USER MOD reduce.3.24.130724 H: found=0, std=0, add=761, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 759 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 13 GLN : amide:sc= 0.788 K(o=2.6,f=-2.2) USER MOD Set 1.2: A 88 SER OG : rot 58:sc= 1.77 USER MOD Set 2.1: A 80 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 89 SER OG : rot 180:sc= -0.0342 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 9 MET CE :methyl 158:sc= -5.19! (180deg=-5.97!) USER MOD Single : A 11 THR OG1 : rot 160:sc= -0.96 USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 THR OG1 : rot -160:sc= 0 USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 TYR OH : rot 180:sc= 0 USER MOD Single : A 21 CYS SG : rot 180:sc= 0 USER MOD Single : A 29 CYS SG : rot -106:sc= 0.0152 USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 37 ASN : amide:sc= -0.0251 X(o=-0.025,f=-0.25) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 LYS NZ :NH3+ -120:sc=1.75e-05 (180deg=0) USER MOD Single : A 43 ASN : amide:sc= -0.116 X(o=-0.12,f=-0.47) USER MOD Single : A 52 LYS NZ :NH3+ -102:sc= -0.221 (180deg=-1.87!) USER MOD Single : A 53 SER OG : rot 180:sc= 0 USER MOD Single : A 55 TYR OH : rot 36:sc= 1.22 USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 HIS : no HD1:sc= -4.92! C(o=-4.9!,f=-4.4!) USER MOD Single : A 72 THR OG1 : rot 180:sc= 0 USER MOD Single : A 73 LYS NZ :NH3+ -169:sc= -0.133 (180deg=-0.58) USER MOD Single : A 79 TYR OH : rot -26:sc= 0.323 USER MOD Single : A 82 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 83 THR OG1 : rot 121:sc= -0.184 USER MOD Single : A 84 THR OG1 : rot 171:sc= -0.428 USER MOD Single : A 87 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 91 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.0651) USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 97 LYS NZ :NH3+ 166:sc= 0 (180deg=-0.135) USER MOD Single : A 98 SER OG : rot 8:sc= 0.427 USER MOD Single : A 101 SER OG : rot 32:sc= 0.655 USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -27.309 4.465 -9.123 1.00 0.00 N ATOM 2 CA GLY A 1 -26.236 3.520 -8.877 1.00 0.00 C ATOM 3 C GLY A 1 -26.394 2.241 -9.675 1.00 0.00 C ATOM 4 O GLY A 1 -27.465 1.634 -9.682 1.00 0.00 O ATOM 0 H1 GLY A 1 -27.154 5.322 -8.554 1.00 0.00 H new ATOM 0 H2 GLY A 1 -27.325 4.717 -10.132 1.00 0.00 H new ATOM 0 H3 GLY A 1 -28.218 4.034 -8.860 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -25.282 3.985 -9.127 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -26.204 3.280 -7.814 1.00 0.00 H new ATOM 8 N SER A 2 -25.326 1.830 -10.351 1.00 0.00 N ATOM 9 CA SER A 2 -25.353 0.618 -11.160 1.00 0.00 C ATOM 10 C SER A 2 -25.498 -0.620 -10.280 1.00 0.00 C ATOM 11 O SER A 2 -24.756 -0.798 -9.314 1.00 0.00 O ATOM 12 CB SER A 2 -24.080 0.513 -12.002 1.00 0.00 C ATOM 13 OG SER A 2 -24.039 1.524 -12.994 1.00 0.00 O ATOM 0 H SER A 2 -24.431 2.319 -10.354 1.00 0.00 H new ATOM 0 HA SER A 2 -26.216 0.673 -11.824 1.00 0.00 H new ATOM 0 HB2 SER A 2 -23.206 0.597 -11.357 1.00 0.00 H new ATOM 0 HB3 SER A 2 -24.034 -0.468 -12.476 1.00 0.00 H new ATOM 0 HG SER A 2 -23.215 1.436 -13.517 1.00 0.00 H new ATOM 19 N SER A 3 -26.459 -1.472 -10.622 1.00 0.00 N ATOM 20 CA SER A 3 -26.705 -2.692 -9.862 1.00 0.00 C ATOM 21 C SER A 3 -25.391 -3.367 -9.478 1.00 0.00 C ATOM 22 O SER A 3 -24.404 -3.291 -10.209 1.00 0.00 O ATOM 23 CB SER A 3 -27.570 -3.658 -10.674 1.00 0.00 C ATOM 24 OG SER A 3 -28.931 -3.265 -10.651 1.00 0.00 O ATOM 0 H SER A 3 -27.080 -1.340 -11.420 1.00 0.00 H new ATOM 0 HA SER A 3 -27.235 -2.421 -8.949 1.00 0.00 H new ATOM 0 HB2 SER A 3 -27.215 -3.691 -11.704 1.00 0.00 H new ATOM 0 HB3 SER A 3 -27.472 -4.666 -10.271 1.00 0.00 H new ATOM 0 HG SER A 3 -29.463 -3.897 -11.178 1.00 0.00 H new ATOM 30 N GLY A 4 -25.388 -4.029 -8.325 1.00 0.00 N ATOM 31 CA GLY A 4 -24.192 -4.708 -7.863 1.00 0.00 C ATOM 32 C GLY A 4 -24.278 -5.103 -6.402 1.00 0.00 C ATOM 33 O GLY A 4 -25.184 -4.675 -5.688 1.00 0.00 O ATOM 0 H GLY A 4 -26.193 -4.107 -7.703 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -24.027 -5.599 -8.468 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -23.329 -4.059 -8.011 1.00 0.00 H new ATOM 37 N SER A 5 -23.333 -5.925 -5.957 1.00 0.00 N ATOM 38 CA SER A 5 -23.308 -6.384 -4.572 1.00 0.00 C ATOM 39 C SER A 5 -22.723 -5.314 -3.656 1.00 0.00 C ATOM 40 O SER A 5 -22.211 -4.295 -4.121 1.00 0.00 O ATOM 41 CB SER A 5 -22.494 -7.674 -4.454 1.00 0.00 C ATOM 42 OG SER A 5 -23.169 -8.760 -5.064 1.00 0.00 O ATOM 0 H SER A 5 -22.574 -6.287 -6.535 1.00 0.00 H new ATOM 0 HA SER A 5 -24.334 -6.581 -4.262 1.00 0.00 H new ATOM 0 HB2 SER A 5 -21.520 -7.537 -4.923 1.00 0.00 H new ATOM 0 HB3 SER A 5 -22.313 -7.899 -3.403 1.00 0.00 H new ATOM 0 HG SER A 5 -22.628 -9.572 -4.977 1.00 0.00 H new ATOM 48 N SER A 6 -22.803 -5.553 -2.351 1.00 0.00 N ATOM 49 CA SER A 6 -22.284 -4.609 -1.368 1.00 0.00 C ATOM 50 C SER A 6 -20.774 -4.446 -1.514 1.00 0.00 C ATOM 51 O SER A 6 -19.998 -5.203 -0.933 1.00 0.00 O ATOM 52 CB SER A 6 -22.623 -5.077 0.048 1.00 0.00 C ATOM 53 OG SER A 6 -24.000 -4.893 0.331 1.00 0.00 O ATOM 0 H SER A 6 -23.222 -6.392 -1.950 1.00 0.00 H new ATOM 0 HA SER A 6 -22.755 -3.642 -1.546 1.00 0.00 H new ATOM 0 HB2 SER A 6 -22.364 -6.130 0.158 1.00 0.00 H new ATOM 0 HB3 SER A 6 -22.023 -4.524 0.771 1.00 0.00 H new ATOM 0 HG SER A 6 -24.191 -5.202 1.241 1.00 0.00 H new ATOM 59 N GLY A 7 -20.366 -3.452 -2.296 1.00 0.00 N ATOM 60 CA GLY A 7 -18.951 -3.206 -2.506 1.00 0.00 C ATOM 61 C GLY A 7 -18.306 -2.491 -1.336 1.00 0.00 C ATOM 62 O GLY A 7 -18.999 -1.987 -0.450 1.00 0.00 O ATOM 0 H GLY A 7 -20.990 -2.812 -2.788 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -18.442 -4.155 -2.673 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -18.819 -2.610 -3.409 1.00 0.00 H new ATOM 66 N ILE A 8 -16.978 -2.446 -1.329 1.00 0.00 N ATOM 67 CA ILE A 8 -16.242 -1.787 -0.258 1.00 0.00 C ATOM 68 C ILE A 8 -15.688 -0.443 -0.718 1.00 0.00 C ATOM 69 O ILE A 8 -14.900 -0.374 -1.660 1.00 0.00 O ATOM 70 CB ILE A 8 -15.079 -2.663 0.247 1.00 0.00 C ATOM 71 CG1 ILE A 8 -15.618 -3.947 0.880 1.00 0.00 C ATOM 72 CG2 ILE A 8 -14.229 -1.890 1.244 1.00 0.00 C ATOM 73 CD1 ILE A 8 -14.553 -4.994 1.121 1.00 0.00 C ATOM 0 H ILE A 8 -16.390 -2.858 -2.053 1.00 0.00 H new ATOM 0 HA ILE A 8 -16.947 -1.627 0.558 1.00 0.00 H new ATOM 0 HB ILE A 8 -14.451 -2.934 -0.602 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -16.097 -3.702 1.828 1.00 0.00 H new ATOM 0 HG13 ILE A 8 -16.388 -4.366 0.233 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -13.412 -2.522 1.592 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -13.821 -1.001 0.762 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -14.844 -1.593 2.093 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -15.006 -5.877 1.571 1.00 0.00 H new ATOM 0 HD12 ILE A 8 -14.090 -5.267 0.173 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -13.794 -4.593 1.793 1.00 0.00 H new ATOM 85 N MET A 9 -16.106 0.624 -0.044 1.00 0.00 N ATOM 86 CA MET A 9 -15.649 1.967 -0.382 1.00 0.00 C ATOM 87 C MET A 9 -14.552 2.425 0.574 1.00 0.00 C ATOM 88 O MET A 9 -14.627 2.187 1.780 1.00 0.00 O ATOM 89 CB MET A 9 -16.819 2.952 -0.344 1.00 0.00 C ATOM 90 CG MET A 9 -18.128 2.359 -0.839 1.00 0.00 C ATOM 91 SD MET A 9 -18.139 2.091 -2.622 1.00 0.00 S ATOM 92 CE MET A 9 -18.396 0.320 -2.697 1.00 0.00 C ATOM 0 H MET A 9 -16.759 0.585 0.738 1.00 0.00 H new ATOM 0 HA MET A 9 -15.239 1.941 -1.391 1.00 0.00 H new ATOM 0 HB2 MET A 9 -16.953 3.305 0.678 1.00 0.00 H new ATOM 0 HB3 MET A 9 -16.571 3.822 -0.952 1.00 0.00 H new ATOM 0 HG2 MET A 9 -18.308 1.411 -0.332 1.00 0.00 H new ATOM 0 HG3 MET A 9 -18.948 3.025 -0.570 1.00 0.00 H new ATOM 0 HE1 MET A 9 -18.809 0.053 -3.670 1.00 0.00 H new ATOM 0 HE2 MET A 9 -17.445 -0.192 -2.553 1.00 0.00 H new ATOM 0 HE3 MET A 9 -19.091 0.020 -1.913 1.00 0.00 H new ATOM 102 N VAL A 10 -13.534 3.083 0.029 1.00 0.00 N ATOM 103 CA VAL A 10 -12.423 3.575 0.834 1.00 0.00 C ATOM 104 C VAL A 10 -12.802 4.855 1.571 1.00 0.00 C ATOM 105 O VAL A 10 -12.802 5.942 0.992 1.00 0.00 O ATOM 106 CB VAL A 10 -11.178 3.844 -0.032 1.00 0.00 C ATOM 107 CG1 VAL A 10 -10.035 4.369 0.824 1.00 0.00 C ATOM 108 CG2 VAL A 10 -10.764 2.583 -0.774 1.00 0.00 C ATOM 0 H VAL A 10 -13.456 3.288 -0.967 1.00 0.00 H new ATOM 0 HA VAL A 10 -12.190 2.796 1.560 1.00 0.00 H new ATOM 0 HB VAL A 10 -11.427 4.607 -0.769 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -9.164 4.553 0.195 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -10.338 5.299 1.305 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -9.783 3.632 1.586 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -9.883 2.791 -1.381 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -10.532 1.797 -0.055 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -11.580 2.256 -1.419 1.00 0.00 H new ATOM 118 N THR A 11 -13.125 4.720 2.854 1.00 0.00 N ATOM 119 CA THR A 11 -13.507 5.865 3.670 1.00 0.00 C ATOM 120 C THR A 11 -12.339 6.829 3.847 1.00 0.00 C ATOM 121 O THR A 11 -12.516 8.047 3.817 1.00 0.00 O ATOM 122 CB THR A 11 -14.007 5.423 5.059 1.00 0.00 C ATOM 123 OG1 THR A 11 -12.914 4.922 5.836 1.00 0.00 O ATOM 124 CG2 THR A 11 -15.079 4.350 4.932 1.00 0.00 C ATOM 0 H THR A 11 -13.129 3.829 3.350 1.00 0.00 H new ATOM 0 HA THR A 11 -14.316 6.372 3.144 1.00 0.00 H new ATOM 0 HB THR A 11 -14.440 6.290 5.558 1.00 0.00 H new ATOM 0 HG1 THR A 11 -13.151 4.945 6.787 1.00 0.00 H new ATOM 0 HG21 THR A 11 -15.417 4.054 5.925 1.00 0.00 H new ATOM 0 HG22 THR A 11 -15.922 4.744 4.364 1.00 0.00 H new ATOM 0 HG23 THR A 11 -14.667 3.483 4.415 1.00 0.00 H new ATOM 132 N LYS A 12 -11.145 6.276 4.030 1.00 0.00 N ATOM 133 CA LYS A 12 -9.946 7.086 4.209 1.00 0.00 C ATOM 134 C LYS A 12 -8.940 6.823 3.093 1.00 0.00 C ATOM 135 O LYS A 12 -8.217 5.827 3.120 1.00 0.00 O ATOM 136 CB LYS A 12 -9.305 6.793 5.568 1.00 0.00 C ATOM 137 CG LYS A 12 -8.240 7.798 5.968 1.00 0.00 C ATOM 138 CD LYS A 12 -7.633 7.460 7.319 1.00 0.00 C ATOM 139 CE LYS A 12 -6.598 8.492 7.740 1.00 0.00 C ATOM 140 NZ LYS A 12 -7.233 9.754 8.210 1.00 0.00 N ATOM 0 H LYS A 12 -10.982 5.270 4.058 1.00 0.00 H new ATOM 0 HA LYS A 12 -10.238 8.135 4.171 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -10.083 6.778 6.331 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -8.862 5.797 5.544 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -7.456 7.819 5.211 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -8.676 8.796 6.004 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -8.421 7.407 8.070 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -7.168 6.475 7.274 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -5.977 8.080 8.535 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -5.938 8.708 6.900 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -6.495 10.432 8.488 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -7.806 10.161 7.443 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -7.843 9.552 9.028 1.00 0.00 H new ATOM 154 N GLN A 13 -8.898 7.723 2.116 1.00 0.00 N ATOM 155 CA GLN A 13 -7.979 7.587 0.992 1.00 