USER MOD reduce.3.24.130724 H: found=0, std=0, add=913, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 911 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 115 ASN : amide:sc= -0.0417 X(o=-0.042,f=-0.084) USER MOD Set 1.2: A 117 TYR OH : rot 180:sc= 0 USER MOD Set 2.1: A 65 LYS NZ :NH3+ -171:sc= 0.172 (180deg=0) USER MOD Set 2.2: A 110 THR OG1 : rot 90:sc= -0.812 USER MOD Set 3.1: A 106 THR OG1 : rot 158:sc= -0.92 USER MOD Set 3.2: A 108 ASN : amide:sc= -3.17 X(o=-4.1,f=-4.1!) USER MOD Set 4.1: A 99 SER OG : rot 180:sc= 0 USER MOD Set 4.2: A 118 THR OG1 : rot 180:sc= 0 USER MOD Set 5.1: A 41 ASN : amide:sc= -4.89 X(o=-5.2,f=-5.3!) USER MOD Set 5.2: A 44 SER OG : rot -170:sc= -0.276 USER MOD Single : A 1 GLY N :NH3+ -136:sc= 0.0658 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 3:sc= 1.13 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 ASN : amide:sc= -1.26 X(o=-1.3,f=-1.3) USER MOD Single : A 10 TYR OH : rot 180:sc= 0 USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 16 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 THR OG1 : rot 180:sc= 0 USER MOD Single : A 23 THR OG1 : rot 50:sc= 1.12 USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 33 GLN : amide:sc= -0.0306 X(o=-0.031,f=0) USER MOD Single : A 34 ASN : amide:sc= -0.645 X(o=-0.65,f=-0.43) USER MOD Single : A 36 SER OG : rot 180:sc= -0.115 USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 56 THR OG1 : rot 100:sc= -0.214 USER MOD Single : A 57 GLN : amide:sc= -3.76 K(o=-3.8,f=-9.1!) USER MOD Single : A 58 ASN :FLIP amide:sc= -1.48! F(o=-2.1,f=-1.5!) USER MOD Single : A 62 THR OG1 : rot 180:sc= -0.0905 USER MOD Single : A 64 TYR OH : rot -110:sc= -1.11 USER MOD Single : A 68 HIS :FLIP no HD1:sc= -0.378 F(o=-2.1,f=-0.38) USER MOD Single : A 70 LYS NZ :NH3+ 160:sc= 0 (180deg=-0.0698) USER MOD Single : A 71 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 THR OG1 : rot 180:sc= -0.463 USER MOD Single : A 77 MET CE :methyl 146:sc= -0.243 (180deg=-0.931) USER MOD Single : A 79 THR OG1 : rot 180:sc= 0 USER MOD Single : A 83 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 84 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 87 TYR OH : rot 180:sc= 0 USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 97 GLN :FLIP amide:sc= -2.13! C(o=-3.2!,f=-2.1!) USER MOD Single : A 98 TYR OH : rot 15:sc= 0.139 USER MOD Single : A 101 GLN : amide:sc= -1.01 K(o=-1,f=-6.1!) USER MOD Single : A 103 SER OG : rot -57:sc= -0.577 USER MOD Single : A 105 MET CE :methyl -149:sc= -0.966 (180deg=-2.03) USER MOD Single : A 114 SER OG : rot -155:sc= 0.263 USER MOD Single : A 121 THR OG1 : rot -129:sc= 0.00407 USER MOD Single : A 124 ASN : amide:sc= -0.106 K(o=-0.11,f=-0.86) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 22.452 -1.575 88.125 1.00 0.00 N ATOM 2 CA GLY A 1 21.659 -1.511 86.912 1.00 0.00 C ATOM 3 C GLY A 1 22.339 -0.714 85.816 1.00 0.00 C ATOM 4 O GLY A 1 23.536 -0.436 85.893 1.00 0.00 O ATOM 0 H1 GLY A 1 22.440 -2.546 88.496 1.00 0.00 H new ATOM 0 H2 GLY A 1 23.432 -1.296 87.914 1.00 0.00 H new ATOM 0 H3 GLY A 1 22.053 -0.928 88.835 1.00 0.00 H new ATOM 0 HA2 GLY A 1 21.465 -2.522 86.555 1.00 0.00 H new ATOM 0 HA3 GLY A 1 20.692 -1.062 87.137 1.00 0.00 H new ATOM 8 N SER A 2 21.575 -0.346 84.793 1.00 0.00 N ATOM 9 CA SER A 2 22.112 0.420 83.674 1.00 0.00 C ATOM 10 C SER A 2 20.988 0.959 82.795 1.00 0.00 C ATOM 11 O SER A 2 19.858 0.473 82.846 1.00 0.00 O ATOM 12 CB SER A 2 23.054 -0.450 82.839 1.00 0.00 C ATOM 13 OG SER A 2 22.406 -1.632 82.404 1.00 0.00 O ATOM 0 H SER A 2 20.582 -0.566 84.716 1.00 0.00 H new ATOM 0 HA SER A 2 22.670 1.264 84.079 1.00 0.00 H new ATOM 0 HB2 SER A 2 23.405 0.115 81.975 1.00 0.00 H new ATOM 0 HB3 SER A 2 23.933 -0.710 83.429 1.00 0.00 H new ATOM 0 HG SER A 2 23.029 -2.169 81.871 1.00 0.00 H new ATOM 19 N SER A 3 21.306 1.967 81.990 1.00 0.00 N ATOM 20 CA SER A 3 20.323 2.577 81.102 1.00 0.00 C ATOM 21 C SER A 3 21.010 3.345 79.976 1.00 0.00 C ATOM 22 O SER A 3 22.221 3.559 80.005 1.00 0.00 O ATOM 23 CB SER A 3 19.406 3.515 81.889 1.00 0.00 C ATOM 24 OG SER A 3 18.519 2.784 82.717 1.00 0.00 O ATOM 0 H SER A 3 22.237 2.379 81.934 1.00 0.00 H new ATOM 0 HA SER A 3 19.724 1.780 80.662 1.00 0.00 H new ATOM 0 HB2 SER A 3 20.007 4.188 82.500 1.00 0.00 H new ATOM 0 HB3 SER A 3 18.835 4.135 81.198 1.00 0.00 H new ATOM 0 HG SER A 3 18.720 1.827 82.647 1.00 0.00 H new ATOM 30 N GLY A 4 20.226 3.757 78.985 1.00 0.00 N ATOM 31 CA GLY A 4 20.774 4.496 77.863 1.00 0.00 C ATOM 32 C GLY A 4 19.748 5.395 77.204 1.00 0.00 C ATOM 33 O GLY A 4 18.649 5.582 77.726 1.00 0.00 O ATOM 0 H GLY A 4 19.220 3.592 78.939 1.00 0.00 H new ATOM 0 HA2 GLY A 4 21.615 5.099 78.205 1.00 0.00 H new ATOM 0 HA3 GLY A 4 21.165 3.794 77.126 1.00 0.00 H new ATOM 37 N SER A 5 20.107 5.956 76.053 1.00 0.00 N ATOM 38 CA SER A 5 19.211 6.846 75.324 1.00 0.00 C ATOM 39 C SER A 5 19.675 7.022 73.881 1.00 0.00 C ATOM 40 O SER A 5 20.867 6.937 73.586 1.00 0.00 O ATOM 41 CB SER A 5 19.136 8.208 76.017 1.00 0.00 C ATOM 42 OG SER A 5 18.081 8.993 75.487 1.00 0.00 O ATOM 0 H SER A 5 21.012 5.810 75.606 1.00 0.00 H new ATOM 0 HA SER A 5 18.219 6.395 75.316 1.00 0.00 H new ATOM 0 HB2 SER A 5 18.986 8.067 77.087 1.00 0.00 H new ATOM 0 HB3 SER A 5 20.082 8.735 75.894 1.00 0.00 H new ATOM 0 HG SER A 5 18.053 9.858 75.948 1.00 0.00 H new ATOM 48 N SER A 6 18.723 7.267 72.986 1.00 0.00 N ATOM 49 CA SER A 6 19.032 7.451 71.573 1.00 0.00 C ATOM 50 C SER A 6 18.250 8.627 70.995 1.00 0.00 C ATOM 51 O SER A 6 17.463 9.266 71.691 1.00 0.00 O ATOM 52 CB SER A 6 18.713 6.177 70.790 1.00 0.00 C ATOM 53 OG SER A 6 19.683 5.173 71.031 1.00 0.00 O ATOM 0 H SER A 6 17.732 7.343 73.214 1.00 0.00 H new ATOM 0 HA SER A 6 20.097 7.666 71.484 1.00 0.00 H new ATOM 0 HB2 SER A 6 17.727 5.810 71.074 1.00 0.00 H new ATOM 0 HB3 SER A 6 18.675 6.402 69.724 1.00 0.00 H new ATOM 0 HG SER A 6 19.455 4.368 70.520 1.00 0.00 H new ATOM 59 N GLY A 7 18.475 8.906 69.714 1.00 0.00 N ATOM 60 CA GLY A 7 17.785 10.004 69.062 1.00 0.00 C ATOM 61 C GLY A 7 17.382 9.672 67.639 1.00 0.00 C ATOM 62 O GLY A 7 17.466 8.520 67.216 1.00 0.00 O ATOM 0 H GLY A 7 19.122 8.391 69.117 1.00 0.00 H new ATOM 0 HA2 GLY A 7 16.896 10.263 69.637 1.00 0.00 H new ATOM 0 HA3 GLY A 7 18.430 10.883 69.058 1.00 0.00 H new ATOM 66 N ASN A 8 16.943 10.685 66.899 1.00 0.00 N ATOM 67 CA ASN A 8 16.523 10.494 65.515 1.00 0.00 C ATOM 68 C ASN A 8 16.543 11.816 64.754 1.00 0.00 C ATOM 69 O ASN A 8 16.664 12.886 65.351 1.00 0.00 O ATOM 70 CB ASN A 8 15.120 9.885 65.465 1.00 0.00 C ATOM 71 CG ASN A 8 14.696 9.527 64.054 1.00 0.00 C ATOM 72 OD1 ASN A 8 13.740 10.088 63.520 1.00 0.00 O ATOM 73 ND2 ASN A 8 15.408 8.587 63.443 1.00 0.00 N ATOM 0 H ASN A 8 16.869 11.646 67.234 1.00 0.00 H new ATOM 0 HA ASN A 8 17.226 9.810 65.039 1.00 0.00 H new ATOM 0 HB2 ASN A 8 15.092 8.991 66.088 1.00 0.00 H new ATOM 0 HB3 ASN A 8 14.405 10.591 65.888 1.00 0.00 H new ATOM 0 HD21 ASN A 8 15.170 8.304 62.493 1.00 0.00 H new ATOM 0 HD22 ASN A 8 16.193 8.148 63.924 1.00 0.00 H new ATOM 80 N ARG A 9 16.422 11.734 63.433 1.00 0.00 N ATOM 81 CA ARG A 9 16.426 12.924 62.590 1.00 0.00 C ATOM 82 C ARG A 9 15.674 12.669 61.287 1.00 0.00 C ATOM 83 O ARG A 9 15.671 11.553 60.768 1.00 0.00 O ATOM 84 CB ARG A 9 17.862 13.354 62.287 1.00 0.00 C ATOM 85 CG ARG A 9 18.002 14.836 61.976 1.00 0.00 C ATOM 86 CD ARG A 9 17.951 15.677 63.242 1.00 0.00 C ATOM 87 NE ARG A 9 16.580 15.998 63.631 1.00 0.00 N ATOM 88 CZ ARG A 9 16.257 16.559 64.791 1.00 0.00 C ATOM 89 NH1 ARG A 9 17.202 16.858 65.672 1.00 0.00 N ATOM 90 NH2 ARG A 9 14.987 16.821 65.073 1.00 0.00 N ATOM 0 H ARG A 9 16.320 10.856 62.923 1.00 0.00 H new ATOM 0 HA ARG A 9 15.920 13.724 63.130 1.00 0.00 H new ATOM 0 HB2 ARG A 9 18.493 13.110 63.141 1.00 0.00 H new ATOM 0 HB3 ARG A 9 18.234 12.777 61.440 1.00 0.00 H new ATOM 0 HG2 ARG A 9 18.945 15.013 61.458 1.00 0.00 H new ATOM 0 HG3 ARG A 9 17.204 15.144 61.300 1.00 0.00 H new ATOM 0 HD2 ARG A 9 18.442 15.140 64.054 1.00 0.00 H new ATOM 0 HD3 ARG A 9 18.509 16.600 63.087 1.00 0.00 H new ATOM 0 HE ARG A 9 15.829 15.779 62.976 1.00 0.00 H new ATOM 0 HH11 ARG A 9 18.179 16.657 65.460 1.00 0.00 H new ATOM 0 HH12 ARG A 9 16.952 17.289 66.562 1.00 0.00 H new ATOM 0 HH21 ARG A 9 14.257 16.592 64.399 1.00 0.00 H new ATOM 0 HH22 ARG A 9 14.741 17.252 65.964 1.00 0.00 H new ATOM 104 N TYR A 10 15.037 13.711 60.765 1.00 0.00 N ATOM 105 CA TYR A 10 14.279 13.600 59.524 1.00 0.00 C ATOM 106 C TYR A 10 14.503 14.822 58.638 1.00 0.00 C ATOM 107 O TYR A 10 14.806 15.910 59.126 1.00 0.00 O ATOM 108 CB TYR A 10 12.788 13.442 59.826 1.00 0.00 C ATOM 109 CG TYR A 10 11.909 13.522 58.598 1.00 0.00 C ATOM 110 CD1 TYR A 10 11.977 12.550 57.607 1.00 0.00 C ATOM 111 CD2 TYR A 10 11.013 14.570 58.428 1.00 0.00 C ATOM 112 CE1 TYR A 10 11.177 12.620 56.483 1.00 0.00 C ATOM 113 CE2 TYR A 10 10.208 14.647 57.307 1.00 0.00 C ATOM 114 CZ TYR A 10 10.294 13.670 56.338 1.00 0.00 C ATOM 115 OH TYR A 10 9.495 13.744 55.220 1.00 0.00 O ATOM 0 H TYR A 10 15.030 14.642 61.182 1.00 0.00 H new ATOM 0 HA TYR A 10 14.631 12.717 58.990 1.00 0.00 H new ATOM 0 HB2 TYR A 10 12.625 12.483 60.317 1.00 0.00 H new ATOM 0 HB3 TYR A 10 12.485 14.216 60.531 1.00 0.00 H new ATOM 0 HD1 TYR A 10 12.667 11.726 57.717 1.00 0.00 H new ATOM 0 HD2 TYR A 10 10.944 15.338 59.185 1.00 0.00 H new ATOM 0 HE1 TYR A 10 11.242 11.857 55.722 1.00 0.00 H new ATOM 0 HE2 TYR A 10 9.516 15.468 57.191 1.00 0.00 H new ATOM 0 HH TYR A 10 8.930 14.543 55.274 1.00 0.00 H new ATOM 125 N GLY A 11 14.349 14.633 57.331 1.00 0.00 N ATOM 126 CA GLY A 11 14.538 15.726 56.396 1.00 0.00 C ATOM 127 C GLY A 11 13.551 15.682 55.246 1.00 0.00 C ATOM 128 O GLY A 11 13.129 14.614 54.802 1.00 0.00 O ATOM 0 H GLY A 11 14.097 13.742 56.903 1.00 0.00 H new ATOM 0 HA2 GLY A 11 14.434 16.674 56.924 1.00 0.00 H new ATOM 0 HA3 GLY A 11 15.553 15.691 56.001 1.00 0.00 H new ATOM 132 N PRO A 12 13.166 16.866 54.746 1.00 0.00 N ATOM 133 CA PRO A 12 12.217 16.985 53.635 1.00 0.00 C ATOM 134 C PRO A 12 12.809 16.508 52.313 1.00 0.00 C ATOM 135 O PRO A 12 13.999 16.207 52.227 1.00 0.00 O ATOM 136 CB PRO A 12 11.923 18.486 53.579 1.00 0.00 C ATOM 137 CG PRO A 12 13.127 19.130 54.174 1.00 0.00 C ATOM 138 CD PRO A 12 13.628 18.179 55.226 1.00 0.00 C ATOM 0 HA PRO A 12 11.331 16.369 53.788 1.00 0.00 H new ATOM 0 HB2 PRO A 12 11.761 18.820 52.554 1.00 0.00 H new ATOM 0 HB3 PRO A 12 11.023 18.734 54.141 1.00 0.00 H new ATOM 0 HG2 PRO A 12 13.889 19.309 53.415 1.00 0.00 H new ATOM 0 HG3 PRO A 12 12.877 20.097 54.610 1.00 0.00 H new ATOM 0 HD2 PRO A 12 14.714 18.215 55.316 1.00 0.00 H new ATOM 0 HD3 PRO A 12 13.219 18.415 56.208 1.00 0.00 H new ATOM 146 N GLY A 13 11.970 16.443 51.283 1.00 0.00 N ATOM 147 CA GLY A 13 12.430 16.002 49.979 1.00 0.00 C ATOM 148 C GLY A 13 11.333 16.041 48.934 1.00 0.00 C ATOM 149 O GLY A 13 10.501 15.136 48.862 1.00 0.00 O