USER MOD reduce.3.24.130724 H: found=0, std=0, add=908, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 904 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 91 ASN : amide:sc= 0.04 X(o=0.12,f=-0.38) USER MOD Set 1.2: A 94 THR OG1 : rot 180:sc= 0.0808 USER MOD Set 2.1: A 70 LYS NZ :NH3+ -144:sc= 0.935 (180deg=-1.27!) USER MOD Set 2.2: A 102 ASN : amide:sc= -0.773 K(o=0.16,f=-3.8) USER MOD Set 3.1: A 48 HIS : no HD1:sc= 0.225 K(o=-0.26,f=-4.8) USER MOD Set 3.2: A 86 SER OG : rot 94:sc= -0.483! USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 2 ASN : amide:sc=-0.00565 K(o=-0.0057,f=-0.51) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 8 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A -1 SER OG : rot 180:sc= 0 USER MOD Single : A -2 SER OG : rot 180:sc= 0 USER MOD Single : A -4 SER OG : rot 180:sc= 0 USER MOD Single : A -5 SER OG : rot 180:sc= 0 USER MOD Single : A -6 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 ASN : amide:sc= -0.357 K(o=-0.36,f=-1.4!) USER MOD Single : A 16 TYR OH : rot 180:sc= 0 USER MOD Single : A 17 THR OG1 : rot -130:sc= -1.45 USER MOD Single : A 20 GLN : amide:sc= -8.15! C(o=-8.2!,f=-11!) USER MOD Single : A 25 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 27 THR OG1 : rot 166:sc= 1.15 USER MOD Single : A 29 TYR OH : rot 180:sc= 0 USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 CYS SG : rot -60:sc= -3.66! USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 GLN : amide:sc= -1.4 X(o=-1.4,f=-1.5) USER MOD Single : A 45 HIS : no HD1:sc= -1.27 K(o=-1.3,f=-2.2!) USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 MET CE :methyl -167:sc= -1.34 (180deg=-1.35) USER MOD Single : A 50 SER OG : rot 180:sc= 0 USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 52 CYS SG : rot 180:sc= 0 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 SER OG : rot 180:sc= -0.0101 USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 MET CE :methyl 166:sc= -0.131 (180deg=-0.633) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 ASN : amide:sc= -1.47 K(o=-1.5,f=-3.4!) USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 SER OG : rot 180:sc= 0 USER MOD Single : A 87 MET CE :methyl -112:sc= -2.57! (180deg=-7.67!) USER MOD Single : A 88 LYS NZ :NH3+ -159:sc= -0.463 (180deg=-0.935) USER MOD Single : A 92 GLN : amide:sc= -0.0867 K(o=-0.087,f=-1.7!) USER MOD Single : A 96 LYS NZ :NH3+ 161:sc= -0.0343 (180deg=-0.326) USER MOD Single : A 101 ASN : amide:sc= 0 X(o=0,f=-0.2) USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD Single : A 111 SER OG : rot 21:sc= 0.0939 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -6 31.518 21.562 20.937 1.00 0.00 N ATOM 2 CA GLY A -6 30.810 21.864 19.706 1.00 0.00 C ATOM 3 C GLY A -6 29.318 21.622 19.821 1.00 0.00 C ATOM 4 O GLY A -6 28.519 22.547 19.678 1.00 0.00 O ATOM 0 H1 GLY A -6 32.534 21.744 20.807 1.00 0.00 H new ATOM 0 H2 GLY A -6 31.154 22.164 21.703 1.00 0.00 H new ATOM 0 H3 GLY A -6 31.374 20.562 21.184 1.00 0.00 H new ATOM 0 HA2 GLY A -6 30.986 22.905 19.435 1.00 0.00 H new ATOM 0 HA3 GLY A -6 31.213 21.252 18.899 1.00 0.00 H new ATOM 8 N SER A -5 28.941 20.374 20.079 1.00 0.00 N ATOM 9 CA SER A -5 27.535 20.012 20.209 1.00 0.00 C ATOM 10 C SER A -5 27.357 18.865 21.199 1.00 0.00 C ATOM 11 O SER A -5 28.313 18.163 21.532 1.00 0.00 O ATOM 12 CB SER A -5 26.961 19.616 18.846 1.00 0.00 C ATOM 13 OG SER A -5 26.947 20.721 17.959 1.00 0.00 O ATOM 0 H SER A -5 29.590 19.597 20.202 1.00 0.00 H new ATOM 0 HA SER A -5 26.996 20.881 20.586 1.00 0.00 H new ATOM 0 HB2 SER A -5 27.556 18.809 18.418 1.00 0.00 H new ATOM 0 HB3 SER A -5 25.948 19.233 18.972 1.00 0.00 H new ATOM 0 HG SER A -5 26.578 20.442 17.095 1.00 0.00 H new ATOM 19 N SER A -4 26.127 18.682 21.670 1.00 0.00 N ATOM 20 CA SER A -4 25.823 17.624 22.626 1.00 0.00 C ATOM 21 C SER A -4 26.269 16.266 22.092 1.00 0.00 C ATOM 22 O SER A -4 26.033 15.934 20.932 1.00 0.00 O ATOM 23 CB SER A -4 24.324 17.599 22.931 1.00 0.00 C ATOM 24 OG SER A -4 24.042 16.741 24.024 1.00 0.00 O ATOM 0 H SER A -4 25.325 19.253 21.405 1.00 0.00 H new ATOM 0 HA SER A -4 26.370 17.830 23.546 1.00 0.00 H new ATOM 0 HB2 SER A -4 23.978 18.608 23.157 1.00 0.00 H new ATOM 0 HB3 SER A -4 23.776 17.264 22.050 1.00 0.00 H new ATOM 0 HG SER A -4 23.078 16.743 24.201 1.00 0.00 H new ATOM 30 N GLY A -3 26.915 15.482 22.951 1.00 0.00 N ATOM 31 CA GLY A -3 27.383 14.169 22.550 1.00 0.00 C ATOM 32 C GLY A -3 26.269 13.299 22.002 1.00 0.00 C ATOM 33 O GLY A -3 26.262 12.963 20.817 1.00 0.00 O ATOM 0 H GLY A -3 27.122 15.734 23.917 1.00 0.00 H new ATOM 0 HA2 GLY A -3 28.160 14.279 21.793 1.00 0.00 H new ATOM 0 HA3 GLY A -3 27.840 13.672 23.406 1.00 0.00 H new ATOM 37 N SER A -2 25.328 12.931 22.865 1.00 0.00 N ATOM 38 CA SER A -2 24.208 12.090 22.462 1.00 0.00 C ATOM 39 C SER A -2 22.899 12.874 22.496 1.00 0.00 C ATOM 40 O SER A -2 22.349 13.139 23.564 1.00 0.00 O ATOM 41 CB SER A -2 24.106 10.868 23.376 1.00 0.00 C ATOM 42 OG SER A -2 23.561 9.758 22.683 1.00 0.00 O ATOM 0 H SER A -2 25.319 13.202 23.848 1.00 0.00 H new ATOM 0 HA SER A -2 24.386 11.757 21.439 1.00 0.00 H new ATOM 0 HB2 SER A -2 25.094 10.613 23.759 1.00 0.00 H new ATOM 0 HB3 SER A -2 23.482 11.105 24.238 1.00 0.00 H new ATOM 0 HG SER A -2 23.508 8.989 23.288 1.00 0.00 H new ATOM 48 N SER A -1 22.407 13.243 21.317 1.00 0.00 N ATOM 49 CA SER A -1 21.166 14.001 21.210 1.00 0.00 C ATOM 50 C SER A -1 20.288 13.449 20.092 1.00 0.00 C ATOM 51 O SER A -1 20.761 13.185 18.988 1.00 0.00 O ATOM 52 CB SER A -1 21.466 15.479 20.955 1.00 0.00 C ATOM 53 OG SER A -1 22.357 15.638 19.864 1.00 0.00 O ATOM 0 H SER A -1 22.849 13.029 20.423 1.00 0.00 H new ATOM 0 HA SER A -1 20.628 13.905 22.153 1.00 0.00 H new ATOM 0 HB2 SER A -1 20.537 16.012 20.751 1.00 0.00 H new ATOM 0 HB3 SER A -1 21.899 15.925 21.850 1.00 0.00 H new ATOM 0 HG SER A -1 22.531 16.592 19.720 1.00 0.00 H new ATOM 59 N GLY A 0 19.002 13.276 20.388 1.00 0.00 N ATOM 60 CA GLY A 0 18.077 12.756 19.399 1.00 0.00 C ATOM 61 C GLY A 0 16.861 12.106 20.028 1.00 0.00 C ATOM 62 O GLY A 0 16.621 12.252 21.226 1.00 0.00 O ATOM 0 H GLY A 0 18.586 13.487 21.295 1.00 0.00 H new ATOM 0 HA2 GLY A 0 17.755 13.567 18.746 1.00 0.00 H new ATOM 0 HA3 GLY A 0 18.591 12.027 18.773 1.00 0.00 H new ATOM 66 N MET A 1 16.091 11.386 19.218 1.00 0.00 N ATOM 67 CA MET A 1 14.893 10.712 19.703 1.00 0.00 C ATOM 68 C MET A 1 15.254 9.433 20.451 1.00 0.00 C ATOM 69 O MET A 1 16.224 8.756 20.110 1.00 0.00 O ATOM 70 CB MET A 1 13.957 10.387 18.537 1.00 0.00 C ATOM 71 CG MET A 1 12.487 10.374 18.924 1.00 0.00 C ATOM 72 SD MET A 1 11.397 10.688 17.522 1.00 0.00 S ATOM 73 CE MET A 1 9.793 10.604 18.315 1.00 0.00 C ATOM 0 H MET A 1 16.276 11.255 18.223 1.00 0.00 H new ATOM 0 HA MET A 1 14.383 11.384 20.393 1.00 0.00 H new ATOM 0 HB2 MET A 1 14.109 11.120 17.744 1.00 0.00 H new ATOM 0 HB3 MET A 1 14.225 9.413 18.127 1.00 0.00 H new ATOM 0 HG2 MET A 1 12.239 9.407 19.363 1.00 0.00 H new ATOM 0 HG3 MET A 1 12.311 11.127 19.692 1.00 0.00 H new ATOM 0 HE1 MET A 1 9.012 10.778 17.575 1.00 0.00 H new ATOM 0 HE2 MET A 1 9.658 9.618 18.760 1.00 0.00 H new ATOM 0 HE3 MET A 1 9.732 11.364 19.093 1.00 0.00 H new ATOM 83 N ASN A 2 14.469 9.107 21.473 1.00 0.00 N ATOM 84 CA ASN A 2 14.708 7.909 22.270 1.00 0.00 C ATOM 85 C ASN A 2 15.952 8.073 23.138 1.00 0.00 C ATOM 86 O ASN A 2 16.628 7.096 23.462 1.00 0.00 O ATOM 87 CB ASN A 2 14.864 6.689 21.360 1.00 0.00 C ATOM 88 CG ASN A 2 14.426 5.404 22.036 1.00 0.00 C ATOM 89 OD1 ASN A 2 14.561 5.251 23.250 1.00 0.00 O ATOM 90 ND2 ASN A 2 13.897 4.473 21.250 1.00 0.00 N ATOM 0 H ASN A 2 13.662 9.656 21.769 1.00 0.00 H new ATOM 0 HA ASN A 2 13.848 7.759 22.923 1.00 0.00 H new ATOM 0 HB2 ASN A 2 14.277 6.838 20.454 1.00 0.00 H new ATOM 0 HB3 ASN A 2 15.906 6.598 21.054 1.00 0.00 H new ATOM 0 HD21 ASN A 2 13.583 3.588 21.648 1.00 0.00 H new ATOM 0 HD22 ASN A 2 13.805 4.643 20.249 1.00 0.00 H new ATOM 97 N SER A 3 16.247 9.313 23.511 1.00 0.00 N ATOM 98 CA SER A 3 17.411 9.606 24.339 1.00 0.00 C ATOM 99 C SER A 3 17.580 8.554 25.432 1.00 0.00 C ATOM 100 O SER A 3 16.601 8.022 25.953 1.00 0.00 O ATOM 101 CB SER A 3 17.281 10.994 24.969 1.00 0.00 C ATOM 102 OG SER A 3 16.185 11.046 25.866 1.00 0.00 O ATOM 0 H SER A 3 15.696 10.132 23.253 1.00 0.00 H new ATOM 0 HA SER A 3 18.293 9.586 23.699 1.00 0.00 H new ATOM 0 HB2 SER A 3 18.200 11.244 25.498 1.00 0.00 H new ATOM 0 HB3 SER A 3 17.150 11.741 24.186 1.00 0.00 H new ATOM 0 HG SER A 3 16.124 11.943 26.257 1.00 0.00 H new ATOM 108 N GLY A 4 18.831 8.257 25.772 1.00 0.00 N ATOM 109 CA GLY A 4 19.105 7.270 26.799 1.00 0.00 C ATOM 110 C GLY A 4 19.879 6.080 26.267 1.00 0.00 C ATOM 111 O GLY A 4 21.059 6.196 25.936 1.00 0.00 O ATOM 0 H GLY A 4 19.659 8.682 25.354 1.00 0.00 H new ATOM 0 HA2 GLY A 4 19.671 7.737 27.605 1.00 0.00 H new ATOM 0 HA3 GLY A 4 18.164 6.925 27.228 1.00 0.00 H new ATOM 115 N ARG A 5 19.214 4.933 26.186 1.00 0.00 N ATOM 116 CA ARG A 5 19.847 3.715 25.694 1.00 0.00 C ATOM 117 C ARG A 5 19.166 3.226 24.419 1.00 0.00 C ATOM 118 O ARG A 5 18.221 2.437 24.454 1.00 0.00 O ATOM 119 CB ARG A 5 19.799 2.622 26.763 1.00 0.00 C ATOM 120 CG ARG A 5 20.688 1.428 26.452 1.00 0.00 C ATOM 121 CD ARG A 5 20.651 0.400 27.573 1.00 0.00 C ATOM 122 NE ARG A 5 20.976 -0.942 27.096 1.00 0.00 N ATOM 123 CZ ARG A 5 22.188 -1.304 26.692 1.00 0.00 C ATOM 124 NH1 ARG A 5 23.185 -0.431 26.707 1.00 0.00 N ATOM 125 NH2 ARG A 5 22.405 -2.545 26.272 1.00 0.00 N ATOM 0 H ARG A 5 18.236 4.821 26.455 1.00 0.00 H new ATOM 0 HA ARG A 5 20.888 3.943 25.465 1.00 0.00 H new ATOM 0 HB2 ARG A 5 20.099 3.048 27.720 1.00 0.00 H new ATOM 0 HB3 ARG A 5 18.770 2.279 26.875 1.00 0.00 H new ATOM 0 HG2 ARG A 5 20.364 0.964 25.520 1.00 0.00 H new ATOM 0 HG3 ARG A 5 21.713 1.766 26.300 1.00 0.00 H new ATOM 0 HD2 ARG A 5 21.356 0.688 28.353 1.00 0.00 H new ATOM 0 HD3 ARG A 5 19.660 0.393 28.026 1.00 0.00 H new ATOM 0 HE ARG A 5 20.231 -1.639 27.072 1.00 0.00 H new ATOM 0 HH11 ARG A 5 23.023 0.523 27.030 1.00 0.00 H new ATOM 0 HH12 ARG A 5 24.115 -0.713 26.396 1.00 0.00 H new ATOM 0 HH21 ARG A 5 21.641 -3.220 26.260 1.00 0.00 H new ATOM 0 HH22 ARG A 5 23.336 -2.823 25.962 1.00 0.00 H new ATOM 139 N PRO A 6 19.656 3.704 23.265 1.00 0.00 N ATOM 140 CA PRO A 6 19.109 3.328 21.957 1.00 0.00 C ATOM 141 C PRO A 6 19.410 1.878 21.598 1.00 0.00 C ATOM 142 O PRO A 6 20.526 1.548 21.197 1.00 0.00 O ATOM 143 CB PRO A 6 19.819 4.279 20.991 1.00 0.00 C ATOM 144 CG PRO A 6 21.092 4.636 21.677 1.00 0.00 C ATOM 145 CD PRO A 6 20.780 4.647 23.149 1.00 0.00 C ATOM 0 HA PRO A 6 18.022 3.405 21.931 1.00 0.00 H new ATOM 0 HB2 PRO A 6 20.008 3.799 20.031 1.00 0.00 H new ATOM 0 HB3 PRO A 6 19.215 5.164 20.792 1.00 0.00 H new ATOM 0 HG2 PRO A 6 21.874 3.912 21.449 1.00 0.00 H new ATOM 0 HG3 PRO A 6 21.453 5.610 21.347 1.00 0.00 H new ATOM 0 HD2 PRO A 6 21.636 4.328 23.744 1.00 0.00 H new ATOM 0 HD3 PRO A 6 20.506 5.644 23.494 1.00 0.00 H new ATOM 153 N GLU A 7 18.409 1.015 21.744 1.00 0.00 N ATOM 154 CA GLU A 7 18.570 -0.400 21.435 1.00 0.00 C ATOM 155 C GLU A 7 17.486 -0.872 20.469 1.00 0.00 C ATOM 156 O GLU A 7 16.559 -1.582 20.856 1.00 0.00 O ATOM 157 CB GLU A 7 18.523 -1.234 22.716 1.00 0.00 C ATOM 158 CG GLU A 7 18.841 -2.704 22.499 1.00 0.00 C ATOM 159 CD GLU A 7 19.073 -3.449 23.798 1.00 0.00 C ATOM 160 OE1 GLU A 7 20.218 -3.429 24.296 1.00 0.00 O ATOM 161 OE2 GLU A 7 18.111 -4.053 24.317 1.00 0.00 O ATOM 0 H GLU A 7 17.479 1.272 22.074 1.00 0.00 H new ATOM 0 HA GLU A 7 19.542 -0.533 20.959 1.00 0.00 H new ATOM 0 HB2 GLU A 7 19.231 -0.820 23.435 1.00 0.00 H new ATOM 0 HB3 GLU A 7 17.531 -1.147 23.159 1.00 0.00 H new ATOM 0 HG2 GLU A 7 18.020 -3.173 21.957 1.00 0.00 H new ATOM 0 HG3 GLU A 7 19.728 -2.791 21.871 1.00 0.00 H new ATOM 168 N THR A 8 17.611 -0.471 19.207 1.00 0.00 N ATOM 169 CA THR A 8 16.643 -0.850 18.185 1.00 0.00 C ATOM 170 C THR A 8 17.285 -0.873 16.802 1.00 0.00 C ATOM 171 O THR A 8 18.431 -0.457 16.632 1.00 0.00 O ATOM 172 CB THR A 8 15.442 0.113 18.166 1.00 0.00 C ATOM 173 OG1 THR A 8 15.900 1.468 18.113 1.00 0.00 O ATOM 174 CG2 THR A 8 14.568 -0.085 19.396 1.00 0.00 C ATOM 0 H THR A 8 18.373 0.116 18.869 1.00 0.00 H new ATOM 0 HA THR A 8 16.292 -1.851 18.436 1.00 0.00 H new ATOM 0 HB THR A 8 14.847 -0.103 17.279 1.00 0.00 H new ATOM 0 HG1 THR A 8 15.130 2.073 18.099 1.00 0.00 H new ATOM 0 HG21 THR A 8 13.726 0.607 19.359 1.00 0.00 H new ATOM 0 HG22 THR A 8 14.195 -1.109 19.417 1.00 0.00 H new ATOM 0 HG23 THR A 8 15.155 0.105 20.294 1.00 0.00 H new ATOM 182 N MET A 9 16.537 -1.359 15.817 1.00 0.00 N ATOM 183 CA MET A 9 17.034 -1.435 14.448 1.00 0.00 C ATOM 184 C MET A 9 16.112 -0.680 13.494 1.00 0.00 C ATOM 185 O MET A 9 15.664 -1.229 12.488 1.00 0.00 O ATOM 186 CB MET A 9 17.159 -2.894 14.007 1.00 0.00 C ATOM 187 CG MET A 9 15.821 -3.581 13.788 1.00 0.00 C ATOM 188 SD MET A 9 15.895 -5.357 14.086 1.00 0.00 S ATOM 189 CE MET A 9 15.109 -5.464 15.692 1.00 0.00 C ATOM 0 H MET A 9 15.586 -1.706 