USER MOD reduce.3.24.130724 H: found=0, std=0, add=553, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 549 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 50 ASN : amide:sc= 0.7 K(o=1.5,f=-2.8) USER MOD Set 1.2: A 52 LYS NZ :NH3+ -165:sc= 0.788 (180deg=0) USER MOD Set 2.1: A 35 MET CE :methyl -179:sc= 0 (180deg=-0.00351) USER MOD Set 2.2: A 55 LYS NZ :NH3+ -145:sc= 0.904 (180deg=0.162) USER MOD Single : A 2 SER OG : rot -43:sc= 0.858 USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 ASN : amide:sc= 0.472 K(o=0.47,f=-4.7!) USER MOD Single : A 8 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 11 ASN : amide:sc= 0.43 X(o=0.43,f=0) USER MOD Single : A 18 LYS NZ :NH3+ -172:sc= 0.7 (180deg=0.625) USER MOD Single : A 19 TYR OH : rot 100:sc= 0 USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 25 SER OG : rot 170:sc= 0 USER MOD Single : A 28 SER OG : rot 76:sc= 1.2 USER MOD Single : A 29 HIS : no HD1:sc= 0 X(o=0,f=-0.0079) USER MOD Single : A 31 LYS NZ :NH3+ -179:sc= 2.46 (180deg=2.46) USER MOD Single : A 32 SER OG : rot 64:sc= 1.15 USER MOD Single : A 36 SER OG : rot -157:sc= 1.11 USER MOD Single : A 42 GLN : amide:sc= 1 K(o=1,f=-0.42) USER MOD Single : A 47 SER OG : rot 42:sc= 0.132 USER MOD Single : A 51 LYS NZ :NH3+ -125:sc= 0.508 (180deg=0.42) USER MOD Single : A 60 GLN : amide:sc= 0.686 K(o=0.69,f=-6.8!) USER MOD Single : A 61 SER OG : rot 77:sc= 1.09 USER MOD Single : A 65 THR OG1 : rot 81:sc= 0 USER MOD Single : A 68 ASN : amide:sc= 0.182 X(o=0.18,f=0) USER MOD Single : A 70 HIS : no HE2:sc= 0.288 K(o=0.29,f=-1.9!) USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 1 -33.942 8.121 -4.292 1.00 0.00 N ATOM 2 CA PRO A 1 -32.924 9.190 -4.149 1.00 0.00 C ATOM 3 C PRO A 1 -31.612 8.781 -4.839 1.00 0.00 C ATOM 4 O PRO A 1 -30.688 8.269 -4.204 1.00 0.00 O ATOM 5 CB PRO A 1 -32.818 9.527 -2.650 1.00 0.00 C ATOM 6 CG PRO A 1 -34.196 9.124 -2.120 1.00 0.00 C ATOM 7 CD PRO A 1 -34.467 7.865 -2.938 1.00 0.00 C ATOM 0 H2 PRO A 1 -33.529 7.276 -4.688 1.00 0.00 H new ATOM 0 H3 PRO A 1 -34.689 8.412 -4.923 1.00 0.00 H new ATOM 0 HA PRO A 1 -33.206 10.110 -4.662 1.00 0.00 H new ATOM 0 HB2 PRO A 1 -32.018 8.969 -2.164 1.00 0.00 H new ATOM 0 HB3 PRO A 1 -32.614 10.585 -2.486 1.00 0.00 H new ATOM 0 HG2 PRO A 1 -34.183 8.925 -1.048 1.00 0.00 H new ATOM 0 HG3 PRO A 1 -34.946 9.896 -2.292 1.00 0.00 H new ATOM 0 HD2 PRO A 1 -33.979 7.000 -2.490 1.00 0.00 H new ATOM 0 HD3 PRO A 1 -35.534 7.647 -2.971 1.00 0.00 H new ATOM 15 N SER A 2 -31.599 8.903 -6.172 1.00 0.00 N ATOM 16 CA SER A 2 -31.066 7.889 -7.107 1.00 0.00 C ATOM 17 C SER A 2 -31.703 6.494 -6.917 1.00 0.00 C ATOM 18 O SER A 2 -32.549 6.296 -6.036 1.00 0.00 O ATOM 19 CB SER A 2 -29.527 7.871 -7.170 1.00 0.00 C ATOM 20 OG SER A 2 -28.943 7.153 -6.098 1.00 0.00 O ATOM 0 H SER A 2 -31.966 9.727 -6.648 1.00 0.00 H new ATOM 0 HA SER A 2 -31.381 8.207 -8.101 1.00 0.00 H new ATOM 0 HB2 SER A 2 -29.212 7.426 -8.114 1.00 0.00 H new ATOM 0 HB3 SER A 2 -29.155 8.896 -7.160 1.00 0.00 H new ATOM 0 HG SER A 2 -29.402 7.381 -5.263 1.00 0.00 H new ATOM 26 N GLY A 3 -31.347 5.521 -7.761 1.00 0.00 N ATOM 27 CA GLY A 3 -31.947 4.182 -7.754 1.00 0.00 C ATOM 28 C GLY A 3 -31.178 3.150 -8.582 1.00 0.00 C ATOM 29 O GLY A 3 -30.154 3.456 -9.199 1.00 0.00 O ATOM 0 H GLY A 3 -30.628 5.641 -8.475 1.00 0.00 H new ATOM 0 HA2 GLY A 3 -32.013 3.830 -6.724 1.00 0.00 H new ATOM 0 HA3 GLY A 3 -32.967 4.250 -8.133 1.00 0.00 H new ATOM 33 N LYS A 4 -31.670 1.905 -8.566 1.00 0.00 N ATOM 34 CA LYS A 4 -30.968 0.698 -9.054 1.00 0.00 C ATOM 35 C LYS A 4 -30.754 0.623 -10.583 1.00 0.00 C ATOM 36 O LYS A 4 -30.022 -0.246 -11.056 1.00 0.00 O ATOM 37 CB LYS A 4 -31.698 -0.537 -8.484 1.00 0.00 C ATOM 38 CG LYS A 4 -30.788 -1.770 -8.359 1.00 0.00 C ATOM 39 CD LYS A 4 -31.480 -2.898 -7.582 1.00 0.00 C ATOM 40 CE LYS A 4 -30.529 -4.092 -7.445 1.00 0.00 C ATOM 41 NZ LYS A 4 -31.147 -5.200 -6.671 1.00 0.00 N ATOM 0 H LYS A 4 -32.600 1.697 -8.201 1.00 0.00 H new ATOM 0 HA LYS A 4 -29.943 0.739 -8.686 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -32.104 -0.291 -7.503 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -32.544 -0.781 -9.127 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -30.514 -2.125 -9.353 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -29.863 -1.492 -7.854 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -31.778 -2.543 -6.595 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -32.390 -3.203 -8.099 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -30.250 -4.451 -8.436 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -29.611 -3.772 -6.952 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -30.475 -5.990 -6.599 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -31.390 -4.864 -5.717 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -32.009 -5.522 -7.155 1.00 0.00 H new ATOM 55 N ASN A 5 -31.349 1.535 -11.357 1.00 0.00 N ATOM 56 CA ASN A 5 -31.114 1.717 -12.797 1.00 0.00 C ATOM 57 C ASN A 5 -31.280 3.208 -13.192 1.00 0.00 C ATOM 58 O ASN A 5 -31.978 3.940 -12.485 1.00 0.00 O ATOM 59 CB ASN A 5 -32.066 0.780 -13.576 1.00 0.00 C ATOM 60 CG ASN A 5 -33.525 1.192 -13.498 1.00 0.00 C ATOM 61 OD1 ASN A 5 -33.939 2.176 -14.089 1.00 0.00 O ATOM 62 ND2 ASN A 5 -34.352 0.464 -12.782 1.00 0.00 N ATOM 0 H ASN A 5 -32.034 2.193 -10.986 1.00 0.00 H new ATOM 0 HA ASN A 5 -30.089 1.448 -13.054 1.00 0.00 H new ATOM 0 HB2 ASN A 5 -31.760 0.754 -14.622 1.00 0.00 H new ATOM 0 HB3 ASN A 5 -31.962 -0.233 -13.188 1.00 0.00 H new ATOM 0 HD21 ASN A 5 -35.337 0.722 -12.721 1.00 0.00 H new ATOM 0 HD22 ASN A 5 -34.009 -0.359 -12.287 1.00 0.00 H new ATOM 69 N PRO A 6 -30.685 3.683 -14.308 1.00 0.00 N ATOM 70 CA PRO A 6 -30.725 5.102 -14.677 1.00 0.00 C ATOM 71 C PRO A 6 -32.113 5.627 -15.042 1.00 0.00 C ATOM 72 O PRO A 6 -32.406 6.794 -14.758 1.00 0.00 O ATOM 73 CB PRO A 6 -29.761 5.267 -15.866 1.00 0.00 C ATOM 74 CG PRO A 6 -29.680 3.860 -16.436 1.00 0.00 C ATOM 75 CD PRO A 6 -29.802 2.960 -15.213 1.00 0.00 C ATOM 0 HA PRO A 6 -30.434 5.693 -13.809 1.00 0.00 H new ATOM 0 HB2 PRO A 6 -30.142 5.978 -16.599 1.00 0.00 H new ATOM 0 HB3 PRO A 6 -28.784 5.630 -15.547 1.00 0.00 H new ATOM 0 HG2 PRO A 6 -30.481 3.672 -17.151 1.00 0.00 H new ATOM 0 HG3 PRO A 6 -28.739 3.695 -16.961 1.00 0.00 H new ATOM 0 HD2 PRO A 6 -30.216 1.987 -15.477 1.00 0.00 H new ATOM 0 HD3 PRO A 6 -28.829 2.779 -14.756 1.00 0.00 H new ATOM 83 N VAL A 7 -32.980 4.780 -15.623 1.00 0.00 N ATOM 84 CA VAL A 7 -34.368 5.172 -15.919 1.00 0.00 C ATOM 85 C VAL A 7 -35.026 5.670 -14.652 1.00 0.00 C ATOM 86 O VAL A 7 -35.558 6.767 -14.634 1.00 0.00 O ATOM 87 CB VAL A 7 -35.247 4.064 -16.536 1.00 0.00 C ATOM 88 CG1 VAL A 7 -36.697 4.517 -16.744 1.00 0.00 C ATOM 89 CG2 VAL A 7 -34.553 3.433 -17.722 1.00 0.00 C ATOM 0 H VAL A 7 -32.746 3.825 -15.895 1.00 0.00 H new ATOM 0 HA VAL A 7 -34.294 5.950 -16.679 1.00 0.00 H new ATOM 0 HB VAL A 7 -35.361 3.247 -15.823 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -37.274 3.702 -17.180 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -37.132 4.796 -15.784 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -36.717 5.375 -17.415 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -35.189 2.654 -18.143 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -34.361 4.194 -18.479 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -33.608 2.995 -17.400 1.00 0.00 H new ATOM 99 N MET A 8 -34.934 4.888 -13.583 1.00 0.00 N ATOM 100 CA MET A 8 -35.533 5.171 -12.289 1.00 0.00 C ATOM 101 C MET A 8 -35.135 6.530 -11.688 1.00 0.00 C ATOM 102 O MET A 8 -36.003 7.248 -11.191 1.00 0.00 O ATOM 103 CB MET A 8 -35.200 3.992 -11.379 1.00 0.00 C ATOM 104 CG MET A 8 -36.140 3.949 -10.180 1.00 0.00 C ATOM 105 SD MET A 8 -35.657 4.998 -8.778 1.00 0.00 S ATOM 106 CE MET A 8 -37.143 4.861 -7.750 1.00 0.00 C ATOM 0 H MET A 8 -34.420 4.007 -13.597 1.00 0.00 H new ATOM 0 HA MET A 8 -36.612 5.273 -12.407 1.00 0.00 H new ATOM 0 HB2 MET A 8 -35.277 3.061 -11.940 1.00 0.00 H new ATOM 0 HB3 MET A 8 -34.169 4.073 -11.035 1.00 0.00 H new ATOM 0 HG2 MET A 8 -37.136 4.246 -10.509 1.00 0.00 H new ATOM 0 HG3 MET A 8 -36.213 2.918 -9.833 1.00 0.00 H new ATOM 0 HE1 MET A 8 -37.013 5.450 -6.842 1.00 0.00 H new ATOM 0 HE2 MET A 8 -38.004 5.234 -8.304 1.00 0.00 H new ATOM 0 HE3 MET A 8 -37.307 3.817 -7.484 1.00 0.00 H new ATOM 116 N ILE A 9 -33.853 6.901 -11.733 1.00 0.00 N ATOM 117 CA ILE A 9 -33.346 8.254 -11.428 1.00 0.00 C ATOM 118 C ILE A 9 -34.013 9.331 -12.285 1.00 0.00 C ATOM 119 O ILE A 9 -34.590 10.279 -11.760 1.00 0.00 O ATOM 120 CB ILE A 9 -31.814 8.356 -11.606 1.00 0.00 C ATOM 121 CG1 ILE A 9 -31.062 7.122 -11.080 1.00 0.00 C ATOM 122 CG2 ILE A 9 -31.294 9.661 -10.969 1.00 0.00 C ATOM 123 CD1 ILE A 9 -29.592 7.119 -11.495 1.00 0.00 C ATOM 0 H ILE A 9 -33.110 6.251 -11.990 1.00 0.00 H new ATOM 0 HA ILE A 9 -33.597 8.427 -10.382 1.00 0.00 H new ATOM 0 HB ILE A 9 -31.611 8.384 -12.677 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -31.130 7.094 -9.993 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -31.545 6.219 -11.453 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -30.214 9.724 -11.099 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -31.768 10.516 -11.452 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -31.532 9.667 -9.905 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -29.104 6.228 -11.100 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -29.521 7.119 -12.583 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -29.100 8.008 -11.099 1.00 0.00 H new ATOM 135 N LEU A 10 -33.883 9.227 -13.614 1.00 0.00 N ATOM 136 CA LEU A 10 -34.458 10.188 -14.568 1.00 0.00 C ATOM 137 C LEU A 10 -35.974 10.362 -14.384 1.00 0.00 C ATOM 138 O LEU A 10 -36.504 11.472 -14.392 1.00 0.00 O ATOM 139 CB LEU A 10 -33.914 9.848 -15.973 1.00 0.00 C ATOM 140 CG LEU A 10 -34.729 9.745 -17.269 1.00 0.00 C ATOM 141 CD1 LEU A 10 -35.789 8.649 -17.306 1.00 0.00 C ATOM 142 CD2 LEU A 10 -35.273 11.092 -17.717 1.00 0.00 C ATOM 0 H LEU A 10 -33.371 8.467 -14.063 1.00 0.00 H new ATOM 0 HA LEU A 10 -34.131 11.210 -14.378 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -33.141 10.590 -16.173 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -33.413 8.886 -15.867 1.00 0.00 H new ATOM 0 HG LEU A 10 -33.997 9.416 -18.007 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -36.301 8.670 -18.268 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -35.313 7.678 -17.170 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -36.511 8.814 -16.507 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -35.842 10.966 -18.638 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -35.922 11.498 -16.942 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -34.445 11.779 -17.893 1.00 0.00 H new ATOM 154 N ASN A 11 -36.641 9.245 -14.112 1.00 0.00 N ATOM 155 CA ASN A 11 -38.035 9.121 -13.670 1.00 0.00 C ATOM 156 C ASN A 11 -38.314 9.935 -12.400 1.00 0.00 C ATOM 157 O ASN A 11 -39.204 10.776 -12.363 1.00 0.00 O ATOM 158 CB ASN A 11 -38.295 7.618 -13.464 1.00 0.00 C ATOM 159 CG ASN A 11 -39.375 7.268 -12.451 1.00 0.00 C ATOM 160 OD1 ASN A 11 -40.565 7.353 -12.712 1.00 0.00 O ATOM 161 ND2 ASN A 11 -38.984 6.857 -11.264 1.00 0.00 N ATOM 0 H ASN A 11 -36.193 8.333 -14.200 1.00 0.00 H new ATOM 0 HA ASN A 11 -38.714 9.530 -14.418 1.00 0.00 H new ATOM 0 HB2 ASN A 11 -38.568 7.180 -14.424 1.00 0.00 H new ATOM 0 HB3 ASN A 11 -37.363 7.146 -13.152 1.00 0.00 H new ATOM 0 HD21 ASN A 11 -39.676 6.608 -10.557 1.00 0.00 H new ATOM 0 HD22 ASN A 11 -37.989 6.788 -11.051 1.00 0.00 H new ATOM 168 N GLU A 12 -37.565 9.646 -11.342 1.00 0.00 N ATOM 169 CA GLU A 12 -37.634 10.309 -10.049 1.00 0.00 C ATOM 170 C GLU A 12 -37.448 11.829 -10.171 1.00 0.00 C ATOM 171 O GLU A 12 -38.320 12.592 -9.756 1.00 0.00 O ATOM 172 CB GLU A 12 -36.616 9.616 -9.128 1.00 0.00 C ATOM 173 CG GLU A 12 -36.266 10.430 -7.883 1.00 0.00 C ATOM 174 CD GLU A 12 -35.395 9.633 -6.911 1.00 0.00 C ATOM 175 OE1 GLU A 12 -35.941 8.893 -6.059 1.00 0.00 O ATOM 176 OE2 GLU A 12 -34.153 9.771 -6.952 1.00 0.00 O ATOM 0 H GLU A 12 -36.861 8.908 -11.366 1.00 0.00 H new ATOM 0 HA GLU A 12 -38.626 10.210 -9.608 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -37.016 8.650 -8.820 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -35.704 9.419 -9.691 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -35.743 11.339 -8.178 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -37.183 10.739 -7.381 1.00 0.00 H new ATOM 183 N LEU A 13 -36.319 12.275 -10.730 1.00 0.00 N ATOM 184 CA LEU A 13 -36.015 13.674 -11.045 1.00 0.00 C ATOM 185 C LEU A 13 -37.022 14.412 -11.949 1.00 0.00 C ATOM 186 O LEU A 13 -37.214 15.614 -11.757 1.00 0.00 O ATOM 187 CB LEU A 13 -34.577 13.808 -11.541 1.00 0.00 C ATOM 188 CG LEU A 13 -33.519 13.416 -10.486 1.00 0.00 C ATOM 189 CD1 LEU A 13 -32.203 14.017 -10.942 1.00 0.00 C ATOM 190 CD2 LEU A 13 -33.746 13.918 -9.055 1.00 0.00 C ATOM 0 H LEU A 13 -35.560 11.644 -10.986 1.00 0.00 H new ATOM 0 HA LEU A 13 -36.125 14.202 -10.098 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -34.446 13.182 -12.424 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -34.403 14.838 -11.852 1.00 0.00 H new ATOM 0 HG LEU A 13 -33.558 12.328 -10.430 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -31.421 13.766 -10.225 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -31.940 13.617 -11.921 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -32.301 15.101 -11.008 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -32.933 13.574 -8.415 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -33.774 15.008 -9.052 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -34.693 13.530 -8.679 1.00 0.00 H new ATOM 202 N ARG A 14 -37.620 13.714 -12.933 1.00 0.00 N ATOM 203 CA ARG A 14 -38.315 14.244 -14.132 1.00 0.00 C ATOM 204 C ARG A 14 -38.588 15.769 -14.182 1.00 0.00 C ATOM 205 O ARG A 14 -39.631 16.221 -13.703 1.00 0.00 O ATOM 206 CB ARG A 14 -39.495 13.341 -14.581 1.00 0.00 C ATOM 207 CG ARG A 14 -40.934 13.543 -14.050 1.00 0.00 C ATOM 208 CD ARG A 14 -41.291 13.124 -12.614 1.00 0.00 C ATOM 209 NE ARG A 14 -40.396 13.616 -11.548 1.00 0.00 N ATOM 210 CZ ARG A 14 -40.462 14.763 -10.895 1.00 0.00 C ATOM 211 NH1 ARG A 14 -41.134 15.786 -11.334 1.00 0.00 N ATOM 212 NH2 ARG A 14 -39.835 14.899 -9.765 1.00 0.00 N ATOM 0 H ARG A 14 -37.634 12.694 -12.914 1.00 0.00 H new ATOM 0 HA ARG A 14 -37.561 14.172 -14.916 1.00 0.00 H new ATOM 0 HB2 ARG A 14 -39.549 13.412 -15.667 1.00 0.00 H new ATOM 0 HB3 ARG A 14 -39.214 12.315 -14.342 1.00 0.00 H new ATOM 0 HG2 ARG A 14 -41.169 14.603 -14.146 1.00 0.00 H new ATOM 0 HG3 ARG A 14 -41.605 13.006 -14.720 1.00 0.00 H new ATOM 0 HD2 ARG A 14 -42.302 13.469 -12.398 1.00 0.00 H new ATOM 0 HD3 ARG A 14 -41.310 12.035 -12.570 1.00 0.00 H new ATOM 0 HE ARG A 14 -39.632 12.994 -11.283 1.00 0.00 H new ATOM 0 HH11 ARG A 14 -41.639 15.723 -12.218 1.00 0.00 H new ATOM 0 HH12 ARG A 14 -41.156 16.651 -10.795 1.00 0.00 H new ATOM 0 HH21 ARG A 14 -39.294 14.122 -9.385 1.00 0.00 H new ATOM 0 HH22 ARG A 14 -39.883 15.783 -9.258 1.00 0.00 H new ATOM 226 N PRO A 15 -37.678 16.596 -14.742 1.00 0.00 N ATOM 227 CA PRO A 15 -37.967 18.006 -15.030 1.00 0.00 C ATOM 228 C PRO A 15 -39.036 18.152 -16.141 1.00 0.00 C ATOM 229 O PRO A 15 -39.726 17.193 -16.491 1.00 0.00 O ATOM 230 CB PRO A 15 -36.602 18.623 -15.372 1.00 0.00 C ATOM 231 CG PRO A 15 -35.809 17.456 -15.951 1.00 0.00 C ATOM 232 CD PRO A 15 -36.313 16.265 -15.139 1.00 0.00 C ATOM 0 HA PRO A 15 -38.415 18.533 -14.187 1.00 0.00 H new ATOM 0 HB2 PRO A 15 -36.700 19.436 -16.091 1.00 0.00 H new ATOM 0 HB3 PRO A 15 -36.117 19.036 -14.488 1.00 0.00 H new ATOM 0 HG2 PRO A 15 -35.999 17.328 -17.017 1.00 0.00 H new ATOM 0 HG3 PRO A 15 -34.735 17.600 -15.834 1.00 0.00 H new ATOM 0 HD2 PRO A 15 -36.290 15.351 -15.732 1.00 0.00 H new ATOM 0 HD3 PRO A 15 -35.683 16.094 -14.266 1.00 0.00 H new ATOM 240 N GLY A 16 -39.199 19.351 -16.708 1.00 0.00 N ATOM 241 CA GLY A 16 -40.106 19.635 -17.833 1.00 0.00 C ATOM 242 C GLY A 16 -39.677 18.993 -19.164 1.00 0.00 C ATOM 243 O GLY A 16 -39.307 19.709 -20.096 1.00 0.00 O ATOM 0 H GLY A 16 -38.691 20.177 -16.391 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -41.105 19.283 -17.578 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -40.173 20.715 -17.968 1.00 0.00 H new ATOM 247 N LEU A 17 -39.694 17.657 -19.247 1.00 0.00 N ATOM 248 CA LEU A 17 -39.232 16.861 -20.390 1.00 0.00 C ATOM 249 C LEU A 17 -40.373 16.132 -21.128 1.00 0.00 C ATOM 250 O LEU A 17 -41.492 16.021 -20.616 1.00 0.00 O ATOM 251 CB LEU A 17 -38.091 15.931 -19.938 1.00 0.00 C ATOM 252 CG LEU A 17 -38.382 14.897 -18.837 1.00 0.00 C ATOM 253 CD1 LEU A 17 -39.236 13.724 -19.298 1.00 0.00 C ATOM 254 CD2 LEU A 17 -37.050 14.319 -18.374 1.00 0.00 C ATOM 0 H LEU A 17 -40.046 17.076 -18.486 1.00 0.00 H new ATOM 0 HA LEU A 17 -38.834 17.540 -21.144 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -37.736 15.390 -20.815 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -37.268 16.558 -19.595 1.00 0.00 H new ATOM 0 HG LEU A 17 -38.932 15.420 -18.054 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -39.396 