USER MOD reduce.3.24.130724 H: found=0, std=0, add=908, rem=0, adj=30 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 70 LYS NZ :NH3+ 151:sc= -4.59! (180deg=-6.2!) USER MOD Set 1.2: A 102 ASN : amide:sc= -0.683 X(o=-5.3,f=-4.9) USER MOD Set 2.1: A 48 HIS : no HD1:sc= 0.213 K(o=0.37,f=-7.1!) USER MOD Set 2.2: A 86 SER OG : rot -121:sc= 0.161 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 2 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 8 THR OG1 : rot 38:sc= 0.515 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= -0.171 USER MOD Single : A -6 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 16 TYR OH : rot 180:sc= 0 USER MOD Single : A 17 THR OG1 : rot -140:sc= -1.44 USER MOD Single : A 20 GLN : amide:sc= -3.74! X(o=-3.7!,f=-3.3) USER MOD Single : A 25 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 27 THR OG1 : rot 135:sc= -0.0886 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 -3:sc= -0.843 USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 GLN : amide:sc= -0.351 X(o=-0.35,f=-0.81) USER MOD Single : A 45 HIS : no HD1:sc= -1.86! C(o=-1.9!,f=-3.4!) USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 MET CE :methyl 161:sc= -0.0334 (180deg=-0.602) 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 USER MOD Single : A 66 LYS NZ :NH3+ -114:sc= 0 (180deg=-0.166) USER MOD Single : A 76 MET CE :methyl 175:sc= 0 (180deg=-0.0233) USER MOD Single : A 77 LYS NZ :NH3+ 160:sc= -0.0301 (180deg=-0.264) USER MOD Single : A 78 ASN : amide:sc= 0.0216 K(o=0.022,f=-2.1!) USER MOD Single : A 82 LYS NZ :NH3+ 151:sc= -0.0102 (180deg=-0.387) USER MOD Single : A 84 SER OG : rot -176:sc= -0.489 USER MOD Single : A 87 MET CE :methyl -113:sc= -2.13 (180deg=-5.87!) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 ASN : amide:sc= -0.293 K(o=-0.29,f=-6!) USER MOD Single : A 92 GLN : amide:sc= -1.75 K(o=-1.8,f=-6.8!) USER MOD Single : A 94 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0479) USER MOD Single : A 101 ASN : amide:sc= -0.705 K(o=-0.71,f=-7.6!) 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 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -6 -10.390 -4.839 39.584 1.00 0.00 N ATOM 2 CA GLY A -6 -8.963 -4.914 39.335 1.00 0.00 C ATOM 3 C GLY A -6 -8.638 -5.062 37.862 1.00 0.00 C ATOM 4 O GLY A -6 -9.214 -4.374 37.019 1.00 0.00 O ATOM 0 H1 GLY A -6 -10.559 -4.738 40.605 1.00 0.00 H new ATOM 0 H2 GLY A -6 -10.787 -4.018 39.085 1.00 0.00 H new ATOM 0 H3 GLY A -6 -10.848 -5.707 39.241 1.00 0.00 H new ATOM 0 HA2 GLY A -6 -8.482 -4.015 39.721 1.00 0.00 H new ATOM 0 HA3 GLY A -6 -8.546 -5.759 39.883 1.00 0.00 H new ATOM 8 N SER A -5 -7.711 -5.963 37.550 1.00 0.00 N ATOM 9 CA SER A -5 -7.306 -6.197 36.169 1.00 0.00 C ATOM 10 C SER A -5 -7.201 -4.881 35.404 1.00 0.00 C ATOM 11 O SER A -5 -7.634 -4.781 34.256 1.00 0.00 O ATOM 12 CB SER A -5 -8.302 -7.126 35.473 1.00 0.00 C ATOM 13 OG SER A -5 -9.596 -6.549 35.434 1.00 0.00 O ATOM 0 H SER A -5 -7.227 -6.543 38.235 1.00 0.00 H new ATOM 0 HA SER A -5 -6.325 -6.671 36.180 1.00 0.00 H new ATOM 0 HB2 SER A -5 -7.962 -7.334 34.458 1.00 0.00 H new ATOM 0 HB3 SER A -5 -8.342 -8.081 35.998 1.00 0.00 H new ATOM 0 HG SER A -5 -10.214 -7.162 34.983 1.00 0.00 H new ATOM 19 N SER A -4 -6.623 -3.872 36.050 1.00 0.00 N ATOM 20 CA SER A -4 -6.464 -2.561 35.434 1.00 0.00 C ATOM 21 C SER A -4 -5.003 -2.123 35.457 1.00 0.00 C ATOM 22 O SER A -4 -4.217 -2.588 36.281 1.00 0.00 O ATOM 23 CB SER A -4 -7.330 -1.526 36.155 1.00 0.00 C ATOM 24 OG SER A -4 -6.880 -1.322 37.483 1.00 0.00 O ATOM 0 H SER A -4 -6.257 -3.939 37.000 1.00 0.00 H new ATOM 0 HA SER A -4 -6.787 -2.634 34.395 1.00 0.00 H new ATOM 0 HB2 SER A -4 -7.304 -0.582 35.610 1.00 0.00 H new ATOM 0 HB3 SER A -4 -8.368 -1.860 36.166 1.00 0.00 H new ATOM 0 HG SER A -4 -7.448 -0.655 37.922 1.00 0.00 H new ATOM 30 N GLY A -3 -4.647 -1.224 34.544 1.00 0.00 N ATOM 31 CA GLY A -3 -3.281 -0.738 34.476 1.00 0.00 C ATOM 32 C GLY A -3 -3.204 0.721 34.070 1.00 0.00 C ATOM 33 O GLY A -3 -3.411 1.612 34.893 1.00 0.00 O ATOM 0 H GLY A -3 -5.280 -0.824 33.851 1.00 0.00 H new ATOM 0 HA2 GLY A -3 -2.804 -0.867 35.447 1.00 0.00 H new ATOM 0 HA3 GLY A -3 -2.719 -1.341 33.762 1.00 0.00 H new ATOM 37 N SER A -2 -2.904 0.965 32.799 1.00 0.00 N ATOM 38 CA SER A -2 -2.795 2.326 32.287 1.00 0.00 C ATOM 39 C SER A -2 -1.771 3.126 33.085 1.00 0.00 C ATOM 40 O SER A -2 -1.990 4.295 33.404 1.00 0.00 O ATOM 41 CB SER A -2 -4.156 3.024 32.338 1.00 0.00 C ATOM 42 OG SER A -2 -4.928 2.723 31.189 1.00 0.00 O ATOM 0 H SER A -2 -2.732 0.238 32.104 1.00 0.00 H new ATOM 0 HA SER A -2 -2.461 2.272 31.251 1.00 0.00 H new ATOM 0 HB2 SER A -2 -4.694 2.713 33.233 1.00 0.00 H new ATOM 0 HB3 SER A -2 -4.013 4.102 32.411 1.00 0.00 H new ATOM 0 HG SER A -2 -5.793 3.180 31.247 1.00 0.00 H new ATOM 48 N SER A -1 -0.650 2.487 33.404 1.00 0.00 N ATOM 49 CA SER A -1 0.409 3.137 34.168 1.00 0.00 C ATOM 50 C SER A -1 1.767 2.928 33.502 1.00 0.00 C ATOM 51 O SER A -1 2.278 1.811 33.446 1.00 0.00 O ATOM 52 CB SER A -1 0.442 2.594 35.598 1.00 0.00 C ATOM 53 OG SER A -1 1.465 3.214 36.356 1.00 0.00 O ATOM 0 H SER A -1 -0.452 1.520 33.146 1.00 0.00 H new ATOM 0 HA SER A -1 0.198 4.206 34.197 1.00 0.00 H new ATOM 0 HB2 SER A -1 -0.523 2.763 36.077 1.00 0.00 H new ATOM 0 HB3 SER A -1 0.603 1.516 35.577 1.00 0.00 H new ATOM 0 HG SER A -1 1.464 2.851 37.266 1.00 0.00 H new ATOM 59 N GLY A 0 2.345 4.015 32.998 1.00 0.00 N ATOM 60 CA GLY A 0 3.636 3.931 32.342 1.00 0.00 C ATOM 61 C GLY A 0 3.874 5.078 31.381 1.00 0.00 C ATOM 62 O GLY A 0 2.946 5.547 30.723 1.00 0.00 O ATOM 0 H GLY A 0 1.942 4.951 33.033 1.00 0.00 H new ATOM 0 HA2 GLY A 0 4.423 3.924 33.096 1.00 0.00 H new ATOM 0 HA3 GLY A 0 3.704 2.987 31.801 1.00 0.00 H new ATOM 66 N MET A 1 5.120 5.532 31.299 1.00 0.00 N ATOM 67 CA MET A 1 5.476 6.631 30.411 1.00 0.00 C ATOM 68 C MET A 1 6.767 6.327 29.657 1.00 0.00 C ATOM 69 O MET A 1 7.398 5.296 29.884 1.00 0.00 O ATOM 70 CB MET A 1 5.631 7.929 31.206 1.00 0.00 C ATOM 71 CG MET A 1 6.738 7.876 32.246 1.00 0.00 C ATOM 72 SD MET A 1 6.199 7.129 33.797 1.00 0.00 S ATOM 73 CE MET A 1 5.551 8.562 34.655 1.00 0.00 C ATOM 0 H MET A 1 5.900 5.155 31.837 1.00 0.00 H new ATOM 0 HA MET A 1 4.672 6.751 29.685 1.00 0.00 H new ATOM 0 HB2 MET A 1 5.832 8.747 30.514 1.00 0.00 H new ATOM 0 HB3 MET A 1 4.688 8.156 31.703 1.00 0.00 H new ATOM 0 HG2 MET A 1 7.579 7.309 31.847 1.00 0.00 H new ATOM 0 HG3 MET A 1 7.098 8.886 32.440 1.00 0.00 H new ATOM 0 HE1 MET A 1 5.178 8.262 35.634 1.00 0.00 H new ATOM 0 HE2 MET A 1 6.343 9.301 34.779 1.00 0.00 H new ATOM 0 HE3 MET A 1 4.737 8.996 34.074 1.00 0.00 H new ATOM 83 N ASN A 2 7.151 7.229 28.761 1.00 0.00 N ATOM 84 CA ASN A 2 8.367 7.056 27.973 1.00 0.00 C ATOM 85 C ASN A 2 8.989 8.405 27.629 1.00 0.00 C ATOM 86 O ASN A 2 8.299 9.324 27.190 1.00 0.00 O ATOM 87 CB ASN A 2 8.061 6.279 26.692 1.00 0.00 C ATOM 88 CG ASN A 2 9.266 6.177 25.776 1.00 0.00 C ATOM 89 OD1 ASN A 2 9.349 6.867 24.760 1.00 0.00 O ATOM 90 ND2 ASN A 2 10.209 5.312 26.133 1.00 0.00 N ATOM 0 H ASN A 2 6.638 8.088 28.562 1.00 0.00 H new ATOM 0 HA ASN A 2 9.082 6.490 28.571 1.00 0.00 H new ATOM 0 HB2 ASN A 2 7.719 5.277 26.951 1.00 0.00 H new ATOM 0 HB3 ASN A 2 7.244 6.767 26.160 1.00 0.00 H new ATOM 0 HD21 ASN A 2 11.043 5.200 25.556 1.00 0.00 H new ATOM 0 HD22 ASN A 2 10.099 4.760 26.984 1.00 0.00 H new ATOM 97 N SER A 3 10.299 8.515 27.829 1.00 0.00 N ATOM 98 CA SER A 3 11.014 9.752 27.543 1.00 0.00 C ATOM 99 C SER A 3 12.243 9.482 26.680 1.00 0.00 C ATOM 100 O SER A 3 13.233 8.921 27.148 1.00 0.00 O ATOM 101 CB SER A 3 11.433 10.438 28.845 1.00 0.00 C ATOM 102 OG SER A 3 11.855 11.769 28.607 1.00 0.00 O ATOM 0 H SER A 3 10.886 7.762 28.188 1.00 0.00 H new ATOM 0 HA SER A 3 10.342 10.411 26.993 1.00 0.00 H new ATOM 0 HB2 SER A 3 10.598 10.438 29.545 1.00 0.00 H new ATOM 0 HB3 SER A 3 12.241 9.875 29.313 1.00 0.00 H new ATOM 0 HG SER A 3 12.116 12.186 29.455 1.00 0.00 H new ATOM 108 N GLY A 4 12.171 9.886 25.415 1.00 0.00 N ATOM 109 CA GLY A 4 13.282 9.678 24.505 1.00 0.00 C ATOM 110 C GLY A 4 12.827 9.334 23.101 1.00 0.00 C ATOM 111 O GLY A 4 11.666 8.982 22.887 1.00 0.00 O ATOM 0 H GLY A 4 11.363 10.354 25.004 1.00 0.00 H new ATOM 0 HA2 GLY A 4 13.895 10.579 24.474 1.00 0.00 H new ATOM 0 HA3 GLY A 4 13.913 8.875 24.886 1.00 0.00 H new ATOM 115 N ARG A 5 13.741 9.436 22.143 1.00 0.00 N ATOM 116 CA ARG A 5 13.426 9.135 20.751 1.00 0.00 C ATOM 117 C ARG A 5 13.173 7.642 20.561 1.00 0.00 C ATOM 118 O ARG A 5 13.733 6.800 21.262 1.00 0.00 O ATOM 119 CB ARG A 5 14.565 9.592 19.838 1.00 0.00 C ATOM 120 CG ARG A 5 14.455 11.045 19.407 1.00 0.00 C ATOM 121 CD ARG A 5 15.119 11.975 20.410 1.00 0.00 C ATOM 122 NE ARG A 5 14.201 12.384 21.468 1.00 0.00 N ATOM 123 CZ ARG A 5 14.570 13.095 22.528 1.00 0.00 C ATOM 124 NH1 ARG A 5 15.832 13.475 22.668 1.00 0.00 N ATOM 125 NH2 ARG A 5 13.675 13.429 23.449 1.00 0.00 N ATOM 0 H ARG A 5 14.706 9.725 22.304 1.00 0.00 H new ATOM 0 HA ARG A 5 12.518 9.676 20.485 1.00 0.00 H new ATOM 0 HB2 ARG A 5 15.514 9.446 20.354 1.00 0.00 H new ATOM 0 HB3 ARG A 5 14.584 8.959 18.951 1.00 0.00 H new ATOM 0 HG2 ARG A 5 14.919 11.172 18.429 1.00 0.00 H new ATOM 0 HG3 ARG A 5 13.405 11.315 19.299 1.00 0.00 H new ATOM 0 HD2 ARG A 5 15.981 11.476 20.852 1.00 0.00 H new ATOM 0 HD3 ARG A 5 15.493 12.859 19.893 1.00 0.00 H new ATOM 0 HE ARG A 5 13.222 12.109 21.389 1.00 0.00 H new ATOM 0 HH11 ARG A 5 16.522 13.222 21.961 1.00 0.00 H new ATOM 0 HH12 ARG A 5 16.113 14.021 23.483 1.00 0.00 H new ATOM 0 HH21 ARG A 5 12.703 13.140 23.344 1.00 0.00 H new ATOM 0 HH22 ARG A 5 13.960 13.975 24.262 1.00 0.00 H new ATOM 139 N PRO A 6 12.311 7.306 19.590 1.00 0.00 N ATOM 140 CA PRO A 6 11.965 5.915 19.286 1.00 0.00 C ATOM 141 C PRO A 6 13.125 5.155 18.652 1.00 0.00 C ATOM 142 O PRO A 6 13.855 5.698 17.823 1.00 0.00 O ATOM 143 CB PRO A 6 10.807 6.046 18.293 1.00 0.00 C ATOM 144 CG PRO A 6 11.003 7.380 17.656 1.00 0.00 C ATOM 145 CD PRO A 6 11.606 8.259 18.716 1.00 0.00 C ATOM 0 HA PRO A 6 11.713 5.352 20.185 1.00 0.00 H new ATOM 0 HB2 PRO A 6 10.828 5.247 17.552 1.00 0.00 H new ATOM 0 HB3 PRO A 6 9.843 5.986 18.799 1.00 0.00 H new ATOM 0 HG2 PRO A 6 11.660 7.306 16.790 1.00 0.00 H new ATOM 0 HG3 PRO A 6 10.055 7.787 17.303 1.00 0.00 H new ATOM 0 HD2 PRO A 6 12.289 8.993 18.288 1.00 0.00 H new ATOM 0 HD3 PRO A 6 10.842 8.814 19.260 1.00 0.00 H new ATOM 153 N GLU A 7 13.288 3.896 19.047 1.00 0.00 N ATOM 154 CA GLU A 7 14.361 3.063 18.518 1.00 0.00 C ATOM 155 C GLU A 7 13.840 2.139 17.419 1.00 0.00 C ATOM 156 O GLU A 7 12.844 1.439 17.601 1.00 0.00 O ATOM 157 CB GLU A 7 14.994 2.234 19.638 1.00 0.00 C ATOM 158 CG GLU A 7 15.982 3.015 20.488 1.00 0.00 C ATOM 159 CD GLU A 7 16.374 2.277 21.753 1.00 0.00 C ATOM 160 OE1 GLU A 7 15.473 1.730 22.423 1.00 0.00 O ATOM 161 OE2 GLU A 7 17.580 2.248 22.074 1.00 0.00 O ATOM 0 H GLU A 7 12.691 3.431 19.731 1.00 0.00 H new ATOM 0 HA GLU A 7 15.118 3.720 18.090 1.00 0.00 H new ATOM 0 HB2 GLU A 7 14.205 1.843 20.280 1.00 0.00 H new ATOM 0 HB3 GLU A 7 15.503 1.376 19.200 1.00 0.00 H new ATOM 0 HG2 GLU A 7 16.877 3.222 19.901 1.00 0.00 H new ATOM 0 HG3 GLU A 7 15.545 3.978 20.754 1.00 0.00 H new ATOM 168 N THR A 8 14.522 2.143 16.279 1.00 0.00 N ATOM 169 CA THR A 8 14.128 1.308 15.150 1.00 0.00 C ATOM 170 C THR A 8 15.267 0.390 14.722 1.00 0.00 C ATOM 171 O THR A 8 16.288 0.849 14.209 1.00 0.00 O ATOM 172 CB THR A 8 13.692 2.162 13.944 1.00 0.00 C ATOM 173 OG1 THR A 8 14.738 3.074 13.587 1.00 0.00 O ATOM 174 CG2 THR A 8 12.423 2.938 14.261 1.00 0.00 C ATOM 0 H THR A 8 15.350 2.715 16.112 1.00 0.00 H new ATOM 0 HA THR A 8 13.283 0.705 15.483 1.00 0.00 H new ATOM 0 HB THR A 8 13.491 1.494 13.107 1.00 0.00 H new ATOM 0 HG1 THR A 8 15.607 2.634 13.695 1.00 0.00 H new ATOM 0 HG21 THR A 8 12.135 3.533 13.395 1.00 0.00 H new ATOM 0 HG22 THR A 8 11.622 2.241 14.505 1.00 0.00 H new ATOM 0 HG23 THR A 8 12.602 3.597 15.111 1.00 0.00 H new ATOM 182 N MET A 9 15.086 -0.909 14.938 1.00 0.00 N ATOM 183 CA MET A 9 16.098 -1.892 14.572 1.00 0.00 C ATOM 184 C MET A 9 16.821 -1.479 13.294 1.00 0.00 C ATOM 185 O MET A 9 18.037 -1.294 13.290 1.00 0.00 O ATOM 186 CB MET A 9 15.460 -3.269 14.388 1.00 0.00 C ATOM 187 CG MET A 9 14.962 -3.887 15.685 1.00 0.00 C ATOM 188 SD MET A 9 16.275 -4.097 16.902 1.00 0.00 S ATOM 189 CE MET A 9 16.388 -5.883 16.974 1.00 0.00 C ATOM 0 H MET A 9 14.248 -1.305 15.364 1.00 0.00 H new ATOM 0 HA MET A 9 16.827 -1.943 15.381 1.00 0.00 H new ATOM 0 HB2 MET A 9 14.625 -3.184 13.692 1.00 0.00 H new ATOM 0 HB3 MET A 9 16.188 -3.940 13.932 1.00 0.00 H new ATOM 0 HG2 MET A 9 14.179 -3.257 16.106 1.00 0.00 H new ATOM 0 HG3 MET A 9 14.511 -4.856 15.472 1.00 0.00 H new ATOM 0 HE1 MET A 9 17.161 -6.170 17.687 1.00 0.00 H new ATOM 0 HE2 MET A 9 15.430 -6.296 17.291 1.00 0.00 H new ATOM 0 HE3 MET A 9 16.642 -6.272 15.988 1.00 0.00 H new ATOM 199 N GLU A 10 16.063 -1.337 