1.162 -4.693 18.549 1.00 0.00 N ATOM 0 H ARG A 38 2.242 -6.049 12.530 1.00 0.00 H new ATOM 0 HA ARG A 38 0.560 -8.113 12.548 1.00 0.00 H new ATOM 0 HB2 ARG A 38 0.818 -6.699 14.475 1.00 0.00 H new ATOM 0 HB3 ARG A 38 0.162 -5.307 13.637 1.00 0.00 H new ATOM 0 HG2 ARG A 38 -1.970 -6.961 13.426 1.00 0.00 H new ATOM 0 HG3 ARG A 38 -1.258 -7.621 14.886 1.00 0.00 H new ATOM 0 HD2 ARG A 38 -1.773 -4.648 14.517 1.00 0.00 H new ATOM 0 HD3 ARG A 38 -2.970 -5.734 15.194 1.00 0.00 H new ATOM 0 HE ARG A 38 -0.378 -5.925 16.535 1.00 0.00 H new ATOM 0 HH11 ARG A 38 -3.441 -4.183 16.333 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -3.353 -3.601 17.999 1.00 0.00 H new ATOM 0 HH21 ARG A 38 -0.272 -5.175 18.674 1.00 0.00 H new ATOM 0 HH22 ARG A 38 -1.566 -4.160 19.319 1.00 0.00 H new ATOM 585 N LYS A 39 -1.246 -5.628 11.317 1.00 0.00 N ATOM 586 CA LYS A 39 -2.361 -5.318 10.430 1.00 0.00 C ATOM 587 C LYS A 39 -2.259 -6.112 9.132 1.00 0.00 C ATOM 588 O LYS A 39 -3.109 -6.954 8.839 1.00 0.00 O ATOM 589 CB LYS A 39 -2.394 -3.820 10.123 1.00 0.00 C ATOM 590 CG LYS A 39 -1.022 -3.219 9.874 1.00 0.00 C ATOM 591 CD LYS A 39 -0.949 -1.778 10.350 1.00 0.00 C ATOM 592 CE LYS A 39 -1.670 -0.839 9.395 1.00 0.00 C ATOM 593 NZ LYS A 39 -0.759 -0.313 8.340 1.00 0.00 N ATOM 0 H LYS A 39 -0.877 -4.825 11.827 1.00 0.00 H new ATOM 0 HA LYS A 39 -3.285 -5.599 10.936 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -3.020 -3.651 9.247 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -2.864 -3.297 10.956 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -0.266 -3.812 10.388 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -0.792 -3.263 8.809 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -1.391 -1.699 11.343 1.00 0.00 H new ATOM 0 HD3 LYS A 39 0.094 -1.476 10.441 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -2.502 -1.366 8.927 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -2.095 -0.007 9.956 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -1.085 0.627 8.037 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 0.206 -0.239 8.720 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -0.761 -0.959 7.525 1.00 0.00 H new ATOM 607 N LEU A 40 -1.215 -5.839 8.357 1.00 0.00 N ATOM 608 CA LEU A 40 -1.002 -6.528 7.089 1.00 0.00 C ATOM 609 C LEU A 40 -1.150 -8.037 7.259 1.00 0.00 C ATOM 610 O LEU A 40 -1.673 -8.722 6.380 1.00 0.00 O ATOM 611 CB LEU A 40 0.386 -6.200 6.535 1.00 0.00 C ATOM 612 CG LEU A 40 0.799 -4.729 6.588 1.00 0.00 C ATOM 613 CD1 LEU A 40 2.183 -4.541 5.988 1.00 0.00 C ATOM 614 CD2 LEU A 40 -0.221 -3.862 5.863 1.00 0.00 C ATOM 0 H LEU A 40 -0.503 -5.145 8.585 1.00 0.00 H new ATOM 0 HA LEU A 40 -1.759 -6.184 6.384 1.00 0.00 H new ATOM 0 HB2 LEU A 40 1.123 -6.784 7.087 1.00 0.00 H new ATOM 0 HB3 LEU A 40 0.429 -6.532 5.498 1.00 0.00 H new ATOM 0 HG LEU A 40 0.833 -4.419 7.632 1.00 0.00 H new ATOM 0 HD11 LEU A 40 2.460 -3.488 6.035 1.00 0.00 H new ATOM 0 HD12 LEU A 40 2.907 -5.131 6.550 1.00 0.00 H new ATOM 0 HD13 LEU A 40 2.176 -4.869 4.948 1.00 0.00 H new ATOM 0 HD21 LEU A 40 0.089 -2.818 5.911 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -0.288 -4.173 4.821 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -1.196 -3.973 6.338 1.00 0.00 H new ATOM 626 N ASN A 41 -0.689 -8.548 8.395 1.00 0.00 N ATOM 627 CA ASN A 41 -0.772 -9.976 8.681 1.00 0.00 C ATOM 628 C ASN A 41 -2.210 -10.389 8.976 1.00 0.00 C ATOM 629 O ASN A 41 -2.830 -11.115 8.198 1.00 0.00 O ATOM 630 CB ASN A 41 0.127 -10.333 9.867 1.00 0.00 C ATOM 631 CG ASN A 41 1.545 -10.661 9.440 1.00 0.00 C ATOM 632 OD1 ASN A 41 2.429 -9.805 9.478 1.00 0.00 O ATOM 633 ND2 ASN A 41 1.767 -11.905 9.031 1.00 0.00 N ATOM 0 H ASN A 41 -0.254 -7.995 9.133 1.00 0.00 H new ATOM 0 HA ASN A 41 -0.431 -10.518 7.799 1.00 0.00 H new ATOM 0 HB2 ASN A 41 0.146 -9.499 10.569 1.00 0.00 H new ATOM 0 HB3 ASN A 41 -0.297 -11.186 10.397 1.00 0.00 H new ATOM 0 HD21 ASN A 41 2.701 -12.184 8.732 1.00 0.00 H new ATOM 0 HD22 ASN A 41 1.003 -12.581 9.016 1.00 0.00 H new ATOM 640 N ARG A 42 -2.735 -9.921 10.103 1.00 0.00 N ATOM 641 CA ARG A 42 -4.101 -10.242 10.501 1.00 0.00 C ATOM 642 C ARG A 42 -5.083 -9.926 9.377 1.00 0.00 C ATOM 643 O ARG A 42 -5.754 -10.817 8.857 1.00 0.00 O ATOM 644 CB ARG A 42 -4.484 -9.463 11.761 1.00 0.00 C ATOM 645 CG ARG A 42 -5.496 -10.182 12.637 1.00 0.00 C ATOM 646 CD ARG A 42 -4.819 -11.171 13.574 1.00 0.00 C ATOM 647 NE ARG A 42 -3.998 -10.500 14.578 1.00 0.00 N ATOM 648 CZ ARG A 42 -3.062 -11.114 15.292 1.00 0.00 C ATOM 649 NH1 ARG A 42 -2.829 -12.407 15.113 1.00 0.00 N ATOM 650 NH2 ARG A 42 -2.356 -10.435 16.187 1.00 0.00 N ATOM 0 H ARG A 42 -2.236 -9.318 10.757 1.00 0.00 H new ATOM 0 HA ARG A 42 -4.150 -11.310 10.713 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -3.584 -9.268 12.345 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -4.891 -8.495 11.470 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -6.057 -9.452 13.220 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -6.214 -10.708 12.008 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -5.577 -11.776 14.071 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -4.197 -11.853 12.994 1.00 0.00 H new ATOM 0 HE ARG A 42 -4.152 -9.505 14.740 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -3.369 -12.932 14.426 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -2.109 -12.876 15.663 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -2.532 -9.440 16.327 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -1.637 -10.908 16.735 1.00 0.00 H new ATOM 664 N ALA A 43 -5.162 -8.652 9.007 1.00 0.00 N ATOM 665 CA ALA A 43 -6.061 -8.219 7.944 1.00 0.00 C ATOM 666 C ALA A 43 -6.109 -9.243 6.815 1.00 0.00 C ATOM 667 O ALA A 43 -7.185 -9.630 6.359 1.00 0.00 O ATOM 668 CB ALA A 43 -5.631 -6.861 7.410 1.00 0.00 C ATOM 0 H ALA A 43 -4.614 -7.901 9.428 1.00 0.00 H new ATOM 0 HA ALA A 43 -7.064 -8.131 8.363 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -6.311 -6.550 6.617 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -5.655 -6.128 8.217 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -4.618 -6.930 7.013 1.00 0.00 H new ATOM 674 N PHE A 44 -4.936 -9.678 6.367 1.00 0.00 N ATOM 675 CA PHE A 44 -4.844 -10.656 5.289 1.00 0.00 C ATOM 676 C PHE A 44 -5.842 -11.791 5.498 1.00 0.00 C ATOM 677 O PHE A 44 -6.520 -12.216 4.563 1.00 0.00 O ATOM 678 CB PHE A 44 -3.424 -11.220 5.203 1.00 0.00 C ATOM 679 CG PHE A 44 -3.203 -12.108 4.012 1.00 0.00 C ATOM 680 CD1 PHE A 44 -3.447 -11.643 2.730 1.00 0.00 C ATOM 681 CD2 PHE A 44 -2.751 -13.407 4.174 1.00 0.00 C ATOM 682 CE1 PHE A 44 -3.244 -12.457 1.631 1.00 0.00 C ATOM 683 CE2 PHE A 44 -2.547 -14.226 3.080 1.00 0.00 C ATOM 684 CZ PHE A 44 -2.794 -13.751 1.807 1.00 0.00 C ATOM 0 H PHE A 44 -4.036 -9.369 6.734 1.00 0.00 H new ATOM 0 HA PHE A 44 -5.085 -10.152 4.353 1.00 0.00 H new ATOM 0 HB2 PHE A 44 -2.715 -10.393 5.166 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -3.210 -11.784 6.111 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -3.800 -10.632 2.587 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -2.556 -13.784 5.167 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -3.437 -12.082 0.637 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -2.195 -15.237 3.220 1.00 0.00 H new ATOM 0 HZ PHE A 44 -2.636 -14.390 0.951 1.00 0.00 H new ATOM 694 N TRP A 45 -5.925 -12.277 6.731 1.00 0.00 N ATOM 695 CA TRP A 45 -6.840 -13.364 7.064 1.00 0.00 C ATOM 696 C TRP A 45 -8.222 -12.824 7.414 1.00 0.00 C ATOM 697 O TRP A 45 -9.234 -13.317 6.917 1.00 0.00 O ATOM 698 CB TRP A 45 -6.288 -14.183 8.232 1.00 0.00 C ATOM 699 CG TRP A 45 -4.793 -14.285 8.232 1.00 0.00 C ATOM 700 CD1 TRP A 45 -3.972 -14.302 7.140 1.00 0.00 C ATOM 701 CD2 TRP A 45 -3.940 -14.385 9.378 1.00 0.00 C ATOM 702 NE1 TRP A 45 -2.662 -14.407 7.538 1.00 0.00 N ATOM 703 CE2 TRP A 45 -2.615 -14.459 8.906 1.00 0.00 C ATOM 704 CE3 TRP A 45 -4.168 -14.418 10.756 1.00 0.00 C ATOM 705 CZ2 TRP A 45 -1.525 -14.565 9.765 1.00 0.00 C ATOM 706 CZ3 TRP A 45 -3.084 -14.523 11.608 1.00 0.00 C ATOM 707 CH2 TRP A 45 -1.776 -14.595 11.110 1.00 0.00 C ATOM 0 H TRP A 45 -5.371 -11.936 7.517 1.00 0.00 H new ATOM 0 HA TRP A 45 -6.933 -14.008 6.190 1.00 0.00 H new ATOM 0 HB2 TRP A 45 -6.614 -13.732 9.169 1.00 0.00 H new ATOM 0 HB3 TRP A 45 -6.713 -15.186 8.196 1.00 0.00 H new ATOM 0 HD1 TRP A 45 -4.305 -14.242 6.114 1.00 0.00 H new ATOM 0 HE1 TRP A 45 -1.855 -14.441 6.916 1.00 0.00 H new ATOM 0 HE3 TRP A 45 -5.173 -14.363 11.149 1.00 0.00 H new ATOM 0 HZ2 TRP A 45 -0.516 -14.622 9.383 1.00 0.00 H new ATOM 0 HZ3 TRP A 45 -3.248 -14.550 12.675 1.00 0.00 H new ATOM 0 HH2 TRP A 45 -0.950 -14.676 11.801 1.00 0.00 H new ATOM 718 N GLU A 46 -8.257 -11.809 8.272 1.00 0.00 N ATOM 719 CA GLU A 46 -9.516 -11.203 8.688 1.00 0.00 C ATOM 720 C GLU A 46 -10.238 -10.578 7.498 1.00 0.00 C ATOM 721 O GLU A 46 -11.407 -10.202 7.594 1.00 0.00 O ATOM 722 CB GLU A 46 -9.268 -10.143 9.762 1.00 0.00 C ATOM 723 CG GLU A 46 -9.166 -10.713 11.167 1.00 0.00 C ATOM 724 CD GLU A 46 -9.474 -9.684 12.238 1.00 0.00 C ATOM 725 OE1 GLU A 46 -10.526 -9.018 12.137 1.00 0.00 O ATOM 726 OE2 GLU A 46 -8.663 -9.545 13.177 1.00 0.00 O ATOM 0 H GLU A 46 -7.428 -11.389 8.692 1.00 0.00 H new ATOM 0 HA GLU A 46 -10.148 -11.988 9.103 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -8.347 -9.609 9.528 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -10.076 -9.412 9.733 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -9.855 -11.552 11.266 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -8.161 -11.106 11.324 1.00 0.00 H new ATOM 733 N SER A 47 -9.534 -10.469 6.376 1.00 0.00 N ATOM 734 CA SER A 47 -10.105 -9.885 5.168 1.00 0.00 C ATOM 735 C SER A 47 -9.763 -10.729 3.943 1.00 0.00 C ATOM 736 O SER A 47 -8.857 -11.560 3.982 1.00 0.00 O ATOM 737 CB SER A 47 -9.594 -8.456 4.976 1.00 0.00 C ATOM 738 OG SER A 47 -10.154 -7.581 5.939 1.00 0.00 O ATOM 0 H SER A 47 -8.567 -10.778 6.278 1.00 0.00 H new ATOM 0 HA SER A 47 -11.189 -9.863 5.282 1.00 0.00 H new ATOM 0 HB2 SER A 47 -8.507 -8.441 5.055 1.00 0.00 H new ATOM 0 HB3 SER A 47 -9.845 -8.108 3.974 1.00 0.00 H new ATOM 0 HG SER A 47 -9.437 -7.180 6.473 1.00 0.00 H new ATOM 744 N SER A 48 -10.496 -10.507 2.857 1.00 0.00 N ATOM 745 CA SER A 48 -10.274 -11.248 1.621 1.00 0.00 C ATOM 746 C SER A 48 -8.912 -10.913 1.023 1.00 0.00 C ATOM 747 O SER A 48 -8.107 -11.803 0.746 1.00 0.00 O ATOM 748 CB SER A 48 -11.379 -10.936 0.609 1.00 0.00 C ATOM 749 OG SER A 48 -12.472 -11.826 0.756 1.00 0.00 O ATOM 0 H SER A 48 -11.249 -9.820 2.808 1.00 0.00 H new ATOM 0 HA SER A 48 -10.296 -12.312 1.856 1.00 0.00 H new ATOM 0 HB2 SER A 48 -11.721 -9.910 0.744 1.00 0.00 H new ATOM 0 HB3 SER A 48 -10.981 -11.009 -0.403 1.00 0.00 H new ATOM 0 HG SER A 48 -13.165 -11.604 0.099 1.00 0.00 H new ATOM 755 N ILE A 49 -8.660 -9.623 0.827 1.00 0.00 N ATOM 756 CA ILE A 49 -7.395 -9.169 0.263 1.00 0.00 C ATOM 757 C ILE A 49 -6.850 -7.969 1.030 1.00 0.00 C ATOM 758 O ILE A 49 -7.527 -7.412 1.895 1.00 0.00 O ATOM 759 CB ILE A 49 -7.544 -8.789 -1.222 1.00 0.00 C ATOM 760 CG1 ILE A 49 -8.465 -9.782 -1.935 1.00 0.00 C ATOM 761 CG2 ILE A 49 -6.181 -8.743 -1.897 1.00 0.00 C ATOM 762 CD1 ILE A 49 -9.005 -9.268 -3.251 1.00 0.00 C ATOM 0 H ILE A 49 -9.315 -8.874 1.051 1.00 0.00 H new ATOM 0 HA ILE A 49 -6.696 -10.001 0.349 1.00 0.00 H new ATOM 0 HB ILE A 49 -7.992 -7.797 -1.285 1.00 0.00 H new ATOM 0 HG12 ILE A 49 -7.919 -10.708 -2.113 1.00 0.00 H new ATOM 0 HG13 ILE A 49 -9.301 -10.025 -1.279 1.00 0.00 H new ATOM 0 HG21 ILE A 49 -6.303 -8.473 -2.946 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -5.555 -8.001 -1.402 1.00 0.00 H new