USER MOD reduce.3.24.130724 H: found=0, std=0, add=957, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 957 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 23 LYS NZ :NH3+ 165:sc=-0.00593 (180deg=-0.106) USER MOD Set 1.2: A 99 THR OG1 : rot 76:sc= -0.267 USER MOD Single : A 1 GLY N :NH3+ -110:sc= 0.0266 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= -0.101 USER MOD Single : A 3 SER OG : rot 180:sc= -0.0355 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 8:sc= 1.69 USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 12 THR OG1 : rot 180:sc= -0.0703 USER MOD Single : A 14 HIS : no HD1:sc= -0.212 X(o=-0.21,f=-0.41) USER MOD Single : A 17 GLN : amide:sc= -0.0119 X(o=-0.012,f=-0.31) USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 ASN : amide:sc= 0.86 K(o=0.86,f=-5!) USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 37 THR OG1 : rot 180:sc= -0.222 USER MOD Single : A 44 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 THR OG1 : rot -53:sc= 1.01 USER MOD Single : A 57 SER OG : rot -108:sc= 0.672 USER MOD Single : A 62 SER OG : rot 70:sc= -1.29 USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 GLN : amide:sc= -1.75 K(o=-1.7,f=-2.9!) USER MOD Single : A 74 ASN : amide:sc= -0.35 X(o=-0.35,f=-0.55) USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 80 ASN : amide:sc= 0.245 K(o=0.24,f=-2!) USER MOD Single : A 83 HIS : no HE2:sc= -0.376 K(o=-0.38,f=-2!) USER MOD Single : A 91 LYS NZ :NH3+ -167:sc= -0.288 (180deg=-0.542) USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 95 HIS : no HD1:sc= -0.0603 X(o=-0.06,f=-0.0044) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 HIS :FLIP no HD1:sc= -0.277 F(o=-0.87,f=-0.28) USER MOD Single : A 111 THR OG1 : rot 180:sc= 0.0308 USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 127 SER OG : rot 180:sc= -0.421 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -13.010 15.655 48.455 1.00 0.00 N ATOM 2 CA GLY A 1 -11.975 16.531 49.068 1.00 0.00 C ATOM 3 C GLY A 1 -10.705 16.592 48.242 1.00 0.00 C ATOM 4 O GLY A 1 -10.380 15.649 47.521 1.00 0.00 O ATOM 0 H1 GLY A 1 -13.795 16.239 48.103 1.00 0.00 H new ATOM 0 H2 GLY A 1 -12.592 15.124 47.664 1.00 0.00 H new ATOM 0 H3 GLY A 1 -13.368 14.988 49.169 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -12.378 17.537 49.185 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -11.738 16.164 50.067 1.00 0.00 H new ATOM 10 N SER A 2 -9.986 17.705 48.347 1.00 0.00 N ATOM 11 CA SER A 2 -8.744 17.886 47.603 1.00 0.00 C ATOM 12 C SER A 2 -8.995 17.816 46.101 1.00 0.00 C ATOM 13 O SER A 2 -9.154 16.733 45.537 1.00 0.00 O ATOM 14 CB SER A 2 -7.721 16.824 48.012 1.00 0.00 C ATOM 15 OG SER A 2 -7.993 16.327 49.310 1.00 0.00 O ATOM 0 H SER A 2 -10.242 18.495 48.940 1.00 0.00 H new ATOM 0 HA SER A 2 -8.347 18.873 47.841 1.00 0.00 H new ATOM 0 HB2 SER A 2 -7.737 16.004 47.294 1.00 0.00 H new ATOM 0 HB3 SER A 2 -6.718 17.251 47.985 1.00 0.00 H new ATOM 0 HG SER A 2 -7.326 15.649 49.547 1.00 0.00 H new ATOM 21 N SER A 3 -9.030 18.979 45.457 1.00 0.00 N ATOM 22 CA SER A 3 -9.262 19.050 44.019 1.00 0.00 C ATOM 23 C SER A 3 -8.023 18.613 43.244 1.00 0.00 C ATOM 24 O SER A 3 -6.968 18.367 43.828 1.00 0.00 O ATOM 25 CB SER A 3 -9.655 20.472 43.615 1.00 0.00 C ATOM 26 OG SER A 3 -10.195 20.499 42.305 1.00 0.00 O ATOM 0 H SER A 3 -8.901 19.884 45.908 1.00 0.00 H new ATOM 0 HA SER A 3 -10.079 18.371 43.775 1.00 0.00 H new ATOM 0 HB2 SER A 3 -10.386 20.865 44.321 1.00 0.00 H new ATOM 0 HB3 SER A 3 -8.782 21.122 43.665 1.00 0.00 H new ATOM 0 HG SER A 3 -10.440 21.419 42.071 1.00 0.00 H new ATOM 32 N GLY A 4 -8.159 18.519 41.926 1.00 0.00 N ATOM 33 CA GLY A 4 -7.043 18.114 41.091 1.00 0.00 C ATOM 34 C GLY A 4 -6.638 16.672 41.323 1.00 0.00 C ATOM 35 O GLY A 4 -6.293 16.288 42.441 1.00 0.00 O ATOM 0 H GLY A 4 -9.023 18.716 41.420 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -7.310 18.249 40.043 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -6.191 18.764 41.289 1.00 0.00 H new ATOM 39 N SER A 5 -6.680 15.871 40.263 1.00 0.00 N ATOM 40 CA SER A 5 -6.313 14.463 40.353 1.00 0.00 C ATOM 41 C SER A 5 -5.596 14.007 39.086 1.00 0.00 C ATOM 42 O SER A 5 -5.404 14.788 38.154 1.00 0.00 O ATOM 43 CB SER A 5 -7.558 13.604 40.584 1.00 0.00 C ATOM 44 OG SER A 5 -8.648 14.064 39.804 1.00 0.00 O ATOM 0 H SER A 5 -6.965 16.174 39.331 1.00 0.00 H new ATOM 0 HA SER A 5 -5.635 14.343 41.198 1.00 0.00 H new ATOM 0 HB2 SER A 5 -7.339 12.566 40.332 1.00 0.00 H new ATOM 0 HB3 SER A 5 -7.828 13.626 41.640 1.00 0.00 H new ATOM 0 HG SER A 5 -9.430 13.497 39.969 1.00 0.00 H new ATOM 50 N SER A 6 -5.199 12.738 39.060 1.00 0.00 N ATOM 51 CA SER A 6 -4.500 12.174 37.908 1.00 0.00 C ATOM 52 C SER A 6 -3.273 13.009 37.549 1.00 0.00 C ATOM 53 O SER A 6 -3.329 13.865 36.666 1.00 0.00 O ATOM 54 CB SER A 6 -5.443 12.083 36.706 1.00 0.00 C ATOM 55 OG SER A 6 -5.699 13.364 36.156 1.00 0.00 O ATOM 0 H SER A 6 -5.349 12.079 39.824 1.00 0.00 H new ATOM 0 HA SER A 6 -4.166 11.171 38.174 1.00 0.00 H new ATOM 0 HB2 SER A 6 -5.004 11.439 35.944 1.00 0.00 H new ATOM 0 HB3 SER A 6 -6.382 11.621 37.011 1.00 0.00 H new ATOM 0 HG SER A 6 -5.112 14.025 36.580 1.00 0.00 H new ATOM 61 N GLY A 7 -2.168 12.753 38.238 1.00 0.00 N ATOM 62 CA GLY A 7 -0.945 13.489 37.978 1.00 0.00 C ATOM 63 C GLY A 7 0.286 12.605 38.027 1.00 0.00 C ATOM 64 O GLY A 7 1.082 12.689 38.963 1.00 0.00 O ATOM 0 H GLY A 7 -2.097 12.049 38.972 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -1.010 13.961 36.998 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -0.843 14.289 38.711 1.00 0.00 H new ATOM 68 N ASP A 8 0.442 11.754 37.018 1.00 0.00 N ATOM 69 CA ASP A 8 1.585 10.851 36.951 1.00 0.00 C ATOM 70 C ASP A 8 2.189 10.842 35.551 1.00 0.00 C ATOM 71 O ASP A 8 1.686 11.501 34.642 1.00 0.00 O ATOM 72 CB ASP A 8 1.164 9.433 37.346 1.00 0.00 C ATOM 73 CG ASP A 8 0.107 8.865 36.421 1.00 0.00 C ATOM 74 OD1 ASP A 8 -0.594 9.662 35.760 1.00 0.00 O ATOM 75 OD2 ASP A 8 -0.020 7.625 36.354 1.00 0.00 O ATOM 0 H ASP A 8 -0.208 11.671 36.236 1.00 0.00 H new ATOM 0 HA ASP A 8 2.340 11.208 37.651 1.00 0.00 H new ATOM 0 HB2 ASP A 8 2.038 8.782 37.337 1.00 0.00 H new ATOM 0 HB3 ASP A 8 0.783 9.441 38.367 1.00 0.00 H new ATOM 80 N ARG A 9 3.272 10.089 35.385 1.00 0.00 N ATOM 81 CA ARG A 9 3.946 9.993 34.096 1.00 0.00 C ATOM 82 C ARG A 9 4.499 8.590 33.874 1.00 0.00 C ATOM 83 O ARG A 9 5.146 8.020 34.753 1.00 0.00 O ATOM 84 CB ARG A 9 5.079 11.019 34.012 1.00 0.00 C ATOM 85 CG ARG A 9 5.278 11.592 32.617 1.00 0.00 C ATOM 86 CD ARG A 9 6.725 11.472 32.163 1.00 0.00 C ATOM 87 NE ARG A 9 7.582 12.471 32.798 1.00 0.00 N ATOM 88 CZ ARG A 9 8.790 12.802 32.349 1.00 0.00 C ATOM 89 NH1 ARG A 9 9.287 12.218 31.265 1.00 0.00 N ATOM 90 NH2 ARG A 9 9.505 13.720 32.986 1.00 0.00 N ATOM 0 H ARG A 9 3.701 9.537 36.127 1.00 0.00 H new ATOM 0 HA ARG A 9 3.215 10.203 33.316 1.00 0.00 H new ATOM 0 HB2 ARG A 9 4.872 11.835 34.705 1.00 0.00 H new ATOM 0 HB3 ARG A 9 6.007 10.551 34.339 1.00 0.00 H new ATOM 0 HG2 ARG A 9 4.631 11.069 31.913 1.00 0.00 H new ATOM 0 HG3 ARG A 9 4.979 12.640 32.608 1.00 0.00 H new ATOM 0 HD2 ARG A 9 7.097 10.474 32.396 1.00 0.00 H new ATOM 0 HD3 ARG A 9 6.776 11.586 31.080 1.00 0.00 H new ATOM 0 HE ARG A 9 7.234 12.942 33.633 1.00 0.00 H new ATOM 0 HH11 ARG A 9 8.742 11.511 30.771 1.00 0.00 H new ATOM 0 HH12 ARG A 9 10.214 12.476 30.926 1.00 0.00 H new ATOM 0 HH21 ARG A 9 9.129 14.172 33.820 1.00 0.00 H new ATOM 0 HH22 ARG A 9 10.431 13.974 32.642 1.00 0.00 H new ATOM 104 N ARG A 10 4.239 8.036 32.695 1.00 0.00 N ATOM 105 CA ARG A 10 4.710 6.698 32.359 1.00 0.00 C ATOM 106 C ARG A 10 4.644 6.458 30.854 1.00 0.00 C ATOM 107 O ARG A 10 5.639 6.087 30.230 1.00 0.00 O ATOM 108 CB ARG A 10 3.880 5.643 33.093 1.00 0.00 C ATOM 109 CG ARG A 10 4.702 4.473 33.608 1.00 0.00 C ATOM 110 CD ARG A 10 4.005 3.768 34.761 1.00 0.00 C ATOM 111 NE ARG A 10 2.636 3.385 34.421 1.00 0.00 N ATOM 112 CZ ARG A 10 1.857 2.648 35.209 1.00 0.00 C ATOM 113 NH1 ARG A 10 2.305 2.213 36.380 1.00 0.00 N ATOM 114 NH2 ARG A 10 0.623 2.346 34.825 1.00 0.00 N ATOM 0 H ARG A 10 3.705 8.493 31.956 1.00 0.00 H new ATOM 0 HA ARG A 10 5.750 6.617 32.675 1.00 0.00 H new ATOM 0 HB2 ARG A 10 3.369 6.114 33.932 1.00 0.00 H new ATOM 0 HB3 ARG A 10 3.109 5.267 32.421 1.00 0.00 H new ATOM 0 HG2 ARG A 10 4.876 3.764 32.798 1.00 0.00 H new ATOM 0 HG3 ARG A 10 5.679 4.829 33.935 1.00 0.00 H new ATOM 0 HD2 ARG A 10 4.572 2.879 35.038 1.00 0.00 H new ATOM 0 HD3 ARG A 10 3.993 4.423 35.632 1.00 0.00 H new ATOM 0 HE ARG A 10 2.256 3.701 33.529 1.00 0.00 H new ATOM 0 HH11 ARG A 10 3.252 2.443 36.681 1.00 0.00 H new ATOM 0 HH12 ARG A 10 1.702 1.649 36.979 1.00 0.00 H new ATOM 0 HH21 ARG A 10 0.273 2.679 33.927 1.00 0.00 H new ATOM 0 HH22 ARG A 10 0.025 1.781 35.428 1.00 0.00 H new ATOM 128 N SER A 11 3.467 6.672 30.275 1.00 0.00 N ATOM 129 CA SER A 11 3.272 6.479 28.844 1.00 0.00 C ATOM 130 C SER A 11 3.796 7.676 28.057 1.00 0.00 C ATOM 131 O SER A 11 3.915 8.778 28.592 1.00 0.00 O ATOM 132 CB SER A 11 1.790 6.262 28.534 1.00 0.00 C ATOM 133 OG SER A 11 1.036 7.432 28.797 1.00 0.00 O ATOM 0 H SER A 11 2.633 6.979 30.776 1.00 0.00 H new ATOM 0 HA SER A 11 3.833 5.594 28.543 1.00 0.00 H new ATOM 0 HB2 SER A 11 1.672 5.977 27.488 1.00 0.00 H new ATOM 0 HB3 SER A 11 1.407 5.437 29.134 1.00 0.00 H new ATOM 0 HG SER A 11 0.093 7.267 28.589 1.00 0.00 H new ATOM 139 N THR A 12 4.108 7.451 26.785 1.00 0.00 N ATOM 140 CA THR A 12 4.619 8.511 25.925 1.00 0.00 C ATOM 141 C THR A 12 4.126 8.333 24.491 1.00 0.00 C ATOM 142 O THR A 12 4.913 8.075 23.581 1.00 0.00 O ATOM 143 CB THR A 12 6.148 8.528 25.957 1.00 0.00 C ATOM 144 OG1 THR A 12 6.630 8.010 27.183 1.00 0.00 O ATOM 145 CG2 THR A 12 6.735 9.912 25.780 1.00 0.00 C ATOM 0 H THR A 12 4.016 6.544 26.327 1.00 0.00 H new ATOM 0 HA THR A 12 4.246 9.464 26.301 1.00 0.00 H new ATOM 0 HB THR A 12 6.461 7.908 25.117 1.00 0.00 H new ATOM 0 HG1 THR A 12 7.610 8.028 27.183 1.00 0.00 H new ATOM 0 HG21 THR A 12 7.823 9.853 25.813 1.00 0.00 H new ATOM 0 HG22 THR A 12 6.422 10.320 24.819 1.00 0.00 H new ATOM 0 HG23 THR A 12 6.383 10.562 26.581 1.00 0.00 H new ATOM 153 N LEU A 13 2.819 8.477 24.299 1.00 0.00 N ATOM 154 CA LEU A 13 2.221 8.333 22.977 1.00 0.00 C ATOM 155 C LEU A 13 1.777 9.687 22.430 1.00 0.00 C ATOM 156 O LEU A 13 1.924 10.713 23.093 1.00 0.00 O ATOM 157 CB LEU A 13 1.028 7.376 23.033 1.00 0.00 C ATOM 158 CG LEU A 13 0.906 6.424 21.842 1.00 0.00 C ATOM 159 CD1 LEU A 13 1.596 5.103 22.141 1.00 0.00 C ATOM 160 CD2 LEU A 13 -0.557 6.195 21.489 1.00 0.00 C ATOM 0 H LEU A 13 2.154 8.693 25.042 1.00 0.00 H new ATOM 0 HA LEU A 13 2.976 7.921 22.308 1.00 0.00 H new ATOM 0 HB2 LEU A 13 1.099 6.785 23.946 1.00 0.00 H new ATOM 0 HB3 LEU A 13 0.113 7.964 23.104 1.00 0.00 H new ATOM 0 HG LEU A 13 1.399 6.882 20.984 1.00 0.00 H new ATOM 0 HD11 LEU A 13 1.498 4.439 21.282 1.00 0.00 H new ATOM 0 HD12 LEU A 13 2.652 5.282 22.343 1.00 0.00 H new ATOM 0 HD13 LEU A 13 1.133 4.640 23.012 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -0.624 5.515 20.640 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -1.074 5.759 22.344 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -1.022 7.146 21.230 1.00 0.00 H new ATOM 172 N HIS A 14 1.236 9.680 21.217 1.00 0.00 N ATOM 173 CA HIS A 14 0.770 10.907 20.579 1.00 0.00 C ATOM 174 C HIS A 14 -0.680 10.769 20.126 1.00 0.00 C ATOM 175 O HIS A 14 -1.094 9.710 19.654 1.00 0.00 O ATOM 176 CB HIS A 14 1.660 11.253 19.385 1.00 0.00 C ATOM 177 CG HIS A 14 1.815 12.724 19.160 1.00 0.00 C ATOM 178 ND1 HIS A 14 1.884 13.641 20.189 1.00 0.00 N ATOM 179 CD2 HIS A 14 1.916 13.441 18.016 1.00 0.00 C ATOM 180 CE1 HIS A 14 2.019 14.855 19.688 1.00 0.00 C ATOM 181 NE2 HIS A 14 2.042 14.761 18.371 1.00 0.00 N ATOM 0 H HIS A 14 1.109 8.838 20.655 1.00 0.00 H new ATOM 0 HA HIS A 14 0.826 11.713 21.311 1.00 0.00 H new ATOM 0 HB2 HIS A 14 2.645 10.811 19.537 1.00 0.00 H new ATOM 0 HB3 HIS A 14 1.242 10.799 18.487 1.00 0.00 H new ATOM 0 HD2 HIS A 14 1.900 13.047 17.010 1.00 0.00 H new ATOM 0 HE1 HIS A 14 2.097 15.769 20.258 1.00 0.00 H new ATOM 0 HE2 HIS A 14 2.138 15.543 17.723 1.00 0.00 H new ATOM 190 N LEU A 15 -1.446 11.845 20.273 1.00 0.00 N ATOM 191 CA LEU A 15 -2.850 11.844 19.879 1.00 0.00 C ATOM 192 C LEU A 15 -3.111 12.884 18.793 1.00 0.00 C ATOM 193 O LEU A 15 -4.146 13.551 18.794 1.00 0.00 O ATOM 194 CB LEU A 15 -3.741 12.120 21.092 1.00 0.00 C ATOM 195 CG LEU A 15 -3.356 11.361 22.363 1.00 0.00 C ATOM 196 CD1 LEU A 15 -2.347 12.158 23.176 1.00 0.00 C ATOM 197 CD2 LEU A 15 -4.592 11.056 23.197 1.00 0.00 C ATOM 0 H LEU A 15 -1.118 12.729 20.662 1.00 0.00 H new ATOM 0 HA LEU A 15 -3.089 10.859 19.478 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -3.719 13.189 21.304 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -4.769 11.868 20.834 1.00 0.00 H new ATOM 0 HG LEU A 15 -2.895 10.417 22.073 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -2.085 11.602 24.076 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -1.450 12.326 22.579 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -2.782 13.118 23.456 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -4.299 10.516 24.097 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -5.082 11.989 23.477 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -5.282 10.445 22.615 1.00 0.00 H new ATOM 209 N LEU A 16 -2.166 13.014 17.868 1.00 0.00 N ATOM 210 CA LEU A 16 -2.293 13.971 16.775 1.00 0.00 C ATOM 211 C LEU A 16 -2.001 13.307 15.434 1.00 0.00 C ATOM 212 O LEU A 16 -1.383 13.907 14.554 1.00 0.00 O ATOM 213 CB LEU A 16 -1.344 15.153 16.992 1.00 0.00 C ATOM 214 CG LEU A 16 -1.829 16.487 16.419 1.00 0.00 C ATOM 215 CD1 LEU A 16 -1.511 17.628 17.373 1.00 0.00 C ATOM 216 CD2 LEU A 16 -1.204 16.739 15.055 1.00 0.00 C ATOM 0 H LEU A 16 -1.304 12.469 17.853 1.00 0.00 H new ATOM 0 HA LEU A 16 -3.320 14.337 16.762 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -1.178 15.274 18.062 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -0.380 14.912 16.545 1.00 0.00 H new