0.00 C ATOM 156 C GLN A 13 -6.530 7.633 1.465 1.00 0.00 C ATOM 157 O GLN A 13 -6.224 8.216 2.506 1.00 0.00 O ATOM 158 CB GLN A 13 -8.228 8.694 -0.034 1.00 0.00 C ATOM 159 CG GLN A 13 -9.598 8.618 -0.690 1.00 0.00 C ATOM 160 CD GLN A 13 -9.647 7.613 -1.824 1.00 0.00 C ATOM 161 OE1 GLN A 13 -8.749 7.563 -2.665 1.00 0.00 O ATOM 162 NE2 GLN A 13 -10.700 6.804 -1.853 1.00 0.00 N ATOM 0 H GLN A 13 -9.489 8.554 2.080 1.00 0.00 H new ATOM 0 HA GLN A 13 -8.159 6.619 0.523 1.00 0.00 H new ATOM 0 HB2 GLN A 13 -8.122 9.662 0.455 1.00 0.00 H new ATOM 0 HB3 GLN A 13 -7.461 8.641 -0.807 1.00 0.00 H new ATOM 0 HG2 GLN A 13 -10.342 8.350 0.060 1.00 0.00 H new ATOM 0 HG3 GLN A 13 -9.870 9.603 -1.070 1.00 0.00 H new ATOM 0 HE21 GLN A 13 -11.421 6.880 -1.136 1.00 0.00 H new ATOM 0 HE22 GLN A 13 -10.787 6.107 -2.592 1.00 0.00 H new ATOM 171 N LEU A 14 -5.642 7.015 0.694 1.00 0.00 N ATOM 172 CA LEU A 14 -4.223 6.985 1.034 1.00 0.00 C ATOM 173 C LEU A 14 -3.643 8.395 1.076 1.00 0.00 C ATOM 174 O LEU A 14 -4.187 9.318 0.470 1.00 0.00 O ATOM 175 CB LEU A 14 -3.454 6.134 0.023 1.00 0.00 C ATOM 176 CG LEU A 14 -3.808 4.647 -0.010 1.00 0.00 C ATOM 177 CD1 LEU A 14 -3.364 4.021 -1.323 1.00 0.00 C ATOM 178 CD2 LEU A 14 -3.176 3.922 1.169 1.00 0.00 C ATOM 0 H LEU A 14 -5.879 6.528 -0.170 1.00 0.00 H new ATOM 0 HA LEU A 14 -4.121 6.541 2.024 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -3.620 6.549 -0.971 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -2.389 6.229 0.234 1.00 0.00 H new ATOM 0 HG LEU A 14 -4.891 4.550 0.067 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -3.624 2.963 -1.328 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -3.864 4.522 -2.152 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -2.285 4.130 -1.431 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -3.439 2.865 1.129 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -2.092 4.029 1.123 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -3.544 4.352 2.100 1.00 0.00 H new ATOM 190 N GLU A 15 -2.534 8.552 1.792 1.00 0.00 N ATOM 191 CA GLU A 15 -1.880 9.850 1.910 1.00 0.00 C ATOM 192 C GLU A 15 -0.424 9.768 1.461 1.00 0.00 C ATOM 193 O GLU A 15 0.307 8.857 1.850 1.00 0.00 O ATOM 194 CB GLU A 15 -1.952 10.353 3.353 1.00 0.00 C ATOM 195 CG GLU A 15 -3.370 10.594 3.843 1.00 0.00 C ATOM 196 CD GLU A 15 -3.987 9.362 4.475 1.00 0.00 C ATOM 197 OE1 GLU A 15 -3.226 8.525 5.007 1.00 0.00 O ATOM 198 OE2 GLU A 15 -5.228 9.233 4.438 1.00 0.00 O ATOM 0 H GLU A 15 -2.070 7.798 2.298 1.00 0.00 H new ATOM 0 HA GLU A 15 -2.404 10.552 1.261 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -1.469 9.627 4.007 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -1.386 11.281 3.434 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -3.366 11.407 4.569 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -3.989 10.917 3.006 1.00 0.00 H new ATOM 205 N ASP A 16 -0.009 10.726 0.639 1.00 0.00 N ATOM 206 CA ASP A 16 1.359 10.763 0.137 1.00 0.00 C ATOM 207 C ASP A 16 2.361 10.619 1.278 1.00 0.00 C ATOM 208 O ASP A 16 2.209 11.233 2.335 1.00 0.00 O ATOM 209 CB ASP A 16 1.613 12.069 -0.618 1.00 0.00 C ATOM 210 CG ASP A 16 3.071 12.482 -0.588 1.00 0.00 C ATOM 211 OD1 ASP A 16 3.559 12.859 0.499 1.00 0.00 O ATOM 212 OD2 ASP A 16 3.725 12.428 -1.650 1.00 0.00 O ATOM 0 H ASP A 16 -0.601 11.487 0.306 1.00 0.00 H new ATOM 0 HA ASP A 16 1.491 9.925 -0.547 1.00 0.00 H new ATOM 0 HB2 ASP A 16 1.292 11.955 -1.653 1.00 0.00 H new ATOM 0 HB3 ASP A 16 1.005 12.861 -0.182 1.00 0.00 H new ATOM 217 N THR A 17 3.387 9.802 1.059 1.00 0.00 N ATOM 218 CA THR A 17 4.413 9.575 2.069 1.00 0.00 C ATOM 219 C THR A 17 5.805 9.847 1.510 1.00 0.00 C ATOM 220 O THR A 17 6.057 9.651 0.321 1.00 0.00 O ATOM 221 CB THR A 17 4.361 8.133 2.607 1.00 0.00 C ATOM 222 OG1 THR A 17 3.076 7.870 3.183 1.00 0.00 O ATOM 223 CG2 THR A 17 5.445 7.905 3.650 1.00 0.00 C ATOM 0 H THR A 17 3.529 9.286 0.190 1.00 0.00 H new ATOM 0 HA THR A 17 4.211 10.268 2.886 1.00 0.00 H new ATOM 0 HB THR A 17 4.531 7.452 1.773 1.00 0.00 H new ATOM 0 HG1 THR A 17 3.140 7.103 3.789 1.00 0.00 H new ATOM 0 HG21 THR A 17 5.388 6.880 4.015 1.00 0.00 H new ATOM 0 HG22 THR A 17 6.423 8.077 3.201 1.00 0.00 H new ATOM 0 HG23 THR A 17 5.301 8.595 4.481 1.00 0.00 H new ATOM 231 N THR A 18 6.707 10.300 2.375 1.00 0.00 N ATOM 232 CA THR A 18 8.074 10.600 1.968 1.00 0.00 C ATOM 233 C THR A 18 9.082 9.874 2.851 1.00 0.00 C ATOM 234 O THR A 18 9.276 10.232 4.012 1.00 0.00 O ATOM 235 CB THR A 18 8.357 12.113 2.022 1.00 0.00 C ATOM 236 OG1 THR A 18 7.342 12.827 1.308 1.00 0.00 O ATOM 237 CG2 THR A 18 9.721 12.429 1.427 1.00 0.00 C ATOM 0 H THR A 18 6.515 10.467 3.363 1.00 0.00 H new ATOM 0 HA THR A 18 8.181 10.255 0.940 1.00 0.00 H new ATOM 0 HB THR A 18 8.353 12.425 3.066 1.00 0.00 H new ATOM 0 HG1 THR A 18 7.528 13.788 1.349 1.00 0.00 H new ATOM 0 HG21 THR A 18 9.899 13.503 1.476 1.00 0.00 H new ATOM 0 HG22 THR A 18 10.494 11.907 1.991 1.00 0.00 H new ATOM 0 HG23 THR A 18 9.749 12.104 0.387 1.00 0.00 H new ATOM 245 N ALA A 19 9.723 8.852 2.292 1.00 0.00 N ATOM 246 CA ALA A 19 10.714 8.077 3.029 1.00 0.00 C ATOM 247 C ALA A 19 12.094 8.205 2.393 1.00 0.00 C ATOM 248 O ALA A 19 12.248 8.824 1.339 1.00 0.00 O ATOM 249 CB ALA A 19 10.296 6.616 3.098 1.00 0.00 C ATOM 0 H ALA A 19 9.574 8.542 1.332 1.00 0.00 H new ATOM 0 HA ALA A 19 10.771 8.475 4.042 1.00 0.00 H new ATOM 0 HB1 ALA A 19 11.045 6.049 3.651 1.00 0.00 H new ATOM 0 HB2 ALA A 19 9.334 6.536 3.604 1.00 0.00 H new ATOM 0 HB3 ALA A 19 10.209 6.214 2.088 1.00 0.00 H new ATOM 255 N TYR A 20 13.095 7.618 3.039 1.00 0.00 N ATOM 256 CA TYR A 20 14.463 7.670 2.538 1.00 0.00 C ATOM 257 C TYR A 20 14.936 6.286 2.103 1.00 0.00 C ATOM 258 O TYR A 20 14.220 5.296 2.257 1.00 0.00 O ATOM 259 CB TYR A 20 15.400 8.228 3.610 1.00 0.00 C ATOM 260 CG TYR A 20 15.382 9.737 3.705 1.00 0.00 C ATOM 261 CD1 TYR A 20 14.323 10.401 4.311 1.00 0.00 C ATOM 262 CD2 TYR A 20 16.422 10.498 3.187 1.00 0.00 C ATOM 263 CE1 TYR A 20 14.301 11.780 4.399 1.00 0.00 C ATOM 264 CE2 TYR A 20 16.410 11.876 3.272 1.00 0.00 C ATOM 265 CZ TYR A 20 15.347 12.513 3.879 1.00 0.00 C ATOM 266 OH TYR A 20 15.330 13.886 3.964 1.00 0.00 O ATOM 0 H TYR A 20 12.985 7.100 3.911 1.00 0.00 H new ATOM 0 HA TYR A 20 14.481 8.330 1.671 1.00 0.00 H new ATOM 0 HB2 TYR A 20 15.123 7.808 4.577 1.00 0.00 H new ATOM 0 HB3 TYR A 20 16.417 7.898 3.399 1.00 0.00 H new ATOM 0 HD1 TYR A 20 13.503 9.830 4.720 1.00 0.00 H new ATOM 0 HD2 TYR A 20 17.255 10.003 2.709 1.00 0.00 H new ATOM 0 HE1 TYR A 20 13.469 12.281 4.872 1.00 0.00 H new ATOM 0 HE2 TYR A 20 17.228 12.452 2.866 1.00 0.00 H new ATOM 0 HH TYR A 20 16.141 14.249 3.551 1.00 0.00 H new ATOM 276 N CYS A 21 16.146 6.226 1.559 1.00 0.00 N ATOM 277 CA CYS A 21 16.717 4.964 1.101 1.00 0.00 C ATOM 278 C CYS A 21 17.082 4.071 2.282 1.00 0.00 C ATOM 279 O CYS A 21 18.054 4.328 2.991 1.00 0.00 O ATOM 280 CB CYS A 21 17.955 5.223 0.240 1.00 0.00 C ATOM 281 SG CYS A 21 18.749 3.722 -0.381 1.00 0.00 S ATOM 0 H CYS A 21 16.751 7.036 1.424 1.00 0.00 H new ATOM 0 HA CYS A 21 15.966 4.451 0.500 1.00 0.00 H new ATOM 0 HB2 CYS A 21 17.671 5.848 -0.607 1.00 0.00 H new ATOM 0 HB3 CYS A 21 18.680 5.789 0.825 1.00 0.00 H new ATOM 0 HG CYS A 21 19.784 4.044 -1.099 1.00 0.00 H new ATOM 287 N GLY A 22 16.293 3.021 2.490 1.00 0.00 N ATOM 288 CA GLY A 22 16.548 2.107 3.588 1.00 0.00 C ATOM 289 C GLY A 22 15.543 2.258 4.713 1.00 0.00 C ATOM 290 O GLY A 22 15.586 1.517 5.694 1.00 0.00 O ATOM 0 H GLY A 22 15.482 2.787 1.918 1.00 0.00 H new ATOM 0 HA2 GLY A 22 16.522 1.082 3.217 1.00 0.00 H new ATOM 0 HA3 GLY A 22 17.552 2.281 3.976 1.00 0.00 H new ATOM 294 N GLU A 23 14.637 3.221 4.571 1.00 0.00 N ATOM 295 CA GLU A 23 13.619 3.467 5.585 1.00 0.00 C ATOM 296 C GLU A 23 12.395 2.586 5.352 1.00 0.00 C ATOM 297 O GLU A 23 12.225 2.013 4.276 1.00 0.00 O ATOM 298 CB GLU A 23 13.209 4.941 5.581 1.00 0.00 C ATOM 299 CG GLU A 23 14.031 5.805 6.523 1.00 0.00 C ATOM 300 CD GLU A 23 14.213 5.169 7.887 1.00 0.00 C ATOM 301 OE1 GLU A 23 13.213 5.054 8.626 1.00 0.00 O ATOM 302 OE2 GLU A 23 15.355 4.786 8.217 1.00 0.00 O ATOM 0 H GLU A 23 14.588 3.843 3.764 1.00 0.00 H new ATOM 0 HA GLU A 23 14.044 3.219 6.558 1.00 0.00 H new ATOM 0 HB2 GLU A 23 13.303 5.332 4.568 1.00 0.00 H new ATOM 0 HB3 GLU A 23 12.157 5.017 5.856 1.00 0.00 H new ATOM 0 HG2 GLU A 23 15.009 5.991 6.079 1.00 0.00 H new ATOM 0 HG3 GLU A 23 13.545 6.773 6.640 1.00 0.00 H new ATOM 309 N ARG A 24 11.546 2.484 6.369 1.00 0.00 N ATOM 310 CA ARG A 24 10.338 1.672 6.277 1.00 0.00 C ATOM 311 C ARG A 24 9.103 2.552 6.109 1.00 0.00 C ATOM 312 O ARG A 24 8.800 3.385 6.963 1.00 0.00 O ATOM 313 CB ARG A 24 10.189 0.798 7.524 1.00 0.00 C ATOM 314 CG ARG A 24 8.814 0.166 7.664 1.00 0.00 C ATOM 315 CD ARG A 24 8.431 -0.019 9.124 1.00 0.00 C ATOM 316 NE ARG A 24 8.793 -1.343 9.621 1.00 0.00 N ATOM 317 CZ ARG A 24 8.738 -1.688 10.903 1.00 0.00 C ATOM 318 NH1 ARG A 24 8.339 -0.809 11.812 1.00 0.00 N ATOM 319 NH2 ARG A 24 9.084 -2.913 11.277 1.00 0.00 N ATOM 0 H ARG A 24 11.672 2.953 7.266 1.00 0.00 H new ATOM 0 HA ARG A 24 10.428 1.030 5.401 1.00 0.00 H new ATOM 0 HB2 ARG A 24 10.941 0.009 7.497 1.00 0.00 H new ATOM 0 HB3 ARG A 24 10.393 1.403 8.408 1.00 0.00 H new ATOM 0 HG2 ARG A 24 8.072 0.793 7.169 1.00 0.00 H new ATOM 0 HG3 ARG A 24 8.803 -0.800 7.159 1.00 0.00 H new ATOM 0 HD2 ARG A 24 8.925 0.742 9.728 1.00 0.00 H new ATOM 0 HD3 ARG A 24 7.357 0.130 9.239 1.00 0.00 H new ATOM 0 HE ARG A 24 9.105 -2.042 8.947 1.00 0.00 H new ATOM 0 HH11 ARG A 24 8.074 0.134 11.528 1.00 0.00 H new ATOM 0 HH12 ARG A 24 8.297 -1.076 12.796 1.00 0.00 H new ATOM 0 HH21 ARG A 24 9.393 -3.591 10.580 1.00 0.00 H new ATOM 0 HH22 ARG A 24 9.041 -3.177 12.261 1.00 0.00 H new ATOM 333 N VAL A 25 8.393 2.361 5.001 1.00 0.00 N ATOM 334 CA VAL A 25 7.190 3.136 4.721 1.00 0.00 C ATOM 335 C VAL A 25 5.942 2.409 5.206 1.00 0.00 C ATOM 336 O VAL A 25 5.840 1.188 5.093 1.00 0.00 O ATOM 337 CB VAL A 25 7.049 3.428 3.215 1.00 0.00 C ATOM 338 CG1 VAL A 25 5.853 4.331 2.956 1.00 0.00 C ATOM 339 CG2 VAL A 25 8.326 4.051 2.672 1.00 0.00 C ATOM 0 H VAL A 25 8.630 1.676 4.283 1.00 0.00 H new ATOM 0 HA VAL A 25 7.289 4.079 5.259 1.00 0.00 H new ATOM 0 HB VAL A 25 6.881 2.486 2.694 1.00 0.00 H new ATOM 0 HG11 VAL A 25 5.769 4.526 1.887 1.00 0.00 H new ATOM 0 HG12 VAL A 25 4.945 3.842 3.308 1.00 0.00 H new ATOM 0 HG13 VAL A 25 5.987 5.273 3.488 1.00 0.00 H new ATOM 0 HG21 VAL A 25 8.209 4.251 1.607 1.00 0.00 H new ATOM 0 HG22 VAL A 25 8.527 4.985 3.197 1.00 0.00 H new ATOM 0 HG23 VAL A 25 9.159 3.364 2.823 1.00 0.00 H new ATOM 349 N GLU A 26 4.993 3.168 5.746 1.00 0.00 N ATOM 350 CA GLU A 26 3.750 2.594 6.248 1.00 0.00 C ATOM 351 C GLU A 26 2.543 3.370 5.728 1.00 0.00 C ATOM 352 O GLU A 26 2.321 4.521 6.106 1.00 0.00 O ATOM 353 CB GLU A 26 3.747 2.590 7.778 1.00 0.00 C ATOM 354 CG GLU A 26 4.540 1.445 8.386 1.00 0.00 C ATOM 355 CD GLU A 26 4.337 1.324 9.884 1.00 0.00 C ATOM 356 OE1 GLU A 26 4.065 2.358 10.530 1.00 0.00 O ATOM 357 OE2 GLU A 26 4.450 0.197 10.409 1.00 0.00 O ATOM 0 H GLU A 26 5.061 4.181 