USER MOD reduce.3.24.130724 H: found=0, std=0, add=882, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 874 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 106 THR OG1 : rot 180:sc= -1.56 USER MOD Set 1.2: A 107 GLN : amide:sc= 0 X(o=-1.6,f=-1.6) USER MOD Set 2.1: A 54 SER OG : rot -135:sc= 1.19 USER MOD Set 2.2: A 63 HIS : no HD1:sc= 0.635 K(o=1.8,f=-2.9) USER MOD Set 3.1: A 45 SER OG : rot -49:sc= -1.96! USER MOD Set 3.2: A 47 SER OG : rot 180:sc= 0.056 USER MOD Set 3.3: A 48 HIS : no HD1:sc= -6.23! C(o=-7.6!,f=-10!) USER MOD Set 3.4: A 52 THR OG1 : rot 4:sc= 0.608 USER MOD Set 3.5: A 65 MET CE :methyl -157:sc= -0.111 (180deg=-0.691) USER MOD Set 4.1: A 3 SER OG : rot 180:sc= -0.152 USER MOD Set 4.2: A 5 SER OG : rot 44:sc= 0.455 USER MOD Single : A 1 GLY N :NH3+ -115:sc= 0.0819 (180deg=0) USER MOD Single : A 2 SER OG : rot 23:sc= 1.23 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 9 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 12 GLN : amide:sc= -0.0323 K(o=-0.032,f=-1.5) USER MOD Single : A 20 HIS : no HE2:sc= -7.06! C(o=-7.1!,f=-8.9!) USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 30 ASN : amide:sc= 0.0993 X(o=0.099,f=0.35) USER MOD Single : A 34 SER OG : rot -44:sc= 0.06 USER MOD Single : A 35 GLN : amide:sc= -0.417 K(o=-0.42,f=-2.3!) USER MOD Single : A 39 SER OG : rot 98:sc= 0.25 USER MOD Single : A 46 HIS :FLIP no HE2:sc= -6.21! C(o=-7.2!,f=-6.2!) USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 55 TYR OH : rot -130:sc= -0.842 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 GLN :FLIP amide:sc= 0 F(o=-0.73,f=0) USER MOD Single : A 59 SER OG : rot 180:sc= 0.0211 USER MOD Single : A 60 SER OG : rot 180:sc= -0.0304 USER MOD Single : A 61 CYS SG : rot 143:sc= -0.521 USER MOD Single : A 62 CYS SG : rot 34:sc= -0.491 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 THR OG1 : rot 140:sc= -0.89 USER MOD Single : A 75 MET CE :methyl -141:sc=-0.00621 (180deg=-1.53) USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 HIS : no HD1:sc= -4.21! X(o=-4.2!,f=-3.7) USER MOD Single : A 84 THR OG1 : rot 180:sc= -0.0324 USER MOD Single : A 85 SER OG : rot 24:sc= 0.321 USER MOD Single : A 91 THR OG1 : rot 180:sc= 0 USER MOD Single : A 93 HIS : no HE2:sc= -6.27! C(o=-6.3!,f=-11!) USER MOD Single : A 94 GLN : amide:sc= 0.0096 K(o=0.0096,f=-2!) USER MOD Single : A 95 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 CYS SG : rot 180:sc= -1.53 USER MOD Single : A 111 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 112 LYS NZ :NH3+ 162:sc= -0.0211 (180deg=-0.188) USER MOD Single : A 114 SER OG : rot 180:sc= 0 USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 20.617 12.573 -35.468 1.00 0.00 N ATOM 2 CA GLY A 1 19.499 12.984 -36.299 1.00 0.00 C ATOM 3 C GLY A 1 18.188 13.004 -35.537 1.00 0.00 C ATOM 4 O GLY A 1 18.165 12.811 -34.322 1.00 0.00 O ATOM 0 H1 GLY A 1 21.284 13.365 -35.367 1.00 0.00 H new ATOM 0 H2 GLY A 1 20.267 12.293 -34.529 1.00 0.00 H new ATOM 0 H3 GLY A 1 21.101 11.767 -35.912 1.00 0.00 H new ATOM 0 HA2 GLY A 1 19.696 13.977 -36.703 1.00 0.00 H new ATOM 0 HA3 GLY A 1 19.412 12.306 -37.148 1.00 0.00 H new ATOM 8 N SER A 2 17.094 13.241 -36.253 1.00 0.00 N ATOM 9 CA SER A 2 15.774 13.292 -35.636 1.00 0.00 C ATOM 10 C SER A 2 14.677 13.278 -36.697 1.00 0.00 C ATOM 11 O SER A 2 14.544 14.218 -37.481 1.00 0.00 O ATOM 12 CB SER A 2 15.641 14.544 -34.767 1.00 0.00 C ATOM 13 OG SER A 2 16.172 14.323 -33.472 1.00 0.00 O ATOM 0 H SER A 2 17.095 13.401 -37.260 1.00 0.00 H new ATOM 0 HA SER A 2 15.660 12.408 -35.008 1.00 0.00 H new ATOM 0 HB2 SER A 2 16.162 15.376 -35.240 1.00 0.00 H new ATOM 0 HB3 SER A 2 14.591 14.827 -34.690 1.00 0.00 H new ATOM 0 HG SER A 2 16.817 13.586 -33.504 1.00 0.00 H new ATOM 19 N SER A 3 13.893 12.204 -36.716 1.00 0.00 N ATOM 20 CA SER A 3 12.810 12.065 -37.683 1.00 0.00 C ATOM 21 C SER A 3 11.488 12.541 -37.089 1.00 0.00 C ATOM 22 O SER A 3 10.764 13.323 -37.703 1.00 0.00 O ATOM 23 CB SER A 3 12.686 10.609 -38.134 1.00 0.00 C ATOM 24 OG SER A 3 12.329 9.767 -37.051 1.00 0.00 O ATOM 0 H SER A 3 13.988 11.418 -36.073 1.00 0.00 H new ATOM 0 HA SER A 3 13.044 12.687 -38.547 1.00 0.00 H new ATOM 0 HB2 SER A 3 11.936 10.532 -38.921 1.00 0.00 H new ATOM 0 HB3 SER A 3 13.632 10.276 -38.561 1.00 0.00 H new ATOM 0 HG SER A 3 12.255 8.842 -37.366 1.00 0.00 H new ATOM 30 N GLY A 4 11.180 12.061 -35.888 1.00 0.00 N ATOM 31 CA GLY A 4 9.944 12.446 -35.229 1.00 0.00 C ATOM 32 C GLY A 4 8.834 11.438 -35.445 1.00 0.00 C ATOM 33 O GLY A 4 7.701 11.808 -35.754 1.00 0.00 O ATOM 0 H GLY A 4 11.764 11.413 -35.359 1.00 0.00 H new ATOM 0 HA2 GLY A 4 10.126 12.558 -34.160 1.00 0.00 H new ATOM 0 HA3 GLY A 4 9.625 13.419 -35.602 1.00 0.00 H new ATOM 37 N SER A 5 9.158 10.159 -35.283 1.00 0.00 N ATOM 38 CA SER A 5 8.179 9.093 -35.468 1.00 0.00 C ATOM 39 C SER A 5 7.925 8.357 -34.156 1.00 0.00 C ATOM 40 O SER A 5 8.675 7.456 -33.782 1.00 0.00 O ATOM 41 CB SER A 5 8.662 8.107 -36.534 1.00 0.00 C ATOM 42 OG SER A 5 9.966 7.636 -36.239 1.00 0.00 O ATOM 0 H SER A 5 10.090 9.836 -35.024 1.00 0.00 H new ATOM 0 HA SER A 5 7.244 9.545 -35.799 1.00 0.00 H new ATOM 0 HB2 SER A 5 7.973 7.265 -36.594 1.00 0.00 H new ATOM 0 HB3 SER A 5 8.659 8.592 -37.510 1.00 0.00 H new ATOM 0 HG SER A 5 10.025 7.413 -35.287 1.00 0.00 H new ATOM 48 N SER A 6 6.860 8.747 -33.463 1.00 0.00 N ATOM 49 CA SER A 6 6.507 8.128 -32.191 1.00 0.00 C ATOM 50 C SER A 6 5.524 6.981 -32.400 1.00 0.00 C ATOM 51 O SER A 6 4.625 7.062 -33.236 1.00 0.00 O ATOM 52 CB SER A 6 5.902 9.166 -31.245 1.00 0.00 C ATOM 53 OG SER A 6 4.778 9.799 -31.833 1.00 0.00 O ATOM 0 H SER A 6 6.227 9.489 -33.761 1.00 0.00 H new ATOM 0 HA SER A 6 7.417 7.727 -31.745 1.00 0.00 H new ATOM 0 HB2 SER A 6 5.606 8.684 -30.313 1.00 0.00 H new ATOM 0 HB3 SER A 6 6.654 9.914 -30.992 1.00 0.00 H new ATOM 0 HG SER A 6 4.409 10.457 -31.207 1.00 0.00 H new ATOM 59 N GLY A 7 5.701 5.910 -31.632 1.00 0.00 N ATOM 60 CA GLY A 7 4.825 4.760 -31.748 1.00 0.00 C ATOM 61 C GLY A 7 4.193 4.377 -30.424 1.00 0.00 C ATOM 62 O GLY A 7 4.770 4.611 -29.363 1.00 0.00 O ATOM 0 H GLY A 7 6.436 5.819 -30.931 1.00 0.00 H new ATOM 0 HA2 GLY A 7 4.040 4.977 -32.473 1.00 0.00 H new ATOM 0 HA3 GLY A 7 5.391 3.913 -32.135 1.00 0.00 H new ATOM 66 N GLY A 8 3.004 3.786 -30.486 1.00 0.00 N ATOM 67 CA GLY A 8 2.312 3.381 -29.276 1.00 0.00 C ATOM 68 C GLY A 8 1.098 2.520 -29.563 1.00 0.00 C ATOM 69 O GLY A 8 0.834 2.173 -30.714 1.00 0.00 O ATOM 0 H GLY A 8 2.507 3.580 -31.353 1.00 0.00 H new ATOM 0 HA2 GLY A 8 3.000 2.831 -28.634 1.00 0.00 H new ATOM 0 HA3 GLY A 8 2.002 4.268 -28.724 1.00 0.00 H new ATOM 73 N GLN A 9 0.359 2.174 -28.513 1.00 0.00 N ATOM 74 CA GLN A 9 -0.833 1.346 -28.659 1.00 0.00 C ATOM 75 C GLN A 9 -2.013 1.956 -27.911 1.00 0.00 C ATOM 76 O GLN A 9 -1.845 2.568 -26.856 1.00 0.00 O ATOM 77 CB GLN A 9 -0.562 -0.069 -28.143 1.00 0.00 C ATOM 78 CG GLN A 9 0.230 -0.929 -29.114 1.00 0.00 C ATOM 79 CD GLN A 9 0.495 -2.321 -28.577 1.00 0.00 C ATOM 80 OE1 GLN A 9 1.282 -2.501 -27.646 1.00 0.00 O ATOM 81 NE2 GLN A 9 -0.162 -3.317 -29.161 1.00 0.00 N ATOM 0 H GLN A 9 0.564 2.454 -27.554 1.00 0.00 H new ATOM 0 HA GLN A 9 -1.084 1.297 -29.718 1.00 0.00 H new ATOM 0 HB2 GLN A 9 -0.018 -0.005 -27.200 1.00 0.00 H new ATOM 0 HB3 GLN A 9 -1.513 -0.558 -27.930 1.00 0.00 H new ATOM 0 HG2 GLN A 9 -0.315 -1.004 -30.055 1.00 0.00 H new ATOM 0 HG3 GLN A 9 1.180 -0.442 -29.334 1.00 0.00 H new ATOM 0 HE21 GLN A 9 -0.805 -3.123 -29.929 1.00 0.00 H new ATOM 0 HE22 GLN A 9 -0.024 -4.276 -28.841 1.00 0.00 H new ATOM 90 N LEU A 10 -3.210 1.786 -28.464 1.00 0.00 N ATOM 91 CA LEU A 10 -4.419 2.320 -27.850 1.00 0.00 C ATOM 92 C LEU A 10 -5.162 1.234 -27.077 1.00 0.00 C ATOM 93 O LEU A 10 -6.389 1.156 -27.121 1.00 0.00 O ATOM 94 CB LEU A 10 -5.337 2.918 -28.918 1.00 0.00 C ATOM 95 CG LEU A 10 -4.935 4.293 -29.454 1.00 0.00 C ATOM 96 CD1 LEU A 10 -5.531 4.524 -30.833 1.00 0.00 C ATOM 97 CD2 LEU A 10 -5.372 5.389 -28.492 1.00 0.00 C ATOM 0 H LEU A 10 -3.368 1.282 -29.337 1.00 0.00 H new ATOM 0 HA LEU A 10 -4.126 3.103 -27.151 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -5.387 2.223 -29.757 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -6.343 2.991 -28.505 1.00 0.00 H new ATOM 0 HG LEU A 10 -3.849 4.324 -29.541 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -5.234 5.507 -31.198 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -5.169 3.758 -31.519 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -6.618 4.473 -30.773 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -5.078 6.360 -28.889 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -6.455 5.358 -28.373 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -4.896 5.234 -27.524 1.00 0.00 H new ATOM 109 N ALA A 11 -4.409 0.400 -26.367 1.00 0.00 N ATOM 110 CA ALA A 11 -4.997 -0.677 -25.580 1.00 0.00 C ATOM 111 C ALA A 11 -5.951 -0.129 -24.524 1.00 0.00 C ATOM 112 O ALA A 11 -5.749 0.967 -24.002 1.00 0.00 O ATOM 113 CB ALA A 11 -3.903 -1.508 -24.925 1.00 0.00 C ATOM 0 H ALA A 11 -3.391 0.450 -26.321 1.00 0.00 H new ATOM 0 HA ALA A 11 -5.570 -1.314 -26.253 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -4.355 -2.309 -24.340 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -3.263 -1.938 -25.695 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -3.307 -0.873 -24.270 1.00 0.00 H new ATOM 119 N GLN A 12 -6.989 -0.899 -24.216 1.00 0.00 N ATOM 120 CA GLN A 12 -7.976 -0.489 -23.224 1.00 0.00 C ATOM 121 C GLN A 12 -7.295 -0.005 -21.947 1.00 0.00 C ATOM 122 O GLN A 12 -6.543 -0.746 -21.314 1.00 0.00 O ATOM 123 CB GLN A 12 -8.920 -1.648 -22.903 1.00 0.00 C ATOM 124 CG GLN A 12 -9.655 -2.189 -24.120 1.00 0.00 C ATOM 125 CD GLN A 12 -10.829 -3.072 -23.748 1.00 0.00 C ATOM 126 OE1 GLN A 12 -11.153 -3.230 -22.571 1.00 0.00 O ATOM 127 NE2 GLN A 12 -11.475 -3.653 -24.753 1.00 0.00 N ATOM 0 H GLN A 12 -7.169 -1.810 -24.639 1.00 0.00 H new ATOM 0 HA GLN A 12 -8.553 0.335 -23.642 1.00 0.00 H new ATOM 0 HB2 GLN A 12 -8.348 -2.455 -22.446 1.00 0.00 H new ATOM 0 HB3 GLN A 12 -9.651 -1.317 -22.165 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -10.010 -1.355 -24.726 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -8.959 -2.757 -24.737 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -11.172 -3.494 -25.714 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -12.274 -4.258 -24.564 1.00 0.00 H new ATOM 136 N ASP A 13 -7.562 1.242 -21.576 1.00 0.00 N ATOM 137 CA ASP A 13 -6.976 1.825 -20.376 1.00 0.00 C ATOM 138 C ASP A 13 -8.009 1.919 -19.257 1.00 0.00 C ATOM 139 O ASP A 13 -8.523 2.997 -18.962 1.00 0.00 O ATOM 140 CB ASP A 13 -6.409 3.212 -20.680 1.00 0.00 C ATOM 141 CG ASP A 13 -4.979 3.156 -21.181 1.00 0.00 C ATOM 142 OD1 ASP A 13 -4.057 3.095 -20.341 1.00 0.00 O ATOM 143 OD2 ASP A 13 -4.782 3.174 -22.415 1.00 0.00 O ATOM 0 H ASP A 13 -8.181 1.869 -22.090 1.00 0.00 H new ATOM 0 HA ASP A 13 -6.166 1.175 -20.046 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -7.034 3.701 -21.427 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -6.452 3.824 -19.779 1.00 0.00 H new ATOM 148 N GLY A 14 -8.310 0.781 -18.638 1.00 0.00 N ATOM 149 CA GLY A 14 -9.281 0.757 -17.560 1.00 0.00 C ATOM 150 C GLY A 14 -8.645 0.974 -16.201 1.00 0.00 C ATOM 151 O GLY A 14 -9.001 0.311 -15.227 1.00 0.00 O ATOM 0 H GLY A 14 -7.898 -0.124 -18.864 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -10.031 1.528 -17.734 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -9.801 -0.201 -17.565 1.00 0.00 H new ATOM 155 N VAL A 15 -7.697 1.905 -16.135 1.00 0.00 N ATOM 156 CA VAL A 15 -7.010 2.208 -14.886 1.00 0.00 C ATOM 157 C VAL A 15 -6.765 3.706 -14.742 1.00 0.00 C ATOM 158 O VAL A 15 -6.378 4.390 -15.690 1.00 0.00 O ATOM 159 CB VAL A 15 -5.662 1.468 -14.793 1.00 0.00 C ATOM 160 CG1 VAL A 15 -4.744 1.886 -15.932 1.00 0.00 C ATOM 161 CG2 VAL A 15 -5.005 1.724 -13.446 1.00 0.00 C ATOM 0 H VAL A 15 -7.388 2.462 -16.932 1.00 0.00 H new ATOM 0 HA VAL A 15 -7.659 1.870 -14.078 1.00 0.00 H new ATOM 0 HB VAL A 15 -5.848 0.398 -14.882 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -3.797 1.353 -15.850 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -5.214 1.645 -16.885 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -4.562 2.959 -15.878 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -4.054 1.193 -13.398 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -4.831 2.793 -13.324 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -5.659 1.369 -12.649 1.00 0.00 H new ATOM 171 N PRO A 16 -6.996 4.229 -13.529 1.00 0.00 N ATOM 172 CA PRO A 16 -6.805 5.652 -13.232 1.00 0.00 C ATOM 173 C PRO A 16 -5.334 6.053 -13.234 1.00 0.00 C ATOM 174 O PRO A 16 -4.463 5.247 -13.556 1.00 0.00 O ATOM 175 CB PRO A 16 -7.399 5.804 -11.828 1.00 0.00 C ATOM 176 CG PRO A 16 -7.287 4.448 -11.222 1.00 0.00 C ATOM 177 CD PRO A 16 -7.458 3.472 -12.353 1.00 0.00 C ATOM 0 HA PRO A 16 -7.274 6.291 -13.980 1.00 0.00 H new ATOM 0 HB2 PRO A 16 -6.852 6.545 -11.245 1.00 0.00 H new ATOM 0 HB3 PRO A 16 -8.437 6.134 -11.871 1.00 0.00 H new ATOM 0 HG2 PRO A 16 -6.320 4.317 -10.736 1.00 0.00 H new ATOM 0 HG3 PRO A 16 -8.050 4.298 -10.458 1.00 0.00 H new