13.040 -18.464 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -40.198 14.092 -19.655 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -38.727 13.198 -20.106 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -37.226 13.581 -17.591 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -36.548 13.842 -19.216 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -36.422 15.120 -17.983 1.00 0.00 H new ATOM 266 N LYS A 18 -40.075 15.608 -22.324 1.00 0.00 N ATOM 267 CA LYS A 18 -40.918 14.661 -23.080 1.00 0.00 C ATOM 268 C LYS A 18 -40.115 13.505 -23.663 1.00 0.00 C ATOM 269 O LYS A 18 -39.038 13.740 -24.206 1.00 0.00 O ATOM 270 CB LYS A 18 -41.773 15.311 -24.180 1.00 0.00 C ATOM 271 CG LYS A 18 -41.006 15.949 -25.353 1.00 0.00 C ATOM 272 CD LYS A 18 -41.972 16.374 -26.469 1.00 0.00 C ATOM 273 CE LYS A 18 -41.241 16.893 -27.717 1.00 0.00 C ATOM 274 NZ LYS A 18 -40.642 15.795 -28.521 1.00 0.00 N ATOM 0 H LYS A 18 -39.210 15.838 -22.813 1.00 0.00 H new ATOM 0 HA LYS A 18 -41.609 14.271 -22.333 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -42.446 14.554 -24.583 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -42.396 16.079 -23.721 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -40.447 16.816 -25.000 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -40.278 15.239 -25.746 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -42.598 15.525 -26.746 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -42.637 17.151 -26.092 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -41.940 17.454 -28.337 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -40.457 17.587 -27.413 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -40.048 16.199 -29.273 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -40.059 15.193 -27.906 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -41.399 15.224 -28.947 1.00 0.00 H new ATOM 288 N TYR A 19 -40.662 12.292 -23.598 1.00 0.00 N ATOM 289 CA TYR A 19 -40.083 11.124 -24.266 1.00 0.00 C ATOM 290 C TYR A 19 -40.899 10.791 -25.519 1.00 0.00 C ATOM 291 O TYR A 19 -42.132 10.757 -25.514 1.00 0.00 O ATOM 292 CB TYR A 19 -40.092 9.871 -23.376 1.00 0.00 C ATOM 293 CG TYR A 19 -39.591 10.028 -21.966 1.00 0.00 C ATOM 294 CD1 TYR A 19 -40.479 10.467 -20.969 1.00 0.00 C ATOM 295 CD2 TYR A 19 -38.267 9.686 -21.639 1.00 0.00 C ATOM 296 CE1 TYR A 19 -40.034 10.597 -19.644 1.00 0.00 C ATOM 297 CE2 TYR A 19 -37.807 9.841 -20.322 1.00 0.00 C ATOM 298 CZ TYR A 19 -38.699 10.289 -19.316 1.00 0.00 C ATOM 299 OH TYR A 19 -38.313 10.423 -18.024 1.00 0.00 O ATOM 0 H TYR A 19 -41.518 12.090 -23.082 1.00 0.00 H new ATOM 0 HA TYR A 19 -39.052 11.384 -24.506 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -41.114 9.495 -23.332 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -39.491 9.104 -23.865 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -41.502 10.704 -21.222 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -37.604 9.304 -22.401 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -40.715 10.933 -18.876 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -36.779 9.620 -20.077 1.00 0.00 H new ATOM 0 HH TYR A 19 -38.312 9.544 -17.590 1.00 0.00 H new ATOM 309 N ASP A 20 -40.172 10.524 -26.592 1.00 0.00 N ATOM 310 CA ASP A 20 -40.642 10.153 -27.920 1.00 0.00 C ATOM 311 C ASP A 20 -40.200 8.712 -28.210 1.00 0.00 C ATOM 312 O ASP A 20 -39.065 8.326 -27.912 1.00 0.00 O ATOM 313 CB ASP A 20 -40.070 11.118 -28.974 1.00 0.00 C ATOM 314 CG ASP A 20 -40.373 12.592 -28.667 1.00 0.00 C ATOM 315 OD1 ASP A 20 -41.489 13.067 -28.987 1.00 0.00 O ATOM 316 OD2 ASP A 20 -39.491 13.315 -28.145 1.00 0.00 O ATOM 0 H ASP A 20 -39.153 10.564 -26.555 1.00 0.00 H new ATOM 0 HA ASP A 20 -41.729 10.216 -27.962 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -38.991 10.980 -29.036 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -40.481 10.864 -29.951 1.00 0.00 H new ATOM 321 N PHE A 21 -41.106 7.897 -28.752 1.00 0.00 N ATOM 322 CA PHE A 21 -40.877 6.475 -29.015 1.00 0.00 C ATOM 323 C PHE A 21 -40.708 6.210 -30.517 1.00 0.00 C ATOM 324 O PHE A 21 -41.591 6.475 -31.338 1.00 0.00 O ATOM 325 CB PHE A 21 -42.012 5.666 -28.370 1.00 0.00 C ATOM 326 CG PHE A 21 -42.008 4.167 -28.619 1.00 0.00 C ATOM 327 CD1 PHE A 21 -40.808 3.443 -28.784 1.00 0.00 C ATOM 328 CD2 PHE A 21 -43.239 3.481 -28.672 1.00 0.00 C ATOM 329 CE1 PHE A 21 -40.846 2.065 -29.055 1.00 0.00 C ATOM 330 CE2 PHE A 21 -43.272 2.096 -28.913 1.00 0.00 C ATOM 331 CZ PHE A 21 -42.075 1.389 -29.118 1.00 0.00 C ATOM 0 H PHE A 21 -42.037 8.212 -29.026 1.00 0.00 H new ATOM 0 HA PHE A 21 -39.940 6.151 -28.562 1.00 0.00 H new ATOM 0 HB2 PHE A 21 -41.979 5.832 -27.293 1.00 0.00 H new ATOM 0 HB3 PHE A 21 -42.961 6.068 -28.726 1.00 0.00 H new ATOM 0 HD1 PHE A 21 -39.858 3.950 -28.702 1.00 0.00 H new ATOM 0 HD2 PHE A 21 -44.162 4.023 -28.527 1.00 0.00 H new ATOM 0 HE1 PHE A 21 -39.926 1.523 -29.216 1.00 0.00 H new ATOM 0 HE2 PHE A 21 -44.218 1.575 -28.941 1.00 0.00 H new ATOM 0 HZ PHE A 21 -42.100 0.329 -29.323 1.00 0.00 H new ATOM 341 N LEU A 22 -39.531 5.682 -30.838 1.00 0.00 N ATOM 342 CA LEU A 22 -38.988 5.344 -32.141 1.00 0.00 C ATOM 343 C LEU A 22 -38.597 3.855 -32.088 1.00 0.00 C ATOM 344 O LEU A 22 -38.287 3.305 -31.031 1.00 0.00 O ATOM 345 CB LEU A 22 -37.742 6.193 -32.494 1.00 0.00 C ATOM 346 CG LEU A 22 -37.694 7.725 -32.318 1.00 0.00 C ATOM 347 CD1 LEU A 22 -38.824 8.497 -32.979 1.00 0.00 C ATOM 348 CD2 LEU A 22 -37.669 8.199 -30.874 1.00 0.00 C ATOM 0 H LEU A 22 -38.861 5.456 -30.103 1.00 0.00 H new ATOM 0 HA LEU A 22 -39.734 5.546 -32.909 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -36.916 5.788 -31.910 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -37.519 5.994 -33.542 1.00 0.00 H new ATOM 0 HG LEU A 22 -36.750 7.941 -32.818 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -38.694 9.563 -32.793 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -38.812 8.311 -34.053 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -39.778 8.171 -32.565 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -37.636 9.288 -30.849 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -38.566 7.852 -30.361 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -36.787 7.797 -30.374 1.00 0.00 H new ATOM 360 N SER A 23 -38.647 3.162 -33.211 1.00 0.00 N ATOM 361 CA SER A 23 -38.196 1.772 -33.328 1.00 0.00 C ATOM 362 C SER A 23 -37.136 1.601 -34.420 1.00 0.00 C ATOM 363 O SER A 23 -37.292 2.113 -35.530 1.00 0.00 O ATOM 364 CB SER A 23 -39.410 0.858 -33.539 1.00 0.00 C ATOM 365 OG SER A 23 -40.186 1.220 -34.672 1.00 0.00 O ATOM 0 H SER A 23 -39.006 3.547 -34.085 1.00 0.00 H new ATOM 0 HA SER A 23 -37.706 1.482 -32.399 1.00 0.00 H new ATOM 0 HB2 SER A 23 -39.068 -0.171 -33.653 1.00 0.00 H new ATOM 0 HB3 SER A 23 -40.039 0.888 -32.650 1.00 0.00 H new ATOM 0 HG SER A 23 -40.944 0.605 -34.760 1.00 0.00 H new ATOM 371 N GLU A 24 -36.064 0.869 -34.094 1.00 0.00 N ATOM 372 CA GLU A 24 -35.088 0.249 -35.002 1.00 0.00 C ATOM 373 C GLU A 24 -33.791 1.043 -35.214 1.00 0.00 C ATOM 374 O GLU A 24 -33.392 1.365 -36.338 1.00 0.00 O ATOM 375 CB GLU A 24 -35.683 -0.331 -36.307 1.00 0.00 C ATOM 376 CG GLU A 24 -36.822 -1.344 -36.098 1.00 0.00 C ATOM 377 CD GLU A 24 -36.293 -2.719 -35.659 1.00 0.00 C ATOM 378 OE1 GLU A 24 -35.948 -2.888 -34.465 1.00 0.00 O ATOM 379 OE2 GLU A 24 -36.226 -3.639 -36.511 1.00 0.00 O ATOM 0 H GLU A 24 -35.838 0.680 -33.117 1.00 0.00 H new ATOM 0 HA GLU A 24 -34.771 -0.627 -34.436 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -36.054 0.492 -36.918 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -34.885 -0.813 -36.872 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -37.513 -0.964 -35.345 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -37.387 -1.451 -37.024 1.00 0.00 H new ATOM 386 N SER A 25 -33.066 1.266 -34.116 1.00 0.00 N ATOM 387 CA SER A 25 -31.601 1.151 -34.160 1.00 0.00 C ATOM 388 C SER A 25 -31.253 -0.320 -34.469 1.00 0.00 C ATOM 389 O SER A 25 -31.606 -1.215 -33.697 1.00 0.00 O ATOM 390 CB SER A 25 -31.004 1.620 -32.828 1.00 0.00 C ATOM 391 OG SER A 25 -29.603 1.399 -32.828 1.00 0.00 O ATOM 0 H SER A 25 -33.453 1.521 -33.207 1.00 0.00 H new ATOM 0 HA SER A 25 -31.176 1.785 -34.938 1.00 0.00 H new ATOM 0 HB2 SER A 25 -31.215 2.679 -32.677 1.00 0.00 H new ATOM 0 HB3 SER A 25 -31.467 1.081 -32.001 1.00 0.00 H new ATOM 0 HG SER A 25 -29.202 1.842 -32.051 1.00 0.00 H new ATOM 397 N GLY A 26 -30.658 -0.599 -35.632 1.00 0.00 N ATOM 398 CA GLY A 26 -30.581 -1.951 -36.214 1.00 0.00 C ATOM 399 C GLY A 26 -29.300 -2.225 -37.021 1.00 0.00 C ATOM 