ATOM 0 HG23 ILE A 49 -5.707 -9.722 -1.827 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -9.649 -10.024 -3.700 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -9.579 -8.358 -3.078 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -8.176 -9.051 -3.925 1.00 0.00 H new ATOM 774 N VAL A 50 -5.622 -7.575 0.708 1.00 0.00 N ATOM 775 CA VAL A 50 -4.987 -6.439 1.364 1.00 0.00 C ATOM 776 C VAL A 50 -4.311 -5.524 0.349 1.00 0.00 C ATOM 777 O VAL A 50 -3.204 -5.804 -0.114 1.00 0.00 O ATOM 778 CB VAL A 50 -3.942 -6.900 2.398 1.00 0.00 C ATOM 779 CG1 VAL A 50 -3.244 -5.702 3.024 1.00 0.00 C ATOM 780 CG2 VAL A 50 -4.596 -7.764 3.466 1.00 0.00 C ATOM 0 H VAL A 50 -5.047 -8.026 -0.004 1.00 0.00 H new ATOM 0 HA VAL A 50 -5.776 -5.888 1.876 1.00 0.00 H new ATOM 0 HB VAL A 50 -3.190 -7.501 1.886 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -2.510 -6.048 3.752 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -2.741 -5.127 2.247 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -3.980 -5.072 3.523 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -3.844 -8.081 4.188 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -5.369 -7.189 3.976 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -5.044 -8.642 3.000 1.00 0.00 H new ATOM 790 N TYR A 51 -4.983 -4.431 0.006 1.00 0.00 N ATOM 791 CA TYR A 51 -4.448 -3.476 -0.957 1.00 0.00 C ATOM 792 C TYR A 51 -3.466 -2.519 -0.288 1.00 0.00 C ATOM 793 O TYR A 51 -3.816 -1.815 0.660 1.00 0.00 O ATOM 794 CB TYR A 51 -5.585 -2.685 -1.608 1.00 0.00 C ATOM 795 CG TYR A 51 -6.322 -3.456 -2.680 1.00 0.00 C ATOM 796 CD1 TYR A 51 -5.633 -4.085 -3.709 1.00 0.00 C ATOM 797 CD2 TYR A 51 -7.708 -3.555 -2.662 1.00 0.00 C ATOM 798 CE1 TYR A 51 -6.303 -4.790 -4.690 1.00 0.00 C ATOM 799 CE2 TYR A 51 -8.386 -4.258 -3.639 1.00 0.00 C ATOM 800 CZ TYR A 51 -7.679 -4.873 -4.651 1.00 0.00 C ATOM 801 OH TYR A 51 -8.350 -5.575 -5.627 1.00 0.00 O ATOM 0 H TYR A 51 -5.899 -4.184 0.380 1.00 0.00 H new ATOM 0 HA TYR A 51 -3.915 -4.035 -1.727 1.00 0.00 H new ATOM 0 HB2 TYR A 51 -6.294 -2.383 -0.837 1.00 0.00 H new ATOM 0 HB3 TYR A 51 -5.179 -1.772 -2.043 1.00 0.00 H new ATOM 0 HD1 TYR A 51 -4.555 -4.022 -3.743 1.00 0.00 H new ATOM 0 HD2 TYR A 51 -8.264 -3.074 -1.871 1.00 0.00 H new ATOM 0 HE1 TYR A 51 -5.752 -5.274 -5.483 1.00 0.00 H new ATOM 0 HE2 TYR A 51 -9.464 -4.326 -3.611 1.00 0.00 H new ATOM 0 HH TYR A 51 -9.314 -5.537 -5.453 1.00 0.00 H new ATOM 811 N LEU A 52 -2.236 -2.499 -0.788 1.00 0.00 N ATOM 812 CA LEU A 52 -1.201 -1.629 -0.240 1.00 0.00 C ATOM 813 C LEU A 52 -0.755 -0.598 -1.271 1.00 0.00 C ATOM 814 O LEU A 52 -0.161 -0.943 -2.293 1.00 0.00 O ATOM 815 CB LEU A 52 -0.002 -2.458 0.222 1.00 0.00 C ATOM 816 CG LEU A 52 -0.327 -3.743 0.983 1.00 0.00 C ATOM 817 CD1 LEU A 52 0.857 -4.698 0.950 1.00 0.00 C ATOM 818 CD2 LEU A 52 -0.721 -3.429 2.419 1.00 0.00 C ATOM 0 H LEU A 52 -1.930 -3.075 -1.572 1.00 0.00 H new ATOM 0 HA LEU A 52 -1.620 -1.101 0.616 1.00 0.00 H new ATOM 0 HB2 LEU A 52 0.593 -2.719 -0.653 1.00 0.00 H new ATOM 0 HB3 LEU A 52 0.624 -1.832 0.858 1.00 0.00 H new ATOM 0 HG LEU A 52 -1.172 -4.227 0.493 1.00 0.00 H new ATOM 0 HD11 LEU A 52 0.607 -5.607 1.497 1.00 0.00 H new ATOM 0 HD12 LEU A 52 1.093 -4.950 -0.084 1.00 0.00 H new ATOM 0 HD13 LEU A 52 1.721 -4.222 1.413 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -0.949 -4.356 2.945 1.00 0.00 H new ATOM 0 HD22 LEU A 52 0.103 -2.921 2.920 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -1.600 -2.785 2.422 1.00 0.00 H new ATOM 830 N VAL A 53 -1.043 0.670 -0.996 1.00 0.00 N ATOM 831 CA VAL A 53 -0.668 1.753 -1.899 1.00 0.00 C ATOM 832 C VAL A 53 0.716 2.295 -1.561 1.00 0.00 C ATOM 833 O VAL A 53 0.902 2.965 -0.545 1.00 0.00 O ATOM 834 CB VAL A 53 -1.686 2.907 -1.844 1.00 0.00 C ATOM 835 CG1 VAL A 53 -1.257 4.042 -2.762 1.00 0.00 C ATOM 836 CG2 VAL A 53 -3.076 2.409 -2.213 1.00 0.00 C ATOM 0 H VAL A 53 -1.535 0.973 -0.155 1.00 0.00 H new ATOM 0 HA VAL A 53 -0.656 1.336 -2.906 1.00 0.00 H new ATOM 0 HB VAL A 53 -1.720 3.290 -0.824 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -1.989 4.848 -2.710 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -0.282 4.415 -2.448 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -1.192 3.676 -3.787 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -3.783 3.238 -2.169 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -3.060 1.999 -3.223 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -3.383 1.633 -1.512 1.00 0.00 H new ATOM 846 N PHE A 54 1.687 2.001 -2.420 1.00 0.00 N ATOM 847 CA PHE A 54 3.056 2.458 -2.214 1.00 0.00 C ATOM 848 C PHE A 54 3.292 3.797 -2.907 1.00 0.00 C ATOM 849 O PHE A 54 2.805 4.029 -4.014 1.00 0.00 O ATOM 850 CB PHE A 54 4.048 1.418 -2.736 1.00 0.00 C ATOM 851 CG PHE A 54 3.690 0.008 -2.363 1.00 0.00 C ATOM 852 CD1 PHE A 54 2.748 -0.699 -3.093 1.00 0.00 C ATOM 853 CD2 PHE A 54 4.295 -0.611 -1.281 1.00 0.00 C ATOM 854 CE1 PHE A 54 2.417 -1.997 -2.752 1.00 0.00 C ATOM 855 CE2 PHE A 54 3.968 -1.909 -0.936 1.00 0.00 C ATOM 856 CZ PHE A 54 3.027 -2.602 -1.672 1.00 0.00 C ATOM 0 H PHE A 54 1.550 1.448 -3.266 1.00 0.00 H new ATOM 0 HA PHE A 54 3.211 2.591 -1.143 1.00 0.00 H new ATOM 0 HB2 PHE A 54 4.105 1.495 -3.822 1.00 0.00 H new ATOM 0 HB3 PHE A 54 5.040 1.647 -2.348 1.00 0.00 H new ATOM 0 HD1 PHE A 54 2.267 -0.230 -3.939 1.00 0.00 H new ATOM 0 HD2 PHE A 54 5.030 -0.073 -0.701 1.00 0.00 H new ATOM 0 HE1 PHE A 54 1.682 -2.537 -3.330 1.00 0.00 H new ATOM 0 HE2 PHE A 54 4.448 -2.381 -0.091 1.00 0.00 H new ATOM 0 HZ PHE A 54 2.769 -3.616 -1.403 1.00 0.00 H new ATOM 866 N SER A 55 4.043 4.673 -2.248 1.00 0.00 N ATOM 867 CA SER A 55 4.342 5.990 -2.798 1.00 0.00 C ATOM 868 C SER A 55 5.654 6.529 -2.238 1.00 0.00 C ATOM 869 O SER A 55 5.790 6.733 -1.031 1.00 0.00 O ATOM 870 CB SER A 55 3.204 6.965 -2.489 1.00 0.00 C ATOM 871 OG SER A 55 3.559 8.292 -2.840 1.00 0.00 O ATOM 0 H SER A 55 4.456 4.495 -1.332 1.00 0.00 H new ATOM 0 HA SER A 55 4.443 5.890 -3.879 1.00 0.00 H new ATOM 0 HB2 SER A 55 2.309 6.668 -3.035 1.00 0.00 H new ATOM 0 HB3 SER A 55 2.960 6.919 -1.428 1.00 0.00 H new ATOM 0 HG SER A 55 2.815 8.895 -2.634 1.00 0.00 H new ATOM 877 N VAL A 56 6.620 6.756 -3.123 1.00 0.00 N ATOM 878 CA VAL A 56 7.922 7.272 -2.718 1.00 0.00 C ATOM 879 C VAL A 56 7.823 8.726 -2.272 1.00 0.00 C ATOM 880 O VAL A 56 7.096 9.520 -2.869 1.00 0.00 O ATOM 881 CB VAL A 56 8.948 7.167 -3.862 1.00 0.00 C ATOM 882 CG1 VAL A 56 10.283 7.760 -3.439 1.00 0.00 C ATOM 883 CG2 VAL A 56 9.113 5.718 -4.298 1.00 0.00 C ATOM 0 H VAL A 56 6.525 6.591 -4.125 1.00 0.00 H new ATOM 0 HA VAL A 56 8.258 6.660 -1.881 1.00 0.00 H new ATOM 0 HB VAL A 56 8.577 7.739 -4.713 1.00 0.00 H new ATOM 0 HG11 VAL A 56 10.995 7.677 -4.260 1.00 0.00 H new ATOM 0 HG12 VAL A 56 10.149 8.810 -3.180 1.00 0.00 H new ATOM 0 HG13 VAL A 56 10.663 7.219 -2.573 1.00 0.00 H new ATOM 0 HG21 VAL A 56 9.841 5.662 -5.107 1.00 0.00 H new ATOM 0 HG22 VAL A 56 9.461 5.122 -3.455 1.00 0.00 H new ATOM 0 HG23 VAL A 56 8.155 5.331 -4.645 1.00 0.00 H new ATOM 893 N GLN A 57 8.558 9.068 -1.219 1.00 0.00 N ATOM 894 CA GLN A 57 8.553 10.427 -0.692 1.00 0.00 C ATOM 895 C GLN A 57 9.203 11.395 -1.676 1.00 0.00 C ATOM 896 O GLN A 57 10.351 11.210 -2.077 1.00 0.00 O ATOM 897 CB GLN A 57 9.283 10.480 0.651 1.00 0.00 C ATOM 898 CG GLN A 57 10.753 10.101 0.559 1.00 0.00 C ATOM 899 CD GLN A 57 11.642 11.286 0.239 1.00 0.00 C ATOM 900 OE1 GLN A 57 12.454 11.235 -0.685 1.00 0.00 O ATOM 901 NE2 GLN A 57 11.493 12.362 1.003 1.00 0.00 N ATOM 0 H GLN A 57 9.165 8.422 -0.714 1.00 0.00 H new ATOM 0 HA GLN A 57 7.516 10.728 -0.545 1.00 0.00 H new ATOM 0 HB2 GLN A 57 9.201 11.487 1.061 1.00 0.00 H new ATOM 0 HB3 GLN A 57 8.786 9.809 1.352 1.00 0.00 H new ATOM 0 HG2 GLN A 57 11.070 9.658 1.503 1.00 0.00 H new ATOM 0 HG3 GLN A 57 10.880 9.338 -0.209 1.00 0.00 H new ATOM 0 HE21 GLN A 57 10.807 12.360 1.758 1.00 0.00 H new ATOM 0 HE22 GLN A 57 12.064 13.190 0.835 1.00 0.00 H new ATOM 935 N HIS A 61 3.909 11.321 -7.498 1.00 0.00 N ATOM 936 CA HIS A 61 2.851 10.422 -7.944 1.00 0.00 C ATOM 937 C HIS A 61 2.829 9.150 -7.102 1.00 0.00 C ATOM 938 O HIS A 61 3.727 8.912 -6.294 1.00 0.00 O ATOM 939 CB HIS A 61 3.041 10.068 -9.419 1.00 0.00 C ATOM 940 CG HIS A 61 3.137 11.264 -10.314 1.00 0.00 C ATOM 941 ND1 HIS A 61 3.788 12.425 -9.953 1.00 0.00 N ATOM 942 CD2 HIS A 61 2.660 11.476 -11.564 1.00 0.00 C ATOM 943 CE1 HIS A 61 3.707 13.299 -10.941 1.00 0.00 C ATOM 944 NE2 HIS A 61 3.027 12.747 -11.930 1.00 0.00 N ATOM 0 HA HIS A 61 1.897 10.935 -7.822 1.00 0.00 H new ATOM 0 HB2 HIS A 61 3.946 9.470 -9.527 1.00 0.00 H new ATOM 0 HB3 HIS A 61 2.207 9.446 -9.745 1.00 0.00 H new ATOM 0 HD1 HIS A 61 4.259 12.584 -9.062 1.00 0.00 H new ATOM 0 HD2 HIS A 61 2.096 10.775 -12.162 1.00 0.00 H new ATOM 0 HE1 HIS A 61 4.125 14.295 -10.940 1.00 0.00 H new ATOM 952 N PHE A 62 1.797 8.335 -7.296 1.00 0.00 N ATOM 953 CA PHE A 62 1.657 7.088 -6.553 1.00 0.00 C ATOM 954 C PHE A 62 2.367 5.945 -7.272 1.00 0.00 C ATOM 955 O PHE A 62 1.874 5.425 -8.272 1.00 0.00 O ATOM 956 CB PHE A 62 0.177 6.746 -6.364 1.00 0.00 C ATOM 957 CG PHE A 62 -0.443 7.408 -5.168 1.00 0.00 C ATOM 958 CD1 PHE A 62 -0.316 6.849 -3.906 1.00 0.00 C ATOM 959 CD2 PHE A 62 -1.155 8.589 -5.304 1.00 0.00 C ATOM 960 CE1 PHE A 62 -0.885 7.456 -2.803 1.00 0.00 C ATOM 961 CE2 PHE A 62 -1.726 9.201 -4.205 1.00 0.00 C ATOM 962 CZ PHE A 62 -1.592 8.633 -2.953 1.00 0.00 C ATOM 0 H PHE A 62 1.045 8.516 -7.962 1.00 0.00 H new ATOM 0 HA PHE A 62 2.120 7.222 -5.575 1.00 0.00 H new ATOM 0 HB2 PHE A 62 -0.373 7.041 -7.258 1.00 0.00 H new ATOM 0 HB3 PHE A 62 0.072 5.665 -6.267 1.00 0.00 H new ATOM 0 HD1 PHE A 62 0.234 5.928 -3.783 1.00 0.00 H new ATOM 0 HD2 PHE A 62 -1.265 9.036 -6.281 1.00 0.00 H new ATOM 0 HE1 PHE A 62 -0.777 7.011 -1.825 1.00 0.00 H new ATOM 0 HE2 PHE A 62 -2.277 10.122 -4.325 1.00 0.00 H new ATOM 0 HZ PHE A 62 -2.039 9.109 -2.093 1.00 0.00 H new ATOM 972 N GLN A 63 3.529 5.559 -6.753 1.00 0.00 N ATOM 973 CA GLN A 63 4.308 4.478 -7.345 1.00 0.00 C ATOM 974 C GLN A 63 3.405 3.324 -7.768 1.00 0.00 C ATOM 975 O GLN A 63 3.755 2.539 -8.648 1.00 0.00 O ATOM 976 CB GLN A 63 5.363 3.981 -6.356 1.00 0.00 C ATOM 977 CG GLN A 63 6.690 4.715 -6.461 1.00 0.00 C ATOM 978 CD GLN A 63 7.197 4.803 -7.887 1.00 0.00 C ATOM 979 OE1 GLN A 63 7.872 3.896 -8.375 1.00 0.00 O ATOM 980 NE2 GLN A 63 6.874 5.899 -8.564 1.00 0.00 N ATOM 0 H GLN A 63 3.951 5.979 -5.925 1.00 0.00 H new ATOM 0 HA GLN A 63 4.807 4.867 -8.232 1.00 0.00 H new ATOM 0 HB2 GLN A 63 4.977 4.088 -5.342 1.00 0.00 H new ATOM 0 HB3 GLN A 63 5.532 2.917 -6.522 1.00 0.00 H new ATOM 0 HG2 GLN A 63 6.577 5.721 -6.057 1.00 0.00 H new ATOM 0 HG3 GLN A 63 7.432 4.206 -5.846 1.00 0.00 H new ATOM 0 HE21 GLN A 63 6.313 6.626 -8.120 1.00 0.00 H new ATOM 0 HE22 GLN A 63 7.187 6.014 -9.528 1.00 0.00 H new ATOM 989 N GLY A 64 2.240 3.227 -7.133 1.00 0.00 N ATOM 990 CA GLY A 64 1.305 2.166 -7.457 1.00 0.00 C ATOM 991 C GLY A 64 0.815 1.430 -6.225 1.00 0.00 C ATOM 992 O GLY A 64 1.067 1.855 -5.098 1.00 0.00 O ATOM 0 H GLY A 64 1.928 3.864 -6.400 1.00 0.00 H new ATOM 0 HA2 GLY A 64 0.452 2.587 -7.988 1.00 0.00 H new ATOM 0 HA3 GLY A 64 1.784 1.458 -8.133 1.00 0.00 H new ATOM 996 N PHE A 65 0.109 0.325 -6.440 1.00 0.00 N ATOM 997 CA PHE A 65 -0.421 -0.470 -5.339 1.00 0.00 C ATOM 998 C PHE A 65 -0.248 -1.961 -5.611 1.00 0.00 C ATOM 999 O PHE A 65 -0.105 -2.381 -6.760 1.00 0.00 O ATOM 1000 CB PHE A 65 -1.900 -0.149 -5.116 1.00 0.00 C ATOM 1001 CG PHE A 65 -2.821 -0.890 -6.042 1.00 0.00 C ATOM 1002 CD1 PHE A 65 -3.155 -0.361 -7.279 1.00 0.00 C ATOM 1003 CD2 PHE A 65 -3.352 -2.117 -5.677 1.00 0.00 C ATOM 1004 CE1 PHE A 