ATOM 0 HD2 PRO A 16 -6.867 2.570 -12.198 1.00 0.00 H new ATOM 0 HD3 PRO A 16 -8.496 3.158 -12.460 1.00 0.00 H new ATOM 185 N GLU A 17 -5.067 7.304 -12.872 1.00 0.00 N ATOM 186 CA GLU A 17 -3.701 7.812 -12.833 1.00 0.00 C ATOM 187 C GLU A 17 -3.096 7.642 -11.442 1.00 0.00 C ATOM 188 O GLU A 17 -1.924 7.294 -11.301 1.00 0.00 O ATOM 189 CB GLU A 17 -3.669 9.287 -13.239 1.00 0.00 C ATOM 190 CG GLU A 17 -4.857 10.084 -12.729 1.00 0.00 C ATOM 191 CD GLU A 17 -6.018 10.088 -13.705 1.00 0.00 C ATOM 192 OE1 GLU A 17 -5.767 10.002 -14.925 1.00 0.00 O ATOM 193 OE2 GLU A 17 -7.177 10.178 -13.248 1.00 0.00 O ATOM 0 H GLU A 17 -5.778 7.984 -12.602 1.00 0.00 H new ATOM 0 HA GLU A 17 -3.106 7.235 -13.541 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -2.751 9.739 -12.863 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -3.636 9.355 -14.326 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -5.188 9.667 -11.778 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -4.545 11.111 -12.536 1.00 0.00 H new ATOM 200 N TRP A 18 -3.905 7.891 -10.419 1.00 0.00 N ATOM 201 CA TRP A 18 -3.451 7.766 -9.038 1.00 0.00 C ATOM 202 C TRP A 18 -2.953 6.354 -8.753 1.00 0.00 C ATOM 203 O TRP A 18 -2.290 6.110 -7.745 1.00 0.00 O ATOM 204 CB TRP A 18 -4.582 8.126 -8.073 1.00 0.00 C ATOM 205 CG TRP A 18 -5.867 7.417 -8.373 1.00 0.00 C ATOM 206 CD1 TRP A 18 -6.896 7.874 -9.144 1.00 0.00 C ATOM 207 CD2 TRP A 18 -6.260 6.121 -7.905 1.00 0.00 C ATOM 208 NE1 TRP A 18 -7.906 6.943 -9.184 1.00 0.00 N ATOM 209 CE2 TRP A 18 -7.540 5.858 -8.433 1.00 0.00 C ATOM 210 CE3 TRP A 18 -5.655 5.158 -7.094 1.00 0.00 C ATOM 211 CZ2 TRP A 18 -8.222 4.673 -8.173 1.00 0.00 C ATOM 212 CZ3 TRP A 18 -6.334 3.982 -6.837 1.00 0.00 C ATOM 213 CH2 TRP A 18 -7.606 3.747 -7.376 1.00 0.00 C ATOM 0 H TRP A 18 -4.878 8.180 -10.519 1.00 0.00 H new ATOM 0 HA TRP A 18 -2.623 8.459 -8.891 1.00 0.00 H new ATOM 0 HB2 TRP A 18 -4.272 7.886 -7.056 1.00 0.00 H new ATOM 0 HB3 TRP A 18 -4.752 9.202 -8.109 1.00 0.00 H new ATOM 0 HD1 TRP A 18 -6.914 8.828 -9.649 1.00 0.00 H new ATOM 0 HE1 TRP A 18 -8.785 7.044 -9.691 1.00 0.00 H new ATOM 0 HE3 TRP A 18 -4.674 5.329 -6.675 1.00 0.00 H new ATOM 0 HZ2 TRP A 18 -9.203 4.491 -8.586 1.00 0.00 H new ATOM 0 HZ3 TRP A 18 -5.876 3.231 -6.210 1.00 0.00 H new ATOM 0 HH2 TRP A 18 -8.110 2.817 -7.158 1.00 0.00 H new ATOM 224 N PHE A 19 -3.278 5.425 -9.647 1.00 0.00 N ATOM 225 CA PHE A 19 -2.864 4.036 -9.493 1.00 0.00 C ATOM 226 C PHE A 19 -1.586 3.757 -10.278 1.00 0.00 C ATOM 227 O PHE A 19 -1.539 3.942 -11.494 1.00 0.00 O ATOM 228 CB PHE A 19 -3.977 3.094 -9.957 1.00 0.00 C ATOM 229 CG PHE A 19 -3.694 1.647 -9.677 1.00 0.00 C ATOM 230 CD1 PHE A 19 -3.939 1.110 -8.423 1.00 0.00 C ATOM 231 CD2 PHE A 19 -3.183 0.822 -10.667 1.00 0.00 C ATOM 232 CE1 PHE A 19 -3.679 -0.223 -8.163 1.00 0.00 C ATOM 233 CE2 PHE A 19 -2.922 -0.510 -10.412 1.00 0.00 C ATOM 234 CZ PHE A 19 -3.171 -1.034 -9.158 1.00 0.00 C ATOM 0 H PHE A 19 -3.827 5.610 -10.486 1.00 0.00 H new ATOM 0 HA PHE A 19 -2.665 3.859 -8.436 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -4.908 3.375 -9.465 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -4.130 3.225 -11.028 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -4.337 1.739 -7.641 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -2.987 1.226 -11.649 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -3.873 -0.630 -7.182 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -2.524 -1.142 -11.192 1.00 0.00 H new ATOM 0 HZ PHE A 19 -2.969 -2.076 -8.957 1.00 0.00 H new ATOM 244 N HIS A 20 -0.550 3.312 -9.573 1.00 0.00 N ATOM 245 CA HIS A 20 0.729 3.008 -10.205 1.00 0.00 C ATOM 246 C HIS A 20 0.922 1.501 -10.342 1.00 0.00 C ATOM 247 O HIS A 20 1.174 0.995 -11.436 1.00 0.00 O ATOM 248 CB HIS A 20 1.877 3.608 -9.392 1.00 0.00 C ATOM 249 CG HIS A 20 1.746 5.083 -9.168 1.00 0.00 C ATOM 250 ND1 HIS A 20 2.649 6.003 -9.656 1.00 0.00 N ATOM 251 CD2 HIS A 20 0.807 5.798 -8.504 1.00 0.00 C ATOM 252 CE1 HIS A 20 2.273 7.218 -9.301 1.00 0.00 C ATOM 253 NE2 HIS A 20 1.158 7.121 -8.601 1.00 0.00 N ATOM 0 H HIS A 20 -0.571 3.154 -8.566 1.00 0.00 H new ATOM 0 HA HIS A 20 0.729 3.449 -11.202 1.00 0.00 H new ATOM 0 HB2 HIS A 20 1.929 3.105 -8.426 1.00 0.00 H new ATOM 0 HB3 HIS A 20 2.818 3.409 -9.906 1.00 0.00 H new ATOM 0 HD1 HIS A 20 3.479 5.780 -10.206 1.00 0.00 H new ATOM 0 HD2 HIS A 20 -0.058 5.401 -7.993 1.00 0.00 H new ATOM 0 HE1 HIS A 20 2.790 8.135 -9.542 1.00 0.00 H new ATOM 261 N GLY A 21 0.802 0.788 -9.226 1.00 0.00 N ATOM 262 CA GLY A 21 0.968 -0.653 -9.245 1.00 0.00 C ATOM 263 C GLY A 21 1.990 -1.133 -8.235 1.00 0.00 C ATOM 264 O GLY A 21 3.165 -1.301 -8.563 1.00 0.00 O ATOM 0 H GLY A 21 0.593 1.183 -8.309 1.00 0.00 H new ATOM 0 HA2 GLY A 21 0.009 -1.129 -9.040 1.00 0.00 H new ATOM 0 HA3 GLY A 21 1.273 -0.967 -10.243 1.00 0.00 H new ATOM 268 N ALA A 22 1.545 -1.352 -7.003 1.00 0.00 N ATOM 269 CA ALA A 22 2.431 -1.815 -5.941 1.00 0.00 C ATOM 270 C ALA A 22 3.827 -1.222 -6.093 1.00 0.00 C ATOM 271 O ALA A 22 4.828 -1.892 -5.837 1.00 0.00 O ATOM 272 CB ALA A 22 2.498 -3.335 -5.936 1.00 0.00 C ATOM 0 H ALA A 22 0.576 -1.216 -6.715 1.00 0.00 H new ATOM 0 HA ALA A 22 2.024 -1.477 -4.988 1.00 0.00 H new ATOM 0 HB1 ALA A 22 3.163 -3.667 -5.139 1.00 0.00 H new ATOM 0 HB2 ALA A 22 1.501 -3.743 -5.771 1.00 0.00 H new ATOM 0 HB3 ALA A 22 2.879 -3.686 -6.895 1.00 0.00 H new ATOM 278 N ILE A 23 3.887 0.038 -6.511 1.00 0.00 N ATOM 279 CA ILE A 23 5.162 0.721 -6.697 1.00 0.00 C ATOM 280 C ILE A 23 6.046 0.579 -5.464 1.00 0.00 C ATOM 281 O ILE A 23 5.599 0.110 -4.417 1.00 0.00 O ATOM 282 CB ILE A 23 4.959 2.218 -7.000 1.00 0.00 C ATOM 283 CG1 ILE A 23 3.927 2.819 -6.043 1.00 0.00 C ATOM 284 CG2 ILE A 23 4.526 2.411 -8.445 1.00 0.00 C ATOM 285 CD1 ILE A 23 3.951 4.331 -6.002 1.00 0.00 C ATOM 0 H ILE A 23 3.068 0.607 -6.727 1.00 0.00 H new ATOM 0 HA ILE A 23 5.652 0.249 -7.549 1.00 0.00 H new ATOM 0 HB ILE A 23 5.907 2.736 -6.853 1.00 0.00 H new ATOM 0 HG12 ILE A 23 2.932 2.487 -6.339 1.00 0.00 H new ATOM 0 HG13 ILE A 23 4.106 2.433 -5.039 1.00 0.00 H new ATOM 0 HG21 ILE A 23 4.386 3.474 -8.644 1.00 0.00 H new ATOM 0 HG22 ILE A 23 5.293 2.015 -9.111 1.00 0.00 H new ATOM 0 HG23 ILE A 23 3.588 1.883 -8.617 1.00 0.00 H new ATOM 0 HD11 ILE A 23 3.194 4.688 -5.304 1.00 0.00 H new ATOM 0 HD12 ILE A 23 4.934 4.671 -5.676 1.00 0.00 H new ATOM 0 HD13 ILE A 23 3.742 4.725 -6.996 1.00 0.00 H new ATOM 297 N SER A 24 7.304 0.988 -5.593 1.00 0.00 N ATOM 298 CA SER A 24 8.253 0.905 -4.490 1.00 0.00 C ATOM 299 C SER A 24 8.180 2.152 -3.614 1.00 0.00 C ATOM 300 O SER A 24 8.034 3.267 -4.115 1.00 0.00 O ATOM 301 CB SER A 24 9.675 0.726 -5.024 1.00 0.00 C ATOM 302 OG SER A 24 10.516 0.129 -4.051 1.00 0.00 O ATOM 0 H SER A 24 7.690 1.381 -6.452 1.00 0.00 H new ATOM 0 HA SER A 24 7.989 0.039 -3.882 1.00 0.00 H new ATOM 0 HB2 SER A 24 9.654 0.106 -5.920 1.00 0.00 H new ATOM 0 HB3 SER A 24 10.082 1.694 -5.315 1.00 0.00 H new ATOM 0 HG SER A 24 11.418 0.024 -4.419 1.00 0.00 H new ATOM 308 N ARG A 25 8.282 1.955 -2.304 1.00 0.00 N ATOM 309 CA ARG A 25 8.227 3.062 -1.358 1.00 0.00 C ATOM 310 C ARG A 25 8.942 4.290 -1.915 1.00 0.00 C ATOM 311 O ARG A 25 8.475 5.417 -1.758 1.00 0.00 O ATOM 312 CB ARG A 25 8.854 2.655 -0.024 1.00 0.00 C ATOM 313 CG ARG A 25 8.379 3.490 1.153 1.00 0.00 C ATOM 314 CD ARG A 25 9.233 4.735 1.333 1.00 0.00 C ATOM 315 NE ARG A 25 9.250 5.192 2.720 1.00 0.00 N ATOM 316 CZ ARG A 25 9.981 6.216 3.147 1.00 0.00 C ATOM 317 NH1 ARG A 25 10.750 6.885 2.300 1.00 0.00 N ATOM 318 NH2 ARG A 25 9.943 6.571 4.425 1.00 0.00 N ATOM 0 H ARG A 25 8.403 1.038 -1.874 1.00 0.00 H new ATOM 0 HA ARG A 25 7.179 3.315 -1.196 1.00 0.00 H new ATOM 0 HB2 ARG A 25 8.626 1.607 0.170 1.00 0.00 H new ATOM 0 HB3 ARG A 25 9.938 2.736 -0.102 1.00 0.00 H new ATOM 0 HG2 ARG A 25 7.339 3.780 0.999 1.00 0.00 H new ATOM 0 HG3 ARG A 25 8.412 2.890 2.063 1.00 0.00 H new ATOM 0 HD2 ARG A 25 10.252 4.525 1.008 1.00 0.00 H new ATOM 0 HD3 ARG A 25 8.852 5.531 0.694 1.00 0.00 H new ATOM 0 HE ARG A 25 8.669 4.698 3.398 1.00 0.00 H new ATOM 0 HH11 ARG A 25 10.782 6.614 1.317 1.00 0.00 H new ATOM 0 HH12 ARG A 25 11.310 7.671 2.631 1.00 0.00 H new ATOM 0 HH21 ARG A 25 9.353 6.058 5.080 1.00 0.00 H new ATOM 0 HH22 ARG A 25 10.504 7.357 4.753 1.00 0.00 H new ATOM 332 N GLU A 26 10.079 4.061 -2.566 1.00 0.00 N ATOM 333 CA GLU A 26 10.859 5.148 -3.145 1.00 0.00 C ATOM 334 C GLU A 26 10.145 5.748 -4.353 1.00 0.00 C ATOM 335 O GLU A 26 10.142 6.964 -4.546 1.00 0.00 O ATOM 336 CB GLU A 26 12.246 4.648 -3.555 1.00 0.00 C ATOM 337 CG GLU A 26 12.234 3.772 -4.797 1.00 0.00 C ATOM 338 CD GLU A 26 13.471 2.902 -4.909 1.00 0.00 C ATOM 339 OE1 GLU A 26 14.175 2.737 -3.891 1.00 0.00 O ATOM 340 OE2 GLU A 26 13.733 2.385 -6.014 1.00 0.00 O ATOM 0 H GLU A 26 10.480 3.133 -2.705 1.00 0.00 H new ATOM 0 HA GLU A 26 10.969 5.924 -2.388 1.00 0.00 H new ATOM 0 HB2 GLU A 26 12.895 5.506 -3.732 1.00 0.00 H new ATOM 0 HB3 GLU A 26 12.680 4.086 -2.728 1.00 0.00 H new ATOM 0 HG2 GLU A 26 11.348 3.137 -4.781 1.00 0.00 H new ATOM 0 HG3 GLU A 26 12.157 4.404 -5.682 1.00 0.00 H new ATOM 347 N ASP A 27 9.539 4.886 -5.163 1.00 0.00 N ATOM 348 CA ASP A 27 8.821 5.329 -6.352 1.00 0.00 C ATOM 349 C ASP A 27 7.704 6.298 -5.982 1.00 0.00 C ATOM 350 O ASP A 27 7.509 7.318 -6.642 1.00 0.00 O ATOM 351 CB ASP A 27 8.244 4.128 -7.103 1.00 0.00 C ATOM 352 CG ASP A 27 9.277 3.438 -7.971 1.00 0.00 C ATOM 353 OD1 ASP A 27 10.394 3.180 -7.476 1.00 0.00 O ATOM 354 OD2 ASP A 27 8.967 3.153 -9.147 1.00 0.00 O ATOM 0 H ASP A 27 9.531 3.876 -5.017 1.00 0.00 H new ATOM 0 HA ASP A 27 9.527 5.847 -7.001 1.00 0.00 H new ATOM 0 HB2 ASP A 27 7.841 3.414 -6.385 1.00 0.00 H new ATOM 0 HB3 ASP A 27 7.412 4.458 -7.726 1.00 0.00 H new ATOM 359 N ALA A 28 6.971 5.972 -4.921 1.00 0.00 N ATOM 360 CA ALA A 28 5.874 6.815 -4.462 1.00 0.00 C ATOM 361 C ALA A 28 6.385 8.167 -3.978 1.00 0.00 C ATOM 362 O ALA A 28 5.800 9.206 -4.281 1.00 0.00 O ATOM 363 CB ALA A 28 5.098 6.114 -3.357 1.00 0.00 C ATOM 0 H ALA A 28 7.118 5.130 -4.364 1.00 0.00 H new ATOM 0 HA ALA A 28 5.206 6.991 -5.305 1.00 0.00 H new ATOM 0 HB1 ALA A 28 4.282 6.754 -3.023 1.00 0.00 H new ATOM 0 HB2 ALA A 28 4.692 5.176 -3.736 1.00 0.00 H new ATOM 0 HB3 ALA A 28 5.764 5.908 -2.519 1.00 0.00 H new ATOM 369 N GLU A 29 7.479 8.144 -3.223 1.00 0.00 N ATOM 370 CA GLU A 29 8.067 9.371 -2.696 1.00 0.00 C ATOM 371 C GLU A 29 8.717 10.185 -3.810 1.00 0.00 C ATOM 372 O GLU A 29 8.712 11.415 -3.779 1.00 0.00 O ATOM 373 CB GLU A 29 9.102 9.044 -1.618 1.00 0.00 C ATOM 374 CG GLU A 29 8.530 9.027 -0.210 1.00 0.00 C ATOM 375 CD GLU A 29 8.659 10.368 0.486 1.00 0.00 C ATOM 376 OE1 GLU A 29 8.694 11.401 -0.216 1.00 0.00 O ATOM 377 OE2 GLU A 29 8.726 10.386 1.733 1.00 0.00 O ATOM 0 H GLU A 29 7.975 7.292 -2.963 1.00 0.00 H new ATOM 0 HA GLU A 29 7.268 9.966 -2.254 1.00 0.00 H new ATOM 0 HB2 GLU A 29 9.544 8.071 -1.833 1.00 0.00 H new ATOM 0 HB3 GLU A 29 9.907 9.777 -1.665 1.00 0.00 H new ATOM 0 HG2 GLU A 29 7.479 8.743 -0.252 1.00 0.00 H new ATOM 0 HG3 GLU A 29 9.043 8.266 0.378 1.00 0.00 H new ATOM 384 N ASN A 30 9.276 9.490 -4.795 1.00 0.00 N ATOM 385 CA ASN A 30 9.932 10.148 -5.919 1.00 0.00 C ATOM 386 C ASN A 30 8.909 10.599 -6.957 1.00 0.00 C ATOM 387 O ASN A 30 9.126 11.577 -7.673 1.00 0.00 O ATOM 388 CB ASN A 30 10.951 9.205 -6.566 1.00 0.00 C ATOM 389 CG ASN A 30 12.322 9.312 -5.928 1.00 0.00 C ATOM 390 OD1 ASN A 30 13.177 10.067 -6.393 1.00 0.00 O ATOM 391 ND2 ASN A 30 12.539 8.555 -4.860 1.00 0.00 N ATOM 0 H ASN A 30 9.288 8.471 -4.838 1.00 0.00 H new ATOM 0 HA ASN A 30 10.451 11.028 -5.540 1.00 0.00 H new ATOM 0 HB2 ASN A 30 10.594 8.178 -6.485 1.00 0.00 H new ATOM 0 HB3 ASN A 30 11.029 9.433 -7.629 1.00 0.00 H new ATOM 0 HD21 ASN A 30 13.444 8.584 -4.390 1.00 0.00 H new ATOM 0 HD22 ASN A 30 11.801 7.944 -4.509 1.00 0.00 H new ATOM 398 N LEU A 31 7.796 9.880 -7.033 1.00 0.00 N ATOM 399 CA LEU A 31 6.738 10.205 -7.984 1.00 0.00 C ATOM 400 C LEU A 31 6.005 11.477 -7.568 1.00 0.00 C ATOM 401 O LEU A 31 5.514 12.228 -8.412 1.00 0.00 O ATOM 402 CB LEU A 31 5.747 9.045 -8.092 1.00 0.00 C ATOM 403 CG LEU A 31 6.053 8.000 -9.166 1.00 0.00 C ATOM 404 CD1 LEU A 31 5.415 6.666 -8.809 1.00 0.00 C ATOM 405 CD2 LEU A 31 5.568 8.477 -10.527 1.00 0.00 C ATOM 0 H LEU A 31 7.602 9.068 -6.448 1.00 0.00 H new ATOM 0 HA LEU A 31 7.198 10.373 -8.958 1.00 0.00 H new ATOM 0 HB2 LEU A 31 5.701 8.542 -7.126 1.00 0.00 H new ATOM 0 HB3 LEU A 31 4.756 9.456 -8.285 1.00 0.00 H new ATOM 0 HG LEU A 31 7.133 7.862 -9.215 1.00 0.00 H new ATOM 0 HD11 LEU A 31 5.643 5.935 -9.584 1.00 0.00 H new ATOM 0 HD12 LEU A 31 5.809 6.318 -7.854 1.00 0.00 H new ATOM 0 HD13 LEU A 31 4.335 6.788 -8.732 1.00 0.00 H new ATOM 0 HD21 LEU A 31 5.794 7.721 -11.279 1.00 0.00 H new ATOM 0 HD22 LEU A 31 4.491 8.643 -10.492 1.00 0.00 H new ATOM 0 HD23 LEU A 31 6.071 9.409 -10.786 1.00 0.00 H new ATOM 417 N LEU A 32 5.936 11.714 -6.263 1.00 0.00 N ATOM 418 CA LEU A 32 5.266 12.897 -5.734 1.00 0.00 C ATOM 419 C LEU A 32 6.245 14.056 -5.582 1.00 0.00 C ATOM 420 O LEU A 32 5.858 15.222 -5.653 1.00 0.00 O ATOM 421 CB LEU A 32 4.619 12.581 -4.384 1.00 0.00 C ATOM 422 CG LEU A 32 3.597 