5.847 1.00 0.00 H new ATOM 0 HA GLU A 26 3.682 1.567 5.888 1.00 0.00 H new ATOM 0 HB2 GLU A 26 4.156 3.535 8.136 1.00 0.00 H new ATOM 0 HB3 GLU A 26 2.717 2.535 8.131 1.00 0.00 H new ATOM 0 HG2 GLU A 26 4.247 0.511 7.907 1.00 0.00 H new ATOM 0 HG3 GLU A 26 5.600 1.591 8.178 1.00 0.00 H new ATOM 364 N LEU A 27 1.767 2.731 4.859 1.00 0.00 N ATOM 365 CA LEU A 27 0.583 3.360 4.286 1.00 0.00 C ATOM 366 C LEU A 27 -0.684 2.867 4.977 1.00 0.00 C ATOM 367 O LEU A 27 -1.058 1.702 4.850 1.00 0.00 O ATOM 368 CB LEU A 27 0.504 3.072 2.785 1.00 0.00 C ATOM 369 CG LEU A 27 1.744 3.431 1.967 1.00 0.00 C ATOM 370 CD1 LEU A 27 1.563 3.019 0.514 1.00 0.00 C ATOM 371 CD2 LEU A 27 2.036 4.921 2.068 1.00 0.00 C ATOM 0 H LEU A 27 1.937 1.778 4.536 1.00 0.00 H new ATOM 0 HA LEU A 27 0.663 4.436 4.440 1.00 0.00 H new ATOM 0 HB2 LEU A 27 0.299 2.010 2.649 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -0.347 3.616 2.375 1.00 0.00 H new ATOM 0 HG LEU A 27 2.595 2.885 2.375 1.00 0.00 H new ATOM 0 HD11 LEU A 27 2.456 3.283 -0.053 1.00 0.00 H new ATOM 0 HD12 LEU A 27 1.403 1.942 0.458 1.00 0.00 H new ATOM 0 HD13 LEU A 27 0.701 3.536 0.094 1.00 0.00 H new ATOM 0 HD21 LEU A 27 2.922 5.159 1.480 1.00 0.00 H new ATOM 0 HD22 LEU A 27 1.185 5.485 1.687 1.00 0.00 H new ATOM 0 HD23 LEU A 27 2.210 5.188 3.110 1.00 0.00 H new ATOM 383 N GLU A 28 -1.341 3.763 5.707 1.00 0.00 N ATOM 384 CA GLU A 28 -2.567 3.418 6.417 1.00 0.00 C ATOM 385 C GLU A 28 -3.795 3.896 5.647 1.00 0.00 C ATOM 386 O GLU A 28 -3.754 4.922 4.967 1.00 0.00 O ATOM 387 CB GLU A 28 -2.561 4.032 7.819 1.00 0.00 C ATOM 388 CG GLU A 28 -3.620 3.452 8.742 1.00 0.00 C ATOM 389 CD GLU A 28 -4.070 4.437 9.804 1.00 0.00 C ATOM 390 OE1 GLU A 28 -3.214 4.888 10.594 1.00 0.00 O ATOM 391 OE2 GLU A 28 -5.276 4.755 9.846 1.00 0.00 O ATOM 0 H GLU A 28 -1.045 4.732 5.822 1.00 0.00 H new ATOM 0 HA GLU A 28 -2.613 2.332 6.503 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -1.579 3.883 8.268 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -2.713 5.108 7.736 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -4.482 3.142 8.151 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -3.226 2.558 9.225 1.00 0.00 H new ATOM 398 N CYS A 29 -4.885 3.145 5.758 1.00 0.00 N ATOM 399 CA CYS A 29 -6.124 3.490 5.071 1.00 0.00 C ATOM 400 C CYS A 29 -7.319 2.805 5.728 1.00 0.00 C ATOM 401 O CYS A 29 -7.158 1.847 6.482 1.00 0.00 O ATOM 402 CB CYS A 29 -6.042 3.094 3.596 1.00 0.00 C ATOM 403 SG CYS A 29 -5.933 1.311 3.315 1.00 0.00 S ATOM 0 H CYS A 29 -4.936 2.293 6.317 1.00 0.00 H new ATOM 0 HA CYS A 29 -6.261 4.569 5.143 1.00 0.00 H new ATOM 0 HB2 CYS A 29 -6.920 3.480 3.078 1.00 0.00 H new ATOM 0 HB3 CYS A 29 -5.172 3.575 3.150 1.00 0.00 H new ATOM 0 HG CYS A 29 -4.722 1.001 2.959 1.00 0.00 H new ATOM 409 N GLU A 30 -8.515 3.305 5.436 1.00 0.00 N ATOM 410 CA GLU A 30 -9.736 2.742 6.000 1.00 0.00 C ATOM 411 C GLU A 30 -10.723 2.366 4.898 1.00 0.00 C ATOM 412 O GLU A 30 -10.693 2.931 3.805 1.00 0.00 O ATOM 413 CB GLU A 30 -10.385 3.738 6.963 1.00 0.00 C ATOM 414 CG GLU A 30 -9.904 3.600 8.398 1.00 0.00 C ATOM 415 CD GLU A 30 -10.795 4.329 9.385 1.00 0.00 C ATOM 416 OE1 GLU A 30 -11.940 3.877 9.594 1.00 0.00 O ATOM 417 OE2 GLU A 30 -10.348 5.350 9.948 1.00 0.00 O ATOM 0 H GLU A 30 -8.665 4.098 4.813 1.00 0.00 H new ATOM 0 HA GLU A 30 -9.469 1.838 6.548 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -10.181 4.751 6.616 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -11.466 3.604 6.937 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -9.863 2.544 8.663 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -8.888 3.988 8.476 1.00 0.00 H new ATOM 424 N VAL A 31 -11.595 1.409 5.195 1.00 0.00 N ATOM 425 CA VAL A 31 -12.591 0.957 4.231 1.00 0.00 C ATOM 426 C VAL A 31 -13.991 0.980 4.835 1.00 0.00 C ATOM 427 O VAL A 31 -14.157 1.200 6.035 1.00 0.00 O ATOM 428 CB VAL A 31 -12.284 -0.467 3.731 1.00 0.00 C ATOM 429 CG1 VAL A 31 -11.151 -0.444 2.716 1.00 0.00 C ATOM 430 CG2 VAL A 31 -11.944 -1.380 4.900 1.00 0.00 C ATOM 0 H VAL A 31 -11.632 0.931 6.095 1.00 0.00 H new ATOM 0 HA VAL A 31 -12.550 1.647 3.388 1.00 0.00 H new ATOM 0 HB VAL A 31 -13.173 -0.860 3.239 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -10.948 -1.459 2.374 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -11.437 0.175 1.866 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -10.255 -0.032 3.180 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -11.730 -2.382 4.529 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -11.070 -0.992 5.422 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -12.789 -1.421 5.588 1.00 0.00 H new ATOM 440 N SER A 32 -14.996 0.751 3.995 1.00 0.00 N ATOM 441 CA SER A 32 -16.383 0.749 4.446 1.00 0.00 C ATOM 442 C SER A 32 -16.680 -0.490 5.284 1.00 0.00 C ATOM 443 O SER A 32 -17.454 -0.435 6.239 1.00 0.00 O ATOM 444 CB SER A 32 -17.331 0.806 3.246 1.00 0.00 C ATOM 445 OG SER A 32 -18.671 0.574 3.644 1.00 0.00 O ATOM 0 H SER A 32 -14.876 0.565 2.999 1.00 0.00 H new ATOM 0 HA SER A 32 -16.539 1.632 5.066 1.00 0.00 H new ATOM 0 HB2 SER A 32 -17.255 1.781 2.764 1.00 0.00 H new ATOM 0 HB3 SER A 32 -17.033 0.061 2.508 1.00 0.00 H new ATOM 0 HG SER A 32 -19.257 0.617 2.860 1.00 0.00 H new ATOM 451 N GLU A 33 -16.057 -1.607 4.920 1.00 0.00 N ATOM 452 CA GLU A 33 -16.255 -2.860 5.638 1.00 0.00 C ATOM 453 C GLU A 33 -15.126 -3.100 6.636 1.00 0.00 C ATOM 454 O GLU A 33 -14.117 -2.395 6.629 1.00 0.00 O ATOM 455 CB GLU A 33 -16.339 -4.029 4.655 1.00 0.00 C ATOM 456 CG GLU A 33 -17.725 -4.231 4.066 1.00 0.00 C ATOM 457 CD GLU A 33 -17.966 -5.660 3.618 1.00 0.00 C ATOM 458 OE1 GLU A 33 -17.387 -6.580 4.233 1.00 0.00 O ATOM 459 OE2 GLU A 33 -18.732 -5.858 2.652 1.00 0.00 O ATOM 0 H GLU A 33 -15.412 -1.669 4.133 1.00 0.00 H new ATOM 0 HA GLU A 33 -17.193 -2.789 6.188 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -15.630 -3.863 3.844 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -16.033 -4.943 5.164 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -18.475 -3.955 4.808 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -17.856 -3.561 3.216 1.00 0.00 H new ATOM 466 N ASP A 34 -15.304 -4.099 7.493 1.00 0.00 N ATOM 467 CA ASP A 34 -14.300 -4.433 8.497 1.00 0.00 C ATOM 468 C ASP A 34 -13.536 -5.693 8.104 1.00 0.00 C ATOM 469 O ASP A 34 -14.041 -6.527 7.351 1.00 0.00 O ATOM 470 CB ASP A 34 -14.960 -4.627 9.864 1.00 0.00 C ATOM 471 CG ASP A 34 -15.633 -5.979 9.994 1.00 0.00 C ATOM 472 OD1 ASP A 34 -14.913 -6.998 10.041 1.00 0.00 O ATOM 473 OD2 ASP A 34 -16.880 -6.019 10.050 1.00 0.00 O ATOM 0 H ASP A 34 -16.134 -4.692 7.513 1.00 0.00 H new ATOM 0 HA ASP A 34 -13.593 -3.606 8.557 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -14.208 -4.522 10.646 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -15.697 -3.840 10.023 1.00 0.00 H new ATOM 478 N ASP A 35 -12.318 -5.824 8.616 1.00 0.00 N ATOM 479 CA ASP A 35 -11.484 -6.983 8.318 1.00 0.00 C ATOM 480 C ASP A 35 -11.585 -7.361 6.844 1.00 0.00 C ATOM 481 O ASP A 35 -11.505 -8.536 6.487 1.00 0.00 O ATOM 482 CB ASP A 35 -11.893 -8.171 9.191 1.00 0.00 C ATOM 483 CG ASP A 35 -10.741 -9.122 9.450 1.00 0.00 C ATOM 484 OD1 ASP A 35 -9.855 -8.776 10.258 1.00 0.00 O ATOM 485 OD2 ASP A 35 -10.726 -10.214 8.843 1.00 0.00 O ATOM 0 H ASP A 35 -11.886 -5.142 9.239 1.00 0.00 H new ATOM 0 HA ASP A 35 -10.449 -6.720 8.537 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -12.278 -7.804 10.142 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -12.705 -8.712 8.706 1.00 0.00 H new ATOM 490 N ALA A 36 -11.763 -6.357 5.992 1.00 0.00 N ATOM 491 CA ALA A 36 -11.875 -6.584 4.556 1.00 0.00 C ATOM 492 C ALA A 36 -10.536 -7.009 3.962 1.00 0.00 C ATOM 493 O ALA A 36 -9.517 -7.021 4.650 1.00 0.00 O ATOM 494 CB ALA A 36 -12.389 -5.331 3.862 1.00 0.00 C ATOM 0 H ALA A 36 -11.833 -5.378 6.271 1.00 0.00 H new ATOM 0 HA ALA A 36 -12.588 -7.393 4.395 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -12.468 -5.515 2.790 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -13.371 -5.072 4.259 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -11.697 -4.507 4.039 1.00 0.00 H new ATOM 500 N ASN A 37 -10.547 -7.357 2.679 1.00 0.00 N ATOM 501 CA ASN A 37 -9.334 -7.784 1.992 1.00 0.00 C ATOM 502 C ASN A 37 -9.038 -6.881 0.799 1.00 0.00 C ATOM 503 O ASN A 37 -9.512 -7.125 -0.311 1.00 0.00 O ATOM 504 CB ASN A 37 -9.470 -9.235 1.527 1.00 0.00 C ATOM 505 CG ASN A 37 -8.282 -9.692 0.703 1.00 0.00 C ATOM 506 OD1 ASN A 37 -8.288 -9.591 -0.524 1.00 0.00 O ATOM 507 ND2 ASN A 37 -7.254 -10.197 1.375 1.00 0.00 N ATOM 0 H ASN A 37 -11.383 -7.352 2.094 1.00 0.00 H new ATOM 0 HA ASN A 37 -8.504 -7.711 2.694 1.00 0.00 H new ATOM 0 HB2 ASN A 37 -9.577 -9.884 2.396 1.00 0.00 H new ATOM 0 HB3 ASN A 37 -10.380 -9.341 0.937 1.00 0.00 H new ATOM 0 HD21 ASN A 37 -6.426 -10.520 0.874 1.00 0.00 H new ATOM 0 HD22 ASN A 37 -7.292 -10.262 2.392 1.00 0.00 H new ATOM 514 N VAL A 38 -8.250 -5.837 1.034 1.00 0.00 N ATOM 515 CA VAL A 38 -7.888 -4.898 -0.021 1.00 0.00 C ATOM 516 C VAL A 38 -6.683 -5.396 -0.811 1.00 0.00 C ATOM 517 O VAL A 38 -5.925 -6.244 -0.339 1.00 0.00 O ATOM 518 CB VAL A 38 -7.572 -3.504 0.552 1.00 0.00 C ATOM 519 CG1 VAL A 38 -8.547 -3.150 1.665 1.00 0.00 C ATOM 520 CG2 VAL A 38 -6.137 -3.447 1.052 1.00 0.00 C ATOM 0 H VAL A 38 -7.850 -5.620 1.947 1.00 0.00 H new ATOM 0 HA VAL A 38 -8.748 -4.823 -0.686 1.00 0.00 H new ATOM 0 HB VAL A 38 -7.685 -2.769 -0.245 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -8.308 -2.162 2.057 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -9.563 -3.148 1.271 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -8.469 -3.887 2.465 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -5.931 -2.455 1.454 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -5.995 -4.192 1.835 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -5.456 -3.653 0.227 1.00 0.00 H new ATOM 530 N LYS A 39 -6.511 -4.864 -2.016 1.00 0.00 N ATOM 531 CA LYS A 39 -5.397 -5.252 -2.873 1.00 0.00 C ATOM 532 C LYS A 39 -4.472 -4.067 -3.131 1.00 0.00 C ATOM 533 O LYS A 39 -4.867 -3.084 -3.758 1.00 0.00 O ATOM 534 CB LYS A 39 -5.917 -5.806 -4.201 1.00 0.00 C ATOM 535 CG LYS A 39 -6.363 -7.256 -4.122 1.00 0.00 C ATOM 536 CD LYS A 39 -6.341 -7.921 -5.488 1.00 0.00 C ATOM 537 CE LYS A 39 -7.510 -7.466 -6.349 1.00 0.00 C ATOM 538 NZ LYS A 39 -7.559 -8.194 -7.647 1.00 0.00 N ATOM 0 H LYS A 39 -7.130 -4.162 -2.422 1.00 0.00 H new ATOM 0 HA LYS A 39 -4.830 -6.029 -2.360 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -6.755 -5.195 -4.537 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -5.134 -5.716 -4.954 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -5.711 -7.802 -3.440 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -7.370 -7.306 -3.708 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -5.404 -7.687 -5.993 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -6.377 -9.004 -5.367 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -8.443 -7.625 -5.808 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -7.428 -6.395 -6.536 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -8.369 -7.856 -8.205 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -6.679 -8.022 -8.175 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -7.663 -9.213 -7.470 1.00 0.00 H new ATOM 552 N TRP A 40 -3.240 -4.169 -2.646 1.00 0.00 N ATOM 553 CA TRP A 40 -2.258 -3.105 -2.827 1.00 0.00 C ATOM 554 C TRP A 40 -1.475 -3.301 -4.121 1.00 0.00 C ATOM 555 O TRP A 40 -0.981 -4.394 -4.400 1.00 0.00 O ATOM 556 CB TRP A 40 -1.297 -3.062 -1.637 1.00 0.00 C ATOM 557 CG TRP A 40 -1.984 -2.814 -0.328 1.00 0.00 C ATOM 558 CD1 TRP A 40 -2.663 -3.726 0.428 1.00 0.00 C ATOM 559 CD2 TRP A 40 -2.060 -1.570 0.377 1.00 0.00 C ATOM 560 NE1 TRP A 40 -3.156 -3.125 1.560 1.00 0.00 N ATOM 561 CE2 TRP A 40 -2.799 -1.802 1.553 1.00 0.00 C ATOM 562 CE3 TRP A 40 -1.573 -0.283 0.130 1.00 0.00 C ATOM 563 CZ2 TRP A 40 -3.063 -0.795 2.477 1.00 0.00 C ATOM 564 CZ3 TRP A 40 -1.836 0.715 1.049 1.00 0.00 C ATOM 565 CH2 TRP A 40 -2.575 0.455 2.211 1.00 0.00 C ATOM 0 H TRP A 40 -2.897 -4.976 -2.125 1.00 0.00 H new ATOM 0 HA TRP A 40 -2.793 -2.157 -2.888 1.00 0.00 H new ATOM 0 HB2 TRP A 40 -0.756 -4.006 -1.582 1.00 0.00 H new ATOM 0 HB3 TRP A 40 -0.557 -2.280 -1.805 1.00 0.00 H new ATOM 0 HD1 TRP A 40 -2.793 -4.767 0.173 1.00 0.00 H new ATOM 0 HE1 TRP A 40 -3.700 -3.588 2.288 1.00 0.00 H new ATOM 0 HE3 TRP A 40 -1.002 -0.073 -0.762 1.00 0.00 H new ATOM 0 HZ2 TRP A 40 -3.633 -0.994 3.373 1.00 0.00 H new ATOM 0 HZ3 TRP A 40 -1.465 1.713 0.868 1.00 0.00 H new ATOM 0 HH2 TRP A 40 -2.763 1.257 2.910 1.00 0.00 H new ATOM 576 N PHE A 41 -1.365 -2.236 -4.908 1.00 0.00 N ATOM 577 CA PHE A 41 -0.643 -2.292 -6.173 1.00 0.00 C ATOM 578 C PHE A 41 0.435 -1.213 -6.232 1.00 0.00 C ATOM 579 O PHE A 41 0.213 -0.074 -5.820 1.00 0.00 O ATOM 580 CB PHE A 41 -1.612 -2.126 -7.346 1.00 0.00 C ATOM 581 CG PHE A 41 -2.708 -3.152 -7.367 1.00 0.00 C ATOM 582 CD1 PHE A 41 -3.788 -3.050 -6.505 1.00 0.00 C ATOM 583 CD2 PHE A 41 -2.659 -4.219 -8.250 1.00 0.00 C ATOM 584 CE1 PHE A 41 -4.797 -3.994 -6.523 1.00 0.00 C ATOM 585 CE2 PHE A 41 -3.666 -5.166 -8.272 1.00 0.00 C ATOM 586 CZ PHE A 41 -4.737 -5.052 -7.408 1.00 0.00 C ATOM 0 H PHE A 41 -1.767 -1.324 -4.692 1.00 0.00 H new ATOM 0 HA PHE A 41 -0.161 -3.267 -6.245 1.00 0.00 H new ATOM 0 HB2 PHE A 41 -2.057 -1.132 -7.302 1.00 0.00 H new ATOM 0 HB3 PHE A 41 -1.053 -2.184 -8.280 1.00 0.00 H new ATOM 0 HD1 PHE A 41 -3.842 -2.224 -5.812 1.00 0.00 H new ATOM 0 HD2 PHE A 41 -1.824 -4.312 -8.929 1.00 0.00 H new ATOM 0 HE1 PHE A 41 -5.633 -3.904 -5.845 1.00 0.00 H new ATOM 0 HE2 PHE A 41 -3.615 -5.994 -8.964 1.00 0.00 H new ATOM 0 HZ PHE A 41 -5.526 -5.789 -7.424 1.00 0.00 H new ATOM 596 N LYS A 42 1.603 -1.579 -6.748 1.00 0.00 N ATOM 597 CA LYS A 42 2.716 -0.645 -6.863 1.00 0.00 C ATOM 598 C LYS A 42 2.879 -0.166 -8.302 1.00 0.00 C ATOM 599 O LYS A 42 3.583 -0.788 -9.097 1.00 0.00 O ATOM 600 CB LYS A 42 4.012 -1.302 -6.383 1.00 0.00 C ATOM 601 CG LYS A 42 5.000 -0.324 -5.770 1.00 0.00 C ATOM 602 CD LYS A 42 6.424 -0.847 -5.850 1.00 0.00 C ATOM 603 CE LYS A 42 7.112 -0.397 -7.130 1.00 0.00 C ATOM 604 NZ LYS A 42 8.298 -1.240 -7.449 1.00 0.00 N ATOM 0 H LYS A 42 1.803 -2.517 -7.094 1.00 0.00 H new ATOM 0 HA LYS A 42 2.499 0.218 -6.234 1.00 0.00 H new ATOM 0 HB2 LYS A 42 3.770 -2.069 -5.648 1.00 0.00 H new ATOM 0 HB3 LYS A 42 4.487 -1.806 -7.225 1.00 0.00 H new ATOM 0 HG2 LYS A 42 4.934 0.634 -6.286 1.00 0.00 H new ATOM 0 HG3 LYS A 42 4.736 -0.143 -4.728 1.00 0.00 H new ATOM 0 HD2 LYS A 42 6.991 -0.495 -4.988 1.00 0.00 H new ATOM 0 HD3 LYS A 42 6.416 -1.936 -5.803 1.00 0.00 H new ATOM 0 HE2 LYS A 42 6.403 -0.439 -7.957 1.00 0.00 H new ATOM 0 HE3 LYS A 42 7.422 0.643 -7.029 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 9.150 -0.644 -7.476 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 8.410 -1.972 -6.719 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 8.163 -1.693 -8.375 1.00 0.00 H new ATOM 618 N ASN A 43 2.224 0.943 -8.630 1.00 0.00 N ATOM 619 CA ASN A 43 2.297 1.505 -9.974 1.00 0.00 C ATOM 620 C ASN A 43 1.528 0.640 -10.968 1.00 0.00 C ATOM 621 O ASN A 43 1.920 0.509 -12.126 1.00 0.00 O ATOM 622 CB ASN A 43 3.756 1.635 -10.416 1.00 0.00 C ATOM 623 CG ASN A 43 3.964 2.777 -11.392 1.00 0.00 C ATOM 624 OD1 ASN A 43 3.105 3.058 -12.228 1.00 0.00 O ATOM 625 ND2 ASN A 43 5.109 3.441 -11.289 1.00 0.00 N ATOM 0 H ASN A 43 1.637 1.470 -7.984 1.00 0.00 H new ATOM 0 HA ASN A 43 1.841 2.495 -9.952 1.00 0.00 H new ATOM 0 HB2 ASN A 43 4.386 1.790 -9.540 1.00 0.00 H new ATOM 0 HB3 ASN A 43 4.077 0.702 -10.879 1.00 0.00 H new ATOM 0 HD21 ASN A 43 5.306 4.219 -11.918 1.00 0.00 H new ATOM 0 HD22 ASN A 43 5.792 3.173 -10.581 1.00 0.00 H new ATOM 632 N GLY A 44 0.429 0.051 -10.505 1.00 0.00 N ATOM 633 CA GLY A 44 -0.378 -0.794 -11.366 1.00 0.00 C ATOM 634 C GLY A 44 -0.116 -2.270 -11.142 1.00 0.00 C ATOM 635 O GLY A 44 -1.007 -3.099 -11.323 1.00 0.00 O ATOM 0 H GLY A 44 0.084 0.144 -9.550 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -1.433 -0.585 -11.189 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -0.174 -0.546 -12.408 1.00 0.00 H new ATOM 639 N GLU A 45 1.110 -2.598 -10.747 1.00 0.00 N ATOM 640 CA GLU A 45 1.487 -3.985 -10.500 1.00 0.00 C ATOM 641 C GLU A 45 0.845 -4.503 -9.217 1.00 0.00 C ATOM 642 O GLU A 45 0.590 -3.739 -8.286 1.00 0.00 O ATOM 643 CB GLU A 45 3.009 -4.115 -10.411 1.00 0.00 C ATOM 644 CG GLU A 45 3.556 -3.915 -9.008 1.00 0.00 C ATOM 645 CD GLU A 45 5.067 -3.787 -8.983 1.00 0.00 C ATOM 646 OE1 GLU A 45 5.680 -3.779 -10.071 1.00 0.00 O ATOM 647 OE2 GLU A 45 5.635 -3.693 -7.875 1.00 0.00 O ATOM 0 H GLU A 45 1.859 -1.923 -10.591 1.00 0.00 H new ATOM 0 HA GLU A 45 1.127 -4.587 -11.334 1.00 0.00 H new ATOM 0 HB2 GLU A 45 3.302 -5.102 -10.769 1.00 0.00 H new ATOM 0 HB3 GLU A 45 3.467 -3.385 -11.078 1.00 0.00 H new ATOM 0 HG2 GLU A 45 3.112 -3.019 -8.573 1.00 0.00 H new ATOM 0 HG3 GLU A 45 3.256 -4.755 -8.382 1.00 0.00 H new ATOM 654 N GLU A 46 0.587 -5.806 -9.175 1.00 0.00 N ATOM 655 CA GLU A 46 -0.027 -6.426 -8.006 1.00 0.00 C ATOM 656 C GLU A 46 1.038 -6.922 -7.032 1.00 0.00 C ATOM 657 O GLU A 46 1.955 -7.648 -7.415 1.00 0.00 O ATOM 658 CB GLU A 46 -0.927 -7.588 -8.431 1.00 0.00 C ATOM 659 CG GLU A 46 -1.464 -8.399 -7.264 1.00 0.00 C ATOM 660 CD GLU A 46 -2.690 -9.211 -7.634 1.00 0.00 C ATOM 661 OE1 GLU A 46 -3.385 -8.830 -8.599 1.00 0.00 O ATOM 662 OE2 GLU A 46 -2.955 -10.228 -6.959 1.00 0.00 O ATOM 0 H GLU A 46 0.793 -6.453 -9.936 1.00 0.00 H new ATOM 0 HA GLU A 46 -0.633 -5.673 -7.502 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -1.765 -7.196 -9.006 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -0.366 -8.247 -9.094 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -0.684 -9.069 -6.903 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -1.712 -7.727 -6.443 1.00 0.00 H new ATOM 669 N ILE A 47 0.908 -6.523 -5.771 1.00 0.00 N ATOM 670 CA ILE A 47 1.858 -6.927 -4.741 1.00 0.00 C ATOM 671 C ILE A 47 1.423 -8.227 -4.072 1.00 0.00 C ATOM 672 O ILE A 47 0.253 -8.400 -3.732 1.00 0.00 O ATOM 673 CB ILE A 47 2.019 -5.837 -3.665 1.00 0.00 C ATOM 674 CG1 ILE A 47 2.620 -4.570 -4.277 1.00 0.00 C ATOM 675 CG2 ILE A 47 2.888 -6.344 -2.524 1.00 0.00 C ATOM 676 CD1 ILE A 47 2.838 -3.460 -3.274 1.00 0.00 C ATOM 0 H ILE A 47 0.155 -5.921 -5.438 1.00 0.00 H new ATOM 0 HA ILE A 47 2.816 -7.080 -5.237 1.00 0.00 H new ATOM 0 HB ILE A 47 1.035 -5.593 -3.266 1.00 0.00 H new ATOM 0 HG12 ILE A 47 3.573 -4.819 -4.744 1.00 0.00 H new ATOM 0 HG13 ILE A 47 1.961 -4.210 -5.068 1.00 0.00 H new ATOM 0 HG21 ILE A 47 2.993 -5.563 -1.771 1.00 0.00 H new ATOM 0 HG22 ILE A 47 2.423 -7.221 -2.074 1.00 0.00 H new ATOM 0 HG23 ILE A 47 3.872 -6.612 -2.908 1.00 0.00 H new ATOM 0 HD11 ILE A 47 3.266 -2.593 -3.778 1.00 0.00 H new ATOM 0 HD12 ILE A 47 1.884 -3.184 -2.824 1.00 0.00 H new ATOM 0 HD13 ILE A 47 3.521 -3.802 -2.496 1.00 0.00 H new ATOM 688 N ILE A 48 2.374 -9.136 -3.885 1.00 0.00 N ATOM 689 CA ILE A 48 2.090 -10.418 -3.253 1.00 0.00 C ATOM 690 C ILE A 48 2.997 -10.651 -2.049 1.00 0.00 C ATOM 691 O ILE A 48 4.123 -11.133 -2.173 1.00 0.00 O ATOM 692 CB ILE A 48 2.263 -11.584 -4.244 1.00 0.00 C ATOM 693 CG1 ILE A 48 1.374 -11.375 -5.472 1.00 0.00 C ATOM 694 CG2 ILE A 48 1.937 -12.907 -3.567 1.00 0.00 C ATOM 695 CD1 ILE A 48 -0.105 -11.485 -5.173 1.00 0.00 C ATOM 0 H ILE A 48 3.347 -9.008 -4.162 1.00 0.00 H new ATOM 0 HA ILE A 48 1.052 -10.383 -2.922 1.00 0.00 H new ATOM 0 HB ILE A 48 3.302 -11.612 -4.572 1.00 0.00 H new ATOM 0 HG12 ILE A 48 1.579 -10.392 -5.896 1.00 0.00 H new ATOM 0 HG13 ILE A 48 1.639 -12.111 -6.232 1.00 0.00 H new ATOM 0 HG21 ILE A 48 2.064 -13.722 -4.280 1.00 0.00 H new ATOM 0 HG22 ILE A 48 2.607 -13.058 -2.721 1.00 0.00 H new ATOM 0 HG23 ILE A 48 0.906 -12.891 -3.214 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -0.674 -11.326 -6.089 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -0.324 -12.477 -4.778 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -0.384 -10.731 -4.437 1.00 0.00 H new ATOM 707 N PRO A 49 2.496 -10.302 -0.855 1.00 0.00 N ATOM 708 CA PRO A 49 3.243 -10.466 0.396 1.00 0.00 C ATOM 709 C PRO A 49 3.409 -11.931 0.784 1.00 0.00 C ATOM 710 O PRO A 49 3.100 -12.829 0.002 1.00 0.00 O ATOM 711 CB PRO A 49 2.377 -9.735 1.425 1.00 0.00 C ATOM 712 CG PRO A 49 0.999 -9.780 0.861 1.00 0.00 C ATOM 713 CD PRO A 49 1.161 -9.721 -0.633 1.00 0.00 C ATOM 0 HA PRO A 49 4.258 -10.076 0.319 1.00 0.00 H new ATOM 0 HB2 PRO A 49 2.422 -10.223 2.399 1.00 0.00 H new ATOM 0 HB3 PRO A 49 2.713 -8.708 1.567 1.00 0.00 H new ATOM 0 HG2 PRO A 49 0.484 -10.692 1.162 1.00 0.00 H new ATOM 0 HG3 PRO A 49 0.402 -8.943 1.222 1.00 0.00 H new ATOM 0 HD2 PRO A 49 0.385 -10.291 -1.144 1.00 0.00 H new ATOM 0 HD3 PRO A 49 1.102 -8.698 -1.003 1.00 0.00 H new ATOM 721 N GLY A 50 3.900 -12.165 1.997 1.00 0.00 N ATOM 722 CA GLY A 50 4.098 -13.524 2.468 1.00 0.00 C ATOM 723 C GLY A 50 5.290 -13.647 3.396 1.00 0.00 C ATOM 724 O GLY A 50 5.844 -12.653 3.865 1.00 0.00 O ATOM 0 H GLY A 50 4.164 -11.438 2.662 1.00 0.00 H new ATOM 0 HA2 GLY A 50 3.201 -13.860 2.988 1.00 0.00 H new ATOM 0 HA3 GLY A 50 4.237 -14.185 1.613 1.00 0.00 H new ATOM 728 N PRO A 51 5.701 -14.893 3.675 1.00 0.00 N ATOM 729 CA PRO A 51 6.838 -15.173 4.556 1.00 0.00 C ATOM 730 C PRO A 51 8.169 -14.769 3.932 1.00 0.00 C ATOM 731 O PRO A 51 8.493 -15.176 2.816 1.00 0.00 O ATOM 732 CB PRO A 51 6.775 -16.691 4.746 1.00 0.00 C ATOM 733 CG PRO A 51 6.072 -17.195 3.533 1.00 0.00 C ATOM 734 CD PRO A 51 5.087 -16.125 3.150 1.00 0.00 C ATOM 0 HA PRO A 51 6.779 -14.610 5.488 1.00 0.00 H new ATOM 0 HB2 PRO A 51 7.773 -17.121 4.833 1.00 0.00 H new ATOM 0 HB3 PRO A 51 6.234 -16.954 5.655 1.00 0.00 H new ATOM 0 HG2 PRO A 51 6.777 -17.384 2.724 1.00 0.00 H new ATOM 0 HG3 PRO A 51 5.564 -18.137 3.740 1.00 0.00 H new ATOM 0 HD2 PRO A 51 4.947 -16.076 2.070 1.00 0.00 H new ATOM 0 HD3 PRO A 51 4.106 -16.305 3.591 1.00 0.00 H new ATOM 742 N LYS A 52 8.939 -13.966 4.658 1.00 0.00 N ATOM 743 CA LYS A 52 10.236 -13.507 4.177 1.00 0.00 C ATOM 744 C LYS A 52 10.077 -12.617 2.948 1.00 