400 O GLY A 26 -28.387 -1.398 -37.049 1.00 0.00 O ATOM 0 H GLY A 26 -30.209 0.114 -36.207 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -30.653 -2.684 -35.410 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -31.444 -2.104 -36.862 1.00 0.00 H new ATOM 404 N GLU A 27 -29.160 -3.362 -37.710 1.00 0.00 N ATOM 405 CA GLU A 27 -30.114 -4.482 -37.866 1.00 0.00 C ATOM 406 C GLU A 27 -30.067 -5.464 -36.662 1.00 0.00 C ATOM 407 O GLU A 27 -29.860 -5.024 -35.531 1.00 0.00 O ATOM 408 CB GLU A 27 -29.856 -5.140 -39.246 1.00 0.00 C ATOM 409 CG GLU A 27 -31.139 -5.425 -40.048 1.00 0.00 C ATOM 410 CD GLU A 27 -32.086 -6.403 -39.337 1.00 0.00 C ATOM 411 OE1 GLU A 27 -31.743 -7.606 -39.251 1.00 0.00 O ATOM 412 OE2 GLU A 27 -33.130 -5.965 -38.798 1.00 0.00 O ATOM 0 H GLU A 27 -28.298 -3.546 -38.223 1.00 0.00 H new ATOM 0 HA GLU A 27 -31.141 -4.117 -37.854 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -29.209 -4.489 -39.833 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -29.316 -6.075 -39.097 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -31.664 -4.487 -40.229 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -30.869 -5.833 -41.022 1.00 0.00 H new ATOM 419 N SER A 28 -30.285 -6.775 -36.849 1.00 0.00 N ATOM 420 CA SER A 28 -30.466 -7.792 -35.790 1.00 0.00 C ATOM 421 C SER A 28 -29.355 -7.902 -34.727 1.00 0.00 C ATOM 422 O SER A 28 -29.594 -8.480 -33.664 1.00 0.00 O ATOM 423 CB SER A 28 -30.718 -9.177 -36.407 1.00 0.00 C ATOM 424 OG SER A 28 -31.978 -9.219 -37.058 1.00 0.00 O ATOM 0 H SER A 28 -30.343 -7.178 -37.784 1.00 0.00 H new ATOM 0 HA SER A 28 -31.335 -7.427 -35.243 1.00 0.00 H new ATOM 0 HB2 SER A 28 -29.928 -9.411 -37.120 1.00 0.00 H new ATOM 0 HB3 SER A 28 -30.681 -9.939 -35.628 1.00 0.00 H new ATOM 0 HG SER A 28 -31.920 -8.745 -37.914 1.00 0.00 H new ATOM 430 N HIS A 29 -28.162 -7.339 -34.956 1.00 0.00 N ATOM 431 CA HIS A 29 -27.118 -7.199 -33.929 1.00 0.00 C ATOM 432 C HIS A 29 -27.494 -6.176 -32.835 1.00 0.00 C ATOM 433 O HIS A 29 -27.238 -6.408 -31.650 1.00 0.00 O ATOM 434 CB HIS A 29 -25.798 -6.812 -34.613 1.00 0.00 C ATOM 435 CG HIS A 29 -24.635 -6.740 -33.655 1.00 0.00 C ATOM 436 ND1 HIS A 29 -24.183 -5.616 -32.998 1.00 0.00 N ATOM 437 CD2 HIS A 29 -23.854 -7.788 -33.242 1.00 0.00 C ATOM 438 CE1 HIS A 29 -23.158 -5.975 -32.207 1.00 0.00 C ATOM 439 NE2 HIS A 29 -22.915 -7.294 -32.324 1.00 0.00 N ATOM 0 H HIS A 29 -27.891 -6.965 -35.865 1.00 0.00 H new ATOM 0 HA HIS A 29 -27.008 -8.157 -33.420 1.00 0.00 H new ATOM 0 HB2 HIS A 29 -25.574 -7.539 -35.394 1.00 0.00 H new ATOM 0 HB3 HIS A 29 -25.919 -5.845 -35.102 1.00 0.00 H new ATOM 0 HD2 HIS A 29 -23.945 -8.814 -33.566 1.00 0.00 H new ATOM 0 HE1 HIS A 29 -22.607 -5.301 -31.568 1.00 0.00 H new ATOM 0 HE2 HIS A 29 -22.192 -7.828 -31.841 1.00 0.00 H new ATOM 447 N ALA A 30 -28.167 -5.080 -33.204 1.00 0.00 N ATOM 448 CA ALA A 30 -28.663 -4.059 -32.275 1.00 0.00 C ATOM 449 C ALA A 30 -30.147 -4.268 -31.918 1.00 0.00 C ATOM 450 O ALA A 30 -30.491 -4.197 -30.737 1.00 0.00 O ATOM 451 CB ALA A 30 -28.422 -2.681 -32.906 1.00 0.00 C ATOM 0 H ALA A 30 -28.387 -4.874 -34.179 1.00 0.00 H new ATOM 0 HA ALA A 30 -28.120 -4.136 -31.333 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -28.783 -1.904 -32.232 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -27.355 -2.542 -33.081 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -28.956 -2.616 -33.854 1.00 0.00 H new ATOM 457 N LYS A 31 -30.996 -4.570 -32.916 1.00 0.00 N ATOM 458 CA LYS A 31 -32.461 -4.805 -32.860 1.00 0.00 C ATOM 459 C LYS A 31 -33.188 -4.045 -31.739 1.00 0.00 C ATOM 460 O LYS A 31 -33.865 -4.613 -30.881 1.00 0.00 O ATOM 461 CB LYS A 31 -32.749 -6.320 -32.887 1.00 0.00 C ATOM 462 CG LYS A 31 -34.042 -6.737 -33.615 1.00 0.00 C ATOM 463 CD LYS A 31 -34.170 -6.156 -35.034 1.00 0.00 C ATOM 464 CE LYS A 31 -35.201 -6.910 -35.876 1.00 0.00 C ATOM 465 NZ LYS A 31 -35.411 -6.230 -37.177 1.00 0.00 N ATOM 0 H LYS A 31 -30.649 -4.666 -33.871 1.00 0.00 H new ATOM 0 HA LYS A 31 -32.896 -4.366 -33.758 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -31.907 -6.824 -33.362 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -32.799 -6.681 -31.860 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -34.081 -7.825 -33.673 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -34.900 -6.419 -33.023 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -34.454 -5.105 -34.970 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -33.200 -6.195 -35.530 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -34.863 -7.933 -36.044 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -36.145 -6.971 -35.335 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -36.126 -6.747 -37.727 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -35.738 -5.257 -37.011 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -34.516 -6.209 -37.706 1.00 0.00 H new ATOM 479 N SER A 32 -32.968 -2.737 -31.733 1.00 0.00 N ATOM 480 CA SER A 32 -33.156 -1.830 -30.606 1.00 0.00 C ATOM 481 C SER A 32 -34.291 -0.840 -30.837 1.00 0.00 C ATOM 482 O SER A 32 -34.458 -0.237 -31.903 1.00 0.00 O ATOM 483 CB SER A 32 -31.849 -1.110 -30.256 1.00 0.00 C ATOM 484 OG SER A 32 -31.106 -1.881 -29.333 1.00 0.00 O ATOM 0 H SER A 32 -32.633 -2.250 -32.565 1.00 0.00 H new ATOM 0 HA SER A 32 -33.447 -2.441 -29.752 1.00 0.00 H new ATOM 0 HB2 SER A 32 -31.262 -0.944 -31.159 1.00 0.00 H new ATOM 0 HB3 SER A 32 -32.066 -0.130 -29.832 1.00 0.00 H new ATOM 0 HG SER A 32 -30.845 -2.729 -29.750 1.00 0.00 H new ATOM 490 N PHE A 33 -35.072 -0.661 -29.785 1.00 0.00 N ATOM 491 CA PHE A 33 -36.191 0.252 -29.696 1.00 0.00 C ATOM 492 C PHE A 33 -35.591 1.511 -29.091 1.00 0.00 C ATOM 493 O PHE A 33 -34.667 1.480 -28.276 1.00 0.00 O ATOM 494 CB PHE A 33 -37.286 -0.276 -28.762 1.00 0.00 C ATOM 495 CG PHE A 33 -37.886 -1.646 -29.031 1.00 0.00 C ATOM 496 CD1 PHE A 33 -37.614 -2.390 -30.200 1.00 0.00 C ATOM 497 CD2 PHE A 33 -38.732 -2.193 -28.049 1.00 0.00 C ATOM 498 CE1 PHE A 33 -38.136 -3.687 -30.353 1.00 0.00 C ATOM 499 CE2 PHE A 33 -39.262 -3.485 -28.202 1.00 0.00 C ATOM 500 CZ PHE A 33 -38.958 -4.237 -29.351 1.00 0.00 C ATOM 0 H PHE A 33 -34.930 -1.182 -28.920 1.00 0.00 H new ATOM 0 HA PHE A 33 -36.658 0.404 -30.669 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -36.879 -0.288 -27.751 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -38.101 0.447 -28.769 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -37.002 -1.961 -30.980 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -38.976 -1.615 -27.170 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -37.906 -4.261 -31.239 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -39.902 -3.900 -27.438 1.00 0.00 H new ATOM 0 HZ PHE A 33 -39.355 -5.235 -29.465 1.00 0.00 H new ATOM 510 N VAL A 34 -35.967 2.632 -29.666 1.00 0.00 N ATOM 511 CA VAL A 34 -35.218 3.865 -29.571 1.00 0.00 C ATOM 512 C VAL A 34 -36.083 4.876 -28.845 1.00 0.00 C ATOM 513 O VAL A 34 -37.144 5.288 -29.306 1.00 0.00 O ATOM 514 CB VAL A 34 -34.752 4.255 -30.973 1.00 0.00 C ATOM 515 CG1 VAL A 34 -34.176 5.653 -31.023 1.00 0.00 C ATOM 516 CG2 VAL A 34 -33.592 3.361 -31.403 1.00 0.00 C ATOM 0 H VAL A 34 -36.818 2.713 -30.223 1.00 0.00 H new ATOM 0 HA VAL A 34 -34.304 3.784 -28.983 1.00 0.00 H new ATOM 0 HB VAL A 34 -35.633 4.167 -31.609 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -33.860 5.880 -32.041 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -34.934 6.370 -30.710 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -33.318 5.717 -30.354 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -33.265 3.645 -32.403 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -32.764 3.478 -30.704 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -33.917 2.321 -31.409 1.00 0.00 H new ATOM 526 N MET A 35 -35.618 5.250 -27.662 1.00 0.00 N ATOM 527 CA MET A 35 -36.293 6.241 -26.830 1.00 0.00 C ATOM 528 C MET A 35 -35.499 7.528 -26.931 1.00 0.00 C ATOM 529 O MET A 35 -34.324 7.570 -26.567 1.00 0.00 O ATOM 530 CB MET A 35 -36.410 5.786 -25.368 1.00 0.00 C ATOM 531 CG MET A 35 -37.438 4.666 -25.161 1.00 0.00 C ATOM 532 SD MET A 35 -39.100 4.914 -25.859 1.00 0.00 S ATOM 533 CE MET A 35 -39.546 6.528 -25.165 1.00 0.00 C ATOM 0 H MET A 35 -34.763 4.877 -27.250 1.00 0.00 H new ATOM 0 HA MET A 35 -37.314 6.383 -27.184 1.00 0.00 H new ATOM 0 HB2 MET A 35 -35.435 5.443 -25.022 1.00 0.00 H new ATOM 0 HB3 MET A 35 -36.685 6.641 -24.750 1.00 0.00 H new ATOM 0 HG2 MET A 35 -37.028 3.750 -25.586 1.00 0.00 H new ATOM 0 HG3 MET A 35 -37.544 4.501 -24.089 1.00 0.00 H new ATOM 0 HE1 MET A 