11.442 -4.381 1.00 0.00 C ATOM 423 CD1 LEU A 32 3.458 10.855 -2.985 1.00 0.00 C ATOM 424 CD2 LEU A 32 2.251 11.934 -4.892 1.00 0.00 C ATOM 0 H LEU A 32 6.336 11.103 -5.551 1.00 0.00 H new ATOM 0 HA LEU A 32 4.491 13.191 -6.442 1.00 0.00 H new ATOM 0 HB2 LEU A 32 5.408 12.336 -3.673 1.00 0.00 H new ATOM 0 HB3 LEU A 32 4.129 13.483 -4.018 1.00 0.00 H new ATOM 0 HG LEU A 32 3.952 10.657 -5.049 1.00 0.00 H new ATOM 0 HD11 LEU A 32 2.727 10.046 -3.001 1.00 0.00 H new ATOM 0 HD12 LEU A 32 4.422 10.466 -2.656 1.00 0.00 H new ATOM 0 HD13 LEU A 32 3.125 11.631 -2.296 1.00 0.00 H new ATOM 0 HD21 LEU A 32 1.536 11.111 -4.883 1.00 0.00 H new ATOM 0 HD22 LEU A 32 1.889 12.736 -4.249 1.00 0.00 H new ATOM 0 HD23 LEU A 32 2.363 12.307 -5.910 1.00 0.00 H new ATOM 436 N GLU A 33 7.517 13.727 -5.372 1.00 0.00 N ATOM 437 CA GLU A 33 8.551 14.741 -5.211 1.00 0.00 C ATOM 438 C GLU A 33 8.542 15.719 -6.383 1.00 0.00 C ATOM 439 O GLU A 33 8.699 16.926 -6.198 1.00 0.00 O ATOM 440 CB GLU A 33 9.928 14.083 -5.094 1.00 0.00 C ATOM 441 CG GLU A 33 10.641 13.922 -6.426 1.00 0.00 C ATOM 442 CD GLU A 33 11.809 12.958 -6.349 1.00 0.00 C ATOM 443 OE1 GLU A 33 12.583 13.039 -5.372 1.00 0.00 O ATOM 444 OE2 GLU A 33 11.949 12.122 -7.266 1.00 0.00 O ATOM 0 H GLU A 33 7.855 12.766 -5.310 1.00 0.00 H new ATOM 0 HA GLU A 33 8.341 15.295 -4.296 1.00 0.00 H new ATOM 0 HB2 GLU A 33 10.551 14.680 -4.428 1.00 0.00 H new ATOM 0 HB3 GLU A 33 9.815 13.103 -4.631 1.00 0.00 H new ATOM 0 HG2 GLU A 33 9.931 13.568 -7.174 1.00 0.00 H new ATOM 0 HG3 GLU A 33 10.999 14.895 -6.762 1.00 0.00 H new ATOM 451 N SER A 34 8.355 15.189 -7.586 1.00 0.00 N ATOM 452 CA SER A 34 8.329 16.014 -8.790 1.00 0.00 C ATOM 453 C SER A 34 6.935 16.585 -9.025 1.00 0.00 C ATOM 454 O SER A 34 6.684 17.238 -10.038 1.00 0.00 O ATOM 455 CB SER A 34 8.770 15.195 -10.005 1.00 0.00 C ATOM 456 OG SER A 34 9.224 16.037 -11.050 1.00 0.00 O ATOM 0 H SER A 34 8.219 14.192 -7.755 1.00 0.00 H new ATOM 0 HA SER A 34 9.023 16.842 -8.649 1.00 0.00 H new ATOM 0 HB2 SER A 34 9.566 14.508 -9.715 1.00 0.00 H new ATOM 0 HB3 SER A 34 7.938 14.587 -10.359 1.00 0.00 H new ATOM 0 HG SER A 34 8.605 16.789 -11.157 1.00 0.00 H new ATOM 462 N GLN A 35 6.032 16.334 -8.083 1.00 0.00 N ATOM 463 CA GLN A 35 4.662 16.824 -8.188 1.00 0.00 C ATOM 464 C GLN A 35 4.391 17.910 -7.153 1.00 0.00 C ATOM 465 O GLN A 35 5.028 17.972 -6.101 1.00 0.00 O ATOM 466 CB GLN A 35 3.671 15.672 -8.007 1.00 0.00 C ATOM 467 CG GLN A 35 3.697 14.663 -9.145 1.00 0.00 C ATOM 468 CD GLN A 35 3.479 15.306 -10.500 1.00 0.00 C ATOM 469 OE1 GLN A 35 2.609 16.164 -10.659 1.00 0.00 O ATOM 470 NE2 GLN A 35 4.267 14.894 -11.485 1.00 0.00 N ATOM 0 H GLN A 35 6.224 15.795 -7.239 1.00 0.00 H new ATOM 0 HA GLN A 35 4.532 17.254 -9.181 1.00 0.00 H new ATOM 0 HB2 GLN A 35 3.891 15.158 -7.071 1.00 0.00 H new ATOM 0 HB3 GLN A 35 2.664 16.080 -7.917 1.00 0.00 H new ATOM 0 HG2 GLN A 35 4.655 14.144 -9.143 1.00 0.00 H new ATOM 0 HG3 GLN A 35 2.927 13.911 -8.976 1.00 0.00 H new ATOM 0 HE21 GLN A 35 4.974 14.181 -11.308 1.00 0.00 H new ATOM 0 HE22 GLN A 35 4.165 15.290 -12.419 1.00 0.00 H new ATOM 479 N PRO A 36 3.423 18.789 -7.456 1.00 0.00 N ATOM 480 CA PRO A 36 3.045 19.889 -6.564 1.00 0.00 C ATOM 481 C PRO A 36 2.341 19.399 -5.304 1.00 0.00 C ATOM 482 O PRO A 36 1.685 18.356 -5.313 1.00 0.00 O ATOM 483 CB PRO A 36 2.091 20.727 -7.420 1.00 0.00 C ATOM 484 CG PRO A 36 1.529 19.767 -8.410 1.00 0.00 C ATOM 485 CD PRO A 36 2.623 18.774 -8.692 1.00 0.00 C ATOM 0 HA PRO A 36 3.914 20.441 -6.206 1.00 0.00 H new ATOM 0 HB2 PRO A 36 1.305 21.175 -6.813 1.00 0.00 H new ATOM 0 HB3 PRO A 36 2.617 21.544 -7.915 1.00 0.00 H new ATOM 0 HG2 PRO A 36 0.644 19.270 -8.013 1.00 0.00 H new ATOM 0 HG3 PRO A 36 1.224 20.281 -9.322 1.00 0.00 H new ATOM 0 HD2 PRO A 36 2.222 17.782 -8.899 1.00 0.00 H new ATOM 0 HD3 PRO A 36 3.217 19.065 -9.559 1.00 0.00 H new ATOM 493 N LEU A 37 2.480 20.156 -4.222 1.00 0.00 N ATOM 494 CA LEU A 37 1.856 19.798 -2.952 1.00 0.00 C ATOM 495 C LEU A 37 0.397 19.401 -3.156 1.00 0.00 C ATOM 496 O LEU A 37 -0.349 20.078 -3.864 1.00 0.00 O ATOM 497 CB LEU A 37 1.946 20.967 -1.970 1.00 0.00 C ATOM 498 CG LEU A 37 2.021 20.594 -0.489 1.00 0.00 C ATOM 499 CD1 LEU A 37 0.697 20.014 -0.017 1.00 0.00 C ATOM 500 CD2 LEU A 37 3.155 19.610 -0.244 1.00 0.00 C ATOM 0 H LEU A 37 3.019 21.022 -4.198 1.00 0.00 H new ATOM 0 HA LEU A 37 2.392 18.943 -2.539 1.00 0.00 H new ATOM 0 HB2 LEU A 37 2.826 21.559 -2.220 1.00 0.00 H new ATOM 0 HB3 LEU A 37 1.078 21.609 -2.119 1.00 0.00 H new ATOM 0 HG LEU A 37 2.222 21.499 0.084 1.00 0.00 H new ATOM 0 HD11 LEU A 37 0.769 19.754 1.039 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -0.094 20.751 -0.156 1.00 0.00 H new ATOM 0 HD13 LEU A 37 0.465 19.120 -0.595 1.00 0.00 H new ATOM 0 HD21 LEU A 37 3.194 19.356 0.815 1.00 0.00 H new ATOM 0 HD22 LEU A 37 2.985 18.706 -0.828 1.00 0.00 H new ATOM 0 HD23 LEU A 37 4.100 20.063 -0.543 1.00 0.00 H new ATOM 512 N GLY A 38 -0.005 18.300 -2.528 1.00 0.00 N ATOM 513 CA GLY A 38 -1.373 17.834 -2.652 1.00 0.00 C ATOM 514 C GLY A 38 -1.483 16.570 -3.481 1.00 0.00 C ATOM 515 O GLY A 38 -2.301 15.697 -3.190 1.00 0.00 O ATOM 0 H GLY A 38 0.592 17.723 -1.936 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -1.782 17.650 -1.659 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -1.980 18.617 -3.107 1.00 0.00 H new ATOM 519 N SER A 39 -0.657 16.471 -4.518 1.00 0.00 N ATOM 520 CA SER A 39 -0.669 15.307 -5.397 1.00 0.00 C ATOM 521 C SER A 39 -0.709 14.016 -4.586 1.00 0.00 C ATOM 522 O SER A 39 0.191 13.738 -3.792 1.00 0.00 O ATOM 523 CB SER A 39 0.564 15.315 -6.303 1.00 0.00 C ATOM 524 OG SER A 39 0.775 16.598 -6.866 1.00 0.00 O ATOM 0 H SER A 39 0.029 17.183 -4.770 1.00 0.00 H new ATOM 0 HA SER A 39 -1.566 15.356 -6.014 1.00 0.00 H new ATOM 0 HB2 SER A 39 1.442 15.017 -5.730 1.00 0.00 H new ATOM 0 HB3 SER A 39 0.439 14.581 -7.099 1.00 0.00 H new ATOM 0 HG SER A 39 1.451 17.078 -6.343 1.00 0.00 H new ATOM 530 N PHE A 40 -1.761 13.229 -4.790 1.00 0.00 N ATOM 531 CA PHE A 40 -1.921 11.967 -4.078 1.00 0.00 C ATOM 532 C PHE A 40 -1.758 10.782 -5.026 1.00 0.00 C ATOM 533 O PHE A 40 -1.733 10.948 -6.248 1.00 0.00 O ATOM 534 CB PHE A 40 -3.293 11.908 -3.403 1.00 0.00 C ATOM 535 CG PHE A 40 -4.428 11.716 -4.368 1.00 0.00 C ATOM 536 CD1 PHE A 40 -4.817 10.444 -4.756 1.00 0.00 C ATOM 537 CD2 PHE A 40 -5.105 12.807 -4.888 1.00 0.00 C ATOM 538 CE1 PHE A 40 -5.862 10.264 -5.643 1.00 0.00 C ATOM 539 CE2 PHE A 40 -6.150 12.633 -5.775 1.00 0.00 C ATOM 540 CZ PHE A 40 -6.529 11.359 -6.154 1.00 0.00 C ATOM 0 H PHE A 40 -2.515 13.443 -5.443 1.00 0.00 H new ATOM 0 HA PHE A 40 -1.145 11.909 -3.315 1.00 0.00 H new ATOM 0 HB2 PHE A 40 -3.299 11.092 -2.681 1.00 0.00 H new ATOM 0 HB3 PHE A 40 -3.454 12.830 -2.844 1.00 0.00 H new ATOM 0 HD1 PHE A 40 -4.298 9.583 -4.361 1.00 0.00 H new ATOM 0 HD2 PHE A 40 -4.813 13.805 -4.597 1.00 0.00 H new ATOM 0 HE1 PHE A 40 -6.156 9.267 -5.936 1.00 0.00 H new ATOM 0 HE2 PHE A 40 -6.670 13.492 -6.172 1.00 0.00 H new ATOM 0 HZ PHE A 40 -7.345 11.221 -6.848 1.00 0.00 H new ATOM 550 N LEU A 41 -1.645 9.588 -4.457 1.00 0.00 N ATOM 551 CA LEU A 41 -1.483 8.374 -5.251 1.00 0.00 C ATOM 552 C LEU A 41 -1.662 7.130 -4.387 1.00 0.00 C ATOM 553 O LEU A 41 -1.667 7.212 -3.158 1.00 0.00 O ATOM 554 CB LEU A 41 -0.105 8.355 -5.913 1.00 0.00 C ATOM 555 CG LEU A 41 1.081 8.080 -4.987 1.00 0.00 C ATOM 556 CD1 LEU A 41 0.922 8.837 -3.678 1.00 0.00 C ATOM 557 CD2 LEU A 41 1.222 6.587 -4.728 1.00 0.00 C ATOM 0 H LEU A 41 -1.662 9.433 -3.449 1.00 0.00 H new ATOM 0 HA LEU A 41 -2.251 8.370 -6.024 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -0.111 7.598 -6.697 1.00 0.00 H new ATOM 0 HB3 LEU A 41 0.055 9.317 -6.400 1.00 0.00 H new ATOM 0 HG LEU A 41 1.989 8.430 -5.478 1.00 0.00 H new ATOM 0 HD11 LEU A 41 1.775 8.629 -3.032 1.00 0.00 H new ATOM 0 HD12 LEU A 41 0.872 9.907 -3.880 1.00 0.00 H new ATOM 0 HD13 LEU A 41 0.005 8.518 -3.182 1.00 0.00 H new ATOM 0 HD21 LEU A 41 2.071 6.411 -4.067 1.00 0.00 H new ATOM 0 HD22 LEU A 41 0.313 6.212 -4.258 1.00 0.00 H new ATOM 0 HD23 LEU A 41 1.383 6.068 -5.673 1.00 0.00 H new ATOM 569 N ILE A 42 -1.808 5.981 -5.037 1.00 0.00 N ATOM 570 CA ILE A 42 -1.984 4.719 -4.328 1.00 0.00 C ATOM 571 C ILE A 42 -1.079 3.635 -4.901 1.00 0.00 C ATOM 572 O ILE A 42 -0.926 3.519 -6.117 1.00 0.00 O ATOM 573 CB ILE A 42 -3.446 4.238 -4.389 1.00 0.00 C ATOM 574 CG1 ILE A 42 -4.378 5.288 -3.780 1.00 0.00 C ATOM 575 CG2 ILE A 42 -3.596 2.907 -3.669 1.00 0.00 C ATOM 576 CD1 ILE A 42 -5.804 4.811 -3.622 1.00 0.00 C ATOM 0 H ILE A 42 -1.808 5.897 -6.054 1.00 0.00 H new ATOM 0 HA ILE A 42 -1.713 4.901 -3.288 1.00 0.00 H new ATOM 0 HB ILE A 42 -3.723 4.097 -5.434 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -3.992 5.583 -2.804 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -4.369 6.178 -4.409 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -4.635 2.580 -3.721 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -2.957 2.162 -4.144 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -3.304 3.023 -2.625 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -6.407 5.606 -3.185 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -6.208 4.544 -4.598 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -5.826 3.939 -2.969 1.00 0.00 H new ATOM 588 N ARG A 43 -0.482 2.842 -4.017 1.00 0.00 N ATOM 589 CA ARG A 43 0.408 1.765 -4.436 1.00 0.00 C ATOM 590 C ARG A 43 -0.020 0.436 -3.822 1.00 0.00 C ATOM 591 O ARG A 43 0.072 0.240 -2.610 1.00 0.00 O ATOM 592 CB ARG A 43 1.850 2.083 -4.036 1.00 0.00 C ATOM 593 CG ARG A 43 2.061 2.166 -2.533 1.00 0.00 C ATOM 594 CD ARG A 43 3.391 2.819 -2.193 1.00 0.00 C ATOM 595 NE ARG A 43 4.476 1.844 -2.113 1.00 0.00 N ATOM 596 CZ ARG A 43 4.735 1.120 -1.029 1.00 0.00 C ATOM 597 NH1 ARG A 43 3.993 1.262 0.060 1.00 0.00 N ATOM 598 NH2 ARG A 43 5.740 0.253 -1.034 1.00 0.00 N ATOM 0 H ARG A 43 -0.598 2.925 -3.007 1.00 0.00 H new ATOM 0 HA ARG A 43 0.349 1.680 -5.521 1.00 0.00 H new ATOM 0 HB2 ARG A 43 2.509 1.317 -4.445 1.00 0.00 H new ATOM 0 HB3 ARG A 43 2.143 3.030 -4.488 1.00 0.00 H new ATOM 0 HG2 ARG A 43 1.249 2.735 -2.081 1.00 0.00 H new ATOM 0 HG3 ARG A 43 2.026 1.165 -2.104 1.00 0.00 H new ATOM 0 HD2 ARG A 43 3.631 3.567 -2.949 1.00 0.00 H new ATOM 0 HD3 ARG A 43 3.304 3.344 -1.241 1.00 0.00 H new ATOM 0 HE ARG A 43 5.067 1.712 -2.934 1.00 0.00 H new ATOM 0 HH11 ARG A 43 3.221 1.928 0.068 1.00 0.00 H new ATOM 0 HH12 ARG A 43 4.194 0.705 0.890 1.00 0.00 H new ATOM 0 HH21 ARG A 43 6.314 0.142 -1.870 1.00 0.00 H new ATOM 0 HH22 ARG A 43 5.938 -0.302 -0.202 1.00 0.00 H new ATOM 612 N VAL A 44 -0.491 -0.476 -4.667 1.00 0.00 N ATOM 613 CA VAL A 44 -0.934 -1.787 -4.208 1.00 0.00 C ATOM 614 C VAL A 44 -0.096 -2.268 -3.028 1.00 0.00 C ATOM 615 O VAL A 44 1.133 -2.238 -3.073 1.00 0.00 O ATOM 616 CB VAL A 44 -0.858 -2.832 -5.337 1.00 0.00 C ATOM 617 CG1 VAL A 44 -1.230 -4.211 -4.815 1.00 0.00 C ATOM 618 CG2 VAL A 44 -1.758 -2.431 -6.496 1.00 0.00 C ATOM 0 H VAL A 44 -0.576 -0.331 -5.673 1.00 0.00 H new ATOM 0 HA VAL A 44 -1.972 -1.678 -3.893 1.00 0.00 H new ATOM 0 HB VAL A 44 0.168 -2.873 -5.701 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -1.170 -4.936 -5.627 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -0.540 -4.498 -4.021 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -2.246 -4.189 -4.422 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -1.692 -3.181 -7.284 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -2.789 -2.360 -6.149 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -1.439 -1.465 -6.887 1.00 0.00 H new ATOM 628 N SER A 45 -0.771 -2.712 -1.972 1.00 0.00 N ATOM 629 CA SER A 45 -0.090 -3.197 -0.778 1.00 0.00 C ATOM 630 C SER A 45 0.324 -4.656 -0.943 1.00 0.00 C ATOM 631 O SER A 45 -0.247 -5.388 -1.752 1.00 0.00 O ATOM 632 CB SER A 45 -0.994 -3.047 0.446 1.00 0.00 C ATOM 633 OG SER A 45 -1.237 -1.682 0.738 1.00 0.00 O ATOM 0 H SER A 45 -1.789 -2.746 -1.920 1.00 0.00 H new ATOM 0 HA SER A 45 0.808 -2.597 -0.633 1.00 0.00 H new ATOM 0 HB2 SER A 45 -1.940 -3.558 0.268 1.00 0.00 H new ATOM 0 HB3 SER A 45 -0.529 -3.529 1.306 1.00 0.00 H new ATOM 0 HG SER A 45 -0.387 -1.194 0.749 1.00 0.00 H new ATOM 639 N HIS A 46 1.323 -5.072 -0.171 1.00 0.00 N ATOM 640 CA HIS A 46 1.815 -6.444 -0.230 1.00 0.00 C ATOM 641 C HIS A 46 1.693 -7.124 1.130 1.00 0.00 C ATOM 642 O HIS A 46 1.334 -8.299 1.217 1.00 0.00 O ATOM 643 CB HIS A 46 3.271 -6.466 -0.696 1.00 0.00 C ATOM 644 CG HIS A 46 3.463 -5.945 -2.087 1.00 0.00 C ATOM 645 ND1 HIS A 46 3.324 -6.553 -3.288 1.00 0.00 N flip ATOM 646 CD2 HIS A 46 3.846 -4.648 -2.358 1.00 0.00 C flip ATOM 647 CE1 HIS A 46 3.622 -5.623 -4.253 1.00 0.00 C flip ATOM 648 NE2 HIS A 46 3.932 -4.482 -3.666 1.00 0.00 N flip ATOM 0 H HIS A 46 1.808 -4.479 0.503 1.00 0.00 H new ATOM 0 HA HIS A 46 1.204 -6.993 -0.947 1.00 0.00 H new ATOM 0 HB2 HIS A 46 3.873 -5.872 -0.008 1.00 0.00 H new ATOM 0 HB3 HIS A 46 3.645 -7.489 -0.645 1.00 0.00 H new ATOM 0 HD1 HIS A 46 3.049 -7.522 -3.447 1.00 0.00 H new ATOM 0 HD2 HIS A 46 4.044 -3.887 -1.617 1.00 0.00 H new ATOM 0 HE1 HIS A 46 3.605 -5.797 -5.319 1.00 0.00 H new ATOM 656 N SER A 47 