ATOM 0 H GLY A 13 10.981 16.688 51.329 1.00 0.00 H new ATOM 0 HA2 GLY A 13 13.258 16.634 49.656 1.00 0.00 H new ATOM 0 HA3 GLY A 13 12.816 14.986 50.058 1.00 0.00 H new ATOM 153 N VAL A 14 11.328 17.093 48.122 1.00 0.00 N ATOM 154 CA VAL A 14 10.324 17.248 47.076 1.00 0.00 C ATOM 155 C VAL A 14 10.753 18.292 46.052 1.00 0.00 C ATOM 156 O VAL A 14 11.323 19.325 46.405 1.00 0.00 O ATOM 157 CB VAL A 14 8.958 17.651 47.664 1.00 0.00 C ATOM 158 CG1 VAL A 14 9.058 18.991 48.376 1.00 0.00 C ATOM 159 CG2 VAL A 14 7.901 17.695 46.571 1.00 0.00 C ATOM 0 H VAL A 14 12.009 17.851 48.168 1.00 0.00 H new ATOM 0 HA VAL A 14 10.228 16.280 46.584 1.00 0.00 H new ATOM 0 HB VAL A 14 8.660 16.900 48.396 1.00 0.00 H new ATOM 0 HG11 VAL A 14 8.084 19.259 48.785 1.00 0.00 H new ATOM 0 HG12 VAL A 14 9.784 18.919 49.186 1.00 0.00 H new ATOM 0 HG13 VAL A 14 9.378 19.756 47.668 1.00 0.00 H new ATOM 0 HG21 VAL A 14 6.942 17.981 47.003 1.00 0.00 H new ATOM 0 HG22 VAL A 14 8.190 18.424 45.814 1.00 0.00 H new ATOM 0 HG23 VAL A 14 7.812 16.711 46.111 1.00 0.00 H new ATOM 169 N SER A 15 10.474 18.018 44.782 1.00 0.00 N ATOM 170 CA SER A 15 10.834 18.933 43.705 1.00 0.00 C ATOM 171 C SER A 15 10.092 18.578 42.420 1.00 0.00 C ATOM 172 O SER A 15 10.061 17.418 42.007 1.00 0.00 O ATOM 173 CB SER A 15 12.344 18.899 43.462 1.00 0.00 C ATOM 174 OG SER A 15 12.769 20.036 42.730 1.00 0.00 O ATOM 0 H SER A 15 10.000 17.169 44.473 1.00 0.00 H new ATOM 0 HA SER A 15 10.544 19.940 44.005 1.00 0.00 H new ATOM 0 HB2 SER A 15 12.868 18.861 44.417 1.00 0.00 H new ATOM 0 HB3 SER A 15 12.607 17.993 42.917 1.00 0.00 H new ATOM 0 HG SER A 15 13.738 19.991 42.589 1.00 0.00 H new ATOM 180 N THR A 16 9.495 19.586 41.791 1.00 0.00 N ATOM 181 CA THR A 16 8.752 19.382 40.554 1.00 0.00 C ATOM 182 C THR A 16 9.442 20.066 39.380 1.00 0.00 C ATOM 183 O THR A 16 10.088 21.101 39.544 1.00 0.00 O ATOM 184 CB THR A 16 7.311 19.914 40.670 1.00 0.00 C ATOM 185 OG1 THR A 16 7.329 21.318 40.949 1.00 0.00 O ATOM 186 CG2 THR A 16 6.551 19.183 41.767 1.00 0.00 C ATOM 0 H THR A 16 9.512 20.552 42.118 1.00 0.00 H new ATOM 0 HA THR A 16 8.721 18.307 40.377 1.00 0.00 H new ATOM 0 HB THR A 16 6.804 19.739 39.721 1.00 0.00 H new ATOM 0 HG1 THR A 16 6.409 21.649 41.020 1.00 0.00 H new ATOM 0 HG21 THR A 16 5.536 19.576 41.830 1.00 0.00 H new ATOM 0 HG22 THR A 16 6.514 18.118 41.537 1.00 0.00 H new ATOM 0 HG23 THR A 16 7.057 19.331 42.721 1.00 0.00 H new ATOM 194 N ASP A 17 9.300 19.483 38.194 1.00 0.00 N ATOM 195 CA ASP A 17 9.908 20.039 36.991 1.00 0.00 C ATOM 196 C ASP A 17 9.235 19.488 35.738 1.00 0.00 C ATOM 197 O ASP A 17 8.868 18.314 35.684 1.00 0.00 O ATOM 198 CB ASP A 17 11.405 19.727 36.960 1.00 0.00 C ATOM 199 CG ASP A 17 12.163 20.623 36.000 1.00 0.00 C ATOM 200 OD1 ASP A 17 12.407 21.796 36.352 1.00 0.00 O ATOM 201 OD2 ASP A 17 12.512 20.152 34.898 1.00 0.00 O ATOM 0 H ASP A 17 8.769 18.626 38.041 1.00 0.00 H new ATOM 0 HA ASP A 17 9.770 21.120 37.010 1.00 0.00 H new ATOM 0 HB2 ASP A 17 11.818 19.841 37.962 1.00 0.00 H new ATOM 0 HB3 ASP A 17 11.550 18.686 36.672 1.00 0.00 H new ATOM 206 N ASP A 18 9.075 20.343 34.734 1.00 0.00 N ATOM 207 CA ASP A 18 8.446 19.941 33.481 1.00 0.00 C ATOM 208 C ASP A 18 8.537 21.058 32.445 1.00 0.00 C ATOM 209 O ASP A 18 8.276 22.222 32.749 1.00 0.00 O ATOM 210 CB ASP A 18 6.983 19.567 33.717 1.00 0.00 C ATOM 211 CG ASP A 18 6.290 19.106 32.449 1.00 0.00 C ATOM 212 OD1 ASP A 18 6.118 19.937 31.533 1.00 0.00 O ATOM 213 OD2 ASP A 18 5.920 17.916 32.374 1.00 0.00 O ATOM 0 H ASP A 18 9.372 21.318 34.763 1.00 0.00 H new ATOM 0 HA ASP A 18 8.978 19.070 33.099 1.00 0.00 H new ATOM 0 HB2 ASP A 18 6.930 18.776 34.465 1.00 0.00 H new ATOM 0 HB3 ASP A 18 6.453 20.427 34.125 1.00 0.00 H new ATOM 218 N ILE A 19 8.910 20.695 31.223 1.00 0.00 N ATOM 219 CA ILE A 19 9.036 21.666 30.143 1.00 0.00 C ATOM 220 C ILE A 19 7.927 21.487 29.111 1.00 0.00 C ATOM 221 O ILE A 19 7.442 20.377 28.890 1.00 0.00 O ATOM 222 CB ILE A 19 10.400 21.551 29.438 1.00 0.00 C ATOM 223 CG1 ILE A 19 10.573 20.154 28.839 1.00 0.00 C ATOM 224 CG2 ILE A 19 11.527 21.859 30.413 1.00 0.00 C ATOM 225 CD1 ILE A 19 11.766 20.036 27.916 1.00 0.00 C ATOM 0 H ILE A 19 9.130 19.736 30.956 1.00 0.00 H new ATOM 0 HA ILE A 19 8.953 22.654 30.596 1.00 0.00 H new ATOM 0 HB ILE A 19 10.437 22.280 28.628 1.00 0.00 H new ATOM 0 HG12 ILE A 19 10.677 19.431 29.648 1.00 0.00 H new ATOM 0 HG13 ILE A 19 9.670 19.889 28.289 1.00 0.00 H new ATOM 0 HG21 ILE A 19 12.485 21.774 29.900 1.00 0.00 H new ATOM 0 HG22 ILE A 19 11.410 22.873 30.796 1.00 0.00 H new ATOM 0 HG23 ILE A 19 11.495 21.152 31.242 1.00 0.00 H new ATOM 0 HD11 ILE A 19 11.827 19.019 27.528 1.00 0.00 H new ATOM 0 HD12 ILE A 19 11.655 20.735 27.087 1.00 0.00 H new ATOM 0 HD13 ILE A 19 12.677 20.269 28.467 1.00 0.00 H new ATOM 237 N THR A 20 7.530 22.588 28.480 1.00 0.00 N ATOM 238 CA THR A 20 6.480 22.554 27.471 1.00 0.00 C ATOM 239 C THR A 20 7.062 22.663 26.066 1.00 0.00 C ATOM 240 O THR A 20 8.007 23.416 25.832 1.00 0.00 O ATOM 241 CB THR A 20 5.461 23.690 27.681 1.00 0.00 C ATOM 242 OG1 THR A 20 6.128 24.957 27.652 1.00 0.00 O ATOM 243 CG2 THR A 20 4.733 23.526 29.007 1.00 0.00 C ATOM 0 H THR A 20 7.921 23.515 28.651 1.00 0.00 H new ATOM 0 HA THR A 20 5.972 21.595 27.578 1.00 0.00 H new ATOM 0 HB THR A 20 4.729 23.645 26.875 1.00 0.00 H new ATOM 0 HG1 THR A 20 5.474 25.674 27.784 1.00 0.00 H new ATOM 0 HG21 THR A 20 4.019 24.340 29.133 1.00 0.00 H new ATOM 0 HG22 THR A 20 4.203 22.574 29.016 1.00 0.00 H new ATOM 0 HG23 THR A 20 5.455 23.547 29.823 1.00 0.00 H new ATOM 251 N VAL A 21 6.492 21.906 25.134 1.00 0.00 N ATOM 252 CA VAL A 21 6.954 21.919 23.751 1.00 0.00 C ATOM 253 C VAL A 21 5.788 22.086 22.784 1.00 0.00 C ATOM 254 O VAL A 21 4.725 21.492 22.966 1.00 0.00 O ATOM 255 CB VAL A 21 7.715 20.626 23.402 1.00 0.00 C ATOM 256 CG1 VAL A 21 8.201 20.665 21.961 1.00 0.00 C ATOM 257 CG2 VAL A 21 8.878 20.417 24.360 1.00 0.00 C ATOM 0 H VAL A 21 5.710 21.276 25.311 1.00 0.00 H new ATOM 0 HA VAL A 21 7.630 22.768 23.651 1.00 0.00 H new ATOM 0 HB VAL A 21 7.032 19.783 23.507 1.00 0.00 H new ATOM 0 HG11 VAL A 21 8.736 19.743 21.733 1.00 0.00 H new ATOM 0 HG12 VAL A 21 7.347 20.764 21.291 1.00 0.00 H new ATOM 0 HG13 VAL A 21 8.869 21.516 21.825 1.00 0.00 H new ATOM 0 HG21 VAL A 21 9.404 19.499 24.099 1.00 0.00 H new ATOM 0 HG22 VAL A 21 9.564 21.261 24.289 1.00 0.00 H new ATOM 0 HG23 VAL A 21 8.500 20.341 25.380 1.00 0.00 H new ATOM 267 N VAL A 22 5.994 22.900 21.753 1.00 0.00 N ATOM 268 CA VAL A 22 4.960 23.145 20.754 1.00 0.00 C ATOM 269 C VAL A 22 4.953 22.053 19.690 1.00 0.00 C ATOM 270 O VAL A 22 5.072 22.332 18.497 1.00 0.00 O ATOM 271 CB VAL A 22 5.153 24.512 20.070 1.00 0.00 C ATOM 272 CG1 VAL A 22 6.417 24.511 19.224 1.00 0.00 C ATOM 273 CG2 VAL A 22 3.937 24.862 19.227 1.00 0.00 C ATOM 0 H VAL A 22 6.867 23.401 21.588 1.00 0.00 H new ATOM 0 HA VAL A 22 4.005 23.141 21.280 1.00 0.00 H new ATOM 0 HB VAL A 22 5.262 25.274 20.842 1.00 0.00 H new ATOM 0 HG11 VAL A 22 6.537 25.484 18.748 1.00 0.00 H new ATOM 0 HG12 VAL A 22 7.280 24.308 19.859 1.00 0.00 H new ATOM 0 HG13 VAL A 22 6.341 23.740 18.458 1.00 0.00 H new ATOM 0 HG21 VAL A 22 4.091 25.831 18.751 1.00 0.00 H new ATOM 0 HG22 VAL A 22 3.794 24.100 18.461 1.00 0.00 H new ATOM 0 HG23 VAL A 22 3.053 24.907 19.864 1.00 0.00 H new ATOM 283 N THR A 23 4.814 20.807 20.131 1.00 0.00 N ATOM 284 CA THR A 23 4.792 19.671 19.217 1.00 0.00 C ATOM 285 C THR A 23 3.561 19.711 18.319 1.00 0.00 C ATOM 286 O THR A 23 2.467 19.322 18.731 1.00 0.00 O ATOM 287 CB THR A 23 4.813 18.334 19.981 1.00 0.00 C ATOM 288 OG1 THR A 23 3.632 18.209 20.781 1.00 0.00 O ATOM 289 CG2 THR A 23 6.046 18.237 20.868 1.00 0.00 C ATOM 0 H THR A 23 4.715 20.558 21.115 1.00 0.00 H new ATOM 0 HA THR A 23 5.689 19.743 18.602 1.00 0.00 H new ATOM 0 HB THR A 23 4.845 17.524 19.252 1.00 0.00 H new ATOM 0 HG1 THR A 23 2.843 18.404 20.233 1.00 0.00 H new ATOM 0 HG21 THR A 23 6.039 17.284 21.398 1.00 0.00 H new ATOM 0 HG22 THR A 23 6.943 18.304 20.253 1.00 0.00 H new ATOM 0 HG23 THR A 23 6.040 19.054 21.590 1.00 0.00 H new ATOM 297 N LEU A 24 3.745 20.183 17.091 1.00 0.00 N ATOM 298 CA LEU A 24 2.648 20.273 16.134 1.00 0.00 C ATOM 299 C LEU A 24 3.149 20.062 14.709 1.00 0.00 C ATOM 300 O LEU A 24 4.204 20.570 14.330 1.00 0.00 O ATOM 301 CB LEU A 24 1.956 21.633 16.247 1.00 0.00 C ATOM 302 CG LEU A 24 0.826 21.728 17.273 1.00 0.00 C ATOM 303 CD1 LEU A 24 0.503 23.183 17.577 1.00 0.00 C ATOM 304 CD2 LEU A 24 -0.411 20.998 16.772 1.00 0.00 C ATOM 0 H LEU A 24 4.643 20.509 16.735 1.00 0.00 H new ATOM 0 HA LEU A 24 1.930 19.486 16.367 1.00 0.00 H new ATOM 0 HB2 LEU A 24 2.709 22.382 16.495 1.00 0.00 H new ATOM 0 HB3 LEU A 24 1.554 21.896 15.268 1.00 0.00 H new ATOM 0 HG LEU A 24 1.156 21.250 18.195 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -0.303 23.231 18.309 1.00 0.00 H new ATOM 0 HD12 LEU A 24 1.388 23.676 17.979 1.00 0.00 H new ATOM 0 HD13 LEU A 24 0.192 23.686 16.661 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -1.205 21.076 17.515 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -0.744 21.447 15.836 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -0.171 19.948 16.606 1.00 0.00 H new ATOM 316 N SER A 25 2.385 19.310 13.924 1.00 0.00 N ATOM 317 CA SER A 25 2.753 19.030 12.541 1.00 0.00 C ATOM 318 C SER A 25 1.511 18.877 11.668 1.00 0.00 C ATOM 319 O SER A 25 0.460 18.439 12.137 1.00 0.00 O ATOM 320 CB SER A 25 3.604 17.761 12.464 1.00 0.00 C ATOM 321 OG SER A 25 3.054 16.729 13.265 1.00 0.00 O ATOM 0 H SER A 25 1.508 18.884 14.222 1.00 0.00 H new ATOM 0 HA SER A 25 3.336 19.873 12.169 1.00 0.00 H new ATOM 0 HB2 SER A 25 3.670 17.426 11.429 1.00 0.00 H new ATOM 0 HB3 SER A 25 4.620 17.980 12.794 1.00 0.00 H new ATOM 0 HG SER A 25 3.615 15.928 13.197 1.00 0.00 H new ATOM 327 N ASP A 26 1.639 19.240 10.397 1.00 0.00 N ATOM 328 CA ASP A 26 0.528 19.143 9.458 1.00 0.00 C ATOM 329 C ASP A 26 0.052 17.699 9.328 1.00 0.00 C ATOM 330 O ASP A 26 -1.144 17.439 9.197 1.00 0.00 O ATOM 331 CB ASP A 26 0.942 19.682 8.088 1.00 0.00 C ATOM 332 CG ASP A 26 2.252 19.090 7.604 1.00 0.00 C ATOM 333 OD1 ASP A 26 2.926 18.410 8.405 1.00 0.00 O ATOM 334 OD2 ASP A 26 2.602 19.308 6.425 1.00 0.00 O ATOM 0 H ASP A 26 2.502 19.604 9.993 1.00 0.00 H new ATOM 0 HA ASP A 26 -0.295 19.745 9.843 1.00 0.00 H new ATOM 0 HB2 ASP A 26 0.158 19.463 7.363 1.00 0.00 H new ATOM 0 HB3 ASP A 26 1.034 20.767 8.140 1.00 0.00 H new ATOM 339 N VAL A 27 0.996 16.764 9.363 1.00 0.00 N ATOM 340 CA VAL A 27 0.673 15.347 9.249 1.00 0.00 C ATOM 341 C VAL A 27 -0.424 14.953 10.231 1.00 0.00 C ATOM 342 O VAL A 27 -0.622 15.588 11.267 1.00 0.00 O ATOM 343 CB VAL A 27 1.912 14.467 9.500 1.00 0.00 C ATOM 344 CG1 VAL A 27 2.822 14.466 8.281 1.00 0.00 C ATOM 345 CG2 VAL A 27 2.662 14.944 10.735 1.00 0.00 C ATOM 0 H VAL A 27 1.991 16.962 9.469 1.00 0.00 H new ATOM 0 HA VAL A 27 