65 -4.002 -1.041 -8.133 1.00 0.00 C ATOM 1005 CE2 PHE A 65 -4.200 -2.802 -6.527 1.00 0.00 C ATOM 1006 CZ PHE A 65 -4.524 -2.264 -7.757 1.00 0.00 C ATOM 0 H PHE A 65 -0.109 -0.040 -7.367 1.00 0.00 H new ATOM 0 HA PHE A 65 0.139 -0.216 -4.439 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -2.164 -0.388 -4.086 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -2.054 0.922 -5.244 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -2.748 0.594 -7.579 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -3.100 -2.543 -4.717 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -4.256 -0.617 -9.093 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -4.609 -3.756 -6.230 1.00 0.00 H new ATOM 0 HZ PHE A 65 -5.184 -2.798 -8.424 1.00 0.00 H new ATOM 1016 N SER A 66 -0.263 -2.757 -4.547 1.00 0.00 N ATOM 1017 CA SER A 66 -0.103 -4.201 -4.670 1.00 0.00 C ATOM 1018 C SER A 66 -0.882 -4.929 -3.578 1.00 0.00 C ATOM 1019 O SER A 66 -0.805 -4.572 -2.403 1.00 0.00 O ATOM 1020 CB SER A 66 1.377 -4.581 -4.595 1.00 0.00 C ATOM 1021 OG SER A 66 2.185 -3.612 -5.241 1.00 0.00 O ATOM 0 H SER A 66 -0.384 -2.426 -3.590 1.00 0.00 H new ATOM 0 HA SER A 66 -0.499 -4.504 -5.639 1.00 0.00 H new ATOM 0 HB2 SER A 66 1.679 -4.675 -3.552 1.00 0.00 H new ATOM 0 HB3 SER A 66 1.530 -5.555 -5.060 1.00 0.00 H new ATOM 0 HG SER A 66 2.681 -3.099 -4.569 1.00 0.00 H new ATOM 1027 N ARG A 67 -1.632 -5.951 -3.976 1.00 0.00 N ATOM 1028 CA ARG A 67 -2.426 -6.729 -3.033 1.00 0.00 C ATOM 1029 C ARG A 67 -1.593 -7.847 -2.413 1.00 0.00 C ATOM 1030 O ARG A 67 -0.934 -8.608 -3.120 1.00 0.00 O ATOM 1031 CB ARG A 67 -3.652 -7.320 -3.732 1.00 0.00 C ATOM 1032 CG ARG A 67 -3.310 -8.191 -4.929 1.00 0.00 C ATOM 1033 CD ARG A 67 -4.555 -8.824 -5.531 1.00 0.00 C ATOM 1034 NE ARG A 67 -4.228 -9.920 -6.438 1.00 0.00 N ATOM 1035 CZ ARG A 67 -5.138 -10.719 -6.985 1.00 0.00 C ATOM 1036 NH1 ARG A 67 -6.424 -10.543 -6.719 1.00 0.00 N ATOM 1037 NH2 ARG A 67 -4.761 -11.695 -7.801 1.00 0.00 N ATOM 0 H ARG A 67 -1.706 -6.260 -4.945 1.00 0.00 H new ATOM 0 HA ARG A 67 -2.756 -6.061 -2.237 1.00 0.00 H new ATOM 0 HB2 ARG A 67 -4.219 -7.911 -3.013 1.00 0.00 H new ATOM 0 HB3 ARG A 67 -4.301 -6.507 -4.058 1.00 0.00 H new ATOM 0 HG2 ARG A 67 -2.804 -7.590 -5.685 1.00 0.00 H new ATOM 0 HG3 ARG A 67 -2.614 -8.973 -4.625 1.00 0.00 H new ATOM 0 HD2 ARG A 67 -5.196 -9.195 -4.731 1.00 0.00 H new ATOM 0 HD3 ARG A 67 -5.123 -8.065 -6.069 1.00 0.00 H new ATOM 0 HE ARG A 67 -3.247 -10.081 -6.664 1.00 0.00 H new ATOM 0 HH11 ARG A 67 -6.717 -9.793 -6.093 1.00 0.00 H new ATOM 0 HH12 ARG A 67 -7.121 -11.158 -7.140 1.00 0.00 H new ATOM 0 HH21 ARG A 67 -3.772 -11.832 -8.009 1.00 0.00 H new ATOM 0 HH22 ARG A 67 -5.460 -12.308 -8.220 1.00 0.00 H new ATOM 1051 N MET A 68 -1.628 -7.938 -1.088 1.00 0.00 N ATOM 1052 CA MET A 68 -0.876 -8.964 -0.373 1.00 0.00 C ATOM 1053 C MET A 68 -1.264 -10.358 -0.856 1.00 0.00 C ATOM 1054 O MET A 68 -2.442 -10.715 -0.871 1.00 0.00 O ATOM 1055 CB MET A 68 -1.119 -8.848 1.133 1.00 0.00 C ATOM 1056 CG MET A 68 0.041 -9.350 1.976 1.00 0.00 C ATOM 1057 SD MET A 68 0.149 -8.521 3.574 1.00 0.00 S ATOM 1058 CE MET A 68 0.330 -9.925 4.672 1.00 0.00 C ATOM 0 H MET A 68 -2.168 -7.315 -0.488 1.00 0.00 H new ATOM 0 HA MET A 68 0.184 -8.810 -0.576 1.00 0.00 H new ATOM 0 HB2 MET A 68 -1.314 -7.805 1.382 1.00 0.00 H new ATOM 0 HB3 MET A 68 -2.016 -9.410 1.392 1.00 0.00 H new ATOM 0 HG2 MET A 68 -0.068 -10.423 2.134 1.00 0.00 H new ATOM 0 HG3 MET A 68 0.973 -9.201 1.430 1.00 0.00 H new ATOM 0 HE1 MET A 68 0.516 -9.572 5.686 1.00 0.00 H new ATOM 0 HE2 MET A 68 -0.584 -10.519 4.656 1.00 0.00 H new ATOM 0 HE3 MET A 68 1.168 -10.539 4.342 1.00 0.00 H new ATOM 1068 N SER A 69 -0.265 -11.141 -1.251 1.00 0.00 N ATOM 1069 CA SER A 69 -0.502 -12.495 -1.739 1.00 0.00 C ATOM 1070 C SER A 69 -0.080 -13.528 -0.700 1.00 0.00 C ATOM 1071 O SER A 69 -0.685 -14.594 -0.587 1.00 0.00 O ATOM 1072 CB SER A 69 0.257 -12.729 -3.046 1.00 0.00 C ATOM 1073 OG SER A 69 0.217 -14.094 -3.422 1.00 0.00 O ATOM 0 H SER A 69 0.716 -10.861 -1.243 1.00 0.00 H new ATOM 0 HA SER A 69 -1.570 -12.607 -1.923 1.00 0.00 H new ATOM 0 HB2 SER A 69 -0.178 -12.118 -3.837 1.00 0.00 H new ATOM 0 HB3 SER A 69 1.293 -12.411 -2.930 1.00 0.00 H new ATOM 0 HG SER A 69 0.708 -14.217 -4.261 1.00 0.00 H new ATOM 1079 N SER A 70 0.964 -13.205 0.057 1.00 0.00 N ATOM 1080 CA SER A 70 1.471 -14.106 1.085 1.00 0.00 C ATOM 1081 C SER A 70 1.535 -13.405 2.439 1.00 0.00 C ATOM 1082 O SER A 70 1.578 -12.178 2.512 1.00 0.00 O ATOM 1083 CB SER A 70 2.859 -14.623 0.700 1.00 0.00 C ATOM 1084 OG SER A 70 3.179 -15.804 1.414 1.00 0.00 O ATOM 0 H SER A 70 1.475 -12.326 -0.022 1.00 0.00 H new ATOM 0 HA SER A 70 0.785 -14.950 1.164 1.00 0.00 H new ATOM 0 HB2 SER A 70 2.892 -14.822 -0.371 1.00 0.00 H new ATOM 0 HB3 SER A 70 3.606 -13.856 0.905 1.00 0.00 H new ATOM 0 HG SER A 70 4.070 -16.115 1.149 1.00 0.00 H new ATOM 1090 N GLU A 71 1.541 -14.195 3.508 1.00 0.00 N ATOM 1091 CA GLU A 71 1.599 -13.651 4.859 1.00 0.00 C ATOM 1092 C GLU A 71 3.035 -13.317 5.251 1.00 0.00 C ATOM 1093 O GLU A 71 3.984 -13.750 4.596 1.00 0.00 O ATOM 1094 CB GLU A 71 1.003 -14.645 5.859 1.00 0.00 C ATOM 1095 CG GLU A 71 -0.089 -15.521 5.270 1.00 0.00 C ATOM 1096 CD GLU A 71 0.453 -16.798 4.658 1.00 0.00 C ATOM 1097 OE1 GLU A 71 1.576 -17.202 5.028 1.00 0.00 O ATOM 1098 OE2 GLU A 71 -0.243 -17.393 3.810 1.00 0.00 O ATOM 0 H GLU A 71 1.506 -15.213 3.464 1.00 0.00 H new ATOM 0 HA GLU A 71 1.013 -12.732 4.878 1.00 0.00 H new ATOM 0 HB2 GLU A 71 1.800 -15.282 6.244 1.00 0.00 H new ATOM 0 HB3 GLU A 71 0.597 -14.094 6.708 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -0.807 -15.773 6.050 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -0.629 -14.959 4.509 1.00 0.00 H new ATOM 1105 N ILE A 72 3.186 -12.545 6.321 1.00 0.00 N ATOM 1106 CA ILE A 72 4.506 -12.154 6.800 1.00 0.00 C ATOM 1107 C ILE A 72 5.052 -13.169 7.798 1.00 0.00 C ATOM 1108 O ILE A 72 4.324 -13.664 8.658 1.00 0.00 O ATOM 1109 CB ILE A 72 4.475 -10.764 7.464 1.00 0.00 C ATOM 1110 CG1 ILE A 72 3.611 -9.803 6.645 1.00 0.00 C ATOM 1111 CG2 ILE A 72 5.887 -10.218 7.615 1.00 0.00 C ATOM 1112 CD1 ILE A 72 3.395 -8.465 7.316 1.00 0.00 C ATOM 0 H ILE A 72 2.411 -12.178 6.873 1.00 0.00 H new ATOM 0 HA ILE A 72 5.160 -12.117 5.928 1.00 0.00 H new ATOM 0 HB ILE A 72 4.036 -10.861 8.457 1.00 0.00 H new ATOM 0 HG12 ILE A 72 4.080 -9.642 5.674 1.00 0.00 H new ATOM 0 HG13 ILE A 72 2.643 -10.267 6.458 1.00 0.00 H new ATOM 0 HG21 ILE A 72 5.849 -9.236 8.086 1.00 0.00 H new ATOM 0 HG22 ILE A 72 6.474 -10.895 8.235 1.00 0.00 H new ATOM 0 HG23 ILE A 72 6.351 -10.132 6.632 1.00 0.00 H new ATOM 0 HD11 ILE A 72 2.774 -7.835 6.679 1.00 0.00 H new ATOM 0 HD12 ILE A 72 2.898 -8.615 8.274 1.00 0.00 H new ATOM 0 HD13 ILE A 72 4.357 -7.980 7.479 1.00 0.00 H new ATOM 1124 N GLY A 73 6.341 -13.475 7.678 1.00 0.00 N ATOM 1125 CA GLY A 73 6.964 -14.429 8.577 1.00 0.00 C ATOM 1126 C GLY A 73 8.114 -15.172 7.928 1.00 0.00 C ATOM 1127 O GLY A 73 9.118 -14.568 7.551 1.00 0.00 O ATOM 0 H GLY A 73 6.964 -13.079 6.974 1.00 0.00 H new ATOM 0 HA2 GLY A 73 7.327 -13.906 9.462 1.00 0.00 H new ATOM 0 HA3 GLY A 73 6.216 -15.147 8.915 1.00 0.00 H new ATOM 1131 N ARG A 74 7.969 -16.487 7.798 1.00 0.00 N ATOM 1132 CA ARG A 74 9.006 -17.314 7.192 1.00 0.00 C ATOM 1133 C ARG A 74 9.723 -16.557 6.078 1.00 0.00 C ATOM 1134 O ARG A 74 10.942 -16.651 5.936 1.00 0.00 O ATOM 1135 CB ARG A 74 8.400 -18.605 6.638 1.00 0.00 C ATOM 1136 CG ARG A 74 9.421 -19.707 6.408 1.00 0.00 C ATOM 1137 CD ARG A 74 9.719 -20.466 7.691 1.00 0.00 C ATOM 1138 NE ARG A 74 10.811 -21.421 7.521 1.00 0.00 N ATOM 1139 CZ ARG A 74 11.061 -22.411 8.370 1.00 0.00 C ATOM 1140 NH1 ARG A 74 10.299 -22.577 9.443 1.00 0.00 N ATOM 1141 NH2 ARG A 74 12.073 -23.239 8.147 1.00 0.00 N ATOM 0 H ARG A 74 7.144 -17.002 8.104 1.00 0.00 H new ATOM 0 HA ARG A 74 9.733 -17.564 7.964 1.00 0.00 H new ATOM 0 HB2 ARG A 74 7.639 -18.965 7.330 1.00 0.00 H new ATOM 0 HB3 ARG A 74 7.897 -18.385 5.696 1.00 0.00 H new ATOM 0 HG2 ARG A 74 9.048 -20.399 5.653 1.00 0.00 H new ATOM 0 HG3 ARG A 74 10.342 -19.275 6.017 1.00 0.00 H new ATOM 0 HD2 ARG A 74 9.976 -19.758 8.479 1.00 0.00 H new ATOM 0 HD3 ARG A 74 8.823 -20.994 8.016 1.00 0.00 H new ATOM 0 HE ARG A 74 11.415 -21.322 6.705 1.00 0.00 H new ATOM 0 HH11 ARG A 74 9.519 -21.943 9.617 1.00 0.00 H new ATOM 0 HH12 ARG A 74 10.493 -23.338 10.094 1.00 0.00 H new ATOM 0 HH21 ARG A 74 12.661 -23.116 7.322 1.00 0.00 H new ATOM 0 HH22 ARG A 74 12.264 -23.999 8.800 1.00 0.00 H new ATOM 1155 N GLU A 75 8.957 -15.808 5.291 1.00 0.00 N ATOM 1156 CA GLU A 75 9.521 -15.036 4.189 1.00 0.00 C ATOM 1157 C GLU A 75 10.499 -13.985 4.705 1.00 0.00 C ATOM 1158 O GLU A 75 10.095 -12.926 5.184 1.00 0.00 O ATOM 1159 CB GLU A 75 8.406 -14.361 3.388 1.00 0.00 C ATOM 1160 CG GLU A 75 7.865 -15.217 2.255 1.00 0.00 C ATOM 1161 CD GLU A 75 7.347 -14.390 1.094 1.00 0.00 C ATOM 1162 OE1 GLU A 75 6.172 -13.970 1.143 1.00 0.00 O ATOM 1163 OE2 GLU A 75 8.117 -14.163 0.138 1.00 0.00 O ATOM 0 H GLU A 75 7.946 -15.719 5.395 1.00 0.00 H new ATOM 0 HA GLU A 75 10.063 -15.722 3.538 1.00 0.00 H new ATOM 0 HB2 GLU A 75 7.588 -14.107 4.063 1.00 0.00 H new ATOM 0 HB3 GLU A 75 8.782 -13.424 2.977 1.00 0.00 H new ATOM 0 HG2 GLU A 75 8.652 -15.882 1.900 1.00 0.00 H new ATOM 0 HG3 GLU A 75 7.061 -15.848 2.634 1.00 0.00 H new ATOM 1170 N LYS A 76 11.790 -14.287 4.603 1.00 0.00 N ATOM 1171 CA LYS A 76 12.828 -13.370 5.058 1.00 0.00 C ATOM 1172 C LYS A 76 13.871 -13.145 3.968 1.00 0.00 C ATOM 1173 O LYS A 76 14.988 -13.657 4.049 1.00 0.00 O ATOM 1174 CB LYS A 76 13.502 -13.916 6.319 1.00 0.00 C ATOM 1175 CG LYS A 76 12.526 -14.263 7.429 1.00 0.00 C ATOM 1176 CD LYS A 76 11.884 -13.018 8.017 1.00 0.00 C ATOM 1177 CE LYS A 76 12.808 -12.331 9.011 1.00 0.00 C ATOM 1178 NZ LYS A 76 12.048 -11.616 10.073 1.00 0.00 N ATOM 0 H LYS A 76 12.142 -15.160 4.209 1.00 0.00 H new ATOM 0 HA LYS A 76 12.358 -12.414 5.289 1.00 0.00 H new ATOM 0 HB2 LYS A 76 14.074 -14.806 6.058 1.00 0.00 H new ATOM 0 HB3 LYS A 76 14.213 -13.177 6.690 1.00 0.00 H new ATOM 0 HG2 LYS A 76 11.751 -14.924 7.040 1.00 0.00 H new ATOM 0 HG3 LYS A 76 13.047 -14.810 8.215 1.00 0.00 H new ATOM 0 HD2 LYS A 76 11.631 -12.325 7.215 1.00 0.00 H new ATOM 0 HD3 LYS A 76 10.951 -13.288 8.512 1.00 0.00 H new ATOM 0 HE2 LYS A 76 13.463 -13.072 9.470 1.00 0.00 H new ATOM 0 HE3 LYS A 76 13.447 -11.623 8.483 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 12.246 -10.597 10.015 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 11.029 -11.779 9.941 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 12.337 -11.972 11.006 1.00 0.00 H new ATOM 1192 N SER A 77 13.500 -12.376 2.950 1.00 0.00 N ATOM 1193 CA SER A 77 14.403 -12.085 1.842 1.00 0.00 C ATOM 1194 C SER A 77 15.693 -11.447 2.347 1.00 0.00 C ATOM 1195 O SER A 77 15.851 -11.203 3.542 1.00 0.00 O ATOM 1196 CB SER A 77 13.723 -11.159 0.832 1.00 0.00 C ATOM 1197 OG SER A 77 14.284 -11.314 -0.460 1.00 0.00 O ATOM 0 H SER A 77 12.580 -11.943 2.869 1.00 0.00 H new ATOM 0 HA SER A 77 14.652 -13.026 1.351 1.00 0.00 H new ATOM 0 HB2 SER A 77 12.655 -11.376 0.797 1.00 0.00 H new ATOM 0 HB3 SER A 77 13.828 -10.123 1.155 1.00 0.00 H new ATOM 0 HG SER A 77 13.831 -10.713 -1.088 1.00 0.00 H new ATOM 1203 N GLN A 78 16.613 -11.180 1.425 1.00 0.00 N ATOM 1204 CA GLN A 78 17.891 -10.571 1.776 1.00 0.00 C ATOM 1205 C GLN A 78 18.031 -9.194 1.135 1.00 0.00 C ATOM 1206 O GLN A 78 18.017 -8.173 1.824 1.00 0.00 O ATOM 1207 CB GLN A 78 19.047 -11.471 1.337 1.00 0.00 C ATOM 1208 CG GLN A 78 19.223 -12.703 2.210 1.00 0.00 C ATOM 1209 CD GLN A 78 18.383 -13.875 1.743 1.00 