1.995 -6.379 2.187 1.00 0.00 N ATOM 657 CA SER A 47 1.923 -6.912 3.543 1.00 0.00 C ATOM 658 C SER A 47 0.547 -7.510 3.820 1.00 0.00 C ATOM 659 O SER A 47 0.434 -8.645 4.286 1.00 0.00 O ATOM 660 CB SER A 47 2.228 -5.812 4.563 1.00 0.00 C ATOM 661 OG SER A 47 1.835 -4.541 4.075 1.00 0.00 O ATOM 0 H SER A 47 2.292 -5.405 2.132 1.00 0.00 H new ATOM 0 HA SER A 47 2.669 -7.702 3.636 1.00 0.00 H new ATOM 0 HB2 SER A 47 1.707 -6.023 5.497 1.00 0.00 H new ATOM 0 HB3 SER A 47 3.295 -5.805 4.787 1.00 0.00 H new ATOM 0 HG SER A 47 2.039 -3.856 4.745 1.00 0.00 H new ATOM 667 N HIS A 48 -0.495 -6.740 3.530 1.00 0.00 N ATOM 668 CA HIS A 48 -1.866 -7.193 3.746 1.00 0.00 C ATOM 669 C HIS A 48 -2.641 -7.225 2.434 1.00 0.00 C ATOM 670 O HIS A 48 -2.138 -6.800 1.393 1.00 0.00 O ATOM 671 CB HIS A 48 -2.574 -6.283 4.749 1.00 0.00 C ATOM 672 CG HIS A 48 -2.817 -4.898 4.233 1.00 0.00 C ATOM 673 ND1 HIS A 48 -1.828 -3.943 4.143 1.00 0.00 N ATOM 674 CD2 HIS A 48 -3.948 -4.310 3.775 1.00 0.00 C ATOM 675 CE1 HIS A 48 -2.338 -2.827 3.654 1.00 0.00 C ATOM 676 NE2 HIS A 48 -3.623 -3.023 3.422 1.00 0.00 N ATOM 0 H HIS A 48 -0.418 -5.799 3.145 1.00 0.00 H new ATOM 0 HA HIS A 48 -1.829 -8.205 4.149 1.00 0.00 H new ATOM 0 HB2 HIS A 48 -3.528 -6.732 5.024 1.00 0.00 H new ATOM 0 HB3 HIS A 48 -1.976 -6.223 5.658 1.00 0.00 H new ATOM 0 HD2 HIS A 48 -4.923 -4.768 3.701 1.00 0.00 H new ATOM 0 HE1 HIS A 48 -1.796 -1.910 3.474 1.00 0.00 H new ATOM 0 HE2 HIS A 48 -4.269 -2.331 3.042 1.00 0.00 H new ATOM 684 N VAL A 49 -3.869 -7.731 2.489 1.00 0.00 N ATOM 685 CA VAL A 49 -4.714 -7.818 1.304 1.00 0.00 C ATOM 686 C VAL A 49 -5.457 -6.509 1.062 1.00 0.00 C ATOM 687 O VAL A 49 -6.586 -6.504 0.573 1.00 0.00 O ATOM 688 CB VAL A 49 -5.739 -8.961 1.429 1.00 0.00 C ATOM 689 CG1 VAL A 49 -5.041 -10.271 1.760 1.00 0.00 C ATOM 690 CG2 VAL A 49 -6.787 -8.626 2.479 1.00 0.00 C ATOM 0 H VAL A 49 -4.301 -8.087 3.342 1.00 0.00 H new ATOM 0 HA VAL A 49 -4.055 -8.021 0.459 1.00 0.00 H new ATOM 0 HB VAL A 49 -6.244 -9.078 0.470 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -5.781 -11.067 1.844 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -4.333 -10.516 0.968 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -4.507 -10.170 2.705 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -7.502 -9.445 2.553 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -6.302 -8.480 3.444 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -7.309 -7.713 2.193 1.00 0.00 H new ATOM 700 N GLY A 50 -4.814 -5.397 1.407 1.00 0.00 N ATOM 701 CA GLY A 50 -5.428 -4.096 1.220 1.00 0.00 C ATOM 702 C GLY A 50 -4.628 -3.205 0.291 1.00 0.00 C ATOM 703 O GLY A 50 -4.051 -3.676 -0.689 1.00 0.00 O ATOM 0 H GLY A 50 -3.878 -5.375 1.813 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -6.433 -4.226 0.817 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -5.534 -3.605 2.187 1.00 0.00 H new ATOM 707 N TYR A 51 -4.592 -1.913 0.599 1.00 0.00 N ATOM 708 CA TYR A 51 -3.859 -0.953 -0.218 1.00 0.00 C ATOM 709 C TYR A 51 -3.155 0.081 0.656 1.00 0.00 C ATOM 710 O TYR A 51 -3.221 0.021 1.885 1.00 0.00 O ATOM 711 CB TYR A 51 -4.807 -0.253 -1.193 1.00 0.00 C ATOM 712 CG TYR A 51 -5.418 -1.182 -2.217 1.00 0.00 C ATOM 713 CD1 TYR A 51 -4.765 -1.455 -3.413 1.00 0.00 C ATOM 714 CD2 TYR A 51 -6.647 -1.788 -1.988 1.00 0.00 C ATOM 715 CE1 TYR A 51 -5.320 -2.304 -4.351 1.00 0.00 C ATOM 716 CE2 TYR A 51 -7.209 -2.638 -2.920 1.00 0.00 C ATOM 717 CZ TYR A 51 -6.542 -2.893 -4.100 1.00 0.00 C ATOM 718 OH TYR A 51 -7.098 -3.739 -5.033 1.00 0.00 O ATOM 0 H TYR A 51 -5.062 -1.507 1.408 1.00 0.00 H new ATOM 0 HA TYR A 51 -3.104 -1.498 -0.784 1.00 0.00 H new ATOM 0 HB2 TYR A 51 -5.606 0.227 -0.628 1.00 0.00 H new ATOM 0 HB3 TYR A 51 -4.263 0.537 -1.711 1.00 0.00 H new ATOM 0 HD1 TYR A 51 -3.808 -0.996 -3.612 1.00 0.00 H new ATOM 0 HD2 TYR A 51 -7.172 -1.591 -1.065 1.00 0.00 H new ATOM 0 HE1 TYR A 51 -4.800 -2.506 -5.276 1.00 0.00 H new ATOM 0 HE2 TYR A 51 -8.165 -3.101 -2.726 1.00 0.00 H new ATOM 0 HH TYR A 51 -7.959 -4.070 -4.702 1.00 0.00 H new ATOM 728 N THR A 52 -2.483 1.030 0.013 1.00 0.00 N ATOM 729 CA THR A 52 -1.765 2.078 0.730 1.00 0.00 C ATOM 730 C THR A 52 -1.937 3.428 0.045 1.00 0.00 C ATOM 731 O THR A 52 -1.525 3.612 -1.101 1.00 0.00 O ATOM 732 CB THR A 52 -0.263 1.756 0.838 1.00 0.00 C ATOM 733 OG1 THR A 52 -0.075 0.512 1.521 1.00 0.00 O ATOM 734 CG2 THR A 52 0.475 2.862 1.577 1.00 0.00 C ATOM 0 H THR A 52 -2.420 1.095 -1.003 1.00 0.00 H new ATOM 0 HA THR A 52 -2.191 2.126 1.732 1.00 0.00 H new ATOM 0 HB THR A 52 0.143 1.680 -0.171 1.00 0.00 H new ATOM 0 HG1 THR A 52 -0.948 0.110 1.715 1.00 0.00 H new ATOM 0 HG21 THR A 52 1.534 2.613 1.641 1.00 0.00 H new ATOM 0 HG22 THR A 52 0.355 3.802 1.038 1.00 0.00 H new ATOM 0 HG23 THR A 52 0.065 2.965 2.582 1.00 0.00 H new ATOM 742 N LEU A 53 -2.547 4.371 0.754 1.00 0.00 N ATOM 743 CA LEU A 53 -2.774 5.708 0.214 1.00 0.00 C ATOM 744 C LEU A 53 -1.661 6.662 0.638 1.00 0.00 C ATOM 745 O LEU A 53 -1.231 6.657 1.790 1.00 0.00 O ATOM 746 CB LEU A 53 -4.127 6.246 0.682 1.00 0.00 C ATOM 747 CG LEU A 53 -4.388 7.730 0.416 1.00 0.00 C ATOM 748 CD1 LEU A 53 -3.547 8.593 1.343 1.00 0.00 C ATOM 749 CD2 LEU A 53 -4.100 8.069 -1.039 1.00 0.00 C ATOM 0 H LEU A 53 -2.893 4.235 1.704 1.00 0.00 H new ATOM 0 HA LEU A 53 -2.774 5.638 -0.874 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -4.913 5.667 0.197 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -4.215 6.069 1.754 1.00 0.00 H new ATOM 0 HG LEU A 53 -5.440 7.937 0.615 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -3.745 9.645 1.140 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -3.801 8.369 2.379 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -2.490 8.384 1.176 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -4.291 9.128 -1.210 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -3.057 7.847 -1.265 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -4.746 7.475 -1.686 1.00 0.00 H new ATOM 761 N SER A 54 -1.200 7.480 -0.303 1.00 0.00 N ATOM 762 CA SER A 54 -0.137 8.439 -0.029 1.00 0.00 C ATOM 763 C SER A 54 -0.333 9.716 -0.840 1.00 0.00 C ATOM 764 O SER A 54 -1.123 9.749 -1.784 1.00 0.00 O ATOM 765 CB SER A 54 1.227 7.823 -0.345 1.00 0.00 C ATOM 766 OG SER A 54 1.422 6.617 0.373 1.00 0.00 O ATOM 0 H SER A 54 -1.546 7.497 -1.262 1.00 0.00 H new ATOM 0 HA SER A 54 -0.176 8.694 1.030 1.00 0.00 H new ATOM 0 HB2 SER A 54 1.302 7.629 -1.415 1.00 0.00 H new ATOM 0 HB3 SER A 54 2.016 8.531 -0.093 1.00 0.00 H new ATOM 0 HG SER A 54 2.324 6.607 0.756 1.00 0.00 H new ATOM 772 N TYR A 55 0.394 10.763 -0.468 1.00 0.00 N ATOM 773 CA TYR A 55 0.299 12.043 -1.159 1.00 0.00 C ATOM 774 C TYR A 55 1.322 13.035 -0.612 1.00 0.00 C ATOM 775 O TYR A 55 1.891 12.831 0.460 1.00 0.00 O ATOM 776 CB TYR A 55 -1.111 12.620 -1.019 1.00 0.00 C ATOM 777 CG TYR A 55 -1.516 12.890 0.413 1.00 0.00 C ATOM 778 CD1 TYR A 55 -1.118 14.053 1.060 1.00 0.00 C ATOM 779 CD2 TYR A 55 -2.296 11.981 1.118 1.00 0.00 C ATOM 780 CE1 TYR A 55 -1.484 14.303 2.368 1.00 0.00 C ATOM 781 CE2 TYR A 55 -2.669 12.224 2.426 1.00 0.00 C ATOM 782 CZ TYR A 55 -2.260 13.386 3.046 1.00 0.00 C ATOM 783 OH TYR A 55 -2.629 13.632 4.350 1.00 0.00 O ATOM 0 H TYR A 55 1.056 10.751 0.308 1.00 0.00 H new ATOM 0 HA TYR A 55 0.512 11.873 -2.214 1.00 0.00 H new ATOM 0 HB2 TYR A 55 -1.172 13.549 -1.586 1.00 0.00 H new ATOM 0 HB3 TYR A 55 -1.824 11.927 -1.465 1.00 0.00 H new ATOM 0 HD1 TYR A 55 -0.512 14.774 0.531 1.00 0.00 H new ATOM 0 HD2 TYR A 55 -2.616 11.069 0.635 1.00 0.00 H new ATOM 0 HE1 TYR A 55 -1.164 15.211 2.857 1.00 0.00 H new ATOM 0 HE2 TYR A 55 -3.277 11.508 2.960 1.00 0.00 H new ATOM 0 HH TYR A 55 -2.423 12.849 4.902 1.00 0.00 H new ATOM 793 N LYS A 56 1.551 14.110 -1.358 1.00 0.00 N ATOM 794 CA LYS A 56 2.504 15.136 -0.950 1.00 0.00 C ATOM 795 C LYS A 56 1.898 16.050 0.112 1.00 0.00 C ATOM 796 O LYS A 56 0.840 16.642 -0.097 1.00 0.00 O ATOM 797 CB LYS A 56 2.942 15.964 -2.160 1.00 0.00 C ATOM 798 CG LYS A 56 4.301 16.621 -1.988 1.00 0.00 C ATOM 799 CD LYS A 56 5.426 15.698 -2.424 1.00 0.00 C ATOM 800 CE LYS A 56 6.763 16.137 -1.846 1.00 0.00 C ATOM 801 NZ LYS A 56 7.255 17.391 -2.480 1.00 0.00 N ATOM 0 H LYS A 56 1.090 14.294 -2.249 1.00 0.00 H new ATOM 0 HA LYS A 56 3.375 14.639 -0.523 1.00 0.00 H new ATOM 0 HB2 LYS A 56 2.967 15.321 -3.040 1.00 0.00 H new ATOM 0 HB3 LYS A 56 2.196 16.736 -2.351 1.00 0.00 H new ATOM 0 HG2 LYS A 56 4.338 17.541 -2.571 1.00 0.00 H new ATOM 0 HG3 LYS A 56 4.442 16.900 -0.944 1.00 0.00 H new ATOM 0 HD2 LYS A 56 5.207 14.679 -2.104 1.00 0.00 H new ATOM 0 HD3 LYS A 56 5.486 15.684 -3.512 1.00 0.00 H new ATOM 0 HE2 LYS A 56 6.662 16.289 -0.771 1.00 0.00 H new ATOM 0 HE3 LYS A 56 7.498 15.345 -1.989 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 8.168 17.658 -2.059 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 7.376 17.239 -3.502 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 6.566 18.153 -2.322 1.00 0.00 H new ATOM 815 N ALA A 57 2.578 16.159 1.248 1.00 0.00 N ATOM 816 CA ALA A 57 2.108 17.002 2.340 1.00 0.00 C ATOM 817 C ALA A 57 3.113 18.107 2.651 1.00 0.00 C ATOM 818 O ALA A 57 4.323 17.890 2.599 1.00 0.00 O ATOM 819 CB ALA A 57 1.844 16.162 3.580 1.00 0.00 C ATOM 0 H ALA A 57 3.456 15.674 1.436 1.00 0.00 H new ATOM 0 HA ALA A 57 1.175 17.472 2.028 1.00 0.00 H new ATOM 0 HB1 ALA A 57 1.494 16.805 4.387 1.00 0.00 H new ATOM 0 HB2 ALA A 57 1.084 15.413 3.357 1.00 0.00 H new ATOM 0 HB3 ALA A 57 2.765 15.665 3.886 1.00 0.00 H new ATOM 825 N GLN A 58 2.602 19.291 2.974 1.00 0.00 N ATOM 826 CA GLN A 58 3.457 20.430 3.292 1.00 0.00 C ATOM 827 C GLN A 58 4.695 19.983 4.061 1.00 0.00 C ATOM 828 O GLN A 58 5.824 20.271 3.660 1.00 0.00 O ATOM 829 CB GLN A 58 2.681 21.464 4.110 1.00 0.00 C ATOM 830 CG GLN A 58 1.944 22.484 3.257 1.00 0.00 C ATOM 831 CD GLN A 58 2.817 23.661 2.870 1.00 0.00 C ATOM 832 OE1 GLN A 58 3.233 23.700 1.610 1.00 0.00 O flip ATOM 833 NE2 GLN A 58 3.115 24.526 3.694 1.00 0.00 N flip ATOM 0 H GLN A 58 1.602 19.487 3.022 1.00 0.00 H new ATOM 0 HA GLN A 58 3.778 20.884 2.355 1.00 0.00 H new ATOM 0 HB2 GLN A 58 1.962 20.947 4.746 1.00 0.00 H new ATOM 0 HB3 GLN A 58 3.373 21.987 4.770 1.00 0.00 H new ATOM 0 HG2 GLN A 58 1.575 21.998 2.354 1.00 0.00 H new ATOM 0 HG3 GLN A 58 1.073 22.847 3.803 1.00 0.00 H new ATOM 0 HE21 GLN A 58 2.773 24.457 4.652 1.00 0.00 H new ATOM 0 HE22 GLN A 58 3.704 25.312 3.418 1.00 0.00 H new ATOM 842 N SER A 59 4.478 19.278 5.167 1.00 0.00 N ATOM 843 CA SER A 59 5.577 18.795 5.993 1.00 0.00 C ATOM 844 C SER A 59 6.466 17.834 5.209 1.00 0.00 C ATOM 845 O SER A 59 7.639 18.114 4.967 1.00 0.00 O ATOM 846 CB SER A 59 5.035 18.101 7.244 1.00 0.00 C ATOM 847 OG SER A 59 4.135 17.061 6.901 1.00 0.00 O ATOM 0 H SER A 59 3.551 19.029 5.511 1.00 0.00 H new ATOM 0 HA SER A 59 6.178 19.654 6.293 1.00 0.00 H new ATOM 0 HB2 SER A 59 5.862 17.693 7.825 1.00 0.00 H new ATOM 0 HB3 SER A 59 4.529 18.830 7.878 1.00 0.00 H new ATOM 0 HG SER A 59 3.804 16.632 7.718 1.00 0.00 H new ATOM 853 N SER A 60 5.897 16.699 4.815 1.00 0.00 N ATOM 854 CA SER A 60 6.636 15.694 4.062 1.00 0.00 C ATOM 855 C SER A 60 5.716 14.562 3.618 1.00 0.00 C ATOM 856 O SER A 60 4.674 14.319 4.227 1.00 0.00 O ATOM 857 CB SER A 60 7.782 15.134 4.907 1.00 0.00 C ATOM 858 OG SER A 60 8.435 14.069 4.238 1.00 0.00 O ATOM 0 H SER A 60 4.926 16.453 5.005 1.00 0.00 H new ATOM 0 HA SER A 60 7.049 16.172 3.174 1.00 0.00 H new ATOM 0 HB2 SER A 60 8.499 15.926 5.124 1.00 0.00 H new ATOM 0 HB3 SER A 60 7.395 14.784 5.864 1.00 0.00 H new ATOM 0 HG SER A 60 9.164 13.729 4.798 1.00 0.00 H new ATOM 864 N CYS A 61 6.108 13.873 2.551 1.00 0.00 N ATOM 865 CA CYS A 61 5.319 12.765 2.024 1.00 0.00 C ATOM 866 C CYS A 61 4.759 11.909 3.155 1.00 0.00 C ATOM 867 O CYS A 61 5.426 11.685 4.167 1.00 0.00 O ATOM 868 CB CYS A 61 6.171 11.905 1.090 1.00 0.00 C ATOM 869 SG CYS A 61 6.121 12.423 -0.642 1.00 0.00 S ATOM 0 H CYS A 61 6.967 14.062 2.034 1.00 0.00 H new ATOM 0 HA CYS A 61 4.483 13.181 1.461 1.00 0.00 H new ATOM 0 HB2 CYS A 61 7.205 11.928 1.435 1.00 0.00 H new ATOM 0 HB3 CYS A 61 5.835 10.870 1.158 1.00 0.00 H new ATOM 0 HG CYS A 61 7.295 12.264 -1.177 1.00 0.00 H new ATOM 875 N CYS A 62 3.532 11.433 2.978 1.00 0.00 N ATOM 876 CA CYS A 62 2.880 10.603 3.985 1.00 0.00 C ATOM 877 C CYS A 62 2.543 9.228 3.421 1.00 0.00 C ATOM 878 O CYS A 62 2.498 9.072 2.201 1.00 0.00 O ATOM 879 CB CYS A 62 1.610 11.286 4.494 1.00 0.00 C ATOM 880 SG CYS A 62 1.913 12.773 5.475 1.00 0.00 S ATOM 0 H CYS A 62 2.968 11.607 2.146 1.00 0.00 H new ATOM 0 HA CYS A 62 3.572 10.473 4.817 1.00 0.00 H new ATOM 0 HB2 CYS A 62 0.985 11.548 3.641 1.00 0.00 H new ATOM 0 HB3 CYS A 62 1.045 10.575 5.097 1.00 0.00 H new ATOM 0 HG CYS A 62 2.966 13.385 5.021 1.00 0.00 H new ATOM 886 N HIS A 63 2.316 8.270 4.308 1.00 0.00 N ATOM 887 CA HIS A 63 1.988 6.920 3.885 1.00 0.00 C ATOM 888 C HIS A 63 0.939 6.327 4.828 1.00 0.00 C ATOM 889 O HIS A 63 1.172 6.126 6.020 1.00 0.00 O ATOM 890 CB HIS A 63 3.249 6.060 3.786 1.00 0.00 C ATOM 891 CG HIS A 63 4.297 6.611 2.848 1.00 0.00 C ATOM 892 ND1 HIS A 63 4.153 6.597 1.472 1.00 0.00 N ATOM 893 CD2 HIS A 63 5.504 7.193 3.104 1.00 0.00 C