12.211 1.00 0.00 N ATOM 200 CA GLU A 10 16.634 -0.948 10.926 1.00 0.00 C ATOM 201 C GLU A 10 16.551 0.564 10.731 1.00 0.00 C ATOM 202 O GLU A 10 16.097 1.291 11.614 1.00 0.00 O ATOM 203 CB GLU A 10 15.908 -1.660 9.783 1.00 0.00 C ATOM 204 CG GLU A 10 16.183 -3.153 9.725 1.00 0.00 C ATOM 205 CD GLU A 10 15.089 -3.921 9.009 1.00 0.00 C ATOM 206 OE1 GLU A 10 14.545 -3.393 8.017 1.00 0.00 O ATOM 207 OE2 GLU A 10 14.777 -5.050 9.441 1.00 0.00 O ATOM 0 H GLU A 10 15.054 -1.485 12.197 1.00 0.00 H new ATOM 0 HA GLU A 10 17.683 -1.243 10.919 1.00 0.00 H new ATOM 0 HB2 GLU A 10 14.835 -1.500 9.890 1.00 0.00 H new ATOM 0 HB3 GLU A 10 16.205 -1.207 8.837 1.00 0.00 H new ATOM 0 HG2 GLU A 10 17.133 -3.324 9.218 1.00 0.00 H new ATOM 0 HG3 GLU A 10 16.288 -3.539 10.739 1.00 0.00 H new ATOM 214 N ASN A 11 16.996 1.029 9.568 1.00 0.00 N ATOM 215 CA ASN A 11 16.973 2.454 9.256 1.00 0.00 C ATOM 216 C ASN A 11 15.858 2.777 8.265 1.00 0.00 C ATOM 217 O ASN A 11 16.037 3.589 7.357 1.00 0.00 O ATOM 218 CB ASN A 11 18.323 2.893 8.683 1.00 0.00 C ATOM 219 CG ASN A 11 19.331 3.222 9.767 1.00 0.00 C ATOM 220 OD1 ASN A 11 19.456 4.374 10.184 1.00 0.00 O ATOM 221 ND2 ASN A 11 20.056 2.210 10.229 1.00 0.00 N ATOM 0 H ASN A 11 17.377 0.441 8.827 1.00 0.00 H new ATOM 0 HA ASN A 11 16.782 3.000 10.180 1.00 0.00 H new ATOM 0 HB2 ASN A 11 18.721 2.100 8.049 1.00 0.00 H new ATOM 0 HB3 ASN A 11 18.178 3.767 8.048 1.00 0.00 H new ATOM 0 HD21 ASN A 11 20.750 2.371 10.959 1.00 0.00 H new ATOM 0 HD22 ASN A 11 19.919 1.271 9.854 1.00 0.00 H new ATOM 228 N LEU A 12 14.709 2.137 8.448 1.00 0.00 N ATOM 229 CA LEU A 12 13.564 2.357 7.571 1.00 0.00 C ATOM 230 C LEU A 12 13.201 3.836 7.510 1.00 0.00 C ATOM 231 O LEU A 12 13.496 4.612 8.419 1.00 0.00 O ATOM 232 CB LEU A 12 12.362 1.544 8.056 1.00 0.00 C ATOM 233 CG LEU A 12 12.421 0.038 7.798 1.00 0.00 C ATOM 234 CD1 LEU A 12 11.409 -0.692 8.666 1.00 0.00 C ATOM 235 CD2 LEU A 12 12.180 -0.261 6.326 1.00 0.00 C ATOM 0 H LEU A 12 14.545 1.462 9.195 1.00 0.00 H new ATOM 0 HA LEU A 12 13.837 2.028 6.568 1.00 0.00 H new ATOM 0 HB2 LEU A 12 12.249 1.704 9.128 1.00 0.00 H new ATOM 0 HB3 LEU A 12 11.465 1.939 7.579 1.00 0.00 H new ATOM 0 HG LEU A 12 13.417 -0.318 8.061 1.00 0.00 H new ATOM 0 HD11 LEU A 12 11.465 -1.763 8.469 1.00 0.00 H new ATOM 0 HD12 LEU A 12 11.629 -0.505 9.717 1.00 0.00 H new ATOM 0 HD13 LEU A 12 10.406 -0.333 8.436 1.00 0.00 H new ATOM 0 HD21 LEU A 12 12.226 -1.337 6.161 1.00 0.00 H new ATOM 0 HD22 LEU A 12 11.197 0.109 6.036 1.00 0.00 H new ATOM 0 HD23 LEU A 12 12.945 0.231 5.725 1.00 0.00 H new ATOM 247 N PRO A 13 12.541 4.239 6.413 1.00 0.00 N ATOM 248 CA PRO A 13 12.120 5.629 6.208 1.00 0.00 C ATOM 249 C PRO A 13 10.997 6.039 7.154 1.00 0.00 C ATOM 250 O PRO A 13 10.440 5.207 7.869 1.00 0.00 O ATOM 251 CB PRO A 13 11.630 5.640 4.758 1.00 0.00 C ATOM 252 CG PRO A 13 11.225 4.233 4.484 1.00 0.00 C ATOM 253 CD PRO A 13 12.155 3.370 5.289 1.00 0.00 C ATOM 0 HA PRO A 13 12.928 6.334 6.404 1.00 0.00 H new ATOM 0 HB2 PRO A 13 10.792 6.325 4.628 1.00 0.00 H new ATOM 0 HB3 PRO A 13 12.416 5.965 4.077 1.00 0.00 H new ATOM 0 HG2 PRO A 13 10.188 4.063 4.772 1.00 0.00 H new ATOM 0 HG3 PRO A 13 11.303 4.005 3.421 1.00 0.00 H new ATOM 0 HD2 PRO A 13 11.662 2.462 5.635 1.00 0.00 H new ATOM 0 HD3 PRO A 13 13.022 3.060 4.705 1.00 0.00 H new ATOM 261 N ALA A 14 10.669 7.327 7.152 1.00 0.00 N ATOM 262 CA ALA A 14 9.611 7.847 8.008 1.00 0.00 C ATOM 263 C ALA A 14 8.251 7.742 7.325 1.00 0.00 C ATOM 264 O ALA A 14 8.153 7.298 6.180 1.00 0.00 O ATOM 265 CB ALA A 14 9.902 9.291 8.388 1.00 0.00 C ATOM 0 H ALA A 14 11.121 8.029 6.567 1.00 0.00 H new ATOM 0 HA ALA A 14 9.581 7.243 8.915 1.00 0.00 H new ATOM 0 HB1 ALA A 14 9.103 9.667 9.028 1.00 0.00 H new ATOM 0 HB2 ALA A 14 10.850 9.342 8.923 1.00 0.00 H new ATOM 0 HB3 ALA A 14 9.961 9.900 7.486 1.00 0.00 H new ATOM 271 N LEU A 15 7.205 8.152 8.034 1.00 0.00 N ATOM 272 CA LEU A 15 5.849 8.102 7.496 1.00 0.00 C ATOM 273 C LEU A 15 5.686 9.087 6.342 1.00 0.00 C ATOM 274 O LEU A 15 6.377 10.104 6.278 1.00 0.00 O ATOM 275 CB LEU A 15 4.833 8.413 8.596 1.00 0.00 C ATOM 276 CG LEU A 15 3.397 7.957 8.330 1.00 0.00 C ATOM 277 CD1 LEU A 15 3.360 6.471 8.010 1.00 0.00 C ATOM 278 CD2 LEU A 15 2.508 8.271 9.524 1.00 0.00 C ATOM 0 H LEU A 15 7.269 8.523 8.982 1.00 0.00 H new ATOM 0 HA LEU A 15 5.669 7.096 7.118 1.00 0.00 H new ATOM 0 HB2 LEU A 15 5.175 7.949 9.521 1.00 0.00 H new ATOM 0 HB3 LEU A 15 4.826 9.490 8.763 1.00 0.00 H new ATOM 0 HG LEU A 15 3.016 8.503 7.467 1.00 0.00 H new ATOM 0 HD11 LEU A 15 2.331 6.164 7.824 1.00 0.00 H new ATOM 0 HD12 LEU A 15 3.963 6.275 7.124 1.00 0.00 H new ATOM 0 HD13 LEU A 15 3.760 5.907 8.853 1.00 0.00 H new ATOM 0 HD21 LEU A 15 1.490 7.940 9.317 1.00 0.00 H new ATOM 0 HD22 LEU A 15 2.886 7.753 10.405 1.00 0.00 H new ATOM 0 HD23 LEU A 15 2.510 9.346 9.706 1.00 0.00 H new ATOM 290 N TYR A 16 4.766 8.779 5.435 1.00 0.00 N ATOM 291 CA TYR A 16 4.510 9.637 4.284 1.00 0.00 C ATOM 292 C TYR A 16 5.807 9.959 3.548 1.00 0.00 C ATOM 293 O TYR A 16 5.924 10.999 2.896 1.00 0.00 O ATOM 294 CB TYR A 16 3.826 10.930 4.727 1.00 0.00 C ATOM 295 CG TYR A 16 2.514 10.707 5.443 1.00 0.00 C ATOM 296 CD1 TYR A 16 1.587 9.789 4.965 1.00 0.00 C ATOM 297 CD2 TYR A 16 2.199 11.415 6.597 1.00 0.00 C ATOM 298 CE1 TYR A 16 0.385 9.581 5.616 1.00 0.00 C ATOM 299 CE2 TYR A 16 1.002 11.214 7.255 1.00 0.00 C ATOM 300 CZ TYR A 16 0.098 10.296 6.760 1.00 0.00 C ATOM 301 OH TYR A 16 -1.097 10.093 7.411 1.00 0.00 O ATOM 0 H TYR A 16 4.185 7.942 5.474 1.00 0.00 H new ATOM 0 HA TYR A 16 3.849 9.101 3.602 1.00 0.00 H new ATOM 0 HB2 TYR A 16 4.499 11.481 5.384 1.00 0.00 H new ATOM 0 HB3 TYR A 16 3.651 11.556 3.852 1.00 0.00 H new ATOM 0 HD1 TYR A 16 1.809 9.228 4.069 1.00 0.00 H new ATOM 0 HD2 TYR A 16 2.903 12.135 6.986 1.00 0.00 H new ATOM 0 HE1 TYR A 16 -0.324 8.863 5.231 1.00 0.00 H new ATOM 0 HE2 TYR A 16 0.774 11.772 8.151 1.00 0.00 H new ATOM 0 HH TYR A 16 -1.143 10.674 8.199 1.00 0.00 H new ATOM 311 N THR A 17 6.781 9.061 3.655 1.00 0.00 N ATOM 312 CA THR A 17 8.070 9.249 3.001 1.00 0.00 C ATOM 313 C THR A 17 8.062 8.664 1.593 1.00 0.00 C ATOM 314 O THR A 17 7.502 7.592 1.359 1.00 0.00 O ATOM 315 CB THR A 17 9.209 8.600 3.808 1.00 0.00 C ATOM 316 OG1 THR A 17 9.299 9.204 5.103 1.00 0.00 O ATOM 317 CG2 THR A 17 10.537 8.744 3.082 1.00 0.00 C ATOM 0 H THR A 17 6.702 8.196 4.189 1.00 0.00 H new ATOM 0 HA THR A 17 8.242 10.324 2.944 1.00 0.00 H new ATOM 0 HB THR A 17 8.987 7.539 3.918 1.00 0.00 H new ATOM 0 HG1 THR A 17 10.242 9.316 5.347 1.00 0.00 H new ATOM 0 HG21 THR A 17 11.326 8.278 3.672 1.00 0.00 H new ATOM 0 HG22 THR A 17 10.475 8.256 2.109 1.00 0.00 H new ATOM 0 HG23 THR A 17 10.763 9.801 2.944 1.00 0.00 H new ATOM 325 N ILE A 18 8.688 9.372 0.660 1.00 0.00 N ATOM 326 CA ILE A 18 8.754 8.921 -0.724 1.00 0.00 C ATOM 327 C ILE A 18 10.157 8.441 -1.079 1.00 0.00 C ATOM 328 O ILE A 18 11.146 9.122 -0.806 1.00 0.00 O ATOM 329 CB ILE A 18 8.345 10.040 -1.701 1.00 0.00 C ATOM 330 CG1 ILE A 18 6.852 10.347 -1.563 1.00 0.00 C ATOM 331 CG2 ILE A 18 8.678 9.643 -3.132 1.00 0.00 C ATOM 332 CD1 ILE A 18 6.400 11.532 -2.386 1.00 0.00 C ATOM 0 H ILE A 18 9.157 10.260 0.837 1.00 0.00 H new ATOM 0 HA ILE A 18 8.053 8.092 -0.819 1.00 0.00 H new ATOM 0 HB ILE A 18 8.907 10.940 -1.454 1.00 0.00 H new ATOM 0 HG12 ILE A 18 6.280 9.469 -1.861 1.00 0.00 H new ATOM 0 HG13 ILE A 18 6.624 10.535 -0.514 1.00 0.00 H new ATOM 0 HG21 ILE A 18 8.383 10.444 -3.810 1.00 0.00 H new ATOM 0 HG22 ILE A 18 9.750 9.469 -3.221 1.00 0.00 H new ATOM 0 HG23 ILE A 18 8.140 8.731 -3.391 1.00 0.00 H new ATOM 0 HD11 ILE A 18 5.332 11.691 -2.239 1.00 0.00 H new ATOM 0 HD12 ILE A 18 6.946 12.422 -2.073 1.00 0.00 H new ATOM 0 HD13 ILE A 18 6.596 11.339 -3.441 1.00 0.00 H new ATOM 344 N PHE A 19 10.236 7.264 -1.691 1.00 0.00 N ATOM 345 CA PHE A 19 11.518 6.692 -2.085 1.00 0.00 C ATOM 346 C PHE A 19 11.367 5.827 -3.333 1.00 0.00 C ATOM 347 O PHE A 19 10.257 5.461 -3.716 1.00 0.00 O ATOM 348 CB PHE A 19 12.102 5.858 -0.942 1.00 0.00 C ATOM 349 CG PHE A 19 11.096 4.962 -0.278 1.00 0.00 C ATOM 350 CD1 PHE A 19 10.753 3.745 -0.843 1.00 0.00 C ATOM 351 CD2 PHE A 19 10.491 5.339 0.911 1.00 0.00 C ATOM 352 CE1 PHE A 19 9.827 2.918 -0.235 1.00 0.00 C ATOM 353 CE2 PHE A 19 9.565 4.516 1.525 1.00 0.00 C ATOM 354 CZ PHE A 19 9.232 3.305 0.950 1.00 0.00 C ATOM 0 H PHE A 19 9.427 6.688 -1.925 1.00 0.00 H new ATOM 0 HA PHE A 19 12.199 7.513 -2.312 1.00 0.00 H new ATOM 0 HB2 PHE A 19 12.920 5.249 -1.328 1.00 0.00 H new ATOM 0 HB3 PHE A 19 12.528 6.528 -0.195 1.00 0.00 H new ATOM 0 HD1 PHE A 19 11.215 3.438 -1.770 1.00 0.00 H new ATOM 0 HD2 PHE A 19 10.746 6.286 1.363 1.00 0.00 H new ATOM 0 HE1 PHE A 19 9.569 1.971 -0.686 1.00 0.00 H new ATOM 0 HE2 PHE A 19 9.103 4.820 2.453 1.00 0.00 H new ATOM 0 HZ PHE A 19 8.507 2.661 1.426 1.00 0.00 H new ATOM 364 N GLN A 20 12.493 5.505 -3.962 1.00 0.00 N ATOM 365 CA GLN A 20 12.486 4.684 -5.168 1.00 0.00 C ATOM 366 C GLN A 20 12.874 3.245 -4.849 1.00 0.00 C ATOM 367 O GLN A 20 13.950 2.986 -4.310 1.00 0.00 O ATOM 368 CB GLN A 20 13.443 5.264 -6.210 1.00 0.00 C ATOM 369 CG GLN A 20 13.021 4.989 -7.644 1.00 0.00 C ATOM 370 CD GLN A 20 13.884 5.716 -8.657 1.00 0.00 C ATOM 371 OE1 GLN A 20 15.010 6.113 -8.358 1.00 0.00 O ATOM 372 NE2 GLN A 20 13.359 5.893 -9.863 1.00 0.00 N ATOM 0 H GLN A 20 13.421 5.800 -3.657 1.00 0.00 H new ATOM 0 HA GLN A 20 11.474 4.686 -5.573 1.00 0.00 H new ATOM 0 HB2 GLN A 20 13.518 6.341 -6.062 1.00 0.00 H new ATOM 0 HB3 GLN A 20 14.438 4.850 -6.047 1.00 0.00 H new ATOM 0 HG2 GLN A 20 13.070 3.917 -7.834 1.00 0.00 H new ATOM 0 HG3 GLN A 20 11.981 5.289 -7.776 1.00 0.00 H new ATOM 0 HE21 GLN A 20 12.421 5.547 -10.067 1.00 0.00 H new ATOM 0 HE22 GLN A 20 13.893 6.375 -10.586 1.00 0.00 H new ATOM 381 N GLY A 21 11.991 2.310 -5.184 1.00 0.00 N ATOM 382 CA GLY A 21 12.260 0.907 -4.926 1.00 0.00 C ATOM 383 C GLY A 21 11.941 0.026 -6.117 1.00 0.00 C ATOM 384 O GLY A 21 11.229 0.441 -7.031 1.00 0.00 O ATOM 0 H GLY A 21 11.093 2.499 -5.630 1.00 0.00 H new ATOM 0 HA2 GLY A 21 13.310 0.785 -4.659 1.00 0.00 H new ATOM 0 HA3 GLY A 21 11.672 0.580 -4.068 1.00 0.00 H new ATOM 388 N GLU A 22 12.472 -1.193 -6.109 1.00 0.00 N ATOM 389 CA GLU A 22 12.242 -2.133 -7.199 1.00 0.00 C ATOM 390 C GLU A 22 11.326 -3.270 -6.753 1.00 0.00 C ATOM 391 O GLU A 22 11.403 -3.734 -5.616 1.00 0.00 O ATOM 392 CB GLU A 22 13.570 -2.702 -7.702 1.00 0.00 C ATOM 393 CG GLU A 22 13.410 -3.866 -8.663 1.00 0.00 C ATOM 394 CD GLU A 22 14.692 -4.656 -8.843 1.00 0.00 C ATOM 395 OE1 GLU A 22 15.628 -4.131 -9.480 1.00 0.00 O ATOM 396 OE2 GLU A 22 14.758 -5.800 -8.346 1.00 0.00 O ATOM 0 H GLU A 22 13.064 -1.552 -5.360 1.00 0.00 H new ATOM 0 HA GLU A 22 11.755 -1.594 -8.012 1.00 0.00 H new ATOM 0 HB2 GLU A 22 14.131 -1.909 -8.196 1.00 0.00 H new ATOM 0 HB3 GLU A 22 14.163 -3.027 -6.847 1.00 0.00 H new ATOM 0 HG2 GLU A 22 12.627 -4.530 -8.296 1.00 0.00 H new ATOM 0 HG3 GLU A 22 13.081 -3.490 -9.632 1.00 0.00 H new ATOM 403 N VAL A 23 10.458 -3.712 -7.659 1.00 0.00 N ATOM 404 CA VAL A 23 9.527 -4.794 -7.360 1.00 0.00 C ATOM 405 C VAL A 23 10.266 -6.108 -7.135 1.00 0.00 C ATOM 406 O VAL A 23 11.055 -6.541 -7.976 1.00 0.00 O ATOM 407 CB VAL A 23 8.503 -4.981 -8.494 1.00 0.00 C ATOM 408 CG1 VAL A 23 7.796 -6.321 -8.360 1.00 0.00 C ATOM 409 CG2 VAL A 23 7.499 -3.838 -8.499 1.00 0.00 C ATOM 0 H VAL A 23 10.381 -3.338 -8.605 1.00 0.00 H new ATOM 0 HA VAL A 23 9.000 -4.516 -6.447 1.00 0.00 H new ATOM 0 HB VAL A 23 9.035 -4.971 -9.445 1.00 0.00 H new ATOM 0 HG11 VAL A 23 7.076 -6.435 -9.170 1.00 0.00 H new ATOM 0 HG12 VAL A 23 8.529 -7.126 -8.410 1.00 0.00 H new ATOM 0 HG13 VAL A 23 7.275 -6.364 -7.403 1.00 0.00 H new ATOM 0 HG21 VAL A 23 6.783 -3.986 -9.307 1.00 0.00 H new ATOM 0 HG22 VAL A 23 6.971 -3.813 -7.546 1.00 0.00 H new ATOM 0 HG23 VAL A 23 8.023 -2.894 -8.648 1.00 0.00 H new ATOM 419 N ALA A 24 10.006 -6.740 -5.996 1.00 0.00 N ATOM 420 CA ALA A 24 10.645 -8.008 -5.662 1.00 0.00 C ATOM 421 C ALA A 24 9.637 -9.152 -5.681 1.00 0.00 C ATOM 422 O ALA A 24 10.005 -10.313 -5.855 1.00 0.00 O ATOM 423 CB ALA A 24 11.317 -7.916 -4.300 1.00 0.00 C ATOM 0 H ALA A 24 9.357 -6.395 -5.288 1.00 0.00 H new ATOM 0 HA ALA A 24 11.404 -8.215 -6.417 1.00 0.00 H new ATOM 0 HB1 ALA A 24 11.790 -8.869 -4.063 1.00 0.00 H new ATOM 0 HB2 ALA A 24 12.073 -7.131 -4.319 1.00 0.00 H new ATOM 0 HB3 ALA A 24 10.570 -7.683 -3.541 1.00 0.00 H new ATOM 429 N MET A 25 8.364 -8.816 -5.499 1.00 0.00 N ATOM 430 CA MET A 25 7.303 -9.817 -5.496 1.00 0.00 C ATOM 431 C MET A 25 6.011 -9.242 -6.070 1.00 0.00 C ATOM 432 O MET A 25 5.649 -8.100 -5.785 1.00 0.00 O ATOM 433 CB MET A 25 7.060 -10.330 -4.075 1.00 0.00 C ATOM 434 CG MET A 25 6.301 -11.645 -4.025 1.00 0.00 C ATOM 435 SD MET A 25 6.703 -12.624 -2.565 1.00 0.00 S ATOM 436 CE MET A 25 5.085 -13.253 -2.123 1.00 0.00 C ATOM 0 H MET A 25 8.042 -7.859 -5.352 1.00 0.00 H new ATOM 0 HA MET A 25 7.621 -10.649 -6.125 1.00 0.00 H new ATOM 0 HB2 MET A 25 8.020 -10.455 -3.574 1.00 0.00 H new ATOM 0 HB3 MET A 25 6.504 -9.577 -3.516 1.00 0.00 H new ATOM 0 HG2 MET A 25 5.230 -11.443 -4.038 1.00 0.00 H new ATOM 0 HG3 MET A 25 6.527 -12.225 -4.920 1.00 0.00 H new ATOM 0 HE1 MET A 25 5.168 -13.879 -1.235 1.00 0.00 H new ATOM 0 HE2 MET A 25 4.414 -12.419 -1.917 1.00 0.00 H new ATOM 0 HE3 MET A 25 4.687 -13.844 -2.948 1.00 0.00 H new ATOM 446 N VAL A 26 5.322 -10.041 -6.878 1.00 0.00 N ATOM 447 CA VAL A 26 4.071 -9.611 -7.490 1.00 0.00 C ATOM 448 C VAL A 26 2.923 -10.537 -7.105 1.00 0.00 C ATOM 449 O VAL A 26 2.988 -11.748 -7.318 1.00 0.00 O ATOM 450 CB VAL A 26 4.184 -9.565 -9.026 1.00 0.00 C ATOM 451 CG1 VAL A 26 2.834 -9.248 -9.652 1.00 0.00 C ATOM 452 CG2 VAL A 26 5.230 -8.547 -9.452 1.00 0.00 C ATOM 0 H VAL A 26 5.609 -10.989 -7.124 1.00 0.00 H new ATOM 0 HA VAL A 26 3.866 -8.608 -7.117 1.00 0.00 H new ATOM 0 HB VAL A 26 4.500 -10.547 -9.379 1.00 0.00 H new ATOM 0 HG11 VAL A 26 2.934 -9.220 -10.737 1.00 0.00 H new ATOM 0 HG12 VAL A 26 2.114 -10.018 -9.374 1.00 0.00 H new ATOM 0 HG13 VAL A 26 2.486 -8.279 -9.294 1.00 0.00 H new ATOM 0 HG21 VAL A 26 5.297 -8.527 -10.540 1.00 0.00 H new ATOM 0 HG22 VAL A 26 4.946 -7.560 -9.088 1.00 0.00 H new ATOM 0 HG23 VAL A 26 6.198 -8.823 -9.034 1.00 0.00 H new ATOM 462 N THR A 27 1.869 -9.960 -6.534 1.00 0.00 N ATOM 463 CA THR A 27 0.707 -10.733 -6.117 1.00 0.00 C ATOM 464 C THR A 27 -0.579 -10.140 -6.679 1.00 0.00 C ATOM 465 O THR A 27 -0.635 -8.955 -7.008 1.00 0.00 O ATOM 466 CB THR A 27 0.600 -10.802 -4.581 1.00 0.00 C ATOM 467 OG1 THR A 27 0.077 -9.570 -4.071 1.00 0.00 O ATOM 468 CG2 THR A 27 1.958 -11.081 -3.956 1.00 0.00 C ATOM 0 H THR A 27 1.798 -8.959 -6.350 1.00 0.00 H new ATOM 0 HA THR A 27 0.840 -11.741 -6.510 1.00 0.00 H new ATOM 0 HB THR A 27 -0.075 -11.617 -4.322 1.00 0.00 H new ATOM 0 HG1 THR A 27 -0.613 -9.760 -3.402 1.00 0.00 H new ATOM 0 HG21 THR A 27 1.857 -11.125 -2.872 1.00 0.00 H new ATOM 0 HG22 THR A 27 2.339 -12.034 -4.324 1.00 0.00 H new ATOM 0 HG23 THR A 27 2.652 -10.285 -4.224 1.00 0.00 H new ATOM 476 N ASP A 28 -1.611 -10.969 -6.785 1.00 0.00 N ATOM 477 CA ASP A 28 -2.898 -10.524 -7.306 1.00 0.00 C ATOM 478 C ASP A 28 -3.583 -9.575 -6.328 1.00 0.00 C ATOM 479 O ASP A 28 -4.628 -9.002 -6.632 1.00 0.00 O ATOM 480 CB ASP A 28 -3.802 -11.727 -7.586 1.00 0.00 C ATOM 481 CG ASP A 28 -5.072 -11.338 -8.317 1.00 0.00 C ATOM 482 OD1 ASP A 28 -4.970 -10.758 -9.419 1.00 0.00 O ATOM 483 OD2 ASP A 28 -6.169 -11.616 -7.789 1.00 0.00 O ATOM 0 H ASP A 28 -1.582 -11.953 -6.517 1.00 0.00 H new ATOM 0 HA ASP A 28 -2.719 -9.988 -8.238 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -3.254 -12.459 -8.179 1.00 0.00 H new ATOM 0 HB3 ASP A 28 -4.062 -12.210 -6.644 1.00 0.00 H new ATOM 488 N TYR A 29 -2.986 -9.414 -5.152 1.00 0.00 N ATOM 489 CA TYR A 29 -3.539 -8.538 -4.127 1.00 0.00 C ATOM 490 C TYR A 29 -2.571 -7.405 -3.799 1.00 0.00 C ATOM 491 O TYR A 29 -2.778 -6.650 -2.849 1.00 0.00 O ATOM 492 CB TYR A 29 -3.856 -9.335 -2.861 1.00 0.00 C ATOM 493 CG TYR A 29 -2.631 -9.902 -2.180 1.00 0.00 C ATOM 494 CD1 TYR A 29 -1.847 -9.113 -1.347 1.00 0.00 C ATOM 495 CD2 TYR A 29 -2.259 -11.227 -2.368 1.00 0.00 C ATOM 496 CE1 TYR A 29 -0.727 -9.628 -0.723 1.00 0.00 C ATOM 497 CE2 TYR A 29 -1.140 -11.750 -1.748 1.00 0.00 C ATOM 498 CZ TYR A 29 -0.378 -10.947 -0.926 1.00 0.00 C ATOM 499 OH TYR A 29 0.736 -11.462 -0.305 1.00 0.00 O ATOM 0 H TYR A 29 -2.118 -9.879 -4.885 1.00 0.00 H new ATOM 0 HA TYR A 29 -4.461 -8.104 -4.515 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -4.386 -8.691 -2.159 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -4.531 -10.152 -3.116 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -2.118 -8.080 -1.185 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -2.854 -11.859 -3.010 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -0.128 -9.001 -0.079 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -0.864 -12.782 -1.906 1.00 0.00 H new ATOM 0 HH TYR A 29 0.842 -12.405 -0.552 1.00 0.00 H new ATOM 509 N GLY A 30 -1.511 -7.291 -4.594 1.00 0.00 N ATOM 510 CA GLY A 30 -0.526 -6.249 -4.373 1.00 0.00 C ATOM 511 C GLY A 30 0.862 -6.656 -4.827 1.00 0.00 C ATOM 512 O GLY A 30 1.037 -7.708 -5.441 1.00 0.00 O ATOM 0 H GLY A 30 -1.317 -7.902 -5.387 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -0.829 -5.348 -4.906 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -0.499 -5.998 -3.313 1.00 0.00 H new ATOM 516 N ALA A 31 1.850 -5.822 -4.524 1.00 0.00 N ATOM 517 CA ALA A 31 3.229 -6.101 -4.903 1.00 0.00 C ATOM 518 C ALA A 31 4.203 -5.613 -3.836 1.00 0.00 C ATOM 519 O ALA A 31 3.947 -4.620 -3.155 1.00 0.00 O ATOM 520 CB ALA A 31 3.548 -5.457 -6.245 1.00 0.00 C ATOM 0 H ALA A 31 1.721 -4.947 -4.017 1.00 0.00 H new ATOM 0 HA ALA A 31 3.342 -7.181 -4.993 1.00 0.00 H new ATOM 0 HB1 ALA A 31 4.581 -5.673 -6.516 1.00 0.00 H new ATOM 0 HB2 ALA A 31 2.881 -5.858 -7.008 1.00 0.00 H new ATOM 0 HB3 ALA A 31 3.410 -4.378 -6.173 1.00 0.00 H new ATOM 526 N PHE A 32 5.320 -6.319 -3.693 1.00 0.00 N ATOM 527 CA PHE A 32 6.331 -5.959 -2.706 1.00 0.00 C ATOM 528 C PHE A 32 7.455 -5.152 -3.350 1.00 0.00 C ATOM 529 O PHE A 32 7.971 -5.519 -4.406 1.00 0.00 O ATOM 530 CB PHE A 32 6.903 -7.216 -2.049 1.00 0.00 C ATOM 531 CG PHE A 32 5.898 -7.973 -1.227 1.00 0.00 C ATOM 532 CD1 PHE A 32 4.765 -8.508 -1.817 1.00 0.00 C ATOM 533 CD2 PHE A 32 6.087 -8.148 0.134 1.00 0.00 C ATOM 534 CE1 PHE A 32 3.838 -9.206 -1.065 1.00 0.00 C ATOM 535 CE2 PHE A 32 5.164 -8.845 0.891 1.00 0.00 C ATOM 536 CZ PHE A 32 4.038 -9.373 0.292 1.00 0.00 C ATOM 0 H PHE A 32 5.548 -7.144 -4.248 1.00 0.00 H new ATOM 0 HA PHE A 32 5.855 -5.343 -1.943 1.00 0.00 H new ATOM 0 HB2 PHE A 32 7.297 -7.874 -2.824 1.00 0.00 H new ATOM 0 HB3 PHE A 32 7.742 -6.934 -1.413 1.00 0.00 H new ATOM 0 HD1 PHE A 32 4.604 -8.379 -2.877 1.00 0.00 H new ATOM 0 HD2 PHE A 32 6.965 -7.735 0.609 1.00 0.00 H new ATOM 0 HE1 PHE A 32 2.959 -9.620 -1.537 1.00 0.00 H new ATOM 0 HE2 PHE A 32 5.324 -8.976 1.951 1.00 0.00 H new ATOM 0 HZ PHE A 32 3.315 -9.916 0.883 1.00 0.00 H new ATOM 546 N ILE A 33 7.828 -4.051 -2.705 1.00 0.00 N ATOM 547 CA ILE A 33 8.891 -3.193 -3.213 1.00 0.00 C ATOM 548 C ILE A 33 10.080 -3.166 -2.258 1.00 0.00 C ATOM 549 O ILE A 33 9.913 -3.205 -1.038 1.00 0.00 O ATOM 550 CB ILE A 33 8.393 -1.752 -3.434 1.00 0.00 C ATOM 551 CG1 ILE A 33 7.135 -1.752 -4.305 1.00 0.00 C ATOM 552 CG2 ILE A 33 9.485 -0.906 -4.072 1.00 0.00 C ATOM 553 CD1 ILE A 33 7.386 -2.195 -5.729 1.00 0.00 C ATOM 0 H ILE A 33 7.410 -3.733 -1.831 1.00 0.00 H new ATOM 0 HA ILE A 33 9.205 -3.612 -4.169 1.00 0.00 H new ATOM 0 HB ILE A 33 8.142 -1.318 -2.466 1.00 0.00 H new ATOM 0 HG12 ILE A 33 6.391 -2.409 -3.854 1.00 0.00 H new ATOM 0 HG13 ILE A 33 6.710 -0.748 -4.315 1.00 0.00 H new ATOM 0 HG21 ILE A 33 9.118 0.109 -4.222 1.00 0.00 H new ATOM 0 HG22 ILE A 33 10.357 -0.884 -3.418 1.00 0.00 H new ATOM 0 HG23 ILE A 33 9.764 -1.337 -5.034 1.00 0.00 H new ATOM 0 HD11 ILE A 33 6.451 -2.170 -6.288 1.00 0.00 H new ATOM 0 HD12 ILE A 33 8.106 -1.524 -6.197 1.00 0.00 H new ATOM 0 HD13 ILE A 33 7.782 -3.210 -5.730 1.00 0.00 H new ATOM 565 N LYS A 34 11.282 -3.098 -2.821 1.00 0.00 N ATOM 566 CA LYS A 34 12.500 -3.063 -2.021 1.00 0.00 C ATOM 567 C LYS A 34 12.897 -1.627 -1.696 1.00 0.00 C ATOM 568 O LYS A 34 12.936 -0.768 -2.577 1.00 0.00 O ATOM 569 CB LYS A 34 13.641 -3.761 -2.764 1.00 0.00 C ATOM 570 CG LYS A 34 13.467 -5.267 -2.869 1.00 0.00 C ATOM 571 CD LYS A 34 14.804 -5.975 -3.007 1.00 0.00 C ATOM 572 CE LYS A 34 14.636 -7.380 -3.564 1.00 0.00 C ATOM 573 NZ LYS A 34 15.909 -8.153 -3.513 1.00 0.00 N ATOM 0 H LYS A 34 11.438 -3.066 -3.828 1.00 0.00 H new ATOM 0 HA LYS A 34 12.306 -3.588 -1.086 1.00 0.00 H new ATOM 0 HB2 LYS A 34 13.720 -3.342 -3.767 1.00 0.00 H new ATOM 0 HB3 LYS A 34 14.580 -3.547 -2.254 1.00 0.00 H new ATOM 0 HG2 LYS A 34 12.948 -5.637 -1.984 1.00 0.00 H new ATOM 0 HG3 LYS A 34 12.839 -5.503 -3.728 1.00 0.00 H new ATOM 0 HD2 LYS A 34 15.456 -5.398 -3.663 1.00 0.00 H new ATOM 0 HD3 LYS A 34 15.293 -6.024 -2.034 1.00 0.00 H new ATOM 0 HE2 LYS A 34 13.869 -7.906 -2.996 1.00 0.00 H new ATOM 0 HE3 LYS A 34 14.287 -7.323 -4.595 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 15.753 -9.105 -3.901 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 16.635 -7.664 -4.075 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 16.229 -8.230 -2.526 1.00 0.00 H new ATOM 587 N ILE A 35 13.189 -1.372 -0.424 1.00 0.00 N ATOM 588 CA ILE A 35 13.584 -0.040 0.016 1.00 0.00 C ATOM 589 C ILE A 35 15.096 0.137 -0.058 1.00 0.00 C ATOM 590 O ILE A 35 15.868 -0.699 0.413 1.00 0.00 O ATOM 591 CB ILE A 35 13.116 0.239 1.457 1.00 0.00 C ATOM 592 CG1 ILE A 35 11.588 0.296 1.517 1.00 0.00 C ATOM 593 CG2 ILE A 35 13.721 1.537 1.969 1.00 0.00 C ATOM 594 CD1 ILE A 35 11.031 0.109 2.911 1.00 0.00 C ATOM 0 H ILE A 35 13.159 -2.070 0.319 1.00 0.00 H new ATOM 0 HA ILE A 35 13.104 0.670 -0.657 1.00 0.00 H new ATOM 0 HB ILE A 35 13.456 -0.574 2.098 1.00 0.00 H new ATOM 0 HG12 ILE A 35 11.253 1.257 1.126 1.00 0.00 H new ATOM 0 HG13 ILE A 35 11.178 -0.474 0.864 1.00 0.00 H new ATOM 0 HG21 ILE A 35 13.381 1.720 2.988 1.00 0.00 H new ATOM 0 HG22 ILE A 35 14.808 1.461 1.958 1.00 0.00 H new ATOM 0 HG23 ILE A 35 13.408 2.362 1.329 1.00 0.00 H new ATOM 0 HD11 ILE A 35 9.943 0.161 2.878 1.00 0.00 H new ATOM 0 HD12 ILE A 35 11.336 -0.863 3.297 1.00 0.00 H new ATOM 0 HD13 ILE A 35 11.412 0.894 3.564 1.00 0.00 H new ATOM 606 N PRO A 36 15.533 1.253 -0.661 1.00 0.00 N ATOM 607 CA PRO A 36 16.957 1.568 -0.808 1.00 0.00 C ATOM 608 C PRO A 36 17.616 1.913 0.524 1.00 0.00 C ATOM 609 O PRO A 36 17.183 2.827 1.222 1.00 0.00 O ATOM 610 CB PRO A 36 16.957 2.786 -1.735 1.00 0.00 C ATOM 611 CG PRO A 36 15.625 3.420 -1.527 1.00 0.00 C ATOM 612 CD PRO A 36 14.670 2.293 -1.244 1.00 0.00 C ATOM 0 HA PRO A 36 17.524 0.721 -1.194 1.00 0.00 H new ATOM 0 HB2 PRO A 36 17.766 3.473 -1.486 1.00 0.00 H new ATOM 0 HB3 PRO A 36 17.097 2.492 -2.775 1.00 0.00 H new ATOM 0 HG2 PRO A 36 15.654 4.125 -0.696 1.00 0.00 H new ATOM 0 HG3 PRO A 36 15.317 3.980 -2.410 1.00 0.00 H new ATOM 0 HD2 PRO A 36 13.884 2.597 -0.553 1.00 0.00 H new ATOM 0 HD3 PRO A 36 14.179 1.945 -2.153 1.00 0.00 H new ATOM 620 N GLY A 37 18.667 1.174 0.868 1.00 0.00 N ATOM 621 CA GLY A 37 19.368 1.418 2.115 1.00 0.00 C ATOM 622 C GLY A 37 18.697 0.747 3.297 1.00 0.00 C ATOM 623 O GLY A 37 18.911 1.140 4.445 1.00 0.00 O ATOM 0 H GLY A 37 19.045 0.411 0.306 1.00 0.00 H new ATOM 0 HA2 GLY A 37 20.393 1.056 2.029 1.00 0.00 H new ATOM 0 HA3 GLY A 37 19.423 2.492 2.294 1.00 0.00 H new ATOM 627 N CYS A 38 17.884 -0.266 3.018 1.00 0.00 N ATOM 628 CA CYS A 38 17.178 -0.990 4.069 1.00 0.00 C ATOM 629 C CYS A 38 17.115 -2.482 3.752 1.00 0.00 C ATOM 630 O CYS A 38 17.429 -2.903 2.639 1.00 0.00 O ATOM 631 CB CYS A 38 15.765 -0.432 4.241 1.00 0.00 C ATOM 632 SG CYS A 38 15.712 1.277 4.827 1.00 0.00 S ATOM 0 H CYS A 38 17.698 -0.604 2.074 1.00 0.00 H new ATOM 0 HA CYS A 38 17.728 -0.858 5.001 1.00 0.00 H new ATOM 0 HB2 CYS A 38 15.243 -0.494 3.286 1.00 0.00 H new ATOM 0 HB3 CYS A 38 15.220 -1.063 4.943 1.00 0.00 H new ATOM 0 HG CYS A 38 16.922 1.698 5.048 1.00 0.00 H new ATOM 638 N ARG A 39 16.707 -3.274 4.738 1.00 0.00 N ATOM 639 CA ARG A 39 16.605 -4.717 4.565 1.00 0.00 C ATOM 640 C ARG A 39 15.149 -5.145 4.408 1.00 0.00 C ATOM 641 O ARG A 39 14.821 -5.970 3.555 1.00 0.00 O ATOM 642 CB ARG A 39 17.234 -5.440 5.758 1.00 0.00 C ATOM 643 CG ARG A 39 17.633 -6.877 5.458 1.00 0.00 C ATOM 644 CD ARG A 39 17.560 -7.746 6.703 1.00 0.00 C ATOM 645 NE ARG A 39 17.448 -9.166 6.373 1.00 0.00 N ATOM 646 CZ ARG A 39 17.026 -10.088 7.231 1.00 0.00 C ATOM 647 NH1 ARG A 39 16.677 -9.743 8.463 1.00 0.00 N ATOM 648 NH2 ARG A 39 16.951 -11.359 6.856 1.00 0.00 N ATOM 0 H ARG A 39 16.442 -2.940 5.665 1.00 0.00 H new ATOM 0 HA ARG A 39 17.145 -4.988 3.658 1.00 0.00 H new ATOM 0 HB2 ARG A 39 18.115 -4.887 6.083 1.00 0.00 H new ATOM 0 HB3 ARG A 39 16.529 -5.434 6.589 1.00 0.00 H new ATOM 0 HG2 ARG A 39 16.977 -7.285 4.689 1.00 0.00 H new ATOM 0 HG3 ARG A 39 18.646 -6.898 5.057 1.00 0.00 H new ATOM 0 HD2 ARG A 39 18.450 -7.584 7.311 1.00 0.00 H new ATOM 0 HD3 ARG A 39 16.703 -7.445 7.306 1.00 0.00 H new ATOM 0 HE ARG A 39 17.708 -9.465 5.433 1.00 0.00 H new ATOM 0 HH11 ARG A 39 16.732 -8.767 8.754 1.00 0.00 H new ATOM 0 HH12 ARG A 39 16.353 -10.454 9.119 1.00 0.00 H new ATOM 0 HH21 ARG A 39 17.217 -11.628 5.909 1.00 0.00 H new ATOM 0 HH22 ARG A 39 16.627 -12.067 7.515 1.00 0.00 H new ATOM 662 N LYS A 40 14.279 -4.578 5.237 1.00 0.00 N ATOM 663 CA LYS A 40 12.857 -4.899 5.190 1.00 0.00 C ATOM 664 C LYS A 40 12.215 -4.340 3.926 1.00 0.00 C ATOM 665 O LYS A 40 12.715 -3.384 3.335 1.00 0.00 O ATOM 666 CB LYS A 40 12.147 -4.339 6.426 1.00 0.00 C ATOM 667 CG LYS A 40 12.175 -5.278 