15.941 1.00 0.00 H new ATOM 0 HA MET A 9 18.019 -0.970 14.419 1.00 0.00 H new ATOM 0 HB2 MET A 9 17.736 -2.937 13.083 1.00 0.00 H new ATOM 0 HB3 MET A 9 17.722 -3.445 14.760 1.00 0.00 H new ATOM 0 HG2 MET A 9 15.076 -3.137 14.448 1.00 0.00 H new ATOM 0 HG3 MET A 9 15.488 -3.402 12.766 1.00 0.00 H new ATOM 0 HE1 MET A 9 15.079 -6.505 16.014 1.00 0.00 H new ATOM 0 HE2 MET A 9 15.676 -4.877 16.414 1.00 0.00 H new ATOM 0 HE3 MET A 9 14.093 -5.075 15.626 1.00 0.00 H new ATOM 199 N GLU A 10 15.833 0.579 13.818 1.00 0.00 N ATOM 200 CA GLU A 10 14.965 1.405 12.989 1.00 0.00 C ATOM 201 C GLU A 10 15.723 1.957 11.786 1.00 0.00 C ATOM 202 O GLU A 10 16.312 3.035 11.851 1.00 0.00 O ATOM 203 CB GLU A 10 14.383 2.557 13.812 1.00 0.00 C ATOM 204 CG GLU A 10 13.200 3.242 13.149 1.00 0.00 C ATOM 205 CD GLU A 10 13.617 4.397 12.260 1.00 0.00 C ATOM 206 OE1 GLU A 10 14.438 5.224 12.709 1.00 0.00 O ATOM 207 OE2 GLU A 10 13.122 4.475 11.116 1.00 0.00 O ATOM 0 H GLU A 10 16.196 1.048 14.648 1.00 0.00 H new ATOM 0 HA GLU A 10 14.150 0.779 12.625 1.00 0.00 H new ATOM 0 HB2 GLU A 10 14.073 2.177 14.785 1.00 0.00 H new ATOM 0 HB3 GLU A 10 15.165 3.295 13.992 1.00 0.00 H new ATOM 0 HG2 GLU A 10 12.649 2.513 12.556 1.00 0.00 H new ATOM 0 HG3 GLU A 10 12.519 3.608 13.918 1.00 0.00 H new ATOM 214 N ASN A 11 15.705 1.208 10.688 1.00 0.00 N ATOM 215 CA ASN A 11 16.393 1.621 9.470 1.00 0.00 C ATOM 216 C ASN A 11 15.406 2.196 8.458 1.00 0.00 C ATOM 217 O ASN A 11 15.712 3.161 7.756 1.00 0.00 O ATOM 218 CB ASN A 11 17.139 0.436 8.854 1.00 0.00 C ATOM 219 CG ASN A 11 16.310 -0.834 8.856 1.00 0.00 C ATOM 220 OD1 ASN A 11 16.106 -1.454 9.900 1.00 0.00 O ATOM 221 ND2 ASN A 11 15.830 -1.227 7.682 1.00 0.00 N ATOM 0 H ASN A 11 15.222 0.313 10.617 1.00 0.00 H new ATOM 0 HA ASN A 11 17.112 2.397 9.733 1.00 0.00 H new ATOM 0 HB2 ASN A 11 17.421 0.681 7.830 1.00 0.00 H new ATOM 0 HB3 ASN A 11 18.063 0.265 9.407 1.00 0.00 H new ATOM 0 HD21 ASN A 11 15.266 -2.075 7.619 1.00 0.00 H new ATOM 0 HD22 ASN A 11 16.025 -0.681 6.843 1.00 0.00 H new ATOM 228 N LEU A 12 14.223 1.597 8.386 1.00 0.00 N ATOM 229 CA LEU A 12 13.190 2.049 7.460 1.00 0.00 C ATOM 230 C LEU A 12 13.029 3.565 7.523 1.00 0.00 C ATOM 231 O LEU A 12 13.360 4.209 8.519 1.00 0.00 O ATOM 232 CB LEU A 12 11.857 1.369 7.779 1.00 0.00 C ATOM 233 CG LEU A 12 11.724 -0.087 7.336 1.00 0.00 C ATOM 234 CD1 LEU A 12 10.294 -0.572 7.517 1.00 0.00 C ATOM 235 CD2 LEU A 12 12.164 -0.246 5.887 1.00 0.00 C ATOM 0 H LEU A 12 13.955 0.796 8.958 1.00 0.00 H new ATOM 0 HA LEU A 12 13.497 1.776 6.450 1.00 0.00 H new ATOM 0 HB2 LEU A 12 11.697 1.416 8.856 1.00 0.00 H new ATOM 0 HB3 LEU A 12 11.058 1.944 7.312 1.00 0.00 H new ATOM 0 HG LEU A 12 12.375 -0.698 7.962 1.00 0.00 H new ATOM 0 HD11 LEU A 12 10.219 -1.611 7.196 1.00 0.00 H new ATOM 0 HD12 LEU A 12 10.014 -0.495 8.568 1.00 0.00 H new ATOM 0 HD13 LEU A 12 9.623 0.042 6.917 1.00 0.00 H new ATOM 0 HD21 LEU A 12 12.063 -1.289 5.588 1.00 0.00 H new ATOM 0 HD22 LEU A 12 11.540 0.377 5.247 1.00 0.00 H new ATOM 0 HD23 LEU A 12 13.205 0.060 5.787 1.00 0.00 H new ATOM 247 N PRO A 13 12.507 4.151 6.435 1.00 0.00 N ATOM 248 CA PRO A 13 12.287 5.597 6.342 1.00 0.00 C ATOM 249 C PRO A 13 11.164 6.072 7.258 1.00 0.00 C ATOM 250 O PRO A 13 10.533 5.272 7.948 1.00 0.00 O ATOM 251 CB PRO A 13 11.905 5.804 4.875 1.00 0.00 C ATOM 252 CG PRO A 13 11.339 4.495 4.442 1.00 0.00 C ATOM 253 CD PRO A 13 12.090 3.444 5.211 1.00 0.00 C ATOM 0 HA PRO A 13 13.165 6.164 6.652 1.00 0.00 H new ATOM 0 HB2 PRO A 13 11.175 6.606 4.765 1.00 0.00 H new ATOM 0 HB3 PRO A 13 12.773 6.078 4.275 1.00 0.00 H new ATOM 0 HG2 PRO A 13 10.271 4.443 4.652 1.00 0.00 H new ATOM 0 HG3 PRO A 13 11.460 4.354 3.368 1.00 0.00 H new ATOM 0 HD2 PRO A 13 11.459 2.585 5.438 1.00 0.00 H new ATOM 0 HD3 PRO A 13 12.947 3.071 4.650 1.00 0.00 H new ATOM 261 N ALA A 14 10.919 7.378 7.257 1.00 0.00 N ATOM 262 CA ALA A 14 9.870 7.959 8.085 1.00 0.00 C ATOM 263 C ALA A 14 8.504 7.814 7.423 1.00 0.00 C ATOM 264 O ALA A 14 8.401 7.363 6.282 1.00 0.00 O ATOM 265 CB ALA A 14 10.170 9.423 8.367 1.00 0.00 C ATOM 0 H ALA A 14 11.433 8.054 6.692 1.00 0.00 H new ATOM 0 HA ALA A 14 9.845 7.417 9.030 1.00 0.00 H new ATOM 0 HB1 ALA A 14 9.378 9.844 8.986 1.00 0.00 H new ATOM 0 HB2 ALA A 14 11.123 9.505 8.891 1.00 0.00 H new ATOM 0 HB3 ALA A 14 10.225 9.971 7.426 1.00 0.00 H new ATOM 271 N LEU A 15 7.457 8.199 8.146 1.00 0.00 N ATOM 272 CA LEU A 15 6.096 8.112 7.627 1.00 0.00 C ATOM 273 C LEU A 15 5.877 9.118 6.503 1.00 0.00 C ATOM 274 O LEU A 15 6.406 10.229 6.538 1.00 0.00 O ATOM 275 CB LEU A 15 5.087 8.355 8.750 1.00 0.00 C ATOM 276 CG LEU A 15 3.653 7.900 8.473 1.00 0.00 C ATOM 277 CD1 LEU A 15 3.617 6.414 8.153 1.00 0.00 C ATOM 278 CD2 LEU A 15 2.755 8.214 9.660 1.00 0.00 C ATOM 0 H LEU A 15 7.525 8.574 9.092 1.00 0.00 H new ATOM 0 HA LEU A 15 5.949 7.110 7.225 1.00 0.00 H new ATOM 0 HB2 LEU A 15 5.442 7.847 9.647 1.00 0.00 H new ATOM 0 HB3 LEU A 15 5.072 9.422 8.973 1.00 0.00 H new ATOM 0 HG LEU A 15 3.280 8.446 7.607 1.00 0.00 H new ATOM 0 HD11 LEU A 15 2.589 6.108 7.959 1.00 0.00 H new ATOM 0 HD12 LEU A 15 4.227 6.217 7.271 1.00 0.00 H new ATOM 0 HD13 LEU A 15 4.009 5.850 8.999 1.00 0.00 H new ATOM 0 HD21 LEU A 15 1.739 7.883 9.445 1.00 0.00 H new ATOM 0 HD22 LEU A 15 3.126 7.695 10.544 1.00 0.00 H new ATOM 0 HD23 LEU A 15 2.756 9.289 9.843 1.00 0.00 H new ATOM 290 N TYR A 16 5.091 8.723 5.508 1.00 0.00 N ATOM 291 CA TYR A 16 4.800 9.590 4.373 1.00 0.00 C ATOM 292 C TYR A 16 6.076 9.944 3.616 1.00 0.00 C ATOM 293 O TYR A 16 6.157 10.982 2.959 1.00 0.00 O ATOM 294 CB TYR A 16 4.104 10.868 4.845 1.00 0.00 C ATOM 295 CG TYR A 16 2.768 10.621 5.507 1.00 0.00 C ATOM 296 CD1 TYR A 16 1.808 9.817 4.903 1.00 0.00 C ATOM 297 CD2 TYR A 16 2.464 11.189 6.738 1.00 0.00 C ATOM 298 CE1 TYR A 16 0.586 9.589 5.505 1.00 0.00 C ATOM 299 CE2 TYR A 16 1.246 10.965 7.347 1.00 0.00 C ATOM 300 CZ TYR A 16 0.309 10.164 6.727 1.00 0.00 C ATOM 301 OH TYR A 16 -0.907 9.939 7.330 1.00 0.00 O ATOM 0 H TYR A 16 4.644 7.807 5.465 1.00 0.00 H new ATOM 0 HA TYR A 16 4.136 9.050 3.698 1.00 0.00 H new ATOM 0 HB2 TYR A 16 4.756 11.389 5.546 1.00 0.00 H new ATOM 0 HB3 TYR A 16 3.960 11.530 3.991 1.00 0.00 H new ATOM 0 HD1 TYR A 16 2.021 9.363 3.947 1.00 0.00 H new ATOM 0 HD2 TYR A 16 3.194 11.817 7.227 1.00 0.00 H new ATOM 0 HE1 TYR A 16 -0.149 8.963 5.021 1.00 0.00 H new ATOM 0 HE2 TYR A 16 1.027 11.415 8.304 1.00 0.00 H new ATOM 0 HH TYR A 16 -0.941 10.416 8.186 1.00 0.00 H new ATOM 311 N THR A 17 7.074 9.070 3.713 1.00 0.00 N ATOM 312 CA THR A 17 8.348 9.287 3.038 1.00 0.00 C ATOM 313 C THR A 17 8.327 8.718 1.625 1.00 0.00 C ATOM 314 O THR A 17 7.806 7.627 1.393 1.00 0.00 O ATOM 315 CB THR A 17 9.513 8.650 3.819 1.00 0.00 C ATOM 316 OG1 THR A 17 9.578 9.200 5.139 1.00 0.00 O ATOM 317 CG2 THR A 17 10.835 8.879 3.102 1.00 0.00 C ATOM 0 H THR A 17 7.024 8.206 4.252 1.00 0.00 H new ATOM 0 HA THR A 17 8.499 10.365 2.989 1.00 0.00 H new ATOM 0 HB THR A 17 9.334 7.577 3.883 1.00 0.00 H new ATOM 0 HG1 THR A 17 10.495 9.487 5.329 1.00 0.00 H new ATOM 0 HG21 THR A 17 11.643 8.420 3.672 1.00 0.00 H new ATOM 0 HG22 THR A 17 10.793 8.432 2.109 1.00 0.00 H new ATOM 0 HG23 THR A 17 11.018 9.950 3.010 1.00 0.00 H new ATOM 325 N ILE A 18 8.896 9.463 0.683 1.00 0.00 N ATOM 326 CA ILE A 18 8.943 9.031 -0.708 1.00 0.00 C ATOM 327 C ILE A 18 10.334 8.529 -1.081 1.00 0.00 C ATOM 328 O ILE A 18 11.336 9.196 -0.821 1.00 0.00 O ATOM 329 CB ILE A 18 8.546 10.169 -1.666 1.00 0.00 C ATOM 330 CG1 ILE A 18 7.052 10.473 -1.541 1.00 0.00 C ATOM 331 CG2 ILE A 18 8.899 9.804 -3.100 1.00 0.00 C ATOM 332 CD1 ILE A 18 6.637 11.760 -2.218 1.00 0.00 C ATOM 0 H ILE A 18 9.331 10.369 0.858 1.00 0.00 H new ATOM 0 HA ILE A 18 8.226 8.216 -0.809 1.00 0.00 H new ATOM 0 HB ILE A 18 9.104 11.064 -1.392 1.00 0.00 H new ATOM 0 HG12 ILE A 18 6.485 9.647 -1.970 1.00 0.00 H new ATOM 0 HG13 ILE A 18 6.788 10.526 -0.485 1.00 0.00 H new ATOM 0 HG21 ILE A 18 8.612 10.619 -3.764 1.00 0.00 H new ATOM 0 HG22 ILE A 18 9.973 9.633 -3.178 1.00 0.00 H new ATOM 0 HG23 ILE A 18 8.366 8.898 -3.387 1.00 0.00 H new ATOM 0 HD11 ILE A 18 5.565 11.910 -2.088 1.00 0.00 H new ATOM 0 HD12 ILE A 18 7.177 12.596 -1.773 1.00 0.00 H new ATOM 0 HD13 ILE A 18 6.869 11.703 -3.281 1.00 0.00 H new ATOM 344 N PHE A 19 10.388 7.352 -1.694 1.00 0.00 N ATOM 345 CA PHE A 19 11.657 6.761 -2.104 1.00 0.00 C ATOM 346 C PHE A 19 11.470 5.870 -3.330 1.00 0.00 C ATOM 347 O PHE A 19 10.367 5.399 -3.605 1.00 0.00 O ATOM 348 CB PHE A 19 12.261 5.949 -0.957 1.00 0.00 C ATOM 349 CG PHE A 19 11.265 5.070 -0.255 1.00 0.00 C ATOM 350 CD1 PHE A 19 10.830 3.891 -0.837 1.00 0.00 C ATOM 351 CD2 PHE A 19 10.763 5.426 0.987 1.00 0.00 C ATOM 352 CE1 PHE A 19 9.914 3.080 -0.195 1.00 0.00 C ATOM 353 CE2 PHE A 19 9.846 4.618 1.635 1.00 0.00 C ATOM 354 CZ PHE A 19 9.420 3.444 1.043 1.00 0.00 C ATOM 0 H PHE A 19 9.568 6.788 -1.918 1.00 0.00 H new ATOM 0 HA PHE A 19 12.339 7.570 -2.364 1.00 0.00 H new ATOM 0 HB2 PHE A 19 13.069 5.330 -1.347 1.00 0.00 H new ATOM 0 HB3 PHE A 19 12.704 6.632 -0.233 1.00 0.00 H new ATOM 0 HD1 PHE A 19 11.212 3.602 -1.805 1.00 0.00 H new ATOM 0 HD2 PHE A 19 11.091 6.343 1.453 1.00 0.00 H new ATOM 0 HE1 PHE A 19 9.585 2.163 -0.660 1.00 0.00 H new ATOM 0 HE2 PHE A 19 9.463 4.905 2.603 1.00 0.00 H new ATOM 0 HZ PHE A 19 8.703 2.813 1.547 1.00 0.00 H new ATOM 364 N GLN A 20 12.558 5.646 -4.061 1.00 0.00 N ATOM 365 CA GLN A 20 12.514 4.813 -5.258 1.00 0.00 C ATOM 366 C GLN A 20 12.933 3.381 -4.940 1.00 0.00 C ATOM 367 O GLN A 20 14.034 3.142 -4.445 1.00 0.00 O ATOM 368 CB GLN A 20 13.422 5.395 -6.342 1.00 0.00 C ATOM 369 CG GLN A 20 12.947 5.101 -7.756 1.00 0.00 C ATOM 370 CD GLN A 20 13.689 5.909 -8.801 1.00 0.00 C ATOM 371 OE1 GLN A 20 14.675 6.583 -8.498 1.00 0.00 O ATOM 372 NE2 GLN A 20 13.218 5.848 -10.041 1.00 0.00 N ATOM 0 H GLN A 20 13.479 6.029 -3.846 1.00 0.00 H new ATOM 0 HA GLN A 20 11.487 4.798 -5.624 1.00 0.00 H new ATOM 0 HB2 GLN A 20 13.489 6.475 -6.207 1.00 0.00 H new ATOM 0 HB3 GLN A 20 14.428 4.995 -6.215 1.00 0.00 H new ATOM 0 HG2 GLN A 20 13.076 4.039 -7.965 1.00 0.00 H new ATOM 0 HG3 GLN A 20 11.880 5.313 -7.828 1.00 0.00 H new ATOM 0 HE21 GLN A 20 12.398 5.277 -10.248 1.00 0.00 H new ATOM 0 HE22 GLN A 20 13.676 6.372 -10.787 1.00 0.00 H new ATOM 381 N GLY A 21 12.047 2.433 -5.227 1.00 0.00 N ATOM 382 CA GLY A 21 12.344 1.037 -4.965 1.00 0.00 C ATOM 383 C GLY A 21 12.056 0.149 -6.159 1.00 0.00 C ATOM 384 O GLY A 21 11.357 0.553 -7.087 1.00 0.00 O ATOM 0 H GLY A 21 11.129 2.606 -5.636 1.00 0.00 H new ATOM 0 HA2 GLY A 21 13.393 0.938 -4.687 1.00 0.00 H new ATOM 0 HA3 GLY A 21 11.755 0.697 -4.113 1.00 0.00 H new ATOM 388 N GLU A 22 12.598 -1.065 -6.137 1.00 0.00 N ATOM 389 CA GLU A 22 12.397 -2.011 -7.227 1.00 0.00 C ATOM 390 C GLU A 22 11.517 -3.175 -6.783 1.00 0.00 C ATOM 391 O GLU A 22 11.688 -3.715 -5.690 1.00 0.00 O ATOM 392 CB GLU A 22 13.744 -2.537 -7.730 1.00 0.00 C ATOM 393 CG GLU A 22 13.619 -3.702 -8.698 1.00 0.00 C ATOM 394 CD GLU A 22 14.890 -4.522 -8.793 1.00 0.00 C ATOM 395 OE1 GLU A 22 15.881 -4.017 -9.361 1.00 0.00 O ATOM 396 OE2 GLU A 22 14.895 -5.668 -8.296 1.00 0.00 O ATOM 0 H GLU A 22 13.180 -1.416 -5.376 1.00 0.00 H new ATOM 0 HA GLU A 22 11.893 -1.488 -8.040 1.00 0.00 H new ATOM 0 HB2 GLU A 22 14.282 -1.725 -8.219 1.00 0.00 H new ATOM 0 HB3 GLU A 22 14.345 -2.848 -6.876 1.00 0.00 H new ATOM 0 HG2 GLU A 22 12.799 -4.346 -8.381 1.00 0.00 H new ATOM 0 HG3 GLU A 22 13.362 -3.322 -9.687 1.00 0.00 H new ATOM 403 N VAL A 23 10.574 -3.557 -7.638 1.00 0.00 N ATOM 404 CA VAL A 23 9.666 -4.658 -7.336 1.00 0.00 C ATOM 405 C VAL A 23 10.431 -5.961 -7.136 1.00 0.00 C ATOM 406 O VAL A 23 11.304 -6.308 -7.931 1.00 0.00 O ATOM 407 CB VAL A 23 8.626 -4.850 -8.454 1.00 0.00 C ATOM 408 CG1 VAL A 23 7.887 -6.168 -8.275 1.00 0.00 C ATOM 409 CG2 VAL A 23 7.650 -3.683 -8.482 1.00 0.00 C ATOM 0 H VAL A 23 10.418 -3.120 -8.546 1.00 0.00 H new ATOM 0 HA VAL A 23 9.149 -4.399 -6.412 1.00 0.00 H new ATOM 0 HB VAL A 23 9.149 -4.880 -9.410 1.00 0.00 H new ATOM 0 HG11 VAL A 23 7.156 -6.287 -9.075 1.00 0.00 H new ATOM 0 HG12 VAL A 23 8.599 -6.992 -8.310 1.00 0.00 H new ATOM 0 HG13 VAL A 23 7.376 -6.171 -7.312 1.00 0.00 H new ATOM 0 HG21 VAL A 23 6.922 -3.836 -9.279 1.00 0.00 H new ATOM 0 HG22 VAL A 23 7.132 -3.619 -7.525 1.00 0.00 H new ATOM 0 HG23 VAL A 23 8.196 -2.757 -8.662 1.00 0.00 H new ATOM 419 N ALA A 24 10.095 -6.681 -6.071 1.00 0.00 N ATOM 420 CA ALA A 24 10.749 -7.948 -5.769 1.00 0.00 C ATOM 421 C ALA A 24 9.762 -9.108 -5.852 1.00 0.00 C ATOM 422 O ALA A 24 10.154 -10.254 -6.066 1.00 0.00 O ATOM 423 CB ALA A 24 11.389 -7.895 -4.389 1.00 0.00 C ATOM 0 H ALA A 24 9.374 -6.409 -5.403 1.00 0.00 H new ATOM 0 HA ALA A 24 11.528 -8.114 -6.513 1.00 0.00 H new ATOM 0 HB1 ALA A 24 11.874 -8.848 -4.176 1.00 0.00 H new ATOM 0 HB2 ALA A 24 12.130 -7.096 -4.362 1.00 0.00 H new ATOM 0 HB3 ALA A 24 10.622 -7.703 -3.639 1.00 0.00 H new ATOM 429 N MET A 25 8.480 -8.801 -5.680 1.00 0.00 N ATOM 430 CA MET A 25 7.437 -9.819 -5.737 1.00 0.00 C ATOM 431 C MET A 25 6.139 -9.237 -6.289 1.00 0.00 C ATOM 432 O MET A 25 5.775 -8.103 -5.980 1.00 0.00 O ATOM 433 CB MET A 25 7.194 -10.409 -4.347 1.00 0.00 C ATOM 434 CG MET A 25 6.392 -11.700 -4.366 1.00 0.00 C ATOM 435 SD MET A 25 6.768 -12.772 -2.965 1.00 0.00 S ATOM 436 CE MET A 25 5.119 -13.253 -2.456 1.00 0.00 C ATOM 0 H MET A 25 8.139 -7.857 -5.500 1.00 0.00 H new ATOM 0 HA MET A 25 7.773 -10.611 -6.406 1.00 0.00 H new ATOM 0 HB2 MET A 25 8.155 -10.595 -3.867 1.00 0.00 H new ATOM 0 HB3 MET A 25 6.670 -9.674 -3.736 1.00 0.00 H new ATOM 0 HG2 MET A 25 5.328 -11.462 -4.362 1.00 0.00 H new ATOM 0 HG3 MET A 25 6.595 -12.236 -5.293 1.00 0.00 H new ATOM 0 HE1 MET A 25 5.184 -13.920 -1.596 1.00 0.00 H new ATOM 0 HE2 MET A 25 4.548 -12.365 -2.185 1.00 0.00 H new ATOM 0 HE3 MET A 25 4.620 -13.768 -3.277 1.00 0.00 H new ATOM 446 N VAL A 26 5.447 -10.022 -7.109 1.00 0.00 N ATOM 447 CA VAL A 26 4.189 -9.585 -7.703 1.00 0.00 C ATOM 448 C VAL A 26 3.046 -10.519 -7.321 1.00 0.00 C ATOM 449 O VAL A 26 3.111 -11.726 -7.554 1.00 0.00 O ATOM 450 CB VAL A 26 4.288 -9.515 -9.238 1.00 0.00 C ATOM 451 CG1 VAL A 26 2.926 -9.221 -9.849 1.00 0.00 C ATOM 452 CG2 VAL A 26 5.308 -8.467 -9.658 1.00 0.00 C ATOM 0 H VAL A 26 5.736 -10.963 -7.377 1.00 0.00 H new ATOM 0 HA VAL A 26 3.985 -8.588 -7.313 1.00 0.00 H new ATOM 0 HB VAL A 26 4.623 -10.484 -9.608 1.00 0.00 H new ATOM 0 HG11 VAL A 26 3.016 -9.175 -10.934 1.00 0.00 H new ATOM 0 HG12 VAL A 26 2.227 -10.011 -9.576 1.00 0.00 H new ATOM 0 HG13 VAL A 26 2.558 -8.266 -9.475 1.00 0.00 H new ATOM 0 HG21 VAL A 26 5.365 -8.431 -10.746 1.00 0.00 H new ATOM 0 HG22 VAL A 26 5.005 -7.491 -9.278 1.00 0.00 H new ATOM 0 HG23 VAL A 26 6.285 -8.727 -9.252 1.00 0.00 H new ATOM 462 N THR A 27 1.998 -9.952 -6.731 1.00 0.00 N ATOM 463 CA THR A 27 0.840 -10.734 -6.315 1.00 0.00 C ATOM 464 C THR A 27 -0.440 -10.199 -6.947 1.00 0.00 C ATOM 465 O THR A 27 -0.494 -9.050 -7.386 1.00 0.00 O ATOM 466 CB THR A 27 0.683 -10.733 -4.783 1.00 0.00 C ATOM 467 OG1 THR A 27 0.400 -9.407 -4.320 1.00 0.00 O ATOM 468 CG2 THR A 27 1.943 -11.253 -4.109 1.00 0.00 C ATOM 0 H THR A 27 1.927 -8.954 -6.531 1.00 0.00 H new ATOM 0 HA THR A 27 1.010 -11.756 -6.654 1.00 0.00 H new ATOM 0 HB THR A 27 -0.146 -11.392 -4.525 1.00 0.00 H new ATOM 0 HG1 THR A 27 0.082 -9.445 -3.394 1.00 0.00 H new ATOM 0 HG21 THR A 27 1.808 -11.243 -3.027 1.00 0.00 H new ATOM 0 HG22 THR A 27 2.139 -12.273 -4.441 1.00 0.00 H new ATOM 0 HG23 THR A 27 2.787 -10.617 -4.375 1.00 0.00 H new ATOM 476 N ASP A 28 -1.469 -11.037 -6.988 1.00 0.00 N ATOM 477 CA ASP A 28 -2.751 -10.648 -7.565 1.00 0.00 C ATOM 478 C ASP A 28 -3.481 -9.667 -6.652 1.00 0.00 C ATOM 479 O ASP A 28 -4.598 -9.241 -6.949 1.00 0.00 O ATOM 480 CB ASP A 28 -3.621 -11.882 -7.808 1.00 0.00 C ATOM 481 CG ASP A 28 -3.058 -12.783 -8.891 1.00 0.00 C ATOM 482 OD1 ASP A 28 -1.918 -13.266 -8.728 1.00 0.00 O ATOM 483 OD2 ASP A 28 -3.757 -13.004 -9.901 1.00 0.00 O ATOM 0 H ASP A 28 -1.441 -11.991 -6.628 1.00 0.00 H new ATOM 0 HA ASP A 28 -2.559 -10.156 -8.518 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -3.712 -12.447 -6.880 1.00 0.00 H new ATOM 0 HB3 ASP A 28 -4.626 -11.565 -8.089 1.00 0.00 H new ATOM 488 N TYR A 29 -2.845 -9.315 -5.541 1.00 0.00 N ATOM 489 CA TYR A 29 -3.435 -8.387 -4.583 1.00 0.00 C ATOM 490 C TYR A 29 -2.474 -7.245 -4.267 1.00 0.00 C ATOM 491 O TYR A 29 -2.693 -6.475 -3.333 1.00 0.00 O ATOM 492 CB TYR A 29 -3.813 -9.122 -3.296 1.00 0.00 C ATOM 493 CG TYR A 29 -2.714 -10.013 -2.763 1.00 0.00 C ATOM 494 CD1 TYR A 29 -1.611 -9.475 -2.112 1.00 0.00 C ATOM 495 CD2 TYR A 29 -2.779 -11.394 -2.910 1.00 0.00 C ATOM 496 CE1 TYR A 29 -0.603 -10.285 -1.624 1.00 0.00 C ATOM 497 CE2 TYR A 29 -1.777 -12.212 -2.423 1.00 0.00 C ATOM 498 CZ TYR A 29 -0.692 -11.653 -1.782 1.00 0.00 C ATOM 499 OH TYR A 29 0.309 -12.464 -1.296 1.00 0.00 O ATOM 0 H TYR A 29 -1.920 -9.658 -5.281 1.00 0.00 H new ATOM 0 HA TYR A 29 -4.335 -7.966 -5.031 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -4.077 -8.389 -2.533 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -4.702 -9.726 -3.480 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -1.540 -8.405 -1.985 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -3.627 -11.835 -3.413 1.00 0.00 H new ATOM 0 HE1 TYR A 29 0.249 -9.850 -1.122 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -1.844 -13.283 -2.544 1.00 0.00 H new ATOM 0 HH TYR A 29 0.093 -13.401 -1.488 1.00 0.00 H new ATOM 509 N GLY A 30 -1.408 -7.143 -5.054 1.00 0.00 N ATOM 510 CA GLY A 30 -0.428 -6.093 -4.844 1.00 0.00 C ATOM 511 C GLY A 30 0.970 -6.512 -5.253 1.00 0.00 C ATOM 512 O GLY A 30 1.155 -7.568 -5.858 1.00 0.00 O ATOM 0 H GLY A 30 -1.205 -7.769 -5.834 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -0.720 -5.210 -5.412 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -0.425 -5.809 -3.792 1.00 0.00 H new ATOM 516 N ALA A 31 1.955 -5.683 -4.924 1.00 0.00 N ATOM 517 CA ALA A 31 3.343 -5.974 -5.262 1.00 0.00 C ATOM 518 C ALA A 31 4.283 -5.522 -4.151 1.00 0.00 C ATOM 519 O ALA A 31 4.020 -4.537 -3.463 1.00 0.00 O ATOM 520 CB ALA A 31 3.716 -5.308 -6.577 1.00 0.00 C ATOM 0 H ALA A 31 1.818 -4.805 -4.424 1.00 0.00 H new ATOM 0 HA ALA A 31 3.447 -7.053 -5.373 1.00 0.00 H new ATOM 0 HB1 ALA A 31 4.755 -5.534 -6.817 1.00 0.00 H new ATOM 0 HB2 ALA A 31 3.070 -5.683 -7.371 1.00 0.00 H new ATOM 0 HB3 ALA A 31 3.590 -4.229 -6.487 1.00 0.00 H new ATOM 526 N PHE A 32 5.383 -6.250 -3.980 1.00 0.00 N ATOM 527 CA PHE A 32 6.363 -5.925 -2.952 1.00 0.00 C ATOM 528 C PHE A 32 7.466 -5.032 -3.513 1.00 0.00 C ATOM 529 O PHE A 32 8.073 -5.348 -4.537 1.00 0.00 O ATOM 530 CB PHE A 32 6.971 -7.205 -2.374 1.00 0.00 C ATOM 531 CG PHE A 32 6.029 -7.970 -1.490 1.00 0.00 C ATOM 532 CD1 PHE A 32 5.035 -8.765 -2.038 1.00 0.00 C ATOM 533 CD2 PHE A 32 6.137 -7.896 -0.111 1.00 0.00 C ATOM 534 CE1 PHE A 32 4.167 -9.472 -1.227 1.00 0.00 C ATOM 535 CE2 PHE A 32 5.272 -8.600 0.705 1.00 0.00 C ATOM 536 CZ PHE A 32 4.285 -9.388 0.146 1.00 0.00 C ATOM 0 H PHE A 32 5.617 -7.069 -4.541 1.00 0.00 H new ATOM 0 HA PHE A 32 5.851 -5.383 -2.157 1.00 0.00 H new ATOM 0 HB2 PHE A 32 7.290 -7.848 -3.194 1.00 0.00 H new ATOM 0 HB3 PHE A 32 7.864 -6.948 -1.804 1.00 0.00 H new ATOM 0 HD1 PHE A 32 4.937 -8.833 -3.111 1.00 0.00 H new ATOM 0 HD2 PHE A 32 6.906 -7.281 0.332 1.00 0.00 H new ATOM 0 HE1 PHE A 32 3.398 -10.089 -1.667 1.00 0.00 H new ATOM 0 HE2 PHE A 32 5.368 -8.534 1.779 1.00 0.00 H new ATOM 0 HZ PHE A 32 3.607 -9.938 0.782 1.00 0.00 H new ATOM 546 N ILE A 33 7.719 -3.918 -2.835 1.00 0.00 N ATOM 547 CA ILE A 33 8.749 -2.980 -3.267 1.00 0.00 C ATOM 548 C ILE A 33 9.938 -2.993 -2.312 1.00 0.00 C ATOM 549 O ILE A 33 9.772 -3.059 -1.095 1.00 0.00 O ATOM 550 CB ILE A 33 8.198 -1.545 -3.363 1.00 0.00 C ATOM 551 CG1 ILE A 33 7.019 -1.492 -4.337 1.00 0.00 C ATOM 552 CG2 ILE A 33 9.295 -0.585 -3.799 1.00 0.00 C ATOM 553 CD1 ILE A 33 7.327 -2.089 -5.692 1.00 0.00 C ATOM 0 H ILE A 33 7.226 -3.643 -1.986 1.00 0.00 H new ATOM 0 HA ILE A 33 9.076 -3.302 -4.256 1.00 0.00 H new ATOM 0 HB ILE A 33 7.845 -1.240 -2.378 1.00 0.00 H new ATOM 0 HG12 ILE A 33 6.173 -2.022 -3.900 1.00 0.00 H new ATOM 0 HG13 ILE A 33 6.712 -0.454 -4.467 1.00 0.00 H new ATOM 0 HG21 ILE A 33 8.890 0.425 -3.862 1.00 0.00 H new ATOM 0 HG22 ILE A 33 10.107 -0.606 -3.072 1.00 0.00 H new ATOM 0 HG23 ILE A 33 9.675 -0.886 -4.775 1.00 0.00 H new ATOM 0 HD11 ILE A 33 6.446 -2.017 -6.330 1.00 0.00 H new ATOM 0 HD12 ILE A 33 8.153 -1.545 -6.150 1.00 0.00 H new ATOM 0 HD13 ILE A 33 7.605 -3.136 -5.574 1.00 0.00 H new ATOM 565 N LYS A 34 11.140 -2.928 -2.875 1.00 0.00 N ATOM 566 CA LYS A 34 12.360 -2.929 -2.076 1.00 0.00 C ATOM 567 C LYS A 34 12.850 -1.506 -1.829 1.00 0.00 C ATOM 568 O LYS A 34 13.033 -0.731 -2.769 1.00 0.00 O ATOM 569 CB LYS A 34 13.452 -3.742 -2.774 1.00 0.00 C ATOM 570 CG LYS A 34 13.181 -5.237 -2.791 1.00 0.00 C ATOM 571 CD LYS A 34 14.441 -6.029 -3.096 1.00 0.00 C ATOM 572 CE LYS A 34 15.338 -6.142 -1.872 1.00 0.00 C ATOM 573 NZ LYS A 34 16.776 -6.238 -2.246 1.00 0.00 N ATOM 0 H LYS A 34 11.295 -2.874 -3.882 1.00 0.00 H new ATOM 0 HA LYS A 34 12.133 -3.389 -1.114 1.00 0.00 H new ATOM 0 HB2 LYS A 34 13.557 -3.389 -3.800 1.00 0.00 H new ATOM 0 HB3 LYS A 34 14.404 -3.559 -2.275 1.00 0.00 H new ATOM 0 HG2 LYS A 34 12.781 -5.546 -1.825 1.00 0.00 H new ATOM 0 HG3 LYS A 34 12.420 -5.461 -3.538 1.00 0.00 H new ATOM 0 HD2 LYS A 34 14.170 -7.026 -3.443 1.00 0.00 H new ATOM 0 HD3 LYS A 34 14.988 -5.547 -3.906 1.00 0.00 H new ATOM 0 HE2 LYS A 34 15.187 -5.275 -1.230 1.00 0.00 H new ATOM 0 HE3 LYS A 34 15.054 -7.021 -1.293 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 17.354 -6.313 -1.385 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 16.925 -7.080 -2.838 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 17.054 -5.388 -2.776 1.00 0.00 H new ATOM 587 N ILE A 35 13.064 -1.169 -0.561 1.00 0.00 N ATOM 588 CA ILE A 35 13.536 0.159 -0.194 1.00 0.00 C ATOM 589 C ILE A 35 15.057 0.245 -0.272 1.00 0.00 C ATOM 590 O ILE A 35 15.776 -0.660 0.152 1.00 0.00 O ATOM 591 CB ILE A 35 13.085 0.543 1.227 1.00 0.00 C ATOM 592 CG1 ILE A 35 11.559 0.493 1.333 1.00 0.00 C ATOM 593 CG2 ILE A 35 13.600 1.927 1.591 1.00 0.00 C ATOM 594 CD1 ILE A 35 11.055 0.379 2.755 1.00 0.00 C ATOM 0 H ILE A 35 12.918 -1.798 0.229 1.00 0.00 H new ATOM 0 HA ILE A 35 13.098 0.857 -0.908 1.00 0.00 H new ATOM 0 HB ILE A 35 13.504 -0.176 1.931 1.00 0.00 H new ATOM 0 HG12 ILE A 35 11.142 1.392 0.879 1.00 0.00 H new ATOM 0 HG13 ILE A 35 11.191 -0.355 0.756 1.00 0.00 H new ATOM 0 HG21 ILE A 35 13.273 2.184 2.598 1.00 0.00 H new ATOM 0 HG22 ILE A 35 14.689 1.932 1.551 1.00 0.00 H new ATOM 0 HG23 ILE A 35 13.208 2.659 0.885 1.00 0.00 H new ATOM 0 HD11 ILE A 35 9.965 0.349 2.754 1.00 0.00 H new ATOM 0 HD12 ILE A 35 11.443 -0.534 3.206 1.00 0.00 H new ATOM 0 HD13 ILE A 35 11.393 1.240 3.331 1.00 0.00 H new ATOM 606 N PRO A 36 15.558 1.357 -0.827 1.00 0.00 N ATOM 607 CA PRO A 36 17.000 1.588 -0.973 1.00 0.00 C ATOM 608 C PRO A 36 17.686 1.828 0.368 1.00 0.00 C ATOM 609 O PRO A 36 17.354 2.769 1.087 1.00 0.00 O ATOM 610 CB PRO A 36 17.071 2.845 -1.843 1.00 0.00 C ATOM 611 CG PRO A 36 15.783 3.552 -1.594 1.00 0.00 C ATOM 612 CD PRO A 36 14.760 2.476 -1.354 1.00 0.00 C ATOM 0 HA PRO A 36 17.510 0.726 -1.403 1.00 0.00 H new ATOM 0 HB2 PRO A 36 17.923 3.467 -1.570 1.00 0.00 H new ATOM 0 HB3 PRO A 36 17.186 2.591 -2.897 1.00 0.00 H new ATOM 0 HG2 PRO A 36 15.862 4.215 -0.732 1.00 0.00 H new ATOM 0 HG3 PRO A 36 15.506 4.171 -2.448 1.00 0.00 H new ATOM 0 HD2 PRO A 36 13.999 2.797 -0.643 1.00 0.00 H new ATOM 0 HD3 PRO A 36 14.242 2.202 -2.273 1.00 0.00 H new ATOM 620 N GLY A 37 18.647 0.970 0.697 1.00 0.00 N ATOM 621 CA GLY A 37 19.366 1.107 1.951 1.00 0.00 C ATOM 622 C GLY A 37 18.539 0.668 3.143 1.00 0.00 C ATOM 623 O GLY A 37 18.513 1.345 4.172 1.00 0.00 O ATOM 0 H GLY A 37 18.940 0.183 0.118 1.00 0.00 H new ATOM 0 HA2 GLY A 37 20.280 0.515 1.909 1.00 0.00 H new ATOM 0 HA3 GLY A 37 19.665 2.147 2.083 1.00 0.00 H new ATOM 627 N CYS A 38 17.864 -0.467 3.007 1.00 0.00 N ATOM 628 CA CYS A 38 17.030 -0.994 4.081 1.00 0.00 C ATOM 629 C CYS A 38 17.143 -2.513 4.161 1.00 0.00 C ATOM 630 O CYS A 38 17.903 -3.130 3.413 1.00 0.00 O ATOM 631 CB CYS A 38 15.570 -0.590 3.869 1.00 0.00 C ATOM 632 SG CYS A 38 15.134 1.010 4.588 1.00 0.00 S ATOM 0 H CYS A 38 17.878 -1.040 2.164 1.00 0.00 H new ATOM 0 HA CYS A 38 17.383 -0.571 5.021 1.00 0.00 H new ATOM 0 HB2 CYS A 38 15.363 -0.564 2.799 1.00 0.00 H new ATOM 0 HB3 CYS A 38 14.926 -1.357 4.299 1.00 0.00 H new ATOM 0 HG CYS A 38 15.337 0.979 5.872 1.00 0.00 H new ATOM 638 N ARG A 39 16.385 -3.111 5.075 1.00 0.00 N ATOM 639 CA ARG A 39 16.402 -4.557 5.255 1.00 0.00 C ATOM 640 C ARG A 39 15.045 -5.165 4.912 1.00 0.00 C ATOM 641 O ARG A 39 14.959 -6.129 4.150 1.00 0.00 O ATOM 642 CB ARG A 39 16.780 -4.909 6.695 1.00 0.00 C ATOM 643 CG ARG A 39 16.871 -6.404 6.954 1.00 0.00 C ATOM 644 CD ARG A 39 18.228 -6.957 6.549 1.00 0.00 C ATOM 645 NE ARG A 39 18.173 -8.390 6.269 1.00 0.00 N ATOM 646 CZ ARG A 39 17.514 -8.912 5.239 1.00 0.00 C ATOM 647 NH1 ARG A 39 16.859 -8.124 4.399 1.00 0.00 N ATOM 648 NH2 ARG A 39 17.511 -10.226 5.050 1.00 0.00 N ATOM 0 H ARG A 39 15.751 -2.616 5.702 1.00 0.00 H new ATOM 0 HA ARG A 39 17.148 -4.972 4.578 1.00 0.00 H new ATOM 0 HB2 ARG A 39 17.739 -4.449 6.932 1.00 0.00 H new ATOM 0 HB3 ARG A 39 16.043 -4.476 7.371 1.00 0.00 H new ATOM 0 HG2 ARG A 39 16.697 -6.603 8.011 1.00 0.00 H new ATOM 0 HG3 ARG A 39 16.087 -6.919 6.399 1.00 0.00 H new ATOM 0 HD2 ARG A 39 18.586 -6.428 5.666 1.00 0.00 H new ATOM 0 HD3 ARG A 39 18.948 -6.771 7.346 1.00 0.00 H new ATOM 0 HE ARG A 39 18.667 -9.024 6.897 1.00 0.00 H new ATOM 0 HH11 ARG A 39 16.859 -7.114 4.542 1.00 0.00 H new ATOM 0 HH12 ARG A 39 16.354 -8.527 3.610 1.00 0.00 H new ATOM 0 HH21 ARG A 39 18.014 -10.835 5.695 1.00 0.00 H new ATOM 0 HH22 ARG A 39 