0.00 C ATOM 1210 OE1 GLN A 78 17.170 -13.907 1.955 1.00 0.00 O ATOM 1211 NE2 GLN A 78 19.024 -14.846 1.103 1.00 0.00 N ATOM 0 H GLN A 78 16.497 -11.376 0.431 1.00 0.00 H new ATOM 0 HA GLN A 78 17.924 -10.453 2.859 1.00 0.00 H new ATOM 0 HB2 GLN A 78 18.880 -11.786 0.307 1.00 0.00 H new ATOM 0 HB3 GLN A 78 19.971 -10.893 1.348 1.00 0.00 H new ATOM 0 HG2 GLN A 78 20.274 -12.993 2.214 1.00 0.00 H new ATOM 0 HG3 GLN A 78 18.956 -12.456 3.238 1.00 0.00 H new ATOM 0 HE21 GLN A 78 20.030 -14.778 0.949 1.00 0.00 H new ATOM 0 HE22 GLN A 78 18.510 -15.660 0.765 1.00 0.00 H new ATOM 1220 N ASP A 79 18.168 -9.173 -0.186 1.00 0.00 N ATOM 1221 CA ASP A 79 18.311 -7.921 -0.920 1.00 0.00 C ATOM 1222 C ASP A 79 17.393 -6.847 -0.346 1.00 0.00 C ATOM 1223 O ASP A 79 16.169 -6.954 -0.426 1.00 0.00 O ATOM 1224 CB ASP A 79 18.000 -8.136 -2.402 1.00 0.00 C ATOM 1225 CG ASP A 79 19.226 -8.540 -3.198 1.00 0.00 C ATOM 1226 OD1 ASP A 79 20.058 -7.658 -3.494 1.00 0.00 O ATOM 1227 OD2 ASP A 79 19.352 -9.739 -3.525 1.00 0.00 O ATOM 0 H ASP A 79 18.183 -10.009 -0.771 1.00 0.00 H new ATOM 0 HA ASP A 79 19.343 -7.584 -0.818 1.00 0.00 H new ATOM 0 HB2 ASP A 79 17.235 -8.906 -2.502 1.00 0.00 H new ATOM 0 HB3 ASP A 79 17.585 -7.219 -2.820 1.00 0.00 H new ATOM 1232 N TRP A 80 17.991 -5.812 0.233 1.00 0.00 N ATOM 1233 CA TRP A 80 17.227 -4.718 0.822 1.00 0.00 C ATOM 1234 C TRP A 80 18.105 -3.488 1.025 1.00 0.00 C ATOM 1235 O TRP A 80 19.313 -3.603 1.227 1.00 0.00 O ATOM 1236 CB TRP A 80 16.621 -5.153 2.157 1.00 0.00 C ATOM 1237 CG TRP A 80 15.314 -5.873 2.010 1.00 0.00 C ATOM 1238 CD1 TRP A 80 14.974 -7.076 2.560 1.00 0.00 C ATOM 1239 CD2 TRP A 80 14.174 -5.434 1.262 1.00 0.00 C ATOM 1240 NE1 TRP A 80 13.692 -7.412 2.199 1.00 0.00 N ATOM 1241 CE2 TRP A 80 13.179 -6.421 1.404 1.00 0.00 C ATOM 1242 CE3 TRP A 80 13.897 -4.304 0.489 1.00 0.00 C ATOM 1243 CZ2 TRP A 80 11.930 -6.310 0.799 1.00 0.00 C ATOM 1244 CZ3 TRP A 80 12.656 -4.195 -0.110 1.00 0.00 C ATOM 1245 CH2 TRP A 80 11.685 -5.193 0.048 1.00 0.00 C ATOM 0 H TRP A 80 19.003 -5.707 0.307 1.00 0.00 H new ATOM 0 HA TRP A 80 16.423 -4.458 0.134 1.00 0.00 H new ATOM 0 HB2 TRP A 80 17.328 -5.801 2.675 1.00 0.00 H new ATOM 0 HB3 TRP A 80 16.475 -4.274 2.785 1.00 0.00 H new ATOM 0 HD1 TRP A 80 15.618 -7.675 3.187 1.00 0.00 H new ATOM 0 HE1 TRP A 80 13.201 -8.262 2.478 1.00 0.00 H new ATOM 0 HE3 TRP A 80 14.639 -3.530 0.362 1.00 0.00 H new ATOM 0 HZ2 TRP A 80 11.181 -7.079 0.918 1.00 0.00 H new ATOM 0 HZ3 TRP A 80 12.431 -3.326 -0.710 1.00 0.00 H new ATOM 0 HH2 TRP A 80 10.725 -5.078 -0.432 1.00 0.00 H new ATOM 1291 N LEU A 85 14.972 -4.227 9.122 1.00 0.00 N ATOM 1292 CA LEU A 85 13.688 -4.754 8.670 1.00 0.00 C ATOM 1293 C LEU A 85 13.302 -5.999 9.461 1.00 0.00 C ATOM 1294 O LEU A 85 13.992 -6.389 10.402 1.00 0.00 O ATOM 1295 CB LEU A 85 13.745 -5.081 7.177 1.00 0.00 C ATOM 1296 CG LEU A 85 13.990 -3.898 6.240 1.00 0.00 C ATOM 1297 CD1 LEU A 85 14.422 -4.387 4.866 1.00 0.00 C ATOM 1298 CD2 LEU A 85 12.741 -3.036 6.133 1.00 0.00 C ATOM 0 HA LEU A 85 12.930 -3.989 8.839 1.00 0.00 H new ATOM 0 HB2 LEU A 85 14.534 -5.816 7.016 1.00 0.00 H new ATOM 0 HB3 LEU A 85 12.805 -5.555 6.893 1.00 0.00 H new ATOM 0 HG LEU A 85 14.793 -3.289 6.656 1.00 0.00 H new ATOM 0 HD11 LEU A 85 14.592 -3.532 4.212 1.00 0.00 H new ATOM 0 HD12 LEU A 85 15.343 -4.962 4.958 1.00 0.00 H new ATOM 0 HD13 LEU A 85 13.641 -5.018 4.442 1.00 0.00 H new ATOM 0 HD21 LEU A 85 12.933 -2.199 5.462 1.00 0.00 H new ATOM 0 HD22 LEU A 85 11.919 -3.634 5.740 1.00 0.00 H new ATOM 0 HD23 LEU A 85 12.475 -2.657 7.120 1.00 0.00 H new ATOM 1310 N GLY A 86 12.194 -6.622 9.071 1.00 0.00 N ATOM 1311 CA GLY A 86 11.736 -7.819 9.753 1.00 0.00 C ATOM 1312 C GLY A 86 11.125 -8.830 8.803 1.00 0.00 C ATOM 1313 O GLY A 86 11.557 -8.956 7.658 1.00 0.00 O ATOM 0 H GLY A 86 11.605 -6.319 8.295 1.00 0.00 H new ATOM 0 HA2 GLY A 86 12.574 -8.278 10.277 1.00 0.00 H new ATOM 0 HA3 GLY A 86 11.000 -7.544 10.508 1.00 0.00 H new ATOM 1317 N GLY A 87 10.117 -9.554 9.279 1.00 0.00 N ATOM 1318 CA GLY A 87 9.463 -10.551 8.452 1.00 0.00 C ATOM 1319 C GLY A 87 8.984 -9.984 7.130 1.00 0.00 C ATOM 1320 O GLY A 87 8.180 -9.052 7.101 1.00 0.00 O ATOM 0 H GLY A 87 9.741 -9.468 10.223 1.00 0.00 H new ATOM 0 HA2 GLY A 87 10.155 -11.372 8.262 1.00 0.00 H new ATOM 0 HA3 GLY A 87 8.614 -10.968 8.994 1.00 0.00 H new ATOM 1324 N VAL A 88 9.480 -10.545 6.032 1.00 0.00 N ATOM 1325 CA VAL A 88 9.098 -10.089 4.701 1.00 0.00 C ATOM 1326 C VAL A 88 7.915 -10.888 4.165 1.00 0.00 C ATOM 1327 O VAL A 88 7.647 -12.001 4.619 1.00 0.00 O ATOM 1328 CB VAL A 88 10.271 -10.204 3.710 1.00 0.00 C ATOM 1329 CG1 VAL A 88 9.824 -9.828 2.306 1.00 0.00 C ATOM 1330 CG2 VAL A 88 11.434 -9.331 4.159 1.00 0.00 C ATOM 0 H VAL A 88 10.147 -11.316 6.038 1.00 0.00 H new ATOM 0 HA VAL A 88 8.813 -9.041 4.795 1.00 0.00 H new ATOM 0 HB VAL A 88 10.608 -11.240 3.692 1.00 0.00 H new ATOM 0 HG11 VAL A 88 10.667 -9.915 1.620 1.00 0.00 H new ATOM 0 HG12 VAL A 88 9.025 -10.498 1.987 1.00 0.00 H new ATOM 0 HG13 VAL A 88 9.459 -8.801 2.303 1.00 0.00 H new ATOM 0 HG21 VAL A 88 12.255 -9.424 3.448 1.00 0.00 H new ATOM 0 HG22 VAL A 88 11.111 -8.291 4.207 1.00 0.00 H new ATOM 0 HG23 VAL A 88 11.770 -9.652 5.145 1.00 0.00 H new ATOM 1340 N PHE A 89 7.210 -10.313 3.196 1.00 0.00 N ATOM 1341 CA PHE A 89 6.055 -10.972 2.598 1.00 0.00 C ATOM 1342 C PHE A 89 5.945 -10.635 1.114 1.00 0.00 C ATOM 1343 O PHE A 89 6.499 -9.638 0.648 1.00 0.00 O ATOM 1344 CB PHE A 89 4.773 -10.556 3.322 1.00 0.00 C ATOM 1345 CG PHE A 89 4.548 -9.071 3.340 1.00 0.00 C ATOM 1346 CD1 PHE A 89 5.272 -8.258 4.197 1.00 0.00 C ATOM 1347 CD2 PHE A 89 3.613 -8.489 2.499 1.00 0.00 C ATOM 1348 CE1 PHE A 89 5.067 -6.891 4.215 1.00 0.00 C ATOM 1349 CE2 PHE A 89 3.404 -7.122 2.513 1.00 0.00 C ATOM 1350 CZ PHE A 89 4.133 -6.323 3.372 1.00 0.00 C ATOM 0 H PHE A 89 7.418 -9.393 2.809 1.00 0.00 H new ATOM 0 HA PHE A 89 6.189 -12.049 2.700 1.00 0.00 H new ATOM 0 HB2 PHE A 89 3.922 -11.038 2.842 1.00 0.00 H new ATOM 0 HB3 PHE A 89 4.810 -10.922 4.348 1.00 0.00 H new ATOM 0 HD1 PHE A 89 6.004 -8.697 4.858 1.00 0.00 H new ATOM 0 HD2 PHE A 89 3.041 -9.110 1.825 1.00 0.00 H new ATOM 0 HE1 PHE A 89 5.637 -6.268 4.888 1.00 0.00 H new ATOM 0 HE2 PHE A 89 2.672 -6.680 1.853 1.00 0.00 H new ATOM 0 HZ PHE A 89 3.972 -5.255 3.384 1.00 0.00 H new ATOM 1360 N LYS A 90 5.227 -11.474 0.374 1.00 0.00 N ATOM 1361 CA LYS A 90 5.043 -11.267 -1.057 1.00 0.00 C ATOM 1362 C LYS A 90 3.935 -10.253 -1.323 1.00 0.00 C ATOM 1363 O LYS A 90 3.070 -10.028 -0.476 1.00 0.00 O ATOM 1364 CB LYS A 90 4.712 -12.592 -1.746 1.00 0.00 C ATOM 1365 CG LYS A 90 5.935 -13.342 -2.244 1.00 0.00 C ATOM 1366 CD LYS A 90 5.590 -14.764 -2.654 1.00 0.00 C ATOM 1367 CE LYS A 90 5.579 -15.702 -1.456 1.00 0.00 C ATOM 1368 NZ LYS A 90 5.775 -17.121 -1.861 1.00 0.00 N ATOM 0 H LYS A 90 4.763 -12.304 0.743 1.00 0.00 H new ATOM 0 HA LYS A 90 5.975 -10.875 -1.464 1.00 0.00 H new ATOM 0 HB2 LYS A 90 4.166 -13.227 -1.049 1.00 0.00 H new ATOM 0 HB3 LYS A 90 4.048 -12.398 -2.588 1.00 0.00 H new ATOM 0 HG2 LYS A 90 6.367 -12.812 -3.093 1.00 0.00 H new ATOM 0 HG3 LYS A 90 6.694 -13.362 -1.462 1.00 0.00 H new ATOM 0 HD2 LYS A 90 4.613 -14.778 -3.137 1.00 0.00 H new ATOM 0 HD3 LYS A 90 6.314 -15.118 -3.388 1.00 0.00 H new ATOM 0 HE2 LYS A 90 6.366 -15.411 -0.760 1.00 0.00 H new ATOM 0 HE3 LYS A 90 4.632 -15.603 -0.926 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 5.761 -17.728 -1.017 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 5.010 -17.407 -2.505 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 6.690 -17.221 -2.344 1.00 0.00 H new ATOM 1382 N VAL A 91 3.967 -9.643 -2.503 1.00 0.00 N ATOM 1383 CA VAL A 91 2.964 -8.655 -2.881 1.00 0.00 C ATOM 1384 C VAL A 91 2.646 -8.736 -4.370 1.00 0.00 C ATOM 1385 O VAL A 91 3.546 -8.849 -5.201 1.00 0.00 O ATOM 1386 CB VAL A 91 3.429 -7.226 -2.544 1.00 0.00 C ATOM 1387 CG1 VAL A 91 3.278 -6.952 -1.055 1.00 0.00 C ATOM 1388 CG2 VAL A 91 4.868 -7.015 -2.989 1.00 0.00 C ATOM 0 H VAL A 91 4.677 -9.816 -3.214 1.00 0.00 H new ATOM 0 HA VAL A 91 2.065 -8.882 -2.308 1.00 0.00 H new ATOM 0 HB VAL A 91 2.798 -6.521 -3.085 1.00 0.00 H new ATOM 0 HG11 VAL A 91 3.612 -5.938 -0.836 1.00 0.00 H new ATOM 0 HG12 VAL A 91 2.232 -7.059 -0.770 1.00 0.00 H new ATOM 0 HG13 VAL A 91 3.883 -7.662 -0.491 1.00 0.00 H new ATOM 0 HG21 VAL A 91 5.180 -6.000 -2.743 1.00 0.00 H new ATOM 0 HG22 VAL A 91 5.515 -7.727 -2.478 1.00 0.00 H new ATOM 0 HG23 VAL A 91 4.942 -7.166 -4.066 1.00 0.00 H new ATOM 1398 N GLU A 92 1.359 -8.677 -4.699 1.00 0.00 N ATOM 1399 CA GLU A 92 0.923 -8.744 -6.088 1.00 0.00 C ATOM 1400 C GLU A 92 0.806 -7.346 -6.690 1.00 0.00 C ATOM 1401 O GLU A 92 -0.036 -6.550 -6.277 1.00 0.00 O ATOM 1402 CB GLU A 92 -0.422 -9.468 -6.190 1.00 0.00 C ATOM 1403 CG GLU A 92 -0.653 -10.137 -7.534 1.00 0.00 C ATOM 1404 CD GLU A 92 -0.009 -9.381 -8.680 1.00 0.00 C ATOM 1405 OE1 GLU A 92 -0.582 -8.361 -9.114 1.00 0.00 O ATOM 1406 OE2 GLU A 92 1.069 -9.811 -9.142 1.00 0.00 O ATOM 0 H GLU A 92 0.601 -8.583 -4.023 1.00 0.00 H new ATOM 0 HA GLU A 92 1.672 -9.302 -6.650 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -0.480 -10.221 -5.404 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -1.224 -8.753 -6.007 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -0.255 -11.151 -7.504 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -1.725 -10.220 -7.715 1.00 0.00 H new ATOM 1413 N TRP A 93 1.658 -7.057 -7.667 1.00 0.00 N ATOM 1414 CA TRP A 93 1.652 -5.755 -8.325 1.00 0.00 C ATOM 1415 C TRP A 93 0.601 -5.709 -9.429 1.00 0.00 C ATOM 1416 O TRP A 93 0.640 -6.504 -10.369 1.00 0.00 O ATOM 1417 CB TRP A 93 3.033 -5.448 -8.906 1.00 0.00 C ATOM 1418 CG TRP A 93 4.001 -4.921 -7.890 1.00 0.00 C ATOM 1419 CD1 TRP A 93 4.865 -5.652 -7.125 1.00 0.00 C ATOM 1420 CD2 TRP A 93 4.201 -3.551 -7.527 1.00 0.00 C ATOM 1421 NE1 TRP A 93 5.590 -4.818 -6.308 1.00 0.00 N ATOM 1422 CE2 TRP A 93 5.202 -3.524 -6.536 1.00 0.00 C ATOM 1423 CE3 TRP A 93 3.633 -2.344 -7.943 1.00 0.00 C ATOM 1424 CZ2 TRP A 93 5.645 -2.337 -5.957 1.00 0.00 C ATOM 1425 CZ3 TRP A 93 4.073 -1.167 -7.368 1.00 0.00 C ATOM 1426 CH2 TRP A 93 5.072 -1.170 -6.384 1.00 0.00 C ATOM 0 H TRP A 93 2.361 -7.706 -8.021 1.00 0.00 H new ATOM 0 HA TRP A 93 1.403 -5.000 -7.580 1.00 0.00 H new ATOM 0 HB2 TRP A 93 3.442 -6.355 -9.351 1.00 0.00 H new ATOM 0 HB3 TRP A 93 2.927 -4.719 -9.709 1.00 0.00 H new ATOM 0 HD1 TRP A 93 4.964 -6.727 -7.157 1.00 0.00 H new ATOM 0 HE1 TRP A 93 6.302 -5.114 -5.640 1.00 0.00 H new ATOM 0 HE3 TRP A 93 2.864 -2.331 -8.701 1.00 0.00 H new ATOM 0 HZ2 TRP A 93 6.413 -2.338 -5.198 1.00 0.00 H new ATOM 0 HZ3 TRP A 93 3.640 -0.229 -7.682 1.00 0.00 H new ATOM 0 HH2 TRP A 93 5.395 -0.233 -5.955 1.00 0.00 H new ATOM 1437 N ILE A 94 -0.335 -4.774 -9.310 1.00 0.00 N ATOM 1438 CA ILE A 94 -1.395 -4.624 -10.299 1.00 0.00 C ATOM 1439 C ILE A 94 -1.054 -3.535 -11.310 1.00 0.00 C ATOM 1440 O ILE A 94 -1.040 -3.776 -12.517 1.00 0.00 O ATOM 1441 CB ILE A 94 -2.743 -4.288 -9.634 1.00 0.00 C ATOM 1442 CG1 ILE A 94 -3.176 -5.425 -8.707 1.00 0.00 C ATOM 1443 CG2 ILE A 94 -3.804 -4.026 -10.692 1.00 0.00 C ATOM 1444 CD1 ILE A 94 -2.489 -5.400 -7.359 1.00 0.00 C ATOM 0 H ILE A 94 -0.381 -4.109 -8.538 1.00 0.00 H new ATOM 0 HA ILE A 94 -1.482 -5.580 -10.815 1.00 0.00 H new ATOM 0 HB ILE A 94 -2.622 -3.384 -9.037 1.00 0.00 H new ATOM 0 HG12 ILE A 94 -4.254 -5.370 -8.557 1.00 0.00 H new ATOM 0 HG13 ILE A 94 -2.970 -6.378 -9.193 1.00 0.00 H new ATOM 0 HG21 ILE A 94 -4.751 -3.790 -10.207 1.00 0.00 H new ATOM 0 HG22 ILE A 94 -3.497 -3.187 -11.316 1.00 0.00 H new ATOM 0 HG23 ILE A 94 -3.926 -4.914 -11.313 1.00 0.00 