ATOM 894 CE1 HIS A 63 5.231 7.147 0.934 1.00 0.00 C ATOM 895 NE2 HIS A 63 6.067 7.515 1.946 1.00 0.00 N ATOM 0 H HIS A 63 2.353 8.403 5.319 1.00 0.00 H new ATOM 0 HA HIS A 63 1.555 6.944 2.885 1.00 0.00 H new ATOM 0 HB2 HIS A 63 3.684 5.956 4.780 1.00 0.00 H new ATOM 0 HB3 HIS A 63 2.969 5.060 3.454 1.00 0.00 H new ATOM 0 HD2 HIS A 63 5.929 7.363 4.082 1.00 0.00 H new ATOM 0 HE1 HIS A 63 5.415 7.281 -0.122 1.00 0.00 H new ATOM 0 HE2 HIS A 63 6.976 7.964 1.832 1.00 0.00 H new ATOM 903 N PHE A 64 -0.232 6.051 4.263 1.00 0.00 N ATOM 904 CA PHE A 64 -1.336 5.483 5.029 1.00 0.00 C ATOM 905 C PHE A 64 -1.702 4.096 4.508 1.00 0.00 C ATOM 906 O PHE A 64 -1.593 3.822 3.313 1.00 0.00 O ATOM 907 CB PHE A 64 -2.555 6.404 4.965 1.00 0.00 C ATOM 908 CG PHE A 64 -2.237 7.842 5.258 1.00 0.00 C ATOM 909 CD1 PHE A 64 -1.640 8.643 4.298 1.00 0.00 C ATOM 910 CD2 PHE A 64 -2.533 8.393 6.495 1.00 0.00 C ATOM 911 CE1 PHE A 64 -1.347 9.967 4.564 1.00 0.00 C ATOM 912 CE2 PHE A 64 -2.243 9.717 6.767 1.00 0.00 C ATOM 913 CZ PHE A 64 -1.647 10.504 5.801 1.00 0.00 C ATOM 0 H PHE A 64 -0.441 6.211 3.278 1.00 0.00 H new ATOM 0 HA PHE A 64 -1.016 5.388 6.067 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -3.001 6.334 3.973 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -3.303 6.054 5.676 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -1.401 8.228 3.330 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -2.996 7.781 7.255 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -0.884 10.581 3.806 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -2.482 10.135 7.734 1.00 0.00 H new ATOM 0 HZ PHE A 64 -1.416 11.538 6.012 1.00 0.00 H new ATOM 923 N MET A 65 -2.138 3.227 5.413 1.00 0.00 N ATOM 924 CA MET A 65 -2.522 1.869 5.045 1.00 0.00 C ATOM 925 C MET A 65 -4.038 1.742 4.940 1.00 0.00 C ATOM 926 O MET A 65 -4.779 2.459 5.615 1.00 0.00 O ATOM 927 CB MET A 65 -1.984 0.868 6.070 1.00 0.00 C ATOM 928 CG MET A 65 -2.880 0.706 7.287 1.00 0.00 C ATOM 929 SD MET A 65 -2.373 -0.665 8.344 1.00 0.00 S ATOM 930 CE MET A 65 -2.712 -2.061 7.274 1.00 0.00 C ATOM 0 H MET A 65 -2.234 3.438 6.406 1.00 0.00 H new ATOM 0 HA MET A 65 -2.088 1.648 4.070 1.00 0.00 H new ATOM 0 HB2 MET A 65 -1.860 -0.102 5.588 1.00 0.00 H new ATOM 0 HB3 MET A 65 -0.995 1.190 6.397 1.00 0.00 H new ATOM 0 HG2 MET A 65 -2.870 1.629 7.866 1.00 0.00 H new ATOM 0 HG3 MET A 65 -3.907 0.546 6.959 1.00 0.00 H new ATOM 0 HE1 MET A 65 -2.848 -2.958 7.878 1.00 0.00 H new ATOM 0 HE2 MET A 65 -3.619 -1.868 6.701 1.00 0.00 H new ATOM 0 HE3 MET A 65 -1.875 -2.207 6.591 1.00 0.00 H new ATOM 940 N VAL A 66 -4.494 0.827 4.091 1.00 0.00 N ATOM 941 CA VAL A 66 -5.922 0.606 3.898 1.00 0.00 C ATOM 942 C VAL A 66 -6.270 -0.874 4.012 1.00 0.00 C ATOM 943 O VAL A 66 -5.889 -1.679 3.162 1.00 0.00 O ATOM 944 CB VAL A 66 -6.392 1.129 2.529 1.00 0.00 C ATOM 945 CG1 VAL A 66 -7.881 0.881 2.343 1.00 0.00 C ATOM 946 CG2 VAL A 66 -6.068 2.608 2.383 1.00 0.00 C ATOM 0 H VAL A 66 -3.894 0.226 3.525 1.00 0.00 H new ATOM 0 HA VAL A 66 -6.436 1.158 4.685 1.00 0.00 H new ATOM 0 HB VAL A 66 -5.858 0.584 1.750 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -8.194 1.258 1.369 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -8.082 -0.189 2.400 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -8.436 1.396 3.127 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -6.408 2.960 1.409 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -6.573 3.170 3.169 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -4.991 2.755 2.467 1.00 0.00 H new ATOM 956 N LYS A 67 -6.996 -1.226 5.067 1.00 0.00 N ATOM 957 CA LYS A 67 -7.398 -2.610 5.292 1.00 0.00 C ATOM 958 C LYS A 67 -8.573 -2.988 4.395 1.00 0.00 C ATOM 959 O LYS A 67 -9.236 -2.121 3.825 1.00 0.00 O ATOM 960 CB LYS A 67 -7.776 -2.820 6.761 1.00 0.00 C ATOM 961 CG LYS A 67 -6.593 -2.738 7.711 1.00 0.00 C ATOM 962 CD LYS A 67 -7.011 -3.012 9.146 1.00 0.00 C ATOM 963 CE LYS A 67 -8.008 -1.978 9.643 1.00 0.00 C ATOM 964 NZ LYS A 67 -8.024 -1.893 11.130 1.00 0.00 N ATOM 0 H LYS A 67 -7.318 -0.572 5.780 1.00 0.00 H new ATOM 0 HA LYS A 67 -6.553 -3.253 5.045 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -8.514 -2.071 7.048 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -8.252 -3.795 6.869 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -5.832 -3.457 7.409 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -6.140 -1.749 7.645 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -7.452 -4.006 9.214 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -6.131 -3.009 9.789 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -7.758 -1.002 9.226 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -9.005 -2.232 9.283 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -8.716 -1.177 11.429 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -8.288 -2.817 11.528 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -7.079 -1.625 11.473 1.00 0.00 H new ATOM 978 N LEU A 68 -8.826 -4.287 4.277 1.00 0.00 N ATOM 979 CA LEU A 68 -9.922 -4.780 3.450 1.00 0.00 C ATOM 980 C LEU A 68 -10.948 -5.528 4.296 1.00 0.00 C ATOM 981 O LEU A 68 -10.747 -6.691 4.650 1.00 0.00 O ATOM 982 CB LEU A 68 -9.384 -5.697 2.351 1.00 0.00 C ATOM 983 CG LEU A 68 -10.232 -5.791 1.081 1.00 0.00 C ATOM 984 CD1 LEU A 68 -9.651 -6.822 0.126 1.00 0.00 C ATOM 985 CD2 LEU A 68 -11.674 -6.135 1.427 1.00 0.00 C ATOM 0 H LEU A 68 -8.288 -5.017 4.743 1.00 0.00 H new ATOM 0 HA LEU A 68 -10.413 -3.922 2.991 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -8.387 -5.353 2.074 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -9.272 -6.699 2.764 1.00 0.00 H new ATOM 0 HG LEU A 68 -10.219 -4.820 0.586 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -10.267 -6.875 -0.771 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -8.636 -6.533 -0.147 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -9.632 -7.798 0.611 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -12.263 -6.198 0.512 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -11.705 -7.094 1.945 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -12.088 -5.360 2.072 1.00 0.00 H new ATOM 997 N LEU A 69 -12.047 -4.855 4.615 1.00 0.00 N ATOM 998 CA LEU A 69 -13.107 -5.457 5.417 1.00 0.00 C ATOM 999 C LEU A 69 -13.681 -6.689 4.725 1.00 0.00 C ATOM 1000 O LEU A 69 -13.415 -6.932 3.547 1.00 0.00 O ATOM 1001 CB LEU A 69 -14.219 -4.439 5.675 1.00 0.00 C ATOM 1002 CG LEU A 69 -13.807 -3.169 6.420 1.00 0.00 C ATOM 1003 CD1 LEU A 69 -12.703 -3.473 7.421 1.00 0.00 C ATOM 1004 CD2 LEU A 69 -13.360 -2.095 5.439 1.00 0.00 C ATOM 0 H LEU A 69 -12.228 -3.892 4.331 1.00 0.00 H new ATOM 0 HA LEU A 69 -12.677 -5.766 6.370 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -14.649 -4.150 4.716 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -15.009 -4.930 6.244 1.00 0.00 H new ATOM 0 HG LEU A 69 -14.672 -2.794 6.967 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -12.422 -2.558 7.942 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -13.059 -4.207 8.144 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -11.835 -3.872 6.896 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -13.071 -1.199 5.988 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -12.509 -2.459 4.864 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -14.180 -1.857 4.762 1.00 0.00 H new ATOM 1016 N ASP A 70 -14.469 -7.463 5.464 1.00 0.00 N ATOM 1017 CA ASP A 70 -15.084 -8.669 4.920 1.00 0.00 C ATOM 1018 C ASP A 70 -16.278 -8.319 4.038 1.00 0.00 C ATOM 1019 O ASP A 70 -16.781 -9.162 3.294 1.00 0.00 O ATOM 1020 CB ASP A 70 -15.525 -9.596 6.053 1.00 0.00 C ATOM 1021 CG ASP A 70 -15.561 -11.052 5.629 1.00 0.00 C ATOM 1022 OD1 ASP A 70 -14.480 -11.619 5.366 1.00 0.00 O ATOM 1023 OD2 ASP A 70 -16.670 -11.622 5.558 1.00 0.00 O ATOM 0 H ASP A 70 -14.697 -7.277 6.441 1.00 0.00 H new ATOM 0 HA ASP A 70 -14.342 -9.183 4.308 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -14.844 -9.483 6.897 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -16.514 -9.297 6.399 1.00 0.00 H new ATOM 1028 N ASP A 71 -16.728 -7.072 4.126 1.00 0.00 N ATOM 1029 CA ASP A 71 -17.864 -6.612 3.336 1.00 0.00 C ATOM 1030 C ASP A 71 -17.405 -6.092 1.977 1.00 0.00 C ATOM 1031 O ASP A 71 -18.109 -5.322 1.325 1.00 0.00 O ATOM 1032 CB ASP A 71 -18.622 -5.515 4.084 1.00 0.00 C ATOM 1033 CG ASP A 71 -19.208 -6.007 5.393 1.00 0.00 C ATOM 1034 OD1 ASP A 71 -19.939 -7.018 5.372 1.00 0.00 O ATOM 1035 OD2 ASP A 71 -18.936 -5.379 6.439 1.00 0.00 O ATOM 0 H ASP A 71 -16.323 -6.362 4.736 1.00 0.00 H new ATOM 0 HA ASP A 71 -18.530 -7.460 3.176 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -17.948 -4.681 4.281 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -19.423 -5.134 3.451 1.00 0.00 H new ATOM 1040 N GLY A 72 -16.218 -6.519 1.555 1.00 0.00 N ATOM 1041 CA GLY A 72 -15.685 -6.087 0.275 1.00 0.00 C ATOM 1042 C GLY A 72 -15.424 -4.595 0.232 1.00 0.00 C ATOM 1043 O GLY A 72 -15.329 -4.004 -0.844 1.00 0.00 O ATOM 0 H GLY A 72 -15.616 -7.156 2.077 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -14.757 -6.621 0.072 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -16.386 -6.353 -0.516 1.00 0.00 H new ATOM 1047 N THR A 73 -15.308 -3.980 1.406 1.00 0.00 N ATOM 1048 CA THR A 73 -15.060 -2.547 1.497 1.00 0.00 C ATOM 1049 C THR A 73 -13.676 -2.265 2.074 1.00 0.00 C ATOM 1050 O THR A 73 -12.997 -3.172 2.555 1.00 0.00 O ATOM 1051 CB THR A 73 -16.119 -1.848 2.369 1.00 0.00 C ATOM 1052 OG1 THR A 73 -16.100 -2.390 3.695 1.00 0.00 O ATOM 1053 CG2 THR A 73 -17.508 -2.011 1.769 1.00 0.00 C ATOM 0 H THR A 73 -15.382 -4.453 2.307 1.00 0.00 H new ATOM 0 HA THR A 73 -15.116 -2.151 0.483 1.00 0.00 H new ATOM 0 HB THR A 73 -15.880 -0.785 2.409 1.00 0.00 H new ATOM 0 HG1 THR A 73 -16.214 -1.666 4.346 1.00 0.00 H new ATOM 0 HG21 THR A 73 -18.239 -1.509 2.403 1.00 0.00 H new ATOM 0 HG22 THR A 73 -17.528 -1.570 0.772 1.00 0.00 H new ATOM 0 HG23 THR A 73 -17.753 -3.071 1.702 1.00 0.00 H new ATOM 1061 N PHE A 74 -13.266 -1.003 2.024 1.00 0.00 N ATOM 1062 CA PHE A 74 -11.963 -0.602 2.541 1.00 0.00 C ATOM 1063 C PHE A 74 -12.110 0.497 3.591 1.00 0.00 C ATOM 1064 O PHE A 74 -12.883 1.438 3.415 1.00 0.00 O ATOM 1065 CB PHE A 74 -11.066 -0.117 1.401 1.00 0.00 C ATOM 1066 CG PHE A 74 -10.890 -1.127 0.304 1.00 0.00 C ATOM 1067 CD1 PHE A 74 -11.874 -1.306 -0.655 1.00 0.00 C ATOM 1068 CD2 PHE A 74 -9.742 -1.899 0.233 1.00 0.00 C ATOM 1069 CE1 PHE A 74 -11.715 -2.236 -1.665 1.00 0.00 C ATOM 1070 CE2 PHE A 74 -9.577 -2.830 -0.775 1.00 0.00 C ATOM 1071 CZ PHE A 74 -10.567 -2.999 -1.725 1.00 0.00 C ATOM 0 H PHE A 74 -13.817 -0.240 1.631 1.00 0.00 H new ATOM 0 HA PHE A 74 -11.503 -1.471 3.011 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -11.489 0.795 0.980 1.00 0.00 H new ATOM 0 HB3 PHE A 74 -10.087 0.143 1.805 1.00 0.00 H new ATOM 0 HD1 PHE A 74 -12.775 -0.712 -0.613 1.00 0.00 H new ATOM 0 HD2 PHE A 74 -8.967 -1.772 0.974 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -12.489 -2.365 -2.407 1.00 0.00 H new ATOM 0 HE2 PHE A 74 -8.676 -3.424 -0.820 1.00 0.00 H new ATOM 0 HZ PHE A 74 -10.442 -3.727 -2.513 1.00 0.00 H new ATOM 1081 N MET A 75 -11.362 0.367 4.682 1.00 0.00 N ATOM 1082 CA MET A 75 -11.408 1.349 5.760 1.00 0.00 C ATOM 1083 C MET A 75 -10.007 1.642 6.288 1.00 0.00 C ATOM 1084 O MET A 75 -9.209 0.728 6.498 1.00 0.00 O ATOM 1085 CB MET A 75 -12.299 0.847 6.898 1.00 0.00 C ATOM 1086 CG MET A 75 -12.235 1.711 8.147 1.00 0.00 C ATOM 1087 SD MET A 75 -13.475 3.019 8.150 1.00 0.00 S ATOM 1088 CE MET A 75 -12.931 3.998 9.548 1.00 0.00 C ATOM 0 H MET A 75 -10.718 -0.407 4.843 1.00 0.00 H new ATOM 0 HA MET A 75 -11.827 2.272 5.360 1.00 0.00 H new ATOM 0 HB2 MET A 75 -13.331 0.804 6.549 1.00 0.00 H new ATOM 0 HB3 MET A 75 -12.007 -0.171 7.155 1.00 0.00 H new ATOM 0 HG2 MET A 75 -12.373 1.082 9.027 1.00 0.00 H new ATOM 0 HG3 MET A 75 -11.243 2.156 8.226 1.00 0.00 H new ATOM 0 HE1 MET A 75 -13.799 4.349 10.106 1.00 0.00 H new ATOM 0 HE2 MET A 75 -12.304 3.387 10.198 1.00 0.00 H new ATOM 0 HE3 MET A 75 -12.358 4.854 9.192 1.00 0.00 H new ATOM 1098 N ILE A 76 -9.715 2.921 6.499 1.00 0.00 N ATOM 1099 CA ILE A 76 -8.411 3.334 7.003 1.00 0.00 C ATOM 1100 C ILE A 76 -8.378 3.311 8.528 1.00 0.00 C ATOM 1101 O ILE A 76 -9.276 3.818 9.200 1.00 0.00 O ATOM 1102 CB ILE A 76 -8.039 4.746 6.514 1.00 0.00 C ATOM 1103 CG1 ILE A 76 -7.526 4.692 5.074 1.00 0.00 C ATOM 1104 CG2 ILE A 76 -6.996 5.366 7.431 1.00 0.00 C ATOM 1105 CD1 ILE A 76 -7.510 6.040 4.387 1.00 0.00 C ATOM 0 H ILE A 76 -10.364 3.689 6.329 1.00 0.00 H new ATOM 0 HA ILE A 76 -7.683 2.621 6.615 1.00 0.00 H new ATOM 0 HB ILE A 76 -8.932 5.370 6.538 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -6.517 4.280 5.072 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -8.151 4.008 4.500 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -6.743 6.364 7.072 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -7.396 5.434 8.443 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -6.100 4.745 7.436 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -7.135 5.926 3.370 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -8.521 6.445 4.357 