17.005 -10.626 4.260 1.00 0.00 H new ATOM 662 N LYS A 40 13.987 -4.594 5.477 1.00 0.00 N ATOM 663 CA LYS A 40 12.634 -5.077 5.231 1.00 0.00 C ATOM 664 C LYS A 40 12.028 -4.397 4.006 1.00 0.00 C ATOM 665 O LYS A 40 12.406 -3.280 3.656 1.00 0.00 O ATOM 666 CB LYS A 40 11.751 -4.828 6.455 1.00 0.00 C ATOM 667 CG LYS A 40 10.427 -5.571 6.412 1.00 0.00 C ATOM 668 CD LYS A 40 10.618 -7.064 6.617 1.00 0.00 C ATOM 669 CE LYS A 40 10.745 -7.411 8.093 1.00 0.00 C ATOM 670 NZ LYS A 40 11.119 -8.838 8.296 1.00 0.00 N ATOM 0 H LYS A 40 14.041 -3.795 6.109 1.00 0.00 H new ATOM 0 HA LYS A 40 12.686 -6.149 5.041 1.00 0.00 H new ATOM 0 HB2 LYS A 40 12.295 -5.125 7.352 1.00 0.00 H new ATOM 0 HB3 LYS A 40 11.555 -3.759 6.540 1.00 0.00 H new ATOM 0 HG2 LYS A 40 9.764 -5.179 7.183 1.00 0.00 H new ATOM 0 HG3 LYS A 40 9.940 -5.394 5.453 1.00 0.00 H new ATOM 0 HD2 LYS A 40 9.774 -7.603 6.187 1.00 0.00 H new ATOM 0 HD3 LYS A 40 11.511 -7.394 6.086 1.00 0.00 H new ATOM 0 HE2 LYS A 40 11.496 -6.769 8.554 1.00 0.00 H new ATOM 0 HE3 LYS A 40 9.800 -7.208 8.597 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 11.196 -9.035 9.314 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 10.390 -9.451 7.879 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 12.033 -9.026 7.837 1.00 0.00 H new ATOM 684 N GLN A 41 11.087 -5.080 3.363 1.00 0.00 N ATOM 685 CA GLN A 41 10.429 -4.541 2.178 1.00 0.00 C ATOM 686 C GLN A 41 8.979 -4.174 2.481 1.00 0.00 C ATOM 687 O GLN A 41 8.396 -4.656 3.450 1.00 0.00 O ATOM 688 CB GLN A 41 10.483 -5.553 1.033 1.00 0.00 C ATOM 689 CG GLN A 41 11.894 -5.970 0.657 1.00 0.00 C ATOM 690 CD GLN A 41 11.925 -7.225 -0.193 1.00 0.00 C ATOM 691 OE1 GLN A 41 10.998 -7.492 -0.959 1.00 0.00 O ATOM 692 NE2 GLN A 41 12.995 -8.002 -0.065 1.00 0.00 N ATOM 0 H GLN A 41 10.763 -6.006 3.642 1.00 0.00 H new ATOM 0 HA GLN A 41 10.959 -3.637 1.878 1.00 0.00 H new ATOM 0 HB2 GLN A 41 9.914 -6.439 1.315 1.00 0.00 H new ATOM 0 HB3 GLN A 41 9.994 -5.125 0.158 1.00 0.00 H new ATOM 0 HG2 GLN A 41 12.377 -5.157 0.115 1.00 0.00 H new ATOM 0 HG3 GLN A 41 12.474 -6.136 1.565 1.00 0.00 H new ATOM 0 HE21 GLN A 41 13.740 -7.742 0.582 1.00 0.00 H new ATOM 0 HE22 GLN A 41 13.072 -8.858 -0.614 1.00 0.00 H new ATOM 701 N GLY A 42 8.403 -3.317 1.643 1.00 0.00 N ATOM 702 CA GLY A 42 7.027 -2.900 1.838 1.00 0.00 C ATOM 703 C GLY A 42 6.095 -3.465 0.783 1.00 0.00 C ATOM 704 O GLY A 42 6.491 -3.661 -0.366 1.00 0.00 O ATOM 0 H GLY A 42 8.865 -2.904 0.833 1.00 0.00 H new ATOM 0 HA2 GLY A 42 6.690 -3.219 2.824 1.00 0.00 H new ATOM 0 HA3 GLY A 42 6.974 -1.811 1.820 1.00 0.00 H new ATOM 708 N LEU A 43 4.854 -3.731 1.176 1.00 0.00 N ATOM 709 CA LEU A 43 3.863 -4.279 0.256 1.00 0.00 C ATOM 710 C LEU A 43 2.922 -3.188 -0.245 1.00 0.00 C ATOM 711 O LEU A 43 2.470 -2.341 0.526 1.00 0.00 O ATOM 712 CB LEU A 43 3.059 -5.386 0.943 1.00 0.00 C ATOM 713 CG LEU A 43 1.765 -5.806 0.245 1.00 0.00 C ATOM 714 CD1 LEU A 43 2.072 -6.578 -1.029 1.00 0.00 C ATOM 715 CD2 LEU A 43 0.901 -6.639 1.181 1.00 0.00 C ATOM 0 H LEU A 43 4.510 -3.576 2.124 1.00 0.00 H new ATOM 0 HA LEU A 43 4.391 -4.698 -0.600 1.00 0.00 H new ATOM 0 HB2 LEU A 43 3.697 -6.264 1.041 1.00 0.00 H new ATOM 0 HB3 LEU A 43 2.814 -5.056 1.953 1.00 0.00 H new ATOM 0 HG LEU A 43 1.211 -4.907 -0.025 1.00 0.00 H new ATOM 0 HD11 LEU A 43 1.139 -6.869 -1.512 1.00 0.00 H new ATOM 0 HD12 LEU A 43 2.650 -5.949 -1.705 1.00 0.00 H new ATOM 0 HD13 LEU A 43 2.647 -7.471 -0.784 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -0.016 -6.929 0.668 1.00 0.00 H new ATOM 0 HD22 LEU A 43 1.447 -7.533 1.481 1.00 0.00 H new ATOM 0 HD23 LEU A 43 0.652 -6.052 2.065 1.00 0.00 H new ATOM 727 N VAL A 44 2.629 -3.215 -1.541 1.00 0.00 N ATOM 728 CA VAL A 44 1.740 -2.231 -2.145 1.00 0.00 C ATOM 729 C VAL A 44 0.414 -2.863 -2.551 1.00 0.00 C ATOM 730 O VAL A 44 0.324 -3.537 -3.578 1.00 0.00 O ATOM 731 CB VAL A 44 2.384 -1.576 -3.382 1.00 0.00 C ATOM 732 CG1 VAL A 44 1.387 -0.668 -4.086 1.00 0.00 C ATOM 733 CG2 VAL A 44 3.633 -0.803 -2.985 1.00 0.00 C ATOM 0 H VAL A 44 2.995 -3.909 -2.193 1.00 0.00 H new ATOM 0 HA VAL A 44 1.558 -1.465 -1.391 1.00 0.00 H new ATOM 0 HB VAL A 44 2.676 -2.363 -4.078 1.00 0.00 H new ATOM 0 HG11 VAL A 44 1.860 -0.214 -4.957 1.00 0.00 H new ATOM 0 HG12 VAL A 44 0.524 -1.253 -4.405 1.00 0.00 H new ATOM 0 HG13 VAL A 44 1.061 0.115 -3.401 1.00 0.00 H new ATOM 0 HG21 VAL A 44 4.075 -0.347 -3.871 1.00 0.00 H new ATOM 0 HG22 VAL A 44 3.367 -0.024 -2.270 1.00 0.00 H new ATOM 0 HG23 VAL A 44 4.353 -1.483 -2.530 1.00 0.00 H new ATOM 743 N HIS A 45 -0.615 -2.643 -1.739 1.00 0.00 N ATOM 744 CA HIS A 45 -1.938 -3.191 -2.014 1.00 0.00 C ATOM 745 C HIS A 45 -2.351 -2.916 -3.457 1.00 0.00 C ATOM 746 O HIS A 45 -1.893 -1.952 -4.071 1.00 0.00 O ATOM 747 CB HIS A 45 -2.969 -2.597 -1.055 1.00 0.00 C ATOM 748 CG HIS A 45 -4.132 -3.503 -0.788 1.00 0.00 C ATOM 749 ND1 HIS A 45 -5.327 -3.060 -0.263 1.00 0.00 N ATOM 750 CD2 HIS A 45 -4.279 -4.835 -0.982 1.00 0.00 C ATOM 751 CE1 HIS A 45 -6.158 -4.080 -0.142 1.00 0.00 C ATOM 752 NE2 HIS A 45 -5.546 -5.168 -0.572 1.00 0.00 N ATOM 0 H HIS A 45 -0.558 -2.089 -0.885 1.00 0.00 H new ATOM 0 HA HIS A 45 -1.895 -4.270 -1.866 1.00 0.00 H new ATOM 0 HB2 HIS A 45 -2.480 -2.360 -0.110 1.00 0.00 H new ATOM 0 HB3 HIS A 45 -3.338 -1.658 -1.468 1.00 0.00 H new ATOM 0 HD2 HIS A 45 -3.538 -5.510 -1.384 1.00 0.00 H new ATOM 0 HE1 HIS A 45 -7.166 -4.032 0.243 1.00 0.00 H new ATOM 0 HE2 HIS A 45 -5.949 -6.105 -0.596 1.00 0.00 H new ATOM 760 N ARG A 46 -3.218 -3.769 -3.992 1.00 0.00 N ATOM 761 CA ARG A 46 -3.690 -3.618 -5.363 1.00 0.00 C ATOM 762 C ARG A 46 -4.409 -2.285 -5.548 1.00 0.00 C ATOM 763 O ARG A 46 -4.324 -1.663 -6.607 1.00 0.00 O ATOM 764 CB ARG A 46 -4.627 -4.770 -5.732 1.00 0.00 C ATOM 765 CG ARG A 46 -5.850 -4.871 -4.835 1.00 0.00 C ATOM 766 CD ARG A 46 -7.032 -5.480 -5.572 1.00 0.00 C ATOM 767 NE ARG A 46 -8.176 -5.696 -4.688 1.00 0.00 N ATOM 768 CZ ARG A 46 -9.393 -6.000 -5.123 1.00 0.00 C ATOM 769 NH1 ARG A 46 -9.625 -6.125 -6.422 1.00 0.00 N ATOM 770 NH2 ARG A 46 -10.382 -6.182 -4.257 1.00 0.00 N ATOM 0 H ARG A 46 -3.608 -4.571 -3.497 1.00 0.00 H new ATOM 0 HA ARG A 46 -2.823 -3.638 -6.023 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -4.953 -4.645 -6.764 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -4.073 -5.708 -5.684 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -5.613 -5.478 -3.961 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -6.119 -3.879 -4.471 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -7.326 -4.824 -6.391 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -6.732 -6.429 -6.016 1.00 0.00 H new ATOM 0 HE ARG A 46 -8.031 -5.608 -3.682 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -8.867 -5.988 -7.091 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -10.561 -6.359 -6.753 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -10.207 -6.088 -3.256 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -11.317 -6.416 -4.592 1.00 0.00 H new ATOM 784 N THR A 47 -5.116 -1.852 -4.509 1.00 0.00 N ATOM 785 CA THR A 47 -5.850 -0.594 -4.557 1.00 0.00 C ATOM 786 C THR A 47 -4.899 0.598 -4.574 1.00 0.00 C ATOM 787 O THR A 47 -5.272 1.696 -4.990 1.00 0.00 O ATOM 788 CB THR A 47 -6.805 -0.455 -3.356 1.00 0.00 C ATOM 789 OG1 THR A 47 -7.573 0.747 -3.478 1.00 0.00 O ATOM 790 CG2 THR A 47 -6.031 -0.439 -2.047 1.00 0.00 C ATOM 0 H THR A 47 -5.196 -2.354 -3.625 1.00 0.00 H new ATOM 0 HA THR A 47 -6.433 -0.604 -5.478 1.00 0.00 H new ATOM 0 HB THR A 47 -7.475 -1.315 -3.351 1.00 0.00 H new ATOM 0 HG1 THR A 47 -8.179 0.827 -2.712 1.00 0.00 H new ATOM 0 HG21 THR A 47 -6.727 -0.340 -1.214 1.00 0.00 H new ATOM 0 HG22 THR A 47 -5.471 -1.369 -1.944 1.00 0.00 H new ATOM 0 HG23 THR A 47 -5.339 0.403 -2.044 1.00 0.00 H new ATOM 798 N HIS A 48 -3.670 0.374 -4.121 1.00 0.00 N ATOM 799 CA HIS A 48 -2.665 1.431 -4.087 1.00 0.00 C ATOM 800 C HIS A 48 -1.783 1.383 -5.332 1.00 0.00 C ATOM 801 O HIS A 48 -1.144 2.372 -5.690 1.00 0.00 O ATOM 802 CB HIS A 48 -1.802 1.302 -2.832 1.00 0.00 C ATOM 803 CG HIS A 48 -2.464 1.821 -1.593 1.00 0.00 C ATOM 804 ND1 HIS A 48 -2.526 3.162 -1.279 1.00 0.00 N ATOM 805 CD2 HIS A 48 -3.097 1.170 -0.589 1.00 0.00 C ATOM 806 CE1 HIS A 48 -3.167 3.314 -0.134 1.00 0.00 C ATOM 807 NE2 HIS A 48 -3.524 2.121 0.306 1.00 0.00 N ATOM 0 H HIS A 48 -3.346 -0.528 -3.773 1.00 0.00 H new ATOM 0 HA HIS A 48 -3.183 2.390 -4.067 1.00 0.00 H new ATOM 0 HB2 HIS A 48 -1.545 0.253 -2.684 1.00 0.00 H new ATOM 0 HB3 HIS A 48 -0.867 1.841 -2.987 1.00 0.00 H new ATOM 0 HD2 HIS A 48 -3.240 0.103 -0.507 1.00 0.00 H new ATOM 0 HE1 HIS A 48 -3.365 4.254 0.359 1.00 0.00 H new ATOM 0 HE2 HIS A 48 -4.034 1.936 1.170 1.00 0.00 H new ATOM 815 N MET A 49 -1.754 0.227 -5.986 1.00 0.00 N ATOM 816 CA MET A 49 -0.952 0.051 -7.191 1.00 0.00 C ATOM 817 C MET A 49 -1.412 0.999 -8.294 1.00 0.00 C ATOM 818 O MET A 49 -0.595 1.552 -9.031 1.00 0.00 O ATOM 819 CB MET A 49 -1.036 -1.396 -7.679 1.00 0.00 C ATOM 820 CG MET A 49 -0.155 -2.355 -6.893 1.00 0.00 C ATOM 821 SD MET A 49 -0.040 -3.981 -7.663 1.00 0.00 S ATOM 822 CE MET A 49 1.284 -3.707 -8.839 1.00 0.00 C ATOM 0 H MET A 49 -2.276 -0.602 -5.702 1.00 0.00 H new ATOM 0 HA MET A 49 0.084 0.284 -6.944 1.00 0.00 H new ATOM 0 HB2 MET A 49 -2.071 -1.732 -7.617 1.00 0.00 H new ATOM 0 HB3 MET A 49 -0.752 -1.433 -8.731 1.00 0.00 H new ATOM 0 HG2 MET A 49 0.844 -1.930 -6.799 1.00 0.00 H new ATOM 0 HG3 MET A 49 -0.552 -2.462 -5.884 1.00 0.00 H new ATOM 0 HE1 MET A 49 1.320 -4.536 -9.546 1.00 0.00 H new ATOM 0 HE2 MET A 49 1.104 -2.777 -9.379 1.00 0.00 H new ATOM 0 HE3 MET A 49 2.234 -3.641 -8.309 1.00 0.00 H new ATOM 832 N SER A 50 -2.724 1.183 -8.402 1.00 0.00 N ATOM 833 CA SER A 50 -3.292 2.061 -9.417 1.00 0.00 C ATOM 834 C SER A 50 -4.644 2.608 -8.968 1.00 0.00 C ATOM 835 O SER A 50 -5.422 1.911 -8.318 1.00 0.00 O ATOM 836 CB SER A 50 -3.448 1.311 -10.741 1.00 0.00 C ATOM 837 OG SER A 50 -3.593 2.213 -11.825 1.00 0.00 O ATOM 0 H SER A 50 -3.414 0.735 -7.798 1.00 0.00 H new ATOM 0 HA SER A 50 -2.610 2.899 -9.560 1.00 0.00 H new ATOM 0 HB2 SER A 50 -2.578 0.675 -10.907 1.00 0.00 H new ATOM 0 HB3 SER A 50 -4.317 0.655 -10.691 1.00 0.00 H new ATOM 0 HG SER A 50 -3.689 1.709 -12.660 1.00 0.00 H new ATOM 843 N SER A 51 -4.915 3.860 -9.320 1.00 0.00 N ATOM 844 CA SER A 51 -6.170 4.503 -8.950 1.00 0.00 C ATOM 845 C SER A 51 -7.333 3.928 -9.753 1.00 0.00 C ATOM 846 O SER A 51 -8.372 3.572 -9.195 1.00 0.00 O ATOM 847 CB SER A 51 -6.079 6.014 -9.175 1.00 0.00 C ATOM 848 OG SER A 51 -7.169 6.686 -8.566 1.00 0.00 O ATOM 0 H SER A 51 -4.282 4.450 -9.861 1.00 0.00 H new ATOM 0 HA SER A 51 -6.350 4.310 -7.893 1.00 0.00 H new ATOM 0 HB2 SER A 51 -5.141 6.390 -8.766 1.00 0.00 H new ATOM 0 HB3 SER A 51 -6.068 6.226 -10.244 1.00 0.00 H new ATOM 0 HG SER A 51 -7.088 7.650 -8.722 1.00 0.00 H new ATOM 854 N CYS A 52 -7.149 3.839 -11.066 1.00 0.00 N ATOM 855 CA CYS A 52 -8.183 3.308 -11.948 1.00 0.00 C ATOM 856 C CYS A 52 -8.659 1.941 -11.466 1.00 0.00 C ATOM 857 O CYS A 52 -8.159 1.413 -10.473 1.00 0.00 O ATOM 858 CB CYS A 52 -7.656 3.202 -13.380 1.00 0.00 C ATOM 859 SG CYS A 52 -7.686 4.761 -14.294 1.00 0.00 S ATOM 0 H CYS A 52 -6.295 4.127 -11.543 1.00 0.00 H new ATOM 0 HA CYS A 52 -9.029 3.995 -11.930 1.00 0.00 H new ATOM 0 HB2 CYS A 52 -6.632 2.829 -13.352 1.00 0.00 H new ATOM 0 HB3 CYS A 52 -8.249 2.465 -13.921 1.00 0.00 H new ATOM 0 HG CYS A 52 -7.220 4.570 -15.492 1.00 0.00 H new ATOM 865 N ARG A 53 -9.629 1.374 -12.176 1.00 0.00 N ATOM 866 CA ARG A 53 -10.174 0.069 -11.819 1.00 0.00 C ATOM 867 C ARG A 53 -9.108 -1.015 -11.933 1.00 0.00 C ATOM 868 O ARG A 53 -8.846 -1.532 -13.019 1.00 0.00 O ATOM 869 CB ARG A 53 -11.363 -0.273 -12.718 1.00 0.00 C ATOM 870 CG ARG A 53 -12.022 -1.600 -12.378 1.00 0.00 C ATOM 871 CD ARG A 53 -13.214 -1.878 -13.281 1.00 0.00 C ATOM 872 NE ARG A 53 -13.480 -3.308 -13.410 1.00 0.00 N ATOM 873 CZ ARG A 53 -14.331 -3.820 -14.292 1.00 0.00 C ATOM 874 NH1 ARG A 53 -14.994 -3.023 -15.118 1.00 0.00 N ATOM 875 NH2 ARG A 53 -14.520 -5.132 -14.349 1.00 0.00 N ATOM 0 H ARG A 53 -10.054 1.797 -13.001 1.00 0.00 H new ATOM 0 HA ARG A 53 -10.511 0.115 -10.783 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -12.105 0.522 -12.642 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -11.028 -0.298 -13.755 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -11.294 -2.405 -12.477 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -12.347 -1.590 -11.338 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -14.097 -1.380 -12.880 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -13.029 -1.453 -14.268 1.00 0.00 H new ATOM 0 HE ARG A 53 -12.985 -3.949 -12.789 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -14.851 -2.014 -15.077 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -15.647 -3.419 -15.794 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -14.012 -5.749 -13.715 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -15.174 -5.524 -15.027 