35 -40.549 6.801 -25.493 1.00 0.00 H new ATOM 0 HE2 MET A 35 -39.522 6.475 -24.077 1.00 0.00 H new ATOM 0 HE3 MET A 35 -38.835 7.280 -25.507 1.00 0.00 H new ATOM 543 N SER A 36 -36.144 8.570 -27.440 1.00 0.00 N ATOM 544 CA SER A 36 -35.501 9.856 -27.682 1.00 0.00 C ATOM 545 C SER A 36 -36.252 10.953 -26.949 1.00 0.00 C ATOM 546 O SER A 36 -37.474 10.940 -26.895 1.00 0.00 O ATOM 547 CB SER A 36 -35.316 10.156 -29.163 1.00 0.00 C ATOM 548 OG SER A 36 -34.652 9.077 -29.800 1.00 0.00 O ATOM 0 H SER A 36 -37.131 8.547 -27.697 1.00 0.00 H new ATOM 0 HA SER A 36 -34.489 9.809 -27.279 1.00 0.00 H new ATOM 0 HB2 SER A 36 -36.286 10.324 -29.632 1.00 0.00 H new ATOM 0 HB3 SER A 36 -34.739 11.072 -29.287 1.00 0.00 H new ATOM 0 HG SER A 36 -34.217 9.397 -30.618 1.00 0.00 H new ATOM 554 N VAL A 37 -35.536 11.847 -26.282 1.00 0.00 N ATOM 555 CA VAL A 37 -36.071 12.668 -25.189 1.00 0.00 C ATOM 556 C VAL A 37 -35.638 14.112 -25.375 1.00 0.00 C ATOM 557 O VAL A 37 -34.468 14.375 -25.663 1.00 0.00 O ATOM 558 CB VAL A 37 -35.661 12.179 -23.780 1.00 0.00 C ATOM 559 CG1 VAL A 37 -36.711 12.493 -22.714 1.00 0.00 C ATOM 560 CG2 VAL A 37 -35.289 10.712 -23.667 1.00 0.00 C ATOM 0 H VAL A 37 -34.553 12.030 -26.483 1.00 0.00 H new ATOM 0 HA VAL A 37 -37.156 12.579 -25.241 1.00 0.00 H new ATOM 0 HB VAL A 37 -34.751 12.752 -23.601 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -36.368 12.126 -21.746 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -36.864 13.571 -22.660 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -37.651 12.006 -22.974 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -35.020 10.483 -22.636 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -36.138 10.097 -23.965 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -34.441 10.500 -24.319 1.00 0.00 H new ATOM 570 N VAL A 38 -36.573 15.040 -25.179 1.00 0.00 N ATOM 571 CA VAL A 38 -36.282 16.476 -25.139 1.00 0.00 C ATOM 572 C VAL A 38 -36.335 16.864 -23.666 1.00 0.00 C ATOM 573 O VAL A 38 -37.375 16.747 -23.014 1.00 0.00 O ATOM 574 CB VAL A 38 -37.274 17.317 -25.964 1.00 0.00 C ATOM 575 CG1 VAL A 38 -36.929 18.810 -25.876 1.00 0.00 C ATOM 576 CG2 VAL A 38 -37.256 16.928 -27.447 1.00 0.00 C ATOM 0 H VAL A 38 -37.559 14.818 -25.043 1.00 0.00 H new ATOM 0 HA VAL A 38 -35.308 16.675 -25.587 1.00 0.00 H new ATOM 0 HB VAL A 38 -38.261 17.123 -25.545 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -37.643 19.384 -26.466 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -36.975 19.133 -24.836 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -35.923 18.974 -26.263 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -37.970 17.545 -27.994 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -36.256 17.084 -27.852 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -37.529 15.878 -27.551 1.00 0.00 H new ATOM 586 N VAL A 39 -35.163 17.228 -23.141 1.00 0.00 N ATOM 587 CA VAL A 39 -34.831 17.338 -21.710 1.00 0.00 C ATOM 588 C VAL A 39 -34.007 18.614 -21.513 1.00 0.00 C ATOM 589 O VAL A 39 -33.105 18.873 -22.309 1.00 0.00 O ATOM 590 CB VAL A 39 -34.006 16.110 -21.234 1.00 0.00 C ATOM 591 CG1 VAL A 39 -33.798 16.146 -19.716 1.00 0.00 C ATOM 592 CG2 VAL A 39 -34.633 14.768 -21.585 1.00 0.00 C ATOM 0 H VAL A 39 -34.370 17.469 -23.735 1.00 0.00 H new ATOM 0 HA VAL A 39 -35.750 17.373 -21.125 1.00 0.00 H new ATOM 0 HB VAL A 39 -33.058 16.190 -21.767 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -33.218 15.276 -19.407 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -33.262 17.055 -19.444 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -34.766 16.132 -19.216 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -33.997 13.962 -21.219 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -35.616 14.693 -21.121 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -34.735 14.686 -22.667 1.00 0.00 H new ATOM 602 N ASP A 40 -34.299 19.400 -20.468 1.00 0.00 N ATOM 603 CA ASP A 40 -33.752 20.748 -20.179 1.00 0.00 C ATOM 604 C ASP A 40 -34.037 21.798 -21.282 1.00 0.00 C ATOM 605 O ASP A 40 -34.797 22.748 -21.081 1.00 0.00 O ATOM 606 CB ASP A 40 -32.253 20.639 -19.825 1.00 0.00 C ATOM 607 CG ASP A 40 -31.532 21.994 -19.879 1.00 0.00 C ATOM 608 OD1 ASP A 40 -31.918 22.916 -19.123 1.00 0.00 O ATOM 609 OD2 ASP A 40 -30.596 22.128 -20.703 1.00 0.00 O ATOM 0 H ASP A 40 -34.963 19.101 -19.754 1.00 0.00 H new ATOM 0 HA ASP A 40 -34.287 21.134 -19.312 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -32.150 20.216 -18.826 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -31.770 19.947 -20.515 1.00 0.00 H new ATOM 614 N GLY A 41 -33.458 21.586 -22.458 1.00 0.00 N ATOM 615 CA GLY A 41 -33.627 22.347 -23.701 1.00 0.00 C ATOM 616 C GLY A 41 -32.874 21.705 -24.877 1.00 0.00 C ATOM 617 O GLY A 41 -32.526 22.390 -25.841 1.00 0.00 O ATOM 0 H GLY A 41 -32.803 20.814 -22.582 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -34.688 22.414 -23.943 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -33.268 23.366 -23.554 1.00 0.00 H new ATOM 621 N GLN A 42 -32.556 20.409 -24.763 1.00 0.00 N ATOM 622 CA GLN A 42 -31.644 19.642 -25.614 1.00 0.00 C ATOM 623 C GLN A 42 -32.283 18.286 -25.966 1.00 0.00 C ATOM 624 O GLN A 42 -33.262 17.878 -25.336 1.00 0.00 O ATOM 625 CB GLN A 42 -30.266 19.461 -24.927 1.00 0.00 C ATOM 626 CG GLN A 42 -30.039 20.265 -23.626 1.00 0.00 C ATOM 627 CD GLN A 42 -28.630 20.155 -23.049 1.00 0.00 C ATOM 628 OE1 GLN A 42 -27.706 19.605 -23.634 1.00 0.00 O ATOM 629 NE2 GLN A 42 -28.414 20.691 -21.868 1.00 0.00 N ATOM 0 H GLN A 42 -32.957 19.832 -24.024 1.00 0.00 H new ATOM 0 HA GLN A 42 -31.471 20.192 -26.539 1.00 0.00 H new ATOM 0 HB2 GLN A 42 -30.132 18.403 -24.703 1.00 0.00 H new ATOM 0 HB3 GLN A 42 -29.489 19.737 -25.640 1.00 0.00 H new ATOM 0 HG2 GLN A 42 -30.257 21.315 -23.821 1.00 0.00 H new ATOM 0 HG3 GLN A 42 -30.753 19.925 -22.875 1.00 0.00 H new ATOM 0 HE21 GLN A 42 -29.176 21.152 -21.370 1.00 0.00 H new ATOM 0 HE22 GLN A 42 -27.485 20.646 -21.450 1.00 0.00 H new ATOM 638 N PHE A 43 -31.725 17.567 -26.942 1.00 0.00 N ATOM 639 CA PHE A 43 -32.276 16.303 -27.449 1.00 0.00 C ATOM 640 C PHE A 43 -31.272 15.149 -27.314 1.00 0.00 C ATOM 641 O PHE A 43 -30.077 15.304 -27.586 1.00 0.00 O ATOM 642 CB PHE A 43 -32.731 16.510 -28.901 1.00 0.00 C ATOM 643 CG PHE A 43 -33.336 15.293 -29.584 1.00 0.00 C ATOM 644 CD1 PHE A 43 -34.569 14.768 -29.147 1.00 0.00 C ATOM 645 CD2 PHE A 43 -32.689 14.712 -30.692 1.00 0.00 C ATOM 646 CE1 PHE A 43 -35.165 13.692 -29.831 1.00 0.00 C ATOM 647 CE2 PHE A 43 -33.281 13.632 -31.372 1.00 0.00 C ATOM 648 CZ PHE A 43 -34.522 13.128 -30.947 1.00 0.00 C ATOM 0 H PHE A 43 -30.864 17.849 -27.411 1.00 0.00 H new ATOM 0 HA PHE A 43 -33.138 16.016 -26.846 1.00 0.00 H new ATOM 0 HB2 PHE A 43 -33.464 17.316 -28.921 1.00 0.00 H new ATOM 0 HB3 PHE A 43 -31.874 16.844 -29.487 1.00 0.00 H new ATOM 0 HD1 PHE A 43 -35.059 15.193 -28.283 1.00 0.00 H new ATOM 0 HD2 PHE A 43 -31.735 15.097 -31.021 1.00 0.00 H new ATOM 0 HE1 PHE A 43 -36.115 13.300 -29.499 1.00 0.00 H new ATOM 0 HE2 PHE A 43 -32.781 13.190 -32.221 1.00 0.00 H new ATOM 0 HZ PHE A 43 -34.982 12.307 -31.478 1.00 0.00 H new ATOM 658 N PHE A 44 -31.780 13.986 -26.906 1.00 0.00 N ATOM 659 CA PHE A 44 -31.016 12.777 -26.577 1.00 0.00 C ATOM 660 C PHE A 44 -31.688 11.555 -27.219 1.00 0.00 C ATOM 661 O PHE A 44 -32.911 11.528 -27.321 1.00 0.00 O ATOM 662 CB PHE A 44 -30.975 12.619 -25.045 1.00 0.00 C ATOM 663 CG PHE A 44 -30.391 13.810 -24.304 1.00 0.00 C ATOM 664 CD1 PHE A 44 -29.004 13.886 -24.075 1.00 0.00 C ATOM 665 CD2 PHE A 44 -31.225 14.867 -23.883 1.00 0.00 C ATOM 666 CE1 PHE A 44 -28.455 15.012 -23.441 1.00 0.00 C ATOM 667 CE2 PHE A 44 -30.671 15.997 -23.255 1.00 0.00 C ATOM 668 CZ PHE A 44 -29.287 16.068 -23.029 1.00 0.00 C ATOM 0 H PHE A 44 -32.784 13.852 -26.789 1.00 0.00 H new ATOM 0 HA PHE A 44 -29.999 12.858 -26.961 1.00 0.00 H new ATOM 0 HB2 PHE A 44 -31.988 12.443 -24.683 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -30.391 11.732 -24.799 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -28.361 13.077 -24.388 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -32.291 14.808 -24.043 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -27.390 15.067 -23.269 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -31.311 16.811 -22.946 1.00 0.00 H new ATOM 0 HZ PHE A 44 -28.862 16.932 -22.540 1.00 0.00 H new ATOM 678 N GLU A 45 -30.924 10.532 -27.609 1.00 0.00 N ATOM 679 CA GLU A 45 -31.435 9.289 -28.223 1.00 0.00 C ATOM 680 C GLU A 45 -30.774 8.071 -27.568 1.00 0.00 C ATOM 681 O GLU A 45 -29.551 