0.321 15.183 8.231 1.00 0.00 H new ATOM 0 HB VAL A 27 1.580 13.444 9.677 1.00 0.00 H new ATOM 0 HG11 VAL A 27 3.692 13.839 8.477 1.00 0.00 H new ATOM 0 HG12 VAL A 27 2.278 14.074 7.421 1.00 0.00 H new ATOM 0 HG13 VAL A 27 3.149 15.484 8.070 1.00 0.00 H new ATOM 0 HG21 VAL A 27 3.534 14.311 10.898 1.00 0.00 H new ATOM 0 HG22 VAL A 27 2.984 15.975 10.590 1.00 0.00 H new ATOM 0 HG23 VAL A 27 2.006 14.888 11.604 1.00 0.00 H new ATOM 355 N PRO A 28 -1.156 13.878 9.901 1.00 0.00 N ATOM 356 CA PRO A 28 -2.246 13.374 10.742 1.00 0.00 C ATOM 357 C PRO A 28 -1.737 12.751 12.037 1.00 0.00 C ATOM 358 O PRO A 28 -1.074 11.714 12.020 1.00 0.00 O ATOM 359 CB PRO A 28 -2.909 12.311 9.862 1.00 0.00 C ATOM 360 CG PRO A 28 -1.835 11.865 8.931 1.00 0.00 C ATOM 361 CD PRO A 28 -0.975 13.073 8.681 1.00 0.00 C ATOM 0 HA PRO A 28 -2.921 14.170 11.055 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -3.285 11.480 10.460 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -3.759 12.722 9.318 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -1.252 11.054 9.368 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -2.258 11.488 8.000 1.00 0.00 H new ATOM 0 HD2 PRO A 28 0.069 12.799 8.531 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -1.293 13.615 7.791 1.00 0.00 H new ATOM 369 N SER A 29 -2.053 13.390 13.159 1.00 0.00 N ATOM 370 CA SER A 29 -1.625 12.899 14.464 1.00 0.00 C ATOM 371 C SER A 29 -2.482 11.718 14.908 1.00 0.00 C ATOM 372 O SER A 29 -1.964 10.695 15.356 1.00 0.00 O ATOM 373 CB SER A 29 -1.703 14.019 15.504 1.00 0.00 C ATOM 374 OG SER A 29 -0.944 15.145 15.098 1.00 0.00 O ATOM 0 H SER A 29 -2.603 14.248 13.191 1.00 0.00 H new ATOM 0 HA SER A 29 -0.592 12.564 14.377 1.00 0.00 H new ATOM 0 HB2 SER A 29 -2.743 14.311 15.651 1.00 0.00 H new ATOM 0 HB3 SER A 29 -1.335 13.655 16.463 1.00 0.00 H new ATOM 0 HG SER A 29 -1.011 15.847 15.778 1.00 0.00 H new ATOM 380 N ALA A 30 -3.797 11.867 14.780 1.00 0.00 N ATOM 381 CA ALA A 30 -4.726 10.812 15.166 1.00 0.00 C ATOM 382 C ALA A 30 -4.613 9.612 14.231 1.00 0.00 C ATOM 383 O ALA A 30 -4.675 9.740 13.008 1.00 0.00 O ATOM 384 CB ALA A 30 -6.152 11.343 15.176 1.00 0.00 C ATOM 0 H ALA A 30 -4.242 12.708 14.412 1.00 0.00 H new ATOM 0 HA ALA A 30 -4.465 10.482 16.172 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -6.835 10.545 15.466 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -6.230 12.164 15.889 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -6.414 11.701 14.180 1.00 0.00 H new ATOM 390 N PRO A 31 -4.444 8.418 14.818 1.00 0.00 N ATOM 391 CA PRO A 31 -4.319 7.172 14.056 1.00 0.00 C ATOM 392 C PRO A 31 -5.628 6.767 13.388 1.00 0.00 C ATOM 393 O PRO A 31 -6.697 7.298 13.690 1.00 0.00 O ATOM 394 CB PRO A 31 -3.921 6.145 15.118 1.00 0.00 C ATOM 395 CG PRO A 31 -4.451 6.696 16.396 1.00 0.00 C ATOM 396 CD PRO A 31 -4.361 8.192 16.271 1.00 0.00 C ATOM 0 HA PRO A 31 -3.601 7.263 13.241 1.00 0.00 H new ATOM 0 HB2 PRO A 31 -4.349 5.166 14.902 1.00 0.00 H new ATOM 0 HB3 PRO A 31 -2.839 6.018 15.160 1.00 0.00 H new ATOM 0 HG2 PRO A 31 -5.481 6.379 16.560 1.00 0.00 H new ATOM 0 HG3 PRO A 31 -3.869 6.340 17.246 1.00 0.00 H new ATOM 0 HD2 PRO A 31 -5.173 8.689 16.802 1.00 0.00 H new ATOM 0 HD3 PRO A 31 -3.428 8.575 16.685 1.00 0.00 H new ATOM 404 N PRO A 32 -5.546 5.805 12.458 1.00 0.00 N ATOM 405 CA PRO A 32 -6.716 5.307 11.728 1.00 0.00 C ATOM 406 C PRO A 32 -7.655 4.501 12.619 1.00 0.00 C ATOM 407 O PRO A 32 -7.210 3.739 13.476 1.00 0.00 O ATOM 408 CB PRO A 32 -6.106 4.411 10.647 1.00 0.00 C ATOM 409 CG PRO A 32 -4.795 3.979 11.209 1.00 0.00 C ATOM 410 CD PRO A 32 -4.305 5.127 12.047 1.00 0.00 C ATOM 0 HA PRO A 32 -7.326 6.120 11.333 1.00 0.00 H new ATOM 0 HB2 PRO A 32 -6.747 3.555 10.434 1.00 0.00 H new ATOM 0 HB3 PRO A 32 -5.976 4.953 9.710 1.00 0.00 H new ATOM 0 HG2 PRO A 32 -4.907 3.077 11.810 1.00 0.00 H new ATOM 0 HG3 PRO A 32 -4.087 3.746 10.414 1.00 0.00 H new ATOM 0 HD2 PRO A 32 -3.733 4.781 12.908 1.00 0.00 H new ATOM 0 HD3 PRO A 32 -3.654 5.791 11.478 1.00 0.00 H new ATOM 418 N GLN A 33 -8.956 4.676 12.411 1.00 0.00 N ATOM 419 CA GLN A 33 -9.958 3.965 13.197 1.00 0.00 C ATOM 420 C GLN A 33 -10.406 2.693 12.484 1.00 0.00 C ATOM 421 O GLN A 33 -10.255 2.564 11.270 1.00 0.00 O ATOM 422 CB GLN A 33 -11.164 4.868 13.462 1.00 0.00 C ATOM 423 CG GLN A 33 -10.963 5.827 14.624 1.00 0.00 C ATOM 424 CD GLN A 33 -12.224 6.591 14.975 1.00 0.00 C ATOM 425 OE1 GLN A 33 -12.818 6.380 16.032 1.00 0.00 O ATOM 426 NE2 GLN A 33 -12.640 7.487 14.087 1.00 0.00 N ATOM 0 H GLN A 33 -9.341 5.304 11.705 1.00 0.00 H new ATOM 0 HA GLN A 33 -9.506 3.686 14.149 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -11.382 5.442 12.562 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -12.036 4.246 13.662 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -10.626 5.268 15.497 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -10.172 6.534 14.374 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -12.117 7.630 13.223 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -13.483 8.032 14.269 1.00 0.00 H new ATOM 435 N ASN A 34 -10.958 1.756 13.248 1.00 0.00 N ATOM 436 CA ASN A 34 -11.428 0.494 12.690 1.00 0.00 C ATOM 437 C ASN A 34 -10.258 -0.354 12.201 1.00 0.00 C ATOM 438 O ASN A 34 -10.292 -0.902 11.099 1.00 0.00 O ATOM 439 CB ASN A 34 -12.402 0.752 11.538 1.00 0.00 C ATOM 440 CG ASN A 34 -13.421 -0.360 11.382 1.00 0.00 C ATOM 441 OD1 ASN A 34 -13.186 -1.336 10.668 1.00 0.00 O ATOM 442 ND2 ASN A 34 -14.559 -0.218 12.051 1.00 0.00 N ATOM 0 H ASN A 34 -11.091 1.847 14.255 1.00 0.00 H new ATOM 0 HA ASN A 34 -11.945 -0.052 13.479 1.00 0.00 H new ATOM 0 HB2 ASN A 34 -12.921 1.695 11.709 1.00 0.00 H new ATOM 0 HB3 ASN A 34 -11.842 0.860 10.609 1.00 0.00 H new ATOM 0 HD21 ASN A 34 -15.282 -0.934 11.985 1.00 0.00 H new ATOM 0 HD22 ASN A 34 -14.710 0.608 12.631 1.00 0.00 H new ATOM 449 N VAL A 35 -9.222 -0.456 13.027 1.00 0.00 N ATOM 450 CA VAL A 35 -8.041 -1.238 12.680 1.00 0.00 C ATOM 451 C VAL A 35 -8.080 -2.613 13.337 1.00 0.00 C ATOM 452 O VAL A 35 -7.594 -2.793 14.454 1.00 0.00 O ATOM 453 CB VAL A 35 -6.747 -0.516 13.101 1.00 0.00 C ATOM 454 CG1 VAL A 35 -5.527 -1.341 12.720 1.00 0.00 C ATOM 455 CG2 VAL A 35 -6.681 0.868 12.475 1.00 0.00 C ATOM 0 H VAL A 35 -9.176 -0.007 13.942 1.00 0.00 H new ATOM 0 HA VAL A 35 -8.046 -1.356 11.596 1.00 0.00 H new ATOM 0 HB VAL A 35 -6.753 -0.399 14.185 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -4.622 -0.815 13.025 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -5.571 -2.308 13.221 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -5.512 -1.492 11.641 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -5.760 1.363 12.783 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -6.698 0.777 11.389 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -7.537 1.457 12.803 1.00 0.00 H new ATOM 465 N SER A 36 -8.660 -3.582 12.636 1.00 0.00 N ATOM 466 CA SER A 36 -8.766 -4.941 13.152 1.00 0.00 C ATOM 467 C SER A 36 -8.346 -5.958 12.094 1.00 0.00 C ATOM 468 O SER A 36 -8.269 -5.640 10.907 1.00 0.00 O ATOM 469 CB SER A 36 -10.197 -5.226 13.610 1.00 0.00 C ATOM 470 OG SER A 36 -10.321 -6.548 14.107 1.00 0.00 O ATOM 0 H SER A 36 -9.064 -3.451 11.709 1.00 0.00 H new ATOM 0 HA SER A 36 -8.095 -5.032 14.006 1.00 0.00 H new ATOM 0 HB2 SER A 36 -10.482 -4.515 14.385 1.00 0.00 H new ATOM 0 HB3 SER A 36 -10.884 -5.082 12.776 1.00 0.00 H new ATOM 0 HG SER A 36 -11.245 -6.704 14.395 1.00 0.00 H new ATOM 476 N LEU A 37 -8.077 -7.182 12.534 1.00 0.00 N ATOM 477 CA LEU A 37 -7.665 -8.247 11.626 1.00 0.00 C ATOM 478 C LEU A 37 -8.783 -9.269 11.442 1.00 0.00 C ATOM 479 O LEU A 37 -9.561 -9.522 12.361 1.00 0.00 O ATOM 480 CB LEU A 37 -6.409 -8.940 12.158 1.00 0.00 C ATOM 481 CG LEU A 37 -5.172 -8.055 12.321 1.00 0.00 C ATOM 482 CD1 LEU A 37 -4.110 -8.768 13.143 1.00 0.00 C ATOM 483 CD2 LEU A 37 -4.619 -7.655 10.961 1.00 0.00 C ATOM 0 H LEU A 37 -8.137 -7.462 13.513 1.00 0.00 H new ATOM 0 HA LEU A 37 -7.444 -7.799 10.657 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -6.645 -9.382 13.126 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -6.158 -9.760 11.485 1.00 0.00 H new ATOM 0 HG LEU A 37 -5.464 -7.149 12.852 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -3.238 -8.123 13.248 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -4.510 -9.002 14.130 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -3.820 -9.691 12.641 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -3.739 -7.026 11.097 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -4.343 -8.550 10.403 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -5.378 -7.103 10.408 1.00 0.00 H new ATOM 495 N GLU A 38 -8.854 -9.852 10.250 1.00 0.00 N ATOM 496 CA GLU A 38 -9.876 -10.847 9.947 1.00 0.00 C ATOM 497 C GLU A 38 -9.246 -12.126 9.403 1.00 0.00 C ATOM 498 O GLU A 38 -8.408 -12.085 8.503 1.00 0.00 O ATOM 499 CB GLU A 38 -10.878 -10.289 8.935 1.00 0.00 C ATOM 500 CG GLU A 38 -12.071 -11.199 8.693 1.00 0.00 C ATOM 501 CD GLU A 38 -12.980 -10.689 7.593 1.00 0.00 C ATOM 502 OE1 GLU A 38 -12.457 -10.186 6.576 1.00 0.00 O ATOM 503 OE2 GLU A 38 -14.215 -10.793 7.747 1.00 0.00 O ATOM 0 H GLU A 38 -8.217 -9.653 9.479 1.00 0.00 H new ATOM 0 HA GLU A 38 -10.400 -11.086 10.873 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -11.236 -9.321 9.287 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -10.367 -10.115 7.988 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -11.716 -12.196 8.432 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -12.643 -11.295 9.616 1.00 0.00 H new ATOM 510 N VAL A 39 -9.656 -13.263 9.958 1.00 0.00 N ATOM 511 CA VAL A 39 -9.133 -14.555 9.529 1.00 0.00 C ATOM 512 C VAL A 39 -10.101 -15.252 8.580 1.00 0.00 C ATOM 513 O VAL A 39 -11.168 -15.710 8.990 1.00 0.00 O ATOM 514 CB VAL A 39 -8.858 -15.476 10.732 1.00 0.00 C ATOM 515 CG1 VAL A 39 -8.340 -16.827 10.263 1.00 0.00 C ATOM 516 CG2 VAL A 39 -7.874 -14.821 11.690 1.00 0.00 C ATOM 0 H VAL A 39 -10.348 -13.315 10.705 1.00 0.00 H new ATOM 0 HA VAL A 39 -8.196 -14.360 9.008 1.00 0.00 H new ATOM 0 HB VAL A 39 -9.795 -15.639 11.265 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -8.151 -17.464 11.127 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -9.083 -17.298 9.620 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -7.414 -16.688 9.706 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -7.691 -15.486 12.534 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -6.935 -14.627 11.171 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -8.290 -13.881 12.052 1.00 0.00 H new ATOM 526 N VAL A 40 -9.723 -15.329 7.308 1.00 0.00 N ATOM 527 CA VAL A 40 -10.557 -15.972 6.300 1.00 0.00 C ATOM 528 C VAL A 40 -10.096 -17.401 6.036 1.00 0.00 C ATOM 529 O VAL A 40 -10.909 -18.320 5.951 1.00 0.00 O ATOM 530 CB VAL A 40 -10.542 -15.186 4.975 1.00 0.00 C ATOM 531 CG1 VAL A 40 -11.365 -15.907 3.918 1.00 0.00 C