ATOM 0 HG LEU A 16 -2.911 16.436 16.298 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -1.864 18.567 16.947 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -2.007 17.453 18.328 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -0.434 17.682 17.529 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -1.560 17.692 14.662 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -0.119 16.769 15.152 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -1.485 15.937 14.372 1.00 0.00 H new ATOM 228 N GLN A 17 -2.446 12.064 15.287 1.00 0.00 N ATOM 229 CA GLN A 17 -2.233 11.316 14.054 1.00 0.00 C ATOM 230 C GLN A 17 -3.497 11.302 13.200 1.00 0.00 C ATOM 231 O GLN A 17 -4.601 11.116 13.711 1.00 0.00 O ATOM 232 CB GLN A 17 -1.801 9.883 14.371 1.00 0.00 C ATOM 233 CG GLN A 17 -0.353 9.769 14.818 1.00 0.00 C ATOM 234 CD GLN A 17 0.620 9.798 13.655 1.00 0.00 C ATOM 235 OE1 GLN A 17 0.432 9.103 12.656 1.00 0.00 O ATOM 236 NE2 GLN A 17 1.667 10.605 13.780 1.00 0.00 N ATOM 0 H GLN A 17 -2.957 11.553 16.007 1.00 0.00 H new ATOM 0 HA GLN A 17 -1.442 11.811 13.490 1.00 0.00 H new ATOM 0 HB2 GLN A 17 -2.446 9.482 15.153 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -1.949 9.264 13.486 1.00 0.00 H new ATOM 0 HG2 GLN A 17 -0.122 10.587 15.501 1.00 0.00 H new ATOM 0 HG3 GLN A 17 -0.220 8.841 15.375 1.00 0.00 H new ATOM 0 HE21 GLN A 17 1.783 11.163 14.626 1.00 0.00 H new ATOM 0 HE22 GLN A 17 2.356 10.667 13.030 1.00 0.00 H new ATOM 245 N GLY A 18 -3.327 11.499 11.896 1.00 0.00 N ATOM 246 CA GLY A 18 -4.463 11.504 10.993 1.00 0.00 C ATOM 247 C GLY A 18 -4.799 12.895 10.492 1.00 0.00 C ATOM 248 O GLY A 18 -3.945 13.781 10.477 1.00 0.00 O ATOM 0 H GLY A 18 -2.423 11.655 11.449 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -4.250 10.856 10.142 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -5.331 11.085 11.503 1.00 0.00 H new ATOM 252 N GLY A 19 -6.049 13.087 10.082 1.00 0.00 N ATOM 253 CA GLY A 19 -6.474 14.383 9.585 1.00 0.00 C ATOM 254 C GLY A 19 -6.591 14.414 8.073 1.00 0.00 C ATOM 255 O GLY A 19 -7.574 14.918 7.531 1.00 0.00 O ATOM 0 H GLY A 19 -6.774 12.370 10.085 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -7.437 14.640 10.026 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -5.763 15.143 9.907 1.00 0.00 H new ATOM 259 N ASP A 20 -5.585 13.875 7.393 1.00 0.00 N ATOM 260 CA ASP A 20 -5.579 13.845 5.935 1.00 0.00 C ATOM 261 C ASP A 20 -5.248 12.447 5.420 1.00 0.00 C ATOM 262 O ASP A 20 -4.649 12.292 4.355 1.00 0.00 O ATOM 263 CB ASP A 20 -4.569 14.854 5.386 1.00 0.00 C ATOM 264 CG ASP A 20 -5.190 16.214 5.135 1.00 0.00 C ATOM 265 OD1 ASP A 20 -6.257 16.497 5.720 1.00 0.00 O ATOM 266 OD2 ASP A 20 -4.610 16.997 4.354 1.00 0.00 O ATOM 0 H ASP A 20 -4.764 13.453 7.827 1.00 0.00 H new ATOM 0 HA ASP A 20 -6.577 14.114 5.588 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -3.744 14.959 6.091 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -4.147 14.473 4.456 1.00 0.00 H new ATOM 271 N GLU A 21 -5.644 11.432 6.181 1.00 0.00 N ATOM 272 CA GLU A 21 -5.389 10.048 5.801 1.00 0.00 C ATOM 273 C GLU A 21 -6.670 9.372 5.322 1.00 0.00 C ATOM 274 O GLU A 21 -7.701 9.427 5.992 1.00 0.00 O ATOM 275 CB GLU A 21 -4.799 9.273 6.981 1.00 0.00 C ATOM 276 CG GLU A 21 -3.279 9.246 6.993 1.00 0.00 C ATOM 277 CD GLU A 21 -2.691 9.978 8.183 1.00 0.00 C ATOM 278 OE1 GLU A 21 -2.750 9.431 9.305 1.00 0.00 O ATOM 279 OE2 GLU A 21 -2.172 11.098 7.994 1.00 0.00 O ATOM 0 H GLU A 21 -6.143 11.542 7.064 1.00 0.00 H new ATOM 0 HA GLU A 21 -4.671 10.048 4.981 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -5.153 9.718 7.911 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -5.172 8.249 6.955 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -2.938 8.211 7.004 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -2.904 9.696 6.073 1.00 0.00 H new ATOM 286 N LYS A 22 -6.596 8.733 4.158 1.00 0.00 N ATOM 287 CA LYS A 22 -7.750 8.045 3.589 1.00 0.00 C ATOM 288 C LYS A 22 -7.480 6.550 3.456 1.00 0.00 C ATOM 289 O LYS A 22 -6.388 6.139 3.064 1.00 0.00 O ATOM 290 CB LYS A 22 -8.100 8.636 2.223 1.00 0.00 C ATOM 291 CG LYS A 22 -9.507 8.298 1.757 1.00 0.00 C ATOM 292 CD LYS A 22 -9.911 9.135 0.555 1.00 0.00 C ATOM 293 CE LYS A 22 -9.681 8.387 -0.749 1.00 0.00 C ATOM 294 NZ LYS A 22 -9.986 9.233 -1.937 1.00 0.00 N ATOM 0 H LYS A 22 -5.750 8.677 3.591 1.00 0.00 H new ATOM 0 HA LYS A 22 -8.594 8.185 4.264 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -7.991 9.720 2.266 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -7.385 8.273 1.485 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -9.562 7.240 1.500 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -10.211 8.465 2.572 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -10.963 9.408 0.638 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -9.340 10.063 0.549 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -8.645 8.053 -0.798 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -10.305 7.494 -0.770 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -9.816 8.686 -2.805 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -10.982 9.531 -1.904 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -9.373 10.073 -1.932 1.00 0.00 H new ATOM 308 N LYS A 23 -8.482 5.741 3.785 1.00 0.00 N ATOM 309 CA LYS A 23 -8.351 4.291 3.703 1.00 0.00 C ATOM 310 C LYS A 23 -9.176 3.735 2.546 1.00 0.00 C ATOM 311 O LYS A 23 -10.363 4.035 2.415 1.00 0.00 O ATOM 312 CB LYS A 23 -8.794 3.645 5.017 1.00 0.00 C ATOM 313 CG LYS A 23 -7.901 2.499 5.464 1.00 0.00 C ATOM 314 CD LYS A 23 -7.892 2.357 6.978 1.00 0.00 C ATOM 315 CE LYS A 23 -6.591 1.746 7.472 1.00 0.00 C ATOM 316 NZ LYS A 23 -5.457 2.709 7.386 1.00 0.00 N ATOM 0 H LYS A 23 -9.393 6.065 4.111 1.00 0.00 H new ATOM 0 HA LYS A 23 -7.302 4.054 3.524 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -8.813 4.405 5.798 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -9.814 3.277 4.905 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -8.247 1.569 5.012 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -6.885 2.668 5.107 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -8.033 3.335 7.437 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -8.730 1.734 7.291 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -6.712 1.419 8.505 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -6.360 0.859 6.882 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -4.660 2.358 7.955 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -5.159 2.806 6.394 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -5.760 3.635 7.749 1.00 0.00 H new ATOM 330 N VAL A 24 -8.539 2.921 1.709 1.00 0.00 N ATOM 331 CA VAL A 24 -9.214 2.323 0.564 1.00 0.00 C ATOM 332 C VAL A 24 -9.040 0.808 0.556 1.00 0.00 C ATOM 333 O VAL A 24 -8.027 0.292 0.086 1.00 0.00 O ATOM 334 CB VAL A 24 -8.684 2.896 -0.764 1.00 0.00 C ATOM 335 CG1 VAL A 24 -9.530 2.412 -1.931 1.00 0.00 C ATOM 336 CG2 VAL A 24 -8.650 4.415 -0.713 1.00 0.00 C ATOM 0 H VAL A 24 -7.557 2.661 1.803 1.00 0.00 H new ATOM 0 HA VAL A 24 -10.272 2.566 0.658 1.00 0.00 H new ATOM 0 HB VAL A 24 -7.665 2.538 -0.913 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -9.140 2.827 -2.860 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -9.496 1.324 -1.978 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -10.561 2.738 -1.793 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -8.273 4.802 -1.659 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -9.657 4.796 -0.540 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -7.996 4.737 0.097 1.00 0.00 H new ATOM 346 N ASN A 25 -10.036 0.101 1.078 1.00 0.00 N ATOM 347 CA ASN A 25 -9.995 -1.356 1.131 1.00 0.00 C ATOM 348 C ASN A 25 -10.393 -1.960 -0.211 1.00 0.00 C ATOM 349 O ASN A 25 -11.431 -1.615 -0.775 1.00 0.00 O ATOM 350 CB ASN A 25 -10.921 -1.874 2.233 1.00 0.00 C ATOM 351 CG ASN A 25 -12.326 -1.312 2.119 1.00 0.00 C ATOM 352 OD1 ASN A 25 -12.516 -0.100 2.030 1.00 0.00 O ATOM 353 ND2 ASN A 25 -13.317 -2.194 2.122 1.00 0.00 N ATOM 0 H ASN A 25 -10.882 0.513 1.471 1.00 0.00 H new ATOM 0 HA ASN A 25 -8.972 -1.658 1.355 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -10.963 -2.962 2.187 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -10.506 -1.612 3.206 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -14.283 -1.876 2.048 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -13.113 -3.190 2.198 1.00 0.00 H new ATOM 360 N LEU A 26 -9.560 -2.863 -0.719 1.00 0.00 N ATOM 361 CA LEU A 26 -9.825 -3.516 -1.996 1.00 0.00 C ATOM 362 C LEU A 26 -9.821 -5.033 -1.843 1.00 0.00 C ATOM 363 O LEU A 26 -8.881 -5.610 -1.296 1.00 0.00 O ATOM 364 CB LEU A 26 -8.782 -3.094 -3.033 1.00 0.00 C ATOM 365 CG LEU A 26 -8.910 -1.653 -3.533 1.00 0.00 C ATOM 366 CD1 LEU A 26 -7.765 -1.312 -4.472 1.00 0.00 C ATOM 367 CD2 LEU A 26 -10.249 -1.447 -4.224 1.00 0.00 C ATOM 0 H LEU A 26 -8.696 -3.159 -0.266 1.00 0.00 H new ATOM 0 HA LEU A 26 -10.813 -3.206 -2.336 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -7.790 -3.226 -2.602 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -8.850 -3.766 -3.888 1.00 0.00 H new ATOM 0 HG LEU A 26 -8.860 -0.983 -2.674 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -7.872 -0.284 -4.818 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -6.817 -1.421 -3.945 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -7.783 -1.986 -5.328 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -10.324 -0.417 -4.573 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -10.328 -2.125 -5.074 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -11.056 -1.651 -3.521 1.00 0.00 H new ATOM 379 N VAL A 27 -10.878 -5.674 -2.330 1.00 0.00 N ATOM 380 CA VAL A 27 -10.998 -7.124 -2.249 1.00 0.00 C ATOM 381 C VAL A 27 -10.912 -7.761 -3.632 1.00 0.00 C ATOM 382 O VAL A 27 -11.832 -7.639 -4.441 1.00 0.00 O ATOM 383 CB VAL A 27 -12.323 -7.543 -1.585 1.00 0.00 C ATOM 384 CG1 VAL A 27 -12.342 -9.041 -1.327 1.00 0.00 C ATOM 385 CG2 VAL A 27 -12.540 -6.768 -0.293 1.00 0.00 C ATOM 0 H VAL A 27 -11.665 -5.211 -2.785 1.00 0.00 H new ATOM 0 HA VAL A 27 -10.167 -7.476 -1.637 1.00 0.00 H new ATOM 0 HB VAL A 27 -13.141 -7.306 -2.266 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -13.286 -9.317 -0.858 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -12.237 -9.574 -2.272 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -11.517 -9.307 -0.666 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -13.481 -7.077 0.163 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -11.720 -6.971 0.395 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -12.575 -5.701 -0.511 1.00 0.00 H new ATOM 395 N LEU A 28 -9.800 -8.439 -3.898 1.00 0.00 N ATOM 396 CA LEU A 28 -9.593 -9.094 -5.184 1.00 0.00 C ATOM 397 C LEU A 28 -10.154 -10.513 -5.170 1.00 0.00 C ATOM 398 O LEU A 28 -9.945 -11.263 -4.218 1.00 0.00 O ATOM 399 CB LEU A 28 -8.103 -9.125 -5.529 1.00 0.00 C ATOM 400 CG LEU A 28 -7.427 -7.756 -5.607 1.00 0.00 C ATOM 401 CD1 LEU A 28 -5.916 -7.909 -5.657 1.00 0.00 C ATOM 402 CD2 LEU A 28 -7.928 -6.984 -6.818 1.00 0.00 C ATOM 0 H LEU A 28 -9.029 -8.549 -3.240 1.00 0.00 H new ATOM 0 HA LEU A 28 -10.124 -8.522 -5.945 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -7.585 -9.727 -4.782 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -7.978 -9.630 -6.487 1.00 0.00 H new ATOM 0 HG LEU A 28 -7.684 -7.193 -4.710 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -5.452 -6.924 -5.712 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -5.572 -8.422 -4.759 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -5.638 -8.491 -6.536 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -7.437 -6.012 -6.858 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -7.701 -7.543 -7.726 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -9.006 -6.843 -6.739 1.00 0.00 H new ATOM 414 N GLY A 29 -10.865 -10.872 -6.232 1.00 0.00 N ATOM 415 CA GLY A 29 -11.444 -12.200 -6.322 1.00 0.00 C ATOM 416 C GLY A 29 -10.389 -13.286 -6.396 1.00 0.00 C ATOM 417 O GLY A 29 -9.600 -13.458 -5.466 1.00 0.00 O ATOM 0 H GLY A 29 -11.051 -10.268 -7.032 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -12.082 -12.375 -5.455 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -12.082 -12.256 -7.204 1.00 0.00 H new ATOM 421 N ASP A 30 -10.373 -14.021 -7.503 1.00 0.00 N ATOM 422 CA ASP A 30 -9.407 -15.095 -7.693 1.00 0.00 C ATOM 423 C ASP A 30 -8.022 -14.533 -7.997 1.00 0.00 C ATOM 424 O ASP A 30 -7.138 -14.537 -7.140 1.00 0.00 O ATOM 425 CB ASP A 30 -9.856 -16.019 -8.827 1.00 0.00 C ATOM 426 CG ASP A 30 -10.634 -17.218 -8.322 1.00 0.00 C ATOM 427 OD1 ASP A 30 -10.056 -18.021 -7.560 1.00 0.00 O ATOM 428 OD2 ASP A 30 -11.820 -17.355 -8.689 1.00 0.00 O ATOM 0 H ASP A 30 -11.019 -13.892 -8.282 1.00 0.00 H new ATOM 0 HA ASP A 30 -9.352 -15.668 -6.768 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -10.474 -15.457 -9.527 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -8.982 -16.363 -9.379 1.00 0.00 H new ATOM 433 N GLY A 31 -7.840 -14.049 -9.221 1.00 0.00 N ATOM 434 CA GLY A 31 -6.559 -13.491 -9.615 1.00 0.00 C ATOM 435 C GLY A 31 -6.703 -12.166 -10.338 1.00 0.00 C ATOM 436 O GLY A 31 -6.548 -12.095 -11.557 1.00 0.00 O ATOM 0 H GLY A 31 -8.556 -14.033 -9.947 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -5.938 -13.353 -8.730 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -6.040 -14.200 -10.261 1.00 0.00 H new ATOM 440 N ARG A 32 -7.001 -11.112 -9.584 1.00 0.00 N ATOM 441 CA ARG A 32 -7.166 -9.782 -10.160 1.00 0.00 C ATOM 442 C ARG A 32 -5.948 -8.911 -9.870 1.00 0.00 C ATOM 443 O ARG A 32 -4.949 -9.382 -9.327 1.00 0.00 O ATOM 444 CB ARG A 32 -8.429 -9.118 -9.607 1.00 0.00 C ATOM 445 CG ARG A 32 -9.673 -9.984 -9.725 1.00 0.00 C ATOM 446 CD ARG A 32 -10.610 -9.472 -10.808 1.00 0.00 C ATOM 447 NE ARG A 32 -9.920 -9.266 -12.078 1.00 0.00 N ATOM 448 CZ ARG A 32 -10.539 -9.172 -13.253 1.00 0.00 C ATOM 449 NH1 ARG A 32 -11.861 -9.263 -13.322 1.00 0.00 N ATOM 450 NH2 ARG A 32 -9.836 -8.983 -14.361 1.00 0.00 N ATOM 0 H ARG A 