7.620 1.00 0.00 C ATOM 668 CD LYS A 40 11.273 -6.482 7.406 1.00 0.00 C ATOM 669 CE LYS A 40 11.491 -7.539 8.478 1.00 0.00 C ATOM 670 NZ LYS A 40 12.605 -8.462 8.127 1.00 0.00 N ATOM 0 H LYS A 40 14.534 -3.894 5.949 1.00 0.00 H new ATOM 0 HA LYS A 40 12.754 -5.984 5.179 1.00 0.00 H new ATOM 0 HB2 LYS A 40 12.613 -3.394 6.706 1.00 0.00 H new ATOM 0 HB3 LYS A 40 11.110 -4.119 6.171 1.00 0.00 H new ATOM 0 HG2 LYS A 40 13.197 -5.615 7.795 1.00 0.00 H new ATOM 0 HG3 LYS A 40 11.859 -4.740 8.514 1.00 0.00 H new ATOM 0 HD2 LYS A 40 10.231 -6.163 7.414 1.00 0.00 H new ATOM 0 HD3 LYS A 40 11.467 -6.913 6.424 1.00 0.00 H new ATOM 0 HE2 LYS A 40 11.708 -7.053 9.429 1.00 0.00 H new ATOM 0 HE3 LYS A 40 10.574 -8.112 8.615 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 12.722 -9.168 8.882 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 12.387 -8.945 7.232 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 13.486 -7.919 8.021 1.00 0.00 H new ATOM 684 N GLN A 41 11.101 -4.941 3.517 1.00 0.00 N ATOM 685 CA GLN A 41 10.391 -4.501 2.323 1.00 0.00 C ATOM 686 C GLN A 41 8.960 -4.093 2.659 1.00 0.00 C ATOM 687 O GLN A 41 8.453 -4.403 3.736 1.00 0.00 O ATOM 688 CB GLN A 41 10.382 -5.612 1.271 1.00 0.00 C ATOM 689 CG GLN A 41 11.751 -6.224 1.022 1.00 0.00 C ATOM 690 CD GLN A 41 11.669 -7.609 0.412 1.00 0.00 C ATOM 691 OE1 GLN A 41 10.816 -8.415 0.785 1.00 0.00 O ATOM 692 NE2 GLN A 41 12.558 -7.895 -0.532 1.00 0.00 N ATOM 0 H GLN A 41 10.672 -5.733 3.995 1.00 0.00 H new ATOM 0 HA GLN A 41 10.913 -3.632 1.921 1.00 0.00 H new ATOM 0 HB2 GLN A 41 9.695 -6.396 1.588 1.00 0.00 H new ATOM 0 HB3 GLN A 41 9.997 -5.211 0.334 1.00 0.00 H new ATOM 0 HG2 GLN A 41 12.321 -5.573 0.359 1.00 0.00 H new ATOM 0 HG3 GLN A 41 12.297 -6.278 1.964 1.00 0.00 H new ATOM 0 HE21 GLN A 41 13.248 -7.197 -0.811 1.00 0.00 H new ATOM 0 HE22 GLN A 41 12.551 -8.812 -0.978 1.00 0.00 H new ATOM 701 N GLY A 42 8.314 -3.395 1.731 1.00 0.00 N ATOM 702 CA GLY A 42 6.948 -2.955 1.949 1.00 0.00 C ATOM 703 C GLY A 42 5.993 -3.493 0.901 1.00 0.00 C ATOM 704 O GLY A 42 6.370 -3.686 -0.255 1.00 0.00 O ATOM 0 H GLY A 42 8.712 -3.126 0.831 1.00 0.00 H new ATOM 0 HA2 GLY A 42 6.619 -3.278 2.937 1.00 0.00 H new ATOM 0 HA3 GLY A 42 6.915 -1.866 1.942 1.00 0.00 H new ATOM 708 N LEU A 43 4.751 -3.737 1.307 1.00 0.00 N ATOM 709 CA LEU A 43 3.738 -4.258 0.396 1.00 0.00 C ATOM 710 C LEU A 43 2.814 -3.143 -0.086 1.00 0.00 C ATOM 711 O LEU A 43 2.454 -2.248 0.679 1.00 0.00 O ATOM 712 CB LEU A 43 2.920 -5.353 1.084 1.00 0.00 C ATOM 713 CG LEU A 43 1.564 -5.673 0.453 1.00 0.00 C ATOM 714 CD1 LEU A 43 1.745 -6.494 -0.813 1.00 0.00 C ATOM 715 CD2 LEU A 43 0.676 -6.408 1.446 1.00 0.00 C ATOM 0 H LEU A 43 4.422 -3.582 2.260 1.00 0.00 H new ATOM 0 HA LEU A 43 4.246 -4.683 -0.470 1.00 0.00 H new ATOM 0 HB2 LEU A 43 3.515 -6.266 1.102 1.00 0.00 H new ATOM 0 HB3 LEU A 43 2.756 -5.059 2.121 1.00 0.00 H new ATOM 0 HG LEU A 43 1.078 -4.735 0.185 1.00 0.00 H new ATOM 0 HD11 LEU A 43 0.770 -6.712 -1.248 1.00 0.00 H new ATOM 0 HD12 LEU A 43 2.344 -5.931 -1.529 1.00 0.00 H new ATOM 0 HD13 LEU A 43 2.252 -7.428 -0.571 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -0.285 -6.628 0.981 1.00 0.00 H new ATOM 0 HD22 LEU A 43 1.157 -7.340 1.744 1.00 0.00 H new ATOM 0 HD23 LEU A 43 0.519 -5.783 2.325 1.00 0.00 H new ATOM 727 N VAL A 44 2.432 -3.207 -1.357 1.00 0.00 N ATOM 728 CA VAL A 44 1.547 -2.205 -1.940 1.00 0.00 C ATOM 729 C VAL A 44 0.225 -2.827 -2.377 1.00 0.00 C ATOM 730 O VAL A 44 0.161 -3.531 -3.385 1.00 0.00 O ATOM 731 CB VAL A 44 2.201 -1.514 -3.151 1.00 0.00 C ATOM 732 CG1 VAL A 44 1.227 -0.546 -3.805 1.00 0.00 C ATOM 733 CG2 VAL A 44 3.476 -0.798 -2.730 1.00 0.00 C ATOM 0 H VAL A 44 2.721 -3.942 -2.003 1.00 0.00 H new ATOM 0 HA VAL A 44 1.358 -1.462 -1.166 1.00 0.00 H new ATOM 0 HB VAL A 44 2.464 -2.276 -3.884 1.00 0.00 H new ATOM 0 HG11 VAL A 44 1.707 -0.068 -4.659 1.00 0.00 H new ATOM 0 HG12 VAL A 44 0.345 -1.090 -4.143 1.00 0.00 H new ATOM 0 HG13 VAL A 44 0.930 0.214 -3.083 1.00 0.00 H new ATOM 0 HG21 VAL A 44 3.926 -0.315 -3.598 1.00 0.00 H new ATOM 0 HG22 VAL A 44 3.239 -0.045 -1.978 1.00 0.00 H new ATOM 0 HG23 VAL A 44 4.178 -1.520 -2.312 1.00 0.00 H new ATOM 743 N HIS A 45 -0.829 -2.560 -1.612 1.00 0.00 N ATOM 744 CA HIS A 45 -2.151 -3.093 -1.921 1.00 0.00 C ATOM 745 C HIS A 45 -2.510 -2.844 -3.384 1.00 0.00 C ATOM 746 O HIS A 45 -2.080 -1.855 -3.978 1.00 0.00 O ATOM 747 CB HIS A 45 -3.204 -2.460 -1.012 1.00 0.00 C ATOM 748 CG HIS A 45 -4.373 -3.355 -0.734 1.00 0.00 C ATOM 749 ND1 HIS A 45 -5.626 -2.879 -0.410 1.00 0.00 N ATOM 750 CD2 HIS A 45 -4.473 -4.705 -0.736 1.00 0.00 C ATOM 751 CE1 HIS A 45 -6.446 -3.897 -0.221 1.00 0.00 C ATOM 752 NE2 HIS A 45 -5.771 -5.017 -0.415 1.00 0.00 N ATOM 0 H HIS A 45 -0.793 -1.978 -0.775 1.00 0.00 H new ATOM 0 HA HIS A 45 -2.131 -4.169 -1.748 1.00 0.00 H new ATOM 0 HB2 HIS A 45 -2.737 -2.183 -0.067 1.00 0.00 H new ATOM 0 HB3 HIS A 45 -3.563 -1.540 -1.472 1.00 0.00 H new ATOM 0 HD2 HIS A 45 -3.680 -5.406 -0.950 1.00 0.00 H new ATOM 0 HE1 HIS A 45 -7.490 -3.826 0.046 1.00 0.00 H new ATOM 0 HE2 HIS A 45 -6.153 -5.960 -0.339 1.00 0.00 H new ATOM 760 N ARG A 46 -3.297 -3.748 -3.956 1.00 0.00 N ATOM 761 CA ARG A 46 -3.710 -3.628 -5.350 1.00 0.00 C ATOM 762 C ARG A 46 -4.468 -2.323 -5.582 1.00 0.00 C ATOM 763 O ARG A 46 -4.411 -1.744 -6.666 1.00 0.00 O ATOM 764 CB ARG A 46 -4.588 -4.817 -5.748 1.00 0.00 C ATOM 765 CG ARG A 46 -5.823 -4.981 -4.878 1.00 0.00 C ATOM 766 CD ARG A 46 -6.899 -5.788 -5.586 1.00 0.00 C ATOM 767 NE ARG A 46 -7.807 -6.436 -4.643 1.00 0.00 N ATOM 768 CZ ARG A 46 -8.609 -7.444 -4.967 1.00 0.00 C ATOM 769 NH1 ARG A 46 -8.614 -7.917 -6.206 1.00 0.00 N ATOM 770 NH2 ARG A 46 -9.406 -7.981 -4.053 1.00 0.00 N ATOM 0 H ARG A 46 -3.662 -4.571 -3.477 1.00 0.00 H new ATOM 0 HA ARG A 46 -2.813 -3.623 -5.970 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -4.899 -4.697 -6.786 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -3.994 -5.730 -5.697 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -5.550 -5.476 -3.946 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -6.217 -3.999 -4.615 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -7.468 -5.133 -6.245 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -6.430 -6.544 -6.215 1.00 0.00 H new ATOM 0 HE ARG A 46 -7.826 -6.095 -3.682 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -8.002 -7.507 -6.911 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -9.230 -8.691 -6.454 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -9.404 -7.620 -3.099 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -10.021 -8.755 -4.304 1.00 0.00 H new ATOM 784 N THR A 47 -5.177 -1.867 -4.554 1.00 0.00 N ATOM 785 CA THR A 47 -5.947 -0.633 -4.645 1.00 0.00 C ATOM 786 C THR A 47 -5.036 0.589 -4.592 1.00 0.00 C ATOM 787 O THR A 47 -5.420 1.681 -5.012 1.00 0.00 O ATOM 788 CB THR A 47 -6.986 -0.533 -3.513 1.00 0.00 C ATOM 789 OG1 THR A 47 -7.871 0.567 -3.755 1.00 0.00 O ATOM 790 CG2 THR A 47 -6.303 -0.353 -2.165 1.00 0.00 C ATOM 0 H THR A 47 -5.234 -2.334 -3.649 1.00 0.00 H new ATOM 0 HA THR A 47 -6.466 -0.655 -5.603 1.00 0.00 H new ATOM 0 HB THR A 47 -7.557 -1.461 -3.492 1.00 0.00 H new ATOM 0 HG1 THR A 47 -8.529 0.622 -3.031 1.00 0.00 H new ATOM 0 HG21 THR A 47 -7.057 -0.285 -1.381 1.00 0.00 H new ATOM 0 HG22 THR A 47 -5.653 -1.206 -1.970 1.00 0.00 H new ATOM 0 HG23 THR A 47 -5.709 0.561 -2.177 1.00 0.00 H new ATOM 798 N HIS A 48 -3.827 0.397 -4.074 1.00 0.00 N ATOM 799 CA HIS A 48 -2.860 1.484 -3.968 1.00 0.00 C ATOM 800 C HIS A 48 -1.901 1.478 -5.155 1.00 0.00 C ATOM 801 O HIS A 48 -1.294 2.497 -5.479 1.00 0.00 O ATOM 802 CB HIS A 48 -2.073 1.369 -2.662 1.00 0.00 C ATOM 803 CG HIS A 48 -2.817 1.877 -1.466 1.00 0.00 C ATOM 804 ND1 HIS A 48 -2.999 3.220 -1.208 1.00 0.00 N ATOM 805 CD2 HIS A 48 -3.430 1.217 -0.458 1.00 0.00 C ATOM 806 CE1 HIS A 48 -3.690 3.362 -0.091 1.00 0.00 C ATOM 807 NE2 HIS A 48 -3.964 2.161 0.384 1.00 0.00 N ATOM 0 H HIS A 48 -3.494 -0.500 -3.721 1.00 0.00 H new ATOM 0 HA HIS A 48 -3.409 2.426 -3.972 1.00 0.00 H new ATOM 0 HB2 HIS A 48 -1.808 0.324 -2.498 1.00 0.00 H new ATOM 0 HB3 HIS A 48 -1.139 1.923 -2.760 1.00 0.00 H new ATOM 0 HD2 HIS A 48 -3.489 0.145 -0.337 1.00 0.00 H new ATOM 0 HE1 HIS A 48 -3.981 4.301 0.357 1.00 0.00 H new ATOM 0 HE2 HIS A 48 -4.487 1.966 1.238 1.00 0.00 H new ATOM 815 N MET A 49 -1.772 0.321 -5.798 1.00 0.00 N ATOM 816 CA MET A 49 -0.888 0.183 -6.949 1.00 0.00 C ATOM 817 C MET A 49 -1.187 1.253 -7.996 1.00 0.00 C ATOM 818 O MET A 49 -0.287 1.959 -8.449 1.00 0.00 O ATOM 819 CB MET A 49 -1.035 -1.208 -7.569 1.00 0.00 C ATOM 820 CG MET A 49 -0.330 -2.301 -6.782 1.00 0.00 C ATOM 821 SD MET A 49 -0.226 -3.854 -7.692 1.00 0.00 S ATOM 822 CE MET A 49 1.395 -3.699 -8.440 1.00 0.00 C ATOM 0 H MET A 49 -2.268 -0.533 -5.541 1.00 0.00 H new ATOM 0 HA MET A 49 0.138 0.313 -6.605 1.00 0.00 H new ATOM 0 HB2 MET A 49 -2.094 -1.453 -7.646 1.00 0.00 H new ATOM 0 HB3 MET A 49 -0.638 -1.188 -8.584 1.00 0.00 H new ATOM 0 HG2 MET A 49 0.675 -1.967 -6.524 1.00 0.00 H new ATOM 0 HG3 MET A 49 -0.860 -2.468 -5.845 1.00 0.00 H new ATOM 0 HE1 MET A 49 1.750 -4.683 -8.746 1.00 0.00 H new ATOM 0 HE2 MET A 49 1.333 -3.048 -9.312 1.00 0.00 H new ATOM 0 HE3 MET A 49 2.090 -3.271 -7.717 1.00 0.00 H new ATOM 832 N SER A 50 -2.456 1.365 -8.375 1.00 0.00 N ATOM 833 CA SER A 50 -2.872 2.345 -9.371 1.00 0.00 C ATOM 834 C SER A 50 -4.081 3.137 -8.882 1.00 0.00 C ATOM 835 O SER A 50 -4.880 2.643 -8.086 1.00 0.00 O ATOM 836 CB SER A 50 -3.203 1.651 -10.694 1.00 0.00 C ATOM 837 OG SER A 50 -2.056 1.556 -11.520 1.00 0.00 O ATOM 0 H SER A 50 -3.214 0.789 -8.007 1.00 0.00 H new ATOM 0 HA SER A 50 -2.046 3.038 -9.530 1.00 0.00 H new ATOM 0 HB2 SER A 50 -3.597 0.654 -10.497 1.00 0.00 H new ATOM 0 HB3 SER A 50 -3.985 2.205 -11.214 1.00 0.00 H new ATOM 0 HG SER A 50 -2.293 1.107 -12.358 1.00 0.00 H new ATOM 843 N SER A 51 -4.210 4.369 -9.365 1.00 0.00 N ATOM 844 CA SER A 51 -5.320 5.231 -8.976 1.00 0.00 C ATOM 845 C SER A 51 -6.633 4.729 -9.570 1.00 0.00 C ATOM 846 O SER A 51 -7.563 4.382 -8.842 1.00 0.00 O ATOM 847 CB SER A 51 -5.058 6.669 -9.428 1.00 0.00 C ATOM 848 OG SER A 51 -6.150 7.512 -9.102 1.00 0.00 O ATOM 0 H SER A 51 -3.559 4.792 -10.027 1.00 0.00 H new ATOM 0 HA SER A 51 -5.402 5.208 -7.889 1.00 0.00 H new ATOM 0 HB2 SER A 51 -4.151 7.043 -8.953 1.00 0.00 H new ATOM 0 HB3 SER A 51 -4.887 6.690 -10.504 1.00 0.00 H new ATOM 0 HG SER A 51 -5.958 8.426 -9.399 1.00 0.00 H new ATOM 854 N CYS A 52 -6.698 4.695 -10.896 1.00 0.00 N ATOM 855 CA CYS A 52 -7.897 4.236 -11.590 1.00 0.00 C ATOM 856 C CYS A 52 -8.284 2.831 -11.139 1.00 0.00 C ATOM 857 O CYS A 52 -7.654 2.260 -10.248 1.00 0.00 O ATOM 858 CB CYS A 52 -7.674 4.256 -13.102 1.00 0.00 C ATOM 859 SG CYS A 52 -8.060 5.839 -13.886 1.00 0.00 S ATOM 0 H CYS A 52 -5.936 4.979 -11.512 1.00 0.00 H new ATOM 0 HA CYS A 52 -8.713 4.914 -11.341 1.00 0.00 H new ATOM 0 HB2 CYS A 52 -6.633 4.005 -13.308 1.00 0.00 H new ATOM 0 HB3 CYS A 52 -8.286 3.478 -13.559 1.00 0.00 H new ATOM 0 HG CYS A 52 -7.837 5.756 -15.164 1.00 0.00 H new ATOM 865 N ARG A 53 -9.323 2.282 -11.758 1.00 0.00 N ATOM 866 CA ARG A 53 -9.794 0.945 -11.417 1.00 0.00 C ATOM 867 C ARG A 53 -8.720 -0.100 -11.702 1.00 0.00 C ATOM 868 O ARG A 53 -8.204 -0.187 -12.816 1.00 0.00 O ATOM 869 CB ARG A 53 -11.064 0.614 -12.203 1.00 0.00 C ATOM 870 CG ARG A 53 -11.989 -0.356 -11.488 1.00 0.00 C ATOM 871 CD ARG A 53 -12.759 0.330 -10.369 1.00 0.00 C ATOM 872 NE ARG A 53 -13.864 1.136 -10.881 1.00 0.00 N ATOM 873 CZ ARG A 53 -14.769 1.719 -10.103 1.00 0.00 C ATOM 874 NH1 ARG A 53 -14.700 1.588 -8.786 1.00 0.00 N ATOM 875 NH2 ARG A 53 -15.747 2.437 -10.643 1.00 0.00 N ATOM 0 H ARG A 53 -9.855 2.741 -12.498 1.00 0.00 H new ATOM 0 HA ARG A 53 -10.019 0.927 -10.351 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -11.607 1.537 -12.405 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -10.784 0.191 -13.168 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -12.690 -0.786 -12.203 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -11.406 -1.181 -11.078 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -13.147 -0.422 -9.681 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -12.081 0.965 -9.798 1.00 0.00 H new ATOM 0 HE ARG A 53 -13.945 1.258 -11.890 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -13.950 1.038 -8.367 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -15.397 2.037 -8.192 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -15.804 2.541 -11.656 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -16.442 2.884 -10.045 1.00 0.00 H new ATOM 889 N VAL A 54 -8.388 -0.892 -10.687 1.00 0.00 N ATOM 890 CA VAL A 54 -7.375 -1.931 -10.828 1.00 0.00 C ATOM 891 C VAL A 54 -8.014 -3.282 -11.131 1.00 0.00 C ATOM 892 O VAL A 54 -8.951 -3.703 -10.455 1.00 0.00 O ATOM 893 CB VAL A 54 -6.517 -2.055 -9.554 