ATOM 532 CG2 VAL A 40 -11.056 -13.771 5.190 1.00 0.00 C ATOM 0 H VAL A 40 -8.844 -14.954 6.951 1.00 0.00 H new ATOM 0 HA VAL A 40 -11.574 -15.988 6.693 1.00 0.00 H new ATOM 0 HB VAL A 40 -9.513 -15.124 4.620 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -11.343 -15.338 2.989 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -10.947 -16.899 3.746 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -12.395 -16.002 4.261 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -11.039 -13.230 4.244 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -12.078 -13.809 5.568 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -10.421 -13.259 5.913 1.00 0.00 H new ATOM 542 N ASN A 41 -8.785 -17.580 5.907 1.00 0.00 N ATOM 543 CA ASN A 41 -8.215 -18.898 5.652 1.00 0.00 C ATOM 544 C ASN A 41 -6.828 -19.020 6.273 1.00 0.00 C ATOM 545 O ASN A 41 -6.352 -18.101 6.940 1.00 0.00 O ATOM 546 CB ASN A 41 -8.137 -19.161 4.146 1.00 0.00 C ATOM 547 CG ASN A 41 -9.448 -18.872 3.440 1.00 0.00 C ATOM 548 OD1 ASN A 41 -10.500 -19.380 3.829 1.00 0.00 O ATOM 549 ND2 ASN A 41 -9.390 -18.053 2.397 1.00 0.00 N ATOM 0 H ASN A 41 -8.098 -16.829 5.975 1.00 0.00 H new ATOM 0 HA ASN A 41 -8.866 -19.642 6.111 1.00 0.00 H new ATOM 0 HB2 ASN A 41 -7.350 -18.544 3.712 1.00 0.00 H new ATOM 0 HB3 ASN A 41 -7.857 -20.201 3.975 1.00 0.00 H new ATOM 0 HD21 ASN A 41 -10.240 -17.822 1.882 1.00 0.00 H new ATOM 0 HD22 ASN A 41 -8.496 -17.655 2.110 1.00 0.00 H new ATOM 556 N SER A 42 -6.183 -20.161 6.050 1.00 0.00 N ATOM 557 CA SER A 42 -4.851 -20.405 6.590 1.00 0.00 C ATOM 558 C SER A 42 -3.800 -19.604 5.828 1.00 0.00 C ATOM 559 O SER A 42 -2.858 -19.076 6.419 1.00 0.00 O ATOM 560 CB SER A 42 -4.517 -21.897 6.525 1.00 0.00 C ATOM 561 OG SER A 42 -4.649 -22.392 5.204 1.00 0.00 O ATOM 0 H SER A 42 -6.562 -20.931 5.499 1.00 0.00 H new ATOM 0 HA SER A 42 -4.844 -20.083 7.631 1.00 0.00 H new ATOM 0 HB2 SER A 42 -3.499 -22.061 6.878 1.00 0.00 H new ATOM 0 HB3 SER A 42 -5.178 -22.450 7.192 1.00 0.00 H new ATOM 0 HG SER A 42 -4.428 -23.347 5.189 1.00 0.00 H new ATOM 567 N ARG A 43 -3.970 -19.517 4.513 1.00 0.00 N ATOM 568 CA ARG A 43 -3.037 -18.780 3.669 1.00 0.00 C ATOM 569 C ARG A 43 -3.696 -17.533 3.089 1.00 0.00 C ATOM 570 O ARG A 43 -3.357 -17.093 1.991 1.00 0.00 O ATOM 571 CB ARG A 43 -2.527 -19.674 2.537 1.00 0.00 C ATOM 572 CG ARG A 43 -3.634 -20.249 1.668 1.00 0.00 C ATOM 573 CD ARG A 43 -3.122 -21.378 0.789 1.00 0.00 C ATOM 574 NE ARG A 43 -4.125 -21.817 -0.178 1.00 0.00 N ATOM 575 CZ ARG A 43 -4.094 -22.998 -0.785 1.00 0.00 C ATOM 576 NH1 ARG A 43 -3.116 -23.855 -0.525 1.00 0.00 N ATOM 577 NH2 ARG A 43 -5.043 -23.325 -1.652 1.00 0.00 N ATOM 0 H ARG A 43 -4.745 -19.948 4.009 1.00 0.00 H new ATOM 0 HA ARG A 43 -2.194 -18.470 4.287 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -1.846 -19.098 1.910 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -1.950 -20.494 2.965 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -4.441 -20.617 2.301 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -4.053 -19.461 1.043 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -2.228 -21.048 0.260 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -2.829 -22.221 1.415 1.00 0.00 H new ATOM 0 HE ARG A 43 -4.892 -21.181 -0.399 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -2.385 -23.608 0.142 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -3.094 -24.761 -0.992 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -5.798 -22.669 -1.853 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -5.018 -24.232 -2.117 1.00 0.00 H new ATOM 591 N SER A 44 -4.641 -16.968 3.835 1.00 0.00 N ATOM 592 CA SER A 44 -5.351 -15.773 3.393 1.00 0.00 C ATOM 593 C SER A 44 -5.857 -14.969 4.587 1.00 0.00 C ATOM 594 O SER A 44 -6.473 -15.517 5.501 1.00 0.00 O ATOM 595 CB SER A 44 -6.523 -16.157 2.488 1.00 0.00 C ATOM 596 OG SER A 44 -6.140 -17.146 1.549 1.00 0.00 O ATOM 0 H SER A 44 -4.932 -17.318 4.748 1.00 0.00 H new ATOM 0 HA SER A 44 -4.654 -15.153 2.829 1.00 0.00 H new ATOM 0 HB2 SER A 44 -7.349 -16.528 3.095 1.00 0.00 H new ATOM 0 HB3 SER A 44 -6.885 -15.273 1.963 1.00 0.00 H new ATOM 0 HG SER A 44 -6.852 -17.260 0.885 1.00 0.00 H new ATOM 602 N ILE A 45 -5.593 -13.667 4.570 1.00 0.00 N ATOM 603 CA ILE A 45 -6.022 -12.787 5.650 1.00 0.00 C ATOM 604 C ILE A 45 -6.441 -11.423 5.114 1.00 0.00 C ATOM 605 O ILE A 45 -5.688 -10.768 4.392 1.00 0.00 O ATOM 606 CB ILE A 45 -4.907 -12.595 6.696 1.00 0.00 C ATOM 607 CG1 ILE A 45 -4.721 -13.873 7.515 1.00 0.00 C ATOM 608 CG2 ILE A 45 -5.232 -11.419 7.605 1.00 0.00 C ATOM 609 CD1 ILE A 45 -3.454 -13.881 8.342 1.00 0.00 C ATOM 0 H ILE A 45 -5.084 -13.198 3.820 1.00 0.00 H new ATOM 0 HA ILE A 45 -6.878 -13.266 6.126 1.00 0.00 H new ATOM 0 HB ILE A 45 -3.973 -12.381 6.176 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -5.578 -13.999 8.177 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -4.710 -14.729 6.840 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -4.436 -11.295 8.339 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -5.320 -10.511 7.008 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -6.174 -11.607 8.120 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -3.387 -14.817 8.897 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -2.590 -13.787 7.685 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -3.471 -13.045 9.041 1.00 0.00 H new ATOM 621 N LYS A 46 -7.648 -10.998 5.472 1.00 0.00 N ATOM 622 CA LYS A 46 -8.169 -9.710 5.030 1.00 0.00 C ATOM 623 C LYS A 46 -7.846 -8.616 6.042 1.00 0.00 C ATOM 624 O LYS A 46 -7.800 -8.866 7.247 1.00 0.00 O ATOM 625 CB LYS A 46 -9.682 -9.794 4.819 1.00 0.00 C ATOM 626 CG LYS A 46 -10.357 -8.437 4.711 1.00 0.00 C ATOM 627 CD LYS A 46 -11.607 -8.503 3.848 1.00 0.00 C ATOM 628 CE LYS A 46 -11.282 -8.281 2.379 1.00 0.00 C ATOM 629 NZ LYS A 46 -12.261 -8.960 1.486 1.00 0.00 N ATOM 0 H LYS A 46 -8.284 -11.528 6.068 1.00 0.00 H new ATOM 0 HA LYS A 46 -7.690 -9.458 4.084 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -9.883 -10.364 3.912 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -10.126 -10.346 5.647 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -10.620 -8.080 5.707 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -9.659 -7.715 4.287 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -12.086 -9.474 3.973 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -12.321 -7.750 4.182 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -11.276 -7.212 2.166 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -10.279 -8.653 2.169 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -12.005 -8.785 0.493 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -12.248 -9.983 1.671 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -13.214 -8.587 1.669 1.00 0.00 H new ATOM 643 N VAL A 47 -7.623 -7.403 5.546 1.00 0.00 N ATOM 644 CA VAL A 47 -7.307 -6.271 6.408 1.00 0.00 C ATOM 645 C VAL A 47 -8.069 -5.023 5.978 1.00 0.00 C ATOM 646 O VAL A 47 -7.919 -4.548 4.852 1.00 0.00 O ATOM 647 CB VAL A 47 -5.797 -5.964 6.401 1.00 0.00 C ATOM 648 CG1 VAL A 47 -5.501 -4.721 7.225 1.00 0.00 C ATOM 649 CG2 VAL A 47 -5.009 -7.158 6.919 1.00 0.00 C ATOM 0 H VAL A 47 -7.655 -7.179 4.551 1.00 0.00 H new ATOM 0 HA VAL A 47 -7.610 -6.549 7.418 1.00 0.00 H new ATOM 0 HB VAL A 47 -5.487 -5.771 5.374 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -4.430 -4.520 7.208 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -6.037 -3.870 6.805 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -5.824 -4.881 8.254 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -3.944 -6.924 6.907 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -5.320 -7.384 7.939 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -5.198 -8.022 6.282 1.00 0.00 H new ATOM 659 N SER A 48 -8.888 -4.496 6.882 1.00 0.00 N ATOM 660 CA SER A 48 -9.678 -3.304 6.595 1.00 0.00 C ATOM 661 C SER A 48 -9.300 -2.163 7.535 1.00 0.00 C ATOM 662 O SER A 48 -8.547 -2.354 8.489 1.00 0.00 O ATOM 663 CB SER A 48 -11.171 -3.612 6.724 1.00 0.00 C ATOM 664 OG SER A 48 -11.546 -4.683 5.875 1.00 0.00 O ATOM 0 H SER A 48 -9.022 -4.875 7.819 1.00 0.00 H new ATOM 0 HA SER A 48 -9.465 -2.995 5.572 1.00 0.00 H new ATOM 0 HB2 SER A 48 -11.405 -3.864 7.758 1.00 0.00 H new ATOM 0 HB3 SER A 48 -11.752 -2.724 6.473 1.00 0.00 H new ATOM 0 HG SER A 48 -12.504 -4.861 5.977 1.00 0.00 H new ATOM 670 N TRP A 49 -9.829 -0.976 7.256 1.00 0.00 N ATOM 671 CA TRP A 49 -9.547 0.197 8.076 1.00 0.00 C ATOM 672 C TRP A 49 -10.467 1.354 7.704 1.00 0.00 C ATOM 673 O TRP A 49 -11.108 1.337 6.652 1.00 0.00 O ATOM 674 CB TRP A 49 -8.086 0.618 7.915 1.00 0.00 C ATOM 675 CG TRP A 49 -7.710 0.929 6.497 1.00 0.00 C ATOM 676 CD1 TRP A 49 -7.802 2.139 5.872 1.00 0.00 C ATOM 677 CD2 TRP A 49 -7.185 0.014 5.530 1.00 0.00 C ATOM 678 NE1 TRP A 49 -7.366 2.032 4.573 1.00 0.00 N ATOM 679 CE2 TRP A 49 -6.981 0.738 4.339 1.00 0.00 C ATOM 680 CE3 TRP A 49 -6.866 -1.347 5.553 1.00 0.00 C ATOM 681 CZ2 TRP A 49 -6.474 0.146 3.185 1.00 0.00 C ATOM 682 CZ3 TRP A 49 -6.363 -1.933 4.408 1.00 0.00 C ATOM 683 CH2 TRP A 49 -6.170 -1.187 3.237 1.00 0.00 C ATOM 0 H TRP A 49 -10.454 -0.801 6.470 1.00 0.00 H new ATOM 0 HA TRP A 49 -9.728 -0.066 9.118 1.00 0.00 H new ATOM 0 HB2 TRP A 49 -7.898 1.495 8.534 1.00 0.00 H new ATOM 0 HB3 TRP A 49 -7.442 -0.179 8.288 1.00 0.00 H new ATOM 0 HD1 TRP A 49 -8.164 3.047 6.331 1.00 0.00 H new ATOM 0 HE1 TRP A 49 -7.334 2.792 3.894 1.00 0.00 H new ATOM 0 HE3 TRP A 49 -7.010 -1.930 6.451 1.00 0.00 H new ATOM 0 HZ2 TRP A 49 -6.326 0.719 2.281 1.00 0.00 H new ATOM 0 HZ3 TRP A 49 -6.114 -2.984 4.415 1.00 0.00 H new ATOM 0 HH2 TRP A 49 -5.773 -1.674 2.358 1.00 0.00 H new ATOM 694 N LEU A 50 -10.528 2.359 8.571 1.00 0.00 N ATOM 695 CA LEU A 50 -11.370 3.526 8.333 1.00 0.00 C ATOM 696 C LEU A 50 -10.605 4.815 8.613 1.00 0.00 C ATOM 697 O LEU A 50 -9.655 4.845 9.395 1.00 0.00 O ATOM 698 CB LEU A 50 -12.623 3.462 9.209 1.00 0.00 C ATOM 699 CG LEU A 50 -13.651 2.395 8.832 1.00 0.00 C ATOM 700 CD1 LEU A 50 -14.724 2.286 9.905 1.00 0.00 C ATOM 701 CD2 LEU A 50 -14.276 2.710 7.481 1.00 0.00 C ATOM 0 H LEU A 50 -10.004 2.389 9.446 1.00 0.00 H new ATOM 0 HA LEU A 50 -11.667 3.522 7.284 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -12.313 3.291 10.240 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -13.112 4.436 9.180 1.00 0.00 H new ATOM 0 HG LEU A 50 -13.140 1.435 8.758 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -15.447 1.522 9.620 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -14.263 2.013 10.854 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -15.232 3.245 10.011 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -15.005 1.940 7.229 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -14.773 3.679 7.527 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -13.498 2.737 6.718 1.00 0.00 H new ATOM 713 N PRO A 51 -11.029 