H new ATOM 0 HD11 ILE A 94 -2.844 -6.234 -6.754 1.00 0.00 H new ATOM 0 HD12 ILE A 94 -1.411 -5.486 -7.498 1.00 0.00 H new ATOM 0 HD13 ILE A 94 -2.716 -4.462 -6.852 1.00 0.00 H new ATOM 1456 N ARG A 95 -0.777 -2.336 -10.809 1.00 0.00 N ATOM 1457 CA ARG A 95 -0.434 -1.209 -11.668 1.00 0.00 C ATOM 1458 C ARG A 95 0.923 -0.626 -11.285 1.00 0.00 C ATOM 1459 O ARG A 95 1.225 -0.449 -10.104 1.00 0.00 O ATOM 1460 CB ARG A 95 -1.510 -0.125 -11.577 1.00 0.00 C ATOM 1461 CG ARG A 95 -2.922 -0.651 -11.777 1.00 0.00 C ATOM 1462 CD ARG A 95 -3.080 -1.324 -13.132 1.00 0.00 C ATOM 1463 NE ARG A 95 -2.856 -0.392 -14.234 1.00 0.00 N ATOM 1464 CZ ARG A 95 -3.799 0.403 -14.727 1.00 0.00 C ATOM 1465 NH1 ARG A 95 -5.023 0.380 -14.218 1.00 0.00 N ATOM 1466 NH2 ARG A 95 -3.519 1.223 -15.731 1.00 0.00 N ATOM 0 H ARG A 95 -0.783 -2.120 -9.812 1.00 0.00 H new ATOM 0 HA ARG A 95 -0.378 -1.571 -12.694 1.00 0.00 H new ATOM 0 HB2 ARG A 95 -1.446 0.358 -10.602 1.00 0.00 H new ATOM 0 HB3 ARG A 95 -1.307 0.641 -12.326 1.00 0.00 H new ATOM 0 HG2 ARG A 95 -3.162 -1.362 -10.986 1.00 0.00 H new ATOM 0 HG3 ARG A 95 -3.633 0.171 -11.693 1.00 0.00 H new ATOM 0 HD2 ARG A 95 -2.377 -2.153 -13.209 1.00 0.00 H new ATOM 0 HD3 ARG A 95 -4.081 -1.747 -13.212 1.00 0.00 H new ATOM 0 HE ARG A 95 -1.925 -0.349 -14.648 1.00 0.00 H new ATOM 0 HH11 ARG A 95 -5.242 -0.249 -13.446 1.00 0.00 H new ATOM 0 HH12 ARG A 95 -5.745 0.992 -14.599 1.00 0.00 H new ATOM 0 HH21 ARG A 95 -2.579 1.244 -16.126 1.00 0.00 H new ATOM 0 HH22 ARG A 95 -4.244 1.833 -16.109 1.00 0.00 H new ATOM 1480 N LYS A 96 1.739 -0.329 -12.291 1.00 0.00 N ATOM 1481 CA LYS A 96 3.064 0.234 -12.061 1.00 0.00 C ATOM 1482 C LYS A 96 3.139 1.671 -12.568 1.00 0.00 C ATOM 1483 O LYS A 96 4.165 2.336 -12.424 1.00 0.00 O ATOM 1484 CB LYS A 96 4.130 -0.618 -12.754 1.00 0.00 C ATOM 1485 CG LYS A 96 4.107 -2.078 -12.336 1.00 0.00 C ATOM 1486 CD LYS A 96 5.347 -2.815 -12.815 1.00 0.00 C ATOM 1487 CE LYS A 96 5.648 -4.025 -11.944 1.00 0.00 C ATOM 1488 NZ LYS A 96 4.864 -5.219 -12.364 1.00 0.00 N ATOM 0 H LYS A 96 1.506 -0.469 -13.274 1.00 0.00 H new ATOM 0 HA LYS A 96 3.250 0.235 -10.987 1.00 0.00 H new ATOM 0 HB2 LYS A 96 3.989 -0.555 -13.833 1.00 0.00 H new ATOM 0 HB3 LYS A 96 5.114 -0.202 -12.537 1.00 0.00 H new ATOM 0 HG2 LYS A 96 4.039 -2.145 -11.250 1.00 0.00 H new ATOM 0 HG3 LYS A 96 3.217 -2.559 -12.741 1.00 0.00 H new ATOM 0 HD2 LYS A 96 5.205 -3.135 -13.847 1.00 0.00 H new ATOM 0 HD3 LYS A 96 6.201 -2.137 -12.806 1.00 0.00 H new ATOM 0 HE2 LYS A 96 6.713 -4.253 -11.995 1.00 0.00 H new ATOM 0 HE3 LYS A 96 5.422 -3.789 -10.904 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 5.097 -6.022 -11.746 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 3.848 -5.010 -12.292 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 5.099 -5.460 -13.348 1.00 0.00 H new ATOM 1502 N GLU A 97 2.046 2.144 -13.158 1.00 0.00 N ATOM 1503 CA GLU A 97 1.990 3.503 -13.685 1.00 0.00 C ATOM 1504 C GLU A 97 1.934 4.523 -12.551 1.00 0.00 C ATOM 1505 O GLU A 97 1.369 4.258 -11.490 1.00 0.00 O ATOM 1506 CB GLU A 97 0.773 3.670 -14.596 1.00 0.00 C ATOM 1507 CG GLU A 97 0.734 5.005 -15.322 1.00 0.00 C ATOM 1508 CD GLU A 97 1.493 4.978 -16.634 1.00 0.00 C ATOM 1509 OE1 GLU A 97 1.287 4.029 -17.420 1.00 0.00 O ATOM 1510 OE2 GLU A 97 2.294 5.906 -16.875 1.00 0.00 O ATOM 0 H GLU A 97 1.188 1.607 -13.283 1.00 0.00 H new ATOM 0 HA GLU A 97 2.896 3.679 -14.265 1.00 0.00 H new ATOM 0 HB2 GLU A 97 0.767 2.866 -15.332 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -0.134 3.563 -14.000 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -0.303 5.281 -15.512 1.00 0.00 H new ATOM 0 HG3 GLU A 97 1.156 5.777 -14.678 1.00 0.00 H new ATOM 1517 N SER A 98 2.525 5.691 -12.785 1.00 0.00 N ATOM 1518 CA SER A 98 2.547 6.750 -11.783 1.00 0.00 C ATOM 1519 C SER A 98 1.323 7.651 -11.918 1.00 0.00 C ATOM 1520 O SER A 98 1.000 8.120 -13.010 1.00 0.00 O ATOM 1521 CB SER A 98 3.824 7.581 -11.917 1.00 0.00 C ATOM 1522 OG SER A 98 4.886 6.804 -12.443 1.00 0.00 O ATOM 0 H SER A 98 2.994 5.927 -13.659 1.00 0.00 H new ATOM 0 HA SER A 98 2.527 6.285 -10.797 1.00 0.00 H new ATOM 0 HB2 SER A 98 3.638 8.436 -12.567 1.00 0.00 H new ATOM 0 HB3 SER A 98 4.108 7.977 -10.942 1.00 0.00 H new ATOM 0 HG SER A 98 5.690 7.359 -12.520 1.00 0.00 H new ATOM 1528 N LEU A 99 0.645 7.889 -10.800 1.00 0.00 N ATOM 1529 CA LEU A 99 -0.544 8.734 -10.792 1.00 0.00 C ATOM 1530 C LEU A 99 -0.295 10.016 -10.004 1.00 0.00 C ATOM 1531 O LEU A 99 0.137 9.992 -8.851 1.00 0.00 O ATOM 1532 CB LEU A 99 -1.728 7.975 -10.191 1.00 0.00 C ATOM 1533 CG LEU A 99 -2.986 8.801 -9.920 1.00 0.00 C ATOM 1534 CD1 LEU A 99 -3.778 9.004 -11.202 1.00 0.00 C ATOM 1535 CD2 LEU A 99 -3.847 8.129 -8.860 1.00 0.00 C ATOM 0 H LEU A 99 0.898 7.509 -9.888 1.00 0.00 H new ATOM 0 HA LEU A 99 -0.777 9.002 -11.823 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -1.991 7.160 -10.865 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -1.406 7.522 -9.253 1.00 0.00 H new ATOM 0 HG LEU A 99 -2.682 9.779 -9.547 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -4.670 9.594 -10.989 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -3.161 9.529 -11.932 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -4.072 8.035 -11.605 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -4.738 8.731 -8.680 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -4.142 7.138 -9.205 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -3.279 8.036 -7.935 1.00 0.00 H new ATOM 1547 N PRO A 100 -0.574 11.164 -10.639 1.00 0.00 N ATOM 1548 CA PRO A 100 -0.391 12.478 -10.016 1.00 0.00 C ATOM 1549 C PRO A 100 -1.398 12.736 -8.900 1.00 0.00 C ATOM 1550 O PRO A 100 -2.576 12.403 -9.024 1.00 0.00 O ATOM 1551 CB PRO A 100 -0.615 13.455 -11.173 1.00 0.00 C ATOM 1552 CG PRO A 100 -1.485 12.715 -12.130 1.00 0.00 C ATOM 1553 CD PRO A 100 -1.092 11.268 -12.014 1.00 0.00 C ATOM 0 HA PRO A 100 0.587 12.572 -9.544 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -1.094 14.372 -10.830 1.00 0.00 H new ATOM 0 HB3 PRO A 100 0.329 13.743 -11.637 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -2.538 12.854 -11.887 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -1.342 13.078 -13.148 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -1.943 10.606 -12.174 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -0.335 10.997 -12.750 1.00 0.00 H new ATOM 1561 N PHE A 101 -0.926 13.332 -7.809 1.00 0.00 N ATOM 1562 CA PHE A 101 -1.785 13.634 -6.671 1.00 0.00 C ATOM 1563 C PHE A 101 -3.015 14.422 -7.111 1.00 0.00 C ATOM 1564 O PHE A 101 -4.084 14.308 -6.513 1.00 0.00 O ATOM 1565 CB PHE A 101 -1.010 14.425 -5.615 1.00 0.00 C ATOM 1566 CG PHE A 101 -0.078 13.579 -4.796 1.00 0.00 C ATOM 1567 CD1 PHE A 101 -0.506 12.375 -4.259 1.00 0.00 C ATOM 1568 CD2 PHE A 101 1.225 13.987 -4.563 1.00 0.00 C ATOM 1569 CE1 PHE A 101 0.349 11.595 -3.504 1.00 0.00 C ATOM 1570 CE2 PHE A 101 2.085 13.210 -3.808 1.00 0.00 C ATOM 1571 CZ PHE A 101 1.646 12.012 -3.279 1.00 0.00 C ATOM 0 H PHE A 101 0.047 13.615 -7.690 1.00 0.00 H new ATOM 0 HA PHE A 101 -2.116 12.690 -6.238 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -0.436 15.209 -6.109 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -1.719 14.919 -4.950 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -1.519 12.043 -4.433 1.00 0.00 H new ATOM 0 HD2 PHE A 101 1.573 14.922 -4.975 1.00 0.00 H new ATOM 0 HE1 PHE A 101 0.003 10.659 -3.090 1.00 0.00 H new ATOM 0 HE2 PHE A 101 3.098 13.540 -3.632 1.00 0.00 H new ATOM 0 HZ PHE A 101 2.316 11.403 -2.691 1.00 0.00 H new ATOM 1581 N GLN A 102 -2.854 15.220 -8.162 1.00 0.00 N ATOM 1582 CA GLN A 102 -3.951 16.028 -8.682 1.00 0.00 C ATOM 1583 C GLN A 102 -5.207 15.183 -8.872 1.00 0.00 C ATOM 1584 O GLN A 102 -6.325 15.695 -8.820 1.00 0.00 O ATOM 1585 CB GLN A 102 -3.552 16.674 -10.010 1.00 0.00 C ATOM 1586 CG GLN A 102 -2.125 17.199 -10.026 1.00 0.00 C ATOM 1587 CD GLN A 102 -1.940 18.358 -10.985 1.00 0.00 C ATOM 1588 OE1 GLN A 102 -2.189 18.232 -12.184 1.00 0.00 O ATOM 1589 NE2 GLN A 102 -1.502 19.497 -10.461 1.00 0.00 N ATOM 0 H GLN A 102 -1.975 15.324 -8.670 1.00 0.00 H new ATOM 0 HA GLN A 102 -4.168 16.811 -7.955 1.00 0.00 H new ATOM 0 HB2 GLN A 102 -3.671 15.943 -10.810 1.00 0.00 H new ATOM 0 HB3 GLN A 102 -4.235 17.496 -10.225 1.00 0.00 H new ATOM 0 HG2 GLN A 102 -1.847 17.516 -9.021 1.00 0.00 H new ATOM 0 HG3 GLN A 102 -1.448 16.391 -10.304 1.00 0.00 H new ATOM 0 HE21 GLN A 102 -1.308 19.557 -9.461 1.00 0.00 H new ATOM 0 HE22 GLN A 102 -1.360 20.312 -11.058 1.00 0.00 H new ATOM 1598 N PHE A 103 -5.015 13.887 -9.092 1.00 0.00 N ATOM 1599 CA PHE A 103 -6.132 12.971 -9.290 1.00 0.00 C ATOM 1600 C PHE A 103 -6.741 12.558 -7.954 1.00 0.00 C ATOM 1601 O PHE A 103 -7.951 12.364 -7.844 1.00 0.00 O ATOM 1602 CB PHE A 103 -5.672 11.731 -10.060 1.00 0.00 C ATOM 1603 CG PHE A 103 -5.611 11.936 -11.546 1.00 0.00 C ATOM 1604 CD1 PHE A 103 -4.861 12.968 -12.087 1.00 0.00 C ATOM 1605 CD2 PHE A 103 -6.305 11.097 -12.404 1.00 0.00 C ATOM 1606 CE1 PHE A 103 -4.802 13.159 -13.454 1.00 0.00 C ATOM 1607 CE2 PHE A 103 -6.250 11.283 -13.772 1.00 0.00 C ATOM 1608 CZ PHE A 103 -5.499 12.316 -14.298 1.00 0.00 C ATOM 0 H PHE A 103 -4.096 13.447 -9.138 1.00 0.00 H new ATOM 0 HA PHE A 103 -6.895 13.489 -9.871 1.00 0.00 H new ATOM 0 HB2 PHE A 103 -4.686 11.436 -9.701 1.00 0.00 H new ATOM 0 HB3 PHE A 103 -6.350 10.906 -9.843 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -4.316 13.631 -11.432 1.00 0.00 H new ATOM 0 HD2 PHE A 103 -6.895 10.289 -11.998 1.00 0.00 H new ATOM 0 HE1 PHE A 103 -4.212 13.966 -13.862 1.00 0.00 H new ATOM 0 HE2 PHE A 103 -6.794 10.621 -14.430 1.00 0.00 H new ATOM 0 HZ PHE A 103 -5.457 12.464 -15.367 1.00 0.00 H new ATOM 1618 N ALA A 104 -5.892 12.424 -6.940 1.00 0.00 N ATOM 1619 CA ALA A 104 -6.345 12.035 -5.610 1.00 0.00 C ATOM 1620 C ALA A 104 -6.454 13.247 -4.691 1.00 0.00 C ATOM 1621 O ALA A 104 -6.547 13.108 -3.471 1.00 0.00 O ATOM 1622 CB ALA A 104 -5.403 11.001 -5.013 1.00 0.00 C ATOM 0 H ALA A 104 -4.887 12.579 -7.014 1.00 0.00 H new ATOM 0 HA ALA A 104 -7.337 11.594 -5.706 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -5.754 10.720 -4.020 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -5.379 10.119 -5.653 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -4.401 11.422 -4.938 1.00 0.00 H new ATOM 1628 N HIS A 105 -6.442 14.437 -5.284 1.00 0.00 N ATOM 1629 CA HIS A 105 -6.539 15.674 -4.518 1.00 0.00 C ATOM 1630 C HIS A 105 -7.940 15.845 -3.938 1.00 0.00 C ATOM 1631 O HIS A 105 -8.149 16.631 -3.013 1.00 0.00 O ATOM 1632 CB HIS A 105 -6.190 16.874 -5.399 1.00 0.00 C ATOM 1633 CG HIS A 105 -5.960 18.137 -4.628 1.00 0.00 C ATOM 1634 ND1 HIS A 105 -6.232 18.256 -3.281 1.00 0.00 N ATOM 1635 CD2 HIS A 105 -5.480 19.340 -5.021 1.00 0.00 C ATOM 1636 CE1 HIS A 105 -5.930 19.478 -2.880 1.00 0.00 C ATOM 1637 NE2 HIS A 105 -5.471 20.156 -3.917 1.00 0.00 N ATOM 0 H HIS A 105 -6.366 14.570 -6.292 1.00 0.00 H new ATOM 0 HA HIS A 105 -5.827 15.619 -3.694 1.00 0.00 H new ATOM 0 HB2 HIS A 105 -5.295 16.642 -5.976 1.00 0.00 H new ATOM 0 HB3 HIS A 105 -6.997 17.036 -6.114 1.00 0.00 H new ATOM 0 HD1 HIS A 105 -6.608 17.516 -2.687 1.00 0.00 H new ATOM 0 HD2 HIS A 105 -5.163 19.608 -6.018 1.00 0.00 H new ATOM 0 HE1 HIS A 105 -6.040 19.858 -1.875 1.00 0.00 H new ATOM 1645 N HIS A 106 -8.898 15.105 -4.488 1.00 0.00 N ATOM 1646 CA HIS A 106 -10.279 15.175 -4.025 1.00 0.00 C ATOM 1647 C HIS A 106 -10.548 14.120 -2.956 1.00 0.00 C ATOM 1648 O HIS A 106 -11.465 14.262 -2.146 1.00 0.00 O ATOM 1649 CB HIS A 106 -11.242 14.986 -5.198 1.00 0.00 C ATOM 1650 CG HIS A 106 -11.249 13.593 -5.749 1.00 0.00 