1.00 0.00 C ATOM 894 CG1 VAL A 54 -5.400 -3.066 -9.759 1.00 0.00 C ATOM 895 CG2 VAL A 54 -5.955 -0.699 -9.157 1.00 0.00 C ATOM 0 H VAL A 54 -8.806 -0.834 -9.758 1.00 0.00 H new ATOM 0 HA VAL A 54 -6.735 -1.639 -11.661 1.00 0.00 H new ATOM 0 HB VAL A 54 -7.151 -2.411 -8.742 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -4.805 -3.140 -8.849 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -5.829 -4.040 -9.992 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -4.764 -2.743 -10.583 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -5.352 -0.805 -8.255 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -5.335 -0.311 -9.965 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -6.775 -0.007 -8.965 1.00 0.00 H new ATOM 905 N ASP A 55 -7.498 -3.957 -12.153 1.00 0.00 N ATOM 906 CA ASP A 55 -8.016 -5.262 -12.547 1.00 0.00 C ATOM 907 C ASP A 55 -6.980 -6.355 -12.299 1.00 0.00 C ATOM 908 O ASP A 55 -7.267 -7.360 -11.650 1.00 0.00 O ATOM 909 CB ASP A 55 -8.420 -5.250 -14.022 1.00 0.00 C ATOM 910 CG ASP A 55 -8.961 -6.589 -14.485 1.00 0.00 C ATOM 911 OD1 ASP A 55 -9.749 -7.201 -13.733 1.00 0.00 O ATOM 912 OD2 ASP A 55 -8.598 -7.023 -15.597 1.00 0.00 O ATOM 0 H ASP A 55 -6.722 -3.622 -12.723 1.00 0.00 H new ATOM 0 HA ASP A 55 -8.896 -5.475 -11.939 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -9.176 -4.481 -14.183 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -7.557 -4.980 -14.630 1.00 0.00 H new ATOM 917 N LYS A 56 -5.776 -6.151 -12.821 1.00 0.00 N ATOM 918 CA LYS A 56 -4.696 -7.117 -12.656 1.00 0.00 C ATOM 919 C LYS A 56 -3.383 -6.415 -12.327 1.00 0.00 C ATOM 920 O LYS A 56 -2.810 -5.702 -13.150 1.00 0.00 O ATOM 921 CB LYS A 56 -4.536 -7.953 -13.928 1.00 0.00 C ATOM 922 CG LYS A 56 -5.397 -9.205 -13.947 1.00 0.00 C ATOM 923 CD LYS A 56 -4.965 -10.163 -15.045 1.00 0.00 C ATOM 924 CE LYS A 56 -3.819 -11.053 -14.590 1.00 0.00 C ATOM 925 NZ LYS A 56 -3.544 -12.144 -15.564 1.00 0.00 N ATOM 0 H LYS A 56 -5.523 -5.325 -13.363 1.00 0.00 H new ATOM 0 HA LYS A 56 -4.953 -7.774 -11.825 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -4.787 -7.337 -14.791 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -3.490 -8.240 -14.035 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -5.334 -9.706 -12.981 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -6.441 -8.928 -14.095 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -5.811 -10.782 -15.343 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -4.660 -9.596 -15.924 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -2.921 -10.450 -14.458 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -4.059 -11.485 -13.619 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -2.756 -12.728 -15.218 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -4.393 -12.735 -15.672 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -3.290 -11.732 -16.485 1.00 0.00 H new ATOM 939 N PRO A 57 -2.893 -6.623 -11.096 1.00 0.00 N ATOM 940 CA PRO A 57 -1.640 -6.021 -10.630 1.00 0.00 C ATOM 941 C PRO A 57 -0.419 -6.615 -11.324 1.00 0.00 C ATOM 942 O PRO A 57 0.616 -5.960 -11.449 1.00 0.00 O ATOM 943 CB PRO A 57 -1.621 -6.351 -9.136 1.00 0.00 C ATOM 944 CG PRO A 57 -2.459 -7.577 -9.009 1.00 0.00 C ATOM 945 CD PRO A 57 -3.524 -7.462 -10.064 1.00 0.00 C ATOM 0 HA PRO A 57 -1.596 -4.953 -10.844 1.00 0.00 H new ATOM 0 HB2 PRO A 57 -0.605 -6.527 -8.782 1.00 0.00 H new ATOM 0 HB3 PRO A 57 -2.027 -5.531 -8.544 1.00 0.00 H new ATOM 0 HG2 PRO A 57 -1.860 -8.476 -9.156 1.00 0.00 H new ATOM 0 HG3 PRO A 57 -2.900 -7.647 -8.015 1.00 0.00 H new ATOM 0 HD2 PRO A 57 -3.807 -8.438 -10.458 1.00 0.00 H new ATOM 0 HD3 PRO A 57 -4.431 -7.002 -9.671 1.00 0.00 H new ATOM 953 N SER A 58 -0.545 -7.860 -11.771 1.00 0.00 N ATOM 954 CA SER A 58 0.550 -8.544 -12.449 1.00 0.00 C ATOM 955 C SER A 58 0.783 -7.955 -13.836 1.00 0.00 C ATOM 956 O SER A 58 1.752 -8.297 -14.512 1.00 0.00 O ATOM 957 CB SER A 58 0.253 -10.041 -12.560 1.00 0.00 C ATOM 958 OG SER A 58 0.683 -10.734 -11.400 1.00 0.00 O ATOM 0 H SER A 58 -1.395 -8.416 -11.676 1.00 0.00 H new ATOM 0 HA SER A 58 1.455 -8.404 -11.858 1.00 0.00 H new ATOM 0 HB2 SER A 58 -0.817 -10.193 -12.703 1.00 0.00 H new ATOM 0 HB3 SER A 58 0.753 -10.450 -13.438 1.00 0.00 H new ATOM 0 HG SER A 58 0.480 -11.688 -11.495 1.00 0.00 H new ATOM 964 N GLU A 59 -0.116 -7.069 -14.254 1.00 0.00 N ATOM 965 CA GLU A 59 -0.010 -6.433 -15.562 1.00 0.00 C ATOM 966 C GLU A 59 0.452 -4.984 -15.428 1.00 0.00 C ATOM 967 O GLU A 59 0.626 -4.282 -16.423 1.00 0.00 O ATOM 968 CB GLU A 59 -1.354 -6.486 -16.291 1.00 0.00 C ATOM 969 CG GLU A 59 -1.955 -7.880 -16.358 1.00 0.00 C ATOM 970 CD GLU A 59 -1.399 -8.701 -17.504 1.00 0.00 C ATOM 971 OE1 GLU A 59 -1.853 -8.503 -18.651 1.00 0.00 O ATOM 972 OE2 GLU A 59 -0.508 -9.540 -17.256 1.00 0.00 O ATOM 0 H GLU A 59 -0.925 -6.776 -13.706 1.00 0.00 H new ATOM 0 HA GLU A 59 0.732 -6.980 -16.143 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -2.056 -5.820 -15.789 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -1.223 -6.107 -17.304 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -1.765 -8.399 -15.419 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -3.037 -7.800 -16.465 1.00 0.00 H new ATOM 979 N ILE A 60 0.647 -4.546 -14.188 1.00 0.00 N ATOM 980 CA ILE A 60 1.087 -3.182 -13.923 1.00 0.00 C ATOM 981 C ILE A 60 2.606 -3.111 -13.790 1.00 0.00 C ATOM 982 O ILE A 60 3.253 -2.259 -14.397 1.00 0.00 O ATOM 983 CB ILE A 60 0.444 -2.622 -12.641 1.00 0.00 C ATOM 984 CG1 ILE A 60 -1.058 -2.917 -12.626 1.00 0.00 C ATOM 985 CG2 ILE A 60 0.696 -1.125 -12.531 1.00 0.00 C ATOM 986 CD1 ILE A 60 -1.786 -2.289 -11.459 1.00 0.00 C ATOM 0 H ILE A 60 0.507 -5.115 -13.353 1.00 0.00 H new ATOM 0 HA ILE A 60 0.770 -2.577 -14.772 1.00 0.00 H new ATOM 0 HB ILE A 60 0.900 -3.112 -11.781 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -1.500 -2.557 -13.555 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -1.208 -3.996 -12.599 1.00 0.00 H new ATOM 0 HG21 ILE A 60 0.235 -0.744 -11.620 1.00 0.00 H new ATOM 0 HG22 ILE A 60 1.769 -0.938 -12.500 1.00 0.00 H new ATOM 0 HG23 ILE A 60 0.264 -0.619 -13.394 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -2.845 -2.540 -11.513 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -1.371 -2.667 -10.525 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -1.667 -1.206 -11.496 1.00 0.00 H new ATOM 998 N VAL A 61 3.166 -4.013 -12.992 1.00 0.00 N ATOM 999 CA VAL A 61 4.608 -4.056 -12.779 1.00 0.00 C ATOM 1000 C VAL A 61 5.132 -5.486 -12.851 1.00 0.00 C ATOM 1001 O VAL A 61 4.358 -6.437 -12.946 1.00 0.00 O ATOM 1002 CB VAL A 61 4.994 -3.447 -11.418 1.00 0.00 C ATOM 1003 CG1 VAL A 61 4.320 -2.096 -11.227 1.00 0.00 C ATOM 1004 CG2 VAL A 61 4.632 -4.397 -10.288 1.00 0.00 C ATOM 0 H VAL A 61 2.643 -4.725 -12.482 1.00 0.00 H new ATOM 0 HA VAL A 61 5.062 -3.465 -13.574 1.00 0.00 H new ATOM 0 HB VAL A 61 6.073 -3.293 -11.401 1.00 0.00 H new ATOM 0 HG11 VAL A 61 4.604 -1.681 -10.260 1.00 0.00 H new ATOM 0 HG12 VAL A 61 4.634 -1.417 -12.020 1.00 0.00 H new ATOM 0 HG13 VAL A 61 3.238 -2.221 -11.264 1.00 0.00 H new ATOM 0 HG21 VAL A 61 4.912 -3.951 -9.334 1.00 0.00 H new ATOM 0 HG22 VAL A 61 3.558 -4.584 -10.300 1.00 0.00 H new ATOM 0 HG23 VAL A 61 5.166 -5.338 -10.419 1.00 0.00 H new ATOM 1014 N ASP A 62 6.453 -5.628 -12.804 1.00 0.00 N ATOM 1015 CA ASP A 62 7.081 -6.943 -12.863 1.00 0.00 C ATOM 1016 C ASP A 62 8.449 -6.921 -12.186 1.00 0.00 C ATOM 1017 O ASP A 62 9.212 -5.967 -12.335 1.00 0.00 O ATOM 1018 CB ASP A 62 7.224 -7.400 -14.315 1.00 0.00 C ATOM 1019 CG ASP A 62 7.517 -6.250 -15.258 1.00 0.00 C ATOM 1020 OD1 ASP A 62 6.607 -5.427 -15.489 1.00 0.00 O ATOM 1021 OD2 ASP A 62 8.656 -6.173 -15.765 1.00 0.00 O ATOM 0 H ASP A 62 7.108 -4.850 -12.725 1.00 0.00 H new ATOM 0 HA ASP A 62 6.442 -7.648 -12.331 1.00 0.00 H new ATOM 0 HB2 ASP A 62 8.025 -8.136 -14.384 1.00 0.00 H new ATOM 0 HB3 ASP A 62 6.306 -7.898 -14.628 1.00 0.00 H new ATOM 1026 N VAL A 63 8.751 -7.980 -11.442 1.00 0.00 N ATOM 1027 CA VAL A 63 10.027 -8.083 -10.742 1.00 0.00 C ATOM 1028 C VAL A 63 11.164 -7.519 -11.586 1.00 0.00 C ATOM 1029 O VAL A 63 11.462 -8.028 -12.666 1.00 0.00 O ATOM 1030 CB VAL A 63 10.350 -9.544 -10.376 1.00 0.00 C ATOM 1031 CG1 VAL A 63 11.684 -9.630 -9.649 1.00 0.00 C ATOM 1032 CG2 VAL A 63 9.234 -10.141 -9.533 1.00 0.00 C ATOM 0 H VAL A 63 8.130 -8.778 -11.308 1.00 0.00 H new ATOM 0 HA VAL A 63 9.934 -7.499 -9.826 1.00 0.00 H new ATOM 0 HB VAL A 63 10.428 -10.123 -11.297 1.00 0.00 H new ATOM 0 HG11 VAL A 63 11.895 -10.670 -9.398 1.00 0.00 H new ATOM 0 HG12 VAL A 63 12.475 -9.244 -10.292 1.00 0.00 H new ATOM 0 HG13 VAL A 63 11.639 -9.038 -8.735 1.00 0.00 H new ATOM 0 HG21 VAL A 63 9.479 -11.173 -9.284 1.00 0.00 H new ATOM 0 HG22 VAL A 63 9.122 -9.563 -8.616 1.00 0.00 H new ATOM 0 HG23 VAL A 63 8.300 -10.115 -10.095 1.00 0.00 H new ATOM 1042 N GLY A 64 11.798 -6.462 -11.086 1.00 0.00 N ATOM 1043 CA GLY A 64 12.896 -5.845 -11.807 1.00 0.00 C ATOM 1044 C GLY A 64 12.606 -4.406 -12.183 1.00 0.00 C ATOM 1045 O GLY A 64 13.525 -3.630 -12.450 1.00 0.00 O ATOM 0 H GLY A 64 11.570 -6.022 -10.194 1.00 0.00 H new ATOM 0 HA2 GLY A 64 13.796 -5.883 -11.194 1.00 0.00 H new ATOM 0 HA3 GLY A 64 13.102 -6.419 -12.710 1.00 0.00 H new ATOM 1049 N ASP A 65 11.327 -4.048 -12.209 1.00 0.00 N ATOM 1050 CA ASP A 65 10.919 -2.692 -12.556 1.00 0.00 C ATOM 1051 C ASP A 65 10.983 -1.776 -11.339 1.00 0.00 C ATOM 1052 O ASP A 65 10.426 -2.086 -10.285 1.00 0.00 O ATOM 1053 CB ASP A 65 9.501 -2.696 -13.133 1.00 0.00 C ATOM 1054 CG ASP A 65 9.414 -3.445 -14.448 1.00 0.00 C ATOM 1055 OD1 ASP A 65 10.086 -4.488 -14.583 1.00 0.00 O ATOM 1056 OD2 ASP A 65 8.671 -2.989 -15.342 1.00 0.00 O ATOM 0 H ASP A 65 10.555 -4.678 -11.994 1.00 0.00 H new ATOM 0 HA ASP A 65 11.610 -2.313 -13.309 1.00 0.00 H new ATOM 0 HB2 ASP A 65 8.820 -3.151 -12.413 1.00 0.00 H new ATOM 0 HB3 ASP A 65 9.169 -1.668 -13.281 1.00 0.00 H new ATOM 1061 N LYS A 66 11.667 -0.646 -11.490 1.00 0.00 N ATOM 1062 CA LYS A 66 11.805 0.316 -10.404 1.00 0.00 C ATOM 1063 C LYS A 66 10.726 1.391 -10.489 1.00 0.00 C ATOM 1064 O LYS A 66 10.491 1.966 -11.551 1.00 0.00 O ATOM 1065 CB LYS A 66 13.190 0.964 -10.443 1.00 0.00 C ATOM 1066 CG LYS A 66 13.299 2.219 -9.594 1.00 0.00 C ATOM 1067 CD LYS A 66 14.748 2.606 -9.352 1.00 0.00 C ATOM 1068 CE LYS A 66 15.265 3.537 -10.437 1.00 0.00 C ATOM 1069 NZ LYS A 66 15.868 2.786 -11.572 1.00 0.00 N ATOM 0 H LYS A 66 12.134 -0.375 -12.355 1.00 0.00 H new ATOM 0 HA LYS A 66 11.687 -0.218 -9.461 1.00 0.00 H new ATOM 0 HB2 LYS A 66 13.930 0.240 -10.103 1.00 0.00 H new ATOM 0 HB3 LYS A 66 13.437 1.211 -11.475 1.00 0.00 H new ATOM 0 HG2 LYS A 66 12.780 3.040 -10.089 1.00 0.00 H new ATOM 0 HG3 LYS A 66 12.801 2.057 -8.638 1.00 0.00 H new ATOM 0 HD2 LYS A 66 14.838 3.092 -8.381 1.00 0.00 H new ATOM 0 HD3 LYS A 66 15.365 1.708 -9.318 1.00 0.00 H new ATOM 0 HE2 LYS A 66 14.446 4.155 -10.805 1.00 0.00 H new ATOM 0 HE3 LYS A 66 16.008 4.212 -10.012 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 16.888 2.984 -11.616 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 15.719 1.766 -11.432 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 15.419 3.083 -12.462 1.00 0.00 H new ATOM 1083 N VAL A 67 10.074 1.659 -9.362 1.00 0.00 N ATOM 1084 CA VAL A 67 9.022 2.666 -9.308 1.00 0.00 C ATOM 1085 C VAL A 67 9.088 3.461 -8.009 1.00 0.00 C ATOM 1086 O VAL A 67 9.825 3.107 -7.089 1.00 0.00 O ATOM 1087 CB VAL A 67 7.626 2.029 -9.436 1.00 0.00 C ATOM 1088 CG1 VAL A 67 7.483 1.321 -10.775 1.00 0.00 C ATOM 1089 CG2 VAL A 67 7.373 1.066 -8.285 1.00 0.00 C ATOM 0 H VAL A 67 10.256 1.192 -8.474 1.00 0.00 H new ATOM 0 HA VAL A 67 9.185 3.338 -10.151 1.00 0.00 H new ATOM 0 HB VAL A 67 6.878 2.821 -9.389 1.00 0.00 H new ATOM 0 HG11 VAL A 67 6.490 0.877 -10.848 1.00 0.00 H new ATOM 0 HG12 VAL A 67 7.619 2.040 -11.583 1.00 0.00 H new ATOM 0 HG13 VAL A 67 8.237 0.538 -10.855 1.00 0.00 H new ATOM 0 HG21 VAL A 67 6.382 0.625 -8.391 1.00 0.00 H new ATOM 0 HG22 VAL A 67 8.125 0.277 -8.299 1.00 0.00 H new ATOM 0 HG23 VAL A 67 7.431 1.606 -7.340 1.00 0.00 H new ATOM 1099 N TRP A 68 8.313 4.538 -7.941 1.00 0.00 N ATOM 1100 CA TRP A 68 8.283 5.384 -6.753 1.00 0.00 C ATOM 1101 C TRP A 68 7.091 5.036 -5.867 1.00 0.00 C ATOM 1102 O TRP A 68 5.966 4.903 -6.348 1.00 0.00 O ATOM 1103 CB TRP A 68 8.223 6.859 -7.154 1.00 0.00 C ATOM 1104 CG TRP A 68 9.493 7.358 -7.771 1.00 0.00 C ATOM 1105 CD1 TRP A 68 9.748 7.521 -9.103 1.00 0.00 C ATOM 1106 CD2 TRP A 68 10.683 7.758 -7.082 1.00 0.00 C ATOM 1107 NE1 TRP A 68 11.025 7.997 -9.283 1.00 0.00 N ATOM 1108 CE2 TRP A 68 11.618 8.153 -8.058 1.00 0.00 C ATOM 1109 CE3 TRP A 68 11.048 7.824 -5.734 1.00 0.00 C ATOM 1110 CZ2 TRP A 68 12.893 8.604 -7.728 1.00 0.00 C ATOM 1111 CZ3 TRP A 68 12.313 8.272 -5.408 1.00 0.00 C ATOM 1112 CH2 TRP A 68 13.223 8.657 -6.401 1.00 0.00 C ATOM 0 H TRP A 68 7.698 4.846 -8.694 