5.908 7.961 1.00 0.00 N ATOM 714 CA PRO A 51 -10.400 7.222 8.125 1.00 0.00 C ATOM 715 C PRO A 51 -10.662 7.822 9.502 1.00 0.00 C ATOM 716 O PRO A 51 -11.616 7.462 10.191 1.00 0.00 O ATOM 717 CB PRO A 51 -11.062 8.071 7.037 1.00 0.00 C ATOM 718 CG PRO A 51 -12.378 7.417 6.794 1.00 0.00 C ATOM 719 CD PRO A 51 -12.156 5.946 7.013 1.00 0.00 C ATOM 0 HA PRO A 51 -9.315 7.168 8.041 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -11.187 9.104 7.362 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -10.458 8.094 6.130 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -13.137 7.803 7.475 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -12.730 7.612 5.781 1.00 0.00 H new ATOM 0 HD2 PRO A 51 -13.043 5.463 7.423 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -11.915 5.433 6.082 1.00 0.00 H new ATOM 727 N PRO A 52 -9.796 8.760 9.914 1.00 0.00 N ATOM 728 CA PRO A 52 -9.914 9.431 11.212 1.00 0.00 C ATOM 729 C PRO A 52 -11.113 10.371 11.272 1.00 0.00 C ATOM 730 O PRO A 52 -11.746 10.674 10.260 1.00 0.00 O ATOM 731 CB PRO A 52 -8.608 10.221 11.323 1.00 0.00 C ATOM 732 CG PRO A 52 -8.182 10.448 9.913 1.00 0.00 C ATOM 733 CD PRO A 52 -8.636 9.239 9.144 1.00 0.00 C ATOM 0 HA PRO A 52 -10.069 8.722 12.025 1.00 0.00 H new ATOM 0 HB2 PRO A 52 -8.759 11.164 11.848 1.00 0.00 H new ATOM 0 HB3 PRO A 52 -7.854 9.664 11.880 1.00 0.00 H new ATOM 0 HG2 PRO A 52 -8.630 11.357 9.511 1.00 0.00 H new ATOM 0 HG3 PRO A 52 -7.101 10.569 9.847 1.00 0.00 H new ATOM 0 HD2 PRO A 52 -8.911 9.494 8.120 1.00 0.00 H new ATOM 0 HD3 PRO A 52 -7.853 8.483 9.085 1.00 0.00 H new ATOM 741 N PRO A 53 -11.434 10.846 12.485 1.00 0.00 N ATOM 742 CA PRO A 53 -12.558 11.760 12.705 1.00 0.00 C ATOM 743 C PRO A 53 -12.301 13.146 12.123 1.00 0.00 C ATOM 744 O PRO A 53 -11.154 13.574 11.997 1.00 0.00 O ATOM 745 CB PRO A 53 -12.664 11.832 14.230 1.00 0.00 C ATOM 746 CG PRO A 53 -11.295 11.508 14.720 1.00 0.00 C ATOM 747 CD PRO A 53 -10.723 10.527 13.734 1.00 0.00 C ATOM 0 HA PRO A 53 -13.468 11.411 12.217 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -12.978 12.823 14.559 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -13.399 11.122 14.610 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -10.679 12.405 14.779 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -11.330 11.079 15.721 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -9.645 10.648 13.625 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -10.898 9.497 14.044 1.00 0.00 H new ATOM 755 N SER A 54 -13.377 13.843 11.770 1.00 0.00 N ATOM 756 CA SER A 54 -13.267 15.180 11.197 1.00 0.00 C ATOM 757 C SER A 54 -12.373 16.068 12.058 1.00 0.00 C ATOM 758 O SER A 54 -11.406 16.652 11.572 1.00 0.00 O ATOM 759 CB SER A 54 -14.652 15.813 11.058 1.00 0.00 C ATOM 760 OG SER A 54 -14.556 17.163 10.638 1.00 0.00 O ATOM 0 H SER A 54 -14.334 13.504 11.871 1.00 0.00 H new ATOM 0 HA SER A 54 -12.816 15.090 10.209 1.00 0.00 H new ATOM 0 HB2 SER A 54 -15.244 15.246 10.339 1.00 0.00 H new ATOM 0 HB3 SER A 54 -15.176 15.762 12.012 1.00 0.00 H new ATOM 0 HG SER A 54 -15.455 17.545 10.555 1.00 0.00 H new ATOM 766 N GLY A 55 -12.706 16.163 13.342 1.00 0.00 N ATOM 767 CA GLY A 55 -11.925 16.981 14.252 1.00 0.00 C ATOM 768 C GLY A 55 -10.444 16.958 13.927 1.00 0.00 C ATOM 769 O GLY A 55 -9.881 17.961 13.488 1.00 0.00 O ATOM 0 H GLY A 55 -13.502 15.688 13.768 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -12.286 18.009 14.213 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -12.075 16.629 15.272 1.00 0.00 H new ATOM 773 N THR A 56 -9.810 15.810 14.144 1.00 0.00 N ATOM 774 CA THR A 56 -8.386 15.661 13.873 1.00 0.00 C ATOM 775 C THR A 56 -8.084 15.857 12.392 1.00 0.00 C ATOM 776 O THR A 56 -7.159 16.583 12.029 1.00 0.00 O ATOM 777 CB THR A 56 -7.873 14.276 14.312 1.00 0.00 C ATOM 778 OG1 THR A 56 -8.378 13.266 13.432 1.00 0.00 O ATOM 779 CG2 THR A 56 -8.295 13.970 15.741 1.00 0.00 C ATOM 0 H THR A 56 -10.261 14.970 14.507 1.00 0.00 H new ATOM 0 HA THR A 56 -7.872 16.430 14.450 1.00 0.00 H new ATOM 0 HB THR A 56 -6.784 14.285 14.267 1.00 0.00 H new ATOM 0 HG1 THR A 56 -7.687 13.025 12.780 1.00 0.00 H new ATOM 0 HG21 THR A 56 -7.921 12.987 16.028 1.00 0.00 H new ATOM 0 HG22 THR A 56 -7.884 14.725 16.411 1.00 0.00 H new ATOM 0 HG23 THR A 56 -9.383 13.978 15.809 1.00 0.00 H new ATOM 787 N GLN A 57 -8.870 15.205 11.541 1.00 0.00 N ATOM 788 CA GLN A 57 -8.685 15.309 10.099 1.00 0.00 C ATOM 789 C GLN A 57 -8.299 16.729 9.700 1.00 0.00 C ATOM 790 O GLN A 57 -9.154 17.606 9.585 1.00 0.00 O ATOM 791 CB GLN A 57 -9.963 14.891 9.368 1.00 0.00 C ATOM 792 CG GLN A 57 -10.043 13.399 9.088 1.00 0.00 C ATOM 793 CD GLN A 57 -11.388 12.983 8.525 1.00 0.00 C ATOM 794 OE1 GLN A 57 -12.427 13.186 9.153 1.00 0.00 O ATOM 795 NE2 GLN A 57 -11.374 12.397 7.333 1.00 0.00 N ATOM 0 H GLN A 57 -9.640 14.600 11.825 1.00 0.00 H new ATOM 0 HA GLN A 57 -7.875 14.638 9.813 1.00 0.00 H new ATOM 0 HB2 GLN A 57 -10.826 15.187 9.964 1.00 0.00 H new ATOM 0 HB3 GLN A 57 -10.026 15.433 8.425 1.00 0.00 H new ATOM 0 HG2 GLN A 57 -9.258 13.122 8.385 1.00 0.00 H new ATOM 0 HG3 GLN A 57 -9.853 12.849 10.010 1.00 0.00 H new ATOM 0 HE21 GLN A 57 -10.489 12.249 6.848 1.00 0.00 H new ATOM 0 HE22 GLN A 57 -12.248 12.095 6.903 1.00 0.00 H new ATOM 804 N ASN A 58 -7.004 16.949 9.491 1.00 0.00 N ATOM 805 CA ASN A 58 -6.505 18.264 9.106 1.00 0.00 C ATOM 806 C ASN A 58 -5.782 18.199 7.764 1.00 0.00 C ATOM 807 O ASN A 58 -4.791 18.896 7.547 1.00 0.00 O ATOM 808 CB ASN A 58 -5.561 18.808 10.181 1.00 0.00 C ATOM 809 CG ASN A 58 -4.593 17.757 10.687 1.00 0.00 C ATOM 810 OD1 ASN A 58 -3.611 17.411 9.863 1.00 0.00 O flip ATOM 811 ND2 ASN A 58 -4.727 17.261 11.806 1.00 0.00 N flip ATOM 0 H ASN A 58 -6.282 16.234 9.582 1.00 0.00 H new ATOM 0 HA ASN A 58 -7.358 18.935 9.007 1.00 0.00 H new ATOM 0 HB2 ASN A 58 -5.000 19.650 9.775 1.00 0.00 H new ATOM 0 HB3 ASN A 58 -6.148 19.190 11.017 1.00 0.00 H new ATOM 0 HD21 ASN A 58 -5.497 17.557 12.406 1.00 0.00 H new ATOM 0 HD22 ASN A 58 -4.068 16.554 12.133 1.00 0.00 H new ATOM 818 N GLY A 59 -6.286 17.358 6.867 1.00 0.00 N ATOM 819 CA GLY A 59 -5.676 17.218 5.557 1.00 0.00 C ATOM 820 C GLY A 59 -6.562 16.468 4.582 1.00 0.00 C ATOM 821 O GLY A 59 -7.686 16.092 4.916 1.00 0.00 O ATOM 0 H GLY A 59 -7.105 16.771 7.023 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -5.454 18.207 5.155 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -4.725 16.694 5.656 1.00 0.00 H new ATOM 825 N PHE A 60 -6.057 16.250 3.373 1.00 0.00 N ATOM 826 CA PHE A 60 -6.811 15.542 2.345 1.00 0.00 C ATOM 827 C PHE A 60 -6.313 14.108 2.195 1.00 0.00 C ATOM 828 O PHE A 60 -5.246 13.866 1.630 1.00 0.00 O ATOM 829 CB PHE A 60 -6.701 16.274 1.006 1.00 0.00 C ATOM 830 CG PHE A 60 -7.844 15.994 0.073 1.00 0.00 C ATOM 831 CD1 PHE A 60 -9.132 16.388 0.397 1.00 0.00 C ATOM 832 CD2 PHE A 60 -7.631 15.335 -1.127 1.00 0.00 C ATOM 833 CE1 PHE A 60 -10.187 16.132 -0.459 1.00 0.00 C ATOM 834 CE2 PHE A 60 -8.681 15.076 -1.987 1.00 0.00 C ATOM 835 CZ PHE A 60 -9.961 15.474 -1.652 1.00 0.00 C ATOM 0 H PHE A 60 -5.128 16.554 3.081 1.00 0.00 H new ATOM 0 HA PHE A 60 -7.857 15.515 2.652 1.00 0.00 H new ATOM 0 HB2 PHE A 60 -6.648 17.347 1.191 1.00 0.00 H new ATOM 0 HB3 PHE A 60 -5.768 15.988 0.520 1.00 0.00 H new ATOM 0 HD1 PHE A 60 -9.314 16.901 1.330 1.00 0.00 H new ATOM 0 HD2 PHE A 60 -6.633 15.020 -1.393 1.00 0.00 H new ATOM 0 HE1 PHE A 60 -11.186 16.446 -0.195 1.00 0.00 H new ATOM 0 HE2 PHE A 60 -8.501 14.563 -2.920 1.00 0.00 H new ATOM 0 HZ PHE A 60 -10.783 15.271 -2.322 1.00 0.00 H new ATOM 845 N ILE A 61 -7.093 13.161 2.707 1.00 0.00 N ATOM 846 CA ILE A 61 -6.731 11.751 2.630 1.00 0.00 C ATOM 847 C ILE A 61 -6.701 11.269 1.183 1.00 0.00 C ATOM 848 O ILE A 61 -7.630 11.517 0.414 1.00 0.00 O ATOM 849 CB ILE A 61 -7.712 10.874 3.430 1.00 0.00 C ATOM 850 CG1 ILE A 61 -7.767 11.333 4.889 1.00 0.00 C ATOM 851 CG2 ILE A 61 -7.306 9.410 3.344 1.00 0.00 C ATOM 852 CD1 ILE A 61 -9.041 10.936 5.600 1.00 0.00 C ATOM 0 H ILE A 61 -7.978 13.345 3.179 1.00 0.00 H new ATOM 0 HA ILE A 61 -5.735 11.657 3.063 1.00 0.00 H new ATOM 0 HB ILE A 61 -8.707 10.980 2.998 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -6.916 10.914 5.425 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -7.664 12.418 4.924 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -8.009 8.803 3.915 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -7.314 9.091 2.302 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -6.304 9.286 3.754 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -9.010 11.294 6.629 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -9.896 11.377 5.088 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -9.136 9.850 5.597 1.00 0.00 H new ATOM 864 N THR A 62 -5.626 10.577 0.818 1.00 0.00 N ATOM 865 CA THR A 62 -5.474 10.059 -0.536 1.00 0.00 C ATOM 866 C THR A 62 -5.415 8.536 -0.538 1.00 0.00 C ATOM 867 O THR A 62 -5.995 7.884 -1.405 1.00 0.00 O ATOM 868 CB THR A 62 -4.203 10.612 -1.209 1.00 0.00 C ATOM 869 OG1 THR A 62 -3.042 9.981 -0.657 1.00 0.00 O ATOM 870 CG2 THR A 62 -4.104 12.119 -1.023 1.00 0.00 C ATOM 0 H THR A 62 -4.848 10.362 1.441 1.00 0.00 H new ATOM 0 HA THR A 62 -6.347 10.387 -1.100 1.00 0.00 H new ATOM 0 HB THR A 62 -4.261 10.396 -2.276 1.00 0.00 H new ATOM 0 HG1 THR A 62 -2.239 10.337 -1.091 1.00 0.00 H new ATOM 0 HG21 THR A 62 -3.199 12.487 -1.506 1.00 0.00 H new ATOM 0 HG22 THR A 62 -4.975 12.599 -1.470 1.00 0.00 H new ATOM 0 HG23 THR A 62 -4.067 12.353 0.041 1.00 0.00 H new ATOM 878 N GLY A 63 -4.710 7.974 0.439 1.00 0.00 N ATOM 879 CA GLY A 63 -4.589 6.531 0.530 1.00 0.00 C ATOM 880 C GLY A 63 -4.157 6.071 1.909 1.00 0.00 C ATOM 881 O GLY A 63 -4.263 6.819 2.881 1.00 0.00 O ATOM 0 H GLY A 63 -4.221 8.492 1.169 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -5.546 6.073 0.281 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -3.867 6.183 -0.209 1.00 0.00 H new ATOM 885 N TYR A 64 -3.672 4.838 1.994 1.00 0.00 N ATOM 886 CA TYR A 64 -3.227 4.278 3.265 1.00 0.00 C ATOM 887 C TYR A 64 -2.025 3.360 3.065 1.00 0.00 C ATOM 888 O TYR A 64 -1.829 2.799 1.987 1.00 0.00 O ATOM 889 CB TYR A 64 -4.366 3.506 3.933 1.00 0.00 C ATOM 890 CG TYR A 64 -5.482 4.392 4.439 1.00 0.00 C ATOM 891 CD1 TYR A 64 -6.365 5.003 3.557 1.00 0.00 C ATOM 892 CD2 TYR A 64 -5.656 4.616 5.799 1.00 0.00 C ATOM 893 CE1 TYR A 64 -7.385 5.814 4.014 1.00 0.00 C ATOM 894 CE2 TYR A 64 -6.674 5.424 6.266 1.00 0.00 C ATOM 895 CZ TYR A 64 -7.536 6.021 5.370 1.00 0.00 C ATOM 896 OH TYR A 64 -8.553 6.827 5.829 1.00 0.00 O ATOM 0 H TYR A 64 -3.577 4.207 1.198 1.00 0.00 H new ATOM 0 HA TYR A 64 -2.928 5.103 3.911 1.00 0.00 H new ATOM 0 HB2 TYR A 64 -4.776 2.791 3.220 1.00 0.00 H new ATOM 0 HB3 TYR A 64 -3.964 2.930 4.767 1.00 0.00 H new ATOM 0 HD1 TYR A 64 -6.252 4.841 2.495 1.00 0.00 H new ATOM 0 HD2 TYR A 64 -4.983 4.150 6.504 1.00 0.00 H new ATOM 0 HE1 TYR A 64 -8.061 6.284 