C ATOM 1651 ND1 HIS A 106 -10.175 13.042 -6.414 1.00 0.00 N ATOM 1652 CD2 HIS A 106 -12.208 12.638 -5.728 1.00 0.00 C ATOM 1653 CE1 HIS A 106 -10.473 11.808 -6.781 1.00 0.00 C ATOM 1654 NE2 HIS A 106 -11.701 11.539 -6.376 1.00 0.00 N ATOM 0 H HIS A 106 -8.743 14.450 -5.255 1.00 0.00 H new ATOM 0 HA HIS A 106 -10.440 16.160 -3.587 1.00 0.00 H new ATOM 0 HB2 HIS A 106 -12.250 15.245 -4.875 1.00 0.00 H new ATOM 0 HB3 HIS A 106 -10.974 15.681 -5.993 1.00 0.00 H new ATOM 0 HD2 HIS A 106 -13.189 12.724 -5.284 1.00 0.00 H new ATOM 0 HE1 HIS A 106 -9.823 11.134 -7.320 1.00 0.00 H new ATOM 0 HE2 HIS A 106 -12.193 10.657 -6.521 1.00 0.00 H new ATOM 1662 N LEU A 107 -9.744 13.063 -2.959 1.00 0.00 N ATOM 1663 CA LEU A 107 -9.895 11.983 -1.990 1.00 0.00 C ATOM 1664 C LEU A 107 -9.239 12.348 -0.662 1.00 0.00 C ATOM 1665 O LEU A 107 -8.216 13.033 -0.631 1.00 0.00 O ATOM 1666 CB LEU A 107 -9.284 10.692 -2.536 1.00 0.00 C ATOM 1667 CG LEU A 107 -9.753 10.264 -3.928 1.00 0.00 C ATOM 1668 CD1 LEU A 107 -8.994 9.030 -4.390 1.00 0.00 C ATOM 1669 CD2 LEU A 107 -11.252 10.003 -3.929 1.00 0.00 C ATOM 0 H LEU A 107 -8.980 12.930 -3.622 1.00 0.00 H new ATOM 0 HA LEU A 107 -10.960 11.829 -1.818 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -8.200 10.808 -2.559 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -9.504 9.885 -1.836 1.00 0.00 H new ATOM 0 HG LEU A 107 -9.546 11.075 -4.626 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -9.341 8.740 -5.382 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -7.928 9.252 -4.429 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -9.169 8.212 -3.691 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -11.568 9.700 -4.927 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -11.484 9.210 -3.218 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -11.780 10.912 -3.642 1.00 0.00 H new ATOM 1681 N LEU A 108 -9.832 11.884 0.432 1.00 0.00 N ATOM 1682 CA LEU A 108 -9.304 12.158 1.764 1.00 0.00 C ATOM 1683 C LEU A 108 -9.459 10.943 2.673 1.00 0.00 C ATOM 1684 O LEU A 108 -10.015 9.922 2.271 1.00 0.00 O ATOM 1685 CB LEU A 108 -10.017 13.364 2.378 1.00 0.00 C ATOM 1686 CG LEU A 108 -10.186 14.580 1.468 1.00 0.00 C ATOM 1687 CD1 LEU A 108 -11.292 15.486 1.986 1.00 0.00 C ATOM 1688 CD2 LEU A 108 -8.876 15.347 1.354 1.00 0.00 C ATOM 0 H LEU A 108 -10.679 11.316 0.423 1.00 0.00 H new ATOM 0 HA LEU A 108 -8.242 12.382 1.668 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -11.005 13.045 2.712 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -9.465 13.674 3.265 1.00 0.00 H new ATOM 0 HG LEU A 108 -10.467 14.230 0.475 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -11.397 16.346 1.325 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -12.231 14.934 2.015 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -11.041 15.829 2.990 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -9.015 16.210 0.702 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -8.565 15.685 2.342 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -8.108 14.696 0.936 1.00 0.00 H new ATOM 1700 N ASN A 109 -8.964 11.062 3.900 1.00 0.00 N ATOM 1701 CA ASN A 109 -9.049 9.974 4.867 1.00 0.00 C ATOM 1702 C ASN A 109 -9.703 10.446 6.162 1.00 0.00 C ATOM 1703 O ASN A 109 -9.099 11.150 6.971 1.00 0.00 O ATOM 1704 CB ASN A 109 -7.656 9.415 5.161 1.00 0.00 C ATOM 1705 CG ASN A 109 -7.699 8.201 6.070 1.00 0.00 C ATOM 1706 OD1 ASN A 109 -7.062 8.178 7.123 1.00 0.00 O ATOM 1707 ND2 ASN A 109 -8.454 7.186 5.666 1.00 0.00 N ATOM 0 H ASN A 109 -8.500 11.901 4.248 1.00 0.00 H new ATOM 0 HA ASN A 109 -9.666 9.186 4.435 1.00 0.00 H new ATOM 0 HB2 ASN A 109 -7.170 9.146 4.223 1.00 0.00 H new ATOM 0 HB3 ASN A 109 -7.047 10.191 5.624 1.00 0.00 H new ATOM 0 HD21 ASN A 109 -8.523 6.343 6.236 1.00 0.00 H new ATOM 0 HD22 ASN A 109 -8.965 7.249 4.785 1.00 0.00 H new ATOM 1714 N PRO A 110 -10.969 10.050 6.365 1.00 0.00 N ATOM 1715 CA PRO A 110 -11.732 10.420 7.560 1.00 0.00 C ATOM 1716 C PRO A 110 -11.212 9.731 8.817 1.00 0.00 C ATOM 1717 O PRO A 110 -11.737 9.936 9.911 1.00 0.00 O ATOM 1718 CB PRO A 110 -13.150 9.942 7.237 1.00 0.00 C ATOM 1719 CG PRO A 110 -12.964 8.841 6.252 1.00 0.00 C ATOM 1720 CD PRO A 110 -11.751 9.209 5.443 1.00 0.00 C ATOM 0 HA PRO A 110 -11.664 11.487 7.772 1.00 0.00 H new ATOM 0 HB2 PRO A 110 -13.662 9.590 8.132 1.00 0.00 H new ATOM 0 HB3 PRO A 110 -13.754 10.748 6.820 1.00 0.00 H new ATOM 0 HG2 PRO A 110 -12.821 7.886 6.757 1.00 0.00 H new ATOM 0 HG3 PRO A 110 -13.841 8.736 5.614 1.00 0.00 H new ATOM 0 HD2 PRO A 110 -11.192 8.326 5.132 1.00 0.00 H new ATOM 0 HD3 PRO A 110 -12.022 9.750 4.537 1.00 0.00 H new ATOM 1728 N TRP A 111 -10.177 8.915 8.653 1.00 0.00 N ATOM 1729 CA TRP A 111 -9.586 8.196 9.775 1.00 0.00 C ATOM 1730 C TRP A 111 -8.262 8.828 10.190 1.00 0.00 C ATOM 1731 O TRP A 111 -7.639 8.405 11.163 1.00 0.00 O ATOM 1732 CB TRP A 111 -9.371 6.726 9.410 1.00 0.00 C ATOM 1733 CG TRP A 111 -10.639 6.011 9.056 1.00 0.00 C ATOM 1734 CD1 TRP A 111 -11.890 6.552 8.973 1.00 0.00 C ATOM 1735 CD2 TRP A 111 -10.780 4.622 8.738 1.00 0.00 C ATOM 1736 NE1 TRP A 111 -12.800 5.584 8.623 1.00 0.00 N ATOM 1737 CE2 TRP A 111 -12.144 4.391 8.472 1.00 0.00 C ATOM 1738 CE3 TRP A 111 -9.886 3.551 8.650 1.00 0.00 C ATOM 1739 CZ2 TRP A 111 -12.632 3.134 8.127 1.00 0.00 C ATOM 1740 CZ3 TRP A 111 -10.372 2.304 8.307 1.00 0.00 C ATOM 1741 CH2 TRP A 111 -11.735 2.103 8.048 1.00 0.00 C ATOM 0 H TRP A 111 -9.730 8.735 7.754 1.00 0.00 H new ATOM 0 HA TRP A 111 -10.276 8.257 10.617 1.00 0.00 H new ATOM 0 HB2 TRP A 111 -8.681 6.665 8.569 1.00 0.00 H new ATOM 0 HB3 TRP A 111 -8.897 6.216 10.249 1.00 0.00 H new ATOM 0 HD1 TRP A 111 -12.129 7.589 9.156 1.00 0.00 H new ATOM 0 HE1 TRP A 111 -13.802 5.730 8.496 1.00 0.00 H new ATOM 0 HE3 TRP A 111 -8.834 3.696 8.847 1.00 0.00 H new ATOM 0 HZ2 TRP A 111 -13.682 2.977 7.929 1.00 0.00 H new ATOM 0 HZ3 TRP A 111 -9.690 1.470 8.237 1.00 0.00 H new ATOM 0 HH2 TRP A 111 -12.084 1.116 7.781 1.00 0.00 H new ATOM 1752 N ASN A 112 -7.837 9.843 9.445 1.00 0.00 N ATOM 1753 CA ASN A 112 -6.585 10.533 9.735 1.00 0.00 C ATOM 1754 C ASN A 112 -6.775 12.046 9.686 1.00 0.00 C ATOM 1755 O ASN A 112 -6.132 12.737 8.895 1.00 0.00 O ATOM 1756 CB ASN A 112 -5.502 10.111 8.740 1.00 0.00 C ATOM 1757 CG ASN A 112 -4.149 10.710 9.070 1.00 0.00 C ATOM 1758 OD1 ASN A 112 -3.518 11.328 8.079 1.00 0.00 O flip ATOM 1759 ND2 ASN A 112 -3.676 10.617 10.204 1.00 0.00 N flip ATOM 0 H ASN A 112 -8.341 10.206 8.636 1.00 0.00 H new ATOM 0 HA ASN A 112 -6.271 10.256 10.741 1.00 0.00 H new ATOM 0 HB2 ASN A 112 -5.423 9.024 8.733 1.00 0.00 H new ATOM 0 HB3 ASN A 112 -5.796 10.416 7.736 1.00 0.00 H new ATOM 0 HD21 ASN A 112 -4.196 10.133 10.936 1.00 0.00 H new ATOM 0 HD22 ASN A 112 -2.764 11.024 10.411 1.00 0.00 H new ATOM 1766 N ASP A 113 -7.659 12.554 10.537 1.00 0.00 N ATOM 1767 CA ASP A 113 -7.932 13.986 10.593 1.00 0.00 C ATOM 1768 C ASP A 113 -8.445 14.494 9.249 1.00 0.00 C ATOM 1769 O ASP A 113 -7.977 15.511 8.740 1.00 0.00 O ATOM 1770 CB ASP A 113 -6.671 14.752 10.995 1.00 0.00 C ATOM 1771 CG ASP A 113 -6.217 14.421 12.403 1.00 0.00 C ATOM 1772 OD1 ASP A 113 -6.997 14.656 13.349 1.00 0.00 O ATOM 1773 OD2 ASP A 113 -5.081 13.925 12.558 1.00 0.00 O ATOM 0 H ASP A 113 -8.199 11.996 11.198 1.00 0.00 H new ATOM 0 HA ASP A 113 -8.704 14.155 11.343 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -5.869 14.520 10.294 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -6.860 15.823 10.920 1.00 0.00 H new ATOM 1778 N ASN A 114 -9.408 13.777 8.679 1.00 0.00 N ATOM 1779 CA ASN A 114 -9.982 14.154 7.393 1.00 0.00 C ATOM 1780 C ASN A 114 -8.914 14.727 6.467 1.00 0.00 C ATOM 1781 O ASN A 114 -9.199 15.578 5.623 1.00 0.00 O ATOM 1782 CB ASN A 114 -11.103 15.177 7.592 1.00 0.00 C ATOM 1783 CG ASN A 114 -10.604 16.467 8.213 1.00 0.00 C ATOM 1784 OD1 ASN A 114 -10.499 16.580 9.435 1.00 0.00 O ATOM 1785 ND2 ASN A 114 -10.295 17.447 7.373 1.00 0.00 N ATOM 0 H ASN A 114 -9.807 12.932 9.088 1.00 0.00 H new ATOM 0 HA ASN A 114 -10.395 13.257 6.931 1.00 0.00 H new ATOM 0 HB2 ASN A 114 -11.567 15.396 6.630 1.00 0.00 H new ATOM 0 HB3 ASN A 114 -11.876 14.746 8.228 1.00 0.00 H new ATOM 0 HD21 ASN A 114 -9.955 18.339 7.733 1.00 0.00 H new ATOM 0 HD22 ASN A 114 -10.398 17.308 6.368 1.00 0.00 H new ATOM 1792 N LYS A 115 -7.682 14.256 6.630 1.00 0.00 N ATOM 1793 CA LYS A 115 -6.570 14.718 5.808 1.00 0.00 C ATOM 1794 C LYS A 115 -6.540 13.986 4.471 1.00 0.00 C ATOM 1795 O LYS A 115 -7.021 12.858 4.358 1.00 0.00 O ATOM 1796 CB LYS A 115 -5.245 14.512 6.545 1.00 0.00 C ATOM 1797 CG LYS A 115 -4.955 15.580 7.586 1.00 0.00 C ATOM 1798 CD LYS A 115 -4.594 16.906 6.939 1.00 0.00 C ATOM 1799 CE LYS A 115 -4.674 18.053 7.935 1.00 0.00 C ATOM 1800 NZ LYS A 115 -3.973 19.269 7.439 1.00 0.00 N ATOM 0 H LYS A 115 -7.429 13.554 7.325 1.00 0.00 H new ATOM 0 HA LYS A 115 -6.710 15.782 5.616 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -5.257 13.537 7.031 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -4.433 14.495 5.818 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -5.827 15.712 8.226 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -4.136 15.252 8.227 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -3.586 16.849 6.528 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -5.268 17.100 6.104 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -5.719 18.291 8.131 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -4.235 17.742 8.883 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -4.051 20.027 8.146 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -2.970 19.049 7.276 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -4.408 19.581 6.548 1.00 0.00 H new ATOM 1814 N LYS A 116 -5.970 14.633 3.460 1.00 0.00 N ATOM 1815 CA LYS A 116 -5.873 14.042 2.130 1.00 0.00 C ATOM 1816 C LYS A 116 -5.141 12.705 2.181 1.00 0.00 C ATOM 1817 O LYS A 116 -4.288 12.485 3.041 1.00 0.00 O ATOM 1818 CB LYS A 116 -5.150 14.996 1.177 1.00 0.00 C ATOM 1819 CG LYS A 116 -4.814 14.375 -0.167 1.00 0.00 C ATOM 1820 CD LYS A 116 -4.934 15.386 -1.295 1.00 0.00 C ATOM 1821 CE LYS A 116 -4.176 16.666 -0.978 1.00 0.00 C ATOM 1822 NZ LYS A 116 -2.715 16.523 -1.229 1.00 0.00 N ATOM 0 H LYS A 116 -5.568 15.567 3.536 1.00 0.00 H new ATOM 0 HA LYS A 116 -6.884 13.868 1.762 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -5.773 15.876 1.016 1.00 0.00 H new ATOM 0 HB3 LYS A 116 -4.230 15.339 1.649 1.00 0.00 H new ATOM 0 HG2 LYS A 116 -3.800 13.976 -0.141 1.00 0.00 H new ATOM 0 HG3 LYS A 116 -5.482 13.535 -0.358 1.00 0.00 H new ATOM 0 HD2 LYS A 116 -4.548 14.952 -2.217 1.00 0.00 H new ATOM 0 HD3 LYS A 116 -5.985 15.617 -1.468 1.00 0.00 H new ATOM 0 HE2 LYS A 116 -4.570 17.481 -1.585 1.00 0.00 H new ATOM 0 HE3 LYS A 116 -4.340 16.936 0.065 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 -2.189 16.772 -0.367 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 -2.503 15.540 -1.493 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 -2.432 17.158 -2.003 1.00 0.00 H new ATOM 1836 N VAL A 117 -5.478 11.816 1.252 1.00 0.00 N ATOM 1837 CA VAL A 117 -4.850 10.501 1.189 1.00 0.00 C ATOM 1838 C VAL A 117 -3.330 10.617 1.209 1.00 0.00 C ATOM 1839 O VAL A 117 -2.653 9.892 1.938 1.00 0.00 O ATOM 1840 CB VAL A 117 -5.279 9.735 -0.076 1.00 0.00 C ATOM 1841 CG1 VAL A 117 -5.011 8.246 0.085 1.00 0.00 C ATOM 1842 CG2 VAL A 117 -6.746 9.991 -0.382 1.00 0.00 C ATOM 0 H VAL A 117 -6.182 11.982 0.533 1.00 0.00 H new ATOM 0 HA VAL A 117 -5.181 9.949 2.069 1.00 0.00 H new ATOM 0 HB VAL A 117 -4.688 10.097 -0.917 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -5.320 7.721 -0.819 