32 -7.133 -11.153 -8.573 1.00 0.00 H new ATOM 0 HA ARG A 32 -7.265 -9.888 -11.240 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -8.269 -8.868 -8.558 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -8.598 -8.180 -10.136 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -9.383 -11.010 -9.949 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -10.196 -10.003 -8.769 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -11.424 -10.184 -10.949 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -11.060 -8.534 -10.484 1.00 0.00 H new ATOM 0 HE ARG A 32 -8.903 -9.190 -12.064 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -12.407 -9.406 -12.473 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -12.331 -9.190 -14.224 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -8.820 -8.909 -14.314 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -10.311 -8.911 -15.261 1.00 0.00 H new ATOM 464 N SER A 33 -6.038 -7.635 -10.235 1.00 0.00 N ATOM 465 CA SER A 33 -4.942 -6.699 -10.015 1.00 0.00 C ATOM 466 C SER A 33 -5.473 -5.304 -9.697 1.00 0.00 C ATOM 467 O SER A 33 -6.679 -5.102 -9.567 1.00 0.00 O ATOM 468 CB SER A 33 -4.035 -6.643 -11.245 1.00 0.00 C ATOM 469 OG SER A 33 -3.549 -7.933 -11.579 1.00 0.00 O ATOM 0 H SER A 33 -6.858 -7.227 -10.684 1.00 0.00 H new ATOM 0 HA SER A 33 -4.363 -7.052 -9.161 1.00 0.00 H new ATOM 0 HB2 SER A 33 -4.586 -6.229 -12.089 1.00 0.00 H new ATOM 0 HB3 SER A 33 -3.197 -5.973 -11.053 1.00 0.00 H new ATOM 0 HG SER A 33 -2.973 -7.871 -12.369 1.00 0.00 H new ATOM 475 N LEU A 34 -4.561 -4.344 -9.574 1.00 0.00 N ATOM 476 CA LEU A 34 -4.936 -2.967 -9.271 1.00 0.00 C ATOM 477 C LEU A 34 -4.931 -2.111 -10.534 1.00 0.00 C ATOM 478 O LEU A 34 -5.917 -1.447 -10.850 1.00 0.00 O ATOM 479 CB LEU A 34 -3.981 -2.374 -8.234 1.00 0.00 C ATOM 480 CG LEU A 34 -4.246 -2.802 -6.790 1.00 0.00 C ATOM 481 CD1 LEU A 34 -3.056 -2.465 -5.906 1.00 0.00 C ATOM 482 CD2 LEU A 34 -5.510 -2.141 -6.263 1.00 0.00 C ATOM 0 H LEU A 34 -3.558 -4.494 -9.679 1.00 0.00 H new ATOM 0 HA LEU A 34 -5.947 -2.973 -8.863 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -2.962 -2.655 -8.499 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -4.037 -1.287 -8.291 1.00 0.00 H new ATOM 0 HG LEU A 34 -4.390 -3.882 -6.771 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -3.263 -2.777 -4.882 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -2.172 -2.986 -6.272 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -2.879 -1.390 -5.929 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -5.684 -2.456 -5.234 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -5.395 -1.058 -6.296 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -6.359 -2.434 -6.881 1.00 0.00 H new ATOM 494 N GLY A 35 -3.812 -2.134 -11.253 1.00 0.00 N ATOM 495 CA GLY A 35 -3.700 -1.357 -12.473 1.00 0.00 C ATOM 496 C GLY A 35 -3.204 0.053 -12.221 1.00 0.00 C ATOM 497 O GLY A 35 -3.521 0.973 -12.975 1.00 0.00 O ATOM 0 H GLY A 35 -2.982 -2.676 -11.012 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -3.019 -1.861 -13.159 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -4.673 -1.314 -12.963 1.00 0.00 H new ATOM 501 N LEU A 36 -2.423 0.223 -11.159 1.00 0.00 N ATOM 502 CA LEU A 36 -1.882 1.532 -10.810 1.00 0.00 C ATOM 503 C LEU A 36 -0.401 1.621 -11.162 1.00 0.00 C ATOM 504 O LEU A 36 0.348 0.660 -10.983 1.00 0.00 O ATOM 505 CB LEU A 36 -2.081 1.810 -9.318 1.00 0.00 C ATOM 506 CG LEU A 36 -3.539 1.924 -8.869 1.00 0.00 C ATOM 507 CD1 LEU A 36 -3.644 1.780 -7.359 1.00 0.00 C ATOM 508 CD2 LEU A 36 -4.132 3.250 -9.322 1.00 0.00 C ATOM 0 H LEU A 36 -2.151 -0.529 -10.526 1.00 0.00 H new ATOM 0 HA LEU A 36 -2.420 2.284 -11.387 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -1.603 1.013 -8.749 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -1.565 2.736 -9.065 1.00 0.00 H new ATOM 0 HG LEU A 36 -4.107 1.117 -9.331 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -4.688 1.864 -7.057 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -3.256 0.807 -7.059 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -3.063 2.566 -6.877 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -5.170 3.315 -8.995 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -3.562 4.071 -8.887 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -4.090 3.315 -10.409 1.00 0.00 H new ATOM 520 N THR A 37 0.015 2.779 -11.662 1.00 0.00 N ATOM 521 CA THR A 37 1.408 2.994 -12.039 1.00 0.00 C ATOM 522 C THR A 37 2.123 3.860 -11.008 1.00 0.00 C ATOM 523 O THR A 37 2.293 5.064 -11.204 1.00 0.00 O ATOM 524 CB THR A 37 1.490 3.650 -13.418 1.00 0.00 C ATOM 525 OG1 THR A 37 0.674 2.962 -14.350 1.00 0.00 O ATOM 526 CG2 THR A 37 2.894 3.689 -13.980 1.00 0.00 C ATOM 0 H THR A 37 -0.592 3.584 -11.816 1.00 0.00 H new ATOM 0 HA THR A 37 1.902 2.023 -12.077 1.00 0.00 H new ATOM 0 HB THR A 37 1.146 4.674 -13.271 1.00 0.00 H new ATOM 0 HG1 THR A 37 0.739 3.398 -15.225 1.00 0.00 H new ATOM 0 HG21 THR A 37 2.881 4.167 -14.960 1.00 0.00 H new ATOM 0 HG22 THR A 37 3.539 4.256 -13.309 1.00 0.00 H new ATOM 0 HG23 THR A 37 3.275 2.673 -14.077 1.00 0.00 H new ATOM 534 N ILE A 38 2.540 3.240 -9.909 1.00 0.00 N ATOM 535 CA ILE A 38 3.237 3.955 -8.847 1.00 0.00 C ATOM 536 C ILE A 38 4.649 4.338 -9.276 1.00 0.00 C ATOM 537 O ILE A 38 5.227 3.717 -10.168 1.00 0.00 O ATOM 538 CB ILE A 38 3.315 3.112 -7.560 1.00 0.00 C ATOM 539 CG1 ILE A 38 4.020 1.783 -7.835 1.00 0.00 C ATOM 540 CG2 ILE A 38 1.921 2.873 -6.998 1.00 0.00 C ATOM 541 CD1 ILE A 38 4.565 1.118 -6.590 1.00 0.00 C ATOM 0 H ILE A 38 2.407 2.244 -9.731 1.00 0.00 H new ATOM 0 HA ILE A 38 2.663 4.860 -8.646 1.00 0.00 H new ATOM 0 HB ILE A 38 3.895 3.661 -6.819 1.00 0.00 H new ATOM 0 HG12 ILE A 38 3.320 1.104 -8.323 1.00 0.00 H new ATOM 0 HG13 ILE A 38 4.839 1.953 -8.534 1.00 0.00 H new ATOM 0 HG21 ILE A 38 1.993 2.276 -6.089 1.00 0.00 H new ATOM 0 HG22 ILE A 38 1.453 3.830 -6.768 1.00 0.00 H new ATOM 0 HG23 ILE A 38 1.318 2.342 -7.734 1.00 0.00 H new ATOM 0 HD11 ILE A 38 5.051 0.181 -6.861 1.00 0.00 H new ATOM 0 HD12 ILE A 38 5.289 1.778 -6.112 1.00 0.00 H new ATOM 0 HD13 ILE A 38 3.747 0.915 -5.898 1.00 0.00 H new ATOM 553 N ARG A 39 5.200 5.363 -8.635 1.00 0.00 N ATOM 554 CA ARG A 39 6.545 5.828 -8.951 1.00 0.00 C ATOM 555 C ARG A 39 7.340 6.095 -7.678 1.00 0.00 C ATOM 556 O ARG A 39 6.768 6.346 -6.617 1.00 0.00 O ATOM 557 CB ARG A 39 6.482 7.098 -9.802 1.00 0.00 C ATOM 558 CG ARG A 39 5.566 8.168 -9.232 1.00 0.00 C ATOM 559 CD ARG A 39 5.865 9.534 -9.828 1.00 0.00 C ATOM 560 NE ARG A 39 5.523 9.599 -11.247 1.00 0.00 N ATOM 561 CZ ARG A 39 5.367 10.737 -11.920 1.00 0.00 C ATOM 562 NH1 ARG A 39 5.521 11.906 -11.309 1.00 0.00 N ATOM 563 NH2 ARG A 39 5.056 10.707 -13.208 1.00 0.00 N ATOM 0 H ARG A 39 4.736 5.887 -7.894 1.00 0.00 H new ATOM 0 HA ARG A 39 7.050 5.045 -9.517 1.00 0.00 H new ATOM 0 HB2 ARG A 39 7.487 7.508 -9.903 1.00 0.00 H new ATOM 0 HB3 ARG A 39 6.142 6.837 -10.804 1.00 0.00 H new ATOM 0 HG2 ARG A 39 4.528 7.903 -9.431 1.00 0.00 H new ATOM 0 HG3 ARG A 39 5.683 8.209 -8.149 1.00 0.00 H new ATOM 0 HD2 ARG A 39 5.306 10.296 -9.285 1.00 0.00 H new ATOM 0 HD3 ARG A 39 6.923 9.762 -9.699 1.00 0.00 H new ATOM 0 HE ARG A 39 5.396 8.721 -11.751 1.00 0.00 H new ATOM 0 HH11 ARG A 39 5.760 11.936 -10.318 1.00 0.00 H new ATOM 0 HH12 ARG A 39 5.400 12.774 -11.831 1.00 0.00 H new ATOM 0 HH21 ARG A 39 4.936 9.812 -13.683 1.00 0.00 H new ATOM 0 HH22 ARG A 39 4.936 11.579 -13.724 1.00 0.00 H new ATOM 577 N GLY A 40 8.664 6.037 -7.790 1.00 0.00 N ATOM 578 CA GLY A 40 9.517 6.274 -6.639 1.00 0.00 C ATOM 579 C GLY A 40 9.403 5.179 -5.598 1.00 0.00 C ATOM 580 O GLY A 40 8.383 4.494 -5.516 1.00 0.00 O ATOM 0 H GLY A 40 9.161 5.830 -8.656 1.00 0.00 H new ATOM 0 HA2 GLY A 40 10.553 6.351 -6.968 1.00 0.00 H new ATOM 0 HA3 GLY A 40 9.254 7.230 -6.186 1.00 0.00 H new ATOM 584 N GLY A 41 10.451 5.014 -4.799 1.00 0.00 N ATOM 585 CA GLY A 41 10.445 3.992 -3.768 1.00 0.00 C ATOM 586 C GLY A 41 11.571 4.172 -2.768 1.00 0.00 C ATOM 587 O GLY A 41 11.589 5.141 -2.010 1.00 0.00 O ATOM 0 H GLY A 41 11.305 5.570 -4.846 1.00 0.00 H new ATOM 0 HA2 GLY A 41 9.490 4.015 -3.243 1.00 0.00 H new ATOM 0 HA3 GLY A 41 10.530 3.010 -4.233 1.00 0.00 H new ATOM 591 N ALA A 42 12.512 3.233 -2.766 1.00 0.00 N ATOM 592 CA ALA A 42 13.647 3.291 -1.853 1.00 0.00 C ATOM 593 C ALA A 42 14.954 3.488 -2.613 1.00 0.00 C ATOM 594 O ALA A 42 15.814 4.265 -2.197 1.00 0.00 O ATOM 595 CB ALA A 42 13.710 2.026 -1.010 1.00 0.00 C ATOM 0 H ALA A 42 12.511 2.423 -3.386 1.00 0.00 H new ATOM 0 HA ALA A 42 13.508 4.148 -1.194 1.00 0.00 H new ATOM 0 HB1 ALA A 42 14.562 2.082 -0.333 1.00 0.00 H new ATOM 0 HB2 ALA A 42 12.792 1.929 -0.431 1.00 0.00 H new ATOM 0 HB3 ALA A 42 13.821 1.160 -1.662 1.00 0.00 H new ATOM 601 N GLU A 43 15.096 2.781 -3.729 1.00 0.00 N ATOM 602 CA GLU A 43 16.298 2.879 -4.548 1.00 0.00 C ATOM 603 C GLU A 43 16.499 4.305 -5.050 1.00 0.00 C ATOM 604 O GLU A 43 17.600 4.851 -4.978 1.00 0.00 O ATOM 605 CB GLU A 43 16.214 1.914 -5.732 1.00 0.00 C ATOM 606 CG GLU A 43 17.527 1.756 -6.482 1.00 0.00 C ATOM 607 CD GLU A 43 17.329 1.287 -7.910 1.00 0.00 C ATOM 608 OE1 GLU A 43 16.688 0.234 -8.106 1.00 0.00 O ATOM 609 OE2 GLU A 43 17.815 1.975 -8.833 1.00 0.00 O ATOM 0 H GLU A 43 14.393 2.134 -4.087 1.00 0.00 H new ATOM 0 HA GLU A 43 17.153 2.608 -3.929 1.00 0.00 H new ATOM 0 HB2 GLU A 43 15.891 0.937 -5.372 1.00 0.00 H new ATOM 0 HB3 GLU A 43 15.450 2.267 -6.424 1.00 0.00 H new ATOM 0 HG2 GLU A 43 18.056 2.709 -6.486 1.00 0.00 H new ATOM 0 HG3 GLU A 43 18.160 1.043 -5.954 1.00 0.00 H new ATOM 616 N TYR A 44 15.427 4.903 -5.561 1.00 0.00 N ATOM 617 CA TYR A 44 15.485 6.266 -6.075 1.00 0.00 C ATOM 618 C TYR A 44 15.463 7.279 -4.935 1.00 0.00 C ATOM 619 O TYR A 44 16.046 8.358 -5.039 1.00 0.00 O ATOM 620 CB TYR A 44 14.315 6.526 -7.025 1.00 0.00 C ATOM 621 CG TYR A 44 14.268 5.577 -8.202 1.00 0.00 C ATOM 622 CD1 TYR A 44 15.334 5.484 -9.086 1.00 0.00 C ATOM 623 CD2 TYR A 44 13.157 4.773 -8.426 1.00 0.00 C ATOM 624 CE1 TYR A 44 15.295 4.617 -10.163 1.00 0.00 C ATOM 625 CE2 TYR A 44 13.110 3.904 -9.500 1.00 0.00 C ATOM 626 CZ TYR A 44 14.181 3.831 -10.365 1.00 0.00 C ATOM 627 OH TYR A 44 14.138 2.966 -11.435 1.00 0.00 O ATOM 0 H TYR A 44 14.508 4.465 -5.630 1.00 0.00 H new ATOM 0 HA TYR A 44 16.421 6.381 -6.622 1.00 0.00 H new ATOM 0 HB2 TYR A 44 13.381 6.447 -6.468 1.00 0.00 H new ATOM 0 HB3 TYR A 44 14.380 7.549 -7.396 1.00 0.00 H new ATOM 0 HD1 TYR A 44 16.208 6.099 -8.930 1.00 0.00 H new ATOM 0 HD2 TYR A 44 12.317 4.828 -7.750 1.00 0.00 H new ATOM 0 HE1 TYR A 44 16.133 4.556 -10.842 1.00 0.00 H new ATOM 0 HE2 TYR A 44 12.239 3.286 -9.661 1.00 0.00 H new ATOM 0 HH TYR A 44 13.284 2.485 -11.433 1.00 0.00 H new ATOM 637 N GLY A 45 14.786 6.924 -3.848 1.00 0.00 N ATOM 638 CA GLY A 45 14.701 7.812 -2.704 1.00 0.00 C ATOM 639 C GLY A 45 13.490 8.723 -2.765 1.00 0.00 C ATOM 640 O GLY A 45 13.510 9.831 -2.228 1.00 0.00 O ATOM 0 H GLY A 45 14.295 6.037 -3.739 1.00 0.00 H new ATOM 0 HA2 GLY A 45 14.660 7.219 -1.790 1.00 0.00 H new ATOM 0 HA3 GLY A 45 15.605 8.418 -2.651 1.00 0.00 H new ATOM 644 N LEU A 46 12.433 8.254 -3.421 1.00 0.00 N ATOM 645 CA LEU A 46 11.207 9.034 -3.551 1.00 0.00 C ATOM 646 C LEU A 46 10.021 8.287 -2.948 1.00 0.00 C ATOM 647 O LEU A 46 9.972 7.057 -2.972 1.00 0.00 O ATOM 648 CB LEU A 46 10.931 9.348 -5.023 1.00 0.00 C ATOM 649 CG LEU A 46 9.661 10.159 -5.283 1.00 0.00 C ATOM 650 CD1 LEU A 46 9.860 11.610 -4.872 1.00 0.00 C ATOM 651 CD2 LEU A 46 9.263 10.068 -6.749 1.00 0.00 C ATOM 0 H LEU A 46 12.401 7.339 -3.870 1.00 0.00 H new ATOM 0 HA LEU A 46 11.341 9.968 -3.006 1.00 0.00 H new ATOM 0 HB2 LEU A 46 11.783 9.895 -5.428 1.00 0.00 H new ATOM 0 HB3 LEU A 46 10.864 8.409 -5.573 1.00 0.00 H new ATOM 0 HG LEU A 46 8.855 9.740 -4.681 1.00 0.00 H new ATOM 0 HD11 LEU A 46 8.946 12.171 -5.064 1.00 0.00 H new ATOM 0 HD12 LEU A 46 10.098 11.658 -3.809 1.00 0.00 H new ATOM 0 HD13 LEU A 46 10.679 12.042 -5.447 1.00 0.00 H new ATOM 0 HD21 LEU A 46 8.357 10.651 -6.917 1.00 0.00 H new ATOM 0 HD22 LEU A 46 10.068 10.462 -7.370 1.00 0.00 H new ATOM 0 HD23 LEU A 46 9.078 9.026 -7.012 1.00 0.00 H new ATOM 663 N GLY A 47 9.067 9.039 -2.409 1.00 0.00 N ATOM 664 CA GLY A 47 7.894 8.430 -1.808 1.00 0.00 C ATOM 665 C GLY A 47 7.086 7.623 -2.805 1.00 0.00 C ATOM 666 O GLY A 47 7.264 7.760 -4.014 1.00 0.00 O ATOM 0 H GLY A 47 9.085 10.058 -2.377 1.00 0.00 H new ATOM 0 HA2 GLY A 47 8.204 7.783 -0.988 1.00 0.00 H new ATOM 0 HA3 GLY A 47 7.263 9.209 -1.379 1.00 0.00 H new ATOM 670 N ILE A 48 6.196 6.777 -2.294 1.00 0.00 N ATOM 671 CA ILE A 48 5.359 5.944 -3.148 1.00 0.00 C ATOM 672 C ILE A 48 4.149 6.720 -3.657 1.00 0.00 C ATOM 673 O ILE A 48 3.107 6.765 -3.003 1.00 0.00 O ATOM 674 CB ILE A 48 4.871 4.687 -2.403 1.00 0.00 C ATOM 675 CG1 ILE A 48 6.044 3.992 -1.707 1.00 0.00 C ATOM 676 CG2 ILE A 48 4.179 3.734 -3.365 1.00 0.00 C ATOM 677 CD1 ILE A 48 7.082 3.452 -2.668 1.00 0.00 C ATOM 0 H ILE A 48 6.037 6.651 -1.294 1.00 0.00 H new ATOM 0 HA ILE A 48 5.975 5.640 -3.994 1.00 0.00 H new ATOM 0 HB ILE A 48 4.150 4.991 -1.644 1.00 0.00 H new ATOM 0 HG12 ILE A 48 6.522 4.697 -1.027 1.00 0.00 H new ATOM 0 HG13 ILE A 48 5.661 3.172 -1.099 1.00 0.00 H new ATOM 0 HG21 ILE A 48 3.841 2.851 -2.822 1.00 0.00 H new ATOM 0 HG22 ILE A 48 3.322 4.233 -3.818 1.00 0.00 H new ATOM 0 HG23 ILE A 48 4.878 3.434 -4.146 1.00 0.00 H new ATOM 0 HD11 ILE A 48 7.884 2.973 -2.106 1.00 0.00 H new ATOM 0 HD12 ILE A 48 6.618 2.723 -3.332 1.00 0.00 H new ATOM 0 HD13 ILE A 48 7.492 4.271 -3.259 1.00 0.00 H new ATOM 689 N TYR A 49 4.293 7.330 -4.829 1.00 0.00 N ATOM 690 CA TYR A 49 3.213 8.104 -5.428 1.00 0.00 C ATOM 691 C TYR A 49 2.519 7.309 -6.530 1.00 0.00 C ATOM 692 O TYR A 49 2.911 6.184 -6.837 1.00 0.00 O ATOM 693 CB TYR A 49 3.752 9.418 -5.995 1.00 0.00 C ATOM 694 CG TYR A 49 4.432 10.291 -4.965 1.00 0.00 C ATOM 695 CD1 TYR A 49 5.788 10.153 -4.697 1.00 0.00 C ATOM 696 CD2 TYR A 49 3.718 11.253 -4.261 1.00 0.00 C ATOM 697 CE1 TYR A 49 6.414 10.949 -3.755 1.00 0.00 C ATOM 698 CE2 TYR