0.00 C ATOM 745 O LYS A 52 10.870 -12.691 2.009 1.00 0.00 O ATOM 746 CB LYS A 52 11.131 -14.703 3.841 1.00 0.00 C ATOM 747 CG LYS A 52 11.302 -15.676 4.994 1.00 0.00 C ATOM 748 CD LYS A 52 12.437 -16.653 4.734 1.00 0.00 C ATOM 749 CE LYS A 52 12.011 -17.764 3.786 1.00 0.00 C ATOM 750 NZ LYS A 52 12.087 -17.336 2.361 1.00 0.00 N ATOM 0 H LYS A 52 8.686 -13.619 5.583 1.00 0.00 H new ATOM 0 HA LYS A 52 10.703 -12.922 4.970 1.00 0.00 H new ATOM 0 HB2 LYS A 52 10.709 -15.234 2.988 1.00 0.00 H new ATOM 0 HB3 LYS A 52 12.112 -14.338 3.536 1.00 0.00 H new ATOM 0 HG2 LYS A 52 11.500 -15.123 5.912 1.00 0.00 H new ATOM 0 HG3 LYS A 52 10.374 -16.227 5.147 1.00 0.00 H new ATOM 0 HD2 LYS A 52 13.288 -16.119 4.311 1.00 0.00 H new ATOM 0 HD3 LYS A 52 12.769 -17.086 5.678 1.00 0.00 H new ATOM 0 HE2 LYS A 52 12.648 -18.635 3.938 1.00 0.00 H new ATOM 0 HE3 LYS A 52 10.991 -18.070 4.020 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 11.133 -17.110 2.015 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 12.692 -16.493 2.283 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 12.490 -18.105 1.789 1.00 0.00 H new ATOM 764 N SER A 53 9.049 -11.775 2.962 1.00 0.00 N ATOM 765 CA SER A 53 8.785 -10.872 1.848 1.00 0.00 C ATOM 766 C SER A 53 9.039 -9.422 2.251 1.00 0.00 C ATOM 767 O SER A 53 9.086 -9.096 3.437 1.00 0.00 O ATOM 768 CB SER A 53 7.343 -11.033 1.364 1.00 0.00 C ATOM 769 OG SER A 53 7.075 -12.376 0.998 1.00 0.00 O ATOM 0 H SER A 53 8.385 -11.699 3.733 1.00 0.00 H new ATOM 0 HA SER A 53 9.465 -11.129 1.036 1.00 0.00 H new ATOM 0 HB2 SER A 53 6.655 -10.723 2.151 1.00 0.00 H new ATOM 0 HB3 SER A 53 7.167 -10.378 0.511 1.00 0.00 H new ATOM 0 HG SER A 53 6.147 -12.453 0.694 1.00 0.00 H new ATOM 775 N ARG A 54 9.201 -8.558 1.256 1.00 0.00 N ATOM 776 CA ARG A 54 9.451 -7.143 1.505 1.00 0.00 C ATOM 777 C ARG A 54 8.168 -6.429 1.920 1.00 0.00 C ATOM 778 O ARG A 54 8.158 -5.653 2.876 1.00 0.00 O ATOM 779 CB ARG A 54 10.038 -6.479 0.258 1.00 0.00 C ATOM 780 CG ARG A 54 11.526 -6.730 0.077 1.00 0.00 C ATOM 781 CD ARG A 54 12.121 -5.811 -0.979 1.00 0.00 C ATOM 782 NE ARG A 54 11.994 -6.369 -2.323 1.00 0.00 N ATOM 783 CZ ARG A 54 12.692 -7.414 -2.754 1.00 0.00 C ATOM 784 NH1 ARG A 54 13.561 -8.011 -1.951 1.00 0.00 N ATOM 785 NH2 ARG A 54 12.521 -7.863 -3.991 1.00 0.00 N ATOM 0 H ARG A 54 9.164 -8.812 0.269 1.00 0.00 H new ATOM 0 HA ARG A 54 10.169 -7.065 2.321 1.00 0.00 H new ATOM 0 HB2 ARG A 54 9.507 -6.844 -0.621 1.00 0.00 H new ATOM 0 HB3 ARG A 54 9.864 -5.404 0.313 1.00 0.00 H new ATOM 0 HG2 ARG A 54 12.040 -6.577 1.026 1.00 0.00 H new ATOM 0 HG3 ARG A 54 11.689 -7.769 -0.210 1.00 0.00 H new ATOM 0 HD2 ARG A 54 11.622 -4.843 -0.940 1.00 0.00 H new ATOM 0 HD3 ARG A 54 13.174 -5.637 -0.757 1.00 0.00 H new ATOM 0 HE ARG A 54 11.333 -5.932 -2.966 1.00 0.00 H new ATOM 0 HH11 ARG A 54 13.695 -7.668 -1.000 1.00 0.00 H new ATOM 0 HH12 ARG A 54 14.096 -8.813 -2.284 1.00 0.00 H new ATOM 0 HH21 ARG A 54 11.853 -7.406 -4.612 1.00 0.00 H new ATOM 0 HH22 ARG A 54 13.057 -8.665 -4.321 1.00 0.00 H new ATOM 799 N TYR A 55 7.088 -6.696 1.194 1.00 0.00 N ATOM 800 CA TYR A 55 5.801 -6.076 1.483 1.00 0.00 C ATOM 801 C TYR A 55 4.994 -6.928 2.459 1.00 0.00 C ATOM 802 O TYR A 55 4.948 -8.152 2.341 1.00 0.00 O ATOM 803 CB TYR A 55 5.007 -5.872 0.192 1.00 0.00 C ATOM 804 CG TYR A 55 5.795 -5.183 -0.900 1.00 0.00 C ATOM 805 CD1 TYR A 55 5.943 -3.802 -0.911 1.00 0.00 C ATOM 806 CD2 TYR A 55 6.389 -5.914 -1.921 1.00 0.00 C ATOM 807 CE1 TYR A 55 6.661 -3.168 -1.907 1.00 0.00 C ATOM 808 CE2 TYR A 55 7.111 -5.289 -2.920 1.00 0.00 C ATOM 809 CZ TYR A 55 7.243 -3.916 -2.909 1.00 0.00 C ATOM 810 OH TYR A 55 7.960 -3.290 -3.903 1.00 0.00 O ATOM 0 H TYR A 55 7.079 -7.338 0.401 1.00 0.00 H new ATOM 0 HA TYR A 55 5.989 -5.106 1.943 1.00 0.00 H new ATOM 0 HB2 TYR A 55 4.667 -6.841 -0.173 1.00 0.00 H new ATOM 0 HB3 TYR A 55 4.116 -5.284 0.412 1.00 0.00 H new ATOM 0 HD1 TYR A 55 5.489 -3.213 -0.127 1.00 0.00 H new ATOM 0 HD2 TYR A 55 6.285 -6.989 -1.934 1.00 0.00 H new ATOM 0 HE1 TYR A 55 6.766 -2.093 -1.901 1.00 0.00 H new ATOM 0 HE2 TYR A 55 7.569 -5.872 -3.705 1.00 0.00 H new ATOM 0 HH TYR A 55 8.445 -2.527 -3.525 1.00 0.00 H new ATOM 820 N ARG A 56 4.359 -6.269 3.424 1.00 0.00 N ATOM 821 CA ARG A 56 3.555 -6.964 4.421 1.00 0.00 C ATOM 822 C ARG A 56 2.226 -6.247 4.644 1.00 0.00 C ATOM 823 O ARG A 56 2.182 -5.173 5.243 1.00 0.00 O ATOM 824 CB ARG A 56 4.319 -7.066 5.743 1.00 0.00 C ATOM 825 CG ARG A 56 5.767 -7.494 5.578 1.00 0.00 C ATOM 826 CD ARG A 56 6.645 -6.929 6.683 1.00 0.00 C ATOM 827 NE ARG A 56 6.168 -7.310 8.010 1.00 0.00 N ATOM 828 CZ ARG A 56 6.344 -8.517 8.536 1.00 0.00 C ATOM 829 NH1 ARG A 56 6.984 -9.455 7.851 1.00 0.00 N ATOM 830 NH2 ARG A 56 5.881 -8.788 9.749 1.00 0.00 N ATOM 0 H ARG A 56 4.386 -5.255 3.536 1.00 0.00 H new ATOM 0 HA ARG A 56 3.349 -7.968 4.049 1.00 0.00 H new ATOM 0 HB2 ARG A 56 4.290 -6.099 6.245 1.00 0.00 H new ATOM 0 HB3 ARG A 56 3.810 -7.778 6.393 1.00 0.00 H new ATOM 0 HG2 ARG A 56 5.829 -8.582 5.584 1.00 0.00 H new ATOM 0 HG3 ARG A 56 6.138 -7.159 4.610 1.00 0.00 H new ATOM 0 HD2 ARG A 56 7.667 -7.283 6.550 1.00 0.00 H new ATOM 0 HD3 ARG A 56 6.671 -5.842 6.605 1.00 0.00 H new ATOM 0 HE ARG A 56 5.673 -6.611 8.563 1.00 0.00 H new ATOM 0 HH11 ARG A 56 7.342 -9.250 6.918 1.00 0.00 H new ATOM 0 HH12 ARG A 56 7.118 -10.381 8.257 1.00 0.00 H new ATOM 0 HH21 ARG A 56 5.389 -8.069 10.279 1.00 0.00 H new ATOM 0 HH22 ARG A 56 6.017 -9.715 10.151 1.00 0.00 H new ATOM 844 N ILE A 57 1.147 -6.849 4.156 1.00 0.00 N ATOM 845 CA ILE A 57 -0.182 -6.269 4.302 1.00 0.00 C ATOM 846 C ILE A 57 -0.854 -6.748 5.584 1.00 0.00 C ATOM 847 O ILE A 57 -1.188 -7.925 5.720 1.00 0.00 O ATOM 848 CB ILE A 57 -1.084 -6.617 3.102 1.00 0.00 C ATOM 849 CG1 ILE A 57 -0.494 -6.048 1.811 1.00 0.00 C ATOM 850 CG2 ILE A 57 -2.492 -6.087 3.327 1.00 0.00 C ATOM 851 CD1 ILE A 57 -0.878 -6.830 0.574 1.00 0.00 C ATOM 0 H ILE A 57 1.167 -7.738 3.656 1.00 0.00 H new ATOM 0 HA ILE A 57 -0.050 -5.188 4.346 1.00 0.00 H new ATOM 0 HB ILE A 57 -1.136 -7.702 3.008 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -0.823 -5.015 1.695 1.00 0.00 H new ATOM 0 HG13 ILE A 57 0.593 -6.028 1.896 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -3.117 -6.341 2.471 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -2.910 -6.536 4.228 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -2.459 -5.004 3.444 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -0.424 -6.369 -0.303 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -0.525 -7.857 0.668 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -1.962 -6.828 0.465 1.00 0.00 H new ATOM 863 N ARG A 58 -1.051 -5.827 6.522 1.00 0.00 N ATOM 864 CA ARG A 58 -1.684 -6.156 7.794 1.00 0.00 C ATOM 865 C ARG A 58 -3.094 -5.577 7.865 1.00 0.00 C ATOM 866 O ARG A 58 -3.376 -4.528 7.286 1.00 0.00 O ATOM 867 CB ARG A 58 -0.844 -5.626 8.958 1.00 0.00 C ATOM 868 CG ARG A 58 -1.554 -5.691 10.300 1.00 0.00 C ATOM 869 CD ARG A 58 -0.741 -5.015 11.393 1.00 0.00 C ATOM 870 NE ARG A 58 0.468 -5.766 11.721 1.00 0.00 N ATOM 871 CZ ARG A 58 1.417 -5.312 12.532 1.00 0.00 C ATOM 872 NH1 ARG A 58 1.299 -4.118 13.094 1.00 0.00 N ATOM 873 NH2 ARG A 58 2.488 -6.055 12.781 1.00 0.00 N ATOM 0 H ARG A 58 -0.782 -4.848 6.425 1.00 0.00 H new ATOM 0 HA ARG A 58 -1.751 -7.241 7.868 1.00 0.00 H new ATOM 0 HB2 ARG A 58 0.081 -6.199 9.018 1.00 0.00 H new ATOM 0 HB3 ARG A 58 -0.566 -4.592 8.753 1.00 0.00 H new ATOM 0 HG2 ARG A 58 -2.529 -5.211 10.221 1.00 0.00 H new ATOM 0 HG3 ARG A 58 -1.732 -6.732 10.569 1.00 0.00 H new ATOM 0 HD2 ARG A 58 -0.467 -4.010 11.072 1.00 0.00 H new ATOM 0 HD3 ARG A 58 -1.355 -4.908 12.287 1.00 0.00 H new ATOM 0 HE ARG A 58 0.590 -6.689 11.305 1.00 0.00 H new ATOM 0 HH11 ARG A 58 0.477 -3.544 12.904 1.00 0.00 H new ATOM 0 HH12 ARG A 58 2.030 -3.773 13.716 1.00 0.00 H new ATOM 0 HH21 ARG A 58 2.582 -6.974 12.350 1.00 0.00 H new ATOM 0 HH22 ARG A 58 3.217 -5.707 13.404 1.00 0.00 H new ATOM 887 N VAL A 59 -3.977 -6.268 8.579 1.00 0.00 N ATOM 888 CA VAL A 59 -5.357 -5.823 8.727 1.00 0.00 C ATOM 889 C VAL A 59 -5.688 -5.534 10.187 1.00 0.00 C ATOM 890 O VAL A 59 -5.673 -6.434 11.026 1.00 0.00 O ATOM 891 CB VAL A 59 -6.346 -6.872 8.185 1.00 0.00 C ATOM 892 CG1 VAL A 59 -7.781 -6.431 8.433 1.00 0.00 C ATOM 893 CG2 VAL A 59 -6.103 -7.118 6.704 1.00 0.00 C ATOM 0 H VAL A 59 -3.761 -7.139 9.064 1.00 0.00 H new ATOM 0 HA VAL A 59 -5.458 -4.906 8.147 1.00 0.00 H new ATOM 0 HB VAL A 59 -6.182 -7.809 8.717 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -8.466 -7.184 8.043 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -7.945 -6.311 9.504 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -7.962 -5.481 7.930 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -6.811 -7.862 6.338 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -6.238 -6.187 6.154 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -5.086 -7.482 6.558 1.00 0.00 H new ATOM 903 N GLU A 60 -5.988 -4.273 10.482 1.00 0.00 N ATOM 904 CA GLU A 60 -6.323 -3.866 11.841 1.00 0.00 C ATOM 905 C GLU A 60 -7.706 -3.225 11.892 1.00 0.00 C ATOM 906 O GLU A 60 -7.900 -2.102 11.427 1.00 0.00 O ATOM 907 CB GLU A 60 -5.275 -2.888 12.377 1.00 0.00 C ATOM 908 CG GLU A 60 -4.101 -3.567 13.060 1.00 0.00 C ATOM 909 CD GLU A 60 -4.528 -4.446 14.220 1.00 0.00 C ATOM 910 OE1 GLU A 60 -5.101 -3.908 15.191 1.00 0.00 O ATOM 911 OE2 GLU A 60 -4.291 -5.670 14.157 1.00 0.00 O ATOM 0 H GLU A 60 -6.006 -3.516 9.798 1.00 0.00 H new ATOM 0 HA GLU A 60 -6.332 -4.758 12.468 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -4.903 -2.280 11.552 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -5.752 -2.209 13.084 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -3.561 -4.171 12.331 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -3.407 -2.808 13.421 1.00 0.00 H new ATOM 918 N GLY A 61 -8.667 -3.947 12.461 1.00 0.00 N ATOM 919 CA GLY A 61 -10.021 -3.434 12.562 1.00 0.00 C ATOM 920 C GLY A 61 -10.631 -3.139 11.206 1.00 0.00 C ATOM 921 O GLY A 61 -10.916 -4.053 10.432 1.00 0.00 O ATOM 0 H GLY A 61 -8.532 -4.878 12.854 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -10.643 -4.159 13.087 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -10.018 -2.524 13.161 1.00 0.00 H new ATOM 925 N LYS A 62 -10.835 -1.858 10.917 1.00 0.00 N ATOM 926 CA LYS A 62 -11.416 -1.443 9.646 1.00 0.00 C ATOM 927 C LYS A 62 -10.425 -0.610 8.840 1.00 0.00 C ATOM 928 O LYS A 62 -10.803 0.083 7.896 1.00 0.00 O ATOM 929 CB LYS A 62 -12.697 -0.640 9.885 1.00 0.00 C ATOM 930 CG LYS A 62 -13.666 -1.312 10.843 1.00 0.00 C ATOM 931 CD LYS A 62 -14.837 -0.403 11.179 1.00 0.00 C ATOM 932 CE LYS A 62 -15.889 -0.421 10.082 1.00 0.00 C ATOM 933 NZ LYS A 62 -17.184 0.151 10.545 1.00 0.00 N ATOM 0 H LYS A 62 -10.606 -1.089 11.547 1.00 0.00 H new ATOM 0 HA LYS A 62 -11.657 -2.340 9.076 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -12.433 0.342 10.278 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -13.197 -0.477 8.930 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -14.037 -2.236 10.399 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -13.143 -1.586 11.759 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -15.286 -0.719 12.120 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -14.478 0.616 11.324 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -15.528 0.146 9.224 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -16.045 -1.446 9.745 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -17.875 0.121 9.768 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -17.542 -0.405 11.348 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -17.041 1.137 10.843 1.00 0.00 H new ATOM 947 N LYS A 63 -9.153 -0.685 9.217 1.00 0.00 N ATOM 948 CA LYS A 63 -8.105 0.060 8.528 1.00 0.00 C ATOM 949 C LYS A 63 -6.920 -0.844 8.203 1.00 0.00 C ATOM 950 O LYS A 63 -6.473 -1.625 9.043 1.00 0.00 O ATOM 951 CB LYS A 63 -7.641 1.239 9.386 1.00 0.00 C ATOM 952 CG LYS A 63 -6.494 0.897 10.320 1.00 0.00 C ATOM 953 CD LYS A 63 -6.338 1.938 11.416 1.00 0.00 C ATOM 954 CE LYS A 63 -7.357 1.736 12.527 1.00 0.00 C ATOM 955 NZ LYS A 63 -7.308 2.834 13.531 1.00 0.00 N ATOM 0 H LYS A 63 -8.823 -1.254 9.996 1.00 0.00 H new ATOM 0 HA LYS A 63 -8.517 0.439 7.593 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -7.335 2.055 8.732 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -8.483 1.602 9.976 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -6.668 -0.081 10.768 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -5.568 0.826 9.750 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -5.331 1.883 11.830 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -6.454 2.935 10.991 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -8.357 1.682 12.097 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -7.171 0.783 13.022 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -8.017 2.659 14.271 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -6.361 2.870 13.960 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -7.511 3.741 13.064 1.00 0.00 H new ATOM 969 N HIS A 64 -6.413 -0.730 6.979 1.00 0.00 N ATOM 970 CA HIS A 64 -5.278 -1.535 6.544 1.00 0.00 C ATOM 971 C HIS A 64 -3.974 -0.755 6.681 1.00 0.00 C ATOM 972 O HIS A 64 -3.985 0.463 6.862 1.00 0.00 O ATOM 973 CB HIS A 64 -5.468 -1.983 5.095 1.00 0.00 C ATOM 974 CG HIS A 64 -6.592 -2.956 4.911 1.00 0.00 C ATOM 975 ND1 HIS A 64 -6.421 -4.208 4.358 1.00 0.00 N ATOM 976 CD2 HIS A 64 -7.908 -2.856 5.212 1.00 0.00 C ATOM 977 CE1 HIS A 64 -7.583 -4.835 4.326 1.00 0.00 C ATOM 978 NE2 HIS A 64 -8.502 -4.036 4.839 1.00 0.00 N ATOM 0 H HIS A 64 -6.771 -0.088 6.272 1.00 0.00 H new ATOM 0 HA HIS A 64 -5.223 -2.416 7.184 1.00 0.00 H new ATOM 0 HB2 HIS A 64 -5.652 -1.107 4.474 1.00 0.00 H new ATOM 0 HB3 HIS A 64 -4.543 -2.437 4.740 1.00 0.00 H new ATOM 0 HD2 HIS A 64 -8.399 -2.006 5.662 1.00 0.00 H new ATOM 0 HE1 HIS A 64 -7.753 -5.831 3.945 1.00 0.00 H new ATOM 0 HE2 HIS A 64 -9.492 -4.260 4.941 1.00 0.00 H new ATOM 987 N ILE A 65 -2.854 -1.464 6.594 1.00 0.00 N ATOM 988 CA ILE A 65 -1.543 -0.837 6.707 1.00 0.00 C ATOM 989 C ILE A 65 -0.500 -1.590 5.888 1.00 0.00 C ATOM 990 O ILE A 65 -0.140 -2.723 6.212 1.00 0.00 O ATOM 991 CB ILE A 65 -1.076 -0.769 8.173 1.00 0.00 C ATOM 992 CG1 ILE A 65 -2.068 0.042 9.010 1.00 0.00 C ATOM 993 CG2 ILE A 65 0.317 -0.163 8.258 1.00 0.00 C ATOM 994 CD1 ILE A 65 -3.250 -0.766 9.498 1.00 0.00 C ATOM 0 H ILE A 65 -2.828 -2.473 6.446 1.00 0.00 H new ATOM 0 HA ILE A 65 -1.644 0.176 6.318 1.00 0.00 H new ATOM 0 HB ILE A 65 -1.035 -1.782 8.573 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -1.546 0.463 9.870 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -2.432 0.880 8.416 1.00 0.00 H new ATOM 0 HG21 ILE A 65 0.633 -0.122 9.300 1.00 0.00 H new ATOM 0 HG22 ILE A 65 1.016 -0.777 7.691 1.00 0.00 H new ATOM 0 HG23 ILE A 65 0.301 0.845 7.844 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -3.911 -0.127 10.084 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -3.796 -1.165 8.643 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -2.897 -1.589 10.119 1.00 0.00 H new ATOM 1006 N LEU A 66 -0.018 -0.954 4.826 1.00 0.00 N ATOM 1007 CA LEU A 66 0.986 -1.563 3.960 1.00 0.00 C ATOM 1008 C LEU A 66 2.388 -1.092 4.336 1.00 0.00 C ATOM 1009 O LEU A 66 2.772 0.040 4.042 1.00 0.00 O ATOM 1010 CB LEU A 66 0.698 -1.226 2.496 1.00 0.00 C ATOM 1011 CG LEU A 66 1.724 -1.724 1.478 1.00 0.00 C ATOM 1012 CD1 LEU A 66 1.674 -3.240 1.369 1.00 0.00 C ATOM 1013 CD2 LEU A 66 1.483 -1.082 0.120 1.00 0.00 C ATOM 0 H LEU A 66 -0.306 -0.017 4.544 1.00 0.00 H new ATOM 0 HA LEU A 66 0.938 -2.644 4.094 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -0.275 -1.641 2.233 1.00 0.00 H new ATOM 0 HB3 LEU A 66 0.619 -0.143 2.402 1.00 0.00 H new ATOM 0 HG LEU A 66 2.718 -1.437 1.822 1.00 0.00 H new ATOM 0 HD11 LEU A 66 2.411 -3.577 0.640 1.00 0.00 H new ATOM 0 HD12 LEU A 66 1.896 -3.682 2.340 1.00 0.00 H new ATOM 0 HD13 LEU A 66 0.679 -3.549 1.049 1.00 0.00 H new ATOM 0 HD21 LEU A 66 2.223 -1.448 -0.592 1.00 0.00 H new ATOM 0 HD22 LEU A 66 0.483 -1.338 -0.231 1.00 0.00 H new ATOM 0 HD23 LEU A 66 1.570 0.001 0.209 1.00 0.00 H new ATOM 1025 N ILE A 67 3.146 -1.968 4.986 1.00 0.00 N ATOM 1026 CA ILE A 67 4.506 -1.643 5.398 1.00 0.00 C ATOM 1027 C ILE A 67 5.522 -2.118 4.366 1.00 0.00 C ATOM 1028 O ILE A 67 5.385 -3.202 3.798 1.00 0.00 O ATOM 1029 CB ILE A 67 4.845 -2.271 6.763 1.00 0.00 C ATOM 1030 CG1 ILE A 67 6.284 -1.934 7.160 1.00 0.00 C ATOM 1031 CG2 ILE A 67 4.642 -3.778 6.718 1.00 0.00 C ATOM 1032 CD1 ILE A 67 7.317 -2.821 6.500 1.00 0.00 C ATOM 0 H ILE A 67 2.842 -2.908 5.239 1.00 0.00 H new ATOM 0 HA ILE A 67 4.559 -0.558 5.483 1.00 0.00 H new ATOM 0 HB ILE A 67 4.173 -1.856 7.514 1.00 0.00 H new ATOM 0 HG12 ILE A 67 6.490 -0.895 6.901 1.00 0.00 H new ATOM 0 HG13 ILE A 67 6.383 -2.018 8.242 1.00 0.00 H new ATOM 0 HG21 ILE A 67 4.886 -4.207 7.690 1.00 0.00 H new ATOM 0 HG22 ILE A 67 3.603 -3.998 6.474 1.00 0.00 H new ATOM 0 HG23 ILE A 67 5.292 -4.210 5.957 1.00 0.00 H new ATOM 0 HD11 ILE A 67 8.314 -2.525 6.827 1.00 0.00 H new ATOM 0 HD12 ILE A 67 7.137 -3.859 6.779 1.00 0.00 H new ATOM 0 HD13 ILE A 67 7.246 -2.719 5.417 1.00 0.00 H new ATOM 1044 N ILE A 68 6.543 -1.301 4.129 1.00 0.00 N ATOM 1045 CA ILE A 68 7.584 -1.640 3.167 1.00 0.00 C ATOM 1046 C ILE A 68 8.960 -1.648 3.825 1.00 0.00 C ATOM 1047 O ILE A 68 9.400 -0.640 4.377 1.00 0.00 O ATOM 1048 CB ILE A 68 7.600 -0.654 1.984 1.00 0.00 C ATOM 1049 CG1 ILE A 68 6.172 -0.349 1.527 1.00 0.00 C ATOM 1050 CG2 ILE A 68 8.420 -1.219 0.834 1.00 0.00 C ATOM 1051 CD1 ILE A 68 6.071 0.863 0.628 1.00 0.00 C ATOM 0 H ILE A 68 6.671 -0.400 4.590 1.00 0.00 H new ATOM 0 HA ILE A 68 7.356 -2.639 2.795 1.00 0.00 H new ATOM 0 HB ILE A 68 8.063 0.276 2.312 1.00 0.00 H new ATOM 0 HG12 ILE A 68 5.775 -1.216 1.000 1.00 0.00 H new ATOM 0 HG13 ILE A 68 5.544 -0.194 2.404 1.00 0.00 H new ATOM 0 HG21 ILE A 68 8.422 -0.510 0.006 1.00 0.00 H new ATOM 0 HG22 ILE A 68 9.444 -1.390 1.167 1.00 0.00 H new ATOM 0 HG23 ILE A 68 7.983 -2.162 0.504 1.00 0.00 H new ATOM 0 HD11 ILE A 68 5.031 1.019 0.343 1.00 0.00 H new ATOM 0 HD12 ILE A 68 6.438 1.741 1.159 1.00 0.00 H new ATOM 0 HD13 ILE A 68 6.672 0.703 -0.267 1.00 0.00 H new ATOM 1063 N GLU A 69 9.634 -2.792 3.761 1.00 0.00 N ATOM 1064 CA GLU A 69 10.960 -2.930 4.351 1.00 0.00 C ATOM 1065 C GLU A 69 12.044 -2.539 3.351 1.00 0.00 C ATOM 1066 O GLU A 69 12.349 -3.289 2.424 1.00 0.00 O ATOM 1067 CB GLU A 69 11.184 -4.367 4.827 1.00 0.00 C ATOM 1068 CG GLU A 69 10.744 -4.610 6.260 1.00 0.00 C ATOM 1069 CD GLU A 69 10.885 -6.061 6.676 1.00 0.00 C ATOM 1070 OE1 GLU A 69 10.302 -6.932 5.998 1.00 0.00 O ATOM 1071 OE2 GLU A 69 11.579 -6.325 7.680 1.00 0.00 O ATOM 0 H GLU A 69 9.284 -3.636 3.307 1.00 0.00 H new ATOM 0 HA GLU A 69 11.020 -2.258 5.207 1.00 0.00 H new ATOM 0 HB2 GLU A 69 10.642 -5.047 4.169 1.00 0.00 H new ATOM 0 HB3 GLU A 69 12.243 -4.610 4.735 1.00 0.00 H new ATOM 0 HG2 GLU A 69 11.336 -3.985 6.929 1.00 0.00 H new ATOM 0 HG3 GLU A 69 9.704 -4.303 6.374 1.00 0.00 H new ATOM 1078 N GLY A 70 12.622 -1.357 3.545 1.00 0.00 N ATOM 1079 CA GLY A 70 13.665 -0.886 2.653 1.00 0.00 C ATOM 1080 C GLY A 70 13.111 -0.123 1.466 1.00 0.00 C ATOM 1081 O GLY A 70 12.995 -0.667 0.369 1.00 0.00 O ATOM 0 H GLY A 70 12.386 -0.718 4.304 1.00 0.00 H new ATOM 0 HA2 GLY A 70 14.350 -0.244 3.207 1.00 0.00 H new ATOM 0 HA3 GLY A 70 14.245 -1.737 2.296 1.00 0.00 H new ATOM 1085 N ALA A 71 12.766 1.142 1.686 1.00 0.00 N ATOM 1086 CA ALA A 71 12.221 1.981 0.626 1.00 0.00 C ATOM 1087 C ALA A 71 13.332 2.544 -0.254 1.00 0.00 C ATOM 1088 O ALA A 71 14.048 3.464 0.144 1.00 0.00 O ATOM 1089 CB ALA A 71 11.392 3.110 1.220 1.00 0.00 C ATOM 0 H ALA A 71 12.854 1.608 2.589 1.00 0.00 H new ATOM 0 HA ALA A 71 11.577 1.362 0.001 1.00 0.00 H new ATOM 0 HB1 ALA A 71 10.991 3.729 0.417 1.00 0.00 H new ATOM 0 HB2 ALA A 71 10.570 2.691 1.800 1.00 0.00 H new ATOM 0 HB3 ALA A 71 12.020 3.720 1.869 1.00 0.00 H new ATOM 1095 N THR A 72 13.472 1.987 -1.452 1.00 0.00 N ATOM 1096 CA THR A 72 14.497 2.432 -2.388 1.00 0.00 C ATOM 1097 C THR A 72 13.881 3.185 -3.561 1.00 0.00 C ATOM 1098 O THR A 72 12.664 3.173 -3.750 1.00 0.00 O ATOM 1099 CB THR A 72 15.317 1.246 -2.929 1.00 0.00 C ATOM 1100 OG1 THR A 72 14.440 0.237 -3.443 1.00 0.00 O ATOM 1101 CG2 THR A 72 16.195 0.653 -1.837 1.00 0.00 C ATOM 0 H THR A 72 12.888 1.226 -1.798 1.00 0.00 H new ATOM 0 HA THR A 72 15.158 3.101 -1.837 1.00 0.00 H new ATOM 0 HB THR A 72 15.958 1.612 -3.731 1.00 0.00 H new ATOM 0 HG1 THR A 72 14.970 -0.513 -3.787 1.00 0.00 H new ATOM 0 HG21 THR A 72 16.765 -0.183 -2.242 1.00 0.00 H new ATOM 0 HG22 THR A 72 16.881 1.415 -1.468 1.00 0.00 H new ATOM 0 HG23 THR A 72 15.569 0.302 -1.017 1.00 0.00 H new ATOM 1109 N LYS A 73 14.727 3.841 -4.348 1.00 0.00 N ATOM 1110 CA LYS A 73 14.267 4.599 -5.505 1.00 0.00 C ATOM 1111 C LYS A 73 13.319 3.765 -6.360 1.00 0.00 C ATOM 1112 O LYS A 73 12.368 4.288 -6.940 1.00 0.00 O ATOM 1113 CB LYS A 73 15.459 5.059 -6.347 1.00 0.00 C ATOM 1114 CG LYS A 73 16.120 6.324 -5.827 1.00 0.00 C ATOM 1115 CD LYS A 73 17.013 6.036 -4.631 1.00 0.00 C ATOM 1116 CE LYS A 73 17.621 7.311 -4.070 1.00 0.00 C ATOM 1117 NZ LYS A 73 16.766 7.915 -3.011 1.00 0.00 N ATOM 0 H LYS A 73 15.737 3.863 -4.205 1.00 0.00 H new ATOM 0 HA LYS A 73 13.727 5.474 -5.143 1.00 0.00 H new ATOM 0 HB2 LYS A 73 16.199 4.260 -6.380 1.00 0.00 H new ATOM 0 HB3 LYS A 73 15.126 5.228 -7.371 1.00 0.00 H new ATOM 0 HG2 LYS A 73 16.711 6.780 -6.622 1.00 0.00 H new ATOM 0 HG3 LYS A 73 15.354 7.046 -5.545 1.00 0.00 H new ATOM 0 HD2 LYS A 73 16.434 5.536 -3.855 1.00 0.00 H new ATOM 0 HD3 LYS A 73 17.808 5.351 -4.926 1.00 0.00 H new ATOM 0 HE2 LYS A 73 18.607 7.093 -3.660 1.00 0.00 H new ATOM 0 HE3 LYS A 73 17.763 8.031 -4.876 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 17.114 8.869 -2.786 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 15.784 7.975 -3.350 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 16.802 7.323 -2.156 1.00 0.00 H new ATOM 1131 N ALA A 74 13.584 2.464 -6.432 1.00 0.00 N ATOM 1132 CA ALA