3.314 1.00 0.00 H new ATOM 0 HE2 TYR A 64 -6.794 5.587 7.327 1.00 0.00 H new ATOM 0 HH TYR A 64 -8.176 7.656 6.190 1.00 0.00 H new ATOM 906 N LYS A 65 -1.221 3.212 4.113 1.00 0.00 N ATOM 907 CA LYS A 65 -0.038 2.361 4.056 1.00 0.00 C ATOM 908 C LYS A 65 -0.153 1.203 5.042 1.00 0.00 C ATOM 909 O LYS A 65 -0.350 1.413 6.239 1.00 0.00 O ATOM 910 CB LYS A 65 1.219 3.180 4.358 1.00 0.00 C ATOM 911 CG LYS A 65 1.861 3.788 3.123 1.00 0.00 C ATOM 912 CD LYS A 65 3.275 4.264 3.407 1.00 0.00 C ATOM 913 CE LYS A 65 3.292 5.709 3.881 1.00 0.00 C ATOM 914 NZ LYS A 65 4.428 5.976 4.806 1.00 0.00 N ATOM 0 H LYS A 65 -1.367 3.671 5.012 1.00 0.00 H new ATOM 0 HA LYS A 65 0.036 1.951 3.049 1.00 0.00 H new ATOM 0 HB2 LYS A 65 0.963 3.978 5.055 1.00 0.00 H new ATOM 0 HB3 LYS A 65 1.947 2.541 4.858 1.00 0.00 H new ATOM 0 HG2 LYS A 65 1.879 3.051 2.321 1.00 0.00 H new ATOM 0 HG3 LYS A 65 1.258 4.626 2.773 1.00 0.00 H new ATOM 0 HD2 LYS A 65 3.729 3.626 4.165 1.00 0.00 H new ATOM 0 HD3 LYS A 65 3.880 4.169 2.505 1.00 0.00 H new ATOM 0 HE2 LYS A 65 3.361 6.373 3.019 1.00 0.00 H new ATOM 0 HE3 LYS A 65 2.352 5.937 4.384 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 4.320 6.922 5.225 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 4.436 5.261 5.562 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 5.323 5.932 4.278 1.00 0.00 H new ATOM 928 N ILE A 66 -0.027 -0.017 4.532 1.00 0.00 N ATOM 929 CA ILE A 66 -0.114 -1.207 5.369 1.00 0.00 C ATOM 930 C ILE A 66 1.232 -1.918 5.455 1.00 0.00 C ATOM 931 O ILE A 66 1.739 -2.433 4.458 1.00 0.00 O ATOM 932 CB ILE A 66 -1.170 -2.194 4.836 1.00 0.00 C ATOM 933 CG1 ILE A 66 -2.507 -1.480 4.628 1.00 0.00 C ATOM 934 CG2 ILE A 66 -1.331 -3.364 5.795 1.00 0.00 C ATOM 935 CD1 ILE A 66 -3.342 -2.074 3.516 1.00 0.00 C ATOM 0 H ILE A 66 0.136 -0.208 3.543 1.00 0.00 H new ATOM 0 HA ILE A 66 -0.410 -0.873 6.363 1.00 0.00 H new ATOM 0 HB ILE A 66 -0.833 -2.581 3.874 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -3.076 -1.514 5.557 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -2.318 -0.429 4.408 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -2.080 -4.053 5.406 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -0.378 -3.884 5.898 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -1.650 -2.994 6.770 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -4.275 -1.518 3.425 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -2.792 -2.015 2.577 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -3.562 -3.117 3.743 1.00 0.00 H new ATOM 947 N ARG A 67 1.806 -1.944 6.653 1.00 0.00 N ATOM 948 CA ARG A 67 3.094 -2.593 6.870 1.00 0.00 C ATOM 949 C ARG A 67 2.948 -3.793 7.802 1.00 0.00 C ATOM 950 O ARG A 67 2.444 -3.668 8.919 1.00 0.00 O ATOM 951 CB ARG A 67 4.098 -1.598 7.456 1.00 0.00 C ATOM 952 CG ARG A 67 5.546 -1.945 7.153 1.00 0.00 C ATOM 953 CD ARG A 67 6.494 -0.868 7.655 1.00 0.00 C ATOM 954 NE ARG A 67 6.103 0.463 7.196 1.00 0.00 N ATOM 955 CZ ARG A 67 5.225 1.231 7.831 1.00 0.00 C ATOM 956 NH1 ARG A 67 4.650 0.803 8.946 1.00 0.00 N ATOM 957 NH2 ARG A 67 4.921 2.430 7.350 1.00 0.00 N ATOM 0 H ARG A 67 1.400 -1.523 7.489 1.00 0.00 H new ATOM 0 HA ARG A 67 3.462 -2.946 5.906 1.00 0.00 H new ATOM 0 HB2 ARG A 67 3.882 -0.604 7.065 1.00 0.00 H new ATOM 0 HB3 ARG A 67 3.963 -1.552 8.537 1.00 0.00 H new ATOM 0 HG2 ARG A 67 5.798 -2.898 7.618 1.00 0.00 H new ATOM 0 HG3 ARG A 67 5.674 -2.071 6.078 1.00 0.00 H new ATOM 0 HD2 ARG A 67 6.516 -0.884 8.745 1.00 0.00 H new ATOM 0 HD3 ARG A 67 7.505 -1.087 7.313 1.00 0.00 H new ATOM 0 HE ARG A 67 6.528 0.822 6.341 1.00 0.00 H new ATOM 0 HH11 ARG A 67 4.882 -0.118 9.318 1.00 0.00 H new ATOM 0 HH12 ARG A 67 3.976 1.395 9.432 1.00 0.00 H new ATOM 0 HH21 ARG A 67 5.362 2.762 6.492 1.00 0.00 H new ATOM 0 HH22 ARG A 67 4.247 3.019 7.838 1.00 0.00 H new ATOM 971 N HIS A 68 3.391 -4.956 7.334 1.00 0.00 N ATOM 972 CA HIS A 68 3.310 -6.179 8.125 1.00 0.00 C ATOM 973 C HIS A 68 4.698 -6.638 8.560 1.00 0.00 C ATOM 974 O HIS A 68 5.662 -6.537 7.800 1.00 0.00 O ATOM 975 CB HIS A 68 2.622 -7.284 7.324 1.00 0.00 C ATOM 976 CG HIS A 68 2.966 -7.271 5.866 1.00 0.00 C ATOM 977 ND1 HIS A 68 2.602 -6.420 4.879 1.00 0.00 N flip ATOM 978 CD2 HIS A 68 3.777 -8.216 5.276 1.00 0.00 C flip ATOM 979 CE1 HIS A 68 3.195 -6.861 3.722 1.00 0.00 C flip ATOM 980 NE2 HIS A 68 3.899 -7.946 3.988 1.00 0.00 N flip ATOM 0 H HIS A 68 3.809 -5.077 6.412 1.00 0.00 H new ATOM 0 HA HIS A 68 2.721 -5.967 9.017 1.00 0.00 H new ATOM 0 HB2 HIS A 68 2.897 -8.251 7.745 1.00 0.00 H new ATOM 0 HB3 HIS A 68 1.542 -7.183 7.435 1.00 0.00 H new ATOM 0 HD2 HIS A 68 4.240 -9.047 5.786 1.00 0.00 H new ATOM 0 HE1 HIS A 68 3.101 -6.396 2.752 1.00 0.00 H new ATOM 0 HE2 HIS A 68 4.444 -8.484 3.314 1.00 0.00 H new ATOM 989 N ARG A 69 4.793 -7.141 9.786 1.00 0.00 N ATOM 990 CA ARG A 69 6.064 -7.613 10.322 1.00 0.00 C ATOM 991 C ARG A 69 5.993 -9.099 10.661 1.00 0.00 C ATOM 992 O ARG A 69 4.937 -9.613 11.030 1.00 0.00 O ATOM 993 CB ARG A 69 6.445 -6.813 11.569 1.00 0.00 C ATOM 994 CG ARG A 69 7.236 -7.615 12.589 1.00 0.00 C ATOM 995 CD ARG A 69 8.136 -6.719 13.426 1.00 0.00 C ATOM 996 NE ARG A 69 7.450 -6.203 14.607 1.00 0.00 N ATOM 997 CZ ARG A 69 7.863 -5.142 15.291 1.00 0.00 C ATOM 998 NH1 ARG A 69 8.952 -4.487 14.913 1.00 0.00 N ATOM 999 NH2 ARG A 69 7.184 -4.733 16.356 1.00 0.00 N ATOM 0 H ARG A 69 4.005 -7.232 10.427 1.00 0.00 H new ATOM 0 HA ARG A 69 6.828 -7.468 9.558 1.00 0.00 H new ATOM 0 HB2 ARG A 69 7.031 -5.945 11.268 1.00 0.00 H new ATOM 0 HB3 ARG A 69 5.537 -6.437 12.040 1.00 0.00 H new ATOM 0 HG2 ARG A 69 6.549 -8.154 13.242 1.00 0.00 H new ATOM 0 HG3 ARG A 69 7.841 -8.363 12.076 1.00 0.00 H new ATOM 0 HD2 ARG A 69 9.018 -7.279 13.735 1.00 0.00 H new ATOM 0 HD3 ARG A 69 8.485 -5.885 12.817 1.00 0.00 H new ATOM 0 HE ARG A 69 6.608 -6.683 14.924 1.00 0.00 H new ATOM 0 HH11 ARG A 69 9.476 -4.797 14.095 1.00 0.00 H new ATOM 0 HH12 ARG A 69 9.266 -3.673 15.441 1.00 0.00 H new ATOM 0 HH21 ARG A 69 6.345 -5.234 16.649 1.00 0.00 H new ATOM 0 HH22 ARG A 69 7.501 -3.918 16.881 1.00 0.00 H new ATOM 1013 N LYS A 70 7.123 -9.785 10.531 1.00 0.00 N ATOM 1014 CA LYS A 70 7.191 -11.212 10.824 1.00 0.00 C ATOM 1015 C LYS A 70 8.010 -11.471 12.084 1.00 0.00 C ATOM 1016 O LYS A 70 9.127 -10.972 12.225 1.00 0.00 O ATOM 1017 CB LYS A 70 7.802 -11.967 9.641 1.00 0.00 C ATOM 1018 CG LYS A 70 7.710 -13.478 9.772 1.00 0.00 C ATOM 1019 CD LYS A 70 6.393 -14.005 9.228 1.00 0.00 C ATOM 1020 CE LYS A 70 6.449 -15.506 8.988 1.00 0.00 C ATOM 1021 NZ LYS A 70 6.763 -16.255 10.236 1.00 0.00 N ATOM 0 H LYS A 70 8.005 -9.376 10.224 1.00 0.00 H new ATOM 0 HA LYS A 70 6.176 -11.572 10.992 1.00 0.00 H new ATOM 0 HB2 LYS A 70 7.299 -11.659 8.725 1.00 0.00 H new ATOM 0 HB3 LYS A 70 8.849 -11.682 9.541 1.00 0.00 H new ATOM 0 HG2 LYS A 70 8.538 -13.942 9.236 1.00 0.00 H new ATOM 0 HG3 LYS A 70 7.811 -13.760 10.820 1.00 0.00 H new ATOM 0 HD2 LYS A 70 5.591 -13.778 9.930 1.00 0.00 H new ATOM 0 HD3 LYS A 70 6.154 -13.495 8.295 1.00 0.00 H new ATOM 0 HE2 LYS A 70 5.493 -15.846 8.591 1.00 0.00 H new ATOM 0 HE3 LYS A 70 7.204 -15.725 8.233 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 6.468 -17.246 10.130 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 7.787 -16.216 10.416 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 6.255 -15.826 11.035 1.00 0.00 H new ATOM 1035 N THR A 71 7.448 -12.255 12.999 1.00 0.00 N ATOM 1036 CA THR A 71 8.125 -12.580 14.247 1.00 0.00 C ATOM 1037 C THR A 71 9.593 -12.914 14.005 1.00 0.00 C ATOM 1038 O THR A 71 10.445 -12.677 14.863 1.00 0.00 O ATOM 1039 CB THR A 71 7.451 -13.768 14.960 1.00 0.00 C ATOM 1040 OG1 THR A 71 8.397 -14.434 15.803 1.00 0.00 O ATOM 1041 CG2 THR A 71 6.884 -14.754 13.949 1.00 0.00 C ATOM 0 H THR A 71 6.525 -12.677 12.898 1.00 0.00 H new ATOM 0 HA THR A 71 8.055 -11.698 14.883 1.00 0.00 H new ATOM 0 HB THR A 71 6.632 -13.382 15.567 1.00 0.00 H new ATOM 0 HG1 THR A 71 7.960 -15.187 16.254 1.00 0.00 H new ATOM 0 HG21 THR A 71 6.413 -15.584 14.475 1.00 0.00 H new ATOM 0 HG22 THR A 71 6.143 -14.252 13.327 1.00 0.00 H new ATOM 0 HG23 THR A 71 7.689 -15.133 13.320 1.00 0.00 H new ATOM 1049 N THR A 72 9.884 -13.466 12.831 1.00 0.00 N ATOM 1050 CA THR A 72 11.249 -13.832 12.476 1.00 0.00 C ATOM 1051 C THR A 72 12.106 -12.595 12.235 1.00 0.00 C ATOM 1052 O THR A 72 11.646 -11.466 12.410 1.00 0.00 O ATOM 1053 CB THR A 72 11.284 -14.720 11.218 1.00 0.00 C ATOM 1054 OG1 THR A 72 10.716 -14.017 10.107 1.00 0.00 O ATOM 1055 CG2 THR A 72 10.520 -16.015 11.449 1.00 0.00 C ATOM 0 H THR A 72 9.192 -13.669 12.110 1.00 0.00 H new ATOM 0 HA THR A 72 11.654 -14.392 13.319 1.00 0.00 H new ATOM 0 HB THR A 72 12.324 -14.964 11.000 1.00 0.00 H new ATOM 0 HG1 THR A 72 10.743 -14.587 9.310 1.00 0.00 H new ATOM 0 HG21 THR A 72 10.558 -16.626 10.547 1.00 0.00 H new ATOM 0 HG22 THR A 72 10.972 -16.561 12.277 1.00 0.00 H new ATOM 0 HG23 THR A 72 9.481 -15.787 11.689 1.00 0.00 H new ATOM 1063 N ARG A 73 13.353 -12.813 11.832 1.00 0.00 N ATOM 1064 CA ARG A 73 14.274 -11.715 11.566 1.00 0.00 C ATOM 1065 C ARG A 73 13.548 -10.542 10.915 1.00 0.00 C ATOM 1066 O ARG A 73 12.499 -10.715 10.294 1.00 0.00 O ATOM 1067 CB ARG A 73 15.417 -12.185 10.664 1.00 0.00 C ATOM 1068 CG ARG A 73 16.558 -11.187 10.556 1.00 0.00 C ATOM 1069 CD ARG A 73 17.629 -11.668 9.590 1.00 0.00 C ATOM 1070 NE ARG A 73 18.900 -10.978 9.794 1.00 0.00 N ATOM 1071 CZ ARG A 73 20.064 -11.437 9.349 1.00 0.00 C ATOM 1072 NH1 ARG A 73 20.119 -12.579 8.678 1.00 0.00 N ATOM 1073 NH2 ARG A 73 21.178 -10.751 9.574 1.00 0.00 N ATOM 0 H ARG A 73 13.749 -13.741 11.682 1.00 0.00 H new ATOM 0 HA ARG A 73 14.686 -11.382 12.519 1.00 0.00 H new ATOM 0 HB2 ARG A 73 15.806 -13.129 11.047 1.00 0.00 H new ATOM 0 HB3 ARG A 73 15.024 -12.383 9.667 1.00 0.00 H new ATOM 0 HG2 ARG A 73 16.171 -10.225 10.222 1.00 0.00 H new ATOM 0 HG3 ARG A 73 16.999 -11.029 11.540 1.00 0.00 H new ATOM 0 HD2 ARG A 73 17.775 -12.741 9.715 1.00 0.00 H new ATOM 0 HD3 ARG A 73 17.291 -11.510 8.566 1.00 0.00 H new ATOM 0 HE ARG A 73 18.893 -10.096 10.306 1.00 0.00 H new ATOM 0 HH11 ARG A 73 19.265 -13.109 8.502 1.00 0.00 H new ATOM 0 HH12 ARG A 73 21.015 -12.928 8.338 1.00 0.00 H new ATOM 0 HH21 ARG A 73 21.140 -9.871 10.089 1.00 0.00 H new ATOM 0 HH22 ARG A 73 22.072 -11.104 9.232 1.00 0.00 H new ATOM 1087 N ARG A 74 14.113 -9.348 11.062 1.00 0.00 N ATOM 1088 CA ARG A 74 13.518 -8.146 10.489 1.00 0.00 C ATOM 1089 C ARG A 74 12.998 -8.414 9.080 1.00 0.00 C ATOM 1090 O ARG A 74 13.376 -9.398 8.445 1.00 0.00 O ATOM 1091 CB ARG A 74 14.542 -7.009 10.459 1.00 0.00 C ATOM 1092 CG ARG A 74 15.804 -7.347 9.682 1.00 0.00 C ATOM 1093 CD ARG A 74 16.538 -6.091 9.238 1.00 0.00 C ATOM 1094 NE ARG A 74 17.520 -5.653 10.226 1.00 0.00 N ATOM 1095 CZ ARG A 74 18.246 -4.548 10.100 1.00 0.00 C ATOM 1096 NH1 ARG A 74 18.100 -3.773 9.034 1.00 0.00 N ATOM 1097 NH2 ARG A 74 19.119 -4.216 11.042 1.00 