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -3.946 8.084 0.252 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -5.574 7.865 0.937 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -7.032 9.442 -1.279 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -7.356 9.658 0.457 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -6.903 11.057 -0.544 1.00 0.00 H new ATOM 1852 N GLN A 118 -2.800 11.533 0.405 1.00 0.00 N ATOM 1853 CA GLN A 118 -1.359 11.743 0.332 1.00 0.00 C ATOM 1854 C GLN A 118 -0.781 12.040 1.711 1.00 0.00 C ATOM 1855 O GLN A 118 0.406 11.826 1.956 1.00 0.00 O ATOM 1856 CB GLN A 118 -1.039 12.891 -0.627 1.00 0.00 C ATOM 1857 CG GLN A 118 -0.950 14.247 0.055 1.00 0.00 C ATOM 1858 CD GLN A 118 -0.402 15.325 -0.858 1.00 0.00 C ATOM 1859 OE1 GLN A 118 -0.271 16.537 -0.332 1.00 0.00 O flip ATOM 1860 NE2 GLN A 118 -0.100 15.072 -2.025 1.00 0.00 N flip ATOM 0 H GLN A 118 -3.347 12.141 -0.205 1.00 0.00 H new ATOM 0 HA GLN A 118 -0.902 10.827 -0.043 1.00 0.00 H new ATOM 0 HB2 GLN A 118 -0.093 12.682 -1.127 1.00 0.00 H new ATOM 0 HB3 GLN A 118 -1.806 12.932 -1.400 1.00 0.00 H new ATOM 0 HG2 GLN A 118 -1.941 14.540 0.403 1.00 0.00 H new ATOM 0 HG3 GLN A 118 -0.314 14.165 0.936 1.00 0.00 H new ATOM 0 HE21 GLN A 118 -0.217 14.126 -2.388 1.00 0.00 H new ATOM 0 HE22 GLN A 118 0.267 15.808 -2.628 1.00 0.00 H new ATOM 1869 N ILE A 119 -1.628 12.535 2.608 1.00 0.00 N ATOM 1870 CA ILE A 119 -1.200 12.860 3.963 1.00 0.00 C ATOM 1871 C ILE A 119 -1.337 11.655 4.887 1.00 0.00 C ATOM 1872 O ILE A 119 -2.180 11.641 5.784 1.00 0.00 O ATOM 1873 CB ILE A 119 -2.013 14.033 4.543 1.00 0.00 C ATOM 1874 CG1 ILE A 119 -1.998 15.219 3.577 1.00 0.00 C ATOM 1875 CG2 ILE A 119 -1.458 14.441 5.900 1.00 0.00 C ATOM 1876 CD1 ILE A 119 -3.032 16.275 3.900 1.00 0.00 C ATOM 0 H ILE A 119 -2.614 12.719 2.421 1.00 0.00 H new ATOM 0 HA ILE A 119 -0.151 13.150 3.902 1.00 0.00 H new ATOM 0 HB ILE A 119 -3.046 13.710 4.676 1.00 0.00 H new ATOM 0 HG12 ILE A 119 -1.008 15.675 3.590 1.00 0.00 H new ATOM 0 HG13 ILE A 119 -2.167 14.854 2.564 1.00 0.00 H new ATOM 0 HG21 ILE A 119 -2.042 15.271 6.298 1.00 0.00 H new ATOM 0 HG22 ILE A 119 -1.515 13.596 6.586 1.00 0.00 H new ATOM 0 HG23 ILE A 119 -0.418 14.749 5.790 1.00 0.00 H new ATOM 0 HD11 ILE A 119 -2.963 17.085 3.174 1.00 0.00 H new ATOM 0 HD12 ILE A 119 -4.028 15.834 3.858 1.00 0.00 H new ATOM 0 HD13 ILE A 119 -2.851 16.668 4.900 1.00 0.00 H new ATOM 1888 N SER A 120 -0.502 10.646 4.663 1.00 0.00 N ATOM 1889 CA SER A 120 -0.531 9.435 5.474 1.00 0.00 C ATOM 1890 C SER A 120 0.850 8.789 5.535 1.00 0.00 C ATOM 1891 O SER A 120 1.438 8.456 4.506 1.00 0.00 O ATOM 1892 CB SER A 120 -1.547 8.441 4.909 1.00 0.00 C ATOM 1893 OG SER A 120 -2.842 8.681 5.432 1.00 0.00 O ATOM 0 H SER A 120 0.203 10.643 3.926 1.00 0.00 H new ATOM 0 HA SER A 120 -0.829 9.712 6.485 1.00 0.00 H new ATOM 0 HB2 SER A 120 -1.570 8.519 3.822 1.00 0.00 H new ATOM 0 HB3 SER A 120 -1.237 7.424 5.149 1.00 0.00 H new ATOM 0 HG SER A 120 -2.933 9.630 5.658 1.00 0.00 H new ATOM 1899 N ARG A 121 1.361 8.614 6.749 1.00 0.00 N ATOM 1900 CA ARG A 121 2.673 8.009 6.946 1.00 0.00 C ATOM 1901 C ARG A 121 2.630 6.512 6.656 1.00 0.00 C ATOM 1902 O ARG A 121 1.561 5.942 6.438 1.00 0.00 O ATOM 1903 CB ARG A 121 3.159 8.248 8.376 1.00 0.00 C ATOM 1904 CG ARG A 121 3.830 9.598 8.574 1.00 0.00 C ATOM 1905 CD ARG A 121 2.819 10.733 8.543 1.00 0.00 C ATOM 1906 NE ARG A 121 2.620 11.252 7.192 1.00 0.00 N ATOM 1907 CZ ARG A 121 3.396 12.177 6.639 1.00 0.00 C ATOM 1908 NH1 ARG A 121 4.418 12.682 7.317 1.00 0.00 N ATOM 1909 NH2 ARG A 121 3.151 12.599 5.405 1.00 0.00 N ATOM 0 H ARG A 121 0.887 8.883 7.611 1.00 0.00 H new ATOM 0 HA ARG A 121 3.369 8.477 6.250 1.00 0.00 H new ATOM 0 HB2 ARG A 121 2.311 8.170 9.057 1.00 0.00 H new ATOM 0 HB3 ARG A 121 3.861 7.460 8.649 1.00 0.00 H new ATOM 0 HG2 ARG A 121 4.359 9.606 9.527 1.00 0.00 H new ATOM 0 HG3 ARG A 121 4.576 9.752 7.794 1.00 0.00 H new ATOM 0 HD2 ARG A 121 1.867 10.381 8.940 1.00 0.00 H new ATOM 0 HD3 ARG A 121 3.158 11.538 9.194 1.00 0.00 H new ATOM 0 HE ARG A 121 1.843 10.884 6.644 1.00 0.00 H new ATOM 0 HH11 ARG A 121 4.610 12.360 8.266 1.00 0.00 H new ATOM 0 HH12 ARG A 121 5.012 13.392 6.890 1.00 0.00 H new ATOM 0 HH21 ARG A 121 2.366 12.213 4.880 1.00 0.00 H new ATOM 0 HH22 ARG A 121 3.748 13.310 4.981 1.00 0.00 H new ATOM 1923 N ASP A 122 3.800 5.881 6.653 1.00 0.00 N ATOM 1924 CA ASP A 122 3.896 4.450 6.390 1.00 0.00 C ATOM 1925 C ASP A 122 3.261 3.646 7.520 1.00 0.00 C ATOM 1926 O ASP A 122 3.403 3.986 8.694 1.00 0.00 O ATOM 1927 CB ASP A 122 5.359 4.040 6.215 1.00 0.00 C ATOM 1928 CG ASP A 122 6.088 3.915 7.539 1.00 0.00 C ATOM 1929 OD1 ASP A 122 5.914 4.805 8.397 1.00 0.00 O ATOM 1930 OD2 ASP A 122 6.832 2.928 7.717 1.00 0.00 O ATOM 0 H ASP A 122 4.694 6.338 6.830 1.00 0.00 H new ATOM 0 HA ASP A 122 3.354 4.237 5.468 1.00 0.00 H new ATOM 0 HB2 ASP A 122 5.406 3.088 5.687 1.00 0.00 H new ATOM 0 HB3 ASP A 122 5.867 4.776 5.592 1.00 0.00 H new ATOM 1935 N GLY A 123 2.558 2.577 7.157 1.00 0.00 N ATOM 1936 CA GLY A 123 1.910 1.742 8.151 1.00 0.00 C ATOM 1937 C GLY A 123 0.637 2.364 8.690 1.00 0.00 C ATOM 1938 O GLY A 123 0.199 2.038 9.793 1.00 0.00 O ATOM 0 H GLY A 123 2.426 2.275 6.192 1.00 0.00 H new ATOM 0 HA2 GLY A 123 1.679 0.772 7.711 1.00 0.00 H new ATOM 0 HA3 GLY A 123 2.600 1.562 8.975 1.00 0.00 H new ATOM 1942 N GLN A 124 0.043 3.262 7.911 1.00 0.00 N ATOM 1943 CA GLN A 124 -1.186 3.932 8.318 1.00 0.00 C ATOM 1944 C GLN A 124 -2.403 3.277 7.672 1.00 0.00 C ATOM 1945 O GLN A 124 -2.424 3.042 6.464 1.00 0.00 O ATOM 1946 CB GLN A 124 -1.132 5.415 7.944 1.00 0.00 C ATOM 1947 CG GLN A 124 -1.963 6.303 8.856 1.00 0.00 C ATOM 1948 CD GLN A 124 -3.451 6.039 8.728 1.00 0.00 C ATOM 1949 OE1 GLN A 124 -4.119 5.701 9.706 1.00 0.00 O ATOM 1950 NE2 GLN A 124 -3.978 6.192 7.519 1.00 0.00 N ATOM 0 H GLN A 124 0.393 3.542 6.995 1.00 0.00 H new ATOM 0 HA GLN A 124 -1.278 3.840 9.400 1.00 0.00 H new ATOM 0 HB2 GLN A 124 -0.095 5.750 7.970 1.00 0.00 H new ATOM 0 HB3 GLN A 124 -1.480 5.535 6.918 1.00 0.00 H new ATOM 0 HG2 GLN A 124 -1.657 6.143 9.890 1.00 0.00 H new ATOM 0 HG3 GLN A 124 -1.762 7.348 8.622 1.00 0.00 H new ATOM 0 HE21 GLN A 124 -3.387 6.473 6.737 1.00 0.00 H new ATOM 0 HE22 GLN A 124 -4.974 6.028 7.372 1.00 0.00 H new ATOM 1959 N GLU A 125 -3.413 2.985 8.485 1.00 0.00 N ATOM 1960 CA GLU A 125 -4.633 2.356 7.992 1.00 0.00 C ATOM 1961 C GLU A 125 -5.432 3.325 7.125 1.00 0.00 C ATOM 1962 O GLU A 125 -5.763 4.431 7.553 1.00 0.00 O ATOM 1963 CB GLU A 125 -5.492 1.873 9.161 1.00 0.00 C ATOM 1964 CG GLU A 125 -6.372 0.682 8.818 1.00 0.00 C ATOM 1965 CD GLU A 125 -6.794 -0.104 10.044 1.00 0.00 C ATOM 1966 OE1 GLU A 125 -7.070 0.527 11.086 1.00 0.00 O ATOM 1967 OE2 GLU A 125 -6.849 -1.349 9.962 1.00 0.00 O ATOM 0 H GLU A 125 -3.411 3.174 9.487 1.00 0.00 H new ATOM 0 HA GLU A 125 -4.349 1.499 7.381 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -4.841 1.605 9.993 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -6.123 2.694 9.501 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -7.260 1.031 8.291 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -5.835 0.023 8.136 1.00 0.00 H new ATOM 1974 N LEU A 126 -5.738 2.902 5.903 1.00 0.00 N ATOM 1975 CA LEU A 126 -6.498 3.731 4.975 1.00 0.00 C ATOM 1976 C LEU A 126 -7.945 3.258 4.881 1.00 0.00 C ATOM 1977 O LEU A 126 -8.216 2.057 4.873 1.00 0.00 O ATOM 1978 CB LEU A 126 -5.851 3.704 3.589 1.00 0.00 C ATOM 1979 CG LEU A 126 -6.407 4.699 2.569 1.00 0.00 C ATOM 1980 CD1 LEU A 126 -6.037 6.122 2.954 1.00 0.00 C ATOM 1981 CD2 LEU A 126 -5.897 4.372 1.173 1.00 0.00 C ATOM 0 H LEU A 126 -5.471 1.990 5.532 1.00 0.00 H new ATOM 0 HA LEU A 126 -6.493 4.753 5.353 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -4.783 3.891 3.705 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -5.956 2.699 3.181 1.00 0.00 H new ATOM 0 HG LEU A 126 -7.494 4.617 2.566 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -6.441 6.815 2.216 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -6.452 6.353 3.935 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -4.952 6.220 2.987 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -6.303 5.090 0.460 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -4.808 4.425 1.162 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -6.214 3.367 0.896 1.00 0.00 H new ATOM 1993 N GLU A 127 -8.871 4.209 4.808 1.00 0.00 N ATOM 1994 CA GLU A 127 -10.290 3.889 4.713 1.00 0.00 C ATOM 1995 C GLU A 127 -10.599 3.169 3.404 1.00 0.00 C ATOM 1996 O GLU A 127 -10.081 3.511 2.341 1.00 0.00 O ATOM 1997 CB GLU A 127 -11.131 5.162 4.819 1.00 0.00 C ATOM 1998 CG GLU A 127 -12.592 4.901 5.147 1.00 0.00 C ATOM 1999 CD GLU A 127 -13.411 6.175 5.219 1.00 0.00 C ATOM 2000 OE1 GLU A 127 -13.223 7.051 4.349 1.00 0.00 O ATOM 2001 OE2 GLU A 127 -14.240 6.296 6.145 1.00 0.00 O ATOM 0 H GLU A 127 -8.663 5.208 4.813 1.00 0.00 H new ATOM 0 HA GLU A 127 -10.543 3.226 5.540 1.00 0.00 H new ATOM 0 HB2 GLU A 127 -10.704 5.806 5.588 1.00 0.00 H new ATOM 0 HB3 GLU A 127 -11.071 5.707 3.877 1.00 0.00 H new ATOM 0 HG2 GLU A 127 -13.018 4.242 4.390 1.00 0.00 H new ATOM 0 HG3 GLU A 127 -12.658 4.377 6.100 1.00 0.00 H new ATOM 2008 N PRO A 128 -11.464 2.146 3.481 1.00 0.00 N ATOM 2009 CA PRO A 128 -11.861 1.356 2.312 1.00 0.00 C ATOM 2010 C PRO A 128 -12.734 2.150 1.346 1.00 0.00 C ATOM 2011 O PRO A 128 -12.710 1.915 0.138 1.00 0.00 O ATOM 2012 CB PRO A 128 -12.655 0.197 2.920 1.00 0.00 C ATOM 2013 CG PRO A 128 -13.168 0.727 4.215 1.00 0.00 C ATOM 2014 CD PRO A 128 -12.120 1.683 4.715 1.00 0.00 C ATOM 0 HA PRO A 128 -11.000 1.039 1.723 1.00 0.00 H new ATOM 0 HB2 PRO A 128 -13.472 -0.109 2.266 1.00 0.00 H new ATOM 0 HB3 PRO A 128 -12.024 -0.678 3.073 1.00 0.00 H new ATOM 0 HG2 PRO A 128 -14.124 1.232 4.079 1.00 0.00 H new ATOM 0 HG3 PRO A 128 -13.333 -0.080 4.929 1.00 0.00 H new ATOM 0 HD2 PRO A 128 -12.563 2.510 5.270 1.00 0.00 H new ATOM 0 HD3 PRO A 128 -11.415 1.191 5.385 1.00 0.00 H new ATOM 2022 N GLN A 129 -13.503 3.090 1.886 1.00 0.00 N ATOM 2023 CA GLN A 129 -14.384 3.918 1.070 1.00 0.00 C ATOM 2024 C GLN A 129 -13.577 4.829 0.151 1.00 0.00 C ATOM 2025 O GLN A 129 -13.919 5.008 -1.018 1.00 0.00 O ATOM 2026 CB GLN A 129 -15.301 4.757 1.962 1.00 0.00 C ATOM 2027 CG GLN A 129 -16.607 5.152 1.292 1.00 0.00 C ATOM 2028 CD GLN A 129 -17.414 6.133 2.119 1.00 0.00 C ATOM 2029 OE1 GLN A 129 -18.257 5.738 2.924 1.00 0.00 O ATOM 2030 NE2 GLN A 129 -17.159 7.422 1.924 1.00 0.00 N ATOM 0 H GLN A 129 -13.534 3.297 2.884 1.00 0.00 H new ATOM 0 HA GLN A 129 -14.994 3.258 0.453 1.00 0.00 H new ATOM 0 HB2 GLN A 129 -15.523 4.196 2.870 1.00 0.00 H new ATOM 0 HB3 GLN A 129 -14.771 5.660 2.267 1.00 0.00 H new ATOM 0 HG2 GLN A 129 -16.393 5.593 0.319 1.00 0.00 H new ATOM 0 HG3 GLN A 129 -17.204 4.258 1.112 1.00 0.00 H new ATOM 0 HE21 GLN A 129 -16.451 7.705 1.246 1.00 0.00 H new ATOM 0 HE22 GLN A 129 -17.671 8.129 2.452 1.00 0.00 H new ATOM 2039 N VAL A 130 -12.505 5.403 0.687 1.00 0.00 N ATOM 2040 CA VAL A 130 -11.649 6.295 -0.086 1.00 0.00 C ATOM 2041 C VAL A 130 -10.507 5.528 -0.743 1.00 0.00 C ATOM 2042 O VAL A 130 -10.011 5.917 -1.800 1.00 0.00 O ATOM 2043 CB VAL A 130 -11.061 7.412 0.796 1.00 0.00 C ATOM 2044 CG1 VAL A 130 -12.169 8.144 1.539 1.00 0.00 C ATOM 2045 CG2 VAL A 130 -10.042 6.841 1.770 1.00 0.00 C ATOM 0 H VAL A 130 -12.209 5.266 1.653 1.00 0.00 H new ATOM 0 HA VAL A 130 -12.274 6.743 -0.858 1.00 0.00 H new ATOM 0 HB VAL A 130 -10.552 8.129 0.152 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -11.735 8.930 2.157 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -12.858 8.587 0.820 