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -6.862 6.722 4.938 1.00 0.00 H new ATOM 1117 N PRO A 77 -7.318 2.710 9.087 1.00 0.00 N ATOM 1118 CA PRO A 77 -7.140 2.608 10.539 1.00 0.00 C ATOM 1119 C PRO A 77 -6.840 3.959 11.182 1.00 0.00 C ATOM 1120 O PRO A 77 -5.680 4.311 11.395 1.00 0.00 O ATOM 1121 CB PRO A 77 -5.942 1.667 10.685 1.00 0.00 C ATOM 1122 CG PRO A 77 -5.182 1.822 9.413 1.00 0.00 C ATOM 1123 CD PRO A 77 -6.210 2.084 8.347 1.00 0.00 C ATOM 0 HA PRO A 77 -8.042 2.251 11.036 1.00 0.00 H new ATOM 0 HB2 PRO A 77 -5.331 1.935 11.547 1.00 0.00 H new ATOM 0 HB3 PRO A 77 -6.264 0.636 10.831 1.00 0.00 H new ATOM 0 HG2 PRO A 77 -4.471 2.646 9.481 1.00 0.00 H new ATOM 0 HG3 PRO A 77 -4.608 0.923 9.189 1.00 0.00 H new ATOM 0 HD2 PRO A 77 -5.823 2.743 7.569 1.00 0.00 H new ATOM 0 HD3 PRO A 77 -6.524 1.163 7.857 1.00 0.00 H new ATOM 1131 N GLY A 78 -7.892 4.710 11.491 1.00 0.00 N ATOM 1132 CA GLY A 78 -7.719 6.013 12.107 1.00 0.00 C ATOM 1133 C GLY A 78 -8.924 6.911 11.912 1.00 0.00 C ATOM 1134 O GLY A 78 -9.211 7.764 12.750 1.00 0.00 O ATOM 0 H GLY A 78 -8.862 4.440 11.326 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -7.534 5.885 13.174 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -6.838 6.496 11.686 1.00 0.00 H new ATOM 1138 N GLU A 79 -9.629 6.720 10.801 1.00 0.00 N ATOM 1139 CA GLU A 79 -10.808 7.523 10.497 1.00 0.00 C ATOM 1140 C GLU A 79 -12.057 6.918 11.133 1.00 0.00 C ATOM 1141 O GLU A 79 -11.977 5.940 11.877 1.00 0.00 O ATOM 1142 CB GLU A 79 -10.997 7.640 8.984 1.00 0.00 C ATOM 1143 CG GLU A 79 -10.230 8.793 8.361 1.00 0.00 C ATOM 1144 CD GLU A 79 -10.774 10.147 8.775 1.00 0.00 C ATOM 1145 OE1 GLU A 79 -11.768 10.596 8.167 1.00 0.00 O ATOM 1146 OE2 GLU A 79 -10.206 10.756 9.704 1.00 0.00 O ATOM 0 H GLU A 79 -9.404 6.017 10.097 1.00 0.00 H new ATOM 0 HA GLU A 79 -10.655 8.519 10.914 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -10.681 6.709 8.514 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -12.058 7.762 8.768 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -9.181 8.724 8.648 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -10.270 8.706 7.275 1.00 0.00 H new ATOM 1153 N LYS A 80 -13.210 7.505 10.833 1.00 0.00 N ATOM 1154 CA LYS A 80 -14.476 7.025 11.372 1.00 0.00 C ATOM 1155 C LYS A 80 -15.453 6.689 10.250 1.00 0.00 C ATOM 1156 O LYS A 80 -16.640 6.465 10.493 1.00 0.00 O ATOM 1157 CB LYS A 80 -15.091 8.077 12.300 1.00 0.00 C ATOM 1158 CG LYS A 80 -14.283 8.321 13.562 1.00 0.00 C ATOM 1159 CD LYS A 80 -13.194 9.355 13.337 1.00 0.00 C ATOM 1160 CE LYS A 80 -13.739 10.771 13.435 1.00 0.00 C ATOM 1161 NZ LYS A 80 -12.653 11.775 13.608 1.00 0.00 N ATOM 0 H LYS A 80 -13.294 8.315 10.219 1.00 0.00 H new ATOM 0 HA LYS A 80 -14.278 6.117 11.942 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -15.191 9.016 11.755 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -16.097 7.761 12.578 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -14.946 8.657 14.360 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -13.834 7.385 13.894 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -12.403 9.217 14.074 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -12.745 9.204 12.355 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -14.308 11.004 12.535 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -14.430 10.836 14.275 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -13.067 12.727 13.671 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -12.125 11.569 14.480 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -12.007 11.731 12.794 1.00 0.00 H new ATOM 1175 N VAL A 81 -14.946 6.654 9.022 1.00 0.00 N ATOM 1176 CA VAL A 81 -15.774 6.342 7.862 1.00 0.00 C ATOM 1177 C VAL A 81 -15.055 5.388 6.915 1.00 0.00 C ATOM 1178 O VAL A 81 -13.832 5.431 6.785 1.00 0.00 O ATOM 1179 CB VAL A 81 -16.164 7.617 7.091 1.00 0.00 C ATOM 1180 CG1 VAL A 81 -17.316 8.329 7.785 1.00 0.00 C ATOM 1181 CG2 VAL A 81 -14.964 8.541 6.949 1.00 0.00 C ATOM 0 H VAL A 81 -13.967 6.838 8.804 1.00 0.00 H new ATOM 0 HA VAL A 81 -16.678 5.864 8.238 1.00 0.00 H new ATOM 0 HB VAL A 81 -16.494 7.331 6.092 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -17.578 9.227 7.226 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -18.179 7.665 7.830 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -17.017 8.605 8.796 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -15.257 9.437 6.402 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -14.602 8.822 7.938 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -14.171 8.027 6.405 1.00 0.00 H new ATOM 1191 N ALA A 82 -15.823 4.527 6.255 1.00 0.00 N ATOM 1192 CA ALA A 82 -15.260 3.564 5.317 1.00 0.00 C ATOM 1193 C ALA A 82 -15.672 3.888 3.885 1.00 0.00 C ATOM 1194 O ALA A 82 -16.375 4.867 3.636 1.00 0.00 O ATOM 1195 CB ALA A 82 -15.692 2.153 5.686 1.00 0.00 C ATOM 0 H ALA A 82 -16.837 4.477 6.353 1.00 0.00 H new ATOM 0 HA ALA A 82 -14.174 3.627 5.378 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -15.264 1.444 4.977 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -15.342 1.917 6.691 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -16.779 2.086 5.655 1.00 0.00 H new ATOM 1201 N HIS A 83 -15.228 3.059 2.945 1.00 0.00 N ATOM 1202 CA HIS A 83 -15.550 3.257 1.536 1.00 0.00 C ATOM 1203 C HIS A 83 -15.648 1.921 0.808 1.00 0.00 C ATOM 1204 O HIS A 83 -15.109 0.911 1.265 1.00 0.00 O ATOM 1205 CB HIS A 83 -14.494 4.139 0.869 1.00 0.00 C ATOM 1206 CG HIS A 83 -13.995 5.244 1.748 1.00 0.00 C ATOM 1207 ND1 HIS A 83 -14.738 6.368 2.039 1.00 0.00 N ATOM 1208 CD2 HIS A 83 -12.818 5.392 2.401 1.00 0.00 C ATOM 1209 CE1 HIS A 83 -14.040 7.162 2.833 1.00 0.00 C ATOM 1210 NE2 HIS A 83 -12.871 6.592 3.068 1.00 0.00 N ATOM 0 H HIS A 83 -14.644 2.244 3.134 1.00 0.00 H new ATOM 0 HA HIS A 83 -16.518 3.754 1.476 1.00 0.00 H new ATOM 0 HB2 HIS A 83 -13.651 3.517 0.567 1.00 0.00 H new ATOM 0 HB3 HIS A 83 -14.914 4.570 -0.040 1.00 0.00 H new ATOM 0 HD2 HIS A 83 -11.992 4.697 2.398 1.00 0.00 H new ATOM 0 HE1 HIS A 83 -14.369 8.114 3.223 1.00 0.00 H new ATOM 0 HE2 HIS A 83 -12.129 6.980 3.650 1.00 0.00 H new ATOM 1218 N THR A 84 -16.339 1.920 -0.328 1.00 0.00 N ATOM 1219 CA THR A 84 -16.509 0.707 -1.118 1.00 0.00 C ATOM 1220 C THR A 84 -15.187 0.260 -1.731 1.00 0.00 C ATOM 1221 O THR A 84 -14.801 -0.903 -1.617 1.00 0.00 O ATOM 1222 CB THR A 84 -17.540 0.911 -2.244 1.00 0.00 C ATOM 1223 OG1 THR A 84 -17.183 2.049 -3.036 1.00 0.00 O ATOM 1224 CG2 THR A 84 -18.936 1.103 -1.672 1.00 0.00 C ATOM 0 H THR A 84 -16.790 2.746 -0.721 1.00 0.00 H new ATOM 0 HA THR A 84 -16.871 -0.065 -0.438 1.00 0.00 H new ATOM 0 HB THR A 84 -17.541 0.019 -2.871 1.00 0.00 H new ATOM 0 HG1 THR A 84 -17.843 2.170 -3.750 1.00 0.00 H new ATOM 0 HG21 THR A 84 -19.646 1.245 -2.486 1.00 0.00 H new ATOM 0 HG22 THR A 84 -19.217 0.222 -1.095 1.00 0.00 H new ATOM 0 HG23 THR A 84 -18.946 1.980 -1.024 1.00 0.00 H new ATOM 1232 N SER A 85 -14.495 1.192 -2.380 1.00 0.00 N ATOM 1233 CA SER A 85 -13.217 0.892 -3.013 1.00 0.00 C ATOM 1234 C SER A 85 -12.335 2.137 -3.073 1.00 0.00 C ATOM 1235 O SER A 85 -12.818 3.261 -2.934 1.00 0.00 O ATOM 1236 CB SER A 85 -13.437 0.342 -4.423 1.00 0.00 C ATOM 1237 OG SER A 85 -13.685 -1.053 -4.393 1.00 0.00 O ATOM 0 H SER A 85 -14.799 2.161 -2.481 1.00 0.00 H new ATOM 0 HA SER A 85 -12.711 0.137 -2.412 1.00 0.00 H new ATOM 0 HB2 SER A 85 -14.279 0.854 -4.889 1.00 0.00 H new ATOM 0 HB3 SER A 85 -12.560 0.546 -5.037 1.00 0.00 H new ATOM 0 HG SER A 85 -14.035 -1.304 -3.513 1.00 0.00 H new ATOM 1243 N LEU A 86 -11.040 1.927 -3.280 1.00 0.00 N ATOM 1244 CA LEU A 86 -10.089 3.031 -3.359 1.00 0.00 C ATOM 1245 C LEU A 86 -10.713 4.238 -4.051 1.00 0.00 C ATOM 1246 O LEU A 86 -10.587 5.369 -3.581 1.00 0.00 O ATOM 1247 CB LEU A 86 -8.830 2.592 -4.109 1.00 0.00 C ATOM 1248 CG LEU A 86 -7.734 1.945 -3.260 1.00 0.00 C ATOM 1249 CD1 LEU A 86 -8.343 1.017 -2.220 1.00 0.00 C ATOM 1250 CD2 LEU A 86 -6.752 1.189 -4.144 1.00 0.00 C ATOM 0 H LEU A 86 -10.624 1.003 -3.396 1.00 0.00 H new ATOM 0 HA LEU A 86 -9.817 3.319 -2.343 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -9.122 1.887 -4.888 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -8.407 3.463 -4.610 1.00 0.00 H new ATOM 0 HG LEU A 86 -7.190 2.733 -2.739 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -7.549 0.566 -1.625 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -9.006 1.586 -1.568 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -8.912 0.233 -2.720 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -5.979 0.735 -3.524 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -7.281 0.410 -4.692 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -6.291 1.880 -4.850 1.00 0.00 H new ATOM 1262 N ASP A 87 -11.387 3.990 -5.169 1.00 0.00 N ATOM 1263 CA ASP A 87 -12.033 5.056 -5.925 1.00 0.00 C ATOM 1264 C ASP A 87 -12.914 5.909 -5.017 1.00 0.00 C ATOM 1265 O ASP A 87 -12.754 7.126 -4.946 1.00 0.00 O ATOM 1266 CB ASP A 87 -12.870 4.469 -7.063 1.00 0.00 C ATOM 1267 CG ASP A 87 -14.051 5.348 -7.426 1.00 0.00 C ATOM 1268 OD1 ASP A 87 -15.099 5.240 -6.756 1.00 0.00 O ATOM 1269 OD2 ASP A 87 -13.926 6.143 -8.381 1.00 0.00 O ATOM 0 H ASP A 87 -11.500 3.060 -5.572 1.00 0.00 H new ATOM 0 HA ASP A 87 -11.254 5.691 -6.347 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -12.239 4.332 -7.941 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -13.231 3.482 -6.773 1.00 0.00 H new ATOM 1274 N ALA A 88 -13.846 5.259 -4.326 1.00 0.00 N ATOM 1275 CA ALA A 88 -14.751 5.958 -3.422 1.00 0.00 C ATOM 1276 C ALA A 88 -14.030 6.393 -2.150 1.00 0.00 C ATOM 1277 O ALA A 88 -14.587 7.118 -1.325 1.00 0.00 O ATOM 1278 CB ALA A 88 -15.941 5.074 -3.080 1.00 0.00 C ATOM 0 H ALA A 88 -13.993 4.251 -4.375 1.00 0.00 H new ATOM 0 HA ALA A 88 -15.111 6.854 -3.928 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -16.609 5.608 -2.404 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -16.478 4.817 -3.993 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -15.590 4.162 -2.597 1.00 0.00 H new ATOM 1284 N LEU A 89 -12.790 5.944 -1.996 1.00 0.00 N ATOM 1285 CA LEU A 89 -11.992 6.286 -0.823 1.00 0.00 C ATOM 1286 C LEU A 89 -11.056 7.453 -1.123 1.00 0.00 C ATOM 1287 O LEU A 89 -10.558 8.113 -0.212 1.00 0.00 O ATOM 1288 CB LEU A 89 -11.182 5.074 -0.361 1.00 0.00 C ATOM 1289 CG LEU A 89 -9.833 5.376 0.290 1.00 0.00 C ATOM 1290 CD1 LEU A 89 -9.429 4.252 1.231 1.00 0.00 C ATOM 1291 CD2 LEU A 89 -8.765 5.594 -0.773 1.00 0.00 C ATOM 0 H LEU A 89 -12.315 5.342 -2.668 1.00 0.00 H new ATOM 0 HA LEU A 89 -12.673 6.585 -0.026 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -11.786 4.508 0.348 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -11.011 4.427 -1.222 1.00 0.00 H new ATOM 0 HG LEU A 89 -9.930 6.292 0.873 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -8.466 4.486 1.685 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -10.181 4.143 2.012 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -9.350 3.320 0.672 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -7.811 5.808 -0.292 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -8.670 4.696 -1.383 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -9.048 6.435 -1.406 1.00 0.00 H new ATOM 1303 N VAL A 90 -10.821 7.702 -2.408 1.00 0.00 N ATOM 1304 CA VAL A 90 -9.948 8.791 -2.829 1.00 0.00 C ATOM 1305 C VAL A 90 -10.708 10.111 -2.897 1.00 0.00 C ATOM 1306 O VAL A 90 -10.170 11.168 -2.567 1.00 0.00 O ATOM 1307 CB VAL A 90 -9.315 8.503 -4.204 1.00 0.00 C ATOM 1308 CG1 VAL A 90 -8.432 9.664 -4.638 1.00 0.00 C ATOM 1309 CG2 VAL A 90 -8.523 7.205 -4.164 1.00 0.00 C ATOM 0 H VAL A 90 -11.223 7.164 -3.175 1.00 0.00 H new ATOM 0 HA VAL A 90 -9.158 8.869 -2.083 1.00 0.00 H new ATOM 0 HB VAL A 90 -10.114 8.391 -4.937 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -7.993 9.443 -5.611 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -9.032 10.571 -4.708 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -7.637 9.810 -3.906 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -8.083 7.017 -5.143 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -7.731 7.285 -3.419 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -9.187 6.382 -3.901 1.00 0.00 H new ATOM 1319 N THR A 91 -11.964 10.042 -3.327 1.00 0.00 N ATOM 1320 CA THR A 91 -12.800 11.231 -3.440 1.00 0.00 C ATOM 1321 C THR A 91 -13.118 11.811 -2.067 1.00 0.00 C ATOM 1322 O THR A 91 -12.991 13.015 -1.846 1.00 0.00 O ATOM 1323 CB THR A 91 -14.118 10.924 -4.174 1.00 0.00 C ATOM 1324 OG1 THR A 91 -13.845 10.459 -5.500 1.00 0.00 O ATOM 1325 CG2 THR A 91 -15.004 12.159 -4.236 1.00 0.00 C ATOM 0 H THR A 91 -12.425 9.175 -3.603 1.00 0.00 H new ATOM 0 HA THR A 91 -12.234 11.962 -4.018 1.00 0.00 H new ATOM 0 HB THR A 91 -14.644 10.147 -3.619 1.00 0.00 H new ATOM 0 HG1 THR A 91 -14.689 10.265 -5.959 1.00 0.00 H new ATOM 0 HG21 THR A 91 -15.929 11.917 -4.759 1.00 0.00 H new ATOM 0 HG22 THR A 91 -15.236 12.492 -3.224 1.00 0.00 H new ATOM 0 HG23 THR A 91 -14.483 12.954 -4.769 1.00 0.00 H new ATOM 1333 N PHE A 92 -13.533 10.947 -1.146 1.00 0.00 N ATOM 1334 CA PHE A 92 -13.871 11.374 0.207 1.00 0.00 C ATOM 1335 C PHE A 92 -12.651 11.959 0.912 1.00 