8.019 -27.409 1.00 0.00 O ATOM 682 CB GLU A 45 -31.212 9.266 -29.747 1.00 0.00 C ATOM 683 CG GLU A 45 -31.747 10.512 -30.476 1.00 0.00 C ATOM 684 CD GLU A 45 -32.171 10.186 -31.921 1.00 0.00 C ATOM 685 OE1 GLU A 45 -31.310 10.239 -32.836 1.00 0.00 O ATOM 686 OE2 GLU A 45 -33.371 9.885 -32.147 1.00 0.00 O ATOM 0 H GLU A 45 -29.909 10.538 -27.507 1.00 0.00 H new ATOM 0 HA GLU A 45 -32.511 9.252 -28.052 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -30.145 9.171 -29.946 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -31.694 8.380 -30.161 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -32.599 10.917 -29.929 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -30.979 11.285 -30.487 1.00 0.00 H new ATOM 693 N GLY A 46 -31.592 7.093 -27.182 1.00 0.00 N ATOM 694 CA GLY A 46 -31.187 5.907 -26.429 1.00 0.00 C ATOM 695 C GLY A 46 -31.691 4.632 -27.089 1.00 0.00 C ATOM 696 O GLY A 46 -32.897 4.393 -27.139 1.00 0.00 O ATOM 0 H GLY A 46 -32.590 7.105 -27.392 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -30.100 5.875 -26.355 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -31.574 5.970 -25.412 1.00 0.00 H new ATOM 700 N SER A 47 -30.773 3.809 -27.596 1.00 0.00 N ATOM 701 CA SER A 47 -31.086 2.619 -28.393 1.00 0.00 C ATOM 702 C SER A 47 -30.893 1.342 -27.577 1.00 0.00 C ATOM 703 O SER A 47 -29.769 0.933 -27.271 1.00 0.00 O ATOM 704 CB SER A 47 -30.215 2.600 -29.653 1.00 0.00 C ATOM 705 OG SER A 47 -28.836 2.774 -29.376 1.00 0.00 O ATOM 0 H SER A 47 -29.772 3.952 -27.463 1.00 0.00 H new ATOM 0 HA SER A 47 -32.135 2.661 -28.688 1.00 0.00 H new ATOM 0 HB2 SER A 47 -30.359 1.653 -30.173 1.00 0.00 H new ATOM 0 HB3 SER A 47 -30.546 3.388 -30.329 1.00 0.00 H new ATOM 0 HG SER A 47 -28.592 2.249 -28.585 1.00 0.00 H new ATOM 711 N GLY A 48 -32.017 0.759 -27.165 1.00 0.00 N ATOM 712 CA GLY A 48 -32.070 -0.426 -26.310 1.00 0.00 C ATOM 713 C GLY A 48 -33.078 -1.491 -26.729 1.00 0.00 C ATOM 714 O GLY A 48 -34.198 -1.157 -27.109 1.00 0.00 O ATOM 0 H GLY A 48 -32.941 1.107 -27.423 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -31.079 -0.879 -26.284 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -32.303 -0.109 -25.293 1.00 0.00 H new ATOM 718 N ARG A 49 -32.698 -2.772 -26.665 1.00 0.00 N ATOM 719 CA ARG A 49 -33.555 -3.940 -26.969 1.00 0.00 C ATOM 720 C ARG A 49 -35.035 -3.799 -26.558 1.00 0.00 C ATOM 721 O ARG A 49 -35.904 -4.089 -27.377 1.00 0.00 O ATOM 722 CB ARG A 49 -32.916 -5.215 -26.385 1.00 0.00 C ATOM 723 CG ARG A 49 -31.676 -5.675 -27.174 1.00 0.00 C ATOM 724 CD ARG A 49 -32.067 -6.500 -28.408 1.00 0.00 C ATOM 725 NE ARG A 49 -30.904 -6.733 -29.283 1.00 0.00 N ATOM 726 CZ ARG A 49 -30.757 -7.686 -30.182 1.00 0.00 C ATOM 727 NH1 ARG A 49 -31.645 -8.621 -30.373 1.00 0.00 N ATOM 728 NH2 ARG A 49 -29.701 -7.713 -30.936 1.00 0.00 N ATOM 0 H ARG A 49 -31.753 -3.041 -26.391 1.00 0.00 H new ATOM 0 HA ARG A 49 -33.599 -4.008 -28.056 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -32.634 -5.033 -25.348 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -33.655 -6.016 -26.378 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -31.098 -4.805 -27.485 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -31.032 -6.270 -26.527 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -32.485 -7.456 -28.092 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -32.846 -5.979 -28.965 1.00 0.00 H new ATOM 0 HE ARG A 49 -30.124 -6.083 -29.181 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -32.498 -8.636 -29.814 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -31.487 -9.338 -31.081 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -28.983 -6.996 -30.834 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -29.589 -8.451 -31.631 1.00 0.00 H new ATOM 742 N ASN A 50 -35.328 -3.290 -25.351 1.00 0.00 N ATOM 743 CA ASN A 50 -36.630 -2.677 -24.997 1.00 0.00 C ATOM 744 C ASN A 50 -36.434 -1.416 -24.110 1.00 0.00 C ATOM 745 O ASN A 50 -35.302 -1.103 -23.741 1.00 0.00 O ATOM 746 CB ASN A 50 -37.633 -3.674 -24.346 1.00 0.00 C ATOM 747 CG ASN A 50 -37.391 -5.174 -24.486 1.00 0.00 C ATOM 748 OD1 ASN A 50 -37.193 -5.876 -23.505 1.00 0.00 O ATOM 749 ND2 ASN A 50 -37.428 -5.730 -25.671 1.00 0.00 N ATOM 0 H ASN A 50 -34.662 -3.290 -24.579 1.00 0.00 H new ATOM 0 HA ASN A 50 -37.083 -2.372 -25.940 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -37.676 -3.447 -23.281 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -38.620 -3.461 -24.757 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -37.293 -6.736 -25.767 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -37.592 -5.157 -26.498 1.00 0.00 H new ATOM 756 N LYS A 51 -37.512 -0.717 -23.704 1.00 0.00 N ATOM 757 CA LYS A 51 -37.511 0.490 -22.821 1.00 0.00 C ATOM 758 C LYS A 51 -36.657 0.389 -21.553 1.00 0.00 C ATOM 759 O LYS A 51 -36.002 1.374 -21.221 1.00 0.00 O ATOM 760 CB LYS A 51 -38.952 0.904 -22.477 1.00 0.00 C ATOM 761 CG LYS A 51 -39.595 1.643 -23.664 1.00 0.00 C ATOM 762 CD LYS A 51 -41.093 1.898 -23.435 1.00 0.00 C ATOM 763 CE LYS A 51 -41.724 2.757 -24.542 1.00 0.00 C ATOM 764 NZ LYS A 51 -41.697 2.084 -25.868 1.00 0.00 N ATOM 0 H LYS A 51 -38.455 -0.981 -23.990 1.00 0.00 H new ATOM 0 HA LYS A 51 -37.023 1.265 -23.412 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -39.541 0.021 -22.227 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -38.952 1.547 -21.597 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -39.084 2.593 -23.820 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -39.461 1.056 -24.573 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -41.616 0.943 -23.379 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -41.230 2.393 -22.474 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -42.756 2.987 -24.276 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -41.192 3.706 -24.609 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -41.228 2.702 -26.561 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -41.173 1.189 -25.792 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -42.670 1.891 -26.179 1.00 0.00 H new ATOM 778 N LYS A 52 -36.554 -0.781 -20.910 1.00 0.00 N ATOM 779 CA LYS A 52 -35.634 -1.026 -19.769 1.00 0.00 C ATOM 780 C LYS A 52 -34.146 -0.756 -20.057 1.00 0.00 C ATOM 781 O LYS A 52 -33.351 -0.632 -19.128 1.00 0.00 O ATOM 782 CB LYS A 52 -35.859 -2.436 -19.175 1.00 0.00 C ATOM 783 CG LYS A 52 -35.084 -3.603 -19.825 1.00 0.00 C ATOM 784 CD LYS A 52 -35.395 -3.823 -21.313 1.00 0.00 C ATOM 785 CE LYS A 52 -34.579 -4.970 -21.925 1.00 0.00 C ATOM 786 NZ LYS A 52 -35.140 -6.302 -21.582 1.00 0.00 N ATOM 0 H LYS A 52 -37.109 -1.599 -21.163 1.00 0.00 H new ATOM 0 HA LYS A 52 -35.898 -0.278 -19.022 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -35.598 -2.404 -18.117 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -36.924 -2.662 -19.234 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -34.015 -3.420 -19.713 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -35.309 -4.520 -19.280 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -36.458 -4.036 -21.430 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -35.191 -2.904 -21.862 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -34.552 -4.857 -23.009 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -33.549 -4.910 -21.573 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -34.437 -7.039 -21.791 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -35.379 -6.328 -20.570 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -35.998 -6.473 -22.145 1.00 0.00 H new ATOM 800 N LEU A 53 -33.789 -0.646 -21.339 1.00 0.00 N ATOM 801 CA LEU A 53 -32.449 -0.404 -21.866 1.00 0.00 C ATOM 802 C LEU A 53 -32.435 0.846 -22.768 1.00 0.00 C ATOM 803 O LEU A 53 -31.514 1.650 -22.682 1.00 0.00 O ATOM 804 CB LEU A 53 -32.004 -1.699 -22.580 1.00 0.00 C ATOM 805 CG LEU A 53 -30.607 -1.685 -23.231 1.00 0.00 C ATOM 806 CD1 LEU A 53 -29.508 -1.228 -22.272 1.00 0.00 C ATOM 807 CD2 LEU A 53 -30.259 -3.088 -23.725 1.00 0.00 C ATOM 0 H LEU A 53 -34.479 -0.730 -22.086 1.00 0.00 H new ATOM 0 HA LEU A 53 -31.734 -0.181 -21.074 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -32.034 -2.514 -21.857 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -32.737 -1.931 -23.353 1.00 0.00 H new ATOM 0 HG LEU A 53 -30.653 -0.972 -24.055 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -28.548 -1.239 -22.787 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -29.723 -0.217 -21.927 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -29.468 -1.902 -21.416 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -29.271 -3.077 -24.185 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -30.260 -3.781 -22.883 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -30.998 -3.409 -24.459 1.00 0.00 H new ATOM 819 N ALA A 54 -33.448 1.038 -23.622 1.00 0.00 N ATOM 820 CA ALA A 54 -33.652 2.247 -24.425 1.00 0.00 C ATOM 821 C ALA A 54 -33.715 3.525 -23.576 1.00 0.00 C ATOM 822 O ALA A 54 -32.893 4.435 -23.733 1.00 0.00 O ATOM 823 CB ALA A 54 -34.888 2.047 -25.306 1.00 0.00 C ATOM 0 H ALA A 54 -34.170 0.334 -23.777 1.00 0.00 H new ATOM 0 HA ALA A 54 -32.785 2.398 -25.068 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -35.053 2.939 -25.910 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -34.733 1.189 -25.961 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -35.759 1.870 -24.676 1.00 0.00 H new ATOM 829 N LYS A 55 -34.671 3.564 -22.630 1.00 0.00 N ATOM 830 CA LYS A 55 -34.729 4.597 -21.592 1.00 0.00 C ATOM 831 C LYS A 55 -33.414 4.646 -20.828 1.00 0.00 C ATOM 832 O LYS A 55 -32.914 5.736 -20.669 1.00 0.00 O ATOM 833 CB LYS A 55 -35.950 4.436 -20.660 1.00 0.00 C ATOM 834 CG LYS A 55 -36.278 5.761 -19.962 1.00 0.00 C ATOM 835 CD LYS A 55 -37.768 6.113 -19.884 1.00 0.00 C ATOM 836 CE LYS A 55 -38.444 6.189 -21.257 1.00 0.00 C ATOM 837 NZ LYS A 55 -39.804 6.784 -21.129 1.00 0.00 N ATOM 0 H LYS A 55 -35.423 2.878 -22.568 1.00 0.00 H new ATOM 0 HA LYS A 55 -34.869 5.559 -22.084 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -36.812 4.100 -21.236 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -35.746 3.667 -19.915 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -35.877 5.727 -18.949 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -35.759 6.565 -20.484 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -38.279 5.367 -19.275 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -37.882 7.071 -19.377 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -37.839 6.790 -21.936 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -38.515 5.192 -21.691 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -40.446 6.334 -21.813 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -40.162 6.629 -20.165 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -39.756 7.805 -21.320 1.00 0.00 H new ATOM 851 N ALA A 56 -32.817 3.533 -20.389 1.00 0.00 N ATOM 852 CA ALA A 56 -31.553 3.538 -19.658 1.00 0.00 C ATOM 853 C ALA A 56 -30.427 4.258 -20.406 1.00 0.00 C ATOM 854 O ALA A 56 -29.762 5.101 -19.813 1.00 0.00 O ATOM 855 CB ALA A 56 -31.159 2.103 -19.283 1.00 0.00 C ATOM 0 H ALA A 56 -33.202 2.600 -20.534 1.00 0.00 H new ATOM 0 HA ALA A 56 -31.708 4.112 -18.745 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -30.215 2.115 -18.738 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -31.935 1.665 -18.655 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -31.047 1.508 -20.189 1.00 0.00 H new ATOM 861 N ARG A 57 -30.226 3.972 -21.698 1.00 0.00 N ATOM 862 CA ARG A 57 -29.328 4.737 -22.573 1.00 0.00 C ATOM 863 C ARG A 57 -29.647 6.229 -22.619 1.00 0.00 C ATOM 864 O ARG A 57 -28.775 7.046 -22.317 1.00 0.00 O ATOM 865 CB ARG A 57 -29.279 4.119 -23.987 1.00 0.00 C ATOM 866 CG ARG A 57 -28.407 2.859 -24.139 1.00 0.00 C ATOM 867 CD ARG A 57 -27.050 2.915 -23.418 1.00 0.00 C ATOM 868 NE ARG A 57 -26.356 4.218 -23.577 1.00 0.00 N ATOM 869 CZ ARG A 57 -25.572 4.787 -22.678 1.00 0.00 C ATOM 870 NH1 ARG A 57 -25.087 4.129 -21.667 1.00 0.00 N ATOM 871 NH2 ARG A 57 -25.262 6.048 -22.736 1.00 0.00 N ATOM 0 H ARG A 57 -30.687 3.195 -22.171 1.00 0.00 H new ATOM 0 HA ARG A 57 -28.334 4.666 -22.132 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -30.296 3.872 -24.290 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -28.914 4.876 -24.681 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -28.966 2.002 -23.763 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -28.230 2.684 -25.200 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -27.202 2.719 -22.357 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -26.409 2.121 -23.801 1.00 0.00 H new ATOM 0 HE ARG A 57 -26.496 4.717 -24.456 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -25.309 3.140 -21.548 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -24.485 4.601 -20.993 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -25.627 6.629 -23.491 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -24.654 6.457 -22.026 1.00 0.00 H new ATOM 885 N ALA A 58 -30.875 6.583 -23.002 1.00 0.00 N ATOM 886 CA ALA A 58 -31.331 7.974 -23.071 1.00 0.00 C ATOM 887 C ALA A 58 -31.152 8.721 -21.738 1.00 0.00 C ATOM 888 O ALA A 58 -30.493 9.756 -21.678 1.00 0.00 O ATOM 889 CB ALA A 58 -32.790 7.978 -23.522 1.00 0.00 C ATOM 0 H ALA A 58 -31.588 5.907 -23.276 1.00 0.00 H new ATOM 0 HA ALA A 58 -30.715 8.512 -23.792 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -33.150 9.005 -23.580 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -32.869 7.510 -24.503 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -33.394 7.422 -22.805 1.00 0.00 H new ATOM 895 N ALA A 59 -31.701 8.139 -20.673 1.00 0.00 N ATOM 896 CA ALA A 59 -31.570 8.533 -19.280 1.00 0.00 C ATOM 897 C ALA A 59 -30.116 8.739 -18.867 1.00 0.00 C ATOM 898 O ALA A 59 -29.790 9.837 -18.455 1.00 0.00 O ATOM 899 CB ALA A 59 -32.233 7.477 -18.383 1.00 0.00 C ATOM 0 H ALA A 59 -32.294 7.316 -20.775 1.00 0.00 H new ATOM 0 HA ALA A 59 -32.073 9.493 -19.159 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -32.134 7.773 -17.339 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -33.289 7.394 -18.638 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -31.746 6.514 -18.535 1.00 0.00 H new ATOM 905 N GLN A 60 -29.244 7.734 -18.971 1.00 0.00 N ATOM 906 CA GLN A 60 -27.828 7.836 -18.595 1.00 0.00 C ATOM 907 C GLN A 60 -27.130 8.996 -19.321 1.00 0.00 C ATOM 908 O GLN A 60 -26.464 9.811 -18.678 1.00 0.00 O ATOM 909 CB GLN A 60 -27.147 6.474 -18.831 1.00 0.00 C ATOM 910 CG GLN A 60 -25.741 6.332 -18.228 1.00 0.00 C ATOM 911 CD GLN A 60 -24.617 6.878 -19.115 1.00 0.00 C ATOM 912 OE1 GLN A 60 -24.131 6.210 -20.019 1.00 0.00 O ATOM 913 NE2 GLN A 60 -24.162 8.095 -18.926 1.00 0.00 N ATOM 0 H GLN A 60 -29.503 6.813 -19.323 1.00 0.00 H new ATOM 0 HA GLN A 60 -27.746 8.074 -17.535 1.00 0.00 H new ATOM 0 HB2 GLN A 60 -27.783 5.691 -18.417 1.00 0.00 H new ATOM 0 HB3 GLN A 60 -27.084 6.299 -19.905 1.00 0.00 H new ATOM 0 HG2 GLN A 60 -25.715 6.850 -17.269 1.00 0.00 H new ATOM 0 HG3 GLN A 60 -25.550 5.278 -18.026 1.00 0.00 H new ATOM 0 HE21 GLN A 60 -24.548 8.674 -18.180 1.00 0.00 H new ATOM 0 HE22 GLN A 60 -23.422 8.462 -19.525 1.00 0.00 H new ATOM 922 N SER A 61 -27.294 9.078 -20.645 1.00 0.00 N ATOM 923 CA SER A 61 -26.770 10.177 -21.474 1.00 0.00 C ATOM 924 C SER A 61 -27.241 11.557 -20.989 1.00 0.00 C ATOM 925 O SER A 61 -26.426 12.435 -20.680 1.00 0.00 O ATOM 926 CB SER A 61 -27.134 9.973 -22.954 1.00 0.00 C ATOM 927 OG SER A 61 -26.779 8.671 -23.398 1.00 0.00 O ATOM 0 H SER A 61 -27.801 8.375 -21.182 1.00 0.00 H new ATOM 0 HA SER A 61 -25.685 10.154 -21.373 1.00 0.00 H new ATOM 0 HB2 SER A 61 -28.204 10.128 -23.092 1.00 0.00 H new ATOM 0 HB3 SER A 61 -26.623 10.719 -23.563 1.00 0.00 H new ATOM 0 HG SER A 61 -27.431 8.021 -23.061 1.00 0.00 H new ATOM 933 N ALA A 62 -28.563 11.724 -20.878 1.00 0.00 N ATOM 934 CA ALA A 62 -29.208 12.918 -20.348 1.00 0.00 C ATOM 935 C ALA A 62 -28.700 13.265 -18.942 1.00 0.00 C ATOM 936 O ALA A 62 -28.169 14.355 -18.776 1.00 0.00 O ATOM 937 CB ALA A 62 -30.728 12.730 -20.405 1.00 0.00 C ATOM 0 H ALA A 62 -29.229 11.007 -21.165 1.00 0.00 H new ATOM 0 HA ALA A 62 -28.946 13.777 -20.966 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -31.220 13.619 -20.010 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -31.037 12.573 -21.439 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -31.010 11.864 -19.807 1.00 0.00 H new ATOM 943 N LEU A 63 -28.782 12.338 -17.978 1.00 0.00 N ATOM 944 CA LEU A 63 -28.270 12.430 -16.601 1.00 0.00 C ATOM 945 C LEU A 63 -26.868 13.038 -16.586 1.00 0.00 C ATOM 946 O LEU A 63 -26.673 14.087 -15.981 1.00 0.00 O ATOM 947 CB LEU A 63 -28.237 11.033 -15.930 1.00 0.00 C ATOM 948 CG LEU A 63 -29.438 10.604 -15.062 1.00 0.00 C ATOM 949 CD1 LEU A 63 -30.776 11.238 -15.419 1.00 0.00 C ATOM 950 CD2 LEU A 63 -29.600 9.083 -15.090 1.00 0.00 C ATOM 0 H LEU A 63 -29.239 11.442 -18.150 1.00 0.00 H new ATOM 0 HA LEU A 63 -28.944 13.076 -16.039 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -28.115 10.290 -16.718 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -27.344 10.986 -15.307 1.00 0.00 H new ATOM 0 HG LEU A 63 -29.187 