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -12.709 7.440 2.173 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -9.637 7.644 2.385 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -10.525 6.102 2.410 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -9.233 6.367 1.214 1.00 0.00 H new ATOM 2055 N GLY A 131 -10.094 4.434 -0.110 1.00 0.00 N ATOM 2056 CA GLY A 131 -9.013 3.629 -0.648 1.00 0.00 C ATOM 2057 C GLY A 131 -9.420 2.871 -1.895 1.00 0.00 C ATOM 2058 O GLY A 131 -8.577 2.527 -2.723 1.00 0.00 O ATOM 0 H GLY A 131 -10.489 4.091 0.766 1.00 0.00 H new ATOM 0 HA2 GLY A 131 -8.165 4.273 -0.879 1.00 0.00 H new ATOM 0 HA3 GLY A 131 -8.679 2.921 0.111 1.00 0.00 H new ATOM 2062 N GLU A 132 -10.716 2.609 -2.030 1.00 0.00 N ATOM 2063 CA GLU A 132 -11.232 1.884 -3.185 1.00 0.00 C ATOM 2064 C GLU A 132 -11.337 2.801 -4.401 1.00 0.00 C ATOM 2065 O GLU A 132 -10.933 2.434 -5.504 1.00 0.00 O ATOM 2066 CB GLU A 132 -12.603 1.282 -2.868 1.00 0.00 C ATOM 2067 CG GLU A 132 -13.741 2.286 -2.943 1.00 0.00 C ATOM 2068 CD GLU A 132 -15.090 1.664 -2.639 1.00 0.00 C ATOM 2069 OE1 GLU A 132 -15.127 0.672 -1.880 1.00 0.00 O ATOM 2070 OE2 GLU A 132 -16.107 2.167 -3.159 1.00 0.00 O ATOM 0 H GLU A 132 -11.427 2.888 -1.354 1.00 0.00 H new ATOM 0 HA GLU A 132 -10.534 1.079 -3.417 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -12.802 0.467 -3.564 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -12.578 0.848 -1.868 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -13.552 3.097 -2.239 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -13.765 2.728 -3.939 1.00 0.00 H new ATOM 2077 N GLN A 133 -11.882 3.994 -4.189 1.00 0.00 N ATOM 2078 CA GLN A 133 -12.041 4.963 -5.267 1.00 0.00 C ATOM 2079 C GLN A 133 -10.700 5.588 -5.639 1.00 0.00 C ATOM 2080 O GLN A 133 -10.590 6.294 -6.642 1.00 0.00 O ATOM 2081 CB GLN A 133 -13.030 6.056 -4.857 1.00 0.00 C ATOM 2082 CG GLN A 133 -12.646 6.774 -3.573 1.00 0.00 C ATOM 2083 CD GLN A 133 -13.672 7.808 -3.153 1.00 0.00 C ATOM 2084 OE1 GLN A 133 -13.344 8.585 -2.128 1.00 0.00 O flip ATOM 2085 NE2 GLN A 133 -14.748 7.907 -3.744 1.00 0.00 N flip ATOM 0 H GLN A 133 -12.221 4.313 -3.281 1.00 0.00 H new ATOM 0 HA GLN A 133 -12.431 4.438 -6.139 1.00 0.00 H new ATOM 0 HB2 GLN A 133 -13.106 6.786 -5.663 1.00 0.00 H new ATOM 0 HB3 GLN A 133 -14.018 5.613 -4.734 1.00 0.00 H new ATOM 0 HG2 GLN A 133 -12.525 6.042 -2.774 1.00 0.00 H new ATOM 0 HG3 GLN A 133 -11.680 7.260 -3.708 1.00 0.00 H new ATOM 0 HE21 GLN A 133 -14.958 7.288 -4.527 1.00 0.00 H new ATOM 0 HE22 GLN A 133 -15.429 8.608 -3.450 1.00 0.00 H new ATOM 2094 N LEU A 134 -9.684 5.323 -4.826 1.00 0.00 N ATOM 2095 CA LEU A 134 -8.349 5.860 -5.070 1.00 0.00 C ATOM 2096 C LEU A 134 -7.615 5.036 -6.124 1.00 0.00 C ATOM 2097 O LEU A 134 -6.845 5.572 -6.921 1.00 0.00 O ATOM 2098 CB LEU A 134 -7.542 5.883 -3.771 1.00 0.00 C ATOM 2099 CG LEU A 134 -6.025 5.992 -3.925 1.00 0.00 C ATOM 2100 CD1 LEU A 134 -5.618 7.433 -4.190 1.00 0.00 C ATOM 2101 CD2 LEU A 134 -5.323 5.457 -2.686 1.00 0.00 C ATOM 0 H LEU A 134 -9.758 4.740 -3.992 1.00 0.00 H new ATOM 0 HA LEU A 134 -8.456 6.879 -5.442 1.00 0.00 H new ATOM 0 HB2 LEU A 134 -7.887 6.722 -3.167 1.00 0.00 H new ATOM 0 HB3 LEU A 134 -7.766 4.975 -3.212 1.00 0.00 H new ATOM 0 HG LEU A 134 -5.721 5.387 -4.779 1.00 0.00 H new ATOM 0 HD11 LEU A 134 -4.535 7.491 -4.297 1.00 0.00 H new ATOM 0 HD12 LEU A 134 -6.092 7.782 -5.107 1.00 0.00 H new ATOM 0 HD13 LEU A 134 -5.935 8.060 -3.356 1.00 0.00 H new ATOM 0 HD21 LEU A 134 -4.244 5.543 -2.814 1.00 0.00 H new ATOM 0 HD22 LEU A 134 -5.632 6.034 -1.815 1.00 0.00 H new ATOM 0 HD23 LEU A 134 -5.589 4.410 -2.541 1.00 0.00 H new ATOM 2113 N LEU A 135 -7.861 3.730 -6.122 1.00 0.00 N ATOM 2114 CA LEU A 135 -7.225 2.831 -7.080 1.00 0.00 C ATOM 2115 C LEU A 135 -7.825 3.005 -8.471 1.00 0.00 C ATOM 2116 O LEU A 135 -7.100 3.117 -9.460 1.00 0.00 O ATOM 2117 CB LEU A 135 -7.377 1.379 -6.624 1.00 0.00 C ATOM 2118 CG LEU A 135 -6.828 1.050 -5.236 1.00 0.00 C ATOM 2119 CD1 LEU A 135 -7.049 -0.419 -4.909 1.00 0.00 C ATOM 2120 CD2 LEU A 135 -5.350 1.401 -5.150 1.00 0.00 C ATOM 0 H LEU A 135 -8.495 3.270 -5.469 1.00 0.00 H new ATOM 0 HA LEU A 135 -6.165 3.081 -7.128 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -8.436 1.122 -6.644 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -6.879 0.737 -7.351 1.00 0.00 H new ATOM 0 HG LEU A 135 -7.366 1.649 -4.502 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -6.652 -0.635 -3.917 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -8.116 -0.639 -4.928 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -6.537 -1.037 -5.647 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -4.976 1.160 -4.155 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -4.796 0.829 -5.894 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -5.217 2.466 -5.339 1.00 0.00 H new ATOM 2132 N GLN A 136 -9.152 3.030 -8.539 1.00 0.00 N ATOM 2133 CA GLN A 136 -9.849 3.192 -9.810 1.00 0.00 C ATOM 2134 C GLN A 136 -9.256 4.346 -10.612 1.00 0.00 C ATOM 2135 O GLN A 136 -9.395 4.401 -11.835 1.00 0.00 O ATOM 2136 CB GLN A 136 -11.340 3.435 -9.570 1.00 0.00 C ATOM 2137 CG GLN A 136 -11.624 4.590 -8.623 1.00 0.00 C ATOM 2138 CD GLN A 136 -13.107 4.806 -8.395 1.00 0.00 C ATOM 2139 OE1 GLN A 136 -13.821 3.895 -7.974 1.00 0.00 O ATOM 2140 NE2 GLN A 136 -13.579 6.016 -8.671 1.00 0.00 N ATOM 0 H GLN A 136 -9.766 2.940 -7.729 1.00 0.00 H new ATOM 0 HA GLN A 136 -9.726 2.274 -10.384 1.00 0.00 H new ATOM 0 HB2 GLN A 136 -11.826 3.632 -10.526 1.00 0.00 H new ATOM 0 HB3 GLN A 136 -11.787 2.527 -9.166 1.00 0.00 H new ATOM 0 HG2 GLN A 136 -11.137 4.399 -7.667 1.00 0.00 H new ATOM 0 HG3 GLN A 136 -11.186 5.502 -9.027 1.00 0.00 H new ATOM 0 HE21 GLN A 136 -12.951 6.741 -9.018 1.00 0.00 H new ATOM 0 HE22 GLN A 136 -14.569 6.220 -8.536 1.00 0.00 H new ATOM 2149 N LEU A 137 -8.595 5.265 -9.917 1.00 0.00 N ATOM 2150 CA LEU A 137 -7.981 6.418 -10.565 1.00 0.00 C ATOM 2151 C LEU A 137 -7.022 5.978 -11.667 1.00 0.00 C ATOM 2152 O LEU A 137 -6.998 6.561 -12.751 1.00 0.00 O ATOM 2153 CB LEU A 137 -7.235 7.269 -9.536 1.00 0.00 C ATOM 2154 CG LEU A 137 -8.097 8.206 -8.688 1.00 0.00 C ATOM 2155 CD1 LEU A 137 -7.263 8.856 -7.595 1.00 0.00 C ATOM 2156 CD2 LEU A 137 -8.752 9.265 -9.563 1.00 0.00 C ATOM 0 H LEU A 137 -8.471 5.234 -8.905 1.00 0.00 H new ATOM 0 HA LEU A 137 -8.774 7.014 -11.016 1.00 0.00 H new ATOM 0 HB2 LEU A 137 -6.693 6.601 -8.866 1.00 0.00 H new ATOM 0 HB3 LEU A 137 -6.491 7.868 -10.061 1.00 0.00 H new ATOM 0 HG LEU A 137 -8.883 7.617 -8.215 1.00 0.00 H new ATOM 0 HD11 LEU A 137 -7.893 9.519 -7.002 1.00 0.00 H new ATOM 0 HD12 LEU A 137 -6.842 8.084 -6.951 1.00 0.00 H new ATOM 0 HD13 LEU A 137 -6.455 9.432 -8.047 1.00 0.00 H new ATOM 0 HD21 LEU A 137 -9.361 9.923 -8.943 1.00 0.00 H new ATOM 0 HD22 LEU A 137 -7.981 9.850 -10.065 1.00 0.00 H new ATOM 0 HD23 LEU A 137 -9.383 8.781 -10.309 1.00 0.00 H new ATOM 2168 N TRP A 138 -6.238 4.945 -11.383 1.00 0.00 N ATOM 2169 CA TRP A 138 -5.279 4.424 -12.352 1.00 0.00 C ATOM 2170 C TRP A 138 -5.969 4.073 -13.665 1.00 0.00 C ATOM 2171 O TRP A 138 -5.350 4.102 -14.728 1.00 0.00 O ATOM 2172 CB TRP A 138 -4.571 3.192 -11.787 1.00 0.00 C ATOM 2173 CG TRP A 138 -3.314 3.520 -11.039 1.00 0.00 C ATOM 2174 CD1 TRP A 138 -2.037 3.475 -11.521 1.00 0.00 C ATOM 2175 CD2 TRP A 138 -3.215 3.941 -9.674 1.00 0.00 C ATOM 2176 NE1 TRP A 138 -1.150 3.842 -10.539 1.00 0.00 N ATOM 2177 CE2 TRP A 138 -1.847 4.135 -9.396 1.00 0.00 C ATOM 2178 CE3 TRP A 138 -4.147 4.176 -8.661 1.00 0.00 C ATOM 2179 CZ2 TRP A 138 -1.393 4.550 -8.148 1.00 0.00 C ATOM 2180 CZ3 TRP A 138 -3.695 4.588 -7.422 1.00 0.00 C ATOM 2181 CH2 TRP A 138 -2.328 4.773 -7.174 1.00 0.00 C ATOM 0 H TRP A 138 -6.247 4.451 -10.491 1.00 0.00 H new ATOM 0 HA TRP A 138 -4.540 5.200 -12.549 1.00 0.00 H new ATOM 0 HB2 TRP A 138 -5.253 2.663 -11.122 1.00 0.00 H new ATOM 0 HB3 TRP A 138 -4.332 2.512 -12.605 1.00 0.00 H new ATOM 0 HD1 TRP A 138 -1.765 3.192 -12.527 1.00 0.00 H new ATOM 0 HE1 TRP A 138 -0.136 3.889 -10.643 1.00 0.00 H new ATOM 0 HE3 TRP A 138 -5.203 4.038 -8.843 1.00 0.00 H new ATOM 0 HZ2 TRP A 138 -0.340 4.691 -7.955 1.00 0.00 H new ATOM 0 HZ3 TRP A 138 -4.407 4.771 -6.631 1.00 0.00 H new ATOM 0 HH2 TRP A 138 -2.006 5.098 -6.195 1.00 0.00 H new ATOM 2192 N GLU A 139 -7.254 3.740 -13.584 1.00 0.00 N ATOM 2193 CA GLU A 139 -8.026 3.382 -14.768 1.00 0.00 C ATOM 2194 C GLU A 139 -8.289 4.609 -15.637 1.00 0.00 C ATOM 2195 O GLU A 139 -8.502 4.493 -16.844 1.00 0.00 O ATOM 2196 CB GLU A 139 -9.353 2.737 -14.362 1.00 0.00 C ATOM 2197 CG GLU A 139 -9.198 1.605 -13.361 1.00 0.00 C ATOM 2198 CD GLU A 139 -10.391 0.669 -13.349 1.00 0.00 C ATOM 2199 OE1 GLU A 139 -11.532 1.161 -13.469 1.00 0.00 O ATOM 2200 OE2 GLU A 139 -10.183 -0.556 -13.219 1.00 0.00 O ATOM 0 H GLU A 139 -7.782 3.711 -12.711 1.00 0.00 H new ATOM 0 HA GLU A 139 -7.444 2.666 -15.348 1.00 0.00 H new ATOM 0 HB2 GLU A 139 -10.003 3.501 -13.936 1.00 0.00 H new ATOM 0 HB3 GLU A 139 -9.850 2.356 -15.254 1.00 0.00 H new ATOM 0 HG2 GLU A 139 -8.298 1.037 -13.597 1.00 0.00 H new ATOM 0 HG3 GLU A 139 -9.059 2.023 -12.364 1.00 0.00 H new ATOM 2207 N ARG A 140 -8.273 5.783 -15.014 1.00 0.00 N ATOM 2208 CA ARG A 140 -8.511 7.030 -15.729 1.00 0.00 C ATOM 2209 C ARG A 140 -7.316 7.391 -16.606 1.00 0.00 C ATOM 2210 O ARG A 140 -7.454 8.107 -17.600 1.00 0.00 O ATOM 2211 CB ARG A 140 -8.793 8.164 -14.741 1.00 0.00 C ATOM 2212 CG ARG A 140 -10.150 8.058 -14.064 1.00 0.00 C ATOM 2213 CD ARG A 140 -10.453 9.292 -13.229 1.00 0.00 C ATOM 2214 NE ARG A 140 -11.344 8.991 -12.111 1.00 0.00 N ATOM 2215 CZ ARG A 140 -12.106 9.900 -11.513 1.00 0.00 C ATOM 2216 NH1 ARG A 140 -12.085 11.161 -11.924 1.00 0.00 N ATOM 2217 NH2 ARG A 140 -12.891 9.549 -10.503 1.00 0.00 N ATOM 0 H ARG A 140 -8.098 5.896 -14.016 1.00 0.00 H new ATOM 0 HA ARG A 140 -9.381 6.891 -16.370 1.00 0.00 H new ATOM 0 HB2 ARG A 140 -8.015 8.171 -13.978 1.00 0.00 H new ATOM 0 HB3 ARG A 140 -8.732 9.117 -15.267 1.00 0.00 H new ATOM 0 HG2 ARG A 140 -10.925 7.929 -14.819 1.00 0.00 H new ATOM 0 HG3 ARG A 140 -10.173 7.173 -13.429 1.00 0.00 H new ATOM 0 HD2 ARG A 140 -9.521 9.709 -12.848 1.00 0.00 H new ATOM 0 HD3 ARG A 140 -10.909 10.054 -13.861 1.00 0.00 H new ATOM 0 HE ARG A 140 -11.383 8.030 -11.771 1.00 0.00 H new ATOM 0 HH11 ARG A 140 -11.483 11.434 -12.701 1.00 0.00 H new ATOM 0 HH12 ARG A 140 -12.671 11.857 -11.463 1.00 0.00 H new ATOM 0 HH21 ARG A 140 -12.910 8.580 -10.185 1.00 0.00 H new ATOM 0 HH22 ARG A 140 -13.476 10.248 -10.045 1.00 0.00 H new ATOM 2231 N LEU A 141 -6.143 6.893 -16.232 1.00 0.00 N ATOM 2232 CA LEU A 141 -4.922 7.163 -16.984 1.00 0.00 C ATOM 2233 C LEU A 141 -4.984 6.528 -18.370 1.00 0.00 C ATOM 2234 O LEU A 141 -4.071 6.689 -19.179 1.00 0.00 O ATOM 2235 CB LEU A 141 -3.704 6.636 -16.224 1.00 0.00 C ATOM 2236 CG LEU A 141 -3.641 6.981 -14.735 1.00 0.00 C ATOM 2237 CD1 LEU A 141 -2.558 6.167 -14.044 1.00 0.00 C ATOM 2238 CD2 LEU A 141 -3.396 8.470 -14.543 1.00 0.00 C ATOM 0 H LEU A 141 -6.011 6.300 -15.413 1.00 0.00 H new ATOM 0 HA LEU A 141 -4.830 8.243 -17.103 1.00 0.00 H new ATOM 0 HB2 LEU A 141 -3.678 5.551 -16.327 1.00 0.00 H new ATOM 0 HB3 LEU A 141 -2.805 7.023 -16.705 1.00 0.00 H new ATOM 0 HG LEU A 141 -4.600 6.730 -14.282 1.00 0.00 H new ATOM 0 HD11 LEU A 141 -2.528 6.426 -12.986 1.00 0.00 H new ATOM 0 HD12 LEU A 141 -2.777 5.105 -14.152 1.00 0.00 H new ATOM 0 HD13 LEU A 141 -1.592 6.386 -14.499 1.00 0.00 H new ATOM 0 HD21 LEU A 141 -3.354 8.697 -13.478 1.00 0.00 H new ATOM 0 HD22 LEU A 141 -2.451 8.747 -15.011 1.00 0.00 H new ATOM 0 HD23 LEU A 141 -4.207 9.034 -15.003 1.00 0.00 H new