1.00 0.00 H new ATOM 889 N VAL A 54 -8.493 -1.355 -10.803 1.00 0.00 N ATOM 890 CA VAL A 54 -7.455 -2.378 -10.776 1.00 0.00 C ATOM 891 C VAL A 54 -8.050 -3.769 -10.970 1.00 0.00 C ATOM 892 O VAL A 54 -8.823 -4.247 -10.139 1.00 0.00 O ATOM 893 CB VAL A 54 -6.671 -2.347 -9.451 1.00 0.00 C ATOM 894 CG1 VAL A 54 -5.458 -3.261 -9.526 1.00 0.00 C ATOM 895 CG2 VAL A 54 -6.257 -0.924 -9.111 1.00 0.00 C ATOM 0 H VAL A 54 -8.696 -0.936 -9.895 1.00 0.00 H new ATOM 0 HA VAL A 54 -6.773 -2.160 -11.598 1.00 0.00 H new ATOM 0 HB VAL A 54 -7.321 -2.712 -8.656 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -4.917 -3.226 -8.581 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -5.784 -4.283 -9.720 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -4.803 -2.930 -10.332 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -5.704 -0.921 -8.172 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -5.624 -0.529 -9.906 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -7.146 -0.301 -9.011 1.00 0.00 H new ATOM 905 N ASP A 55 -7.683 -4.415 -12.071 1.00 0.00 N ATOM 906 CA ASP A 55 -8.178 -5.753 -12.374 1.00 0.00 C ATOM 907 C ASP A 55 -7.080 -6.795 -12.184 1.00 0.00 C ATOM 908 O ASP A 55 -7.256 -7.773 -11.458 1.00 0.00 O ATOM 909 CB ASP A 55 -8.712 -5.810 -13.806 1.00 0.00 C ATOM 910 CG ASP A 55 -10.133 -5.296 -13.915 1.00 0.00 C ATOM 911 OD1 ASP A 55 -10.415 -4.210 -13.366 1.00 0.00 O ATOM 912 OD2 ASP A 55 -10.965 -5.980 -14.549 1.00 0.00 O ATOM 0 H ASP A 55 -7.044 -4.034 -12.769 1.00 0.00 H new ATOM 0 HA ASP A 55 -8.990 -5.979 -11.683 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -8.065 -5.221 -14.456 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -8.672 -6.839 -14.165 1.00 0.00 H new ATOM 917 N LYS A 56 -5.946 -6.579 -12.844 1.00 0.00 N ATOM 918 CA LYS A 56 -4.818 -7.498 -12.749 1.00 0.00 C ATOM 919 C LYS A 56 -3.529 -6.746 -12.432 1.00 0.00 C ATOM 920 O LYS A 56 -2.855 -6.221 -13.317 1.00 0.00 O ATOM 921 CB LYS A 56 -4.658 -8.277 -14.056 1.00 0.00 C ATOM 922 CG LYS A 56 -5.413 -9.595 -14.075 1.00 0.00 C ATOM 923 CD LYS A 56 -4.708 -10.653 -13.244 1.00 0.00 C ATOM 924 CE LYS A 56 -5.565 -11.899 -13.083 1.00 0.00 C ATOM 925 NZ LYS A 56 -5.693 -12.653 -14.361 1.00 0.00 N ATOM 0 H LYS A 56 -5.784 -5.775 -13.451 1.00 0.00 H new ATOM 0 HA LYS A 56 -5.018 -8.198 -11.938 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -5.005 -7.657 -14.883 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -3.599 -8.472 -14.226 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -6.422 -9.443 -13.692 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -5.511 -9.944 -15.103 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -3.763 -10.919 -13.718 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -4.469 -10.246 -12.262 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -5.127 -12.545 -12.322 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -6.556 -11.615 -12.728 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -6.284 -13.495 -14.210 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -6.134 -12.045 -15.080 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -4.750 -12.946 -14.687 1.00 0.00 H new ATOM 939 N PRO A 57 -3.177 -6.694 -11.139 1.00 0.00 N ATOM 940 CA PRO A 57 -1.966 -6.012 -10.675 1.00 0.00 C ATOM 941 C PRO A 57 -0.693 -6.740 -11.094 1.00 0.00 C ATOM 942 O PRO A 57 0.407 -6.196 -10.995 1.00 0.00 O ATOM 943 CB PRO A 57 -2.112 -6.024 -9.152 1.00 0.00 C ATOM 944 CG PRO A 57 -2.988 -7.194 -8.865 1.00 0.00 C ATOM 945 CD PRO A 57 -3.934 -7.298 -10.029 1.00 0.00 C ATOM 0 HA PRO A 57 -1.874 -5.012 -11.100 1.00 0.00 H new ATOM 0 HB2 PRO A 57 -1.143 -6.125 -8.662 1.00 0.00 H new ATOM 0 HB3 PRO A 57 -2.557 -5.098 -8.790 1.00 0.00 H new ATOM 0 HG2 PRO A 57 -2.399 -8.105 -8.758 1.00 0.00 H new ATOM 0 HG3 PRO A 57 -3.532 -7.054 -7.931 1.00 0.00 H new ATOM 0 HD2 PRO A 57 -4.199 -8.334 -10.240 1.00 0.00 H new ATOM 0 HD3 PRO A 57 -4.865 -6.763 -9.839 1.00 0.00 H new ATOM 953 N SER A 58 -0.851 -7.974 -11.563 1.00 0.00 N ATOM 954 CA SER A 58 0.286 -8.778 -11.994 1.00 0.00 C ATOM 955 C SER A 58 0.765 -8.346 -13.377 1.00 0.00 C ATOM 956 O SER A 58 1.799 -8.806 -13.858 1.00 0.00 O ATOM 957 CB SER A 58 -0.089 -10.262 -12.012 1.00 0.00 C ATOM 958 OG SER A 58 0.144 -10.862 -10.750 1.00 0.00 O ATOM 0 H SER A 58 -1.755 -8.438 -11.654 1.00 0.00 H new ATOM 0 HA SER A 58 1.098 -8.624 -11.283 1.00 0.00 H new ATOM 0 HB2 SER A 58 -1.139 -10.372 -12.282 1.00 0.00 H new ATOM 0 HB3 SER A 58 0.492 -10.778 -12.776 1.00 0.00 H new ATOM 0 HG SER A 58 -0.105 -11.809 -10.787 1.00 0.00 H new ATOM 964 N GLU A 59 0.003 -7.459 -14.009 1.00 0.00 N ATOM 965 CA GLU A 59 0.349 -6.966 -15.337 1.00 0.00 C ATOM 966 C GLU A 59 0.779 -5.502 -15.278 1.00 0.00 C ATOM 967 O GLU A 59 1.364 -4.978 -16.226 1.00 0.00 O ATOM 968 CB GLU A 59 -0.839 -7.121 -16.288 1.00 0.00 C ATOM 969 CG GLU A 59 -1.163 -8.567 -16.626 1.00 0.00 C ATOM 970 CD GLU A 59 -0.181 -9.171 -17.610 1.00 0.00 C ATOM 971 OE1 GLU A 59 0.192 -8.476 -18.577 1.00 0.00 O ATOM 972 OE2 GLU A 59 0.216 -10.339 -17.413 1.00 0.00 O ATOM 0 H GLU A 59 -0.857 -7.068 -13.624 1.00 0.00 H new ATOM 0 HA GLU A 59 1.184 -7.558 -15.711 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -1.717 -6.656 -15.839 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -0.629 -6.579 -17.210 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -1.164 -9.159 -15.710 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -2.169 -8.622 -17.042 1.00 0.00 H new ATOM 979 N ILE A 60 0.484 -4.849 -14.159 1.00 0.00 N ATOM 980 CA ILE A 60 0.839 -3.448 -13.976 1.00 0.00 C ATOM 981 C ILE A 60 2.341 -3.286 -13.760 1.00 0.00 C ATOM 982 O ILE A 60 2.927 -2.270 -14.137 1.00 0.00 O ATOM 983 CB ILE A 60 0.090 -2.827 -12.783 1.00 0.00 C ATOM 984 CG1 ILE A 60 -1.408 -3.126 -12.882 1.00 0.00 C ATOM 985 CG2 ILE A 60 0.334 -1.327 -12.726 1.00 0.00 C ATOM 986 CD1 ILE A 60 -2.221 -2.514 -11.763 1.00 0.00 C ATOM 0 H ILE A 60 -0.000 -5.268 -13.365 1.00 0.00 H new ATOM 0 HA ILE A 60 0.546 -2.927 -14.888 1.00 0.00 H new ATOM 0 HB ILE A 60 0.470 -3.271 -11.863 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -1.782 -2.756 -13.837 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -1.556 -4.206 -12.879 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -0.202 -0.903 -11.877 1.00 0.00 H new ATOM 0 HG22 ILE A 60 1.401 -1.136 -12.613 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -0.022 -0.865 -13.647 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -3.273 -2.767 -11.897 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -1.874 -2.903 -10.806 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -2.103 -1.430 -11.778 1.00 0.00 H new ATOM 998 N VAL A 61 2.957 -4.294 -13.152 1.00 0.00 N ATOM 999 CA VAL A 61 4.391 -4.264 -12.887 1.00 0.00 C ATOM 1000 C VAL A 61 4.998 -5.659 -12.997 1.00 0.00 C ATOM 1001 O VAL A 61 4.283 -6.647 -13.164 1.00 0.00 O ATOM 1002 CB VAL A 61 4.692 -3.694 -11.488 1.00 0.00 C ATOM 1003 CG1 VAL A 61 4.116 -2.294 -11.348 1.00 0.00 C ATOM 1004 CG2 VAL A 61 4.145 -4.615 -10.409 1.00 0.00 C ATOM 0 H VAL A 61 2.486 -5.141 -12.834 1.00 0.00 H new ATOM 0 HA VAL A 61 4.839 -3.615 -13.639 1.00 0.00 H new ATOM 0 HB VAL A 61 5.773 -3.630 -11.365 1.00 0.00 H new ATOM 0 HG11 VAL A 61 4.338 -1.907 -10.354 1.00 0.00 H new ATOM 0 HG12 VAL A 61 4.560 -1.641 -12.099 1.00 0.00 H new ATOM 0 HG13 VAL A 61 3.036 -2.329 -11.491 1.00 0.00 H new ATOM 0 HG21 VAL A 61 4.367 -4.197 -9.427 1.00 0.00 H new ATOM 0 HG22 VAL A 61 3.066 -4.713 -10.527 1.00 0.00 H new ATOM 0 HG23 VAL A 61 4.610 -5.597 -10.499 1.00 0.00 H new ATOM 1014 N ASP A 62 6.321 -5.730 -12.902 1.00 0.00 N ATOM 1015 CA ASP A 62 7.026 -7.004 -12.989 1.00 0.00 C ATOM 1016 C ASP A 62 8.393 -6.916 -12.319 1.00 0.00 C ATOM 1017 O ASP A 62 9.135 -5.954 -12.522 1.00 0.00 O ATOM 1018 CB ASP A 62 7.187 -7.423 -14.451 1.00 0.00 C ATOM 1019 CG ASP A 62 7.426 -6.241 -15.369 1.00 0.00 C ATOM 1020 OD1 ASP A 62 6.477 -5.461 -15.591 1.00 0.00 O ATOM 1021 OD2 ASP A 62 8.563 -6.096 -15.866 1.00 0.00 O ATOM 0 H ASP A 62 6.927 -4.921 -12.765 1.00 0.00 H new ATOM 0 HA ASP A 62 6.433 -7.755 -12.467 1.00 0.00 H new ATOM 0 HB2 ASP A 62 8.021 -8.120 -14.536 1.00 0.00 H new ATOM 0 HB3 ASP A 62 6.292 -7.955 -14.774 1.00 0.00 H new ATOM 1026 N VAL A 63 8.721 -7.924 -11.517 1.00 0.00 N ATOM 1027 CA VAL A 63 9.999 -7.960 -10.817 1.00 0.00 C ATOM 1028 C VAL A 63 11.109 -7.355 -11.668 1.00 0.00 C ATOM 1029 O VAL A 63 11.374 -7.814 -12.778 1.00 0.00 O ATOM 1030 CB VAL A 63 10.387 -9.400 -10.432 1.00 0.00 C ATOM 1031 CG1 VAL A 63 11.756 -9.425 -9.769 1.00 0.00 C ATOM 1032 CG2 VAL A 63 9.333 -10.011 -9.522 1.00 0.00 C ATOM 0 H VAL A 63 8.119 -8.727 -11.336 1.00 0.00 H new ATOM 0 HA VAL A 63 9.880 -7.369 -9.909 1.00 0.00 H new ATOM 0 HB VAL A 63 10.439 -9.999 -11.341 1.00 0.00 H new ATOM 0 HG11 VAL A 63 12.013 -10.451 -9.504 1.00 0.00 H new ATOM 0 HG12 VAL A 63 12.502 -9.031 -10.459 1.00 0.00 H new ATOM 0 HG13 VAL A 63 11.735 -8.812 -8.868 1.00 0.00 H new ATOM 0 HG21 VAL A 63 9.624 -11.028 -9.260 1.00 0.00 H new ATOM 0 HG22 VAL A 63 9.245 -9.414 -8.614 1.00 0.00 H new ATOM 0 HG23 VAL A 63 8.373 -10.029 -10.038 1.00 0.00 H new ATOM 1042 N GLY A 64 11.758 -6.322 -11.139 1.00 0.00 N ATOM 1043 CA GLY A 64 12.833 -5.671 -11.863 1.00 0.00 C ATOM 1044 C GLY A 64 12.512 -4.230 -12.206 1.00 0.00 C ATOM 1045 O GLY A 64 13.414 -3.424 -12.438 1.00 0.00 O ATOM 0 H GLY A 64 11.558 -5.925 -10.221 1.00 0.00 H new ATOM 0 HA2 GLY A 64 13.743 -5.704 -11.264 1.00 0.00 H new ATOM 0 HA3 GLY A 64 13.035 -6.223 -12.781 1.00 0.00 H new ATOM 1049 N ASP A 65 11.224 -3.904 -12.239 1.00 0.00 N ATOM 1050 CA ASP A 65 10.787 -2.549 -12.557 1.00 0.00 C ATOM 1051 C ASP A 65 10.886 -1.645 -11.333 1.00 0.00 C ATOM 1052 O ASP A 65 10.355 -1.963 -10.268 1.00 0.00 O ATOM 1053 CB ASP A 65 9.349 -2.565 -13.079 1.00 0.00 C ATOM 1054 CG ASP A 65 9.233 -3.242 -14.431 1.00 0.00 C ATOM 1055 OD1 ASP A 65 10.213 -3.200 -15.202 1.00 0.00 O ATOM 1056 OD2 ASP A 65 8.158 -3.813 -14.718 1.00 0.00 O ATOM 0 H ASP A 65 10.465 -4.559 -12.050 1.00 0.00 H new ATOM 0 HA ASP A 65 11.443 -2.154 -13.332 1.00 0.00 H new ATOM 0 HB2 ASP A 65 8.710 -3.080 -12.362 1.00 0.00 H new ATOM 0 HB3 ASP A 65 8.981 -1.542 -13.155 1.00 0.00 H new ATOM 1061 N LYS A 66 11.570 -0.517 -11.491 1.00 0.00 N ATOM 1062 CA LYS A 66 11.740 0.434 -10.399 1.00 0.00 C ATOM 1063 C LYS A 66 10.694 1.542 -10.475 1.00 0.00 C ATOM 1064 O LYS A 66 10.474 2.131 -11.534 1.00 0.00 O ATOM 1065 CB LYS A 66 13.145 1.041 -10.438 1.00 0.00 C ATOM 1066 CG LYS A 66 13.320 2.228 -9.507 1.00 0.00 C ATOM 1067 CD LYS A 66 14.678 2.885 -9.691 1.00 0.00 C ATOM 1068 CE LYS A 66 15.803 1.988 -9.197 1.00 0.00 C ATOM 1069 NZ LYS A 66 17.058 2.753 -8.959 1.00 0.00 N ATOM 0 H LYS A 66 12.016 -0.239 -12.365 1.00 0.00 H new ATOM 0 HA LYS A 66 11.608 -0.102 -9.459 1.00 0.00 H new ATOM 0 HB2 LYS A 66 13.871 0.272 -10.174 1.00 0.00 H new ATOM 0 HB3 LYS A 66 13.369 1.354 -11.458 1.00 0.00 H new ATOM 0 HG2 LYS A 66 12.533 2.958 -9.695 1.00 0.00 H new ATOM 0 HG3 LYS A 66 13.210 1.900 -8.473 1.00 0.00 H new ATOM 0 HD2 LYS A 66 14.832 3.116 -10.745 1.00 0.00 H new ATOM 0 HD3 LYS A 66 14.702 3.831 -9.151 1.00 0.00 H new ATOM 0 HE2 LYS A 66 15.497 1.496 -8.274 1.00 0.00 H new ATOM 0 HE3 LYS A 66 15.990 1.203 -9.930 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 17.800 2.107 -8.623 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 17.365 3.202 -9.846 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 16.887 3.486 -8.241 1.00 0.00 H new ATOM 1083 N VAL A 67 10.052 1.823 -9.344 1.00 0.00 N ATOM 1084 CA VAL A 67 9.031 2.862 -9.283 1.00 0.00 C ATOM 1085 C VAL A 67 9.124 3.645 -7.979 1.00 0.00 C ATOM 1086 O VAL A 67 9.850 3.262 -7.063 1.00 0.00 O ATOM 1087 CB VAL A 67 7.617 2.267 -9.413 1.00 0.00 C ATOM 1088 CG1 VAL A 67 7.504 1.428 -10.678 1.00 0.00 C ATOM 1089 CG2 VAL A 67 7.271 1.441 -8.183 1.00 0.00 C ATOM 0 H VAL A 67 10.221 1.346 -8.459 1.00 0.00 H new ATOM 0 HA VAL A 67 9.212 3.535 -10.121 1.00 0.00 H new ATOM 0 HB VAL A 67 6.902 3.087 -9.485 1.00 0.00 H new ATOM 0 HG11 VAL A 67 6.498 1.016 -10.753 1.00 0.00 H new ATOM 0 HG12 VAL A 67 7.706 2.053 -11.548 1.00 0.00 H new ATOM 0 HG13 VAL A 67 8.228 0.614 -10.640 1.00 0.00 H new ATOM 0 HG21 VAL A 67 6.268 1.028 -8.292 1.00 0.00 H new ATOM 0 HG22 VAL A 67 7.989 0.627 -8.077 1.00 0.00 H new ATOM 0 HG23 VAL A 67 7.308 2.075 -7.297 1.00 0.00 H new ATOM 1099 N TRP A 68 8.381 4.743 -7.902 1.00 0.00 N ATOM 1100 CA TRP A 68 8.377 5.582 -6.708 1.00 0.00 C ATOM 1101 C TRP A 68 7.155 5.294 -5.844 1.00 0.00 C ATOM 1102 O TRP A 68 6.026 5.278 -6.334 1.00 0.00 O ATOM 1103 CB TRP A 68 8.404 7.061 -7.099 1.00 0.00 C ATOM 1104 CG TRP A 68 9.676 7.473 -7.775 1.00 0.00 C ATOM 1105 CD1 TRP A 68 9.917 7.509 -9.120 1.00 0.00 C ATOM 1106 CD2 TRP A 68 10.883 7.908 -7.139 1.00 0.00 C ATOM 1107 NE1 TRP A 68 11.200 7.938 -9.357 1.00 0.00 N ATOM 1108 CE2 TRP A 68 11.814 8.191 -8.159 1.00 0.00 C ATOM 1109 CE3 TRP A 68 11.269 