10.970 -14.067 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -31.547 10.865 -14.745 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -30.703 12.321 -15.322 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -31.037 10.983 -16.446 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -30.451 8.796 -14.473 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -29.768 8.754 -16.115 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -28.696 8.614 -14.702 1.00 0.00 H new ATOM 962 N ALA A 64 -25.915 12.424 -17.294 1.00 0.00 N ATOM 963 CA ALA A 64 -24.548 12.927 -17.384 1.00 0.00 C ATOM 964 C ALA A 64 -24.511 14.388 -17.875 1.00 0.00 C ATOM 965 O ALA A 64 -23.966 15.251 -17.179 1.00 0.00 O ATOM 966 CB ALA A 64 -23.730 11.982 -18.273 1.00 0.00 C ATOM 0 H ALA A 64 -26.073 11.564 -17.820 1.00 0.00 H new ATOM 0 HA ALA A 64 -24.098 12.943 -16.391 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -22.706 12.348 -18.348 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -23.727 10.983 -17.837 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -24.174 11.942 -19.267 1.00 0.00 H new ATOM 972 N THR A 65 -25.134 14.682 -19.024 1.00 0.00 N ATOM 973 CA THR A 65 -25.256 16.057 -19.545 1.00 0.00 C ATOM 974 C THR A 65 -25.898 17.034 -18.552 1.00 0.00 C ATOM 975 O THR A 65 -25.229 17.957 -18.082 1.00 0.00 O ATOM 976 CB THR A 65 -25.985 16.072 -20.901 1.00 0.00 C ATOM 977 OG1 THR A 65 -25.228 15.350 -21.853 1.00 0.00 O ATOM 978 CG2 THR A 65 -26.195 17.479 -21.471 1.00 0.00 C ATOM 0 H THR A 65 -25.568 13.977 -19.620 1.00 0.00 H new ATOM 0 HA THR A 65 -24.238 16.416 -19.696 1.00 0.00 H new ATOM 0 HB THR A 65 -26.962 15.626 -20.717 1.00 0.00 H new ATOM 0 HG1 THR A 65 -25.389 14.390 -21.739 1.00 0.00 H new ATOM 0 HG21 THR A 65 -26.714 17.411 -22.427 1.00 0.00 H new ATOM 0 HG22 THR A 65 -26.792 18.068 -20.775 1.00 0.00 H new ATOM 0 HG23 THR A 65 -25.228 17.960 -21.617 1.00 0.00 H new ATOM 986 N VAL A 66 -27.195 16.885 -18.256 1.00 0.00 N ATOM 987 CA VAL A 66 -27.938 17.799 -17.379 1.00 0.00 C ATOM 988 C VAL A 66 -27.318 17.974 -15.994 1.00 0.00 C ATOM 989 O VAL A 66 -27.184 19.105 -15.531 1.00 0.00 O ATOM 990 CB VAL A 66 -29.462 17.559 -17.331 1.00 0.00 C ATOM 991 CG1 VAL A 66 -30.065 17.638 -18.737 1.00 0.00 C ATOM 992 CG2 VAL A 66 -29.929 16.249 -16.691 1.00 0.00 C ATOM 0 H VAL A 66 -27.763 16.121 -18.621 1.00 0.00 H new ATOM 0 HA VAL A 66 -27.828 18.764 -17.874 1.00 0.00 H new ATOM 0 HB VAL A 66 -29.817 18.357 -16.678 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -31.140 17.466 -18.682 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -29.876 18.625 -19.159 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -29.608 16.879 -19.372 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -31.018 16.199 -16.718 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -29.513 15.406 -17.243 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -29.589 16.208 -15.656 1.00 0.00 H new ATOM 1002 N PHE A 67 -26.915 16.897 -15.315 1.00 0.00 N ATOM 1003 CA PHE A 67 -26.161 16.979 -14.061 1.00 0.00 C ATOM 1004 C PHE A 67 -24.836 17.754 -14.153 1.00 0.00 C ATOM 1005 O PHE A 67 -24.565 18.556 -13.262 1.00 0.00 O ATOM 1006 CB PHE A 67 -25.975 15.609 -13.405 1.00 0.00 C ATOM 1007 CG PHE A 67 -27.229 14.784 -13.089 1.00 0.00 C ATOM 1008 CD1 PHE A 67 -28.528 15.309 -13.243 1.00 0.00 C ATOM 1009 CD2 PHE A 67 -27.093 13.452 -12.643 1.00 0.00 C ATOM 1010 CE1 PHE A 67 -29.660 14.512 -13.027 1.00 0.00 C ATOM 1011 CE2 PHE A 67 -28.232 12.665 -12.374 1.00 0.00 C ATOM 1012 CZ PHE A 67 -29.523 13.187 -12.588 1.00 0.00 C ATOM 0 H PHE A 67 -27.103 15.942 -15.620 1.00 0.00 H new ATOM 0 HA PHE A 67 -26.791 17.581 -13.406 1.00 0.00 H new ATOM 0 HB2 PHE A 67 -25.338 15.011 -14.056 1.00 0.00 H new ATOM 0 HB3 PHE A 67 -25.429 15.757 -12.473 1.00 0.00 H new ATOM 0 HD1 PHE A 67 -28.653 16.342 -13.532 1.00 0.00 H new ATOM 0 HD2 PHE A 67 -26.108 13.031 -12.506 1.00 0.00 H new ATOM 0 HE1 PHE A 67 -30.645 14.921 -13.200 1.00 0.00 H new ATOM 0 HE2 PHE A 67 -28.114 11.658 -12.002 1.00 0.00 H new ATOM 0 HZ PHE A 67 -30.396 12.575 -12.416 1.00 0.00 H new ATOM 1022 N ASN A 68 -23.981 17.520 -15.161 1.00 0.00 N ATOM 1023 CA ASN A 68 -22.805 18.373 -15.438 1.00 0.00 C ATOM 1024 C ASN A 68 -23.155 19.861 -15.643 1.00 0.00 C ATOM 1025 O ASN A 68 -22.395 20.739 -15.235 1.00 0.00 O ATOM 1026 CB ASN A 68 -21.998 17.777 -16.612 1.00 0.00 C ATOM 1027 CG ASN A 68 -20.526 18.175 -16.676 1.00 0.00 C ATOM 1028 OD1 ASN A 68 -19.667 17.366 -17.004 1.00 0.00 O ATOM 1029 ND2 ASN A 68 -20.150 19.400 -16.380 1.00 0.00 N ATOM 0 H ASN A 68 -24.081 16.738 -15.808 1.00 0.00 H new ATOM 0 HA ASN A 68 -22.175 18.370 -14.548 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -22.059 16.690 -16.555 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -22.476 18.075 -17.545 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -19.164 19.656 -16.427 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -20.845 20.094 -16.104 1.00 0.00 H new ATOM 1036 N LEU A 69 -24.292 20.147 -16.281 1.00 0.00 N ATOM 1037 CA LEU A 69 -24.893 21.486 -16.368 1.00 0.00 C ATOM 1038 C LEU A 69 -25.296 22.018 -14.971 1.00 0.00 C ATOM 1039 O LEU A 69 -25.038 23.181 -14.660 1.00 0.00 O ATOM 1040 CB LEU A 69 -26.049 21.402 -17.399 1.00 0.00 C ATOM 1041 CG LEU A 69 -27.390 22.077 -17.056 1.00 0.00 C ATOM 1042 CD1 LEU A 69 -27.307 23.607 -17.108 1.00 0.00 C ATOM 1043 CD2 LEU A 69 -28.439 21.702 -18.106 1.00 0.00 C ATOM 0 H LEU A 69 -24.838 19.435 -16.766 1.00 0.00 H new ATOM 0 HA LEU A 69 -24.179 22.229 -16.723 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -25.691 21.832 -18.334 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -26.248 20.347 -17.589 1.00 0.00 H new ATOM 0 HG LEU A 69 -27.646 21.741 -16.051 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -28.279 24.033 -16.858 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -26.563 23.956 -16.392 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -27.020 23.922 -18.111 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -29.387 22.181 -17.861 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -28.107 22.037 -19.088 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -28.572 20.620 -18.118 1.00 0.00 H new ATOM 1055 N HIS A 70 -25.894 21.141 -14.154 1.00 0.00 N ATOM 1056 CA HIS A 70 -26.314 21.251 -12.745 1.00 0.00 C ATOM 1057 C HIS A 70 -27.842 21.441 -12.587 1.00 0.00 C ATOM 1058 O HIS A 70 -28.296 22.202 -11.727 1.00 0.00 O ATOM 1059 CB HIS A 70 -25.447 22.215 -11.903 1.00 0.00 C ATOM 1060 CG HIS A 70 -23.959 21.925 -11.950 1.00 0.00 C ATOM 1061 ND1 HIS A 70 -23.357 20.687 -11.926 1.00 0.00 N ATOM 1062 CD2 HIS A 70 -22.951 22.843 -12.063 1.00 0.00 C ATOM 1063 CE1 HIS A 70 -22.028 20.853 -12.024 1.00 0.00 C ATOM 1064 NE2 HIS A 70 -21.724 22.161 -12.093 1.00 0.00 N ATOM 0 H HIS A 70 -26.126 20.214 -14.511 1.00 0.00 H new ATOM 0 HA HIS A 70 -26.109 20.278 -12.298 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -25.617 23.234 -12.250 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -25.780 22.172 -10.866 1.00 0.00 H new ATOM 0 HD1 HIS A 70 -23.840 19.792 -11.847 1.00 0.00 H new ATOM 0 HD2 HIS A 70 -23.078 23.914 -12.120 1.00 0.00 H new ATOM 0 HE1 HIS A 70 -21.306 20.050 -12.044 1.00 0.00 H new ATOM 1072 N LEU A 71 -28.642 20.733 -13.406 1.00 0.00 N ATOM 1073 CA LEU A 71 -30.121 20.676 -13.363 1.00 0.00 C ATOM 1074 C LEU A 71 -30.667 19.235 -13.395 1.00 0.00 C ATOM 1075 O LEU A 71 -31.716 18.992 -12.754 1.00 0.00 O ATOM 1076 CB LEU A 71 -30.720 21.511 -14.520 1.00 0.00 C ATOM 1077 CG LEU A 71 -30.553 23.036 -14.413 1.00 0.00 C ATOM 1078 CD1 LEU A 71 -31.228 23.698 -15.612 1.00 0.00 C ATOM 1079 CD2 LEU A 71 -31.209 23.609 -13.155 1.00 0.00 C ATOM 1080 OXT LEU A 71 -30.052 18.372 -14.056 1.00 0.00 O ATOM 0 H LEU A 71 -28.258 20.155 -14.154 1.00 0.00 H new ATOM 0 HA LEU A 71 -30.429 21.103 -12.409 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -30.263 21.181 -15.453 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -31.784 21.287 -14.589 1.00 0.00 H new ATOM 0 HG LEU A 71 -29.482 23.237 -14.377 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -31.113 24.780 -15.543 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -30.765 23.342 -16.532 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -32.288 23.445 -15.618 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -31.062 24.689 -13.128 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -32.276 23.388 -13.168 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -30.756 23.159 -12.271 1.00 0.00 H new TER 1092 LEU A 71