0.00 C ATOM 1336 O PHE A 92 -12.775 12.837 1.767 1.00 0.00 O ATOM 1337 CB PHE A 92 -14.423 10.197 1.012 1.00 0.00 C ATOM 1338 CG PHE A 92 -15.067 10.606 2.306 1.00 0.00 C ATOM 1339 CD1 PHE A 92 -14.293 10.976 3.395 1.00 0.00 C ATOM 1340 CD2 PHE A 92 -16.447 10.621 2.435 1.00 0.00 C ATOM 1341 CE1 PHE A 92 -14.882 11.354 4.586 1.00 0.00 C ATOM 1342 CE2 PHE A 92 -17.042 10.999 3.624 1.00 0.00 C ATOM 1343 CZ PHE A 92 -16.258 11.365 4.702 1.00 0.00 C ATOM 0 H PHE A 92 -13.643 9.947 -1.312 1.00 0.00 H new ATOM 0 HA PHE A 92 -14.635 12.148 0.138 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -15.153 9.662 0.405 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -13.612 9.499 1.223 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -13.216 10.969 3.311 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -17.065 10.334 1.597 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -14.267 11.641 5.426 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -18.118 11.008 3.711 1.00 0.00 H new ATOM 0 HZ PHE A 92 -16.720 11.659 5.633 1.00 0.00 H new ATOM 1353 N HIS A 93 -11.471 11.466 0.548 1.00 0.00 N ATOM 1354 CA HIS A 93 -10.227 11.940 1.146 1.00 0.00 C ATOM 1355 C HIS A 93 -9.927 13.371 0.712 1.00 0.00 C ATOM 1356 O HIS A 93 -9.316 14.139 1.455 1.00 0.00 O ATOM 1357 CB HIS A 93 -9.068 11.023 0.757 1.00 0.00 C ATOM 1358 CG HIS A 93 -8.856 9.888 1.712 1.00 0.00 C ATOM 1359 ND1 HIS A 93 -9.126 9.979 3.061 1.00 0.00 N ATOM 1360 CD2 HIS A 93 -8.398 8.631 1.506 1.00 0.00 C ATOM 1361 CE1 HIS A 93 -8.842 8.828 3.643 1.00 0.00 C ATOM 1362 NE2 HIS A 93 -8.399 7.992 2.721 1.00 0.00 N ATOM 0 H HIS A 93 -11.350 10.739 -0.157 1.00 0.00 H new ATOM 0 HA HIS A 93 -10.344 11.925 2.230 1.00 0.00 H new ATOM 0 HB2 HIS A 93 -9.253 10.620 -0.239 1.00 0.00 H new ATOM 0 HB3 HIS A 93 -8.153 11.613 0.697 1.00 0.00 H new ATOM 0 HD1 HIS A 93 -9.488 10.806 3.535 1.00 0.00 H new ATOM 0 HD2 HIS A 93 -8.089 8.209 0.561 1.00 0.00 H new ATOM 0 HE1 HIS A 93 -8.953 8.608 4.694 1.00 0.00 H new ATOM 1370 N GLN A 94 -10.359 13.722 -0.495 1.00 0.00 N ATOM 1371 CA GLN A 94 -10.134 15.060 -1.028 1.00 0.00 C ATOM 1372 C GLN A 94 -10.896 16.104 -0.219 1.00 0.00 C ATOM 1373 O GLN A 94 -10.577 17.291 -0.262 1.00 0.00 O ATOM 1374 CB GLN A 94 -10.558 15.126 -2.496 1.00 0.00 C ATOM 1375 CG GLN A 94 -9.453 14.742 -3.466 1.00 0.00 C ATOM 1376 CD GLN A 94 -9.953 14.595 -4.890 1.00 0.00 C ATOM 1377 OE1 GLN A 94 -10.826 13.774 -5.173 1.00 0.00 O ATOM 1378 NE2 GLN A 94 -9.399 15.392 -5.797 1.00 0.00 N ATOM 0 H GLN A 94 -10.867 13.098 -1.122 1.00 0.00 H new ATOM 0 HA GLN A 94 -9.068 15.277 -0.955 1.00 0.00 H new ATOM 0 HB2 GLN A 94 -11.411 14.465 -2.649 1.00 0.00 H new ATOM 0 HB3 GLN A 94 -10.894 16.138 -2.723 1.00 0.00 H new ATOM 0 HG2 GLN A 94 -8.669 15.499 -3.436 1.00 0.00 H new ATOM 0 HG3 GLN A 94 -9.002 13.803 -3.144 1.00 0.00 H new ATOM 0 HE21 GLN A 94 -8.679 16.058 -5.519 1.00 0.00 H new ATOM 0 HE22 GLN A 94 -9.694 15.338 -6.772 1.00 0.00 H new ATOM 1387 N GLN A 95 -11.906 15.652 0.518 1.00 0.00 N ATOM 1388 CA GLN A 95 -12.714 16.548 1.337 1.00 0.00 C ATOM 1389 C GLN A 95 -12.459 16.308 2.821 1.00 0.00 C ATOM 1390 O GLN A 95 -12.689 17.187 3.652 1.00 0.00 O ATOM 1391 CB GLN A 95 -14.200 16.354 1.026 1.00 0.00 C ATOM 1392 CG GLN A 95 -14.526 16.428 -0.457 1.00 0.00 C ATOM 1393 CD GLN A 95 -16.015 16.530 -0.724 1.00 0.00 C ATOM 1394 OE1 GLN A 95 -16.653 17.523 -0.376 1.00 0.00 O ATOM 1395 NE2 GLN A 95 -16.577 15.498 -1.343 1.00 0.00 N ATOM 0 H GLN A 95 -12.184 14.672 0.565 1.00 0.00 H new ATOM 0 HA GLN A 95 -12.429 17.573 1.099 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -14.520 15.386 1.412 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -14.775 17.114 1.554 1.00 0.00 H new ATOM 0 HG2 GLN A 95 -14.023 17.291 -0.893 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -14.131 15.543 -0.956 1.00 0.00 H new ATOM 0 HE21 GLN A 95 -16.009 14.695 -1.614 1.00 0.00 H new ATOM 0 HE22 GLN A 95 -17.576 15.509 -1.548 1.00 0.00 H new ATOM 1404 N LYS A 96 -11.981 15.112 3.149 1.00 0.00 N ATOM 1405 CA LYS A 96 -11.693 14.757 4.533 1.00 0.00 C ATOM 1406 C LYS A 96 -10.294 14.163 4.662 1.00 0.00 C ATOM 1407 O LYS A 96 -9.973 13.135 4.064 1.00 0.00 O ATOM 1408 CB LYS A 96 -12.732 13.760 5.052 1.00 0.00 C ATOM 1409 CG LYS A 96 -13.937 14.420 5.699 1.00 0.00 C ATOM 1410 CD LYS A 96 -13.725 14.629 7.189 1.00 0.00 C ATOM 1411 CE LYS A 96 -13.912 13.335 7.967 1.00 0.00 C ATOM 1412 NZ LYS A 96 -13.691 13.528 9.426 1.00 0.00 N ATOM 0 H LYS A 96 -11.785 14.372 2.475 1.00 0.00 H new ATOM 0 HA LYS A 96 -11.739 15.666 5.133 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -13.070 13.137 4.224 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -12.258 13.098 5.777 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -14.128 15.380 5.220 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -14.821 13.802 5.539 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -12.722 15.018 7.364 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -14.426 15.379 7.555 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -14.919 12.953 7.800 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -13.219 12.582 7.591 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -13.828 12.623 9.920 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -12.722 13.868 9.588 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -14.369 14.228 9.790 1.00 0.00 H new ATOM 1426 N PRO A 97 -9.442 14.820 5.462 1.00 0.00 N ATOM 1427 CA PRO A 97 -8.064 14.373 5.689 1.00 0.00 C ATOM 1428 C PRO A 97 -7.999 13.091 6.511 1.00 0.00 C ATOM 1429 O PRO A 97 -9.008 12.409 6.697 1.00 0.00 O ATOM 1430 CB PRO A 97 -7.437 15.536 6.462 1.00 0.00 C ATOM 1431 CG PRO A 97 -8.585 16.207 7.134 1.00 0.00 C ATOM 1432 CD PRO A 97 -9.758 16.051 6.206 1.00 0.00 C ATOM 0 HA PRO A 97 -7.552 14.138 4.756 1.00 0.00 H new ATOM 0 HB2 PRO A 97 -6.706 15.180 7.188 1.00 0.00 H new ATOM 0 HB3 PRO A 97 -6.915 16.220 5.793 1.00 0.00 H new ATOM 0 HG2 PRO A 97 -8.791 15.751 8.103 1.00 0.00 H new ATOM 0 HG3 PRO A 97 -8.369 17.260 7.316 1.00 0.00 H new ATOM 0 HD2 PRO A 97 -10.695 15.960 6.755 1.00 0.00 H new ATOM 0 HD3 PRO A 97 -9.861 16.908 5.540 1.00 0.00 H new ATOM 1440 N ILE A 98 -6.808 12.768 7.002 1.00 0.00 N ATOM 1441 CA ILE A 98 -6.612 11.569 7.806 1.00 0.00 C ATOM 1442 C ILE A 98 -6.535 11.908 9.291 1.00 0.00 C ATOM 1443 O ILE A 98 -6.004 12.950 9.672 1.00 0.00 O ATOM 1444 CB ILE A 98 -5.332 10.817 7.395 1.00 0.00 C ATOM 1445 CG1 ILE A 98 -5.041 11.036 5.909 1.00 0.00 C ATOM 1446 CG2 ILE A 98 -5.467 9.333 7.702 1.00 0.00 C ATOM 1447 CD1 ILE A 98 -6.172 10.607 5.002 1.00 0.00 C ATOM 0 H ILE A 98 -5.963 13.321 6.857 1.00 0.00 H new ATOM 0 HA ILE A 98 -7.474 10.926 7.627 1.00 0.00 H new ATOM 0 HB ILE A 98 -4.495 11.212 7.972 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -4.831 12.092 5.740 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -4.140 10.485 5.638 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -4.554 8.816 7.406 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -5.631 9.196 8.771 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -6.312 8.923 7.150 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -5.896 10.791 3.964 1.00 0.00 H new ATOM 0 HD12 ILE A 98 -6.368 9.544 5.142 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -7.069 11.176 5.245 1.00 0.00 H new ATOM 1459 N GLU A 99 -7.067 11.019 10.124 1.00 0.00 N ATOM 1460 CA GLU A 99 -7.058 11.225 11.567 1.00 0.00 C ATOM 1461 C GLU A 99 -5.740 11.845 12.019 1.00 0.00 C ATOM 1462 O GLU A 99 -5.703 12.921 12.618 1.00 0.00 O ATOM 1463 CB GLU A 99 -7.286 9.898 12.296 1.00 0.00 C ATOM 1464 CG GLU A 99 -6.590 9.817 13.644 1.00 0.00 C ATOM 1465 CD GLU A 99 -7.263 8.840 14.590 1.00 0.00 C ATOM 1466 OE1 GLU A 99 -6.900 7.646 14.564 1.00 0.00 O ATOM 1467 OE2 GLU A 99 -8.152 9.270 15.354 1.00 0.00 O ATOM 0 H GLU A 99 -7.509 10.150 9.824 1.00 0.00 H new ATOM 0 HA GLU A 99 -7.867 11.912 11.815 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -8.356 9.751 12.440 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -6.934 9.082 11.665 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -5.553 9.517 13.496 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -6.574 10.807 14.101 1.00 0.00 H new ATOM 1474 N PRO A 100 -4.628 11.153 11.728 1.00 0.00 N ATOM 1475 CA PRO A 100 -3.287 11.616 12.094 1.00 0.00 C ATOM 1476 C PRO A 100 -2.856 12.837 11.289 1.00 0.00 C ATOM 1477 O PRO A 100 -2.408 13.837 11.852 1.00 0.00 O ATOM 1478 CB PRO A 100 -2.395 10.416 11.766 1.00 0.00 C ATOM 1479 CG PRO A 100 -3.137 9.671 10.711 1.00 0.00 C ATOM 1480 CD PRO A 100 -4.597 9.864 11.016 1.00 0.00 C ATOM 0 HA PRO A 100 -3.235 11.930 13.136 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -1.416 10.736 11.410 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -2.227 9.795 12.646 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -2.892 10.051 9.719 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -2.873 8.614 10.721 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -5.197 9.892 10.107 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -4.989 9.055 11.632 1.00 0.00 H new ATOM 1488 N ARG A 101 -2.992 12.749 9.970 1.00 0.00 N ATOM 1489 CA ARG A 101 -2.616 13.847 9.088 1.00 0.00 C ATOM 1490 C ARG A 101 -3.841 14.656 8.674 1.00 0.00 C ATOM 1491 O ARG A 101 -4.732 14.148 7.993 1.00 0.00 O ATOM 1492 CB ARG A 101 -1.902 13.309 7.846 1.00 0.00 C ATOM 1493 CG ARG A 101 -0.619 12.557 8.158 1.00 0.00 C ATOM 1494 CD ARG A 101 0.271 13.344 9.107 1.00 0.00 C ATOM 1495 NE ARG A 101 1.538 12.662 9.362 1.00 0.00 N ATOM 1496 CZ ARG A 101 2.475 13.134 10.175 1.00 0.00 C ATOM 1497 NH1 ARG A 101 2.291 14.283 10.810 1.00 0.00 N ATOM 1498 NH2 ARG A 101 3.601 12.455 10.356 1.00 0.00 N ATOM 0 H ARG A 101 -3.360 11.928 9.489 1.00 0.00 H new ATOM 0 HA ARG A 101 -1.937 14.503 9.634 1.00 0.00 H new ATOM 0 HB2 ARG A 101 -2.579 12.647 7.307 1.00 0.00 H new ATOM 0 HB3 ARG A 101 -1.673 14.141 7.180 1.00 0.00 H new ATOM 0 HG2 ARG A 101 -0.861 11.591 8.601 1.00 0.00 H new ATOM 0 HG3 ARG A 101 -0.079 12.357 7.233 1.00 0.00 H new ATOM 0 HD2 ARG A 101 0.468 14.330 8.685 1.00 0.00 H new ATOM 0 HD3 ARG A 101 -0.253 13.500 10.050 1.00 0.00 H new ATOM 0 HE ARG A 101 1.712 11.775 8.889 1.00 0.00 H new ATOM 0 HH11 ARG A 101 1.427 14.808 10.675 1.00 0.00 H new ATOM 0 HH12 ARG A 101 3.014 14.642 11.434 1.00 0.00 H new ATOM 0 HH21 ARG A 101 3.747 11.570 9.870 1.00 0.00 H new ATOM 0 HH22 ARG A 101 4.321 12.818 10.981 1.00 0.00 H new ATOM 1512 N ARG A 102 -3.878 15.919 9.089 1.00 0.00 N ATOM 1513 CA ARG A 102 -4.994 16.798 8.762 1.00 0.00 C ATOM 1514 C ARG A 102 -4.803 17.431 7.387 1.00 0.00 C ATOM 1515 O ARG A 102 -5.311 18.519 7.120 1.00 0.00 O ATOM 1516 CB ARG A 102 -5.137 17.890 9.823 1.00 0.00 C ATOM 1517 CG ARG A 102 -3.906 18.772 9.960 1.00 0.00 C ATOM 1518 CD ARG A 102 -3.936 19.927 8.972 1.00 0.00 C ATOM 1519 NE ARG A 102 -3.192 21.085 9.463 1.00 0.00 N ATOM 1520 CZ ARG A 102 -2.972 22.177 8.740 1.00 0.00 C ATOM 1521 NH1 ARG A 102 -3.435 22.259 7.499 1.00 0.00 N ATOM 1522 NH2 ARG A 102 -2.287 23.189 9.256 1.00 0.00 N ATOM 0 H ARG A 102 -3.148 16.356 9.652 1.00 0.00 H new ATOM 0 HA ARG A 102 -5.904 16.198 8.743 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -5.995 18.515 9.576 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -5.349 17.424 10.785 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -3.848 19.162 10.976 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -3.009 18.175 9.796 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -3.515 19.602 8.021 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -4.970 20.214 8.781 1.00 0.00 H new ATOM 0 HE ARG A 102 -2.821 21.053 10.413 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -3.961 21.482 7.099 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -3.265 23.099 6.946 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -1.929 23.129 10.209 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -2.119 24.027 8.700 1.00 0.00 H new ATOM 1536 N GLU A 103 -4.069 16.741 6.521 1.00 0.00 N ATOM 1537 CA GLU A 103 -3.810 17.237 5.174 1.00 0.00 C ATOM 1538 C GLU A 103 -4.842 16.696 4.188 1.00 0.00 C ATOM 1539 O GLU A 103 -5.299 15.558 4.312 1.00 0.00 O ATOM 1540 CB GLU A 103 -2.401 16.844 4.723 1.00 0.00 C ATOM 1541 CG GLU A 103 -1.772 17.837 3.761 1.00 0.00 C ATOM 1542 CD GLU A 103 -2.404 17.797 2.384 1.00 0.00 C ATOM 1543 OE1 GLU A 103 -2.042 16.902 1.590 1.00 0.00 O ATOM 1544 OE2 GLU A 103 -3.261 18.660 2.099 1.00 0.00 O ATOM 0 H GLU A 103 -3.643 15.837 6.727 1.00 0.00 H new ATOM 0 HA GLU A 103 -3.886 18.324 5.194 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -1.762 16.746 5.600 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -2.441 15.864 4.247 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -1.866 18.843 4.170 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -0.706 17.627 3.673 1.00 0.00 H new ATOM 1551 N LEU A 104 -5.202 17.517 3.209 1.00 0.00 N ATOM 1552 CA LEU A 104 -6.180 17.123 2.200 1.00 0.00 C ATOM 1553 C LEU A 104 -5.500 16.841 0.863 1.00 0.00 C ATOM 1554 O LEU A 104 -4.282 16.973 0.735 1.00 0.00 O ATOM 1555 CB LEU A 104 -7.235 18.217 