A 49 4.338 12.053 -3.319 1.00 0.00 C ATOM 699 CZ TYR A 49 5.685 11.896 -3.070 1.00 0.00 C ATOM 700 OH TYR A 49 6.304 12.691 -2.133 1.00 0.00 O ATOM 0 H TYR A 49 5.149 7.303 -5.383 1.00 0.00 H new ATOM 0 HA TYR A 49 2.483 8.324 -4.649 1.00 0.00 H new ATOM 0 HB2 TYR A 49 4.459 9.196 -6.794 1.00 0.00 H new ATOM 0 HB3 TYR A 49 2.929 9.974 -6.444 1.00 0.00 H new ATOM 0 HD1 TYR A 49 6.363 9.412 -5.233 1.00 0.00 H new ATOM 0 HD2 TYR A 49 2.662 11.378 -4.453 1.00 0.00 H new ATOM 0 HE1 TYR A 49 7.469 10.829 -3.557 1.00 0.00 H new ATOM 0 HE2 TYR A 49 3.770 12.797 -2.781 1.00 0.00 H new ATOM 0 HH TYR A 49 5.649 13.307 -1.742 1.00 0.00 H new ATOM 710 N ILE A 50 1.488 7.904 -7.122 1.00 0.00 N ATOM 711 CA ILE A 50 0.741 7.252 -8.191 1.00 0.00 C ATOM 712 C ILE A 50 0.724 8.112 -9.450 1.00 0.00 C ATOM 713 O ILE A 50 0.749 9.340 -9.377 1.00 0.00 O ATOM 714 CB ILE A 50 -0.711 6.958 -7.767 1.00 0.00 C ATOM 715 CG1 ILE A 50 -0.738 6.274 -6.399 1.00 0.00 C ATOM 716 CG2 ILE A 50 -1.403 6.095 -8.811 1.00 0.00 C ATOM 717 CD1 ILE A 50 -2.123 6.181 -5.798 1.00 0.00 C ATOM 0 H ILE A 50 1.151 8.836 -6.879 1.00 0.00 H new ATOM 0 HA ILE A 50 1.248 6.310 -8.401 1.00 0.00 H new ATOM 0 HB ILE A 50 -1.250 7.903 -7.690 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -0.324 5.270 -6.495 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -0.090 6.822 -5.715 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -2.428 5.896 -8.497 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -1.411 6.618 -9.768 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -0.866 5.152 -8.917 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -2.067 5.685 -4.829 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -2.532 7.183 -5.669 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -2.770 5.608 -6.462 1.00 0.00 H new ATOM 729 N THR A 51 0.678 7.457 -10.606 1.00 0.00 N ATOM 730 CA THR A 51 0.657 8.160 -11.883 1.00 0.00 C ATOM 731 C THR A 51 0.099 7.265 -12.984 1.00 0.00 C ATOM 732 O THR A 51 0.566 7.298 -14.123 1.00 0.00 O ATOM 733 CB THR A 51 2.063 8.631 -12.255 1.00 0.00 C ATOM 734 OG1 THR A 51 2.045 9.349 -13.476 1.00 0.00 O ATOM 735 CG2 THR A 51 3.056 7.499 -12.401 1.00 0.00 C ATOM 0 H THR A 51 0.655 6.440 -10.684 1.00 0.00 H new ATOM 0 HA THR A 51 0.008 9.030 -11.781 1.00 0.00 H new ATOM 0 HB THR A 51 2.382 9.266 -11.429 1.00 0.00 H new ATOM 0 HG1 THR A 51 1.604 8.810 -14.166 1.00 0.00 H new ATOM 0 HG21 THR A 51 4.033 7.904 -12.666 1.00 0.00 H new ATOM 0 HG22 THR A 51 3.131 6.957 -11.458 1.00 0.00 H new ATOM 0 HG23 THR A 51 2.720 6.819 -13.184 1.00 0.00 H new ATOM 743 N GLY A 52 -0.905 6.465 -12.638 1.00 0.00 N ATOM 744 CA GLY A 52 -1.510 5.572 -13.607 1.00 0.00 C ATOM 745 C GLY A 52 -2.791 4.941 -13.094 1.00 0.00 C ATOM 746 O GLY A 52 -2.843 4.458 -11.964 1.00 0.00 O ATOM 0 H GLY A 52 -1.310 6.420 -11.703 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -1.722 6.124 -14.523 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -0.800 4.787 -13.866 1.00 0.00 H new ATOM 750 N VAL A 53 -3.825 4.947 -13.930 1.00 0.00 N ATOM 751 CA VAL A 53 -5.112 4.373 -13.557 1.00 0.00 C ATOM 752 C VAL A 53 -5.710 3.573 -14.709 1.00 0.00 C ATOM 753 O VAL A 53 -6.327 4.136 -15.614 1.00 0.00 O ATOM 754 CB VAL A 53 -6.112 5.462 -13.129 1.00 0.00 C ATOM 755 CG1 VAL A 53 -7.374 4.837 -12.559 1.00 0.00 C ATOM 756 CG2 VAL A 53 -5.474 6.407 -12.122 1.00 0.00 C ATOM 0 H VAL A 53 -3.796 5.343 -14.870 1.00 0.00 H new ATOM 0 HA VAL A 53 -4.929 3.709 -12.712 1.00 0.00 H new ATOM 0 HB VAL A 53 -6.389 6.040 -14.011 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -8.068 5.624 -12.263 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -7.842 4.207 -13.316 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -7.119 4.231 -11.689 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -6.196 7.170 -11.831 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -5.165 5.845 -11.241 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -4.603 6.884 -12.572 1.00 0.00 H new ATOM 766 N ASP A 54 -5.521 2.258 -14.671 1.00 0.00 N ATOM 767 CA ASP A 54 -6.039 1.380 -15.714 1.00 0.00 C ATOM 768 C ASP A 54 -7.562 1.483 -15.807 1.00 0.00 C ATOM 769 O ASP A 54 -8.277 1.036 -14.910 1.00 0.00 O ATOM 770 CB ASP A 54 -5.630 -0.069 -15.434 1.00 0.00 C ATOM 771 CG ASP A 54 -4.872 -0.689 -16.593 1.00 0.00 C ATOM 772 OD1 ASP A 54 -5.527 -1.199 -17.526 1.00 0.00 O ATOM 773 OD2 ASP A 54 -3.624 -0.663 -16.567 1.00 0.00 O ATOM 0 H ASP A 54 -5.013 1.777 -13.929 1.00 0.00 H new ATOM 0 HA ASP A 54 -5.614 1.695 -16.667 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -5.010 -0.102 -14.538 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -6.521 -0.662 -15.227 1.00 0.00 H new ATOM 778 N PRO A 55 -8.084 2.075 -16.898 1.00 0.00 N ATOM 779 CA PRO A 55 -9.529 2.230 -17.094 1.00 0.00 C ATOM 780 C PRO A 55 -10.267 0.896 -17.033 1.00 0.00 C ATOM 781 O PRO A 55 -10.022 0.002 -17.844 1.00 0.00 O ATOM 782 CB PRO A 55 -9.643 2.836 -18.497 1.00 0.00 C ATOM 783 CG PRO A 55 -8.324 3.482 -18.743 1.00 0.00 C ATOM 784 CD PRO A 55 -7.312 2.639 -18.021 1.00 0.00 C ATOM 0 HA PRO A 55 -9.978 2.845 -16.314 1.00 0.00 H new ATOM 0 HB2 PRO A 55 -9.853 2.069 -19.243 1.00 0.00 H new ATOM 0 HB3 PRO A 55 -10.454 3.562 -18.549 1.00 0.00 H new ATOM 0 HG2 PRO A 55 -8.104 3.528 -19.810 1.00 0.00 H new ATOM 0 HG3 PRO A 55 -8.315 4.507 -18.371 1.00 0.00 H new ATOM 0 HD2 PRO A 55 -6.907 1.858 -18.664 1.00 0.00 H new ATOM 0 HD3 PRO A 55 -6.468 3.234 -17.671 1.00 0.00 H new ATOM 792 N GLY A 56 -11.171 0.768 -16.068 1.00 0.00 N ATOM 793 CA GLY A 56 -11.930 -0.459 -15.921 1.00 0.00 C ATOM 794 C GLY A 56 -11.231 -1.472 -15.033 1.00 0.00 C ATOM 795 O GLY A 56 -11.379 -2.679 -15.223 1.00 0.00 O ATOM 0 H GLY A 56 -11.391 1.493 -15.385 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -12.910 -0.228 -15.502 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -12.099 -0.898 -16.904 1.00 0.00 H new ATOM 799 N SER A 57 -10.468 -0.979 -14.064 1.00 0.00 N ATOM 800 CA SER A 57 -9.744 -1.849 -13.145 1.00 0.00 C ATOM 801 C SER A 57 -10.364 -1.806 -11.753 1.00 0.00 C ATOM 802 O SER A 57 -11.340 -1.092 -11.519 1.00 0.00 O ATOM 803 CB SER A 57 -8.272 -1.438 -13.073 1.00 0.00 C ATOM 804 OG SER A 57 -8.141 -0.081 -12.687 1.00 0.00 O ATOM 0 H SER A 57 -10.335 0.018 -13.895 1.00 0.00 H new ATOM 0 HA SER A 57 -9.811 -2.870 -13.522 1.00 0.00 H new ATOM 0 HB2 SER A 57 -7.748 -2.075 -12.360 1.00 0.00 H new ATOM 0 HB3 SER A 57 -7.800 -1.591 -14.044 1.00 0.00 H new ATOM 0 HG SER A 57 -7.859 0.453 -13.459 1.00 0.00 H new ATOM 810 N GLU A 58 -9.793 -2.574 -10.831 1.00 0.00 N ATOM 811 CA GLU A 58 -10.291 -2.622 -9.461 1.00 0.00 C ATOM 812 C GLU A 58 -9.947 -1.338 -8.713 1.00 0.00 C ATOM 813 O GLU A 58 -10.778 -0.786 -7.992 1.00 0.00 O ATOM 814 CB GLU A 58 -9.707 -3.831 -8.725 1.00 0.00 C ATOM 815 CG GLU A 58 -10.735 -4.606 -7.917 1.00 0.00 C ATOM 816 CD GLU A 58 -10.892 -4.073 -6.507 1.00 0.00 C ATOM 817 OE1 GLU A 58 -10.081 -4.449 -5.636 1.00 0.00 O ATOM 818 OE2 GLU A 58 -11.826 -3.277 -6.275 1.00 0.00 O ATOM 0 H GLU A 58 -8.985 -3.171 -11.007 1.00 0.00 H new ATOM 0 HA GLU A 58 -11.376 -2.719 -9.497 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -9.248 -4.501 -9.452 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -8.914 -3.492 -8.059 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -11.698 -4.565 -8.426 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -10.442 -5.655 -7.874 1.00 0.00 H new ATOM 825 N ALA A 59 -8.717 -0.866 -8.892 1.00 0.00 N ATOM 826 CA ALA A 59 -8.264 0.354 -8.236 1.00 0.00 C ATOM 827 C ALA A 59 -8.977 1.576 -8.804 1.00 0.00 C ATOM 828 O ALA A 59 -9.254 2.536 -8.086 1.00 0.00 O ATOM 829 CB ALA A 59 -6.757 0.502 -8.382 1.00 0.00 C ATOM 0 H ALA A 59 -8.017 -1.310 -9.486 1.00 0.00 H new ATOM 0 HA ALA A 59 -8.509 0.283 -7.176 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -6.432 1.417 -7.888 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -6.261 -0.354 -7.924 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -6.497 0.549 -9.439 1.00 0.00 H new ATOM 835 N GLU A 60 -9.270 1.532 -10.099 1.00 0.00 N ATOM 836 CA GLU A 60 -9.951 2.635 -10.768 1.00 0.00 C ATOM 837 C GLU A 60 -11.370 2.804 -10.234 1.00 0.00 C ATOM 838 O GLU A 60 -11.860 3.924 -10.089 1.00 0.00 O ATOM 839 CB GLU A 60 -9.988 2.395 -12.279 1.00 0.00 C ATOM 840 CG GLU A 60 -10.407 3.616 -13.080 1.00 0.00 C ATOM 841 CD GLU A 60 -11.743 3.430 -13.774 1.00 0.00 C ATOM 842 OE1 GLU A 60 -12.654 2.837 -13.159 1.00 0.00 O ATOM 843 OE2 GLU A 60 -11.877 3.878 -14.932 1.00 0.00 O ATOM 0 H GLU A 60 -9.047 0.744 -10.707 1.00 0.00 H new ATOM 0 HA GLU A 60 -9.395 3.550 -10.564 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -9.001 2.074 -12.612 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -10.677 1.578 -12.492 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -10.464 4.479 -12.416 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -9.643 3.837 -13.825 1.00 0.00 H new ATOM 850 N GLY A 61 -12.024 1.684 -9.943 1.00 0.00 N ATOM 851 CA GLY A 61 -13.381 1.730 -9.431 1.00 0.00 C ATOM 852 C GLY A 61 -13.451 2.266 -8.013 1.00 0.00 C ATOM 853 O GLY A 61 -14.461 2.844 -7.612 1.00 0.00 O ATOM 0 H GLY A 61 -11.639 0.746 -10.053 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -13.990 2.356 -10.083 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -13.810 0.728 -9.459 1.00 0.00 H new ATOM 857 N SER A 62 -12.377 2.074 -7.255 1.00 0.00 N ATOM 858 CA SER A 62 -12.324 2.542 -5.875 1.00 0.00 C ATOM 859 C SER A 62 -12.262 4.065 -5.817 1.00 0.00 C ATOM 860 O SER A 62 -13.202 4.718 -5.362 1.00 0.00 O ATOM 861 CB SER A 62 -11.113 1.943 -5.157 1.00 0.00 C ATOM 862 OG SER A 62 -11.421 1.628 -3.810 1.00 0.00 O ATOM 0 H SER A 62 -11.532 1.598 -7.572 1.00 0.00 H new ATOM 0 HA SER A 62 -13.234 2.215 -5.373 1.00 0.00 H new ATOM 0 HB2 SER A 62 -10.786 1.043 -5.678 1.00 0.00 H new ATOM 0 HB3 SER A 62 -10.283 2.649 -5.188 1.00 0.00 H new ATOM 0 HG SER A 62 -12.037 0.867 -3.785 1.00 0.00 H new ATOM 868 N GLY A 63 -11.151 4.625 -6.281 1.00 0.00 N ATOM 869 CA GLY A 63 -10.985 6.067 -6.273 1.00 0.00 C ATOM 870 C GLY A 63 -9.532 6.481 -6.166 1.00 0.00 C ATOM 871 O GLY A 63 -9.186 7.362 -5.378 1.00 0.00 O ATOM 0 H GLY A 63 -10.361 4.106 -6.663 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -11.412 6.484 -7.185 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -11.543 6.489 -5.437 1.00 0.00 H new ATOM 875 N LEU A 64 -8.677 5.846 -6.962 1.00 0.00 N ATOM 876 CA LEU A 64 -7.252 6.151 -6.954 1.00 0.00 C ATOM 877 C LEU A 64 -6.827 6.797 -8.269 1.00 0.00 C ATOM 878 O LEU A 64 -6.784 6.140 -9.309 1.00 0.00 O ATOM 879 CB LEU A 64 -6.438 4.879 -6.712 1.00 0.00 C ATOM 880 CG LEU A 64 -6.480 4.346 -5.278 1.00 0.00 C ATOM 881 CD1 LEU A 64 -6.126 2.867 -5.248 1.00 0.00 C ATOM 882 CD2 LEU A 64 -5.536 5.140 -4.389 1.00 0.00 C ATOM 0 H LEU A 64 -8.948 5.116 -7.621 1.00 0.00 H new ATOM 0 HA LEU A 64 -7.061 6.856 -6.145 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -6.801 4.101 -7.383 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -5.400 5.074 -6.981 1.00 0.00 H new ATOM 0 HG LEU A 64 -7.494 4.463 -4.895 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -6.161 2.505 -4.220 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -6.841 2.309 -5.853 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -5.122 2.725 -5.649 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -5.578 4.748 -3.373 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -4.518 5.053 -4.770 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -5.834 6.188 -4.386 1.00 0.00 H new ATOM 894 N LYS A 65 -6.514 8.088 -8.215 1.00 0.00 N ATOM 895 CA LYS A 65 -6.092 8.823 -9.403 1.00 0.00 C ATOM 896 C LYS A 65 -4.630 9.240 -9.294 1.00 0.00 C ATOM 897 O LYS A 65 -3.986 9.024 -8.267 1.00 0.00 O ATOM 898 CB LYS A 65 -6.973 10.058 -9.601 1.00 0.00 C ATOM 899 CG LYS A 65 -8.197 9.800 -10.466 1.00 0.00 C ATOM 900 CD LYS A 65 -9.459 9.682 -9.627 1.00 0.00 C ATOM 901 CE LYS A 65 -10.644 10.350 -10.305 1.00 0.00 C ATOM 902 NZ LYS A 65 -11.942 9.862 -9.763 1.00 0.00 N ATOM 0 H LYS A 65 -6.545 8.647 -7.362 1.00 0.00 H new ATOM 0 HA LYS A 65 -6.199 8.165 -10.265 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -7.297 10.423 -8.626 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -6.378 10.850 -10.055 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -8.312 10.610 -11.186 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -8.053 8.884 -11.038 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -9.684 8.630 -9.453 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -9.292 10.138 -8.651 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -10.578 11.430 -10.171 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -10.604 10.159 -11.377 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -12.725 10.342 -10.252 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -12.017 8.836 -9.914 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -11.992 10.067 -8.745 1.00 0.00 H new ATOM 916 N VAL A 66 -4.111 9.838 -10.362 1.00 0.00 N ATOM 917 CA VAL A 66 -2.724 10.286 -10.388 1.00 0.00 C ATOM 918 C VAL A 66 -2.503 11.443 -9.419 1.00 0.00 C ATOM 919 O VAL A 66 -3.331 12.349 -9.319 1.00 0.00 O ATOM 920 CB VAL A 66 -2.301 10.729 -11.801 1.00 0.00 C ATOM 921 CG1 VAL A 66 -2.230 9.531 -12.737 1.00 0.00 C ATOM 922 CG2 VAL A 66 -3.259 11.780 -12.340 1.00 0.00 C ATOM 0 H VAL A 66 -4.630 10.023 -11.220 1.00 0.00 H new ATOM 0 HA VAL A 66 -2.112 9.436 -10.084 1.00 0.00 H new ATOM 0 HB VAL A 66 -1.308 11.173 -11.741 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -1.930 9.863 -13.731 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -1.500 8.816 -12.358 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -3.209 9.055 -12.794 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -2.944 12.081 -13.339 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -4.266 11.365 -12.386 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -3.255 12.648 -11.681 1.00 0.00 H new ATOM 932 N GLY A 67 -1.382 11.406 -8.705 