1.00 0.00 H new ATOM 0 HA TRP A 68 9.197 5.206 -6.187 1.00 0.00 H new ATOM 0 HB2 TRP A 68 7.404 7.004 -7.858 1.00 0.00 H new ATOM 0 HB3 TRP A 68 7.995 7.459 -6.273 1.00 0.00 H new ATOM 0 HD1 TRP A 68 9.049 7.307 -9.898 1.00 0.00 H new ATOM 0 HE1 TRP A 68 11.460 8.201 -10.183 1.00 0.00 H new ATOM 0 HE3 TRP A 68 10.353 7.530 -4.961 1.00 0.00 H new ATOM 0 HZ2 TRP A 68 13.596 8.901 -8.492 1.00 0.00 H new ATOM 0 HZ3 TRP A 68 12.606 8.326 -4.370 1.00 0.00 H new ATOM 0 HH2 TRP A 68 14.205 9.003 -6.113 1.00 0.00 H new ATOM 1123 N VAL A 69 7.346 4.891 -4.571 1.00 0.00 N ATOM 1124 CA VAL A 69 6.293 4.560 -3.617 1.00 0.00 C ATOM 1125 C VAL A 69 6.343 5.479 -2.402 1.00 0.00 C ATOM 1126 O VAL A 69 7.349 6.146 -2.155 1.00 0.00 O ATOM 1127 CB VAL A 69 6.403 3.097 -3.145 1.00 0.00 C ATOM 1128 CG1 VAL A 69 6.080 2.143 -4.284 1.00 0.00 C ATOM 1129 CG2 VAL A 69 7.790 2.821 -2.585 1.00 0.00 C ATOM 0 H VAL A 69 8.272 4.997 -4.157 1.00 0.00 H new ATOM 0 HA VAL A 69 5.343 4.697 -4.134 1.00 0.00 H new ATOM 0 HB VAL A 69 5.676 2.934 -2.349 1.00 0.00 H new ATOM 0 HG11 VAL A 69 6.163 1.115 -3.932 1.00 0.00 H new ATOM 0 HG12 VAL A 69 5.064 2.326 -4.635 1.00 0.00 H new ATOM 0 HG13 VAL A 69 6.781 2.304 -5.103 1.00 0.00 H new ATOM 0 HG21 VAL A 69 7.850 1.783 -2.256 1.00 0.00 H new ATOM 0 HG22 VAL A 69 8.537 3.000 -3.358 1.00 0.00 H new ATOM 0 HG23 VAL A 69 7.979 3.481 -1.738 1.00 0.00 H new ATOM 1139 N LYS A 70 5.251 5.511 -1.646 1.00 0.00 N ATOM 1140 CA LYS A 70 5.170 6.348 -0.455 1.00 0.00 C ATOM 1141 C LYS A 70 4.558 5.577 0.710 1.00 0.00 C ATOM 1142 O LYS A 70 3.537 4.904 0.557 1.00 0.00 O ATOM 1143 CB LYS A 70 4.339 7.600 -0.742 1.00 0.00 C ATOM 1144 CG LYS A 70 4.175 8.512 0.461 1.00 0.00 C ATOM 1145 CD LYS A 70 2.861 9.274 0.411 1.00 0.00 C ATOM 1146 CE LYS A 70 1.681 8.371 0.736 1.00 0.00 C ATOM 1147 NZ LYS A 70 0.387 8.980 0.321 1.00 0.00 N ATOM 0 H LYS A 70 4.410 4.967 -1.837 1.00 0.00 H new ATOM 0 HA LYS A 70 6.182 6.645 -0.181 1.00 0.00 H new ATOM 0 HB2 LYS A 70 4.809 8.160 -1.550 1.00 0.00 H new ATOM 0 HB3 LYS A 70 3.353 7.298 -1.095 1.00 0.00 H new ATOM 0 HG2 LYS A 70 4.218 7.920 1.375 1.00 0.00 H new ATOM 0 HG3 LYS A 70 5.004 9.218 0.499 1.00 0.00 H new ATOM 0 HD2 LYS A 70 2.892 10.102 1.119 1.00 0.00 H new ATOM 0 HD3 LYS A 70 2.727 9.707 -0.581 1.00 0.00 H new ATOM 0 HE2 LYS A 70 1.809 7.412 0.234 1.00 0.00 H new ATOM 0 HE3 LYS A 70 1.661 8.170 1.807 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -0.293 8.227 0.091 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 0.011 9.560 1.098 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 0.538 9.578 -0.516 1.00 0.00 H new ATOM 1161 N LEU A 71 5.187 5.678 1.876 1.00 0.00 N ATOM 1162 CA LEU A 71 4.705 4.990 3.068 1.00 0.00 C ATOM 1163 C LEU A 71 3.389 5.594 3.550 1.00 0.00 C ATOM 1164 O LEU A 71 3.274 6.810 3.708 1.00 0.00 O ATOM 1165 CB LEU A 71 5.750 5.065 4.183 1.00 0.00 C ATOM 1166 CG LEU A 71 5.523 4.141 5.380 1.00 0.00 C ATOM 1167 CD1 LEU A 71 5.983 2.728 5.058 1.00 0.00 C ATOM 1168 CD2 LEU A 71 6.246 4.673 6.609 1.00 0.00 C ATOM 0 H LEU A 71 6.032 6.230 2.021 1.00 0.00 H new ATOM 0 HA LEU A 71 4.533 3.945 2.809 1.00 0.00 H new ATOM 0 HB2 LEU A 71 6.726 4.838 3.754 1.00 0.00 H new ATOM 0 HB3 LEU A 71 5.792 6.092 4.545 1.00 0.00 H new ATOM 0 HG LEU A 71 4.455 4.113 5.596 1.00 0.00 H new ATOM 0 HD11 LEU A 71 5.814 2.085 5.921 1.00 0.00 H new ATOM 0 HD12 LEU A 71 5.420 2.347 4.206 1.00 0.00 H new ATOM 0 HD13 LEU A 71 7.046 2.738 4.816 1.00 0.00 H new ATOM 0 HD21 LEU A 71 6.073 4.003 7.451 1.00 0.00 H new ATOM 0 HD22 LEU A 71 7.315 4.732 6.405 1.00 0.00 H new ATOM 0 HD23 LEU A 71 5.868 5.666 6.852 1.00 0.00 H new ATOM 1180 N ILE A 72 2.402 4.736 3.783 1.00 0.00 N ATOM 1181 CA ILE A 72 1.096 5.185 4.250 1.00 0.00 C ATOM 1182 C ILE A 72 0.820 4.694 5.667 1.00 0.00 C ATOM 1183 O ILE A 72 0.038 5.296 6.403 1.00 0.00 O ATOM 1184 CB ILE A 72 -0.032 4.698 3.321 1.00 0.00 C ATOM 1185 CG1 ILE A 72 -0.061 3.168 3.277 1.00 0.00 C ATOM 1186 CG2 ILE A 72 0.149 5.269 1.923 1.00 0.00 C ATOM 1187 CD1 ILE A 72 -1.051 2.611 2.278 1.00 0.00 C ATOM 0 H ILE A 72 2.481 3.727 3.656 1.00 0.00 H new ATOM 0 HA ILE A 72 1.116 6.275 4.243 1.00 0.00 H new ATOM 0 HB ILE A 72 -0.985 5.050 3.716 1.00 0.00 H new ATOM 0 HG12 ILE A 72 0.936 2.801 3.032 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -0.306 2.789 4.269 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -0.656 4.916 1.279 1.00 0.00 H new ATOM 0 HG22 ILE A 72 0.126 6.358 1.969 1.00 0.00 H new ATOM 0 HG23 ILE A 72 1.107 4.943 1.518 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -1.017 1.522 2.301 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -2.055 2.949 2.534 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -0.795 2.961 1.278 1.00 0.00 H new ATOM 1199 N GLY A 73 1.469 3.597 6.045 1.00 0.00 N ATOM 1200 CA GLY A 73 1.282 3.045 7.374 1.00 0.00 C ATOM 1201 C GLY A 73 2.415 2.124 7.784 1.00 0.00 C ATOM 1202 O GLY A 73 2.569 1.035 7.231 1.00 0.00 O ATOM 0 H GLY A 73 2.121 3.081 5.454 1.00 0.00 H new ATOM 0 HA2 GLY A 73 1.201 3.859 8.094 1.00 0.00 H new ATOM 0 HA3 GLY A 73 0.341 2.496 7.407 1.00 0.00 H new ATOM 1206 N ARG A 74 3.210 2.564 8.753 1.00 0.00 N ATOM 1207 CA ARG A 74 4.336 1.773 9.234 1.00 0.00 C ATOM 1208 C ARG A 74 4.037 1.180 10.609 1.00 0.00 C ATOM 1209 O ARG A 74 3.665 1.899 11.536 1.00 0.00 O ATOM 1210 CB ARG A 74 5.600 2.632 9.301 1.00 0.00 C ATOM 1211 CG ARG A 74 5.480 3.818 10.245 1.00 0.00 C ATOM 1212 CD ARG A 74 6.772 4.618 10.301 1.00 0.00 C ATOM 1213 NE ARG A 74 7.681 4.120 11.329 1.00 0.00 N ATOM 1214 CZ ARG A 74 8.726 4.804 11.781 1.00 0.00 C ATOM 1215 NH1 ARG A 74 8.992 6.010 11.298 1.00 0.00 N ATOM 1216 NH2 ARG A 74 9.507 4.283 12.719 1.00 0.00 N ATOM 0 H ARG A 74 3.096 3.463 9.220 1.00 0.00 H new ATOM 0 HA ARG A 74 4.498 0.955 8.532 1.00 0.00 H new ATOM 0 HB2 ARG A 74 6.436 2.009 9.618 1.00 0.00 H new ATOM 0 HB3 ARG A 74 5.835 2.996 8.301 1.00 0.00 H new ATOM 0 HG2 ARG A 74 4.665 4.464 9.918 1.00 0.00 H new ATOM 0 HG3 ARG A 74 5.226 3.465 11.244 1.00 0.00 H new ATOM 0 HD2 ARG A 74 7.266 4.577 9.330 1.00 0.00 H new ATOM 0 HD3 ARG A 74 6.542 5.665 10.498 1.00 0.00 H new ATOM 0 HE ARG A 74 7.504 3.196 11.722 1.00 0.00 H new ATOM 0 HH11 ARG A 74 8.394 6.414 10.578 1.00 0.00 H new ATOM 0 HH12 ARG A 74 9.795 6.533 11.647 1.00 0.00 H new ATOM 0 HH21 ARG A 74 9.305 3.356 13.094 1.00 0.00 H new ATOM 0 HH22 ARG A 74 10.309 4.809 13.065 1.00 0.00 H new ATOM 1230 N GLU A 75 4.203 -0.132 10.731 1.00 0.00 N ATOM 1231 CA GLU A 75 3.948 -0.819 11.992 1.00 0.00 C ATOM 1232 C GLU A 75 5.035 -1.851 12.278 1.00 0.00 C ATOM 1233 O GLU A 75 5.290 -2.741 11.467 1.00 0.00 O ATOM 1234 CB GLU A 75 2.579 -1.501 11.961 1.00 0.00 C ATOM 1235 CG GLU A 75 1.438 -0.595 12.394 1.00 0.00 C ATOM 1236 CD GLU A 75 0.194 -1.370 12.783 1.00 0.00 C ATOM 1237 OE1 GLU A 75 0.288 -2.233 13.680 1.00 0.00 O ATOM 1238 OE2 GLU A 75 -0.874 -1.111 12.190 1.00 0.00 O ATOM 0 H GLU A 75 4.513 -0.741 9.973 1.00 0.00 H new ATOM 0 HA GLU A 75 3.957 -0.075 12.789 1.00 0.00 H new ATOM 0 HB2 GLU A 75 2.384 -1.859 10.950 1.00 0.00 H new ATOM 0 HB3 GLU A 75 2.604 -2.376 12.610 1.00 0.00 H new ATOM 0 HG2 GLU A 75 1.762 0.013 13.239 1.00 0.00 H new ATOM 0 HG3 GLU A 75 1.195 0.091 11.582 1.00 0.00 H new ATOM 1245 N MET A 76 5.673 -1.725 13.437 1.00 0.00 N ATOM 1246 CA MET A 76 6.733 -2.646 13.830 1.00 0.00 C ATOM 1247 C MET A 76 6.344 -3.417 15.088 1.00 0.00 C ATOM 1248 O MET A 76 6.184 -2.834 16.161 1.00 0.00 O ATOM 1249 CB MET A 76 8.039 -1.886 14.067 1.00 0.00 C ATOM 1250 CG MET A 76 8.494 -1.071 12.867 1.00 0.00 C ATOM 1251 SD MET A 76 9.872 0.025 13.254 1.00 0.00 S ATOM 1252 CE MET A 76 11.211 -1.156 13.406 1.00 0.00 C ATOM 0 H MET A 76 5.474 -0.994 14.120 1.00 0.00 H new ATOM 0 HA MET A 76 6.879 -3.359 13.018 1.00 0.00 H new ATOM 0 HB2 MET A 76 7.913 -1.221 14.921 1.00 0.00 H new ATOM 0 HB3 MET A 76 8.821 -2.598 14.330 1.00 0.00 H new ATOM 0 HG2 MET A 76 8.787 -1.747 12.064 1.00 0.00 H new ATOM 0 HG3 MET A 76 7.657 -0.479 12.496 1.00 0.00 H new ATOM 0 HE1 MET A 76 12.150 -0.624 13.557 1.00 0.00 H new ATOM 0 HE2 MET A 76 11.024 -1.810 14.258 1.00 0.00 H new ATOM 0 HE3 MET A 76 11.274 -1.753 12.496 1.00 0.00 H new ATOM 1262 N LYS A 77 6.193 -4.729 14.950 1.00 0.00 N ATOM 1263 CA LYS A 77 5.824 -5.581 16.075 1.00 0.00 C ATOM 1264 C LYS A 77 6.943 -6.564 16.404 1.00 0.00 C ATOM 1265 O LYS A 77 7.627 -7.061 15.511 1.00 0.00 O ATOM 1266 CB LYS A 77 4.535 -6.345 15.762 1.00 0.00 C ATOM 1267 CG LYS A 77 3.825 -6.871 16.998 1.00 0.00 C ATOM 1268 CD LYS A 77 3.006 -5.786 17.676 1.00 0.00 C ATOM 1269 CE LYS A 77 1.634 -5.640 17.035 1.00 0.00 C ATOM 1270 NZ LYS A 77 0.756 -6.805 17.335 1.00 0.00 N ATOM 0 H LYS A 77 6.321 -5.227 14.069 1.00 0.00 H new ATOM 0 HA LYS A 77 5.659 -4.942 16.943 1.00 0.00 H new ATOM 0 HB2 LYS A 77 3.857 -5.689 15.215 1.00 0.00 H new ATOM 0 HB3 LYS A 77 4.769 -7.182 15.104 1.00 0.00 H new ATOM 0 HG2 LYS A 77 3.173 -7.699 16.719 1.00 0.00 H new ATOM 0 HG3 LYS A 77 4.559 -7.266 17.700 1.00 0.00 H new ATOM 0 HD2 LYS A 77 2.891 -6.023 18.734 1.00 0.00 H new ATOM 0 HD3 LYS A 77 3.539 -4.837 17.618 1.00 0.00 H new ATOM 0 HE2 LYS A 77 1.161 -4.726 17.394 1.00 0.00 H new ATOM 0 HE3 LYS A 77 1.746 -5.538 15.956 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -0.238 -6.537 17.188 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 0.999 -7.595 16.704 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 0.893 -7.097 18.324 1.00 0.00 H new ATOM 1284 N ASN A 78 7.121 -6.840 17.692 1.00 0.00 N ATOM 1285 CA ASN A 78 8.156 -7.765 18.138 1.00 0.00 C ATOM 1286 C ASN A 78 7.945 -9.151 17.535 1.00 0.00 C ATOM 1287 O ASN A 78 8.835 -10.000 17.576 1.00 0.00 O ATOM 1288 CB ASN A 78 8.164 -7.857 19.665 1.00 0.00 C ATOM 1289 CG ASN A 78 6.886 -8.460 20.215 1.00 0.00 C ATOM 1290 OD1 ASN A 78 5.798 -7.917 20.023 1.00 0.00 O ATOM 1291 ND2 ASN A 78 7.012 -9.588 20.902 1.00 0.00 N ATOM 0 H ASN A 78 6.562 -6.437 18.444 1.00 0.00 H new ATOM 0 HA ASN A 78 9.119 -7.384 17.798 1.00 0.00 H new ATOM 0 HB2 ASN A 78 9.014 -8.460 19.985 1.00 0.00 H new ATOM 0 HB3 ASN A 78 8.303 -6.861 20.085 1.00 0.00 H new ATOM 0 HD21 ASN A 78 6.187 -10.040 21.296 1.00 0.00 H new ATOM 0 HD22 ASN A 78 7.934 -10.003 21.036 1.00 0.00 H new ATOM 1298 N ASP A 79 6.761 -9.372 16.976 1.00 0.00 N ATOM 1299 CA ASP A 79 6.432 -10.653 16.362 1.00 0.00 C ATOM 1300 C ASP A 79 6.648 -10.605 14.854 1.00 0.00 C ATOM 1301 O ASP A 79 6.950 -11.621 14.227 1.00 0.00 O ATOM 1302 CB ASP A 79 4.983 -11.033 16.671 1.00 0.00 C ATOM 1303 CG ASP A 79 4.739 -11.231 18.153 1.00 0.00 C ATOM 1304 OD1 ASP A 79 5.513 -11.978 18.788 1.00 0.00 O ATOM 1305 OD2 ASP A 79 3.774 -10.639 18.680 1.00 0.00 O ATOM 0 H ASP A 79 6.012 -8.680 16.935 1.00 0.00 H new ATOM 0 HA ASP A 79 7.095 -11.410 16.781 1.00 0.00 H new ATOM 0 HB2 ASP A 79 4.319 -10.254 16.298 1.00 0.00 H new ATOM 0 HB3 ASP A 79 4.730 -11.950 16.139 1.00 0.00 H new ATOM 1310 N ARG A 80 6.492 -9.419 14.276 1.00 0.00 N ATOM 1311 CA ARG A 80 6.668 -9.239 12.839 1.00 0.00 C ATOM 1312 C ARG A 80 6.548 -7.767 12.457 1.00 0.00 C ATOM 1313 O ARG A 80 5.937 -6.976 13.177 1.00 0.00 O ATOM 1314 CB ARG A 80 5.633 -10.063 12.070 1.00 0.00 C ATOM 1315 CG ARG A 80 4.220 -9.517 12.175 1.00 0.00 C ATOM 1316 CD ARG A 80 3.257 -10.287 11.286 1.00 0.00 C ATOM 1317 NE ARG A 80 3.792 -10.483 9.941 1.00 0.00 N ATOM 1318 CZ ARG A 80 4.590 -11.493 9.607 1.00 0.00 C ATOM 1319 NH1 ARG A 80 4.943 -12.391 10.516 1.00 0.00 N ATOM 1320 NH2 ARG A 80 5.036 -11.603 8.362 1.00 0.00 N ATOM 0 H ARG A 80 6.244 -8.568 14.780 1.00 0.00 H new ATOM 0 HA ARG A 80 7.667 -9.585 12.574 1.00 0.00 H new ATOM 0 HB2 ARG A 80 5.921 -10.103 11.019 1.00 0.00 H new ATOM 0 HB3 ARG A 80 5.646 -11.087 12.443 1.00 0.00 H new ATOM 0 HG2 ARG A 80 3.884 -9.572 13.210 1.00 0.00 H new ATOM 0 HG3 ARG A 80 4.214 -8.464 11.893 1.00 0.00 H new ATOM 0 HD2 ARG A 80 3.044 -11.257 11.736 1.00 0.00 H new ATOM 0 HD3 ARG A 80 2.311 -9.749 11.225 1.00 0.00 H new ATOM 0 HE ARG A 80 3.540 -9.808 9.219 1.00 0.00 H new ATOM 0 HH11 ARG A 80 4.602 -12.308 11.474 1.00 0.00 H new ATOM 0 HH12 ARG A 80 5.555 -13.165 10.258 1.00 0.00 H new ATOM 0 HH21 ARG A 80 4.767 -10.913 7.661 1.00 0.00 H new ATOM 0 HH22 ARG A 80 5.648 -12.378 8.106 1.00 0.00 H new ATOM 1334 N ILE A 81 7.134 -7.406 11.321 1.00 0.00 N ATOM 1335 CA ILE A 81 7.092 -6.029 10.843 1.00 0.00 C ATOM 1336 C ILE A 81 6.195 -5.900 9.617 1.00 0.00 C ATOM 1337 O ILE A 81 6.295 -6.686 8.674 1.00 0.00 O ATOM 1338 CB ILE A 81 8.500 -5.512 10.492 1.00 0.00 C ATOM 1339 CG1 ILE A 81 9.302 -5.247 11.768 1.00 0.00 C ATOM 1340 CG2 ILE A 81 8.404 -4.251 9.648 1.00 0.00 C ATOM 1341 CD1 ILE A 81 10.783 -5.069 11.524 1.00 0.00 C ATOM 0 H ILE A 81 7.644 -8.048 10.714 1.00 0.00 H new ATOM 0 HA ILE A 81 6.684 -5.426 11.654 1.00 0.00 H new ATOM 0 HB ILE A 81 9.019 -6.275 9.912 1.00 0.00 H new ATOM 0 HG12 ILE A 81 8.912 -4.352 12.254 1.00 0.00 