0.00 N ATOM 0 H ARG A 74 14.981 -9.187 11.573 1.00 0.00 H new ATOM 0 HA ARG A 74 12.677 -7.853 11.117 1.00 0.00 H new ATOM 0 HB2 ARG A 74 14.079 -6.126 10.018 1.00 0.00 H new ATOM 0 HB3 ARG A 74 14.814 -6.749 11.482 1.00 0.00 H new ATOM 0 HG2 ARG A 74 16.463 -7.955 10.302 1.00 0.00 H new ATOM 0 HG3 ARG A 74 15.546 -7.947 8.809 1.00 0.00 H new ATOM 0 HD2 ARG A 74 17.039 -6.280 8.288 1.00 0.00 H new ATOM 0 HD3 ARG A 74 15.817 -5.292 9.065 1.00 0.00 H new ATOM 0 HE ARG A 74 17.656 -6.227 11.058 1.00 0.00 H new ATOM 0 HH11 ARG A 74 17.429 -4.025 8.308 1.00 0.00 H new ATOM 0 HH12 ARG A 74 18.659 -2.925 8.940 1.00 0.00 H new ATOM 0 HH21 ARG A 74 19.233 -4.809 11.864 1.00 0.00 H new ATOM 0 HH22 ARG A 74 19.676 -3.367 10.945 1.00 0.00 H new ATOM 1111 N GLY A 75 12.129 -7.532 8.597 1.00 0.00 N ATOM 1112 CA GLY A 75 11.571 -7.692 7.267 1.00 0.00 C ATOM 1113 C GLY A 75 10.231 -7.000 7.113 1.00 0.00 C ATOM 1114 O GLY A 75 9.220 -7.646 6.844 1.00 0.00 O ATOM 0 H GLY A 75 11.801 -6.709 9.103 1.00 0.00 H new ATOM 0 HA2 GLY A 75 12.270 -7.291 6.533 1.00 0.00 H new ATOM 0 HA3 GLY A 75 11.455 -8.754 7.050 1.00 0.00 H new ATOM 1118 N GLU A 76 10.224 -5.682 7.286 1.00 0.00 N ATOM 1119 CA GLU A 76 8.997 -4.903 7.167 1.00 0.00 C ATOM 1120 C GLU A 76 8.725 -4.535 5.712 1.00 0.00 C ATOM 1121 O GLU A 76 9.522 -3.846 5.075 1.00 0.00 O ATOM 1122 CB GLU A 76 9.088 -3.634 8.017 1.00 0.00 C ATOM 1123 CG GLU A 76 9.177 -3.905 9.509 1.00 0.00 C ATOM 1124 CD GLU A 76 10.433 -4.665 9.890 1.00 0.00 C ATOM 1125 OE1 GLU A 76 11.538 -4.113 9.709 1.00 0.00 O ATOM 1126 OE2 GLU A 76 10.310 -5.812 10.369 1.00 0.00 O ATOM 0 H GLU A 76 11.053 -5.132 7.509 1.00 0.00 H new ATOM 0 HA GLU A 76 8.171 -5.516 7.529 1.00 0.00 H new ATOM 0 HB2 GLU A 76 9.963 -3.062 7.708 1.00 0.00 H new ATOM 0 HB3 GLU A 76 8.214 -3.012 7.821 1.00 0.00 H new ATOM 0 HG2 GLU A 76 9.152 -2.958 10.049 1.00 0.00 H new ATOM 0 HG3 GLU A 76 8.303 -4.475 9.824 1.00 0.00 H new ATOM 1133 N MET A 77 7.594 -5.001 5.191 1.00 0.00 N ATOM 1134 CA MET A 77 7.217 -4.721 3.811 1.00 0.00 C ATOM 1135 C MET A 77 6.111 -3.671 3.752 1.00 0.00 C ATOM 1136 O MET A 77 5.019 -3.878 4.279 1.00 0.00 O ATOM 1137 CB MET A 77 6.755 -6.003 3.115 1.00 0.00 C ATOM 1138 CG MET A 77 6.260 -5.780 1.696 1.00 0.00 C ATOM 1139 SD MET A 77 7.545 -5.138 0.605 1.00 0.00 S ATOM 1140 CE MET A 77 8.791 -6.415 0.760 1.00 0.00 C ATOM 0 H MET A 77 6.924 -5.574 5.704 1.00 0.00 H new ATOM 0 HA MET A 77 8.094 -4.331 3.294 1.00 0.00 H new ATOM 0 HB2 MET A 77 7.581 -6.714 3.095 1.00 0.00 H new ATOM 0 HB3 MET A 77 5.957 -6.458 3.702 1.00 0.00 H new ATOM 0 HG2 MET A 77 5.884 -6.721 1.294 1.00 0.00 H new ATOM 0 HG3 MET A 77 5.422 -5.083 1.713 1.00 0.00 H new ATOM 0 HE1 MET A 77 9.313 -6.531 -0.190 1.00 0.00 H new ATOM 0 HE2 MET A 77 9.505 -6.135 1.535 1.00 0.00 H new ATOM 0 HE3 MET A 77 8.314 -7.358 1.029 1.00 0.00 H new ATOM 1150 N GLU A 78 6.404 -2.545 3.108 1.00 0.00 N ATOM 1151 CA GLU A 78 5.434 -1.464 2.983 1.00 0.00 C ATOM 1152 C GLU A 78 4.604 -1.622 1.713 1.00 0.00 C ATOM 1153 O GLU A 78 5.145 -1.768 0.616 1.00 0.00 O ATOM 1154 CB GLU A 78 6.146 -0.109 2.974 1.00 0.00 C ATOM 1155 CG GLU A 78 5.219 1.067 3.228 1.00 0.00 C ATOM 1156 CD GLU A 78 5.835 2.393 2.827 1.00 0.00 C ATOM 1157 OE1 GLU A 78 6.018 2.619 1.612 1.00 0.00 O ATOM 1158 OE2 GLU A 78 6.136 3.205 3.727 1.00 0.00 O ATOM 0 H GLU A 78 7.304 -2.358 2.666 1.00 0.00 H new ATOM 0 HA GLU A 78 4.765 -1.510 3.842 1.00 0.00 H new ATOM 0 HB2 GLU A 78 6.929 -0.114 3.733 1.00 0.00 H new ATOM 0 HB3 GLU A 78 6.637 0.028 2.010 1.00 0.00 H new ATOM 0 HG2 GLU A 78 4.291 0.920 2.675 1.00 0.00 H new ATOM 0 HG3 GLU A 78 4.958 1.097 4.286 1.00 0.00 H new ATOM 1165 N THR A 79 3.284 -1.594 1.868 1.00 0.00 N ATOM 1166 CA THR A 79 2.377 -1.736 0.736 1.00 0.00 C ATOM 1167 C THR A 79 1.142 -0.860 0.907 1.00 0.00 C ATOM 1168 O THR A 79 0.514 -0.854 1.967 1.00 0.00 O ATOM 1169 CB THR A 79 1.933 -3.200 0.553 1.00 0.00 C ATOM 1170 OG1 THR A 79 3.079 -4.057 0.496 1.00 0.00 O ATOM 1171 CG2 THR A 79 1.110 -3.361 -0.717 1.00 0.00 C ATOM 0 H THR A 79 2.819 -1.474 2.768 1.00 0.00 H new ATOM 0 HA THR A 79 2.925 -1.416 -0.150 1.00 0.00 H new ATOM 0 HB THR A 79 1.314 -3.478 1.406 1.00 0.00 H new ATOM 0 HG1 THR A 79 2.788 -4.986 0.381 1.00 0.00 H new ATOM 0 HG21 THR A 79 0.808 -4.403 -0.825 1.00 0.00 H new ATOM 0 HG22 THR A 79 0.223 -2.730 -0.658 1.00 0.00 H new ATOM 0 HG23 THR A 79 1.709 -3.066 -1.579 1.00 0.00 H new ATOM 1179 N LEU A 80 0.797 -0.121 -0.142 1.00 0.00 N ATOM 1180 CA LEU A 80 -0.365 0.760 -0.108 1.00 0.00 C ATOM 1181 C LEU A 80 -1.323 0.443 -1.252 1.00 0.00 C ATOM 1182 O LEU A 80 -0.895 0.128 -2.362 1.00 0.00 O ATOM 1183 CB LEU A 80 0.076 2.223 -0.188 1.00 0.00 C ATOM 1184 CG LEU A 80 0.975 2.589 -1.370 1.00 0.00 C ATOM 1185 CD1 LEU A 80 0.145 2.797 -2.627 1.00 0.00 C ATOM 1186 CD2 LEU A 80 1.790 3.834 -1.055 1.00 0.00 C ATOM 0 H LEU A 80 1.305 -0.114 -1.026 1.00 0.00 H new ATOM 0 HA LEU A 80 -0.887 0.595 0.835 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -0.816 2.849 -0.228 1.00 0.00 H new ATOM 0 HB3 LEU A 80 0.601 2.474 0.734 1.00 0.00 H new ATOM 0 HG LEU A 80 1.664 1.763 -1.547 1.00 0.00 H new ATOM 0 HD11 LEU A 80 0.801 3.057 -3.458 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -0.394 1.879 -2.863 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -0.569 3.604 -2.462 1.00 0.00 H new ATOM 0 HD21 LEU A 80 2.424 4.079 -1.907 1.00 0.00 H new ATOM 0 HD22 LEU A 80 1.117 4.667 -0.851 1.00 0.00 H new ATOM 0 HD23 LEU A 80 2.414 3.649 -0.181 1.00 0.00 H new ATOM 1198 N GLU A 81 -2.620 0.530 -0.972 1.00 0.00 N ATOM 1199 CA GLU A 81 -3.637 0.252 -1.979 1.00 0.00 C ATOM 1200 C GLU A 81 -4.718 1.330 -1.972 1.00 0.00 C ATOM 1201 O GLU A 81 -5.602 1.352 -1.115 1.00 0.00 O ATOM 1202 CB GLU A 81 -4.268 -1.120 -1.734 1.00 0.00 C ATOM 1203 CG GLU A 81 -5.511 -1.376 -2.570 1.00 0.00 C ATOM 1204 CD GLU A 81 -5.187 -1.664 -4.023 1.00 0.00 C ATOM 1205 OE1 GLU A 81 -4.258 -1.026 -4.561 1.00 0.00 O ATOM 1206 OE2 GLU A 81 -5.863 -2.526 -4.623 1.00 0.00 O ATOM 0 H GLU A 81 -2.990 0.790 -0.058 1.00 0.00 H new ATOM 0 HA GLU A 81 -3.154 0.252 -2.956 1.00 0.00 H new ATOM 0 HB2 GLU A 81 -3.530 -1.893 -1.949 1.00 0.00 H new ATOM 0 HB3 GLU A 81 -4.525 -1.209 -0.679 1.00 0.00 H new ATOM 0 HG2 GLU A 81 -6.060 -2.219 -2.150 1.00 0.00 H new ATOM 0 HG3 GLU A 81 -6.168 -0.508 -2.513 1.00 0.00 H new ATOM 1213 N PRO A 82 -4.646 2.246 -2.949 1.00 0.00 N ATOM 1214 CA PRO A 82 -5.609 3.344 -3.077 1.00 0.00 C ATOM 1215 C PRO A 82 -6.990 2.856 -3.502 1.00 0.00 C ATOM 1216 O PRO A 82 -8.005 3.458 -3.153 1.00 0.00 O ATOM 1217 CB PRO A 82 -4.996 4.228 -4.166 1.00 0.00 C ATOM 1218 CG PRO A 82 -4.147 3.305 -4.970 1.00 0.00 C ATOM 1219 CD PRO A 82 -3.619 2.281 -4.004 1.00 0.00 C ATOM 0 HA PRO A 82 -5.768 3.860 -2.130 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -5.768 4.692 -4.780 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -4.404 5.035 -3.734 1.00 0.00 H new ATOM 0 HG2 PRO A 82 -4.727 2.832 -5.762 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -3.331 3.845 -5.451 1.00 0.00 H new ATOM 0 HD2 PRO A 82 -3.496 1.307 -4.478 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -2.645 2.567 -3.607 1.00 0.00 H new ATOM 1227 N ASN A 83 -7.021 1.762 -4.255 1.00 0.00 N ATOM 1228 CA ASN A 83 -8.278 1.193 -4.727 1.00 0.00 C ATOM 1229 C ASN A 83 -9.359 1.299 -3.656 1.00 0.00 C ATOM 1230 O ASN A 83 -10.350 2.007 -3.828 1.00 0.00 O ATOM 1231 CB ASN A 83 -8.082 -0.270 -5.127 1.00 0.00 C ATOM 1232 CG ASN A 83 -7.674 -0.423 -6.580 1.00 0.00 C ATOM 1233 OD1 ASN A 83 -8.494 -0.755 -7.435 1.00 0.00 O ATOM 1234 ND2 ASN A 83 -6.399 -0.182 -6.864 1.00 0.00 N ATOM 0 H ASN A 83 -6.189 1.251 -4.552 1.00 0.00 H new ATOM 0 HA ASN A 83 -8.600 1.761 -5.600 1.00 0.00 H new ATOM 0 HB2 ASN A 83 -7.320 -0.719 -4.489 1.00 0.00 H new ATOM 0 HB3 ASN A 83 -9.008 -0.819 -4.953 1.00 0.00 H new ATOM 0 HD21 ASN A 83 -6.065 -0.270 -7.824 1.00 0.00 H new ATOM 0 HD22 ASN A 83 -5.754 0.091 -6.122 1.00 0.00 H new ATOM 1241 N ASN A 84 -9.160 0.590 -2.550 1.00 0.00 N ATOM 1242 CA ASN A 84 -10.117 0.604 -1.450 1.00 0.00 C ATOM 1243 C ASN A 84 -9.399 0.595 -0.104 1.00 0.00 C ATOM 1244 O ASN A 84 -8.169 0.564 -0.044 1.00 0.00 O ATOM 1245 CB ASN A 84 -11.056 -0.601 -1.548 1.00 0.00 C ATOM 1246 CG ASN A 84 -12.111 -0.425 -2.623 1.00 0.00 C ATOM 1247 OD1 ASN A 84 -13.105 0.273 -2.424 1.00 0.00 O ATOM 1248 ND2 ASN A 84 -11.899 -1.061 -3.769 1.00 0.00 N ATOM 0 H ASN A 84 -8.344 -0.002 -2.392 1.00 0.00 H new ATOM 0 HA ASN A 84 -10.703 1.520 -1.523 1.00 0.00 H new ATOM 0 HB2 ASN A 84 -10.472 -1.497 -1.759 1.00 0.00 H new ATOM 0 HB3 ASN A 84 -11.544 -0.757 -0.586 1.00 0.00 H new ATOM 0 HD21 ASN A 84 -12.575 -0.982 -4.529 1.00 0.00 H new ATOM 0 HD22 ASN A 84 -11.060 -1.629 -3.890 1.00 0.00 H new ATOM 1255 N LEU A 85 -10.175 0.621 0.974 1.00 0.00 N ATOM 1256 CA LEU A 85 -9.614 0.615 2.321 1.00 0.00 C ATOM 1257 C LEU A 85 -9.478 -0.810 2.848 1.00 0.00 C ATOM 1258 O LEU A 85 -9.555 -1.045 4.054 1.00 0.00 O ATOM 1259 CB LEU A 85 -10.492 1.439 3.264 1.00 0.00 C ATOM 1260 CG LEU A 85 -11.121 2.699 2.667 1.00 0.00 C ATOM 1261 CD1 LEU A 85 -12.335 3.125 3.478 1.00 0.00 C ATOM 1262 CD2 LEU A 85 -10.100 3.824 2.600 1.00 0.00 C ATOM 0 H LEU A 85 -11.194 0.646 0.942 1.00 0.00 H new ATOM 0 HA LEU A 85 -8.621 1.062 2.277 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -11.292 0.799 3.635 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -9.891 1.730 4.126 1.00 0.00 H new ATOM 0 HG LEU A 85 -11.449 2.473 1.652 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -12.769 4.023 3.038 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -13.075 2.324 3.473 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -12.032 3.333 4.504 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -10.565 4.712 2.173 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -9.741 4.050 3.604 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -9.261 3.517 1.975 1.00 0.00 H new ATOM 1274 N TRP A 86 -9.275 -1.755 1.938 1.00 0.00 N ATOM 1275 CA TRP A 86 -9.127 -3.157 2.312 1.00 0.00 C ATOM 1276 C TRP A 86 -8.057 -3.836 1.464 1.00 0.00 C ATOM 1277 O TRP A 86 -7.943 -3.574 0.266 1.00 0.00 O ATOM 1278 CB TRP A 86 -10.460 -3.891 2.158 1.00 0.00 C ATOM 1279 CG TRP A 86 -10.926 -3.983 0.737 1.00 0.00 C ATOM 1280 CD1 TRP A 86 -11.773 -3.125 0.095 1.00 0.00 C ATOM 1281 CD2 TRP A 86 -10.574 -4.991 -0.217 1.00 0.00 C ATOM 1282 NE1 TRP A 86 -11.968 -3.539 -1.201 1.00 0.00 N ATOM 1283 CE2 TRP A 86 -11.242 -4.681 -1.417 1.00 0.00 C ATOM 1284 CE3 TRP A 86 -9.757 -6.124 -0.175 1.00 0.00 C ATOM 1285 CZ2 TRP A 86 -11.119 -5.464 -2.562 1.00 0.00 C ATOM 1286 CZ3 TRP A 86 -9.635 -6.901 -1.311 1.00 0.00 C ATOM 1287 CH2 TRP A 86 -10.313 -6.568 -2.492 1.00 0.00 C ATOM 0 H TRP A 86 -9.209 -1.576 0.936 1.00 0.00 H new ATOM 0 HA TRP A 86 -8.817 -3.198 3.356 1.00 0.00 H new ATOM 0 HB2 TRP A 86 -10.362 -4.897 2.567 1.00 0.00 