2.028 1.00 0.00 C ATOM 1556 CG LEU A 104 -8.464 18.113 2.932 1.00 0.00 C ATOM 1557 CD1 LEU A 104 -9.474 19.196 2.586 1.00 0.00 C ATOM 1558 CD2 LEU A 104 -9.096 16.734 2.817 1.00 0.00 C ATOM 0 H LEU A 104 -4.832 18.460 3.092 1.00 0.00 H new ATOM 0 HA LEU A 104 -6.667 16.209 2.539 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -6.760 19.182 2.204 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -7.570 18.211 0.991 1.00 0.00 H new ATOM 0 HG LEU A 104 -8.146 18.259 3.964 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -10.342 19.106 3.239 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -9.017 20.176 2.722 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -9.788 19.083 1.548 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -9.969 16.679 3.467 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -9.400 16.558 1.785 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -8.372 15.976 3.116 1.00 0.00 H new ATOM 1570 N LEU A 105 -6.295 16.453 -0.128 1.00 0.00 N ATOM 1571 CA LEU A 105 -5.770 16.155 -1.456 1.00 0.00 C ATOM 1572 C LEU A 105 -6.217 17.207 -2.467 1.00 0.00 C ATOM 1573 O LEU A 105 -7.096 18.021 -2.184 1.00 0.00 O ATOM 1574 CB LEU A 105 -6.231 14.768 -1.908 1.00 0.00 C ATOM 1575 CG LEU A 105 -6.059 13.639 -0.892 1.00 0.00 C ATOM 1576 CD1 LEU A 105 -6.647 12.343 -1.429 1.00 0.00 C ATOM 1577 CD2 LEU A 105 -4.589 13.455 -0.544 1.00 0.00 C ATOM 0 H LEU A 105 -7.304 16.337 -0.037 1.00 0.00 H new ATOM 0 HA LEU A 105 -4.681 16.170 -1.402 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -7.285 14.828 -2.179 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -5.684 14.502 -2.812 1.00 0.00 H new ATOM 0 HG LEU A 105 -6.597 13.909 0.017 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -6.515 11.551 -0.692 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -7.710 12.481 -1.628 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -6.138 12.068 -2.353 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -4.485 12.647 0.180 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -4.030 13.207 -1.446 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -4.198 14.378 -0.117 1.00 0.00 H new ATOM 1589 N THR A 106 -5.607 17.182 -3.647 1.00 0.00 N ATOM 1590 CA THR A 106 -5.942 18.131 -4.701 1.00 0.00 C ATOM 1591 C THR A 106 -6.211 17.417 -6.020 1.00 0.00 C ATOM 1592 O THR A 106 -7.274 17.581 -6.618 1.00 0.00 O ATOM 1593 CB THR A 106 -4.814 19.160 -4.908 1.00 0.00 C ATOM 1594 OG1 THR A 106 -3.829 18.635 -5.805 1.00 0.00 O ATOM 1595 CG2 THR A 106 -4.160 19.521 -3.583 1.00 0.00 C ATOM 0 H THR A 106 -4.878 16.514 -3.897 1.00 0.00 H new ATOM 0 HA THR A 106 -6.846 18.651 -4.383 1.00 0.00 H new ATOM 0 HB THR A 106 -5.251 20.062 -5.337 1.00 0.00 H new ATOM 0 HG1 THR A 106 -3.117 19.296 -5.932 1.00 0.00 H new ATOM 0 HG21 THR A 106 -3.367 20.249 -3.755 1.00 0.00 H new ATOM 0 HG22 THR A 106 -4.906 19.949 -2.914 1.00 0.00 H new ATOM 0 HG23 THR A 106 -3.737 18.624 -3.130 1.00 0.00 H new ATOM 1603 N GLN A 107 -5.242 16.626 -6.467 1.00 0.00 N ATOM 1604 CA GLN A 107 -5.376 15.886 -7.717 1.00 0.00 C ATOM 1605 C GLN A 107 -4.503 14.635 -7.706 1.00 0.00 C ATOM 1606 O GLN A 107 -3.472 14.575 -7.036 1.00 0.00 O ATOM 1607 CB GLN A 107 -4.999 16.775 -8.903 1.00 0.00 C ATOM 1608 CG GLN A 107 -3.587 17.332 -8.822 1.00 0.00 C ATOM 1609 CD GLN A 107 -3.357 18.481 -9.784 1.00 0.00 C ATOM 1610 OE1 GLN A 107 -2.909 18.280 -10.913 1.00 0.00 O ATOM 1611 NE2 GLN A 107 -3.661 19.695 -9.340 1.00 0.00 N ATOM 0 H GLN A 107 -4.356 16.481 -5.983 1.00 0.00 H new ATOM 0 HA GLN A 107 -6.417 15.579 -7.818 1.00 0.00 H new ATOM 0 HB2 GLN A 107 -5.102 16.201 -9.824 1.00 0.00 H new ATOM 0 HB3 GLN A 107 -5.704 17.604 -8.964 1.00 0.00 H new ATOM 0 HG2 GLN A 107 -3.392 17.670 -7.804 1.00 0.00 H new ATOM 0 HG3 GLN A 107 -2.874 16.536 -9.036 1.00 0.00 H new ATOM 0 HE21 GLN A 107 -4.030 19.815 -8.397 1.00 0.00 H new ATOM 0 HE22 GLN A 107 -3.526 20.507 -9.942 1.00 0.00 H new ATOM 1620 N PRO A 108 -4.924 13.613 -8.465 1.00 0.00 N ATOM 1621 CA PRO A 108 -4.194 12.344 -8.560 1.00 0.00 C ATOM 1622 C PRO A 108 -2.876 12.489 -9.313 1.00 0.00 C ATOM 1623 O PRO A 108 -2.777 13.260 -10.268 1.00 0.00 O ATOM 1624 CB PRO A 108 -5.155 11.440 -9.334 1.00 0.00 C ATOM 1625 CG PRO A 108 -6.001 12.375 -10.128 1.00 0.00 C ATOM 1626 CD PRO A 108 -6.143 13.616 -9.290 1.00 0.00 C ATOM 0 HA PRO A 108 -3.920 11.957 -7.579 1.00 0.00 H new ATOM 0 HB2 PRO A 108 -4.614 10.750 -9.981 1.00 0.00 H new ATOM 0 HB3 PRO A 108 -5.760 10.836 -8.658 1.00 0.00 H new ATOM 0 HG2 PRO A 108 -5.537 12.603 -11.087 1.00 0.00 H new ATOM 0 HG3 PRO A 108 -6.975 11.935 -10.342 1.00 0.00 H new ATOM 0 HD2 PRO A 108 -6.208 14.512 -9.907 1.00 0.00 H new ATOM 0 HD3 PRO A 108 -7.043 13.585 -8.676 1.00 0.00 H new ATOM 1634 N CYS A 109 -1.866 11.744 -8.876 1.00 0.00 N ATOM 1635 CA CYS A 109 -0.553 11.790 -9.510 1.00 0.00 C ATOM 1636 C CYS A 109 -0.540 10.969 -10.795 1.00 0.00 C ATOM 1637 O CYS A 109 -1.285 9.998 -10.931 1.00 0.00 O ATOM 1638 CB CYS A 109 0.517 11.271 -8.548 1.00 0.00 C ATOM 1639 SG CYS A 109 2.207 11.421 -9.175 1.00 0.00 S ATOM 0 H CYS A 109 -1.931 11.102 -8.086 1.00 0.00 H new ATOM 0 HA CYS A 109 -0.334 12.828 -9.762 1.00 0.00 H new ATOM 0 HB2 CYS A 109 0.440 11.816 -7.607 1.00 0.00 H new ATOM 0 HB3 CYS A 109 0.314 10.223 -8.327 1.00 0.00 H new ATOM 0 HG CYS A 109 3.040 10.958 -8.291 1.00 0.00 H new ATOM 1645 N ARG A 110 0.310 11.366 -11.736 1.00 0.00 N ATOM 1646 CA ARG A 110 0.418 10.669 -13.012 1.00 0.00 C ATOM 1647 C ARG A 110 1.743 9.919 -13.111 1.00 0.00 C ATOM 1648 O ARG A 110 2.804 10.474 -12.829 1.00 0.00 O ATOM 1649 CB ARG A 110 0.293 11.659 -14.171 1.00 0.00 C ATOM 1650 CG ARG A 110 -0.569 12.869 -13.847 1.00 0.00 C ATOM 1651 CD ARG A 110 -2.046 12.510 -13.820 1.00 0.00 C ATOM 1652 NE ARG A 110 -2.891 13.637 -14.207 1.00 0.00 N ATOM 1653 CZ ARG A 110 -2.844 14.213 -15.402 1.00 0.00 C ATOM 1654 NH1 ARG A 110 -1.998 13.772 -16.322 1.00 0.00 N ATOM 1655 NH2 ARG A 110 -3.645 15.234 -15.680 1.00 0.00 N ATOM 0 H ARG A 110 0.934 12.167 -11.639 1.00 0.00 H new ATOM 0 HA ARG A 110 -0.395 9.946 -13.072 1.00 0.00 H new ATOM 0 HB2 ARG A 110 1.289 11.999 -14.457 1.00 0.00 H new ATOM 0 HB3 ARG A 110 -0.128 11.144 -15.034 1.00 0.00 H new ATOM 0 HG2 ARG A 110 -0.275 13.278 -12.880 1.00 0.00 H new ATOM 0 HG3 ARG A 110 -0.397 13.649 -14.589 1.00 0.00 H new ATOM 0 HD2 ARG A 110 -2.228 11.673 -14.494 1.00 0.00 H new ATOM 0 HD3 ARG A 110 -2.320 12.179 -12.818 1.00 0.00 H new ATOM 0 HE ARG A 110 -3.553 14.001 -13.522 1.00 0.00 H new ATOM 0 HH11 ARG A 110 -1.380 12.988 -16.113 1.00 0.00 H new ATOM 0 HH12 ARG A 110 -1.965 14.217 -17.239 1.00 0.00 H new ATOM 0 HH21 ARG A 110 -4.298 15.577 -14.975 1.00 0.00 H new ATOM 0 HH22 ARG A 110 -3.608 15.676 -16.599 1.00 0.00 H new ATOM 1669 N GLN A 111 1.672 8.654 -13.514 1.00 0.00 N ATOM 1670 CA GLN A 111 2.866 7.828 -13.649 1.00 0.00 C ATOM 1671 C GLN A 111 4.025 8.636 -14.224 1.00 0.00 C ATOM 1672 O GLN A 111 3.821 9.557 -15.015 1.00 0.00 O ATOM 1673 CB GLN A 111 2.578 6.620 -14.542 1.00 0.00 C ATOM 1674 CG GLN A 111 1.954 5.449 -13.800 1.00 0.00 C ATOM 1675 CD GLN A 111 1.042 4.617 -14.681 1.00 0.00 C ATOM 1676 OE1 GLN A 111 1.398 3.515 -15.097 1.00 0.00 O ATOM 1677 NE2 GLN A 111 -0.142 5.144 -14.969 1.00 0.00 N ATOM 0 H GLN A 111 0.801 8.179 -13.752 1.00 0.00 H new ATOM 0 HA GLN A 111 3.149 7.478 -12.656 1.00 0.00 H new ATOM 0 HB2 GLN A 111 1.911 6.926 -15.348 1.00 0.00 H new ATOM 0 HB3 GLN A 111 3.508 6.291 -15.005 1.00 0.00 H new ATOM 0 HG2 GLN A 111 2.745 4.814 -13.401 1.00 0.00 H new ATOM 0 HG3 GLN A 111 1.386 5.825 -12.949 1.00 0.00 H new ATOM 0 HE21 GLN A 111 -0.395 6.061 -14.602 1.00 0.00 H new ATOM 0 HE22 GLN A 111 -0.799 4.631 -15.557 1.00 0.00 H new ATOM 1686 N LYS A 112 5.241 8.285 -13.823 1.00 0.00 N ATOM 1687 CA LYS A 112 6.434 8.975 -14.298 1.00 0.00 C ATOM 1688 C LYS A 112 6.708 8.642 -15.762 1.00 0.00 C ATOM 1689 O LYS A 112 6.161 7.681 -16.303 1.00 0.00 O ATOM 1690 CB LYS A 112 7.644 8.594 -13.443 1.00 0.00 C ATOM 1691 CG LYS A 112 7.893 7.098 -13.373 1.00 0.00 C ATOM 1692 CD LYS A 112 8.533 6.700 -12.053 1.00 0.00 C ATOM 1693 CE LYS A 112 9.409 5.467 -12.208 1.00 0.00 C ATOM 1694 NZ LYS A 112 10.658 5.764 -12.963 1.00 0.00 N ATOM 0 H LYS A 112 5.427 7.525 -13.169 1.00 0.00 H new ATOM 0 HA LYS A 112 6.261 10.048 -14.213 1.00 0.00 H new ATOM 0 HB2 LYS A 112 8.531 9.083 -13.846 1.00 0.00 H new ATOM 0 HB3 LYS A 112 7.500 8.977 -12.433 1.00 0.00 H new ATOM 0 HG2 LYS A 112 6.950 6.565 -13.496 1.00 0.00 H new ATOM 0 HG3 LYS A 112 8.540 6.797 -14.197 1.00 0.00 H new ATOM 0 HD2 LYS A 112 9.132 7.528 -11.674 1.00 0.00 H new ATOM 0 HD3 LYS A 112 7.755 6.505 -11.315 1.00 0.00 H new ATOM 0 HE2 LYS A 112 9.665 5.077 -11.223 1.00 0.00 H new ATOM 0 HE3 LYS A 112 8.850 4.687 -12.724 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 11.355 5.011 -12.792 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 10.445 5.814 -13.980 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 11.047 6.675 -12.645 1.00 0.00 H new ATOM 1708 N ASP A 113 7.559 9.442 -16.396 1.00 0.00 N ATOM 1709 CA ASP A 113 7.907 9.231 -17.796 1.00 0.00 C ATOM 1710 C ASP A 113 8.870 8.056 -17.945 1.00 0.00 C ATOM 1711 O ASP A 113 9.978 8.077 -17.411 1.00 0.00 O ATOM 1712 CB ASP A 113 8.533 10.496 -18.384 1.00 0.00 C ATOM 1713 CG ASP A 113 7.492 11.513 -18.808 1.00 0.00 C ATOM 1714 OD1 ASP A 113 7.099 12.346 -17.965 1.00 0.00 O ATOM 1715 OD2 ASP A 113 7.069 11.477 -19.983 1.00 0.00 O ATOM 0 H ASP A 113 8.020 10.242 -15.963 1.00 0.00 H new ATOM 0 HA ASP A 113 6.992 9.000 -18.342 1.00 0.00 H new ATOM 0 HB2 ASP A 113 9.197 10.946 -17.646 1.00 0.00 H new ATOM 0 HB3 ASP A 113 9.147 10.228 -19.244 1.00 0.00 H new ATOM 1720 N SER A 114 8.437 7.032 -18.673 1.00 0.00 N ATOM 1721 CA SER A 114 9.258 5.846 -18.889 1.00 0.00 C ATOM 1722 C SER A 114 10.318 6.106 -19.955 1.00 0.00 C ATOM 1723 O SER A 114 11.517 6.015 -19.690 1.00 0.00 O ATOM 1724 CB SER A 114 8.382 4.662 -19.302 1.00 0.00 C ATOM 1725 OG SER A 114 9.070 3.435 -19.130 1.00 0.00 O ATOM 0 H SER A 114 7.522 6.999 -19.123 1.00 0.00 H new ATOM 0 HA SER A 114 9.761 5.607 -17.952 1.00 0.00 H new ATOM 0 HB2 SER A 114 7.468 4.657 -18.708 1.00 0.00 H new ATOM 0 HB3 SER A 114 8.084 4.772 -20.345 1.00 0.00 H new ATOM 0 HG SER A 114 8.489 2.693 -19.399 1.00 0.00 H new ATOM 1731 N GLY A 115 9.868 6.431 -21.162 1.00 0.00 N ATOM 1732 CA GLY A 115 10.789 6.698 -22.251 1.00 0.00 C ATOM 1733 C GLY A 115 10.319 6.110 -23.566 1.00 0.00 C ATOM 1734 O GLY A 115 9.712 5.040 -23.611 1.00 0.00 O ATOM 0 H GLY A 115 8.881 6.514 -21.406 1.00 0.00 H new ATOM 0 HA2 GLY A 115 10.913 7.775 -22.362 1.00 0.00 H new ATOM 0 HA3 GLY A 115 11.768 6.289 -22.003 1.00 0.00 H new ATOM 1738 N PRO A 116 10.599 6.819 -24.670 1.00 0.00 N ATOM 1739 CA PRO A 116 10.208 6.381 -26.014 1.00 0.00 C ATOM 1740 C PRO A 116 10.998 5.163 -26.478 1.00 0.00 C ATOM 1741 O PRO A 116 10.596 4.468 -27.412 1.00 0.00 O ATOM 1742 CB PRO A 116 10.531 7.594 -26.890 1.00 0.00 C ATOM 1743 CG PRO A 116 11.602 8.320 -26.152 1.00 0.00 C ATOM 1744 CD PRO A 116 11.318 8.104 -24.692 1.00 0.00 C ATOM 0 HA PRO A 116 9.163 6.075 -26.056 1.00 0.00 H new ATOM 0 HB2 PRO A 116 10.870 7.288 -27.880 1.00 0.00 H new ATOM 0 HB3 PRO A 116 9.653 8.223 -27.034 1.00 0.00 H new ATOM 0 HG2 PRO A 116 12.587 7.938 -26.419 1.00 0.00 H new ATOM 0 HG3 PRO A 116 11.595 9.382 -26.398 1.00 0.00 H new ATOM 0 HD2 PRO A 116 12.236 8.061 -24.106 1.00 0.00 H new ATOM 0 HD3 PRO A 116 10.713 8.910 -24.277 1.00 0.00 H new ATOM 1752 N SER A 117 12.125 4.908 -25.820 1.00 0.00 N ATOM 1753 CA SER A 117 12.974 3.774 -26.169 1.00 0.00 C ATOM 1754 C SER A 117 12.134 2.589 -26.633 1.00 0.00 C ATOM 1755 O SER A 117 11.027 2.368 -26.141 1.00 0.00 O ATOM 1756 CB SER A 117 13.833 3.367 -24.970 1.00 0.00 C ATOM 1757 OG SER A 117 13.100 2.554 -24.070 1.00 0.00 O ATOM 0 H SER A 117 12.471 5.471 -25.043 1.00 0.00 H new ATOM 0 HA SER A 117 13.626 4.077 -26.988 1.00 0.00 H new ATOM 0 HB2 SER A 117 14.715 2.828 -25.317 1.00 0.00 H new ATOM 0 HB3 SER A 117 14.188 4.259 -24.453 1.00 0.00 H new ATOM 0 HG SER A 117 13.672 2.306 -23.314 1.00 0.00 H new ATOM 1763 N SER A 118 12.668 1.829 -27.584 1.00 0.00 N ATOM 1764 CA SER A 118 11.966 0.668 -28.119 1.00 0.00 C ATOM 1765 C SER A 118 12.779 -0.604 -27.904 1.00 0.00 C ATOM 1766 O SER A 118 13.979 -0.642 -28.176 1.00 0.00 O ATOM 1767 CB SER A 118 11.682 0.859 -29.610 1.00 0.00 C ATOM 1768 OG SER A 118 12.883 0.840 -30.364 1.00 0.00 O ATOM 0 H SER A 118 13.584 1.996 -28.000 1.00 0.00 H new ATOM 0 HA SER A 118 11.020 0.569 -27.586 1.00 0.00 H new ATOM 0 HB2 SER A 118 11.016 0.071 -29.961 1.00 0.00 H new ATOM 0 HB3 SER A 118 11.165 1.806 -29.767 1.00 0.00 H new ATOM 0 HG SER A 118 12.675 0.962 -31.314 1.00 0.00 H new ATOM 1774 N GLY A 119 12.116 -1.647 -27.412 1.00 0.00 N ATOM 1775 CA GLY A 119 12.792 -2.908 -27.168 1.00 0.00 C ATOM 1776 C GLY A 119 14.174 -2.720 -26.576 1.00 0.00 C ATOM 1777 O GLY A 119 14.488 -1.657 -26.040 1.00 0.00 O ATOM 0 H GLY A 119 11.123 -1.641 -27.178 1.00 0.00 H new ATOM 0 HA2 GLY A 119 12.190 -3.514 -26.491 1.00 0.00 H new ATOM 0 HA3 GLY A 119 12.873 -3.460 -28.104 1.00 0.00 H new TER 1781 GLY A 119