H new ATOM 0 HG13 ILE A 81 9.153 -6.076 12.460 1.00 0.00 H new ATOM 0 HG21 ILE A 81 9.406 -3.897 9.408 1.00 0.00 H new ATOM 0 HG22 ILE A 81 7.866 -4.470 8.726 1.00 0.00 H new ATOM 0 HG23 ILE A 81 7.871 -3.480 10.205 1.00 0.00 H new ATOM 0 HD11 ILE A 81 11.288 -4.885 12.472 1.00 0.00 H new ATOM 0 HD12 ILE A 81 11.188 -5.972 11.067 1.00 0.00 H new ATOM 0 HD13 ILE A 81 10.943 -4.222 10.857 1.00 0.00 H new ATOM 1353 N LYS A 82 5.318 -4.902 9.635 1.00 0.00 N ATOM 1354 CA LYS A 82 4.403 -4.667 8.524 1.00 0.00 C ATOM 1355 C LYS A 82 4.571 -3.255 7.972 1.00 0.00 C ATOM 1356 O LYS A 82 4.440 -2.272 8.701 1.00 0.00 O ATOM 1357 CB LYS A 82 2.956 -4.881 8.973 1.00 0.00 C ATOM 1358 CG LYS A 82 2.520 -6.336 8.945 1.00 0.00 C ATOM 1359 CD LYS A 82 2.846 -7.040 10.253 1.00 0.00 C ATOM 1360 CE LYS A 82 1.768 -6.800 11.298 1.00 0.00 C ATOM 1361 NZ LYS A 82 0.520 -7.553 10.992 1.00 0.00 N ATOM 0 H LYS A 82 5.221 -4.243 10.407 1.00 0.00 H new ATOM 0 HA LYS A 82 4.640 -5.379 7.734 1.00 0.00 H new ATOM 0 HB2 LYS A 82 2.837 -4.494 9.985 1.00 0.00 H new ATOM 0 HB3 LYS A 82 2.295 -4.300 8.330 1.00 0.00 H new ATOM 0 HG2 LYS A 82 1.448 -6.392 8.758 1.00 0.00 H new ATOM 0 HG3 LYS A 82 3.015 -6.850 8.121 1.00 0.00 H new ATOM 0 HD2 LYS A 82 2.950 -8.110 10.075 1.00 0.00 H new ATOM 0 HD3 LYS A 82 3.805 -6.685 10.630 1.00 0.00 H new ATOM 0 HE2 LYS A 82 2.140 -7.097 12.278 1.00 0.00 H new ATOM 0 HE3 LYS A 82 1.545 -5.734 11.351 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 0.024 -7.778 11.878 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -0.096 -6.973 10.388 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 0.760 -8.435 10.496 1.00 0.00 H new ATOM 1375 N VAL A 83 4.861 -3.162 6.678 1.00 0.00 N ATOM 1376 CA VAL A 83 5.044 -1.869 6.026 1.00 0.00 C ATOM 1377 C VAL A 83 4.058 -1.687 4.878 1.00 0.00 C ATOM 1378 O VAL A 83 3.889 -2.578 4.045 1.00 0.00 O ATOM 1379 CB VAL A 83 6.479 -1.711 5.487 1.00 0.00 C ATOM 1380 CG1 VAL A 83 6.583 -0.478 4.602 1.00 0.00 C ATOM 1381 CG2 VAL A 83 7.474 -1.638 6.636 1.00 0.00 C ATOM 0 H VAL A 83 4.974 -3.966 6.060 1.00 0.00 H new ATOM 0 HA VAL A 83 4.861 -1.105 6.781 1.00 0.00 H new ATOM 0 HB VAL A 83 6.721 -2.585 4.882 1.00 0.00 H new ATOM 0 HG11 VAL A 83 7.603 -0.382 4.230 1.00 0.00 H new ATOM 0 HG12 VAL A 83 5.898 -0.576 3.760 1.00 0.00 H new ATOM 0 HG13 VAL A 83 6.323 0.408 5.181 1.00 0.00 H new ATOM 0 HG21 VAL A 83 8.482 -1.527 6.238 1.00 0.00 H new ATOM 0 HG22 VAL A 83 7.237 -0.783 7.269 1.00 0.00 H new ATOM 0 HG23 VAL A 83 7.416 -2.553 7.226 1.00 0.00 H new ATOM 1391 N SER A 84 3.410 -0.528 4.840 1.00 0.00 N ATOM 1392 CA SER A 84 2.437 -0.230 3.795 1.00 0.00 C ATOM 1393 C SER A 84 2.968 0.843 2.849 1.00 0.00 C ATOM 1394 O SER A 84 3.375 1.922 3.280 1.00 0.00 O ATOM 1395 CB SER A 84 1.116 0.228 4.414 1.00 0.00 C ATOM 1396 OG SER A 84 0.017 -0.126 3.593 1.00 0.00 O ATOM 0 H SER A 84 3.541 0.221 5.520 1.00 0.00 H new ATOM 0 HA SER A 84 2.264 -1.142 3.223 1.00 0.00 H new ATOM 0 HB2 SER A 84 0.997 -0.222 5.399 1.00 0.00 H new ATOM 0 HB3 SER A 84 1.133 1.308 4.557 1.00 0.00 H new ATOM 0 HG SER A 84 -0.809 0.232 3.980 1.00 0.00 H new ATOM 1402 N LEU A 85 2.960 0.538 1.556 1.00 0.00 N ATOM 1403 CA LEU A 85 3.440 1.476 0.546 1.00 0.00 C ATOM 1404 C LEU A 85 2.380 1.713 -0.524 1.00 0.00 C ATOM 1405 O LEU A 85 1.527 0.860 -0.767 1.00 0.00 O ATOM 1406 CB LEU A 85 4.724 0.948 -0.098 1.00 0.00 C ATOM 1407 CG LEU A 85 5.805 0.456 0.864 1.00 0.00 C ATOM 1408 CD1 LEU A 85 7.000 -0.084 0.094 1.00 0.00 C ATOM 1409 CD2 LEU A 85 6.234 1.576 1.802 1.00 0.00 C ATOM 0 H LEU A 85 2.627 -0.351 1.182 1.00 0.00 H new ATOM 0 HA LEU A 85 3.651 2.426 1.037 1.00 0.00 H new ATOM 0 HB2 LEU A 85 4.461 0.128 -0.767 1.00 0.00 H new ATOM 0 HB3 LEU A 85 5.149 1.739 -0.716 1.00 0.00 H new ATOM 0 HG LEU A 85 5.389 -0.354 1.463 1.00 0.00 H new ATOM 0 HD11 LEU A 85 7.759 -0.430 0.796 1.00 0.00 H new ATOM 0 HD12 LEU A 85 6.682 -0.915 -0.535 1.00 0.00 H new ATOM 0 HD13 LEU A 85 7.417 0.705 -0.532 1.00 0.00 H new ATOM 0 HD21 LEU A 85 7.004 1.208 2.480 1.00 0.00 H new ATOM 0 HD22 LEU A 85 6.631 2.407 1.219 1.00 0.00 H new ATOM 0 HD23 LEU A 85 5.374 1.916 2.380 1.00 0.00 H new ATOM 1421 N SER A 86 2.442 2.877 -1.163 1.00 0.00 N ATOM 1422 CA SER A 86 1.487 3.228 -2.208 1.00 0.00 C ATOM 1423 C SER A 86 2.204 3.754 -3.446 1.00 0.00 C ATOM 1424 O SER A 86 3.311 4.285 -3.357 1.00 0.00 O ATOM 1425 CB SER A 86 0.499 4.276 -1.692 1.00 0.00 C ATOM 1426 OG SER A 86 -0.459 3.693 -0.825 1.00 0.00 O ATOM 0 H SER A 86 3.144 3.593 -0.975 1.00 0.00 H new ATOM 0 HA SER A 86 0.940 2.327 -2.484 1.00 0.00 H new ATOM 0 HB2 SER A 86 1.040 5.062 -1.165 1.00 0.00 H new ATOM 0 HB3 SER A 86 -0.008 4.748 -2.534 1.00 0.00 H new ATOM 0 HG SER A 86 -1.359 3.845 -1.182 1.00 0.00 H new ATOM 1432 N MET A 87 1.566 3.601 -4.602 1.00 0.00 N ATOM 1433 CA MET A 87 2.142 4.063 -5.860 1.00 0.00 C ATOM 1434 C MET A 87 1.216 5.058 -6.550 1.00 0.00 C ATOM 1435 O MET A 87 1.669 5.945 -7.273 1.00 0.00 O ATOM 1436 CB MET A 87 2.416 2.875 -6.785 1.00 0.00 C ATOM 1437 CG MET A 87 3.564 1.994 -6.320 1.00 0.00 C ATOM 1438 SD MET A 87 3.407 0.291 -6.891 1.00 0.00 S ATOM 1439 CE MET A 87 3.825 0.473 -8.622 1.00 0.00 C ATOM 0 H MET A 87 0.650 3.161 -4.694 1.00 0.00 H new ATOM 0 HA MET A 87 3.083 4.566 -5.638 1.00 0.00 H new ATOM 0 HB2 MET A 87 1.513 2.270 -6.862 1.00 0.00 H new ATOM 0 HB3 MET A 87 2.637 3.247 -7.785 1.00 0.00 H new ATOM 0 HG2 MET A 87 4.505 2.409 -6.681 1.00 0.00 H new ATOM 0 HG3 MET A 87 3.608 2.006 -5.231 1.00 0.00 H new ATOM 0 HE1 MET A 87 2.945 0.268 -9.232 1.00 0.00 H new ATOM 0 HE2 MET A 87 4.167 1.491 -8.809 1.00 0.00 H new ATOM 0 HE3 MET A 87 4.617 -0.229 -8.881 1.00 0.00 H new ATOM 1449 N LYS A 88 -0.084 4.904 -6.324 1.00 0.00 N ATOM 1450 CA LYS A 88 -1.076 5.789 -6.924 1.00 0.00 C ATOM 1451 C LYS A 88 -0.966 7.197 -6.349 1.00 0.00 C ATOM 1452 O LYS A 88 -1.614 8.128 -6.830 1.00 0.00 O ATOM 1453 CB LYS A 88 -2.486 5.240 -6.691 1.00 0.00 C ATOM 1454 CG LYS A 88 -3.003 5.469 -5.283 1.00 0.00 C ATOM 1455 CD LYS A 88 -4.393 4.884 -5.096 1.00 0.00 C ATOM 1456 CE LYS A 88 -4.907 5.107 -3.682 1.00 0.00 C ATOM 1457 NZ LYS A 88 -6.333 4.701 -3.540 1.00 0.00 N ATOM 0 H LYS A 88 -0.476 4.174 -5.729 1.00 0.00 H new ATOM 0 HA LYS A 88 -0.884 5.837 -7.996 1.00 0.00 H new ATOM 0 HB2 LYS A 88 -3.170 5.706 -7.400 1.00 0.00 H new ATOM 0 HB3 LYS A 88 -2.489 4.170 -6.901 1.00 0.00 H new ATOM 0 HG2 LYS A 88 -2.318 5.018 -4.565 1.00 0.00 H new ATOM 0 HG3 LYS A 88 -3.026 6.538 -5.073 1.00 0.00 H new ATOM 0 HD2 LYS A 88 -5.079 5.340 -5.810 1.00 0.00 H new ATOM 0 HD3 LYS A 88 -4.371 3.816 -5.312 1.00 0.00 H new ATOM 0 HE2 LYS A 88 -4.296 4.540 -2.980 1.00 0.00 H new ATOM 0 HE3 LYS A 88 -4.801 6.159 -3.419 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 -6.646 4.868 -2.562 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 -6.920 5.260 -4.192 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 -6.430 3.691 -3.766 1.00 0.00 H new ATOM 1471 N VAL A 89 -0.140 7.348 -5.318 1.00 0.00 N ATOM 1472 CA VAL A 89 0.057 8.644 -4.679 1.00 0.00 C ATOM 1473 C VAL A 89 1.488 9.135 -4.863 1.00 0.00 C ATOM 1474 O VAL A 89 1.969 9.977 -4.104 1.00 0.00 O ATOM 1475 CB VAL A 89 -0.265 8.582 -3.174 1.00 0.00 C ATOM 1476 CG1 VAL A 89 -1.679 8.067 -2.950 1.00 0.00 C ATOM 1477 CG2 VAL A 89 0.750 7.712 -2.448 1.00 0.00 C ATOM 0 H VAL A 89 0.403 6.589 -4.908 1.00 0.00 H new ATOM 0 HA VAL A 89 -0.628 9.342 -5.160 1.00 0.00 H new ATOM 0 HB VAL A 89 -0.203 9.591 -2.765 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -1.888 8.030 -1.881 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -2.391 8.734 -3.436 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -1.773 7.067 -3.373 1.00 0.00 H new ATOM 0 HG21 VAL A 89 0.507 7.679 -1.386 1.00 0.00 H new ATOM 0 HG22 VAL A 89 0.723 6.702 -2.858 1.00 0.00 H new ATOM 0 HG23 VAL A 89 1.748 8.130 -2.580 1.00 0.00 H new ATOM 1487 N VAL A 90 2.165 8.603 -5.875 1.00 0.00 N ATOM 1488 CA VAL A 90 3.543 8.988 -6.160 1.00 0.00 C ATOM 1489 C VAL A 90 3.825 8.954 -7.658 1.00 0.00 C ATOM 1490 O VAL A 90 3.448 8.007 -8.349 1.00 0.00 O ATOM 1491 CB VAL A 90 4.543 8.066 -5.439 1.00 0.00 C ATOM 1492 CG1 VAL A 90 5.960 8.606 -5.574 1.00 0.00 C ATOM 1493 CG2 VAL A 90 4.162 7.909 -3.975 1.00 0.00 C ATOM 0 H VAL A 90 1.782 7.904 -6.512 1.00 0.00 H new ATOM 0 HA VAL A 90 3.670 10.007 -5.793 1.00 0.00 H new ATOM 0 HB VAL A 90 4.508 7.083 -5.908 1.00 0.00 H new ATOM 0 HG11 VAL A 90 6.653 7.942 -5.058 1.00 0.00 H new ATOM 0 HG12 VAL A 90 6.229 8.663 -6.629 1.00 0.00 H new ATOM 0 HG13 VAL A 90 6.014 9.601 -5.132 1.00 0.00 H new ATOM 0 HG21 VAL A 90 4.879 7.254 -3.481 1.00 0.00 H new ATOM 0 HG22 VAL A 90 4.168 8.885 -3.491 1.00 0.00 H new ATOM 0 HG23 VAL A 90 3.165 7.475 -3.903 1.00 0.00 H new ATOM 1503 N ASN A 91 4.490 9.991 -8.154 1.00 0.00 N ATOM 1504 CA ASN A 91 4.822 10.080 -9.571 1.00 0.00 C ATOM 1505 C ASN A 91 5.818 8.993 -9.965 1.00 0.00 C ATOM 1506 O ASN A 91 6.883 8.866 -9.360 1.00 0.00 O ATOM 1507 CB ASN A 91 5.399 11.459 -9.896 1.00 0.00 C ATOM 1508 CG ASN A 91 5.463 11.722 -11.388 1.00 0.00 C ATOM 1509 OD1 ASN A 91 6.142 11.009 -12.127 1.00 0.00 O ATOM 1510 ND2 ASN A 91 4.753 12.751 -11.838 1.00 0.00 N ATOM 0 H ASN A 91 4.810 10.782 -7.596 1.00 0.00 H new ATOM 0 HA ASN A 91 3.906 9.934 -10.143 1.00 0.00 H new ATOM 0 HB2 ASN A 91 4.788 12.227 -9.420 1.00 0.00 H new ATOM 0 HB3 ASN A 91 6.400 11.540 -9.472 1.00 0.00 H new ATOM 0 HD21 ASN A 91 4.757 12.977 -12.833 1.00 0.00 H new ATOM 0 HD22 ASN A 91 4.204 13.315 -11.189 1.00 0.00 H new ATOM 1517 N GLN A 92 5.466 8.214 -10.982 1.00 0.00 N ATOM 1518 CA GLN A 92 6.329 7.140 -11.456 1.00 0.00 C ATOM 1519 C GLN A 92 7.293 7.647 -12.523 1.00 0.00 C ATOM 1520 O GLN A 92 7.487 7.004 -13.554 1.00 0.00 O ATOM 1521 CB GLN A 92 5.489 5.990 -12.015 1.00 0.00 C ATOM 1522 CG GLN A 92 4.304 5.620 -11.137 1.00 0.00 C ATOM 1523 CD GLN A 92 4.708 5.323 -9.706 1.00 0.00 C ATOM 1524 OE1 GLN A 92 5.891 5.178 -9.401 1.00 0.00 O ATOM 1525 NE2 GLN A 92 3.723 5.232 -8.820 1.00 0.00 N ATOM 0 H GLN A 92 4.589 8.307 -11.494 1.00 0.00 H new ATOM 0 HA GLN A 92 6.911 6.776 -10.610 1.00 0.00 H new ATOM 0 HB2 GLN A 92 5.125 6.265 -13.005 1.00 0.00 H new ATOM 0 HB3 GLN A 92 6.125 5.114 -12.141 1.00 0.00 H new ATOM 0 HG2 GLN A 92 3.582 6.437 -11.145 1.00 0.00 H new ATOM 0 HG3 GLN A 92 3.803 4.748 -11.558 1.00 0.00 H new ATOM 0 HE21 GLN A 92 2.756 5.360 -9.118 1.00 0.00 H new ATOM 0 HE22 GLN A 92 3.934 5.035 -7.842 1.00 0.00 H new ATOM 1534 N GLY A 93 7.895 8.805 -12.269 1.00 0.00 N ATOM 1535 CA GLY A 93 8.832 9.378 -13.219 1.00 0.00 C ATOM 1536 C GLY A 93 9.780 10.368 -12.571 1.00 0.00 C ATOM 1537 O GLY A 93 10.953 10.448 -12.937 1.00 0.00 O ATOM 0 H GLY A 93 7.751 9.356 -11.423 1.00 0.00 H new ATOM 0 HA2 GLY A 93 9.408 8.578 -13.684 1.00 0.00 H new ATOM 0 HA3 GLY A 93 8.279 9.877 -14.015 1.00 0.00 H new ATOM 1541 N THR A 94 9.271 11.129 -11.607 1.00 0.00 N ATOM 1542 CA THR A 94 10.079 12.121 -10.909 1.00 0.00 C ATOM 1543 C THR A 94 10.214 11.779 -9.429 1.00 0.00 C ATOM 1544 O THR A 94 11.238 12.060 -8.808 1.00 0.00 O ATOM 1545 CB THR A 94 9.478 13.532 -11.045 1.00 0.00 C ATOM 1546 OG1 THR A 94 8.138 13.545 -10.539 1.00 0.00 O ATOM 1547 CG2 THR A 94 9.480 13.983 -12.498 1.00 0.00 C ATOM 0 H THR A 94 8.302 11.077 -11.292 1.00 0.00 H new ATOM 0 HA THR A 94 11.065 12.108 -11.373 1.00 0.00 H new ATOM 0 HB THR A 94 10.092 14.222 -10.465 1.00 0.00 H new ATOM 0 HG1 THR A 94 7.764 14.446 -10.628 1.00 0.00 H new ATOM 0 HG21 THR A 94 9.051 14.982 -12.569 1.00 0.00 H new ATOM 0 HG22 THR A 94 10.504 14.000 -12.872 1.00 0.00 H new ATOM 0 HG23 THR A 94 8.887 13.290 -13.095 1.00 0.00 H new ATOM 1555 N GLY A 95 9.173 11.169 -8.870 1.00 0.00 N ATOM 1556 CA GLY A 95 9.196 10.798 -7.468 1.00 0.00 C ATOM 1557 C GLY A 95 8.654 11.892 -6.570 1.00 0.00 C ATOM 1558 O GLY A 95 9.015 11.979 -5.396 1.00 0.00 O ATOM 0 H GLY A 95 8.314 10.925 -9.364 1.00 0.00 H new ATOM 0 HA2 GLY A 95 8.608 9.891 -7.326 1.00 0.00 H new ATOM 0 HA3 GLY A 95 10.219 10.564 -7.174 1.00 0.00 H new ATOM 1562 N LYS A 96 7.785 12.732 -7.122 1.00 0.00 N ATOM 1563 CA LYS A 96 7.192 13.827 -6.364 1.00 0.00 C ATOM 1564 C LYS A 96 5.835 13.424 -5.794 1.00 0.00 C ATOM 1565 O LYS A 96 5.015 12.823 -6.489 1.00 0.00 O ATOM 1566 CB LYS A 96 7.037 15.065 -7.252 1.00 0.00 C ATOM 1567 CG LYS A 96 6.937 16.364 -6.472 1.00 0.00 C ATOM 1568 CD LYS A 96 6.559 17.527 -7.374 1.00 0.00 C ATOM 1569 CE LYS A 96 7.738 17.983 -8.219 1.00 0.00 C ATOM 1570 NZ LYS A 96 8.728 18.757 -7.419 1.00 0.00 N ATOM 0 H LYS A 96 7.476 12.675 -8.092 1.00 0.00 H new ATOM 0 HA LYS A 96 7.859 14.063 -5.535 1.00 0.00 H new ATOM 0 HB2 LYS A 96 7.887 15.123 -7.931 1.00 0.00 H new ATOM 0 HB3 LYS A 96 6.145 14.951 -7.868 1.00 0.00 H new ATOM 0 HG2 LYS A 96 6.194 16.259 -5.681 1.00 0.00 H new ATOM 0 HG3 LYS A 96 7.891 16.573 -5.987 1.00 0.00 H new ATOM 0 HD2 LYS A 96 5.736 17.231 -8.025 1.00 0.00 