1.00 0.00 N ATOM 933 CA GLY A 67 -1.074 12.458 -7.754 1.00 0.00 C ATOM 934 C GLY A 67 -1.203 11.995 -6.316 1.00 0.00 C ATOM 935 O GLY A 67 -0.568 12.549 -5.419 1.00 0.00 O ATOM 0 H GLY A 67 -0.682 10.667 -8.768 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -0.059 12.815 -7.928 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -1.742 13.303 -7.922 1.00 0.00 H new ATOM 939 N ASP A 68 -2.029 10.976 -6.094 1.00 0.00 N ATOM 940 CA ASP A 68 -2.239 10.440 -4.754 1.00 0.00 C ATOM 941 C ASP A 68 -0.923 9.974 -4.139 1.00 0.00 C ATOM 942 O ASP A 68 -0.050 9.455 -4.835 1.00 0.00 O ATOM 943 CB ASP A 68 -3.234 9.278 -4.799 1.00 0.00 C ATOM 944 CG ASP A 68 -4.671 9.742 -4.670 1.00 0.00 C ATOM 945 OD1 ASP A 68 -4.953 10.906 -5.025 1.00 0.00 O ATOM 946 OD2 ASP A 68 -5.515 8.942 -4.216 1.00 0.00 O ATOM 0 H ASP A 68 -2.563 10.506 -6.825 1.00 0.00 H new ATOM 0 HA ASP A 68 -2.646 11.237 -4.131 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -3.113 8.736 -5.737 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -3.008 8.578 -3.995 1.00 0.00 H new ATOM 951 N GLN A 69 -0.788 10.162 -2.830 1.00 0.00 N ATOM 952 CA GLN A 69 0.420 9.761 -2.120 1.00 0.00 C ATOM 953 C GLN A 69 0.141 8.585 -1.190 1.00 0.00 C ATOM 954 O GLN A 69 -0.518 8.738 -0.162 1.00 0.00 O ATOM 955 CB GLN A 69 0.981 10.938 -1.319 1.00 0.00 C ATOM 956 CG GLN A 69 2.461 10.808 -1.000 1.00 0.00 C ATOM 957 CD GLN A 69 2.720 10.521 0.465 1.00 0.00 C ATOM 958 OE1 GLN A 69 2.485 11.368 1.328 1.00 0.00 O ATOM 959 NE2 GLN A 69 3.207 9.320 0.757 1.00 0.00 N ATOM 0 H GLN A 69 -1.501 10.590 -2.240 1.00 0.00 H new ATOM 0 HA GLN A 69 1.158 9.449 -2.859 1.00 0.00 H new ATOM 0 HB2 GLN A 69 0.819 11.858 -1.880 1.00 0.00 H new ATOM 0 HB3 GLN A 69 0.424 11.030 -0.387 1.00 0.00 H new ATOM 0 HG2 GLN A 69 2.890 10.008 -1.604 1.00 0.00 H new ATOM 0 HG3 GLN A 69 2.971 11.729 -1.281 1.00 0.00 H new ATOM 0 HE21 GLN A 69 3.387 8.648 0.011 1.00 0.00 H new ATOM 0 HE22 GLN A 69 3.401 9.070 1.727 1.00 0.00 H new ATOM 968 N ILE A 70 0.646 7.412 -1.558 1.00 0.00 N ATOM 969 CA ILE A 70 0.450 6.211 -0.757 1.00 0.00 C ATOM 970 C ILE A 70 1.302 6.250 0.507 1.00 0.00 C ATOM 971 O ILE A 70 2.531 6.228 0.440 1.00 0.00 O ATOM 972 CB ILE A 70 0.793 4.939 -1.556 1.00 0.00 C ATOM 973 CG1 ILE A 70 0.076 4.948 -2.907 1.00 0.00 C ATOM 974 CG2 ILE A 70 0.419 3.696 -0.761 1.00 0.00 C ATOM 975 CD1 ILE A 70 0.600 3.911 -3.875 1.00 0.00 C ATOM 0 H ILE A 70 1.194 7.268 -2.406 1.00 0.00 H new ATOM 0 HA ILE A 70 -0.604 6.183 -0.481 1.00 0.00 H new ATOM 0 HB ILE A 70 1.868 4.922 -1.737 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -0.988 4.778 -2.746 1.00 0.00 H new ATOM 0 HG13 ILE A 70 0.176 5.936 -3.356 1.00 0.00 H new ATOM 0 HG21 ILE A 70 0.668 2.806 -1.339 1.00 0.00 H new ATOM 0 HG22 ILE A 70 0.972 3.685 0.178 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -0.651 3.706 -0.552 1.00 0.00 H new ATOM 0 HD11 ILE A 70 0.046 3.975 -4.811 1.00 0.00 H new ATOM 0 HD12 ILE A 70 1.658 4.093 -4.066 1.00 0.00 H new ATOM 0 HD13 ILE A 70 0.475 2.917 -3.446 1.00 0.00 H new ATOM 987 N LEU A 71 0.641 6.309 1.658 1.00 0.00 N ATOM 988 CA LEU A 71 1.338 6.352 2.939 1.00 0.00 C ATOM 989 C LEU A 71 1.676 4.945 3.422 1.00 0.00 C ATOM 990 O LEU A 71 2.802 4.677 3.843 1.00 0.00 O ATOM 991 CB LEU A 71 0.483 7.071 3.984 1.00 0.00 C ATOM 992 CG LEU A 71 -0.015 8.457 3.572 1.00 0.00 C ATOM 993 CD1 LEU A 71 -0.980 9.008 4.610 1.00 0.00 C ATOM 994 CD2 LEU A 71 1.156 9.407 3.373 1.00 0.00 C ATOM 0 H LEU A 71 -0.376 6.328 1.731 1.00 0.00 H new ATOM 0 HA LEU A 71 2.269 6.902 2.800 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -0.379 6.447 4.217 1.00 0.00 H new ATOM 0 HB3 LEU A 71 1.064 7.168 4.901 1.00 0.00 H new ATOM 0 HG LEU A 71 -0.547 8.364 2.625 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -1.324 9.995 4.300 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -1.835 8.339 4.703 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -0.474 9.086 5.572 1.00 0.00 H new ATOM 0 HD21 LEU A 71 0.783 10.388 3.080 1.00 0.00 H new ATOM 0 HD22 LEU A 71 1.716 9.495 4.304 1.00 0.00 H new ATOM 0 HD23 LEU A 71 1.810 9.020 2.592 1.00 0.00 H new ATOM 1006 N GLU A 72 0.695 4.052 3.358 1.00 0.00 N ATOM 1007 CA GLU A 72 0.890 2.672 3.790 1.00 0.00 C ATOM 1008 C GLU A 72 -0.159 1.754 3.171 1.00 0.00 C ATOM 1009 O GLU A 72 -1.252 2.195 2.815 1.00 0.00 O ATOM 1010 CB GLU A 72 0.828 2.580 5.315 1.00 0.00 C ATOM 1011 CG GLU A 72 -0.503 3.024 5.899 1.00 0.00 C ATOM 1012 CD GLU A 72 -0.444 4.417 6.494 1.00 0.00 C ATOM 1013 OE1 GLU A 72 0.375 5.232 6.020 1.00 0.00 O ATOM 1014 OE2 GLU A 72 -1.217 4.693 7.436 1.00 0.00 O ATOM 0 H GLU A 72 -0.242 4.258 3.012 1.00 0.00 H new ATOM 0 HA GLU A 72 1.874 2.348 3.453 1.00 0.00 H new ATOM 0 HB2 GLU A 72 1.022 1.551 5.616 1.00 0.00 H new ATOM 0 HB3 GLU A 72 1.624 3.192 5.740 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -1.264 2.998 5.119 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -0.811 2.317 6.669 1.00 0.00 H new ATOM 1021 N VAL A 73 0.181 0.476 3.045 1.00 0.00 N ATOM 1022 CA VAL A 73 -0.732 -0.504 2.469 1.00 0.00 C ATOM 1023 C VAL A 73 -0.679 -1.821 3.238 1.00 0.00 C ATOM 1024 O VAL A 73 0.399 -2.315 3.568 1.00 0.00 O ATOM 1025 CB VAL A 73 -0.406 -0.774 0.989 1.00 0.00 C ATOM 1026 CG1 VAL A 73 -1.482 -1.642 0.354 1.00 0.00 C ATOM 1027 CG2 VAL A 73 -0.250 0.535 0.230 1.00 0.00 C ATOM 0 H VAL A 73 1.082 0.095 3.334 1.00 0.00 H new ATOM 0 HA VAL A 73 -1.735 -0.083 2.541 1.00 0.00 H new ATOM 0 HB VAL A 73 0.540 -1.313 0.937 1.00 0.00 H new ATOM 0 HG11 VAL A 73 -1.234 -1.822 -0.692 1.00 0.00 H new ATOM 0 HG12 VAL A 73 -1.540 -2.594 0.882 1.00 0.00 H new ATOM 0 HG13 VAL A 73 -2.444 -1.133 0.416 1.00 0.00 H new ATOM 0 HG21 VAL A 73 -0.020 0.325 -0.814 1.00 0.00 H new ATOM 0 HG22 VAL A 73 -1.178 1.103 0.290 1.00 0.00 H new ATOM 0 HG23 VAL A 73 0.560 1.116 0.670 1.00 0.00 H new ATOM 1037 N ASN A 74 -1.850 -2.385 3.518 1.00 0.00 N ATOM 1038 CA ASN A 74 -1.937 -3.645 4.247 1.00 0.00 C ATOM 1039 C ASN A 74 -1.320 -3.513 5.636 1.00 0.00 C ATOM 1040 O ASN A 74 -0.799 -4.481 6.190 1.00 0.00 O ATOM 1041 CB ASN A 74 -1.239 -4.759 3.465 1.00 0.00 C ATOM 1042 CG ASN A 74 -2.223 -5.666 2.751 1.00 0.00 C ATOM 1043 OD1 ASN A 74 -2.641 -6.692 3.287 1.00 0.00 O ATOM 1044 ND2 ASN A 74 -2.597 -5.292 1.532 1.00 0.00 N ATOM 0 H ASN A 74 -2.751 -1.989 3.251 1.00 0.00 H new ATOM 0 HA ASN A 74 -2.991 -3.899 4.362 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -0.560 -4.317 2.735 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -0.631 -5.353 4.147 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -3.256 -5.864 1.003 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -2.226 -4.433 1.126 1.00 0.00 H new ATOM 1051 N GLY A 75 -1.382 -2.309 6.195 1.00 0.00 N ATOM 1052 CA GLY A 75 -0.826 -2.073 7.515 1.00 0.00 C ATOM 1053 C GLY A 75 0.687 -2.154 7.530 1.00 0.00 C ATOM 1054 O GLY A 75 1.280 -2.640 8.493 1.00 0.00 O ATOM 0 H GLY A 75 -1.808 -1.492 5.757 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -1.138 -1.089 7.866 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -1.233 -2.805 8.213 1.00 0.00 H new ATOM 1058 N ARG A 76 1.315 -1.677 6.461 1.00 0.00 N ATOM 1059 CA ARG A 76 2.770 -1.698 6.356 1.00 0.00 C ATOM 1060 C ARG A 76 3.299 -0.353 5.870 1.00 0.00 C ATOM 1061 O ARG A 76 2.725 0.265 4.974 1.00 0.00 O ATOM 1062 CB ARG A 76 3.218 -2.809 5.404 1.00 0.00 C ATOM 1063 CG ARG A 76 4.728 -2.964 5.319 1.00 0.00 C ATOM 1064 CD ARG A 76 5.155 -4.421 5.438 1.00 0.00 C ATOM 1065 NE ARG A 76 6.072 -4.632 6.556 1.00 0.00 N ATOM 1066 CZ ARG A 76 6.807 -5.731 6.714 1.00 0.00 C ATOM 1067 NH1 ARG A 76 6.736 -6.718 5.829 1.00 0.00 N ATOM 1068 NH2 ARG A 76 7.616 -5.842 7.759 1.00 0.00 N ATOM 0 H ARG A 76 0.840 -1.271 5.655 1.00 0.00 H new ATOM 0 HA ARG A 76 3.178 -1.892 7.348 1.00 0.00 H new ATOM 0 HB2 ARG A 76 2.782 -3.753 5.730 1.00 0.00 H new ATOM 0 HB3 ARG A 76 2.825 -2.603 4.408 1.00 0.00 H new ATOM 0 HG2 ARG A 76 5.082 -2.558 4.372 1.00 0.00 H new ATOM 0 HG3 ARG A 76 5.198 -2.382 6.111 1.00 0.00 H new ATOM 0 HD2 ARG A 76 4.273 -5.048 5.569 1.00 0.00 H new ATOM 0 HD3 ARG A 76 5.635 -4.735 4.511 1.00 0.00 H new ATOM 0 HE ARG A 76 6.154 -3.895 7.256 1.00 0.00 H new ATOM 0 HH11 ARG A 76 6.116 -6.637 5.023 1.00 0.00 H new ATOM 0 HH12 ARG A 76 7.301 -7.558 5.955 1.00 0.00 H new ATOM 0 HH21 ARG A 76 7.675 -5.086 8.441 1.00 0.00 H new ATOM 0 HH22 ARG A 76 8.179 -6.684 7.881 1.00 0.00 H new ATOM 1082 N SER A 77 4.398 0.094 6.467 1.00 0.00 N ATOM 1083 CA SER A 77 5.006 1.367 6.095 1.00 0.00 C ATOM 1084 C SER A 77 5.478 1.340 4.645 1.00 0.00 C ATOM 1085 O SER A 77 6.245 0.463 4.248 1.00 0.00 O ATOM 1086 CB SER A 77 6.181 1.685 7.022 1.00 0.00 C ATOM 1087 OG SER A 77 5.752 2.411 8.161 1.00 0.00 O ATOM 0 H SER A 77 4.886 -0.406 7.210 1.00 0.00 H new ATOM 0 HA SER A 77 4.251 2.147 6.198 1.00 0.00 H new ATOM 0 HB2 SER A 77 6.660 0.758 7.337 1.00 0.00 H new ATOM 0 HB3 SER A 77 6.930 2.263 6.480 1.00 0.00 H new ATOM 0 HG SER A 77 6.522 2.600 8.738 1.00 0.00 H new ATOM 1093 N PHE A 78 5.014 2.306 3.859 1.00 0.00 N ATOM 1094 CA PHE A 78 5.388 2.393 2.451 1.00 0.00 C ATOM 1095 C PHE A 78 6.297 3.593 2.202 1.00 0.00 C ATOM 1096 O PHE A 78 6.292 4.171 1.115 1.00 0.00 O ATOM 1097 CB PHE A 78 4.136 2.492 1.577 1.00 0.00 C ATOM 1098 CG PHE A 78 3.717 1.182 0.975 1.00 0.00 C ATOM 1099 CD1 PHE A 78 3.411 0.098 1.783 1.00 0.00 C ATOM 1100 CD2 PHE A 78 3.629 1.032 -0.399 1.00 0.00 C ATOM 1101 CE1 PHE A 78 3.025 -1.109 1.233 1.00 0.00 C ATOM 1102 CE2 PHE A 78 3.244 -0.173 -0.956 1.00 0.00 C ATOM 1103 CZ PHE A 78 2.942 -1.244 -0.139 1.00 0.00 C ATOM 0 H PHE A 78 4.379 3.040 4.173 1.00 0.00 H new ATOM 0 HA PHE A 78 5.935 1.488 2.188 1.00 0.00 H new ATOM 0 HB2 PHE A 78 3.315 2.886 2.176 1.00 0.00 H new ATOM 0 HB3 PHE A 78 4.318 3.208 0.776 1.00 0.00 H new ATOM 0 HD1 PHE A 78 3.475 0.198 2.856 1.00 0.00 H new ATOM 0 HD2 PHE A 78 3.864 1.867 -1.043 1.00 0.00 H new ATOM 0 HE1 PHE A 78 2.789 -1.945 1.874 1.00 0.00 H new ATOM 0 HE2 PHE A 78 3.180 -0.277 -2.029 1.00 0.00 H new ATOM 0 HZ PHE A 78 2.641 -2.186 -0.572 1.00 0.00 H new ATOM 1113 N LEU A 79 7.076 3.961 3.213 1.00 0.00 N ATOM 1114 CA LEU A 79 7.989 5.092 3.101 1.00 0.00 C ATOM 1115 C LEU A 79 9.334 4.652 2.532 1.00 0.00 C ATOM 1116 O LEU A 79 9.789 5.172 1.513 1.00 0.00 O ATOM 1117 CB LEU A 79 8.193 5.750 4.467 1.00 0.00 C ATOM 1118 CG LEU A 79 7.003 6.564 4.978 1.00 0.00 C ATOM 1119 CD1 LEU A 79 7.162 6.870 6.458 1.00 0.00 C ATOM 1120 CD2 LEU A 79 6.855 7.849 4.179 1.00 0.00 C ATOM 0 H LEU A 79 7.093 3.493 4.119 1.00 0.00 H new ATOM 0 HA LEU A 79 7.544 5.817 2.419 1.00 0.00 H new ATOM 0 HB2 LEU A 79 8.423 4.973 5.197 1.00 0.00 H new ATOM 0 HB3 LEU A 79 9.064 6.403 4.412 1.00 0.00 H new ATOM 0 HG LEU A 79 6.098 5.971 4.846 1.00 0.00 H new ATOM 0 HD11 LEU A 79 6.306 7.450 6.804 1.00 0.00 H new ATOM 0 HD12 LEU A 79 7.219 5.937 7.018 1.00 0.00 H new ATOM 0 HD13 LEU A 79 8.076 7.443 6.615 1.00 0.00 H new ATOM 0 HD21 LEU A 79 6.004 8.416 4.556 1.00 0.00 H new ATOM 0 HD22 LEU A 79 7.761 8.446 4.279 1.00 0.00 H new ATOM 0 HD23 LEU A 79 6.694 7.608 3.128 1.00 0.00 H new ATOM 1132 N ASN A 80 9.967 3.692 3.199 1.00 0.00 N ATOM 1133 CA ASN A 80 11.261 3.182 2.760 1.00 0.00 C ATOM 1134 C ASN A 80 11.098 1.886 1.974 1.00 0.00 C ATOM 1135 O ASN A 80 11.963 1.011 2.014 1.00 0.00 O ATOM 1136 CB ASN A 80 12.174 2.949 3.965 1.00 0.00 C ATOM 1137 CG ASN A 80 11.607 1.925 4.929 1.00 0.00 C ATOM 1138 OD1 ASN A 80 10.581 2.157 5.568 1.00 0.00 O ATOM 1139 ND2 ASN A 80 12.277 0.783 5.040 1.00 0.00 N ATOM 0 H ASN A 80 9.605 3.252 4.045 1.00 0.00 H new ATOM 0 HA ASN A 80 11.714 3.927 2.106 1.00 0.00 H new ATOM 0 HB2 ASN A 80 13.152 2.615 3.618 1.00 0.00 H new ATOM 0 HB3 ASN A 80 12.327 3.892 4.489 1.00 0.00 H new ATOM 0 HD21 ASN A 80 11.945 0.056 5.674 1.00 0.00 H new ATOM 0 HD22 ASN A 80 13.123 0.633 4.491 1.00 0.00 H new ATOM 1146 N ILE A 81 9.984 1.770 1.258 1.00 0.00 N ATOM 1147 CA ILE A 81 9.709 0.580 0.462 1.00 0.00 C ATOM 1148 C ILE A 81 10.268 0.723 -0.950 1.00 0.00 C ATOM 1149 O ILE A 81 10.136 1.774 -1.577 1.00 0.00 O ATOM 1150 CB ILE A 81 8.195 0.293 0.383 1.00 0.00 C ATOM 1151 CG1 ILE A 81 7.938 -1.033 -0.338 1.00 0.00 C ATOM 1152 CG2 ILE A 81 7.470 1.435 -0.317 1.00 0.00 C ATOM 1153 CD1 ILE A 81 7.681 -2.191 0.602 1.00 0.00 C ATOM 0 H ILE A 81 9.258 2.485 1.213 1.00 0.00 H new ATOM 0 HA ILE A 81 10.201 -0.256 0.959 1.00 0.00 H new ATOM 0 HB ILE A 81 7.806 0.213 1.398 1.00 0.00 H new ATOM 0 HG12 ILE A 81 7.081 -0.917 -1.001 1.00 0.00 H new ATOM 0 HG13 ILE A 81 8.797 -1.269 -0.966 1.00 0.00 H new ATOM 0 HG21 ILE A 81 6.403 1.215 -0.363 1.00 0.00 H new ATOM 0 HG22 ILE A 81 7.626 2.360 0.239 1.00 0.00 H new ATOM 0 HG23 ILE A 81 7.861 1.549 -1.328 1.00 0.00 H new ATOM 0 HD11 ILE A 81 7.507 -3.098 0.023 1.00 0.00 H new ATOM 0 HD12 ILE A 81 8.547 -2.334 1.249 1.00 0.00 H new ATOM 0 HD13 ILE A 81 6.804 -1.976 1.212 1.00 0.00 H new ATOM 1165 N LEU A 82 10.893 -0.341 -1.444 1.00 0.00 N ATOM 1166 CA LEU A 82 11.472 -0.334 -2.783 1.00 0.00 C ATOM 1167 C LEU A 82 10.382 -0.224 -3.844 1.00 0.00 C ATOM 1168 O LEU A 82 9.201 -0.421 -3.559 1.00 0.00 O ATOM 1169 CB LEU A 82 12.295 -1.603 -3.011 1.00 0.00 C ATOM 1170 CG LEU A 82 13.476 -1.790 -2.057 1.00 0.00 C ATOM 1171 CD1 LEU A 82 13.591 -3.243 -1.623 1.00 0.00 C ATOM 1172 CD2 LEU A 82 14.769 -1.324 -2.711 1.00 0.00 C ATOM 0 H LEU A 82 11.012 -1.219 -0.938 1.00 0.00 H new ATOM 0 HA LEU A 82 12.125 0.534 -2.866 1.00 0.00 H new ATOM 0 HB2 LEU A 82 11.635 -2.466 -2.922 1.00 0.00 H new ATOM 0 HB3 LEU A 82 12.672 -1.594 -4.034 1.00 0.00 H new ATOM 0 HG LEU A 82 13.299 -1.181 -1.170 1.00 0.00 H new ATOM 0 HD11 LEU A 82 14.437 -3.354 -0.945 1.00 0.00 H new ATOM 0 HD12 LEU A 82 12.676 -3.544 -1.114 1.00 0.00 H new ATOM 0 HD13 LEU A 82 13.743 -3.873 -2.499 1.00 0.00 H new ATOM 0 HD21 LEU A 82 15.598 -1.464 -2.018 1.00 0.00 H new ATOM 0 HD22 LEU A 82 14.949 -1.905 -3.615 1.00 0.00 H new ATOM 0 HD23 LEU A 82 14.686 -0.268 -2.969 1.00 0.00 H new ATOM 1184 N HIS A 83 10.786 0.091 -5.070 1.00 0.00 N ATOM 1185 CA HIS A 83 9.844 0.226 -6.173 1.00 0.00 C ATOM 1186 C HIS A 83 9.331 -1.139 -6.620 1.00 0.00 C ATOM 1187 O HIS A 83 8.125 -1.348 -6.752 1.00 0.00 O ATOM 1188 CB HIS A 83 10.503 0.946 -7.351 1.00 0.00 C ATOM 1189 CG HIS A 83 9.573 1.185 -8.501 1.00 0.00 C ATOM 1190 ND1 HIS A 83 8.220 0.921 -8.443 1.00 0.00 N ATOM 1191 CD2 HIS A 83 9.808 1.667 -9.744 1.00 0.00 C ATOM 1192 CE1 HIS A 83 7.664 1.229 -9.601 1.00 0.00 C ATOM 1193 NE2 HIS A 83 8.605 1.684 -10.407 1.00 0.00 N ATOM 0 H HIS A 83 11.760 0.257 -5.324 1.00 0.00 H new ATOM 0 HA HIS A 83 8.997 0.817 -5.823 1.00 0.00 H new ATOM 0 HB2 HIS A 83 10.897 1.903 -7.008 1.00 0.00 H new ATOM 0 HB3 HIS A 83 11.353 0.357 -7.697 1.00 0.00 H new ATOM 0 HD1 HIS A 83 7.726 0.547 -7.633 1.00 0.00 H new ATOM 0 HD2 HIS A 83 10.763 1.980 -10.140 1.00 0.00 H new ATOM 0 HE1 HIS A 83 6.617 1.126 -9.847 1.00 0.00 H new ATOM 1202 N ASP A 84 10.255 -2.065 -6.850 1.00 0.00 N ATOM 1203 CA ASP A 84 9.898 -3.411 -7.281 1.00 0.00 C ATOM 1204 C ASP A 84 9.086 -4.130 -6.208 1.00 0.00 C ATOM 1205 O ASP A 84 8.233 -4.963 -6.515 1.00 0.00 O ATOM 1206 CB ASP A 84 11.157 -4.216 -7.608 1.00 0.00 C ATOM 1207 CG ASP A 84 12.137 -4.251 -6.451 1.00 0.00 C ATOM 1208 OD1 ASP A 84 13.001 -3.351 -6.378 1.00 0.00 O ATOM 1209 OD2 ASP A 84 12.042 -5.178 -5.620 1.00 0.00 O ATOM 0 H ASP A 84 11.257 -1.908 -6.745 1.00 0.00 H new ATOM 0 HA ASP A 84 9.286 -3.326 -8.179 1.00 0.00 H new ATOM 0 HB2 ASP A 84 10.875 -5.235 -7.873 1.00 0.00 H new ATOM 0 HB3 ASP A 84 11.645 -3.783 -8.481 1.00 0.00 H new ATOM 1214 N GLU A 85 9.356 -3.804 -4.949 1.00 0.00 N ATOM 1215 CA GLU A 85 8.651 -4.420 -3.831 1.00 0.00 C ATOM 1216 C GLU A 85 7.237 -3.861 -3.706 1.00 0.00 C ATOM 1217 O GLU A 85 6.320 -4.558 -3.271 1.00 0.00 O ATOM 1218 CB GLU A 85 9.419 -4.193 -2.528 1.00 0.00 C ATOM 1219 CG GLU A 85 9.017 -5.145 -1.413 1.00 0.00 C ATOM 1220 CD GLU A 85 9.964 -5.087 -0.229 1.00 0.00 C ATOM 1221 OE1 GLU A 85 11.186 -5.240 -0.438 1.00 0.00 O ATOM 1222 OE2 GLU A 85 9.483 -4.891 0.906 1.00 0.00 O ATOM 0 H GLU A 85 10.058 -3.116 -4.677 1.00 0.00 H new ATOM 0 HA GLU A 85 8.584 -5.491 -4.022 1.00 0.00 H new ATOM 0 HB2 GLU A 85 10.486 -4.302 -2.721 1.00 0.00 H new ATOM 0 HB3 GLU A 85 9.259 -3.168 -2.195 1.00 0.00 H new ATOM 0 HG2 GLU A 85 8.008 -4.903 -1.079 1.00 0.00 H new ATOM 0 HG3 GLU A 85 8.988 -6.163 -1.802 1.00 0.00 H new ATOM 1229 N ALA A 86 7.068 -2.599 -4.088 1.00 0.00 N ATOM 1230 CA ALA A 86 5.766 -1.948 -4.017 1.00 0.00 C ATOM 1231 C ALA A 86 4.832 -2.472 -5.103 1.00 0.00 C ATOM 1232 O ALA A 86 3.623 -2.577 -4.898 1.00 0.00 O ATOM 1233 CB ALA A 86 5.923 -0.440 -4.136 1.00 0.00 C ATOM 0 H ALA A 86 7.816 -2.008 -4.450 1.00 0.00 H new ATOM 0 HA ALA A 86 5.323 -2.180 -3.049 1.00 0.00 H new ATOM 0 HB1 ALA A 86 4.943 0.033 -4.081 1.00 0.00 H new ATOM 0 HB2 ALA A 86 6.549 -0.074 -3.322 1.00 0.00 H new ATOM 0 HB3 ALA A 86 6.391 -0.197 -5.090 1.00 0.00 H new ATOM 1239 N VAL A 87 5.400 -2.797 -6.259 1.00 0.00 N ATOM 1240 CA VAL A 87 4.619 -3.310 -7.377 1.00 0.00 C ATOM 1241 C VAL A 87 4.302 -4.790 -7.192 1.00 0.00 C ATOM 1242 O VAL A 87 3.261 -5.273 -7.638 1.00 0.00 O ATOM 1243 CB VAL A 87 5.360 -3.119 -8.715 1.00 0.00 C ATOM 1244 CG1 VAL A 87 4.463 -3.500 -9.883 1.00 0.00 C ATOM 1245 CG2 VAL A 87 5.848 -1.685 -8.855 1.00 0.00 C ATOM 0 H VAL A 87 6.399 -2.714 -6.446 1.00 0.00 H new ATOM 0 HA VAL A 87 3.689 -2.741 -7.401 1.00 0.00 H new ATOM 0 HB VAL A 87 6.229 -3.777 -8.725 1.00 0.00 H new ATOM 0 HG11 VAL A 87 5.004 -3.358 -10.819 1.00 0.00 H new ATOM 0 HG12 VAL A 87 4.168 -4.545 -9.789 1.00 0.00 H new ATOM 0 HG13 VAL A 87 3.574 -2.870 -9.879 1.00 0.00 H new ATOM 0 HG21 VAL A 87 6.369 -1.569 -9.806 1.00 0.00 H new ATOM 0 HG22 VAL A 87 4.996 -1.006 -8.823 1.00 0.00 H new ATOM 0 HG23 VAL A 87 6.529 -1.451 -8.037 1.00 0.00 H new ATOM 1255 N ARG A 88 5.206 -5.506 -6.530 1.00 0.00 N ATOM 1256 CA ARG A 88 5.021 -6.931 -6.285 1.00 0.00 C ATOM 1257 C ARG A 88 4.145 -7.163 -5.058 1.00 0.00 C ATOM 1258 O ARG A 88 3.409 -8.148 -4.985 1.00 0.00 O ATOM 1259 CB ARG A 88 6.378 -7.618 -6.100 1.00 0.00 C ATOM 1260 CG ARG A 88 6.764 -8.521 -7.261 1.00 0.00 C ATOM 1261 CD ARG A 88 8.152 -8.192 -7.789 1.00 0.00 C ATOM 1262 NE ARG A 88 9.165 -9.110 -7.272 1.00 0.00 N ATOM 1263 CZ ARG A 88 9.333 -10.354 -7.714 1.00 0.00 C ATOM 1264 NH1 ARG A 88 8.559 -10.833 -8.680 1.00 0.00 N ATOM 1265 NH2 ARG A 88 10.279 -11.121 -7.189 1.00 0.00 N ATOM 0 H ARG A 88 6.073 -5.122 -6.154 1.00 0.00 H new ATOM 0 HA ARG A 88 4.520 -7.362 -7.151 1.00 0.00 H new ATOM 0 HB2 ARG A 88 7.147 -6.857 -5.971 1.00 0.00 H new ATOM 0 HB3 ARG A 88 6.356 -8.207 -5.183 1.00 0.00 H new ATOM 0 HG2 ARG A 88 6.734 -9.562 -6.939 1.00 0.00 H new ATOM 0 HG3 ARG A 88 6.034 -8.415 -8.064 1.00 0.00 H new ATOM 0 HD2 ARG A 88 8.145 -8.235 -8.878 1.00 0.00 H new ATOM 0 HD3 ARG A 88 8.413 -7.171 -7.512 1.00 0.00 H new ATOM 0 HE ARG A 88 9.779 -8.778 -6.529 1.00 0.00 H new ATOM 0 HH11 ARG A 88 7.831 -10.247 -9.088 1.00 0.00 H new ATOM 0 HH12 ARG A 88 8.693 -11.787 -9.015 1.00 0.00 H new ATOM 0 HH21 ARG A 88 10.877 -10.757 -6.447 1.00 0.00 H new ATOM 0 HH22 ARG A 88 10.408 -12.075 -7.527 1.00 0.00 H new ATOM 1279 N LEU A 89 4.230 -6.252 -4.094 1.00 0.00 N ATOM 1280 CA LEU A 89 3.445 -6.359 -2.870 1.00 0.00 C ATOM 1281 C LEU A 89 2.000 -5.933 -3.111 1.00 0.00 C ATOM 1282 O LEU A 89 1.073 -6.487 -2.519 1.00 0.00 O ATOM 1283 CB LEU A 89 4.064 -5.500 -1.764 1.00 0.00 C ATOM 1284 CG LEU A 89 3.503 -5.748 -0.363 1.00 0.00 C ATOM 1285 CD1 LEU A 89 3.924 -7.118 0.145 1.00 0.00 C ATOM 1286 CD2 LEU A 89 3.962 -4.659 0.594 1.00 0.00 C ATOM 0 H LEU A 89 4.835 -5.432 -4.137 1.00 0.00 H new ATOM 0 HA LEU A 89 3.450 -7.403 -2.556 1.00 0.00 H new ATOM 0 HB2 LEU A 89 5.139 -5.678 -1.745 1.00 0.00 H new ATOM 0 HB3 LEU A 89 3.919 -4.450 -2.016 1.00 0.00 H new ATOM 0 HG LEU A 89 2.415 -5.722 -0.418 1.00 0.00 H new ATOM 0 HD11 LEU A 89 3.516 -7.277 1.143 1.00 0.00 H new ATOM 0 HD12 LEU A 89 3.547 -7.888 -0.528 1.00 0.00 H new ATOM 0 HD13 LEU A 89 5.012 -7.173 0.185 1.00 0.00 H new ATOM 0 HD21 LEU A 89 3.554 -4.851 1.586 1.00 0.00 H new ATOM 0 HD22 LEU A 89 5.051 -4.654 0.644 1.00 0.00 H new ATOM 0 HD23 LEU A 89 3.611 -3.690 0.238 1.00 0.00 H new ATOM 1298 N LEU A 90 1.815 -4.948 -3.982 1.00 0.00 N ATOM 1299 CA LEU A 90 0.482 -4.450 -4.300 1.00 0.00 C ATOM 1300 C LEU A 90 -0.232 -5.388 -5.269 1.00 0.00 C ATOM 1301 O LEU A 90 -1.455 -5.525 -5.230 1.00 0.00 O ATOM 1302 CB LEU A 90 0.567 -3.046 -4.901 1.00 0.00 C ATOM 1303 CG LEU A 90 0.927 -1.938 -3.909 1.00 0.00 C ATOM 1304 CD1 LEU A 90 1.339 -0.674 -4.647 1.00 0.00 C ATOM 1305 CD2 LEU A 90 -0.243 -1.657 -2.978 1.00 0.00 C ATOM 0 H LEU A 90 2.571 -4.478 -4.481 1.00 0.00 H new ATOM 0 HA LEU A 90 -0.092 -4.406 -3.374 1.00 0.00 H new ATOM 0 HB2 LEU A 90 1.309 -3.053 -5.699 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -0.392 -2.805 -5.360 1.00 0.00 H new ATOM 0 HG LEU A 90 1.772 -2.274 -3.308 1.00 0.00 H new ATOM 0 HD11 LEU A 90 1.591 0.103 -3.925 1.00 0.00 H new ATOM 0 HD12 LEU A 90 2.207 -0.884 -5.272 1.00 0.00 H new ATOM 0 HD13 LEU A 90 0.515 -0.333 -5.273 1.00 0.00 H new ATOM 0 HD21 LEU A 90 0.030 -0.867 -2.279 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -1.106 -1.341 -3.564 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -0.492 -2.562 -2.423 1.00 0.00 H new ATOM 1317 N LYS A 91 0.540 -6.032 -6.138 1.00 0.00 N ATOM 1318 CA LYS A 91 -0.017 -6.958 -7.116 1.00 0.00 C ATOM 1319 C LYS A 91 0.244 -8.404 -6.705 1.00 0.00 C ATOM 1320 O LYS A 91 0.886 -9.163 -7.431 1.00 0.00 O ATOM 1321 CB LYS A 91 0.579 -6.691 -8.500 1.00 0.00 C ATOM 1322 CG LYS A 91 0.657 -5.214 -8.854 1.00 0.00 C ATOM 1323 CD LYS A 91 -0.724 -4.623 -9.080 1.00 0.00 C ATOM 1324 CE LYS A 91 -0.698 -3.539 -10.144 1.00 0.00 C ATOM 1325 NZ LYS A 91 -1.074 -4.066 -11.485 1.00 0.00 N ATOM 0 H LYS A 91 1.554 -5.929 -6.185 1.00 0.00 H new ATOM 0 HA LYS A 91 -1.095 -6.800 -7.157 1.00 0.00 H new ATOM 0 HB2 LYS A 91 1.580 -7.120 -8.544 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -0.022 -7.205 -9.250 1.00 0.00 H new ATOM 0 HG2 LYS A 91 1.159 -4.672 -8.052 1.00 0.00 H new ATOM 0 HG3 LYS A 91 1.261 -5.085 -9.752 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -1.414 -5.412 -9.380 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -1.101 -4.208 -8.145 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -1.383 -2.739 -9.864 1.00 0.00 H new ATOM 0 HE3 LYS A 91 0.299 -3.102 -10.193 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -0.835 -3.363 -12.214 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -0.554 -4.947 -11.670 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -2.096 -4.256 -11.509 1.00 0.00 H new ATOM 1339 N SER A 92 -0.260 -8.781 -5.533 1.00 0.00 N ATOM 1340 CA SER A 92 -0.080 -10.135 -5.025 1.00 0.00 C ATOM 1341 C SER A 92 -1.203 -10.511 -4.062 1.00 0.00 C ATOM 1342 O SER A 92 -1.950 -11.459 -4.304 1.00 0.00 O ATOM 1343 CB SER A 92 1.273 -10.264 -4.322 1.00 0.00 C ATOM 1344 OG SER A 92 1.510 -11.599 -3.910 1.00 0.00 O ATOM 0 H SER A 92 -0.796 -8.168 -4.919 1.00 0.00 H new ATOM 0 HA SER A 92 -0.109 -10.819 -5.873 1.00 0.00 H new ATOM 0 HB2 SER A 92 2.068 -9.941 -4.995 1.00 0.00 H new ATOM 0 HB3 SER A 92 1.301 -9.603 -3.456 1.00 0.00 H new ATOM 0 HG SER A 92 2.382 -11.654 -3.465 1.00 0.00 H new ATOM 1350 N SER A 93 -1.314 -9.761 -2.971 1.00 0.00 N ATOM 1351 CA SER A 93 -2.346 -10.016 -1.970 1.00 0.00 C ATOM 1352 C SER A 93 -3.734 -9.728 -2.533 1.00 0.00 C ATOM 1353 O SER A 93 -3.885 -8.942 -3.468 1.00 0.00 O ATOM 1354 CB SER A 93 -2.100 -9.163 -0.725 1.00 0.00 C ATOM 1355 OG SER A 93 -1.277 -9.844 0.205 1.00 0.00 O ATOM 0 H SER A 93 -0.704 -8.972 -2.757 1.00 0.00 H new ATOM 0 HA SER A 93 -2.298 -11.070 -1.695 1.00 0.00 H new ATOM 0 HB2 SER A 93 -1.629 -8.223 -1.012 1.00 0.00 H new ATOM 0 HB3 SER A 93 -3.052 -8.913 -0.258 1.00 0.00 H new ATOM 0 HG SER A 93 -1.133 -9.277 0.991 1.00 0.00 H new ATOM 1361 N ARG A 94 -4.745 -10.370 -1.956 1.00 0.00 N ATOM 1362 CA ARG A 94 -6.123 -10.183 -2.400 1.00 0.00 C ATOM 1363 C ARG A 94 -6.759 -8.981 -1.710 1.00 0.00 C ATOM 1364 O ARG A 94 -7.606 -8.299 -2.288 1.00 0.00 O ATOM 1365 CB ARG A 94 -6.946 -11.441 -2.118 1.00 0.00 C ATOM 1366 CG ARG A 94 -6.803 -11.954 -0.693 1.00 0.00 C ATOM 1367 CD ARG A 94 -5.869 -13.153 -0.618 1.00 0.00 C ATOM 1368 NE ARG A 94 -6.540 -14.338 -0.089 1.00 0.00 N ATOM 1369 CZ ARG A 94 -5.923 -15.490 0.161 1.00 0.00 C ATOM 1370 NH1 ARG A 94 -4.621 -15.617 -0.067 1.00 0.00 N ATOM 1371 NH2 ARG A 94 -6.608 -16.518 0.641 1.00 0.00 N ATOM 0 H ARG A 94 -4.637 -11.024 -1.181 1.00 0.00 H new ATOM 0 HA ARG A 94 -6.110 -9.998 -3.474 1.00 0.00 H new ATOM 0 HB2 ARG A 94 -7.997 -11.230 -2.316 1.00 0.00 H new ATOM 0 HB3 ARG A 94 -6.643 -12.226 -2.810 1.00 0.00 H new ATOM 0 HG2 ARG A 94 -6.423 -11.156 -0.055 1.00 0.00 H new ATOM 0 HG3 ARG A 94 -7.783 -12.232 -0.306 1.00 0.00 H new ATOM 0 HD2 ARG A 94 -5.479 -13.371 -1.612 1.00 0.00 H new ATOM 0 HD3 ARG A 94 -5.015 -12.908 0.013 1.00 0.00 H new ATOM 0 HE ARG A 94 -7.541 -14.279 0.100 1.00 0.00 H new ATOM 0 HH11 ARG A 94 -4.089 -14.829 -0.436 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -4.153 -16.503 0.127 1.00 0.00 H new ATOM 0 HH21 ARG A 94 -7.608 -16.426 0.819 1.00 0.00 H new ATOM 0 HH22 ARG A 94 -6.135 -17.401 0.833 1.00 0.00 H new ATOM 1385 N HIS A 95 -6.346 -8.726 -0.474 1.00 0.00 N ATOM 1386 CA HIS A 95 -6.877 -7.605 0.294 1.00 0.00 C ATOM 1387 C HIS A 95 -5.872 -6.459 0.350 1.00 0.00 C ATOM 1388 O HIS A 95 -4.928 -6.486 1.142 1.00 0.00 O ATOM 1389 CB HIS A 95 -7.238 -8.055 1.712 1.00 0.00 C ATOM 1390 CG HIS A 95 -8.505 -7.449 2.229 1.00 0.00 C ATOM 1391 ND1 HIS A 95 -9.324 -8.079 3.141 1.00 0.00 N ATOM 1392 CD2 HIS A 95 -9.094 -6.260 1.957 1.00 0.00 C ATOM 1393 CE1 HIS A 95 -10.362 -7.305 3.407 1.00 0.00 C ATOM 1394 NE2 HIS A 95 -10.246 -6.196 2.702 1.00 0.00 N ATOM 0 H HIS A 95 -5.645 -9.280 0.018 1.00 0.00 H new ATOM 0 HA HIS A 95 -7.778 -7.249 -0.206 1.00 0.00 H new ATOM 0 HB2 HIS A 95 -7.332 -9.141 1.727 1.00 0.00 H new ATOM 0 HB3 HIS A 95 -6.421 -7.797 2.385 1.00 0.00 H new ATOM 0 HD2 HIS A 95 -8.726 -5.503 1.280 1.00 0.00 H new ATOM 0 HE1 HIS A 95 -11.168 -7.540 4.086 1.00 0.00 H new ATOM 0 HE2 HIS A 95 -10.905 -5.417 2.709 1.00 0.00 H new ATOM 1403 N LEU A 96 -6.078 -5.456 -0.495 1.00 0.00 N ATOM 1404 CA LEU A 96 -5.189 -4.300 -0.543 1.00 0.00 C ATOM 1405 C LEU A 96 -5.871 -3.065 0.038 1.00 0.00 C ATOM 1406 O LEU A 96 -6.797 -2.515 -0.559 1.00 0.00 O ATOM 1407 CB LEU A 96 -4.751 -4.025 -1.982 1.00 0.00 C ATOM 1408 CG LEU A 96 -4.308 -5.259 -2.770 1.00 0.00 C ATOM 1409 CD1 LEU A 96 -3.995 -4.887 -4.211 1.00 0.00 C ATOM 1410 CD2 LEU A 96 -3.099 -5.906 -2.110 1.00 0.00 C ATOM 0 H LEU A 96 -6.853 -5.419 -1.157 1.00 0.00 H new ATOM 0 HA LEU A 96 -4.309 -4.525 0.060 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -5.576 -3.551 -2.513 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -3.929 -3.309 -1.965 1.00 0.00 H new ATOM 0 HG LEU A 96 -5.126 -5.980 -2.772 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -3.682 -5.777 -4.757 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -4.885 -4.468 -4.680 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -3.194 -4.149 -4.230 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -2.797 -6.782 -2.683 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -2.276 -5.192 -2.078 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -3.357 -6.208 -1.095 1.00 0.00 H new ATOM 1422 N ILE A 97 -5.405 -2.633 1.205 1.00 0.00 N ATOM 1423 CA ILE A 97 -5.968 -1.462 1.867 1.00 0.00 C ATOM 1424 C ILE A 97 -5.010 -0.277 1.792 1.00 0.00 C ATOM 1425 O ILE A 97 -4.394 0.103 2.788 1.00 0.00 O ATOM 1426 CB ILE A 97 -6.295 -1.754 3.344 1.00 0.00 C ATOM 1427 CG1 ILE A 97 -7.095 -3.052 3.466 1.00 0.00 C ATOM 1428 CG2 ILE A 97 -7.063 -0.592 3.957 1.00 0.00 C ATOM 1429 CD1 ILE A 97 -7.168 -3.588 4.878 1.00 0.00 C ATOM 0 H ILE A 97 -4.639 -3.076 1.712 1.00 0.00 H new ATOM 0 HA ILE A 97 -6.891 -1.214 1.343 1.00 0.00 H new ATOM 0 HB ILE A 97 -5.359 -1.874 3.890 1.00 0.00 H new ATOM 0 HG12 ILE A 97 -8.107 -2.881 3.098 1.00 