8.087 -5.808 1.00 0.00 C ATOM 1110 CZ2 TRP A 68 13.102 8.642 -7.886 1.00 0.00 C ATOM 1111 CZ3 TRP A 68 12.548 8.534 -5.539 1.00 0.00 C ATOM 1112 CH2 TRP A 68 13.453 8.808 -6.574 1.00 0.00 C ATOM 0 H TRP A 68 7.773 5.074 -8.652 1.00 0.00 H new ATOM 0 HA TRP A 68 9.271 5.350 -6.128 1.00 0.00 H new ATOM 0 HB2 TRP A 68 7.564 7.270 -7.762 1.00 0.00 H new ATOM 0 HB3 TRP A 68 8.263 7.668 -6.205 1.00 0.00 H new ATOM 0 HD1 TRP A 68 9.203 7.240 -9.884 1.00 0.00 H new ATOM 0 HE1 TRP A 68 11.627 8.050 -10.277 1.00 0.00 H new ATOM 0 HE3 TRP A 68 10.579 7.879 -5.003 1.00 0.00 H new ATOM 0 HZ2 TRP A 68 13.800 8.854 -8.682 1.00 0.00 H new ATOM 0 HZ3 TRP A 68 12.856 8.675 -4.514 1.00 0.00 H new ATOM 0 HH2 TRP A 68 14.446 9.157 -6.331 1.00 0.00 H new ATOM 1123 N VAL A 69 7.387 5.067 -4.555 1.00 0.00 N ATOM 1124 CA VAL A 69 6.305 4.780 -3.622 1.00 0.00 C ATOM 1125 C VAL A 69 6.406 5.655 -2.377 1.00 0.00 C ATOM 1126 O VAL A 69 7.476 6.169 -2.051 1.00 0.00 O ATOM 1127 CB VAL A 69 6.306 3.300 -3.197 1.00 0.00 C ATOM 1128 CG1 VAL A 69 6.159 2.395 -4.411 1.00 0.00 C ATOM 1129 CG2 VAL A 69 7.574 2.969 -2.426 1.00 0.00 C ATOM 0 H VAL A 69 8.316 5.076 -4.133 1.00 0.00 H new ATOM 0 HA VAL A 69 5.373 4.999 -4.143 1.00 0.00 H new ATOM 0 HB VAL A 69 5.453 3.128 -2.541 1.00 0.00 H new ATOM 0 HG11 VAL A 69 6.162 1.353 -4.091 1.00 0.00 H new ATOM 0 HG12 VAL A 69 5.220 2.616 -4.918 1.00 0.00 H new ATOM 0 HG13 VAL A 69 6.990 2.566 -5.095 1.00 0.00 H new ATOM 0 HG21 VAL A 69 7.558 1.919 -2.133 1.00 0.00 H new ATOM 0 HG22 VAL A 69 8.443 3.157 -3.057 1.00 0.00 H new ATOM 0 HG23 VAL A 69 7.631 3.593 -1.534 1.00 0.00 H new ATOM 1139 N LYS A 70 5.285 5.819 -1.683 1.00 0.00 N ATOM 1140 CA LYS A 70 5.246 6.630 -0.472 1.00 0.00 C ATOM 1141 C LYS A 70 4.659 5.840 0.693 1.00 0.00 C ATOM 1142 O LYS A 70 3.635 5.171 0.550 1.00 0.00 O ATOM 1143 CB LYS A 70 4.422 7.898 -0.708 1.00 0.00 C ATOM 1144 CG LYS A 70 4.173 8.706 0.553 1.00 0.00 C ATOM 1145 CD LYS A 70 2.860 9.467 0.478 1.00 0.00 C ATOM 1146 CE LYS A 70 1.675 8.566 0.787 1.00 0.00 C ATOM 1147 NZ LYS A 70 0.417 9.345 0.963 1.00 0.00 N ATOM 0 H LYS A 70 4.391 5.401 -1.939 1.00 0.00 H new ATOM 0 HA LYS A 70 6.269 6.910 -0.220 1.00 0.00 H new ATOM 0 HB2 LYS A 70 4.937 8.525 -1.435 1.00 0.00 H new ATOM 0 HB3 LYS A 70 3.464 7.622 -1.147 1.00 0.00 H new ATOM 0 HG2 LYS A 70 4.160 8.040 1.416 1.00 0.00 H new ATOM 0 HG3 LYS A 70 4.993 9.408 0.704 1.00 0.00 H new ATOM 0 HD2 LYS A 70 2.880 10.299 1.182 1.00 0.00 H new ATOM 0 HD3 LYS A 70 2.743 9.895 -0.517 1.00 0.00 H new ATOM 0 HE2 LYS A 70 1.546 7.846 -0.021 1.00 0.00 H new ATOM 0 HE3 LYS A 70 1.879 7.996 1.693 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -0.164 8.903 1.704 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 0.649 10.320 1.240 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -0.113 9.356 0.068 1.00 0.00 H new ATOM 1161 N LEU A 71 5.313 5.922 1.846 1.00 0.00 N ATOM 1162 CA LEU A 71 4.855 5.216 3.037 1.00 0.00 C ATOM 1163 C LEU A 71 3.512 5.761 3.512 1.00 0.00 C ATOM 1164 O LEU A 71 3.357 6.965 3.715 1.00 0.00 O ATOM 1165 CB LEU A 71 5.891 5.337 4.157 1.00 0.00 C ATOM 1166 CG LEU A 71 5.891 4.215 5.195 1.00 0.00 C ATOM 1167 CD1 LEU A 71 6.628 2.995 4.663 1.00 0.00 C ATOM 1168 CD2 LEU A 71 6.520 4.693 6.496 1.00 0.00 C ATOM 0 H LEU A 71 6.162 6.470 1.981 1.00 0.00 H new ATOM 0 HA LEU A 71 4.729 4.165 2.778 1.00 0.00 H new ATOM 0 HB2 LEU A 71 6.881 5.386 3.705 1.00 0.00 H new ATOM 0 HB3 LEU A 71 5.729 6.283 4.674 1.00 0.00 H new ATOM 0 HG LEU A 71 4.858 3.932 5.395 1.00 0.00 H new ATOM 0 HD11 LEU A 71 6.618 2.207 5.416 1.00 0.00 H new ATOM 0 HD12 LEU A 71 6.136 2.639 3.758 1.00 0.00 H new ATOM 0 HD13 LEU A 71 7.659 3.264 4.434 1.00 0.00 H new ATOM 0 HD21 LEU A 71 6.512 3.882 7.224 1.00 0.00 H new ATOM 0 HD22 LEU A 71 7.548 5.004 6.310 1.00 0.00 H new ATOM 0 HD23 LEU A 71 5.951 5.537 6.887 1.00 0.00 H new ATOM 1180 N ILE A 72 2.545 4.867 3.688 1.00 0.00 N ATOM 1181 CA ILE A 72 1.216 5.259 4.141 1.00 0.00 C ATOM 1182 C ILE A 72 0.951 4.766 5.560 1.00 0.00 C ATOM 1183 O ILE A 72 0.142 5.340 6.286 1.00 0.00 O ATOM 1184 CB ILE A 72 0.119 4.713 3.208 1.00 0.00 C ATOM 1185 CG1 ILE A 72 0.171 3.185 3.163 1.00 0.00 C ATOM 1186 CG2 ILE A 72 0.274 5.295 1.811 1.00 0.00 C ATOM 1187 CD1 ILE A 72 -0.817 2.574 2.194 1.00 0.00 C ATOM 0 H ILE A 72 2.657 3.867 3.524 1.00 0.00 H new ATOM 0 HA ILE A 72 1.186 6.348 4.125 1.00 0.00 H new ATOM 0 HB ILE A 72 -0.853 5.013 3.600 1.00 0.00 H new ATOM 0 HG12 ILE A 72 1.178 2.872 2.888 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -0.023 2.794 4.162 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -0.508 4.900 1.163 1.00 0.00 H new ATOM 0 HG22 ILE A 72 0.192 6.381 1.858 1.00 0.00 H new ATOM 0 HG23 ILE A 72 1.250 5.022 1.409 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -0.724 1.488 2.215 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -1.830 2.857 2.481 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -0.610 2.936 1.187 1.00 0.00 H new ATOM 1199 N GLY A 73 1.644 3.700 5.949 1.00 0.00 N ATOM 1200 CA GLY A 73 1.471 3.148 7.280 1.00 0.00 C ATOM 1201 C GLY A 73 2.590 2.199 7.664 1.00 0.00 C ATOM 1202 O GLY A 73 2.793 1.174 7.015 1.00 0.00 O ATOM 0 H GLY A 73 2.322 3.209 5.366 1.00 0.00 H new ATOM 0 HA2 GLY A 73 1.424 3.961 8.004 1.00 0.00 H new ATOM 0 HA3 GLY A 73 0.518 2.621 7.330 1.00 0.00 H new ATOM 1206 N ARG A 74 3.317 2.543 8.722 1.00 0.00 N ATOM 1207 CA ARG A 74 4.423 1.715 9.189 1.00 0.00 C ATOM 1208 C ARG A 74 4.184 1.249 10.623 1.00 0.00 C ATOM 1209 O ARG A 74 3.929 2.059 11.514 1.00 0.00 O ATOM 1210 CB ARG A 74 5.738 2.490 9.105 1.00 0.00 C ATOM 1211 CG ARG A 74 5.891 3.550 10.185 1.00 0.00 C ATOM 1212 CD ARG A 74 7.156 4.371 9.985 1.00 0.00 C ATOM 1213 NE ARG A 74 8.310 3.766 10.644 1.00 0.00 N ATOM 1214 CZ ARG A 74 8.559 3.885 11.944 1.00 0.00 C ATOM 1215 NH1 ARG A 74 7.739 4.582 12.719 1.00 0.00 N ATOM 1216 NH2 ARG A 74 9.630 3.306 12.471 1.00 0.00 N ATOM 0 H ARG A 74 3.161 3.388 9.271 1.00 0.00 H new ATOM 0 HA ARG A 74 4.485 0.837 8.546 1.00 0.00 H new ATOM 0 HB2 ARG A 74 6.569 1.788 9.177 1.00 0.00 H new ATOM 0 HB3 ARG A 74 5.807 2.967 8.127 1.00 0.00 H new ATOM 0 HG2 ARG A 74 5.023 4.209 10.175 1.00 0.00 H new ATOM 0 HG3 ARG A 74 5.917 3.072 11.164 1.00 0.00 H new ATOM 0 HD2 ARG A 74 7.359 4.471 8.919 1.00 0.00 H new ATOM 0 HD3 ARG A 74 7.001 5.377 10.376 1.00 0.00 H new ATOM 0 HE ARG A 74 8.960 3.223 10.076 1.00 0.00 H new ATOM 0 HH11 ARG A 74 6.914 5.029 12.318 1.00 0.00 H new ATOM 0 HH12 ARG A 74 7.933 4.671 13.716 1.00 0.00 H new ATOM 0 HH21 ARG A 74 10.263 2.769 11.878 1.00 0.00 H new ATOM 0 HH22 ARG A 74 9.820 3.398 13.469 1.00 0.00 H new ATOM 1230 N GLU A 75 4.270 -0.060 10.836 1.00 0.00 N ATOM 1231 CA GLU A 75 4.063 -0.633 12.161 1.00 0.00 C ATOM 1232 C GLU A 75 5.074 -1.741 12.439 1.00 0.00 C ATOM 1233 O GLU A 75 5.180 -2.704 11.680 1.00 0.00 O ATOM 1234 CB GLU A 75 2.640 -1.182 12.286 1.00 0.00 C ATOM 1235 CG GLU A 75 1.614 -0.132 12.678 1.00 0.00 C ATOM 1236 CD GLU A 75 1.455 -0.003 14.180 1.00 0.00 C ATOM 1237 OE1 GLU A 75 1.398 -1.048 14.862 1.00 0.00 O ATOM 1238 OE2 GLU A 75 1.389 1.141 14.674 1.00 0.00 O ATOM 0 H GLU A 75 4.481 -0.743 10.109 1.00 0.00 H new ATOM 0 HA GLU A 75 4.206 0.158 12.897 1.00 0.00 H new ATOM 0 HB2 GLU A 75 2.347 -1.627 11.335 1.00 0.00 H new ATOM 0 HB3 GLU A 75 2.632 -1.981 13.028 1.00 0.00 H new ATOM 0 HG2 GLU A 75 1.910 0.832 12.264 1.00 0.00 H new ATOM 0 HG3 GLU A 75 0.651 -0.387 12.235 1.00 0.00 H new ATOM 1245 N MET A 76 5.814 -1.597 13.533 1.00 0.00 N ATOM 1246 CA MET A 76 6.818 -2.586 13.912 1.00 0.00 C ATOM 1247 C MET A 76 6.438 -3.271 15.221 1.00 0.00 C ATOM 1248 O MET A 76 6.393 -2.637 16.276 1.00 0.00 O ATOM 1249 CB MET A 76 8.190 -1.925 14.049 1.00 0.00 C ATOM 1250 CG MET A 76 8.629 -1.173 12.804 1.00 0.00 C ATOM 1251 SD MET A 76 10.142 -0.225 13.061 1.00 0.00 S ATOM 1252 CE MET A 76 11.252 -1.510 13.634 1.00 0.00 C ATOM 0 H MET A 76 5.738 -0.806 14.173 1.00 0.00 H new ATOM 0 HA MET A 76 6.863 -3.340 13.127 1.00 0.00 H new ATOM 0 HB2 MET A 76 8.169 -1.234 14.892 1.00 0.00 H new ATOM 0 HB3 MET A 76 8.931 -2.690 14.282 1.00 0.00 H new ATOM 0 HG2 MET A 76 8.783 -1.883 11.991 1.00 0.00 H new ATOM 0 HG3 MET A 76 7.831 -0.499 12.491 1.00 0.00 H new ATOM 0 HE1 MET A 76 12.279 -1.146 13.599 1.00 0.00 H new ATOM 0 HE2 MET A 76 10.997 -1.780 14.659 1.00 0.00 H new ATOM 0 HE3 MET A 76 11.156 -2.386 12.993 1.00 0.00 H new ATOM 1262 N LYS A 77 6.163 -4.569 15.146 1.00 0.00 N ATOM 1263 CA LYS A 77 5.787 -5.341 16.325 1.00 0.00 C ATOM 1264 C LYS A 77 6.805 -6.444 16.601 1.00 0.00 C ATOM 1265 O LYS A 77 7.350 -7.042 15.674 1.00 0.00 O ATOM 1266 CB LYS A 77 4.396 -5.951 16.139 1.00 0.00 C ATOM 1267 CG LYS A 77 3.694 -6.276 17.446 1.00 0.00 C ATOM 1268 CD LYS A 77 3.124 -5.027 18.098 1.00 0.00 C ATOM 1269 CE LYS A 77 1.702 -4.755 17.631 1.00 0.00 C ATOM 1270 NZ LYS A 77 1.042 -3.700 18.448 1.00 0.00 N ATOM 0 H LYS A 77 6.193 -5.109 14.281 1.00 0.00 H new ATOM 0 HA LYS A 77 5.769 -4.665 17.180 1.00 0.00 H new ATOM 0 HB2 LYS A 77 3.778 -5.258 15.567 1.00 0.00 H new ATOM 0 HB3 LYS A 77 4.484 -6.862 15.547 1.00 0.00 H new ATOM 0 HG2 LYS A 77 2.891 -6.990 17.261 1.00 0.00 H new ATOM 0 HG3 LYS A 77 4.396 -6.755 18.128 1.00 0.00 H new ATOM 0 HD2 LYS A 77 3.136 -5.143 19.182 1.00 0.00 H new ATOM 0 HD3 LYS A 77 3.756 -4.171 17.862 1.00 0.00 H new ATOM 0 HE2 LYS A 77 1.716 -4.449 16.585 1.00 0.00 H new ATOM 0 HE3 LYS A 77 1.119 -5.675 17.686 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 0.075 -3.544 18.098 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 1.006 -4.003 19.442 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 1.583 -2.815 18.375 1.00 0.00 H new ATOM 1284 N ASN A 78 7.053 -6.708 17.879 1.00 0.00 N ATOM 1285 CA ASN A 78 8.005 -7.740 18.275 1.00 0.00 C ATOM 1286 C ASN A 78 7.581 -9.105 17.741 1.00 0.00 C ATOM 1287 O ASN A 78 8.365 -10.054 17.742 1.00 0.00 O ATOM 1288 CB ASN A 78 8.128 -7.791 19.799 1.00 0.00 C ATOM 1289 CG ASN A 78 9.015 -8.928 20.270 1.00 0.00 C ATOM 1290 OD1 ASN A 78 8.643 -10.098 20.177 1.00 0.00 O ATOM 1291 ND2 ASN A 78 10.193 -8.587 20.779 1.00 0.00 N ATOM 0 H ASN A 78 6.609 -6.222 18.658 1.00 0.00 H new ATOM 0 HA ASN A 78 8.975 -7.488 17.847 1.00 0.00 H new ATOM 0 HB2 ASN A 78 8.532 -6.845 20.160 1.00 0.00 H new ATOM 0 HB3 ASN A 78 7.136 -7.902 20.237 1.00 0.00 H new ATOM 0 HD21 ASN A 78 10.832 -9.308 21.113 1.00 0.00 H new ATOM 0 HD22 ASN A 78 10.459 -7.604 20.836 1.00 0.00 H new ATOM 1298 N ASP A 79 6.336 -9.195 17.286 1.00 0.00 N ATOM 1299 CA ASP A 79 5.808 -10.443 16.748 1.00 0.00 C ATOM 1300 C ASP A 79 5.905 -10.462 15.225 1.00 0.00 C ATOM 1301 O ASP A 79 6.028 -11.524 14.615 1.00 0.00 O ATOM 1302 CB ASP A 79 4.353 -10.634 17.181 1.00 0.00 C ATOM 1303 CG ASP A 79 3.372 -10.024 16.198 1.00 0.00 C ATOM 1304 OD1 ASP A 79 3.446 -8.799 15.967 1.00 0.00 O ATOM 1305 OD2 ASP A 79 2.529 -10.773 15.661 1.00 0.00 O ATOM 0 H ASP A 79 5.674 -8.419 17.279 1.00 0.00 H new ATOM 0 HA ASP A 79 6.408 -11.263 17.143 1.00 0.00 H new ATOM 0 HB2 ASP A 79 4.144 -11.699 17.285 1.00 0.00 H new ATOM 0 HB3 ASP A 79 4.207 -10.184 18.163 1.00 0.00 H new ATOM 1310 N ARG A 80 5.847 -9.281 14.618 1.00 0.00 N ATOM 1311 CA ARG A 80 5.926 -9.162 13.168 1.00 0.00 C ATOM 1312 C ARG A 80 5.958 -7.698 12.743 1.00 0.00 C ATOM 1313 O ARG A 80 5.510 -6.817 13.479 1.00 0.00 O ATOM 1314 CB ARG A 80 4.739 -9.869 12.512 1.00 0.00 C ATOM 1315 CG ARG A 80 3.435 -9.096 12.619 1.00 0.00 C ATOM 1316 CD ARG A 80 2.240 -9.969 12.268 1.00 0.00 C ATOM 1317 NE ARG A 80 2.071 -10.113 10.824 1.00 0.00 N ATOM 1318 CZ ARG A 80 1.039 -10.733 10.264 1.00 0.00 C ATOM 1319 NH1 ARG A 80 0.088 -11.263 11.021 1.00 0.00 N ATOM 1320 NH2 ARG A 80 0.956 -10.823 8.942 1.00 0.00 N ATOM 0 H ARG A 80 5.745 -8.393 15.109 1.00 0.00 H new ATOM 0 HA ARG A 80 6.850 -9.637 12.840 1.00 0.00 H new ATOM 0 HB2 ARG A 80 4.965 -10.040 11.459 1.00 0.00 H new ATOM 0 HB3 ARG A 80 4.610 -10.848 12.973 1.00 0.00 H new ATOM 0 HG2 ARG A 80 3.321 -8.711 13.632 1.00 0.00 H new ATOM 0 HG3 ARG A 80 3.466 -8.234 11.952 1.00 0.00 H new ATOM 0 HD2 ARG A 80 2.366 -10.954 12.718 1.00 0.00 H new ATOM 0 HD3 ARG A 80 1.336 -9.536 12.697 1.00 0.00 H new ATOM 0 HE ARG A 80 2.784 -9.716 10.213 1.00 0.00 H new ATOM 0 HH11 ARG A 80 0.148 -11.195 12.037 1.00 0.00 H new ATOM 0 HH12 ARG A 80 -0.703 -11.739 10.587 1.00 0.00 H new ATOM 0 HH21 ARG A 80 1.685 -10.416 8.356 1.00 0.00 H new ATOM 0 HH22 ARG A 80 0.163 -11.299 8.512 1.00 0.00 H new ATOM 1334 N ILE A 81 6.490 -7.444 11.552 1.00 0.00 N ATOM 1335 CA ILE A 81 6.580 -6.086 11.029 1.00 0.00 C ATOM 1336 C ILE A 81 5.668 -5.901 9.821 1.00 0.00 C ATOM 1337 O ILE A 81 5.666 -6.718 8.900 1.00 0.00 O ATOM 1338 CB ILE A 81 8.023 -5.731 10.628 1.00 0.00 C ATOM 1339 CG1 ILE A 81 8.925 -5.696 11.863 1.00 0.00 C ATOM 1340 CG2 ILE A 81 8.058 -4.394 9.902 1.00 0.00 C ATOM 1341 CD1 ILE A 81 10.397 -5.585 11.532 1.00 0.00 C ATOM 0 H ILE A 81 6.865 -8.161 10.931 1.00 0.00 H new ATOM 