A 74 12.752 1.558 -7.214 1.00 0.00 C ATOM 1133 C ALA A 74 11.351 1.451 -6.622 1.00 0.00 C ATOM 1134 O ALA A 74 10.359 1.424 -7.352 1.00 0.00 O ATOM 1135 CB ALA A 74 13.399 0.183 -7.292 1.00 0.00 C ATOM 0 H ALA A 74 14.368 2.015 -5.958 1.00 0.00 H new ATOM 0 HA ALA A 74 12.663 1.964 -8.222 1.00 0.00 H new ATOM 0 HB1 ALA A 74 12.767 -0.484 -7.879 1.00 0.00 H new ATOM 0 HB2 ALA A 74 14.377 0.267 -7.767 1.00 0.00 H new ATOM 0 HB3 ALA A 74 13.517 -0.221 -6.287 1.00 0.00 H new ATOM 1141 N ASP A 75 11.276 1.391 -5.297 1.00 0.00 N ATOM 1142 CA ASP A 75 9.995 1.288 -4.608 1.00 0.00 C ATOM 1143 C ASP A 75 9.199 2.582 -4.743 1.00 0.00 C ATOM 1144 O ASP A 75 7.979 2.592 -4.583 1.00 0.00 O ATOM 1145 CB ASP A 75 10.212 0.960 -3.130 1.00 0.00 C ATOM 1146 CG ASP A 75 10.268 -0.532 -2.869 1.00 0.00 C ATOM 1147 OD1 ASP A 75 9.591 -1.287 -3.599 1.00 0.00 O ATOM 1148 OD2 ASP A 75 10.988 -0.945 -1.937 1.00 0.00 O ATOM 0 H ASP A 75 12.087 1.412 -4.679 1.00 0.00 H new ATOM 0 HA ASP A 75 9.425 0.483 -5.071 1.00 0.00 H new ATOM 0 HB2 ASP A 75 11.140 1.420 -2.792 1.00 0.00 H new ATOM 0 HB3 ASP A 75 9.406 1.399 -2.542 1.00 0.00 H new ATOM 1153 N ALA A 76 9.899 3.673 -5.038 1.00 0.00 N ATOM 1154 CA ALA A 76 9.258 4.973 -5.195 1.00 0.00 C ATOM 1155 C ALA A 76 8.295 4.970 -6.378 1.00 0.00 C ATOM 1156 O ALA A 76 8.683 5.269 -7.507 1.00 0.00 O ATOM 1157 CB ALA A 76 10.307 6.061 -5.368 1.00 0.00 C ATOM 0 H ALA A 76 10.910 3.682 -5.173 1.00 0.00 H new ATOM 0 HA ALA A 76 8.683 5.179 -4.292 1.00 0.00 H new ATOM 0 HB1 ALA A 76 9.814 7.026 -5.484 1.00 0.00 H new ATOM 0 HB2 ALA A 76 10.953 6.087 -4.490 1.00 0.00 H new ATOM 0 HB3 ALA A 76 10.907 5.851 -6.254 1.00 0.00 H new ATOM 1163 N ALA A 77 7.038 4.630 -6.111 1.00 0.00 N ATOM 1164 CA ALA A 77 6.020 4.590 -7.153 1.00 0.00 C ATOM 1165 C ALA A 77 4.642 4.914 -6.586 1.00 0.00 C ATOM 1166 O ALA A 77 4.470 5.023 -5.373 1.00 0.00 O ATOM 1167 CB ALA A 77 6.008 3.226 -7.827 1.00 0.00 C ATOM 0 H ALA A 77 6.701 4.378 -5.182 1.00 0.00 H new ATOM 0 HA ALA A 77 6.266 5.348 -7.896 1.00 0.00 H new ATOM 0 HB1 ALA A 77 5.243 3.210 -8.603 1.00 0.00 H new ATOM 0 HB2 ALA A 77 6.983 3.033 -8.275 1.00 0.00 H new ATOM 0 HB3 ALA A 77 5.790 2.456 -7.087 1.00 0.00 H new ATOM 1173 N GLU A 78 3.663 5.067 -7.473 1.00 0.00 N ATOM 1174 CA GLU A 78 2.300 5.380 -7.060 1.00 0.00 C ATOM 1175 C GLU A 78 1.606 4.144 -6.495 1.00 0.00 C ATOM 1176 O GLU A 78 1.248 3.227 -7.234 1.00 0.00 O ATOM 1177 CB GLU A 78 1.500 5.932 -8.241 1.00 0.00 C ATOM 1178 CG GLU A 78 0.071 6.309 -7.885 1.00 0.00 C ATOM 1179 CD GLU A 78 -0.683 6.909 -9.056 1.00 0.00 C ATOM 1180 OE1 GLU A 78 -1.252 6.134 -9.854 1.00 0.00 O ATOM 1181 OE2 GLU A 78 -0.705 8.151 -9.175 1.00 0.00 O ATOM 0 H GLU A 78 3.789 4.979 -8.481 1.00 0.00 H new ATOM 0 HA GLU A 78 2.349 6.138 -6.278 1.00 0.00 H new ATOM 0 HB2 GLU A 78 2.011 6.810 -8.636 1.00 0.00 H new ATOM 0 HB3 GLU A 78 1.483 5.188 -9.037 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -0.458 5.423 -7.533 1.00 0.00 H new ATOM 0 HG3 GLU A 78 0.082 7.022 -7.061 1.00 0.00 H new ATOM 1188 N TYR A 79 1.420 4.127 -5.180 1.00 0.00 N ATOM 1189 CA TYR A 79 0.771 3.004 -4.514 1.00 0.00 C ATOM 1190 C TYR A 79 -0.745 3.170 -4.517 1.00 0.00 C ATOM 1191 O TYR A 79 -1.284 4.062 -3.862 1.00 0.00 O ATOM 1192 CB TYR A 79 1.278 2.874 -3.077 1.00 0.00 C ATOM 1193 CG TYR A 79 2.681 2.317 -2.978 1.00 0.00 C ATOM 1194 CD1 TYR A 79 3.787 3.121 -3.224 1.00 0.00 C ATOM 1195 CD2 TYR A 79 2.900 0.988 -2.638 1.00 0.00 C ATOM 1196 CE1 TYR A 79 5.070 2.617 -3.136 1.00 0.00 C ATOM 1197 CE2 TYR A 79 4.180 0.476 -2.546 1.00 0.00 C ATOM 1198 CZ TYR A 79 5.262 1.294 -2.796 1.00 0.00 C ATOM 1199 OH TYR A 79 6.538 0.788 -2.706 1.00 0.00 O ATOM 0 H TYR A 79 1.710 4.878 -4.554 1.00 0.00 H new ATOM 0 HA TYR A 79 1.020 2.096 -5.064 1.00 0.00 H new ATOM 0 HB2 TYR A 79 1.251 3.854 -2.601 1.00 0.00 H new ATOM 0 HB3 TYR A 79 0.600 2.229 -2.518 1.00 0.00 H new ATOM 0 HD1 TYR A 79 3.641 4.158 -3.489 1.00 0.00 H new ATOM 0 HD2 TYR A 79 2.055 0.344 -2.442 1.00 0.00 H new ATOM 0 HE1 TYR A 79 5.919 3.256 -3.332 1.00 0.00 H new ATOM 0 HE2 TYR A 79 4.333 -0.559 -2.280 1.00 0.00 H new ATOM 0 HH TYR A 79 7.138 1.311 -3.277 1.00 0.00 H new ATOM 1209 N SER A 80 -1.428 2.304 -5.258 1.00 0.00 N ATOM 1210 CA SER A 80 -2.882 2.355 -5.350 1.00 0.00 C ATOM 1211 C SER A 80 -3.503 1.046 -4.874 1.00 0.00 C ATOM 1212 O SER A 80 -3.059 -0.039 -5.250 1.00 0.00 O ATOM 1213 CB SER A 80 -3.314 2.644 -6.789 1.00 0.00 C ATOM 1214 OG SER A 80 -2.803 3.888 -7.235 1.00 0.00 O ATOM 0 H SER A 80 -0.997 1.558 -5.804 1.00 0.00 H new ATOM 0 HA SER A 80 -3.234 3.160 -4.704 1.00 0.00 H new ATOM 0 HB2 SER A 80 -2.963 1.847 -7.444 1.00 0.00 H new ATOM 0 HB3 SER A 80 -4.402 2.651 -6.851 1.00 0.00 H new ATOM 0 HG SER A 80 -3.092 4.049 -8.158 1.00 0.00 H new ATOM 1220 N VAL A 81 -4.535 1.155 -4.042 1.00 0.00 N ATOM 1221 CA VAL A 81 -5.219 -0.019 -3.514 1.00 0.00 C ATOM 1222 C VAL A 81 -6.505 -0.299 -4.284 1.00 0.00 C ATOM 1223 O VAL A 81 -7.071 0.596 -4.912 1.00 0.00 O ATOM 1224 CB VAL A 81 -5.555 0.151 -2.021 1.00 0.00 C ATOM 1225 CG1 VAL A 81 -4.417 0.851 -1.294 1.00 0.00 C ATOM 1226 CG2 VAL A 81 -6.858 0.918 -1.852 1.00 0.00 C ATOM 0 H VAL A 81 -4.915 2.045 -3.720 1.00 0.00 H new ATOM 0 HA VAL A 81 -4.537 -0.861 -3.632 1.00 0.00 H new ATOM 0 HB VAL A 81 -5.682 -0.838 -1.580 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -4.672 0.962 -0.240 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -3.507 0.258 -1.386 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -4.255 1.835 -1.734 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -7.080 1.029 -0.791 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -6.762 1.904 -2.307 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -7.667 0.372 -2.337 1.00 0.00 H new ATOM 1236 N MET A 82 -6.961 -1.546 -4.231 1.00 0.00 N ATOM 1237 CA MET A 82 -8.182 -1.943 -4.922 1.00 0.00 C ATOM 1238 C MET A 82 -9.069 -2.789 -4.016 1.00 0.00 C ATOM 1239 O MET A 82 -8.603 -3.736 -3.380 1.00 0.00 O ATOM 1240 CB MET A 82 -7.842 -2.722 -6.195 1.00 0.00 C ATOM 1241 CG MET A 82 -8.869 -2.553 -7.303 1.00 0.00 C ATOM 1242 SD MET A 82 -8.634 -3.725 -8.652 1.00 0.00 S ATOM 1243 CE MET A 82 -8.004 -2.643 -9.934 1.00 0.00 C ATOM 0 H MET A 82 -6.503 -2.299 -3.717 1.00 0.00 H new ATOM 0 HA MET A 82 -8.727 -1.039 -5.192 1.00 0.00 H new ATOM 0 HB2 MET A 82 -6.868 -2.397 -6.561 1.00 0.00 H new ATOM 0 HB3 MET A 82 -7.754 -3.781 -5.951 1.00 0.00 H new ATOM 0 HG2 MET A 82 -9.869 -2.678 -6.888 1.00 0.00 H new ATOM 0 HG3 MET A 82 -8.811 -1.538 -7.695 1.00 0.00 H new ATOM 0 HE1 MET A 82 -7.809 -3.223 -10.836 1.00 0.00 H new ATOM 0 HE2 MET A 82 -8.741 -1.870 -10.152 1.00 0.00 H new ATOM 0 HE3 MET A 82 -7.079 -2.177 -9.595 1.00 0.00 H new ATOM 1253 N THR A 83 -10.352 -2.443 -3.959 1.00 0.00 N ATOM 1254 CA THR A 83 -11.304 -3.170 -3.129 1.00 0.00 C ATOM 1255 C THR A 83 -12.474 -3.686 -3.958 1.00 0.00 C ATOM 1256 O THR A 83 -12.577 -3.401 -5.152 1.00 0.00 O ATOM 1257 CB THR A 83 -11.846 -2.285 -1.990 1.00 0.00 C ATOM 1258 OG1 THR A 83 -12.605 -1.199 -2.533 1.00 0.00 O ATOM 1259 CG2 THR A 83 -10.709 -1.741 -1.139 1.00 0.00 C ATOM 0 H THR A 83 -10.755 -1.663 -4.478 1.00 0.00 H new ATOM 0 HA THR A 83 -10.767 -4.015 -2.698 1.00 0.00 H new ATOM 0 HB THR A 83 -12.489 -2.897 -1.358 1.00 0.00 H new ATOM 0 HG1 THR A 83 -13.519 -1.230 -2.181 1.00 0.00 H new ATOM 0 HG21 THR A 83 -11.116 -1.119 -0.342 1.00 0.00 H new ATOM 0 HG22 THR A 83 -10.151 -2.570 -0.704 1.00 0.00 H new ATOM 0 HG23 THR A 83 -10.043 -1.143 -1.761 1.00 0.00 H new ATOM 1267 N THR A 84 -13.357 -4.446 -3.318 1.00 0.00 N ATOM 1268 CA THR A 84 -14.521 -5.003 -3.997 1.00 0.00 C ATOM 1269 C THR A 84 -15.445 -3.899 -4.499 1.00 0.00 C ATOM 1270 O THR A 84 -16.414 -4.162 -5.209 1.00 0.00 O ATOM 1271 CB THR A 84 -15.317 -5.941 -3.070 1.00 0.00 C ATOM 1272 OG1 THR A 84 -15.548 -5.303 -1.809 1.00 0.00 O ATOM 1273 CG2 THR A 84 -14.571 -7.249 -2.853 1.00 0.00 C ATOM 0 H THR A 84 -13.288 -4.690 -2.330 1.00 0.00 H new ATOM 0 HA THR A 84 -14.148 -5.575 -4.846 1.00 0.00 H new ATOM 0 HB THR A 84 -16.273 -6.161 -3.546 1.00 0.00 H new ATOM 0 HG1 THR A 84 -16.174 -5.841 -1.280 1.00 0.00 H new ATOM 0 HG21 THR A 84 -15.153 -7.895 -2.195 1.00 0.00 H new ATOM 0 HG22 THR A 84 -14.422 -7.746 -3.811 1.00 0.00 H new ATOM 0 HG23 THR A 84 -13.603 -7.044 -2.397 1.00 0.00 H new ATOM 1281 N GLY A 85 -15.137 -2.660 -4.125 1.00 0.00 N ATOM 1282 CA GLY A 85 -15.949 -1.534 -4.547 1.00 0.00 C ATOM 1283 C GLY A 85 -15.308 -0.201 -4.219 1.00 0.00 C ATOM 1284 O GLY A 85 -15.979 0.723 -3.761 1.00 0.00 O ATOM 0 H GLY A 85 -14.340 -2.417 -3.537 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -16.120 -1.596 -5.622 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -16.925 -1.593 -4.065 1.00 0.00 H new ATOM 1288 N GLY A 86 -14.003 -0.100 -4.453 1.00 0.00 N ATOM 1289 CA GLY A 86 -13.292 1.133 -4.172 1.00 0.00 C ATOM 1290 C GLY A 86 -11.841 1.079 -4.607 1.00 0.00 C ATOM 1291 O GLY A 86 -11.273 -0.002 -4.760 1.00 0.00 O ATOM 0 H GLY A 86 -13.426 -0.851 -4.832 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -13.790 1.959 -4.680 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -13.340 1.341 -3.103 1.00 0.00 H new ATOM 1295 N GLN A 87 -11.241 2.247 -4.809 1.00 0.00 N ATOM 1296 CA GLN A 87 -9.848 2.327 -5.232 1.00 0.00 C ATOM 1297 C GLN A 87 -9.209 3.629 -4.760 1.00 0.00 C ATOM 1298 O GLN A 87 -9.865 4.669 -4.702 1.00 0.00 O ATOM 1299 CB GLN A 87 -9.748 2.219 -6.755 1.00 0.00 C ATOM 1300 CG GLN A 87 -10.670 3.176 -7.494 1.00 0.00 C ATOM 1301 CD GLN A 87 -10.264 3.377 -8.940 1.00 0.00 C ATOM 1302 OE1 GLN A 87 -9.702 4.412 -9.301 1.00 0.00 O ATOM 1303 NE2 GLN A 87 -10.546 2.386 -9.778 1.00 0.00 N ATOM 0 H GLN A 87 -11.697 3.151 -4.687 1.00 0.00 H new ATOM 0 HA GLN A 87 -9.309 1.494 -4.779 1.00 0.00 H new ATOM 0 HB2 GLN A 87 -8.719 2.412 -7.058 1.00 0.00 H new ATOM 0 HB3 GLN A 87 -9.982 1.198 -7.055 1.00 0.00 H new ATOM 0 HG2 GLN A 87 -11.690 2.793 -7.457 1.00 0.00 H new ATOM 0 HG3 GLN A 87 -10.672 4.139 -6.984 1.00 0.00 H new ATOM 0 HE21 GLN A 87 -11.013 1.546 -9.436 1.00 0.00 H new ATOM 0 HE22 GLN A 87 -10.296 2.465 -10.764 1.00 0.00 H new ATOM 1312 N SER A 88 -7.925 3.564 -4.422 1.00 0.00 N ATOM 1313 CA SER A 88 -7.198 4.737 -3.950 1.00 0.00 C ATOM 1314 C SER A 88 -5.800 4.790 -4.558 1.00 0.00 C ATOM 1315 O SER A 88 -5.297 3.793 -5.074 1.00 0.00 O ATOM 1316 CB SER A 88 -7.103 4.724 -2.423 1.00 0.00 C ATOM 1317 OG SER A 88 -6.687 5.985 -1.927 1.00 0.00 O ATOM 0 H SER A 88 -7.367 2.712 -4.466 1.00 0.00 H new ATOM 0 HA SER A 88 -7.746 5.625 -4.265 1.00 0.00 H new ATOM 0 HB2 SER A 88 -8.072 4.464 -1.997 1.00 0.00 H new ATOM 0 HB3 SER A 88 -6.399 3.955 -2.106 1.00 0.00 H new ATOM 0 HG SER A 88 -7.317 6.676 -2.220 1.00 0.00 H new ATOM 1323 N SER A 89 -5.178 5.963 -4.493 1.00 0.00 N ATOM 1324 CA SER A 89 -3.839 6.150 -5.040 1.00 0.00 C ATOM 1325 C SER A 89 -3.024 7.102 -4.169 1.00 0.00 C ATOM 1326 O SER A 89 -3.574 7.990 -3.520 1.00 0.00 O ATOM 1327 CB SER A 89 -3.920 6.690 -6.469 1.00 0.00 C ATOM 1328 OG SER A 89 -5.019 6.129 -7.165 1.00 0.00 O