0.00 H new ATOM 0 HG13 ILE A 97 -6.645 -3.808 2.822 1.00 0.00 H new ATOM 0 HG21 ILE A 97 -7.286 -0.814 5.001 1.00 0.00 H new ATOM 0 HG22 ILE A 97 -6.459 0.314 3.900 1.00 0.00 H new ATOM 0 HG23 ILE A 97 -7.994 -0.443 3.410 1.00 0.00 H new ATOM 0 HD11 ILE A 97 -7.750 -4.509 4.888 1.00 0.00 H new ATOM 0 HD12 ILE A 97 -6.161 -3.791 5.243 1.00 0.00 H new ATOM 0 HD13 ILE A 97 -7.645 -2.850 5.523 1.00 0.00 H new ATOM 1441 N LEU A 98 -4.887 0.301 0.602 1.00 0.00 N ATOM 1442 CA LEU A 98 -4.003 1.442 0.391 1.00 0.00 C ATOM 1443 C LEU A 98 -4.414 2.620 1.269 1.00 0.00 C ATOM 1444 O LEU A 98 -5.597 2.817 1.547 1.00 0.00 O ATOM 1445 CB LEU A 98 -4.016 1.859 -1.080 1.00 0.00 C ATOM 1446 CG LEU A 98 -3.093 1.046 -1.991 1.00 0.00 C ATOM 1447 CD1 LEU A 98 -3.861 -0.088 -2.653 1.00 0.00 C ATOM 1448 CD2 LEU A 98 -2.455 1.944 -3.041 1.00 0.00 C ATOM 0 H LEU A 98 -5.389 -0.002 -0.232 1.00 0.00 H new ATOM 0 HA LEU A 98 -2.992 1.142 0.668 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -5.036 1.778 -1.456 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -3.734 2.910 -1.147 1.00 0.00 H new ATOM 0 HG LEU A 98 -2.300 0.613 -1.381 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -3.189 -0.655 -3.297 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -4.271 -0.746 -1.887 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -4.674 0.324 -3.250 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -1.802 1.350 -3.680 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -3.234 2.405 -3.648 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -1.871 2.721 -2.549 1.00 0.00 H new ATOM 1460 N THR A 99 -3.429 3.401 1.700 1.00 0.00 N ATOM 1461 CA THR A 99 -3.687 4.563 2.545 1.00 0.00 C ATOM 1462 C THR A 99 -3.127 5.831 1.910 1.00 0.00 C ATOM 1463 O THR A 99 -1.993 6.226 2.185 1.00 0.00 O ATOM 1464 CB THR A 99 -3.072 4.358 3.930 1.00 0.00 C ATOM 1465 OG1 THR A 99 -3.468 3.112 4.475 1.00 0.00 O ATOM 1466 CG2 THR A 99 -3.456 5.436 4.920 1.00 0.00 C ATOM 0 H THR A 99 -2.445 3.251 1.479 1.00 0.00 H new ATOM 0 HA THR A 99 -4.766 4.675 2.647 1.00 0.00 H new ATOM 0 HB THR A 99 -1.994 4.396 3.776 1.00 0.00 H new ATOM 0 HG1 THR A 99 -2.967 2.391 4.040 1.00 0.00 H new ATOM 0 HG21 THR A 99 -2.986 5.231 5.882 1.00 0.00 H new ATOM 0 HG22 THR A 99 -3.119 6.405 4.552 1.00 0.00 H new ATOM 0 HG23 THR A 99 -4.539 5.450 5.041 1.00 0.00 H new ATOM 1474 N VAL A 100 -3.927 6.464 1.059 1.00 0.00 N ATOM 1475 CA VAL A 100 -3.510 7.688 0.385 1.00 0.00 C ATOM 1476 C VAL A 100 -4.178 8.912 1.003 1.00 0.00 C ATOM 1477 O VAL A 100 -5.230 8.804 1.635 1.00 0.00 O ATOM 1478 CB VAL A 100 -3.841 7.642 -1.119 1.00 0.00 C ATOM 1479 CG1 VAL A 100 -2.908 6.686 -1.843 1.00 0.00 C ATOM 1480 CG2 VAL A 100 -5.295 7.246 -1.332 1.00 0.00 C ATOM 0 H VAL A 100 -4.867 6.150 0.820 1.00 0.00 H new ATOM 0 HA VAL A 100 -2.430 7.765 0.510 1.00 0.00 H new ATOM 0 HB VAL A 100 -3.694 8.638 -1.536 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -3.158 6.667 -2.904 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -1.878 7.019 -1.719 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -3.018 5.685 -1.427 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -5.512 7.218 -2.400 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -5.471 6.261 -0.900 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -5.945 7.975 -0.848 1.00 0.00 H new ATOM 1490 N LYS A 101 -3.562 10.074 0.817 1.00 0.00 N ATOM 1491 CA LYS A 101 -4.098 11.318 1.357 1.00 0.00 C ATOM 1492 C LYS A 101 -4.707 12.173 0.250 1.00 0.00 C ATOM 1493 O LYS A 101 -4.354 12.035 -0.921 1.00 0.00 O ATOM 1494 CB LYS A 101 -3.000 12.102 2.076 1.00 0.00 C ATOM 1495 CG LYS A 101 -1.864 12.536 1.164 1.00 0.00 C ATOM 1496 CD LYS A 101 -0.676 13.052 1.960 1.00 0.00 C ATOM 1497 CE LYS A 101 0.170 14.012 1.139 1.00 0.00 C ATOM 1498 NZ LYS A 101 0.700 15.132 1.967 1.00 0.00 N ATOM 0 H LYS A 101 -2.691 10.181 0.297 1.00 0.00 H new ATOM 0 HA LYS A 101 -4.882 11.067 2.071 1.00 0.00 H new ATOM 0 HB2 LYS A 101 -3.440 12.985 2.539 1.00 0.00 H new ATOM 0 HB3 LYS A 101 -2.595 11.488 2.880 1.00 0.00 H new ATOM 0 HG2 LYS A 101 -1.551 11.695 0.546 1.00 0.00 H new ATOM 0 HG3 LYS A 101 -2.216 13.315 0.488 1.00 0.00 H new ATOM 0 HD2 LYS A 101 -1.030 13.556 2.859 1.00 0.00 H new ATOM 0 HD3 LYS A 101 -0.062 12.212 2.286 1.00 0.00 H new ATOM 0 HE2 LYS A 101 1.001 13.469 0.688 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -0.428 14.416 0.322 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 1.271 15.764 1.371 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 -0.093 15.666 2.377 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 1.292 14.749 2.732 1.00 0.00 H new ATOM 1512 N ASP A 102 -5.625 13.056 0.629 1.00 0.00 N ATOM 1513 CA ASP A 102 -6.284 13.934 -0.331 1.00 0.00 C ATOM 1514 C ASP A 102 -5.301 14.947 -0.908 1.00 0.00 C ATOM 1515 O ASP A 102 -5.154 16.052 -0.385 1.00 0.00 O ATOM 1516 CB ASP A 102 -7.455 14.663 0.331 1.00 0.00 C ATOM 1517 CG ASP A 102 -7.068 15.300 1.651 1.00 0.00 C ATOM 1518 OD1 ASP A 102 -5.854 15.422 1.920 1.00 0.00 O ATOM 1519 OD2 ASP A 102 -7.979 15.678 2.418 1.00 0.00 O ATOM 0 H ASP A 102 -5.929 13.183 1.594 1.00 0.00 H new ATOM 0 HA ASP A 102 -6.663 13.318 -1.146 1.00 0.00 H new ATOM 0 HB2 ASP A 102 -7.829 15.432 -0.345 1.00 0.00 H new ATOM 0 HB3 ASP A 102 -8.271 13.959 0.496 1.00 0.00 H new ATOM 1524 N VAL A 103 -4.628 14.563 -1.988 1.00 0.00 N ATOM 1525 CA VAL A 103 -3.658 15.439 -2.635 1.00 0.00 C ATOM 1526 C VAL A 103 -4.311 16.261 -3.740 1.00 0.00 C ATOM 1527 O VAL A 103 -4.359 17.489 -3.670 1.00 0.00 O ATOM 1528 CB VAL A 103 -2.486 14.637 -3.232 1.00 0.00 C ATOM 1529 CG1 VAL A 103 -1.395 15.572 -3.727 1.00 0.00 C ATOM 1530 CG2 VAL A 103 -1.935 13.656 -2.208 1.00 0.00 C ATOM 0 H VAL A 103 -4.736 13.652 -2.433 1.00 0.00 H new ATOM 0 HA VAL A 103 -3.275 16.109 -1.865 1.00 0.00 H new ATOM 0 HB VAL A 103 -2.856 14.067 -4.084 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -0.576 14.987 -4.145 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -1.801 16.229 -4.496 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -1.025 16.172 -2.895 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -1.108 13.098 -2.647 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -1.581 14.203 -1.334 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -2.721 12.963 -1.908 1.00 0.00 H new ATOM 1540 N GLY A 104 -4.814 15.575 -4.763 1.00 0.00 N ATOM 1541 CA GLY A 104 -5.459 16.260 -5.869 1.00 0.00 C ATOM 1542 C GLY A 104 -6.959 16.044 -5.892 1.00 0.00 C ATOM 1543 O GLY A 104 -7.450 15.104 -6.516 1.00 0.00 O ATOM 0 H GLY A 104 -4.786 14.559 -4.845 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -5.250 17.328 -5.802 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -5.031 15.910 -6.808 1.00 0.00 H new ATOM 1547 N ARG A 105 -7.689 16.920 -5.208 1.00 0.00 N ATOM 1548 CA ARG A 105 -9.144 16.823 -5.151 1.00 0.00 C ATOM 1549 C ARG A 105 -9.789 17.708 -6.214 1.00 0.00 C ATOM 1550 O ARG A 105 -9.535 18.911 -6.271 1.00 0.00 O ATOM 1551 CB ARG A 105 -9.647 17.219 -3.761 1.00 0.00 C ATOM 1552 CG ARG A 105 -10.330 16.084 -3.016 1.00 0.00 C ATOM 1553 CD ARG A 105 -11.839 16.123 -3.199 1.00 0.00 C ATOM 1554 NE ARG A 105 -12.397 17.429 -2.859 1.00 0.00 N ATOM 1555 CZ ARG A 105 -12.514 17.886 -1.614 1.00 0.00 C ATOM 1556 NH1 ARG A 105 -12.108 17.146 -0.588 1.00 0.00 N ATOM 1557 NH2 ARG A 105 -13.034 19.085 -1.393 1.00 0.00 N ATOM 0 H ARG A 105 -7.298 17.704 -4.686 1.00 0.00 H new ATOM 0 HA ARG A 105 -9.425 15.788 -5.348 1.00 0.00 H new ATOM 0 HB2 ARG A 105 -8.806 17.578 -3.168 1.00 0.00 H new ATOM 0 HB3 ARG A 105 -10.345 18.050 -3.859 1.00 0.00 H new ATOM 0 HG2 ARG A 105 -9.944 15.129 -3.373 1.00 0.00 H new ATOM 0 HG3 ARG A 105 -10.090 16.148 -1.955 1.00 0.00 H new ATOM 0 HD2 ARG A 105 -12.085 15.881 -4.233 1.00 0.00 H new ATOM 0 HD3 ARG A 105 -12.300 15.358 -2.574 1.00 0.00 H new ATOM 0 HE ARG A 105 -12.716 18.027 -3.621 1.00 0.00 H new ATOM 0 HH11 ARG A 105 -11.705 16.224 -0.752 1.00 0.00 H new ATOM 0 HH12 ARG A 105 -12.200 17.500 0.364 1.00 0.00 H new ATOM 0 HH21 ARG A 105 -13.345 19.658 -2.177 1.00 0.00 H new ATOM 0 HH22 ARG A 105 -13.123 19.434 -0.439 1.00 0.00 H new ATOM 1571 N LEU A 106 -10.623 17.105 -7.055 1.00 0.00 N ATOM 1572 CA LEU A 106 -11.304 17.840 -8.114 1.00 0.00 C ATOM 1573 C LEU A 106 -12.602 18.460 -7.602 1.00 0.00 C ATOM 1574 O LEU A 106 -13.180 17.990 -6.622 1.00 0.00 O ATOM 1575 CB LEU A 106 -11.601 16.918 -9.299 1.00 0.00 C ATOM 1576 CG LEU A 106 -12.197 15.557 -8.929 1.00 0.00 C ATOM 1577 CD1 LEU A 106 -13.293 15.168 -9.909 1.00 0.00 C ATOM 1578 CD2 LEU A 106 -11.110 14.492 -8.890 1.00 0.00 C ATOM 0 H LEU A 106 -10.843 16.110 -7.023 1.00 0.00 H new ATOM 0 HA LEU A 106 -10.643 18.642 -8.443 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -12.290 17.428 -9.973 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -10.676 16.754 -9.853 1.00 0.00 H new ATOM 0 HG LEU A 106 -12.639 15.634 -7.936 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -13.704 14.198 -9.629 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -14.084 15.917 -9.886 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -12.878 15.109 -10.915 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -11.551 13.531 -8.625 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -10.639 14.417 -9.870 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -10.361 14.764 -8.147 1.00 0.00 H new ATOM 1590 N PRO A 107 -13.077 19.530 -8.262 1.00 0.00 N ATOM 1591 CA PRO A 107 -14.313 20.214 -7.869 1.00 0.00 C ATOM 1592 C PRO A 107 -15.557 19.390 -8.180 1.00 0.00 C ATOM 1593 O PRO A 107 -15.462 18.217 -8.543 1.00 0.00 O ATOM 1594 CB PRO A 107 -14.292 21.492 -8.710 1.00 0.00 C ATOM 1595 CG PRO A 107 -13.486 21.138 -9.912 1.00 0.00 C ATOM 1596 CD PRO A 107 -12.448 20.155 -9.441 1.00 0.00 C ATOM 0 HA PRO A 107 -14.356 20.395 -6.795 1.00 0.00 H new ATOM 0 HB2 PRO A 107 -15.300 21.802 -8.986 1.00 0.00 H new ATOM 0 HB3 PRO A 107 -13.843 22.320 -8.162 1.00 0.00 H new ATOM 0 HG2 PRO A 107 -14.114 20.700 -10.688 1.00 0.00 H new ATOM 0 HG3 PRO A 107 -13.018 22.023 -10.343 1.00 0.00 H new ATOM 0 HD2 PRO A 107 -12.215 19.418 -10.210 1.00 0.00 H new ATOM 0 HD3 PRO A 107 -11.513 20.652 -9.181 1.00 0.00 H new ATOM 1604 N HIS A 108 -16.723 20.012 -8.036 1.00 0.00 N ATOM 1605 CA HIS A 108 -17.988 19.337 -8.301 1.00 0.00 C ATOM 1606 C HIS A 108 -18.450 19.588 -9.733 1.00 0.00 C ATOM 1607 O HIS A 108 -18.544 18.660 -10.536 1.00 0.00 O ATOM 1608 CB HIS A 108 -19.059 19.811 -7.316 1.00 0.00 C ATOM 1609 CG HIS A 108 -20.370 19.106 -7.470 1.00 0.00 C ATOM 1610 ND1 HIS A 108 -20.768 18.157 -8.350 1.00 0.00 N flip ATOM 1611 CD2 HIS A 108 -21.456 19.350 -6.656 1.00 0.00 C flip ATOM 1612 CE1 HIS A 108 -22.073 17.850 -8.055 1.00 0.00 C flip ATOM 1613 NE2 HIS A 108 -22.465 18.582 -7.029 1.00 0.00 N flip ATOM 0 H HIS A 108 -16.818 20.983 -7.737 1.00 0.00 H new ATOM 0 HA HIS A 108 -17.834 18.266 -8.171 1.00 0.00 H new ATOM 0 HB2 HIS A 108 -18.695 19.665 -6.299 1.00 0.00 H new ATOM 0 HB3 HIS A 108 -19.214 20.882 -7.449 1.00 0.00 H new ATOM 0 HD2 HIS A 108 -21.479 20.058 -5.841 1.00 0.00 H new ATOM 0 HE1 HIS A 108 -22.681 17.126 -8.578 1.00 0.00 H new ATOM 0 HE2 HIS A 108 -23.389 18.559 -6.598 1.00 0.00 H new ATOM 1622 N ALA A 109 -18.738 20.847 -10.045 1.00 0.00 N ATOM 1623 CA ALA A 109 -19.190 21.221 -11.379 1.00 0.00 C ATOM 1624 C ALA A 109 -19.244 22.737 -11.536 1.00 0.00 C ATOM 1625 O ALA A 109 -19.301 23.471 -10.549 1.00 0.00 O ATOM 1626 CB ALA A 109 -20.555 20.610 -11.663 1.00 0.00 C ATOM 0 H ALA A 109 -18.666 21.626 -9.391 1.00 0.00 H new ATOM 0 HA ALA A 109 -18.472 20.833 -12.102 1.00 0.00 H new ATOM 0 HB1 ALA A 109 -20.881 20.897 -12.663 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -20.487 19.524 -11.601 1.00 0.00 H new ATOM 0 HB3 ALA A 109 -21.275 20.971 -10.929 1.00 0.00 H new ATOM 1632 N ARG A 110 -19.223 23.198 -12.782 1.00 0.00 N ATOM 1633 CA ARG A 110 -19.269 24.628 -13.068 1.00 0.00 C ATOM 1634 C ARG A 110 -20.334 24.940 -14.115 1.00 0.00 C ATOM 1635 O ARG A 110 -21.342 25.581 -13.818 1.00 0.00 O ATOM 1636 CB ARG A 110 -17.901 25.117 -13.552 1.00 0.00 C ATOM 1637 CG ARG A 110 -17.475 26.440 -12.937 1.00 0.00 C ATOM 1638 CD ARG A 110 -18.524 27.521 -13.153 1.00 0.00 C ATOM 1639 NE ARG A 110 -19.336 27.740 -11.957 1.00 0.00 N ATOM 1640 CZ ARG A 110 -20.520 28.347 -11.967 1.00 0.00 C ATOM 1641 NH1 ARG A 110 -21.036 28.794 -13.106 1.00 0.00 N ATOM 1642 NH2 ARG A 110 -21.193 28.506 -10.835 1.00 0.00 N ATOM 0 H ARG A 110 -19.174 22.603 -13.609 1.00 0.00 H new ATOM 0 HA ARG A 110 -19.528 25.149 -12.147 1.00 0.00 H new ATOM 0 HB2 ARG A 110 -17.151 24.360 -13.321 1.00 0.00 H new ATOM 0 HB3 ARG A 110 -17.925 25.221 -14.637 1.00 0.00 H new ATOM 0 HG2 ARG A 110 -17.303 26.307 -11.869 1.00 0.00 H new ATOM 0 HG3 ARG A 110 -16.529 26.758 -13.375 1.00 0.00 H new ATOM 0 HD2 ARG A 110 -18.033 28.453 -13.434 1.00 0.00 H new ATOM 0 HD3 ARG A 110 -19.170 27.239 -13.984 1.00 0.00 H new ATOM 0 HE ARG A 110 -18.974 27.408 -11.063 1.00 0.00 H new ATOM 0 HH11 ARG A 110 -20.524 28.673 -13.980 1.00 0.00 H new ATOM 0 HH12 ARG A 110 -21.944 29.258 -13.107 1.00 0.00 H new ATOM 0 HH21 ARG A 110 -20.803 28.163 -9.957 1.00 0.00 H new ATOM 0 HH22 ARG A 110 -22.101 28.971 -10.842 1.00 0.00 H new ATOM 1656 N THR A 111 -20.104 24.480 -15.341 1.00 0.00 N ATOM 1657 CA THR A 111 -21.043 24.710 -16.432 1.00 0.00 C ATOM 1658 C THR A 111 -21.928 23.488 -16.652 1.00 0.00 C ATOM 1659 O THR A 111 -21.809 22.487 -15.945 1.00 0.00 O ATOM 1660 CB THR A 111 -20.290 25.047 -17.720 1.00 0.00 C ATOM 1661 OG1 THR A 111 -19.013 24.433 -17.730 1.00 0.00 O ATOM 1662 CG2 THR A 111 -20.087 26.533 -17.924 1.00 0.00 C ATOM 0 H THR A 111 -19.275 23.946 -15.603 1.00 0.00 H new ATOM 0 HA THR A 111 -21.678 25.553 -16.160 1.00 0.00 H new ATOM 0 HB THR A 111 -20.916 24.669 -18.528 1.00 0.00 H new ATOM 0 HG1 THR A 111 -18.548 24.659 -18.562 1.00 0.00 H new ATOM 0 HG21 THR A 111 -19.547 26.702 -18.856 1.00 0.00 H new ATOM 0 HG22 THR A 111 -21.056 27.029 -17.971 1.00 0.00 H new ATOM 0 HG23 THR A 