0 HA ILE A 81 6.260 -5.418 11.829 1.00 0.00 H new ATOM 0 HB ILE A 81 8.395 -6.500 9.951 1.00 0.00 H new ATOM 0 HG12 ILE A 81 8.637 -4.852 12.490 1.00 0.00 H new ATOM 0 HG13 ILE A 81 8.760 -6.600 12.450 1.00 0.00 H new ATOM 0 HG21 ILE A 81 9.085 -4.157 9.625 1.00 0.00 H new ATOM 0 HG22 ILE A 81 7.444 -4.452 9.003 1.00 0.00 H new ATOM 0 HG23 ILE A 81 7.670 -3.614 10.557 1.00 0.00 H new ATOM 0 HD11 ILE A 81 10.977 -5.565 12.455 1.00 0.00 H new ATOM 0 HD12 ILE A 81 10.700 -6.442 10.931 1.00 0.00 H new ATOM 0 HD13 ILE A 81 10.576 -4.667 10.972 1.00 0.00 H new ATOM 1353 N LYS A 82 4.894 -4.821 9.831 1.00 0.00 N ATOM 1354 CA LYS A 82 3.979 -4.525 8.735 1.00 0.00 C ATOM 1355 C LYS A 82 4.323 -3.189 8.083 1.00 0.00 C ATOM 1356 O LYS A 82 4.467 -2.174 8.764 1.00 0.00 O ATOM 1357 CB LYS A 82 2.536 -4.499 9.242 1.00 0.00 C ATOM 1358 CG LYS A 82 1.515 -4.907 8.193 1.00 0.00 C ATOM 1359 CD LYS A 82 1.578 -6.397 7.904 1.00 0.00 C ATOM 1360 CE LYS A 82 0.570 -6.801 6.840 1.00 0.00 C ATOM 1361 NZ LYS A 82 -0.821 -6.820 7.371 1.00 0.00 N ATOM 0 H LYS A 82 4.882 -4.136 10.587 1.00 0.00 H new ATOM 0 HA LYS A 82 4.082 -5.311 7.987 1.00 0.00 H new ATOM 0 HB2 LYS A 82 2.449 -5.166 10.100 1.00 0.00 H new ATOM 0 HB3 LYS A 82 2.301 -3.494 9.594 1.00 0.00 H new ATOM 0 HG2 LYS A 82 0.514 -4.644 8.536 1.00 0.00 H new ATOM 0 HG3 LYS A 82 1.694 -4.349 7.274 1.00 0.00 H new ATOM 0 HD2 LYS A 82 2.583 -6.663 7.575 1.00 0.00 H new ATOM 0 HD3 LYS A 82 1.385 -6.955 8.820 1.00 0.00 H new ATOM 0 HE2 LYS A 82 0.629 -6.107 6.002 1.00 0.00 H new ATOM 0 HE3 LYS A 82 0.825 -7.788 6.455 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -1.478 -7.100 6.615 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -0.884 -7.501 8.154 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -1.074 -5.872 7.715 1.00 0.00 H new ATOM 1375 N VAL A 83 4.455 -3.197 6.761 1.00 0.00 N ATOM 1376 CA VAL A 83 4.780 -1.986 6.017 1.00 0.00 C ATOM 1377 C VAL A 83 3.874 -1.828 4.801 1.00 0.00 C ATOM 1378 O VAL A 83 3.770 -2.731 3.971 1.00 0.00 O ATOM 1379 CB VAL A 83 6.249 -1.990 5.552 1.00 0.00 C ATOM 1380 CG1 VAL A 83 6.591 -0.685 4.852 1.00 0.00 C ATOM 1381 CG2 VAL A 83 7.179 -2.232 6.731 1.00 0.00 C ATOM 0 H VAL A 83 4.342 -4.029 6.182 1.00 0.00 H new ATOM 0 HA VAL A 83 4.623 -1.147 6.695 1.00 0.00 H new ATOM 0 HB VAL A 83 6.384 -2.803 4.838 1.00 0.00 H new ATOM 0 HG11 VAL A 83 7.632 -0.706 4.531 1.00 0.00 H new ATOM 0 HG12 VAL A 83 5.946 -0.558 3.983 1.00 0.00 H new ATOM 0 HG13 VAL A 83 6.441 0.147 5.540 1.00 0.00 H new ATOM 0 HG21 VAL A 83 8.213 -2.232 6.385 1.00 0.00 H new ATOM 0 HG22 VAL A 83 7.043 -1.442 7.470 1.00 0.00 H new ATOM 0 HG23 VAL A 83 6.948 -3.196 7.184 1.00 0.00 H new ATOM 1391 N SER A 84 3.223 -0.674 4.702 1.00 0.00 N ATOM 1392 CA SER A 84 2.322 -0.397 3.589 1.00 0.00 C ATOM 1393 C SER A 84 2.876 0.716 2.706 1.00 0.00 C ATOM 1394 O SER A 84 3.218 1.797 3.190 1.00 0.00 O ATOM 1395 CB SER A 84 0.937 -0.010 4.110 1.00 0.00 C ATOM 1396 OG SER A 84 0.146 -1.158 4.359 1.00 0.00 O ATOM 0 H SER A 84 3.302 0.085 5.379 1.00 0.00 H new ATOM 0 HA SER A 84 2.236 -1.303 2.989 1.00 0.00 H new ATOM 0 HB2 SER A 84 1.039 0.571 5.027 1.00 0.00 H new ATOM 0 HB3 SER A 84 0.437 0.629 3.382 1.00 0.00 H new ATOM 0 HG SER A 84 -0.733 -0.883 4.693 1.00 0.00 H new ATOM 1402 N LEU A 85 2.963 0.447 1.409 1.00 0.00 N ATOM 1403 CA LEU A 85 3.475 1.425 0.456 1.00 0.00 C ATOM 1404 C LEU A 85 2.433 1.746 -0.609 1.00 0.00 C ATOM 1405 O LEU A 85 1.624 0.894 -0.977 1.00 0.00 O ATOM 1406 CB LEU A 85 4.752 0.903 -0.205 1.00 0.00 C ATOM 1407 CG LEU A 85 5.857 0.437 0.743 1.00 0.00 C ATOM 1408 CD1 LEU A 85 7.105 0.053 -0.038 1.00 0.00 C ATOM 1409 CD2 LEU A 85 6.177 1.520 1.762 1.00 0.00 C ATOM 0 H LEU A 85 2.685 -0.442 0.992 1.00 0.00 H new ATOM 0 HA LEU A 85 3.703 2.341 1.002 1.00 0.00 H new ATOM 0 HB2 LEU A 85 4.486 0.071 -0.857 1.00 0.00 H new ATOM 0 HB3 LEU A 85 5.155 1.690 -0.842 1.00 0.00 H new ATOM 0 HG LEU A 85 5.502 -0.444 1.277 1.00 0.00 H new ATOM 0 HD11 LEU A 85 7.880 -0.276 0.654 1.00 0.00 H new ATOM 0 HD12 LEU A 85 6.867 -0.756 -0.728 1.00 0.00 H new ATOM 0 HD13 LEU A 85 7.462 0.916 -0.600 1.00 0.00 H new ATOM 0 HD21 LEU A 85 6.966 1.171 2.429 1.00 0.00 H new ATOM 0 HD22 LEU A 85 6.511 2.419 1.244 1.00 0.00 H new ATOM 0 HD23 LEU A 85 5.284 1.747 2.344 1.00 0.00 H new ATOM 1421 N SER A 86 2.457 2.981 -1.103 1.00 0.00 N ATOM 1422 CA SER A 86 1.513 3.415 -2.126 1.00 0.00 C ATOM 1423 C SER A 86 2.246 3.861 -3.387 1.00 0.00 C ATOM 1424 O SER A 86 3.368 4.363 -3.322 1.00 0.00 O ATOM 1425 CB SER A 86 0.644 4.556 -1.595 1.00 0.00 C ATOM 1426 OG SER A 86 -0.410 4.855 -2.493 1.00 0.00 O ATOM 0 H SER A 86 3.121 3.698 -0.811 1.00 0.00 H new ATOM 0 HA SER A 86 0.874 2.569 -2.380 1.00 0.00 H new ATOM 0 HB2 SER A 86 0.232 4.282 -0.624 1.00 0.00 H new ATOM 0 HB3 SER A 86 1.258 5.444 -1.441 1.00 0.00 H new ATOM 0 HG SER A 86 -1.214 4.360 -2.230 1.00 0.00 H new ATOM 1432 N MET A 87 1.602 3.676 -4.535 1.00 0.00 N ATOM 1433 CA MET A 87 2.190 4.061 -5.811 1.00 0.00 C ATOM 1434 C MET A 87 1.293 5.051 -6.549 1.00 0.00 C ATOM 1435 O MET A 87 1.775 5.938 -7.251 1.00 0.00 O ATOM 1436 CB MET A 87 2.428 2.824 -6.681 1.00 0.00 C ATOM 1437 CG MET A 87 3.504 1.898 -6.140 1.00 0.00 C ATOM 1438 SD MET A 87 3.387 0.229 -6.812 1.00 0.00 S ATOM 1439 CE MET A 87 3.968 0.497 -8.485 1.00 0.00 C ATOM 0 H MET A 87 0.673 3.262 -4.607 1.00 0.00 H new ATOM 0 HA MET A 87 3.146 4.545 -5.610 1.00 0.00 H new ATOM 0 HB2 MET A 87 1.494 2.269 -6.772 1.00 0.00 H new ATOM 0 HB3 MET A 87 2.707 3.144 -7.685 1.00 0.00 H new ATOM 0 HG2 MET A 87 4.485 2.312 -6.374 1.00 0.00 H new ATOM 0 HG3 MET A 87 3.427 1.854 -5.054 1.00 0.00 H new ATOM 0 HE1 MET A 87 3.144 0.354 -9.184 1.00 0.00 H new ATOM 0 HE2 MET A 87 4.351 1.513 -8.579 1.00 0.00 H new ATOM 0 HE3 MET A 87 4.764 -0.213 -8.712 1.00 0.00 H new ATOM 1449 N LYS A 88 -0.016 4.891 -6.383 1.00 0.00 N ATOM 1450 CA LYS A 88 -0.982 5.770 -7.031 1.00 0.00 C ATOM 1451 C LYS A 88 -0.831 7.204 -6.533 1.00 0.00 C ATOM 1452 O LYS A 88 -1.225 8.152 -7.213 1.00 0.00 O ATOM 1453 CB LYS A 88 -2.407 5.276 -6.771 1.00 0.00 C ATOM 1454 CG LYS A 88 -2.740 5.130 -5.296 1.00 0.00 C ATOM 1455 CD LYS A 88 -4.171 4.660 -5.092 1.00 0.00 C ATOM 1456 CE LYS A 88 -4.630 4.879 -3.659 1.00 0.00 C ATOM 1457 NZ LYS A 88 -4.955 6.307 -3.392 1.00 0.00 N ATOM 0 H LYS A 88 -0.432 4.161 -5.805 1.00 0.00 H new ATOM 0 HA LYS A 88 -0.789 5.754 -8.104 1.00 0.00 H new ATOM 0 HB2 LYS A 88 -3.112 5.971 -7.227 1.00 0.00 H new ATOM 0 HB3 LYS A 88 -2.544 4.313 -7.263 1.00 0.00 H new ATOM 0 HG2 LYS A 88 -2.053 4.420 -4.836 1.00 0.00 H new ATOM 0 HG3 LYS A 88 -2.595 6.086 -4.793 1.00 0.00 H new ATOM 0 HD2 LYS A 88 -4.832 5.196 -5.773 1.00 0.00 H new ATOM 0 HD3 LYS A 88 -4.247 3.602 -5.342 1.00 0.00 H new ATOM 0 HE2 LYS A 88 -5.508 4.264 -3.461 1.00 0.00 H new ATOM 0 HE3 LYS A 88 -3.849 4.550 -2.973 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 -4.916 6.486 -2.368 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 -4.266 6.916 -3.877 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 -5.911 6.517 -3.744 1.00 0.00 H new ATOM 1471 N VAL A 89 -0.258 7.357 -5.343 1.00 0.00 N ATOM 1472 CA VAL A 89 -0.053 8.675 -4.757 1.00 0.00 C ATOM 1473 C VAL A 89 1.376 9.157 -4.975 1.00 0.00 C ATOM 1474 O VAL A 89 1.814 10.134 -4.366 1.00 0.00 O ATOM 1475 CB VAL A 89 -0.357 8.671 -3.247 1.00 0.00 C ATOM 1476 CG1 VAL A 89 -1.799 8.257 -2.994 1.00 0.00 C ATOM 1477 CG2 VAL A 89 0.607 7.752 -2.512 1.00 0.00 C ATOM 0 H VAL A 89 0.072 6.583 -4.766 1.00 0.00 H new ATOM 0 HA VAL A 89 -0.743 9.355 -5.257 1.00 0.00 H new ATOM 0 HB VAL A 89 -0.222 9.682 -2.864 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -1.996 8.260 -1.922 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -2.471 8.959 -3.488 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -1.965 7.255 -3.391 1.00 0.00 H new ATOM 0 HG21 VAL A 89 0.378 7.761 -1.446 1.00 0.00 H new ATOM 0 HG22 VAL A 89 0.506 6.737 -2.896 1.00 0.00 H new ATOM 0 HG23 VAL A 89 1.629 8.098 -2.666 1.00 0.00 H new ATOM 1487 N VAL A 90 2.102 8.466 -5.849 1.00 0.00 N ATOM 1488 CA VAL A 90 3.483 8.824 -6.149 1.00 0.00 C ATOM 1489 C VAL A 90 3.742 8.805 -7.651 1.00 0.00 C ATOM 1490 O VAL A 90 3.404 7.840 -8.336 1.00 0.00 O ATOM 1491 CB VAL A 90 4.474 7.871 -5.456 1.00 0.00 C ATOM 1492 CG1 VAL A 90 5.906 8.322 -5.695 1.00 0.00 C ATOM 1493 CG2 VAL A 90 4.175 7.782 -3.967 1.00 0.00 C ATOM 0 H VAL A 90 1.756 7.655 -6.362 1.00 0.00 H new ATOM 0 HA VAL A 90 3.637 9.834 -5.769 1.00 0.00 H new ATOM 0 HB VAL A 90 4.356 6.877 -5.887 1.00 0.00 H new ATOM 0 HG11 VAL A 90 6.591 7.636 -5.197 1.00 0.00 H new ATOM 0 HG12 VAL A 90 6.112 8.328 -6.765 1.00 0.00 H new ATOM 0 HG13 VAL A 90 6.043 9.326 -5.294 1.00 0.00 H new ATOM 0 HG21 VAL A 90 4.885 7.104 -3.493 1.00 0.00 H new ATOM 0 HG22 VAL A 90 4.263 8.771 -3.518 1.00 0.00 H new ATOM 0 HG23 VAL A 90 3.162 7.406 -3.821 1.00 0.00 H new ATOM 1503 N ASN A 91 4.342 9.877 -8.156 1.00 0.00 N ATOM 1504 CA ASN A 91 4.647 9.984 -9.578 1.00 0.00 C ATOM 1505 C ASN A 91 5.755 9.012 -9.972 1.00 0.00 C ATOM 1506 O ASN A 91 6.840 9.026 -9.391 1.00 0.00 O ATOM 1507 CB ASN A 91 5.060 11.415 -9.928 1.00 0.00 C ATOM 1508 CG ASN A 91 4.758 11.768 -11.371 1.00 0.00 C ATOM 1509 OD1 ASN A 91 3.670 11.489 -11.877 1.00 0.00 O ATOM 1510 ND2 ASN A 91 5.722 12.386 -12.044 1.00 0.00 N ATOM 0 H ASN A 91 4.627 10.684 -7.602 1.00 0.00 H new ATOM 0 HA ASN A 91 3.747 9.727 -10.136 1.00 0.00 H new ATOM 0 HB2 ASN A 91 4.540 12.111 -9.270 1.00 0.00 H new ATOM 0 HB3 ASN A 91 6.127 11.538 -9.743 1.00 0.00 H new ATOM 0 HD21 ASN A 91 5.576 12.648 -13.019 1.00 0.00 H new ATOM 0 HD22 ASN A 91 6.608 12.598 -11.586 1.00 0.00 H new ATOM 1517 N GLN A 92 5.475 8.171 -10.963 1.00 0.00 N ATOM 1518 CA GLN A 92 6.448 7.194 -11.434 1.00 0.00 C ATOM 1519 C GLN A 92 7.323 7.783 -12.536 1.00 0.00 C ATOM 1520 O GLN A 92 7.622 7.118 -13.527 1.00 0.00 O ATOM 1521 CB GLN A 92 5.738 5.940 -11.945 1.00 0.00 C ATOM 1522 CG GLN A 92 5.184 5.060 -10.837 1.00 0.00 C ATOM 1523 CD GLN A 92 3.762 5.425 -10.457 1.00 0.00 C ATOM 1524 OE1 GLN A 92 2.963 5.823 -11.305 1.00 0.00 O ATOM 1525 NE2 GLN A 92 3.440 5.293 -9.176 1.00 0.00 N ATOM 0 H GLN A 92 4.582 8.147 -11.455 1.00 0.00 H new ATOM 0 HA GLN A 92 7.088 6.923 -10.594 1.00 0.00 H new ATOM 0 HB2 GLN A 92 4.922 6.238 -12.603 1.00 0.00 H new ATOM 0 HB3 GLN A 92 6.436 5.357 -12.546 1.00 0.00 H new ATOM 0 HG2 GLN A 92 5.215 4.018 -11.156 1.00 0.00 H new ATOM 0 HG3 GLN A 92 5.824 5.143 -9.958 1.00 0.00 H new ATOM 0 HE21 GLN A 92 4.134 4.959 -8.507 1.00 0.00 H new ATOM 0 HE22 GLN A 92 2.498 5.525 -8.860 1.00 0.00 H new ATOM 1534 N GLY A 93 7.730 9.036 -12.356 1.00 0.00 N ATOM 1535 CA GLY A 93 8.566 9.694 -13.343 1.00 0.00 C ATOM 1536 C GLY A 93 9.567 10.643 -12.716 1.00 0.00 C ATOM 1537 O GLY A 93 10.678 10.809 -13.220 1.00 0.00 O ATOM 0 H GLY A 93 7.496 9.607 -11.544 1.00 0.00 H new ATOM 0 HA2 GLY A 93 9.099 8.941 -13.923 1.00 0.00 H new ATOM 0 HA3 GLY A 93 7.935 10.245 -14.040 1.00 0.00 H new ATOM 1541 N THR A 94 9.174 11.270 -11.612 1.00 0.00 N ATOM 1542 CA THR A 94 10.044 12.211 -10.915 1.00 0.00 C ATOM 1543 C THR A 94 10.146 11.872 -9.433 1.00 0.00 C ATOM 1544 O THR A 94 11.156 12.153 -8.790 1.00 0.00 O ATOM 1545 CB THR A 94 9.540 13.658 -11.066 1.00 0.00 C ATOM 1546 OG1 THR A 94 8.214 13.773 -10.543 1.00 0.00 O ATOM 1547 CG2 THR A 94 9.553 14.087 -12.526 1.00 0.00 C ATOM 0 H THR A 94 8.258 11.144 -11.181 1.00 0.00 H new ATOM 0 HA THR A 94 11.030 12.128 -11.372 1.00 0.00 H new ATOM 0 HB THR A 94 10.209 14.311 -10.505 1.00 0.00 H new ATOM 0 HG1 THR A 94 7.902 14.697 -10.642 1.00 0.00 H new ATOM 0 HG21 THR A 94 9.193 15.113 -12.607 1.00 0.00 H new ATOM 0 HG22 THR A 94 10.570 14.028 -12.914 1.00 0.00 H new ATOM 0 HG23 THR A 94 8.905 13.428 -13.105 1.00 0.00 H new ATOM 1555 N GLY A 95 9.092 11.264 -8.895 1.00 0.00 N ATOM 1556 CA GLY A 95 9.084 10.896 -7.492 1.00 0.00 C ATOM 1557 C GLY A 95 8.502 11.984 -6.610 1.00 0.00 C ATOM 1558 O GLY A 95 8.860 12.103 -5.439 1.00 0.00 O ATOM 0 H GLY A 95 8.244 11.020 -9.407 1.00 0.00 H new ATOM 0 HA2 GLY A 95 8.507 9.980 -7.363 1.00 0.00 H new ATOM 0 HA3 GLY A 95 10.103 10.678 -7.171 1.00 0.00 H new ATOM 1562 N LYS A 96 7.601 12.781 -7.176 1.00 0.00 N ATOM 1563 CA LYS A 96 6.968 13.865 -6.434 1.00 0.00 C ATOM 1564 C LYS A 96 5.670 13.394 -5.784 1.00 0.00 C ATOM 1565 O LYS A 96 4.885 12.671 -6.398 1.00 0.00 O ATOM 1566 CB LYS A 96 6.685 15.048 -7.363 1.00 0.00 C ATOM 1567 CG LYS A 96 6.714 16.394 -6.660 1.00 0.00 C ATOM 1568 CD LYS A 96 6.802 17.541 -7.653 1.00 0.00 C ATOM 1569 CE LYS A 96 5.458 17.814 -8.309 1.00 0.00 C ATOM 1570 NZ LYS A 96 4.468 18.361 -7.339 1.00 0.00 N ATOM 0 H LYS A 96 7.293 12.697 -8.145 1.00 0.00 H new ATOM 0 HA LYS A 96 7.653 14.183 -5.648 1.00 0.00 H new ATOM 0 HB2 LYS A 96 7.421 15.052 -8.167 1.00 0.00 H new ATOM 0 HB3 LYS A 96 5.708 14.910 -7.826 1.00 0.00 H new ATOM 0 HG2 LYS A 96 5.817 16.507 -6.051 1.00 0.00 H new ATOM 0 HG3 LYS A 96 7.566 16.433 -5.982 1.00 0.00 H new ATOM 0 HD2 LYS A 96 7.148 18.440 -7.143 1.00 0.00 H new ATOM 0 HD3 LYS A 96 7.541 17.305 -8.419 1.00 0.00 H new ATOM 0 HE2 LYS A 96 5.591 18.520 -9.129 1.00 0.00 H new ATOM 0 HE3 LYS A 96 5.071 16.891 -8.742 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 3.696 18.828 -7.857 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 4.080 17.586 -6.764 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 4.936 19.052 -6.718 1.00 0.00 H new ATOM 1584 N ASP A 97 5.451 13.811 -4.542 1.00 0.00 N ATOM 1585 CA ASP A 97 4.247 13.434 -3.810 1.00 0.00 C ATOM 1586 C ASP A 97 2.999 13.974 -4.503 1.00 0.00 C ATOM 1587 O ASP A 97 2.817 15.186 -4.622 1.00 0.00 O ATOM 1588 CB ASP A 97 4.314 13.954 -2.374 1.00 0.00 C ATOM 1589 CG ASP A 97 3.467 13.133 -1.421 1.00 0.00 C ATOM 1590 OD1 ASP A 97 3.161 11.969 -1.751 1.00 0.00 O ATOM 1591 OD2 ASP A 97 3.111 13.656 -0.344 1.00 0.00 O ATOM 0 H ASP A 97 6.091 14.410 -4.021 1.00 0.00 H new ATOM 0 HA ASP A 97 4.188 12.346 -3.791 1.00 0.00 H new ATOM 0 HB2 ASP A 97 5.350 13.944 -2.035 1.00 0.00 H new ATOM 0 HB3 ASP A 97 3.980 14.991 -2.350 1.00 0.00 H new ATOM 1596 N LEU A 98 2.143 13.066 -4.958 1.00 0.00 N ATOM 1597 CA LEU A 98 0.911 13.450 -5.639 1.00 0.00 C ATOM 1598 C LEU A 98 -0.181 13.801 -4.633 1.00 0.00 C ATOM 1599 O LEU A 98 -1.134 14.510 -4.959 1.00 0.00 O ATOM 1600 CB LEU A 98 0.435 12.320 -6.552 1.00 0.00 C ATOM 1601 CG LEU A 98 1.417 11.875 -7.637 1.00 0.00 C ATOM 1602 CD1 LEU A 98 0.926 10.604 -8.313 1.00 0.00 C ATOM 1603 CD2 LEU A 98 1.617 12.982 -8.661 1.00 0.00 C ATOM 0 H LEU A 98 2.279 12.059 -4.868 1.00 0.00 H new ATOM 0 HA LEU A 98 1.120 14.333 -6.243 1.00 0.00 H new ATOM 0 HB2 LEU A 98 0.193 11.456 -5.932 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -0.490 12.635 -7.034 1.00 0.00 H new ATOM 0 HG LEU A 98 2.377 11.664 -7.167 1.00 0.00 H new ATOM 0 HD11 LEU A 98 1.637 10.303 -9.082 1.00 0.00 H new ATOM 0 HD12 LEU A 98 0.834 9.810 -7.572 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -0.046 10.787 -8.770 1.00 0.00 H new ATOM 0 HD21 LEU A 98 2.319 12.648 -9.425 1.00 0.00 H new ATOM 0 HD22 LEU A 98 0.662 13.224 -9.126 1.00 0.00 H new ATOM 0 HD23 LEU A 98 2.014 13.868 -8.166 1.00 0.00 H new ATOM 1615 N ASP A 99 -0.036 13.301 -3.411 1.00 0.00 N ATOM 1616 CA ASP A 99 -1.008 13.564 -2.356 1.00 0.00 C ATOM 1617 C ASP A 99 -0.322 14.108 -1.108 1.00 0.00 C ATOM 1618 O ASP A 99 -0.095 13.392 -0.132 1.00 0.00 O ATOM 1619 CB ASP A 99 -1.779 12.288 -2.015 1.00 0.00 C ATOM 1620 CG ASP A 99 -0.922 11.271 -1.286 1.00 0.00 C ATOM 1621 OD1 ASP A 99 0.316 11.321 -1.440 1.00 0.00 O ATOM 1622 OD2 ASP A 99 -1.490 10.426 -0.563 1.00 0.00 O ATOM 0 H ASP A 99 0.746 12.711 -3.126 1.00 0.00 H new ATOM 0 HA ASP A 99 -1.708 14.316 -2.720 1.00 0.00 H new ATOM 0 HB2 ASP A 99 -2.641 12.542 -1.398 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -2.164 11.843 -2.933 1.00 0.00 H new ATOM 1627 N PRO A 100 0.020 15.404 -1.137 1.00 0.00 N ATOM 1628 CA PRO A 100 0.687 16.074 -0.017 1.00 0.00 C ATOM 1629 C PRO A 100 -0.234 16.242 1.188 1.00 0.00 C ATOM 1630 O PRO A 100 0.164 16.796 2.212 1.00 0.00 O ATOM 1631 CB PRO A 100 1.068 17.439 -0.594 1.00 0.00 C ATOM 1632 CG PRO A 100 0.089 17.673 -1.692 1.00 0.00 C ATOM 1633 CD PRO A 100 -0.219 16.318 -2.268 1.00 0.00 C ATOM 0 HA PRO A 100 1.538 15.501 0.352 1.00 0.00 H new ATOM 0 HB2 PRO A 100 1.007 18.220 0.164 1.00 0.00 H new ATOM 0 HB3 PRO A 100 2.091 17.438 -0.969 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -0.815 18.151 -1.314 1.00 0.00 H new ATOM 0 HG3 PRO A 100 0.505 18.335 -2.452 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -1.248 16.257 -2.624 1.00 0.00 H new ATOM 0 HD3 PRO A 100 0.426 16.086 -3.116 1.00 0.00 H new ATOM 1641 N ASN A 101 -1.466 15.761 1.058 1.00 0.00 N ATOM 1642 CA ASN A 101 -2.443 15.858 2.136 1.00 0.00 C ATOM 1643 C ASN A 101 -2.525 14.550 2.916 1.00 0.00 C ATOM 1644 O ASN A 101 -2.682 14.551 4.136 1.00 0.00 O ATOM 1645 CB ASN A 101 -3.819 16.218 1.574 1.00 0.00 C ATOM 1646 CG ASN A 101 -3.878 17.640 1.052 1.00 0.00 C ATOM 1647 OD1 ASN A 101 -3.463 18.579 1.730 1.00 0.00 O ATOM 1648 ND2 ASN A 101 -4.393 17.804 -0.161 1.00 0.00 N ATOM 0 H ASN A 101 -1.812 15.300 0.216 1.00 0.00 H new ATOM 0 HA ASN A 101 -2.119 16.645 2.817 1.00 0.00 H new ATOM 0 HB2 ASN A 101 -4.071 15.528 0.769 1.00 0.00 H new ATOM 0 HB3 ASN A 101 -4.571 16.088 2.352 1.00 0.00 H new ATOM 0 HD21 ASN A 101 -4.457 18.738 -0.566 1.00 0.00 H new ATOM 0 HD22 ASN A 101 -4.725 16.996 -0.688 1.00 0.00 H new ATOM 1655 N ASN A 102 -2.419 13.434 2.202 1.00 0.00 N ATOM 1656 CA ASN A 102 -2.481 12.118 2.827 1.00 0.00 C ATOM 1657 C ASN A 102 -3.835 11.896 3.492 1.00 0.00 C ATOM 1658 O ASN A 102 -3.909 11.528 4.665 1.00 0.00 O ATOM 1659 CB ASN A 102 -1.361 11.967 3.859 1.00 0.00 C ATOM 1660 CG ASN A 102 -0.043 12.535 3.370 1.00 0.00 C ATOM 1661 OD1 ASN A 102 0.722 11.858 2.685 1.00 0.00 O ATOM 1662 ND2 ASN A 102 0.227 13.788 3.722 1.00 0.00 N ATOM 0 H ASN A 102 -2.290 13.415 1.190 1.00 0.00 H new ATOM 0 HA ASN A 102 -2.351 11.366 2.048 1.00 0.00 H new ATOM 0 HB2 ASN A 102 -1.650 12.471 4.781 1.00 0.00 H new ATOM 0 HB3 ASN A 102 -1.232 10.912 4.099 1.00 0.00 H new ATOM 0 HD21 ASN A 102 1.098 14.225 3.423 1.00 0.00 H new ATOM 0 HD22 ASN A 102 -0.437 14.312 4.291 1.00 0.00 H new ATOM 1669 N VAL A 103 -4.905 12.119 2.736 1.00 0.00 N ATOM 1670 CA VAL A 103 -6.256 11.941 3.251 1.00 0.00 C ATOM 1671 C VAL A 103 -6.944 10.749 2.594 1.00 0.00 C ATOM 1672 O VAL A 103 -7.972 10.272 3.073 1.00 0.00 O ATOM 1673 CB VAL A 103 -7.114 13.201 3.025 1.00 0.00 C ATOM 1674 CG1 VAL A 103 -8.557 12.946 3.431 1.00 0.00 C ATOM 1675 CG2 VAL A 103 -6.536 14.383 3.791 1.00 0.00 C ATOM 0 H VAL A 103 -4.862 12.424 1.764 1.00 0.00 H new ATOM 0 HA VAL A 103 -6.163 11.759 4.322 1.00 0.00 H new ATOM 0 HB VAL A 103 -7.099 13.443 1.962 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -9.147 13.847 3.264 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -8.964 12.130 2.834 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -8.596 12.677 4.487 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -7.154 15.264 3.620 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -6.519 14.153 4.856 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -5.521 14.579 3.446 1.00 0.00 H new ATOM 1685 N ILE A 104 -6.366 10.272 1.497 1.00 0.00 N ATOM 1686 CA ILE A 104 -6.921 9.133 0.775 1.00 0.00 C ATOM 1687 C ILE A 104 -6.458 7.816 1.388 1.00 0.00 C ATOM 1688 O ILE A 104 -7.274 6.976 1.770 1.00 0.00 O ATOM 1689 CB ILE A 104 -6.526 9.163 -0.713 1.00 0.00 C ATOM 1690 CG1 ILE A 104 -7.142 10.381 -1.403 1.00 0.00 C ATOM 1691 CG2 ILE A 104 -6.964 7.879 -1.402 1.00 0.00 C ATOM 1692 CD1 ILE A 104 -6.298 11.631 -1.289 1.00 0.00 C ATOM 0 H ILE A 104 -5.514 10.656 1.089 1.00 0.00 H new ATOM 0 HA ILE A 104 -8.006 9.206 0.855 1.00 0.00 H new ATOM 0 HB ILE A 104 -5.441 9.240 -0.784 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -7.297 10.152 -2.457 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -8.124 10.575 -0.972 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -6.678 7.914 -2.453 1.00 0.00 H new ATOM 0 HG22 ILE A 104 -6.482 7.027 -0.923 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -8.046 7.775 -1.324 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -6.796 12.454 -1.801 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -6.164 11.885 -0.238 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -5.324 11.455 -1.746 1.00 0.00 H new ATOM 1704 N ILE A 105 -5.144 7.643 1.480 1.00 0.00 N ATOM 1705 CA ILE A 105 -4.572 6.428 2.049 1.00 0.00 C ATOM 1706 C ILE A 105 -5.265 6.054 3.354 1.00 0.00 C ATOM 1707 O ILE A 105 -5.309 4.884 3.731 1.00 0.00 O ATOM 1708 CB ILE A 105 -3.062 6.585 2.308 1.00 0.00 C ATOM 1709 CG1 ILE A 105 -2.813 7.658 3.370 1.00 0.00 C ATOM 1710 CG2 ILE A 105 -2.337 6.931 1.016 1.00 0.00 C ATOM 1711 CD1 ILE A 105 -2.813 7.121 4.783 1.00 0.00 C ATOM 0 H ILE A 105 -4.455 8.328 1.168 1.00 0.00 H new ATOM 0 HA ILE A 105 -4.726 5.634 1.319 1.00 0.00 H new ATOM 0 HB ILE A 105 -2.671 5.637 2.679 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -1.854 8.138 3.172 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -3.579 8.429 3.283 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -1.271 7.039 1.215 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -2.492 6.135 0.288 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -2.729 7.867 0.619 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -2.631 7.937 5.482 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -3.780 6.667 5.000 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -2.029 6.371 4.887 1.00 0.00 H new ATOM 1723 N GLU A 106 -5.805 7.056 4.040 1.00 0.00 N ATOM 1724 CA GLU A 106 -6.497 6.832 5.304 1.00 0.00 C ATOM 1725 C GLU A 106 -7.928 6.362 5.064 1.00 0.00 C ATOM 1726 O GLU A 106 -8.815 7.163 4.766 1.00 0.00 O ATOM 1727 CB GLU A 106 -6.502 8.111 6.143 1.00 0.00 C ATOM 1728 CG GLU A 106 -7.358 8.014 7.395 1.00 0.00 C ATOM 1729 CD GLU A 106 -6.579 7.511 8.595 1.00 0.00 C ATOM 1730 OE1 GLU A 106 -5.917 8.332 9.262 1.00 0.00 O ATOM 1731 OE2 GLU A 106 -6.633 6.293 8.868 1.00 0.00 O ATOM 0 H GLU A 106 -5.777 8.031 3.742 1.00 0.00 H new ATOM 0 HA GLU A 106 -5.963 6.053 5.848 1.00 0.00 H new ATOM 0 HB2 GLU A 106 -5.478 8.351 6.431 1.00 0.00 H new ATOM 0 HB3 GLU A 106 -6.863 8.937 5.529 1.00 0.00 H new ATOM 0 HG2 GLU A 106 -7.776 8.995 7.622 1.00 0.00 H new ATOM 0 HG3 GLU A 106 -8.198 7.346 7.206 1.00 0.00 H new ATOM 1738 N SER A 107 -8.148 5.057 5.197 1.00 0.00 N ATOM 1739 CA SER A 107 -9.471 4.480 4.991 1.00 0.00 C ATOM 1740 C SER A 107 -10.463 5.012 6.020 1.00 0.00 C ATOM 1741 O SER A 107 -10.077 5.656 6.995 1.00 0.00 O ATOM 1742 CB SER A 107 -9.402 2.953 5.074 1.00 0.00 C ATOM 1743 OG SER A 107 -8.886 2.400 3.875 1.00 0.00 O ATOM 0 H SER A 107 -7.427 4.380 5.446 1.00 0.00 H new ATOM 0 HA SER A 107 -9.816 4.769 3.998 1.00 0.00 H new ATOM 0 HB2 SER A 107 -8.773 2.659 5.914 1.00 0.00 H new ATOM 0 HB3 SER A 107 -10.397 2.551 5.265 1.00 0.00 H new ATOM 0 HG SER A 107 -8.850 1.424 3.954 1.00 0.00 H new ATOM 1749 N GLY A 108 -11.743 4.738 5.795 1.00 0.00 N ATOM 1750 CA GLY A 108 -12.772 5.196 6.711 1.00 0.00 C ATOM 1751 C GLY A 108 -12.705 6.690 6.958 1.00 0.00 C ATOM 1752 O GLY A 108 -12.107 7.153 7.928 1.00 0.00 O ATOM 0 H GLY A 108 -12.087 4.207 4.995 1.00 0.00 H new ATOM 0 HA2 GLY A 108 -13.752 4.941 6.308 1.00 0.00 H new ATOM 0 HA3 GLY A 108 -12.670 4.669 7.660 1.00 0.00 H new ATOM 1756 N PRO A 109 -13.328 7.471 6.063 1.00 0.00 N ATOM 1757 CA PRO A 109 -13.350 8.933 6.167 1.00 0.00 C ATOM 1758 C PRO A 109 -14.204 9.419 7.332 1.00 0.00 C ATOM 1759 O PRO A 109 -15.226 8.816 7.659 1.00 0.00 O ATOM 1760 CB PRO A 109 -13.962 9.374 4.835 1.00 0.00 C ATOM 1761 CG PRO A 109 -14.782 8.212 4.391 1.00 0.00 C ATOM 1762 CD PRO A 109 -14.062 6.986 4.881 1.00 0.00 C ATOM 0 HA PRO A 109 -12.357 9.343 6.353 1.00 0.00 H new ATOM 0 HB2 PRO A 109 -14.575 10.267 4.957 1.00 0.00 H new ATOM 0 HB3 PRO A 109 -13.189 9.615 4.105 1.00 0.00 H new ATOM 0 HG2 PRO A 109 -15.789 8.264 4.804 1.00 0.00 H new ATOM 0 HG3 PRO A 109 -14.883 8.198 3.306 1.00 0.00 H new ATOM 0 HD2 PRO A 109 -14.758 6.188 5.140 1.00 0.00 H new ATOM 0 HD3 PRO A 109 -13.387 6.587 4.124 1.00 0.00 H new ATOM 1770 N SER A 110 -13.778 10.513 7.957 1.00 0.00 N ATOM 1771 CA SER A 110 -14.503 11.078 9.089 1.00 0.00 C ATOM 1772 C SER A 110 -15.962 11.335 8.726 1.00 0.00 C ATOM 1773 O SER A 110 -16.296 11.545 7.560 1.00 0.00 O ATOM 1774 CB SER A 110 -13.842 12.379 9.546 1.00 0.00 C ATOM 1775 OG SER A 110 -12.586 12.129 10.150 1.00 0.00 O ATOM 0 H SER A 110 -12.935 11.025 7.698 1.00 0.00 H new ATOM 0 HA SER A 110 -14.472 10.357 9.906 1.00 0.00 H new ATOM 0 HB2 SER A 110 -13.712 13.044 8.692 1.00 0.00 H new ATOM 0 HB3 SER A 110 -14.493 12.892 10.253 1.00 0.00 H new ATOM 0 HG SER A 110 -12.184 12.977 10.432 1.00 0.00 H new ATOM 1781 N SER A 111 -16.827 11.316 9.734 1.00 0.00 N ATOM 1782 CA SER A 111 -18.253 11.543 9.522 1.00 0.00 C ATOM 1783 C SER A 111 -18.741 12.734 10.341 1.00 0.00 C ATOM 1784 O SER A 111 -18.504 12.812 11.547 1.00 0.00 O ATOM 1785 CB SER A 111 -19.051 10.292 9.895 1.00 0.00 C ATOM 1786 OG SER A 111 -18.899 9.981 11.269 1.00 0.00 O ATOM 0 H SER A 111 -16.567 11.146 10.705 1.00 0.00 H new ATOM 0 HA SER A 111 -18.408 11.763 8.466 1.00 0.00 H new ATOM 0 HB2 SER A 111 -20.106 10.449 9.669 1.00 0.00 H new ATOM 0 HB3 SER A 111 -18.717 9.450 9.289 1.00 0.00 H new ATOM 0 HG SER A 111 -18.614 10.782 11.756 1.00 0.00 H new ATOM 1792 N GLY A 112 -19.424 13.661 9.677 1.00 0.00 N ATOM 1793 CA GLY A 112 -19.935 14.837 10.358 1.00 0.00 C ATOM 1794 C GLY A 112 -21.234 14.564 11.091 1.00 0.00 C ATOM 1795 O GLY A 112 -21.978 15.489 11.415 1.00 0.00 O ATOM 0 H GLY A 112 -19.633 13.619 8.679 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -19.189 15.195 11.068 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -20.092 15.634 9.631 1.00 0.00 H new TER 1799 GLY A 112