H new ATOM 0 HD3 LYS A 96 6.202 18.359 -6.767 1.00 0.00 H new ATOM 0 HE2 LYS A 96 8.227 17.114 -8.659 1.00 0.00 H new ATOM 0 HE3 LYS A 96 7.377 18.598 -9.044 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 9.445 19.164 -8.053 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 8.241 19.522 -6.910 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 9.191 18.126 -6.734 1.00 0.00 H new ATOM 1584 N ASP A 97 5.607 13.758 -4.530 1.00 0.00 N ATOM 1585 CA ASP A 97 4.349 13.432 -3.868 1.00 0.00 C ATOM 1586 C ASP A 97 3.165 14.020 -4.632 1.00 0.00 C ATOM 1587 O ASP A 97 3.147 15.209 -4.949 1.00 0.00 O ATOM 1588 CB ASP A 97 4.353 13.954 -2.431 1.00 0.00 C ATOM 1589 CG ASP A 97 3.454 13.144 -1.517 1.00 0.00 C ATOM 1590 OD1 ASP A 97 2.437 12.610 -2.008 1.00 0.00 O ATOM 1591 OD2 ASP A 97 3.769 13.042 -0.313 1.00 0.00 O ATOM 0 H ASP A 97 6.277 14.255 -3.942 1.00 0.00 H new ATOM 0 HA ASP A 97 4.247 12.347 -3.852 1.00 0.00 H new ATOM 0 HB2 ASP A 97 5.372 13.935 -2.044 1.00 0.00 H new ATOM 0 HB3 ASP A 97 4.029 14.995 -2.425 1.00 0.00 H new ATOM 1596 N LEU A 98 2.181 13.178 -4.925 1.00 0.00 N ATOM 1597 CA LEU A 98 0.994 13.612 -5.653 1.00 0.00 C ATOM 1598 C LEU A 98 -0.147 13.934 -4.693 1.00 0.00 C ATOM 1599 O LEU A 98 -1.071 14.671 -5.035 1.00 0.00 O ATOM 1600 CB LEU A 98 0.553 12.532 -6.642 1.00 0.00 C ATOM 1601 CG LEU A 98 1.601 12.090 -7.664 1.00 0.00 C ATOM 1602 CD1 LEU A 98 1.081 10.926 -8.494 1.00 0.00 C ATOM 1603 CD2 LEU A 98 1.996 13.253 -8.561 1.00 0.00 C ATOM 0 H LEU A 98 2.181 12.190 -4.670 1.00 0.00 H new ATOM 0 HA LEU A 98 1.248 14.518 -6.204 1.00 0.00 H new ATOM 0 HB2 LEU A 98 0.235 11.657 -6.076 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -0.321 12.897 -7.182 1.00 0.00 H new ATOM 0 HG LEU A 98 2.488 11.757 -7.125 1.00 0.00 H new ATOM 0 HD11 LEU A 98 1.841 10.626 -9.216 1.00 0.00 H new ATOM 0 HD12 LEU A 98 0.851 10.086 -7.839 1.00 0.00 H new ATOM 0 HD13 LEU A 98 0.178 11.231 -9.023 1.00 0.00 H new ATOM 0 HD21 LEU A 98 2.743 12.919 -9.282 1.00 0.00 H new ATOM 0 HD22 LEU A 98 1.117 13.618 -9.092 1.00 0.00 H new ATOM 0 HD23 LEU A 98 2.412 14.056 -7.953 1.00 0.00 H new ATOM 1615 N ASP A 99 -0.073 13.378 -3.489 1.00 0.00 N ATOM 1616 CA ASP A 99 -1.098 13.607 -2.477 1.00 0.00 C ATOM 1617 C ASP A 99 -0.496 14.252 -1.232 1.00 0.00 C ATOM 1618 O ASP A 99 -0.282 13.601 -0.208 1.00 0.00 O ATOM 1619 CB ASP A 99 -1.782 12.291 -2.105 1.00 0.00 C ATOM 1620 CG ASP A 99 -0.872 11.366 -1.321 1.00 0.00 C ATOM 1621 OD1 ASP A 99 0.349 11.375 -1.583 1.00 0.00 O ATOM 1622 OD2 ASP A 99 -1.381 10.634 -0.447 1.00 0.00 O ATOM 0 H ASP A 99 0.686 12.766 -3.190 1.00 0.00 H new ATOM 0 HA ASP A 99 -1.841 14.287 -2.894 1.00 0.00 H new ATOM 0 HB2 ASP A 99 -2.674 12.503 -1.516 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -2.112 11.787 -3.013 1.00 0.00 H new ATOM 1627 N PRO A 100 -0.215 15.561 -1.318 1.00 0.00 N ATOM 1628 CA PRO A 100 0.365 16.321 -0.208 1.00 0.00 C ATOM 1629 C PRO A 100 -0.617 16.509 0.943 1.00 0.00 C ATOM 1630 O PRO A 100 -0.292 17.132 1.952 1.00 0.00 O ATOM 1631 CB PRO A 100 0.708 17.671 -0.844 1.00 0.00 C ATOM 1632 CG PRO A 100 -0.228 17.795 -1.995 1.00 0.00 C ATOM 1633 CD PRO A 100 -0.444 16.399 -2.508 1.00 0.00 C ATOM 0 HA PRO A 100 1.222 15.810 0.231 1.00 0.00 H new ATOM 0 HB2 PRO A 100 0.574 18.488 -0.135 1.00 0.00 H new ATOM 0 HB3 PRO A 100 1.747 17.701 -1.173 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -1.170 18.246 -1.684 1.00 0.00 H new ATOM 0 HG3 PRO A 100 0.191 18.435 -2.771 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -1.451 16.268 -2.905 1.00 0.00 H new ATOM 0 HD3 PRO A 100 0.250 16.154 -3.312 1.00 0.00 H new ATOM 1641 N ASN A 101 -1.819 15.964 0.783 1.00 0.00 N ATOM 1642 CA ASN A 101 -2.849 16.071 1.811 1.00 0.00 C ATOM 1643 C ASN A 101 -3.029 14.745 2.542 1.00 0.00 C ATOM 1644 O ASN A 101 -3.352 14.717 3.729 1.00 0.00 O ATOM 1645 CB ASN A 101 -4.176 16.508 1.188 1.00 0.00 C ATOM 1646 CG ASN A 101 -4.560 15.659 -0.009 1.00 0.00 C ATOM 1647 OD1 ASN A 101 -4.802 14.459 0.119 1.00 0.00 O ATOM 1648 ND2 ASN A 101 -4.616 16.280 -1.182 1.00 0.00 N ATOM 0 H ASN A 101 -2.104 15.445 -0.047 1.00 0.00 H new ATOM 0 HA ASN A 101 -2.529 16.822 2.534 1.00 0.00 H new ATOM 0 HB2 ASN A 101 -4.964 16.450 1.939 1.00 0.00 H new ATOM 0 HB3 ASN A 101 -4.104 17.552 0.882 1.00 0.00 H new ATOM 0 HD21 ASN A 101 -4.868 15.760 -2.023 1.00 0.00 H new ATOM 0 HD22 ASN A 101 -4.407 17.277 -1.242 1.00 0.00 H new ATOM 1655 N ASN A 102 -2.817 13.646 1.823 1.00 0.00 N ATOM 1656 CA ASN A 102 -2.956 12.316 2.404 1.00 0.00 C ATOM 1657 C ASN A 102 -4.379 12.086 2.903 1.00 0.00 C ATOM 1658 O ASN A 102 -4.591 11.701 4.053 1.00 0.00 O ATOM 1659 CB ASN A 102 -1.964 12.131 3.554 1.00 0.00 C ATOM 1660 CG ASN A 102 -0.589 12.680 3.225 1.00 0.00 C ATOM 1661 OD1 ASN A 102 0.232 11.999 2.609 1.00 0.00 O ATOM 1662 ND2 ASN A 102 -0.332 13.916 3.633 1.00 0.00 N ATOM 0 H ASN A 102 -2.549 13.651 0.839 1.00 0.00 H new ATOM 0 HA ASN A 102 -2.740 11.584 1.626 1.00 0.00 H new ATOM 0 HB2 ASN A 102 -2.347 12.629 4.445 1.00 0.00 H new ATOM 0 HB3 ASN A 102 -1.881 11.071 3.792 1.00 0.00 H new ATOM 0 HD21 ASN A 102 0.576 14.339 3.439 1.00 0.00 H new ATOM 0 HD22 ASN A 102 -1.042 14.444 4.140 1.00 0.00 H new ATOM 1669 N VAL A 103 -5.353 12.323 2.030 1.00 0.00 N ATOM 1670 CA VAL A 103 -6.756 12.141 2.380 1.00 0.00 C ATOM 1671 C VAL A 103 -7.327 10.887 1.727 1.00 0.00 C ATOM 1672 O VAL A 103 -8.314 10.323 2.200 1.00 0.00 O ATOM 1673 CB VAL A 103 -7.603 13.356 1.960 1.00 0.00 C ATOM 1674 CG1 VAL A 103 -9.047 13.181 2.404 1.00 0.00 C ATOM 1675 CG2 VAL A 103 -7.013 14.638 2.531 1.00 0.00 C ATOM 0 H VAL A 103 -5.195 12.642 1.074 1.00 0.00 H new ATOM 0 HA VAL A 103 -6.800 12.035 3.464 1.00 0.00 H new ATOM 0 HB VAL A 103 -7.589 13.428 0.872 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -9.630 14.050 2.098 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -9.463 12.285 1.944 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -9.085 13.083 3.489 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -7.624 15.487 2.225 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -6.995 14.577 3.619 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -5.997 14.768 2.158 1.00 0.00 H new ATOM 1685 N ILE A 104 -6.701 10.457 0.637 1.00 0.00 N ATOM 1686 CA ILE A 104 -7.146 9.270 -0.081 1.00 0.00 C ATOM 1687 C ILE A 104 -6.793 7.999 0.685 1.00 0.00 C ATOM 1688 O ILE A 104 -7.662 7.181 0.985 1.00 0.00 O ATOM 1689 CB ILE A 104 -6.525 9.196 -1.488 1.00 0.00 C ATOM 1690 CG1 ILE A 104 -7.061 10.330 -2.365 1.00 0.00 C ATOM 1691 CG2 ILE A 104 -6.813 7.845 -2.126 1.00 0.00 C ATOM 1692 CD1 ILE A 104 -6.255 11.607 -2.262 1.00 0.00 C ATOM 0 H ILE A 104 -5.884 10.913 0.232 1.00 0.00 H new ATOM 0 HA ILE A 104 -8.229 9.347 -0.175 1.00 0.00 H new ATOM 0 HB ILE A 104 -5.445 9.309 -1.398 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -7.073 10.000 -3.404 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -8.094 10.538 -2.085 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -6.367 7.810 -3.120 1.00 0.00 H new ATOM 0 HG22 ILE A 104 -6.388 7.053 -1.509 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -7.891 7.703 -2.207 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -6.692 12.367 -2.910 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -6.264 11.961 -1.231 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -5.227 11.415 -2.571 1.00 0.00 H new ATOM 1704 N ILE A 105 -5.511 7.842 1.000 1.00 0.00 N ATOM 1705 CA ILE A 105 -5.043 6.674 1.734 1.00 0.00 C ATOM 1706 C ILE A 105 -5.938 6.384 2.935 1.00 0.00 C ATOM 1707 O ILE A 105 -6.039 5.242 3.383 1.00 0.00 O ATOM 1708 CB ILE A 105 -3.594 6.857 2.221 1.00 0.00 C ATOM 1709 CG1 ILE A 105 -3.543 7.861 3.374 1.00 0.00 C ATOM 1710 CG2 ILE A 105 -2.704 7.314 1.074 1.00 0.00 C ATOM 1711 CD1 ILE A 105 -3.784 7.237 4.730 1.00 0.00 C ATOM 0 H ILE A 105 -4.779 8.509 0.758 1.00 0.00 H new ATOM 0 HA ILE A 105 -5.081 5.832 1.043 1.00 0.00 H new ATOM 0 HB ILE A 105 -3.224 5.898 2.583 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -2.569 8.350 3.376 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -4.289 8.637 3.202 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -1.683 7.439 1.434 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -2.720 6.567 0.281 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -3.071 8.264 0.685 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -3.733 8.008 5.499 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -4.770 6.772 4.747 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -3.023 6.481 4.923 1.00 0.00 H new ATOM 1723 N GLU A 106 -6.585 7.424 3.448 1.00 0.00 N ATOM 1724 CA GLU A 106 -7.473 7.281 4.596 1.00 0.00 C ATOM 1725 C GLU A 106 -8.797 6.643 4.184 1.00 0.00 C ATOM 1726 O GLU A 106 -9.776 7.339 3.914 1.00 0.00 O ATOM 1727 CB GLU A 106 -7.730 8.642 5.244 1.00 0.00 C ATOM 1728 CG GLU A 106 -8.798 8.611 6.325 1.00 0.00 C ATOM 1729 CD GLU A 106 -8.242 8.231 7.683 1.00 0.00 C ATOM 1730 OE1 GLU A 106 -7.253 8.858 8.118 1.00 0.00 O ATOM 1731 OE2 GLU A 106 -8.797 7.306 8.312 1.00 0.00 O ATOM 0 H GLU A 106 -6.512 8.375 3.087 1.00 0.00 H new ATOM 0 HA GLU A 106 -6.985 6.629 5.320 1.00 0.00 H new ATOM 0 HB2 GLU A 106 -6.799 9.011 5.675 1.00 0.00 H new ATOM 0 HB3 GLU A 106 -8.027 9.352 4.472 1.00 0.00 H new ATOM 0 HG2 GLU A 106 -9.271 9.591 6.391 1.00 0.00 H new ATOM 0 HG3 GLU A 106 -9.575 7.900 6.043 1.00 0.00 H new ATOM 1738 N SER A 107 -8.819 5.316 4.136 1.00 0.00 N ATOM 1739 CA SER A 107 -10.021 4.584 3.753 1.00 0.00 C ATOM 1740 C SER A 107 -10.556 3.766 4.925 1.00 0.00 C ATOM 1741 O SER A 107 -9.805 3.066 5.604 1.00 0.00 O ATOM 1742 CB SER A 107 -9.726 3.663 2.567 1.00 0.00 C ATOM 1743 OG SER A 107 -8.996 2.520 2.978 1.00 0.00 O ATOM 0 H SER A 107 -8.018 4.725 4.358 1.00 0.00 H new ATOM 0 HA SER A 107 -10.781 5.309 3.462 1.00 0.00 H new ATOM 0 HB2 SER A 107 -10.662 3.353 2.102 1.00 0.00 H new ATOM 0 HB3 SER A 107 -9.160 4.208 1.812 1.00 0.00 H new ATOM 0 HG SER A 107 -8.822 1.947 2.202 1.00 0.00 H new ATOM 1749 N GLY A 108 -11.862 3.862 5.157 1.00 0.00 N ATOM 1750 CA GLY A 108 -12.477 3.126 6.248 1.00 0.00 C ATOM 1751 C GLY A 108 -13.416 2.043 5.758 1.00 0.00 C ATOM 1752 O GLY A 108 -14.629 2.238 5.667 1.00 0.00 O ATOM 0 H GLY A 108 -12.505 4.435 4.610 1.00 0.00 H new ATOM 0 HA2 GLY A 108 -11.698 2.676 6.864 1.00 0.00 H new ATOM 0 HA3 GLY A 108 -13.027 3.819 6.885 1.00 0.00 H new ATOM 1756 N PRO A 109 -12.855 0.870 5.431 1.00 0.00 N ATOM 1757 CA PRO A 109 -13.633 -0.272 4.942 1.00 0.00 C ATOM 1758 C PRO A 109 -14.512 -0.883 6.028 1.00 0.00 C ATOM 1759 O PRO A 109 -14.054 -1.123 7.146 1.00 0.00 O ATOM 1760 CB PRO A 109 -12.561 -1.268 4.497 1.00 0.00 C ATOM 1761 CG PRO A 109 -11.361 -0.921 5.310 1.00 0.00 C ATOM 1762 CD PRO A 109 -11.416 0.568 5.514 1.00 0.00 C ATOM 0 HA PRO A 109 -14.322 0.015 4.148 1.00 0.00 H new ATOM 0 HB2 PRO A 109 -12.877 -2.296 4.676 1.00 0.00 H new ATOM 0 HB3 PRO A 109 -12.356 -1.179 3.430 1.00 0.00 H new ATOM 0 HG2 PRO A 109 -11.371 -1.446 6.265 1.00 0.00 H new ATOM 0 HG3 PRO A 109 -10.444 -1.211 4.796 1.00 0.00 H new ATOM 0 HD2 PRO A 109 -11.000 0.857 6.479 1.00 0.00 H new ATOM 0 HD3 PRO A 109 -10.849 1.100 4.750 1.00 0.00 H new ATOM 1770 N SER A 110 -15.772 -1.134 5.693 1.00 0.00 N ATOM 1771 CA SER A 110 -16.715 -1.715 6.642 1.00 0.00 C ATOM 1772 C SER A 110 -17.041 -3.158 6.269 1.00 0.00 C ATOM 1773 O SER A 110 -16.771 -3.599 5.151 1.00 0.00 O ATOM 1774 CB SER A 110 -17.999 -0.886 6.689 1.00 0.00 C ATOM 1775 OG SER A 110 -18.707 -0.970 5.464 1.00 0.00 O ATOM 0 H SER A 110 -16.165 -0.944 4.771 1.00 0.00 H new ATOM 0 HA SER A 110 -16.251 -1.709 7.628 1.00 0.00 H new ATOM 0 HB2 SER A 110 -18.633 -1.237 7.503 1.00 0.00 H new ATOM 0 HB3 SER A 110 -17.756 0.155 6.901 1.00 0.00 H new ATOM 0 HG SER A 110 -19.525 -0.433 5.521 1.00 0.00 H new ATOM 1781 N SER A 111 -17.624 -3.889 7.213 1.00 0.00 N ATOM 1782 CA SER A 111 -17.985 -5.284 6.986 1.00 0.00 C ATOM 1783 C SER A 111 -18.838 -5.428 5.730 1.00 0.00 C ATOM 1784 O SER A 111 -19.161 -4.442 5.070 1.00 0.00 O ATOM 1785 CB SER A 111 -18.738 -5.841 8.196 1.00 0.00 C ATOM 1786 OG SER A 111 -17.871 -6.012 9.303 1.00 0.00 O ATOM 0 H SER A 111 -17.857 -3.539 8.142 1.00 0.00 H new ATOM 0 HA SER A 111 -17.066 -5.853 6.846 1.00 0.00 H new ATOM 0 HB2 SER A 111 -19.549 -5.164 8.466 1.00 0.00 H new ATOM 0 HB3 SER A 111 -19.194 -6.797 7.936 1.00 0.00 H new ATOM 0 HG SER A 111 -18.377 -6.367 10.063 1.00 0.00 H new ATOM 1792 N GLY A 112 -19.201 -6.665 5.407 1.00 0.00 N ATOM 1793 CA GLY A 112 -20.014 -6.917 4.231 1.00 0.00 C ATOM 1794 C GLY A 112 -19.293 -7.762 3.199 1.00 0.00 C ATOM 1795 O GLY A 112 -19.782 -8.821 2.804 1.00 0.00 O ATOM 0 H GLY A 112 -18.947 -7.498 5.939 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -20.934 -7.420 4.530 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -20.302 -5.967 3.781 1.00 0.00 H new TER 1799 GLY A 112