111 -19.512 26.939 -17.092 1.00 0.00 H new ATOM 1670 N THR A 112 -22.817 23.575 -17.637 1.00 0.00 N ATOM 1671 CA THR A 112 -23.721 22.475 -17.949 1.00 0.00 C ATOM 1672 C THR A 112 -23.375 21.850 -19.297 1.00 0.00 C ATOM 1673 O THR A 112 -23.329 20.628 -19.432 1.00 0.00 O ATOM 1674 CB THR A 112 -25.170 22.966 -17.958 1.00 0.00 C ATOM 1675 OG1 THR A 112 -25.318 24.106 -17.130 1.00 0.00 O ATOM 1676 CG2 THR A 112 -26.158 21.923 -17.483 1.00 0.00 C ATOM 0 H THR A 112 -22.930 24.396 -18.232 1.00 0.00 H new ATOM 0 HA THR A 112 -23.607 21.714 -17.177 1.00 0.00 H new ATOM 0 HB THR A 112 -25.388 23.203 -18.999 1.00 0.00 H new ATOM 0 HG1 THR A 112 -26.251 24.406 -17.150 1.00 0.00 H new ATOM 0 HG21 THR A 112 -27.166 22.336 -17.514 1.00 0.00 H new ATOM 0 HG22 THR A 112 -26.104 21.049 -18.131 1.00 0.00 H new ATOM 0 HG23 THR A 112 -25.917 21.632 -16.461 1.00 0.00 H new ATOM 1684 N VAL A 113 -23.131 22.698 -20.292 1.00 0.00 N ATOM 1685 CA VAL A 113 -22.788 22.229 -21.630 1.00 0.00 C ATOM 1686 C VAL A 113 -22.546 23.399 -22.581 1.00 0.00 C ATOM 1687 O VAL A 113 -21.663 23.343 -23.436 1.00 0.00 O ATOM 1688 CB VAL A 113 -23.896 21.327 -22.212 1.00 0.00 C ATOM 1689 CG1 VAL A 113 -25.200 22.096 -22.346 1.00 0.00 C ATOM 1690 CG2 VAL A 113 -23.467 20.749 -23.552 1.00 0.00 C ATOM 0 H VAL A 113 -23.165 23.713 -20.197 1.00 0.00 H new ATOM 0 HA VAL A 113 -21.870 21.648 -21.534 1.00 0.00 H new ATOM 0 HB VAL A 113 -24.062 20.499 -21.523 1.00 0.00 H new ATOM 0 HG11 VAL A 113 -25.968 21.441 -22.758 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -25.515 22.452 -21.365 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -25.054 22.947 -23.011 1.00 0.00 H new ATOM 0 HG21 VAL A 113 -24.262 20.116 -23.946 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -23.269 21.561 -24.252 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -22.562 20.156 -23.419 1.00 0.00 H new ATOM 1700 N ASP A 114 -23.338 24.456 -22.425 1.00 0.00 N ATOM 1701 CA ASP A 114 -23.213 25.639 -23.270 1.00 0.00 C ATOM 1702 C ASP A 114 -23.524 25.301 -24.724 1.00 0.00 C ATOM 1703 O ASP A 114 -22.717 25.555 -25.620 1.00 0.00 O ATOM 1704 CB ASP A 114 -21.804 26.228 -23.156 1.00 0.00 C ATOM 1705 CG ASP A 114 -21.698 27.263 -22.054 1.00 0.00 C ATOM 1706 OD1 ASP A 114 -22.010 28.444 -22.315 1.00 0.00 O ATOM 1707 OD2 ASP A 114 -21.300 26.892 -20.929 1.00 0.00 O ATOM 0 H ASP A 114 -24.073 24.517 -21.721 1.00 0.00 H new ATOM 0 HA ASP A 114 -23.935 26.380 -22.927 1.00 0.00 H new ATOM 0 HB2 ASP A 114 -21.092 25.425 -22.966 1.00 0.00 H new ATOM 0 HB3 ASP A 114 -21.525 26.683 -24.106 1.00 0.00 H new ATOM 1712 N GLU A 115 -24.702 24.728 -24.954 1.00 0.00 N ATOM 1713 CA GLU A 115 -25.121 24.356 -26.300 1.00 0.00 C ATOM 1714 C GLU A 115 -26.613 24.034 -26.336 1.00 0.00 C ATOM 1715 O GLU A 115 -27.006 22.878 -26.490 1.00 0.00 O ATOM 1716 CB GLU A 115 -24.315 23.154 -26.795 1.00 0.00 C ATOM 1717 CG GLU A 115 -24.101 23.143 -28.300 1.00 0.00 C ATOM 1718 CD GLU A 115 -24.634 21.885 -28.957 1.00 0.00 C ATOM 1719 OE1 GLU A 115 -24.185 20.782 -28.582 1.00 0.00 O ATOM 1720 OE2 GLU A 115 -25.501 22.003 -29.849 1.00 0.00 O ATOM 0 H GLU A 115 -25.382 24.512 -24.226 1.00 0.00 H new ATOM 0 HA GLU A 115 -24.935 25.204 -26.959 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -23.345 23.148 -26.298 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -24.828 22.238 -26.503 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -24.590 24.013 -28.739 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -23.036 23.236 -28.512 1.00 0.00 H new ATOM 1727 N THR A 116 -27.439 25.066 -26.194 1.00 0.00 N ATOM 1728 CA THR A 116 -28.887 24.894 -26.212 1.00 0.00 C ATOM 1729 C THR A 116 -29.524 25.751 -27.300 1.00 0.00 C ATOM 1730 O THR A 116 -30.076 26.817 -27.023 1.00 0.00 O ATOM 1731 CB THR A 116 -29.482 25.255 -24.848 1.00 0.00 C ATOM 1732 OG1 THR A 116 -28.556 24.985 -23.810 1.00 0.00 O ATOM 1733 CG2 THR A 116 -30.757 24.504 -24.534 1.00 0.00 C ATOM 0 H THR A 116 -27.130 26.030 -26.065 1.00 0.00 H new ATOM 0 HA THR A 116 -29.100 23.847 -26.428 1.00 0.00 H new ATOM 0 HB THR A 116 -29.712 26.319 -24.905 1.00 0.00 H new ATOM 0 HG1 THR A 116 -28.954 25.224 -22.947 1.00 0.00 H new ATOM 0 HG21 THR A 116 -31.126 24.807 -23.554 1.00 0.00 H new ATOM 0 HG22 THR A 116 -31.509 24.731 -25.290 1.00 0.00 H new ATOM 0 HG23 THR A 116 -30.557 23.433 -24.531 1.00 0.00 H new ATOM 1741 N LYS A 117 -29.445 25.279 -28.540 1.00 0.00 N ATOM 1742 CA LYS A 117 -30.015 26.001 -29.671 1.00 0.00 C ATOM 1743 C LYS A 117 -31.497 25.681 -29.831 1.00 0.00 C ATOM 1744 O LYS A 117 -31.863 24.659 -30.411 1.00 0.00 O ATOM 1745 CB LYS A 117 -29.263 25.651 -30.957 1.00 0.00 C ATOM 1746 CG LYS A 117 -29.466 26.662 -32.074 1.00 0.00 C ATOM 1747 CD LYS A 117 -28.499 27.829 -31.952 1.00 0.00 C ATOM 1748 CE LYS A 117 -27.114 27.460 -32.460 1.00 0.00 C ATOM 1749 NZ LYS A 117 -26.983 27.685 -33.926 1.00 0.00 N ATOM 0 H LYS A 117 -28.992 24.399 -28.787 1.00 0.00 H new ATOM 0 HA LYS A 117 -29.912 27.069 -29.477 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -28.198 25.575 -30.736 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -29.588 24.670 -31.303 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -29.328 26.173 -33.038 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -30.491 27.033 -32.049 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -28.880 28.680 -32.517 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -28.434 28.142 -30.910 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -26.365 28.051 -31.933 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -26.911 26.413 -32.234 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -26.025 27.422 -34.233 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -27.681 27.102 -34.430 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -27.151 28.689 -34.140 1.00 0.00 H new ATOM 1763 N TRP A 118 -32.346 26.561 -29.311 1.00 0.00 N ATOM 1764 CA TRP A 118 -33.790 26.372 -29.395 1.00 0.00 C ATOM 1765 C TRP A 118 -34.527 27.685 -29.148 1.00 0.00 C ATOM 1766 O TRP A 118 -34.887 28.001 -28.015 1.00 0.00 O ATOM 1767 CB TRP A 118 -34.246 25.320 -28.382 1.00 0.00 C ATOM 1768 CG TRP A 118 -35.389 24.481 -28.868 1.00 0.00 C ATOM 1769 CD1 TRP A 118 -35.658 24.131 -30.159 1.00 0.00 C ATOM 1770 CD2 TRP A 118 -36.417 23.888 -28.067 1.00 0.00 C ATOM 1771 NE1 TRP A 118 -36.792 23.355 -30.211 1.00 0.00 N ATOM 1772 CE2 TRP A 118 -37.276 23.192 -28.939 1.00 0.00 C ATOM 1773 CE3 TRP A 118 -36.695 23.877 -26.697 1.00 0.00 C ATOM 1774 CZ2 TRP A 118 -38.391 22.492 -28.486 1.00 0.00 C ATOM 1775 CZ3 TRP A 118 -37.804 23.183 -26.248 1.00 0.00 C ATOM 1776 CH2 TRP A 118 -38.639 22.498 -27.140 1.00 0.00 C ATOM 0 H TRP A 118 -32.059 27.412 -28.827 1.00 0.00 H new ATOM 0 HA TRP A 118 -34.028 26.027 -30.401 1.00 0.00 H new ATOM 0 HB2 TRP A 118 -33.405 24.670 -28.141 1.00 0.00 H new ATOM 0 HB3 TRP A 118 -34.538 25.819 -27.458 1.00 0.00 H new ATOM 0 HD1 TRP A 118 -35.067 24.421 -31.015 1.00 0.00 H new ATOM 0 HE1 TRP A 118 -37.205 22.964 -31.058 1.00 0.00 H new ATOM 0 HE3 TRP A 118 -36.056 24.401 -26.002 1.00 0.00 H new ATOM 0 HZ2 TRP A 118 -39.037 21.964 -29.172 1.00 0.00 H new ATOM 0 HZ3 TRP A 118 -38.030 23.169 -25.192 1.00 0.00 H new ATOM 0 HH2 TRP A 118 -39.496 21.964 -26.758 1.00 0.00 H new ATOM 1787 N ILE A 119 -34.746 28.445 -30.216 1.00 0.00 N ATOM 1788 CA ILE A 119 -35.437 29.725 -30.114 1.00 0.00 C ATOM 1789 C ILE A 119 -36.835 29.644 -30.720 1.00 0.00 C ATOM 1790 O ILE A 119 -37.354 30.629 -31.245 1.00 0.00 O ATOM 1791 CB ILE A 119 -34.650 30.848 -30.816 1.00 0.00 C ATOM 1792 CG1 ILE A 119 -33.177 30.803 -30.407 1.00 0.00 C ATOM 1793 CG2 ILE A 119 -35.255 32.204 -30.486 1.00 0.00 C ATOM 1794 CD1 ILE A 119 -32.280 31.654 -31.279 1.00 0.00 C ATOM 0 H ILE A 119 -34.455 28.197 -31.162 1.00 0.00 H new ATOM 0 HA ILE A 119 -35.516 29.957 -29.052 1.00 0.00 H new ATOM 0 HB ILE A 119 -34.712 30.695 -31.893 1.00 0.00 H new ATOM 0 HG12 ILE A 119 -33.085 31.135 -29.373 1.00 0.00 H new ATOM 0 HG13 ILE A 119 -32.830 29.770 -30.442 1.00 0.00 H new ATOM 0 HG21 ILE A 119 -34.688 32.987 -30.989 1.00 0.00 H new ATOM 0 HG22 ILE A 119 -36.291 32.232 -30.823 1.00 0.00 H new ATOM 0 HG23 ILE A 119 -35.220 32.366 -29.409 1.00 0.00 H new ATOM 0 HD11 ILE A 119 -31.251 31.573 -30.930 1.00 0.00 H new ATOM 0 HD12 ILE A 119 -32.342 31.308 -32.311 1.00 0.00 H new ATOM 0 HD13 ILE A 119 -32.601 32.694 -31.225 1.00 0.00 H new ATOM 1806 N ALA A 120 -37.442 28.463 -30.643 1.00 0.00 N ATOM 1807 CA ALA A 120 -38.779 28.255 -31.183 1.00 0.00 C ATOM 1808 C ALA A 120 -39.427 27.014 -30.578 1.00 0.00 C ATOM 1809 O ALA A 120 -38.857 26.370 -29.699 1.00 0.00 O ATOM 1810 CB ALA A 120 -38.725 28.139 -32.698 1.00 0.00 C ATOM 0 H ALA A 120 -37.028 27.637 -30.212 1.00 0.00 H new ATOM 0 HA ALA A 120 -39.389 29.118 -30.918 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -39.731 27.984 -33.087 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -38.311 29.055 -33.119 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -38.094 27.295 -32.976 1.00 0.00 H new ATOM 1816 N SER A 121 -40.624 26.685 -31.055 1.00 0.00 N ATOM 1817 CA SER A 121 -41.350 25.522 -30.561 1.00 0.00 C ATOM 1818 C SER A 121 -41.615 24.525 -31.683 1.00 0.00 C ATOM 1819 O SER A 121 -42.734 24.424 -32.188 1.00 0.00 O ATOM 1820 CB SER A 121 -42.672 25.952 -29.922 1.00 0.00 C ATOM 1821 OG SER A 121 -42.481 27.043 -29.037 1.00 0.00 O ATOM 0 H SER A 121 -41.111 27.208 -31.783 1.00 0.00 H new ATOM 0 HA SER A 121 -40.731 25.035 -29.807 1.00 0.00 H new ATOM 0 HB2 SER A 121 -43.382 26.232 -30.701 1.00 0.00 H new ATOM 0 HB3 SER A 121 -43.108 25.112 -29.380 1.00 0.00 H new ATOM 0 HG SER A 121 -43.341 27.299 -28.643 1.00 0.00 H new ATOM 1827 N SER A 122 -40.579 23.787 -32.070 1.00 0.00 N ATOM 1828 CA SER A 122 -40.700 22.796 -33.132 1.00 0.00 C ATOM 1829 C SER A 122 -40.801 21.390 -32.552 1.00 0.00 C ATOM 1830 O SER A 122 -40.031 21.016 -31.666 1.00 0.00 O ATOM 1831 CB SER A 122 -39.502 22.883 -34.081 1.00 0.00 C ATOM 1832 OG SER A 122 -38.320 22.413 -33.455 1.00 0.00 O ATOM 0 H SER A 122 -39.646 23.857 -31.663 1.00 0.00 H new ATOM 0 HA SER A 122 -41.612 23.008 -33.690 1.00 0.00 H new ATOM 0 HB2 SER A 122 -39.701 22.296 -34.977 1.00 0.00 H new ATOM 0 HB3 SER A 122 -39.362 23.915 -34.401 1.00 0.00 H new ATOM 0 HG SER A 122 -37.570 22.477 -34.082 1.00 0.00 H new ATOM 1838 N SER A 123 -41.754 20.613 -33.055 1.00 0.00 N ATOM 1839 CA SER A 123 -41.954 19.247 -32.582 1.00 0.00 C ATOM 1840 C SER A 123 -42.936 18.499 -33.477 1.00 0.00 C ATOM 1841 O SER A 123 -43.534 19.080 -34.382 1.00 0.00 O ATOM 1842 CB SER A 123 -42.463 19.254 -31.140 1.00 0.00 C ATOM 1843 OG SER A 123 -41.815 18.261 -30.365 1.00 0.00 O ATOM 0 H SER A 123 -42.399 20.905 -33.789 1.00 0.00 H new ATOM 0 HA SER A 123 -40.994 18.732 -32.618 1.00 0.00 H new ATOM 0 HB2 SER A 123 -42.293 20.235 -30.696 1.00 0.00 H new ATOM 0 HB3 SER A 123 -43.539 19.082 -31.130 1.00 0.00 H new ATOM 0 HG SER A 123 -42.157 18.288 -29.447 1.00 0.00 H new ATOM 1849 N GLY A 124 -43.097 17.205 -33.217 1.00 0.00 N ATOM 1850 CA GLY A 124 -44.007 16.396 -34.005 1.00 0.00 C ATOM 1851 C GLY A 124 -43.350 15.135 -34.535 1.00 0.00 C ATOM 1852 O GLY A 124 -42.153 15.131 -34.821 1.00 0.00 O ATOM 0 H GLY A 124 -42.612 16.702 -32.473 1.00 0.00 H new ATOM 0 HA2 GLY A 124 -44.868 16.125 -33.395 1.00 0.00 H new ATOM 0 HA3 GLY A 124 -44.382 16.986 -34.841 1.00 0.00 H new ATOM 1856 N PRO A 125 -44.114 14.038 -34.680 1.00 0.00 N ATOM 1857 CA PRO A 125 -43.583 12.767 -35.182 1.00 0.00 C ATOM 1858 C PRO A 125 -43.266 12.816 -36.675 1.00 0.00 C ATOM 1859 O PRO A 125 -42.548 11.961 -37.193 1.00 0.00 O ATOM 1860 CB PRO A 125 -44.715 11.777 -34.910 1.00 0.00 C ATOM 1861 CG PRO A 125 -45.951 12.607 -34.915 1.00 0.00 C ATOM 1862 CD PRO A 125 -45.554 13.950 -34.364 1.00 0.00 C ATOM 0 HA PRO A 125 -42.641 12.503 -34.701 1.00 0.00 H new ATOM 0 HB2 PRO A 125 -44.755 11.002 -35.675 1.00 0.00 H new ATOM 0 HB3 PRO A 125 -44.580 11.274 -33.953 1.00 0.00 H new ATOM 0 HG2 PRO A 125 -46.352 12.703 -35.924 1.00 0.00 H new ATOM 0 HG3 PRO A 125 -46.730 12.150 -34.305 1.00 0.00 H new ATOM 0 HD2 PRO A 125 -46.118 14.758 -34.830 1.00 0.00 H new ATOM 0 HD3 PRO A 125 -45.734 14.013 -33.291 1.00 0.00 H new ATOM 1870 N SER A 126 -43.805 13.819 -37.363 1.00 0.00 N ATOM 1871 CA SER A 126 -43.576 13.971 -38.795 1.00 0.00 C ATOM 1872 C SER A 126 -43.515 15.444 -39.189 1.00 0.00 C ATOM 1873 O SER A 126 -42.637 15.857 -39.947 1.00 0.00 O ATOM 1874 CB SER A 126 -44.679 13.264 -39.585 1.00 0.00 C ATOM 1875 OG SER A 126 -44.144 12.566 -40.696 1.00 0.00 O ATOM 0 H SER A 126 -44.402 14.537 -36.952 1.00 0.00 H new ATOM 0 HA SER A 126 -42.616 13.514 -39.033 1.00 0.00 H new ATOM 0 HB2 SER A 126 -45.207 12.567 -38.934 1.00 0.00 H new ATOM 0 HB3 SER A 126 -45.410 13.996 -39.929 1.00 0.00 H new ATOM 0 HG SER A 126 -44.869 12.122 -41.183 1.00 0.00 H new ATOM 1881 N SER A 127 -44.453 16.232 -38.673 1.00 0.00 N ATOM 1882 CA SER A 127 -44.507 17.659 -38.973 1.00 0.00 C ATOM 1883 C SER A 127 -44.855 17.892 -40.439 1.00 0.00 C ATOM 1884 O SER A 127 -44.032 17.665 -41.326 1.00 0.00 O ATOM 1885 CB SER A 127 -43.171 18.328 -38.640 1.00 0.00 C ATOM 1886 OG SER A 127 -42.421 17.545 -37.728 1.00 0.00 O ATOM 0 H SER A 127 -45.187 15.906 -38.044 1.00 0.00 H new ATOM 0 HA SER A 127 -45.288 18.104 -38.356 1.00 0.00 H new ATOM 0 HB2 SER A 127 -42.597 18.476 -39.555 1.00 0.00 H new ATOM 0 HB3 SER A 127 -43.351 19.315 -38.214 1.00 0.00 H new ATOM 0 HG SER A 127 -41.572 17.994 -37.533 1.00 0.00 H new ATOM 1892 N GLY A 128 -46.079 18.347 -40.687 1.00 0.00 N ATOM 1893 CA GLY A 128 -46.515 18.603 -42.048 1.00 0.00 C ATOM 1894 C GLY A 128 -46.658 20.083 -42.342 1.00 0.00 C ATOM 1895 O GLY A 128 -47.745 20.639 -42.078 1.00 0.00 O ATOM 1896 OXT GLY A 128 -45.683 20.687 -42.837 1.00 0.00 O ATOM 0 H GLY A 128 -46.777 18.543 -39.970 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -45.800 18.165 -42.744 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -47.471 18.108 -42.219 1.00 0.00 H new TER 1900 GLY A 128