ATOM 0 H SER A 89 -5.580 6.798 -4.067 1.00 0.00 H new ATOM 0 HA SER A 89 -3.340 5.181 -5.053 1.00 0.00 H new ATOM 0 HB2 SER A 89 -4.016 7.776 -6.446 1.00 0.00 H new ATOM 0 HB3 SER A 89 -2.995 6.463 -7.000 1.00 0.00 H new ATOM 0 HG SER A 89 -5.049 6.491 -8.075 1.00 0.00 H new ATOM 1334 N ALA A 90 -1.710 6.908 -4.162 1.00 0.00 N ATOM 1335 CA ALA A 90 -0.818 7.750 -3.374 1.00 0.00 C ATOM 1336 C ALA A 90 0.576 7.802 -3.991 1.00 0.00 C ATOM 1337 O ALA A 90 0.951 6.932 -4.777 1.00 0.00 O ATOM 1338 CB ALA A 90 -0.744 7.244 -1.941 1.00 0.00 C ATOM 0 H ALA A 90 -1.239 6.175 -4.693 1.00 0.00 H new ATOM 0 HA ALA A 90 -1.223 8.762 -3.370 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -0.075 7.882 -1.364 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -1.739 7.265 -1.496 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -0.366 6.222 -1.935 1.00 0.00 H new ATOM 1344 N LYS A 91 1.340 8.827 -3.631 1.00 0.00 N ATOM 1345 CA LYS A 91 2.693 8.993 -4.148 1.00 0.00 C ATOM 1346 C LYS A 91 3.727 8.747 -3.054 1.00 0.00 C ATOM 1347 O LYS A 91 3.548 9.166 -1.910 1.00 0.00 O ATOM 1348 CB LYS A 91 2.871 10.399 -4.726 1.00 0.00 C ATOM 1349 CG LYS A 91 2.188 10.596 -6.068 1.00 0.00 C ATOM 1350 CD LYS A 91 2.508 11.957 -6.663 1.00 0.00 C ATOM 1351 CE LYS A 91 2.250 11.985 -8.161 1.00 0.00 C ATOM 1352 NZ LYS A 91 3.302 11.254 -8.920 1.00 0.00 N ATOM 0 H LYS A 91 1.045 9.557 -2.982 1.00 0.00 H new ATOM 0 HA LYS A 91 2.846 8.259 -4.940 1.00 0.00 H new ATOM 0 HB2 LYS A 91 2.477 11.127 -4.017 1.00 0.00 H new ATOM 0 HB3 LYS A 91 3.936 10.605 -4.836 1.00 0.00 H new ATOM 0 HG2 LYS A 91 2.505 9.813 -6.757 1.00 0.00 H new ATOM 0 HG3 LYS A 91 1.109 10.496 -5.946 1.00 0.00 H new ATOM 0 HD2 LYS A 91 1.903 12.720 -6.174 1.00 0.00 H new ATOM 0 HD3 LYS A 91 3.551 12.204 -6.468 1.00 0.00 H new ATOM 0 HE2 LYS A 91 1.277 11.541 -8.370 1.00 0.00 H new ATOM 0 HE3 LYS A 91 2.208 13.019 -8.503 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 3.197 11.451 -9.936 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 4.241 11.568 -8.602 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 3.204 10.232 -8.753 1.00 0.00 H new ATOM 1366 N LEU A 92 4.810 8.066 -3.413 1.00 0.00 N ATOM 1367 CA LEU A 92 5.875 7.765 -2.462 1.00 0.00 C ATOM 1368 C LEU A 92 7.232 8.193 -3.011 1.00 0.00 C ATOM 1369 O LEU A 92 7.677 7.700 -4.048 1.00 0.00 O ATOM 1370 CB LEU A 92 5.890 6.270 -2.140 1.00 0.00 C ATOM 1371 CG LEU A 92 6.811 5.839 -0.997 1.00 0.00 C ATOM 1372 CD1 LEU A 92 6.309 6.390 0.329 1.00 0.00 C ATOM 1373 CD2 LEU A 92 6.917 4.322 -0.941 1.00 0.00 C ATOM 0 H LEU A 92 4.974 7.712 -4.355 1.00 0.00 H new ATOM 0 HA LEU A 92 5.681 8.325 -1.547 1.00 0.00 H new ATOM 0 HB2 LEU A 92 4.873 5.961 -1.897 1.00 0.00 H new ATOM 0 HB3 LEU A 92 6.182 5.728 -3.039 1.00 0.00 H new ATOM 0 HG LEU A 92 7.805 6.246 -1.183 1.00 0.00 H new ATOM 0 HD11 LEU A 92 6.976 6.073 1.131 1.00 0.00 H new ATOM 0 HD12 LEU A 92 6.286 7.479 0.285 1.00 0.00 H new ATOM 0 HD13 LEU A 92 5.305 6.013 0.523 1.00 0.00 H new ATOM 0 HD21 LEU A 92 7.576 4.033 -0.122 1.00 0.00 H new ATOM 0 HD22 LEU A 92 5.928 3.894 -0.779 1.00 0.00 H new ATOM 0 HD23 LEU A 92 7.323 3.951 -1.882 1.00 0.00 H new ATOM 1385 N SER A 93 7.886 9.112 -2.308 1.00 0.00 N ATOM 1386 CA SER A 93 9.193 9.607 -2.726 1.00 0.00 C ATOM 1387 C SER A 93 10.300 9.020 -1.856 1.00 0.00 C ATOM 1388 O SER A 93 10.139 8.867 -0.645 1.00 0.00 O ATOM 1389 CB SER A 93 9.229 11.135 -2.655 1.00 0.00 C ATOM 1390 OG SER A 93 8.746 11.712 -3.856 1.00 0.00 O ATOM 0 H SER A 93 7.533 9.529 -1.447 1.00 0.00 H new ATOM 0 HA SER A 93 9.360 9.294 -3.757 1.00 0.00 H new ATOM 0 HB2 SER A 93 8.625 11.478 -1.815 1.00 0.00 H new ATOM 0 HB3 SER A 93 10.250 11.470 -2.472 1.00 0.00 H new ATOM 0 HG SER A 93 8.777 12.689 -3.785 1.00 0.00 H new ATOM 1396 N VAL A 94 11.426 8.693 -2.482 1.00 0.00 N ATOM 1397 CA VAL A 94 12.561 8.123 -1.767 1.00 0.00 C ATOM 1398 C VAL A 94 13.786 9.025 -1.873 1.00 0.00 C ATOM 1399 O VAL A 94 14.258 9.321 -2.971 1.00 0.00 O ATOM 1400 CB VAL A 94 12.919 6.725 -2.303 1.00 0.00 C ATOM 1401 CG1 VAL A 94 14.012 6.091 -1.456 1.00 0.00 C ATOM 1402 CG2 VAL A 94 11.683 5.838 -2.343 1.00 0.00 C ATOM 0 H VAL A 94 11.576 8.813 -3.484 1.00 0.00 H new ATOM 0 HA VAL A 94 12.265 8.037 -0.721 1.00 0.00 H new ATOM 0 HB VAL A 94 13.297 6.831 -3.320 1.00 0.00 H new ATOM 0 HG11 VAL A 94 14.251 5.103 -1.851 1.00 0.00 H new ATOM 0 HG12 VAL A 94 14.903 6.718 -1.483 1.00 0.00 H new ATOM 0 HG13 VAL A 94 13.666 5.996 -0.427 1.00 0.00 H new ATOM 0 HG21 VAL A 94 11.954 4.853 -2.724 1.00 0.00 H new ATOM 0 HG22 VAL A 94 11.274 5.738 -1.337 1.00 0.00 H new ATOM 0 HG23 VAL A 94 10.934 6.287 -2.996 1.00 0.00 H new ATOM 1412 N ASP A 95 14.297 9.458 -0.726 1.00 0.00 N ATOM 1413 CA ASP A 95 15.469 10.325 -0.690 1.00 0.00 C ATOM 1414 C ASP A 95 16.678 9.582 -0.130 1.00 0.00 C ATOM 1415 O ASP A 95 16.546 8.491 0.428 1.00 0.00 O ATOM 1416 CB ASP A 95 15.184 11.569 0.153 1.00 0.00 C ATOM 1417 CG ASP A 95 15.911 12.796 -0.360 1.00 0.00 C ATOM 1418 OD1 ASP A 95 15.910 13.015 -1.589 1.00 0.00 O ATOM 1419 OD2 ASP A 95 16.484 13.536 0.467 1.00 0.00 O ATOM 0 H ASP A 95 13.918 9.223 0.191 1.00 0.00 H new ATOM 0 HA ASP A 95 15.695 10.632 -1.711 1.00 0.00 H new ATOM 0 HB2 ASP A 95 14.111 11.762 0.159 1.00 0.00 H new ATOM 0 HB3 ASP A 95 15.480 11.380 1.185 1.00 0.00 H new ATOM 1424 N LEU A 96 17.855 10.178 -0.282 1.00 0.00 N ATOM 1425 CA LEU A 96 19.088 9.572 0.208 1.00 0.00 C ATOM 1426 C LEU A 96 19.585 10.287 1.461 1.00 0.00 C ATOM 1427 O LEU A 96 19.799 11.499 1.454 1.00 0.00 O ATOM 1428 CB LEU A 96 20.165 9.613 -0.877 1.00 0.00 C ATOM 1429 CG LEU A 96 20.081 8.524 -1.948 1.00 0.00 C ATOM 1430 CD1 LEU A 96 21.059 8.809 -3.077 1.00 0.00 C ATOM 1431 CD2 LEU A 96 20.349 7.156 -1.340 1.00 0.00 C ATOM 0 H LEU A 96 17.982 11.080 -0.741 1.00 0.00 H new ATOM 0 HA LEU A 96 18.877 8.534 0.464 1.00 0.00 H new ATOM 0 HB2 LEU A 96 20.119 10.584 -1.370 1.00 0.00 H new ATOM 0 HB3 LEU A 96 21.140 9.546 -0.395 1.00 0.00 H new ATOM 0 HG LEU A 96 19.072 8.524 -2.361 1.00 0.00 H new ATOM 0 HD11 LEU A 96 20.985 8.024 -3.829 1.00 0.00 H new ATOM 0 HD12 LEU A 96 20.820 9.771 -3.531 1.00 0.00 H new ATOM 0 HD13 LEU A 96 22.074 8.837 -2.681 1.00 0.00 H new ATOM 0 HD21 LEU A 96 20.285 6.394 -2.117 1.00 0.00 H new ATOM 0 HD22 LEU A 96 21.346 7.143 -0.900 1.00 0.00 H new ATOM 0 HD23 LEU A 96 19.608 6.950 -0.567 1.00 0.00 H new ATOM 1443 N LYS A 97 19.771 9.526 2.535 1.00 0.00 N ATOM 1444 CA LYS A 97 20.246 10.084 3.795 1.00 0.00 C ATOM 1445 C LYS A 97 21.769 10.039 3.870 1.00 0.00 C ATOM 1446 O LYS A 97 22.347 9.074 4.371 1.00 0.00 O ATOM 1447 CB LYS A 97 19.644 9.319 4.975 1.00 0.00 C ATOM 1448 CG LYS A 97 19.544 10.143 6.247 1.00 0.00 C ATOM 1449 CD LYS A 97 18.361 11.095 6.204 1.00 0.00 C ATOM 1450 CE LYS A 97 18.373 12.053 7.385 1.00 0.00 C ATOM 1451 NZ LYS A 97 19.473 13.050 7.279 1.00 0.00 N ATOM 0 H LYS A 97 19.600 8.521 2.557 1.00 0.00 H new ATOM 0 HA LYS A 97 19.928 11.125 3.845 1.00 0.00 H new ATOM 0 HB2 LYS A 97 18.649 8.968 4.700 1.00 0.00 H new ATOM 0 HB3 LYS A 97 20.251 8.435 5.172 1.00 0.00 H new ATOM 0 HG2 LYS A 97 19.446 9.478 7.105 1.00 0.00 H new ATOM 0 HG3 LYS A 97 20.464 10.711 6.387 1.00 0.00 H new ATOM 0 HD2 LYS A 97 18.383 11.663 5.274 1.00 0.00 H new ATOM 0 HD3 LYS A 97 17.433 10.524 6.207 1.00 0.00 H new ATOM 0 HE2 LYS A 97 17.416 12.572 7.441 1.00 0.00 H new ATOM 0 HE3 LYS A 97 18.483 11.487 8.310 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 19.311 13.819 7.960 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 20.381 12.588 7.488 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 19.496 13.440 6.315 1.00 0.00 H new ATOM 1465 N SER A 98 22.413 11.088 3.369 1.00 0.00 N ATOM 1466 CA SER A 98 23.870 11.167 3.378 1.00 0.00 C ATOM 1467 C SER A 98 24.336 12.619 3.375 1.00 0.00 C ATOM 1468 O SER A 98 24.246 13.310 2.361 1.00 0.00 O ATOM 1469 CB SER A 98 24.448 10.431 2.167 1.00 0.00 C ATOM 1470 OG SER A 98 24.308 9.028 2.308 1.00 0.00 O ATOM 0 H SER A 98 21.949 11.895 2.952 1.00 0.00 H new ATOM 0 HA SER A 98 24.230 10.691 4.290 1.00 0.00 H new ATOM 0 HB2 SER A 98 23.940 10.761 1.261 1.00 0.00 H new ATOM 0 HB3 SER A 98 25.502 10.685 2.052 1.00 0.00 H new ATOM 0 HG SER A 98 23.760 8.832 3.096 1.00 0.00 H new ATOM 1476 N GLY A 99 24.835 13.077 4.519 1.00 0.00 N ATOM 1477 CA GLY A 99 25.308 14.444 4.628 1.00 0.00 C ATOM 1478 C GLY A 99 25.930 14.736 5.979 1.00 0.00 C ATOM 1479 O GLY A 99 26.153 13.838 6.791 1.00 0.00 O ATOM 0 H GLY A 99 24.920 12.525 5.373 1.00 0.00 H new ATOM 0 HA2 GLY A 99 26.042 14.635 3.845 1.00 0.00 H new ATOM 0 HA3 GLY A 99 24.476 15.128 4.459 1.00 0.00 H new ATOM 1483 N PRO A 100 26.224 16.020 6.235 1.00 0.00 N ATOM 1484 CA PRO A 100 26.830 16.457 7.496 1.00 0.00 C ATOM 1485 C PRO A 100 25.868 16.341 8.673 1.00 0.00 C ATOM 1486 O PRO A 100 24.701 15.988 8.500 1.00 0.00 O ATOM 1487 CB PRO A 100 27.178 17.924 7.232 1.00 0.00 C ATOM 1488 CG PRO A 100 26.225 18.355 6.171 1.00 0.00 C ATOM 1489 CD PRO A 100 25.986 17.143 5.313 1.00 0.00 C ATOM 0 HA PRO A 100 27.688 15.843 7.770 1.00 0.00 H new ATOM 0 HB2 PRO A 100 27.065 18.526 8.134 1.00 0.00 H new ATOM 0 HB3 PRO A 100 28.212 18.033 6.904 1.00 0.00 H new ATOM 0 HG2 PRO A 100 25.293 18.715 6.606 1.00 0.00 H new ATOM 0 HG3 PRO A 100 26.640 19.174 5.583 1.00 0.00 H new ATOM 0 HD2 PRO A 100 24.972 17.127 4.914 1.00 0.00 H new ATOM 0 HD3 PRO A 100 26.665 17.114 4.461 1.00 0.00 H new ATOM 1497 N SER A 101 26.364 16.641 9.869 1.00 0.00 N ATOM 1498 CA SER A 101 25.548 16.567 11.075 1.00 0.00 C ATOM 1499 C SER A 101 25.667 17.851 11.891 1.00 0.00 C ATOM 1500 O SER A 101 26.739 18.180 12.398 1.00 0.00 O ATOM 1501 CB SER A 101 25.968 15.367 11.927 1.00 0.00 C ATOM 1502 OG SER A 101 27.325 15.473 12.323 1.00 0.00 O ATOM 0 H SER A 101 27.327 16.938 10.029 1.00 0.00 H new ATOM 0 HA SER A 101 24.508 16.444 10.774 1.00 0.00 H new ATOM 0 HB2 SER A 101 25.332 15.303 12.810 1.00 0.00 H new ATOM 0 HB3 SER A 101 25.822 14.447 11.362 1.00 0.00 H new ATOM 0 HG SER A 101 27.559 16.418 12.439 1.00 0.00 H new ATOM 1508 N SER A 102 24.557 18.572 12.012 1.00 0.00 N ATOM 1509 CA SER A 102 24.536 19.822 12.763 1.00 0.00 C ATOM 1510 C SER A 102 25.089 19.620 14.170 1.00 0.00 C ATOM 1511 O SER A 102 25.192 18.493 14.653 1.00 0.00 O ATOM 1512 CB SER A 102 23.110 20.373 12.837 1.00 0.00 C ATOM 1513 OG SER A 102 22.262 19.497 13.559 1.00 0.00 O ATOM 0 H SER A 102 23.661 18.312 11.600 1.00 0.00 H new ATOM 0 HA SER A 102 25.169 20.541 12.243 1.00 0.00 H new ATOM 0 HB2 SER A 102 23.119 21.352 13.316 1.00 0.00 H new ATOM 0 HB3 SER A 102 22.719 20.515 11.830 1.00 0.00 H new ATOM 0 HG SER A 102 21.357 19.872 13.594 1.00 0.00 H new ATOM 1519 N GLY A 103 25.444 20.723 14.824 1.00 0.00 N ATOM 1520 CA GLY A 103 25.982 20.646 16.169 1.00 0.00 C ATOM 1521 C GLY A 103 27.446 20.253 16.186 1.00 0.00 C ATOM 1522 O GLY A 103 27.846 19.297 15.522 1.00 0.00 O ATOM 0 H GLY A 103 25.368 21.667 14.446 1.00 0.00 H new ATOM 0 HA2 GLY A 103 25.862 21.611 16.661 1.00 0.00 H new ATOM 0 HA3 GLY A 103 25.408 19.921 16.746 1.00 0.00 H new TER 1526 GLY A 103