H new ATOM 0 HB3 TRP A 86 -11.219 -3.379 2.749 1.00 0.00 H new ATOM 0 HD1 TRP A 86 -12.223 -2.250 0.540 1.00 0.00 H new ATOM 0 HE1 TRP A 86 -12.557 -3.072 -1.890 1.00 0.00 H new ATOM 0 HE3 TRP A 86 -9.230 -6.388 0.730 1.00 0.00 H new ATOM 0 HZ2 TRP A 86 -11.641 -5.209 -3.473 1.00 0.00 H new ATOM 0 HZ3 TRP A 86 -9.007 -7.779 -1.289 1.00 0.00 H new ATOM 0 HH2 TRP A 86 -10.197 -7.195 -3.364 1.00 0.00 H new ATOM 1298 N TYR A 87 -7.277 -4.709 2.091 1.00 0.00 N ATOM 1299 CA TYR A 87 -6.215 -5.424 1.394 1.00 0.00 C ATOM 1300 C TYR A 87 -6.235 -6.908 1.745 1.00 0.00 C ATOM 1301 O TYR A 87 -6.057 -7.286 2.904 1.00 0.00 O ATOM 1302 CB TYR A 87 -4.852 -4.824 1.744 1.00 0.00 C ATOM 1303 CG TYR A 87 -3.782 -5.111 0.715 1.00 0.00 C ATOM 1304 CD1 TYR A 87 -3.131 -6.338 0.684 1.00 0.00 C ATOM 1305 CD2 TYR A 87 -3.421 -4.154 -0.227 1.00 0.00 C ATOM 1306 CE1 TYR A 87 -2.152 -6.604 -0.254 1.00 0.00 C ATOM 1307 CE2 TYR A 87 -2.445 -4.412 -1.169 1.00 0.00 C ATOM 1308 CZ TYR A 87 -1.813 -5.638 -1.178 1.00 0.00 C ATOM 1309 OH TYR A 87 -0.838 -5.899 -2.115 1.00 0.00 O ATOM 0 H TYR A 87 -7.360 -4.939 3.081 1.00 0.00 H new ATOM 0 HA TYR A 87 -6.386 -5.321 0.322 1.00 0.00 H new ATOM 0 HB2 TYR A 87 -4.957 -3.745 1.855 1.00 0.00 H new ATOM 0 HB3 TYR A 87 -4.530 -5.214 2.709 1.00 0.00 H new ATOM 0 HD1 TYR A 87 -3.395 -7.097 1.406 1.00 0.00 H new ATOM 0 HD2 TYR A 87 -3.912 -3.192 -0.222 1.00 0.00 H new ATOM 0 HE1 TYR A 87 -1.655 -7.563 -0.264 1.00 0.00 H new ATOM 0 HE2 TYR A 87 -2.178 -3.658 -1.895 1.00 0.00 H new ATOM 0 HH TYR A 87 -0.720 -5.115 -2.691 1.00 0.00 H new ATOM 1319 N LEU A 88 -6.453 -7.745 0.737 1.00 0.00 N ATOM 1320 CA LEU A 88 -6.496 -9.190 0.938 1.00 0.00 C ATOM 1321 C LEU A 88 -5.143 -9.823 0.630 1.00 0.00 C ATOM 1322 O LEU A 88 -4.729 -9.896 -0.527 1.00 0.00 O ATOM 1323 CB LEU A 88 -7.577 -9.815 0.054 1.00 0.00 C ATOM 1324 CG LEU A 88 -8.038 -11.218 0.449 1.00 0.00 C ATOM 1325 CD1 LEU A 88 -6.842 -12.112 0.737 1.00 0.00 C ATOM 1326 CD2 LEU A 88 -8.962 -11.156 1.657 1.00 0.00 C ATOM 0 H LEU A 88 -6.603 -7.449 -0.227 1.00 0.00 H new ATOM 0 HA LEU A 88 -6.735 -9.380 1.984 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -8.445 -9.155 0.055 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -7.205 -9.851 -0.970 1.00 0.00 H new ATOM 0 HG LEU A 88 -8.593 -11.645 -0.386 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -7.190 -13.106 1.016 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -6.218 -12.183 -0.154 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -6.260 -11.688 1.555 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -9.280 -12.164 1.924 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -8.432 -10.708 2.498 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -9.836 -10.552 1.416 1.00 0.00 H new ATOM 1338 N PHE A 89 -4.459 -10.281 1.673 1.00 0.00 N ATOM 1339 CA PHE A 89 -3.153 -10.910 1.515 1.00 0.00 C ATOM 1340 C PHE A 89 -3.291 -12.424 1.382 1.00 0.00 C ATOM 1341 O PHE A 89 -4.157 -13.038 2.006 1.00 0.00 O ATOM 1342 CB PHE A 89 -2.252 -10.571 2.704 1.00 0.00 C ATOM 1343 CG PHE A 89 -1.744 -9.158 2.687 1.00 0.00 C ATOM 1344 CD1 PHE A 89 -0.582 -8.834 2.007 1.00 0.00 C ATOM 1345 CD2 PHE A 89 -2.429 -8.154 3.353 1.00 0.00 C ATOM 1346 CE1 PHE A 89 -0.111 -7.534 1.989 1.00 0.00 C ATOM 1347 CE2 PHE A 89 -1.964 -6.852 3.338 1.00 0.00 C ATOM 1348 CZ PHE A 89 -0.803 -6.542 2.657 1.00 0.00 C ATOM 0 H PHE A 89 -4.788 -10.228 2.637 1.00 0.00 H new ATOM 0 HA PHE A 89 -2.699 -10.523 0.603 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -2.805 -10.739 3.628 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -1.403 -11.254 2.712 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -0.037 -9.606 1.484 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -3.336 -8.391 3.889 1.00 0.00 H new ATOM 0 HE1 PHE A 89 0.796 -7.295 1.454 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -2.508 -6.078 3.858 1.00 0.00 H new ATOM 0 HZ PHE A 89 -0.437 -5.526 2.647 1.00 0.00 H new ATOM 1358 N THR A 90 -2.430 -13.021 0.564 1.00 0.00 N ATOM 1359 CA THR A 90 -2.455 -14.462 0.346 1.00 0.00 C ATOM 1360 C THR A 90 -1.044 -15.035 0.290 1.00 0.00 C ATOM 1361 O THR A 90 -0.078 -14.310 0.053 1.00 0.00 O ATOM 1362 CB THR A 90 -3.195 -14.821 -0.956 1.00 0.00 C ATOM 1363 OG1 THR A 90 -2.639 -14.088 -2.053 1.00 0.00 O ATOM 1364 CG2 THR A 90 -4.680 -14.515 -0.836 1.00 0.00 C ATOM 0 H THR A 90 -1.706 -12.528 0.041 1.00 0.00 H new ATOM 0 HA THR A 90 -2.988 -14.899 1.190 1.00 0.00 H new ATOM 0 HB THR A 90 -3.074 -15.889 -1.135 1.00 0.00 H new ATOM 0 HG1 THR A 90 -3.114 -14.323 -2.878 1.00 0.00 H new ATOM 0 HG21 THR A 90 -5.182 -14.777 -1.768 1.00 0.00 H new ATOM 0 HG22 THR A 90 -5.106 -15.096 -0.018 1.00 0.00 H new ATOM 0 HG23 THR A 90 -4.818 -13.452 -0.636 1.00 0.00 H new ATOM 1372 N GLY A 91 -0.930 -16.341 0.509 1.00 0.00 N ATOM 1373 CA GLY A 91 0.368 -16.989 0.478 1.00 0.00 C ATOM 1374 C GLY A 91 1.113 -16.858 1.791 1.00 0.00 C ATOM 1375 O GLY A 91 2.239 -16.362 1.828 1.00 0.00 O ATOM 0 H GLY A 91 -1.714 -16.962 0.708 1.00 0.00 H new ATOM 0 HA2 GLY A 91 0.238 -18.045 0.242 1.00 0.00 H new ATOM 0 HA3 GLY A 91 0.968 -16.555 -0.322 1.00 0.00 H new ATOM 1379 N LEU A 92 0.483 -17.303 2.873 1.00 0.00 N ATOM 1380 CA LEU A 92 1.093 -17.231 4.197 1.00 0.00 C ATOM 1381 C LEU A 92 1.383 -18.627 4.739 1.00 0.00 C ATOM 1382 O LEU A 92 0.860 -19.620 4.233 1.00 0.00 O ATOM 1383 CB LEU A 92 0.177 -16.477 5.162 1.00 0.00 C ATOM 1384 CG LEU A 92 -0.380 -15.146 4.657 1.00 0.00 C ATOM 1385 CD1 LEU A 92 -1.412 -14.596 5.629 1.00 0.00 C ATOM 1386 CD2 LEU A 92 0.745 -14.143 4.447 1.00 0.00 C ATOM 0 H LEU A 92 -0.449 -17.717 2.860 1.00 0.00 H new ATOM 0 HA LEU A 92 2.037 -16.693 4.107 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -0.661 -17.125 5.417 1.00 0.00 H new ATOM 0 HB3 LEU A 92 0.728 -16.291 6.084 1.00 0.00 H new ATOM 0 HG LEU A 92 -0.870 -15.319 3.699 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -1.797 -13.648 5.253 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -2.232 -15.307 5.730 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -0.947 -14.438 6.602 1.00 0.00 H new ATOM 0 HD21 LEU A 92 0.330 -13.201 4.087 1.00 0.00 H new ATOM 0 HD22 LEU A 92 1.263 -13.974 5.391 1.00 0.00 H new ATOM 0 HD23 LEU A 92 1.448 -14.534 3.712 1.00 0.00 H new ATOM 1398 N GLU A 93 2.218 -18.695 5.771 1.00 0.00 N ATOM 1399 CA GLU A 93 2.575 -19.970 6.382 1.00 0.00 C ATOM 1400 C GLU A 93 1.546 -20.377 7.432 1.00 0.00 C ATOM 1401 O GLU A 93 0.920 -19.528 8.067 1.00 0.00 O ATOM 1402 CB GLU A 93 3.964 -19.883 7.019 1.00 0.00 C ATOM 1403 CG GLU A 93 5.095 -20.217 6.061 1.00 0.00 C ATOM 1404 CD GLU A 93 5.209 -21.705 5.789 1.00 0.00 C ATOM 1405 OE1 GLU A 93 4.483 -22.204 4.904 1.00 0.00 O ATOM 1406 OE2 GLU A 93 6.026 -22.369 6.460 1.00 0.00 O ATOM 0 H GLU A 93 2.660 -17.883 6.201 1.00 0.00 H new ATOM 0 HA GLU A 93 2.589 -20.729 5.599 1.00 0.00 H new ATOM 0 HB2 GLU A 93 4.114 -18.876 7.408 1.00 0.00 H new ATOM 0 HB3 GLU A 93 4.007 -20.563 7.870 1.00 0.00 H new ATOM 0 HG2 GLU A 93 4.936 -19.691 5.120 1.00 0.00 H new ATOM 0 HG3 GLU A 93 6.036 -19.854 6.475 1.00 0.00 H new ATOM 1413 N LYS A 94 1.377 -21.683 7.610 1.00 0.00 N ATOM 1414 CA LYS A 94 0.425 -22.206 8.583 1.00 0.00 C ATOM 1415 C LYS A 94 1.062 -22.312 9.964 1.00 0.00 C ATOM 1416 O LYS A 94 2.260 -22.563 10.089 1.00 0.00 O ATOM 1417 CB LYS A 94 -0.087 -23.578 8.139 1.00 0.00 C ATOM 1418 CG LYS A 94 0.908 -24.702 8.368 1.00 0.00 C ATOM 1419 CD LYS A 94 0.301 -26.058 8.048 1.00 0.00 C ATOM 1420 CE LYS A 94 0.423 -26.387 6.568 1.00 0.00 C ATOM 1421 NZ LYS A 94 1.728 -27.029 6.248 1.00 0.00 N ATOM 0 H LYS A 94 1.887 -22.399 7.093 1.00 0.00 H new ATOM 0 HA LYS A 94 -0.414 -21.513 8.642 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -1.008 -23.804 8.677 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -0.338 -23.537 7.079 1.00 0.00 H new ATOM 0 HG2 LYS A 94 1.789 -24.541 7.747 1.00 0.00 H new ATOM 0 HG3 LYS A 94 1.242 -24.688 9.405 1.00 0.00 H new ATOM 0 HD2 LYS A 94 0.799 -26.829 8.636 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -0.750 -26.065 8.338 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -0.390 -27.052 6.276 1.00 0.00 H new ATOM 0 HE3 LYS A 94 0.314 -25.474 5.983 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 1.772 -27.237 5.230 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 2.504 -26.385 6.503 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 1.821 -27.914 6.787 1.00 0.00 H new ATOM 1435 N GLY A 95 0.252 -22.121 11.001 1.00 0.00 N ATOM 1436 CA GLY A 95 0.755 -22.200 12.360 1.00 0.00 C ATOM 1437 C GLY A 95 1.873 -21.211 12.624 1.00 0.00 C ATOM 1438 O GLY A 95 2.871 -21.547 13.260 1.00 0.00 O ATOM 0 H GLY A 95 -0.744 -21.913 10.924 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -0.062 -22.015 13.058 1.00 0.00 H new ATOM 0 HA3 GLY A 95 1.115 -23.211 12.552 1.00 0.00 H new ATOM 1442 N SER A 96 1.706 -19.987 12.132 1.00 0.00 N ATOM 1443 CA SER A 96 2.712 -18.947 12.313 1.00 0.00 C ATOM 1444 C SER A 96 2.074 -17.657 12.818 1.00 0.00 C ATOM 1445 O SER A 96 0.876 -17.612 13.096 1.00 0.00 O ATOM 1446 CB SER A 96 3.447 -18.685 10.997 1.00 0.00 C ATOM 1447 OG SER A 96 4.351 -19.735 10.700 1.00 0.00 O ATOM 0 H SER A 96 0.884 -19.692 11.605 1.00 0.00 H new ATOM 0 HA SER A 96 3.428 -19.294 13.058 1.00 0.00 H new ATOM 0 HB2 SER A 96 2.724 -18.583 10.187 1.00 0.00 H new ATOM 0 HB3 SER A 96 3.989 -17.741 11.061 1.00 0.00 H new ATOM 0 HG SER A 96 4.807 -19.545 9.854 1.00 0.00 H new ATOM 1453 N GLN A 97 2.885 -16.610 12.935 1.00 0.00 N ATOM 1454 CA GLN A 97 2.400 -15.318 13.408 1.00 0.00 C ATOM 1455 C GLN A 97 2.675 -14.225 12.381 1.00 0.00 C ATOM 1456 O GLN A 97 3.693 -14.251 11.689 1.00 0.00 O ATOM 1457 CB GLN A 97 3.059 -14.959 14.741 1.00 0.00 C ATOM 1458 CG GLN A 97 2.510 -13.688 15.368 1.00 0.00 C ATOM 1459 CD GLN A 97 3.066 -13.435 16.756 1.00 0.00 C ATOM 1460 OE1 GLN A 97 2.199 -13.031 17.676 1.00 0.00 O flip ATOM 1461 NE2 GLN A 97 4.262 -13.600 16.997 1.00 0.00 N flip ATOM 0 H GLN A 97 3.879 -16.631 12.709 1.00 0.00 H new ATOM 0 HA GLN A 97 1.322 -15.393 13.552 1.00 0.00 H new ATOM 0 HB2 GLN A 97 2.924 -15.786 15.438 1.00 0.00 H new ATOM 0 HB3 GLN A 97 4.132 -14.844 14.587 1.00 0.00 H new ATOM 0 HG2 GLN A 97 2.746 -12.839 14.726 1.00 0.00 H new ATOM 0 HG3 GLN A 97 1.423 -13.754 15.422 1.00 0.00 H new ATOM 0 HE21 GLN A 97 4.893 -13.912 16.259 1.00 0.00 H new ATOM 0 HE22 GLN A 97 4.622 -13.425 17.935 1.00 0.00 H new ATOM 1470 N TYR A 98 1.761 -13.265 12.287 1.00 0.00 N ATOM 1471 CA TYR A 98 1.903 -12.164 11.342 1.00 0.00 C ATOM 1472 C TYR A 98 1.358 -10.867 11.932 1.00 0.00 C ATOM 1473 O TYR A 98 0.245 -10.830 12.457 1.00 0.00 O ATOM 1474 CB TYR A 98 1.177 -12.488 10.036 1.00 0.00 C ATOM 1475 CG TYR A 98 1.908 -13.489 9.169 1.00 0.00 C ATOM 1476 CD1 TYR A 98 3.012 -13.110 8.415 1.00 0.00 C ATOM 1477 CD2 TYR A 98 1.494 -14.814 9.105 1.00 0.00 C ATOM 1478 CE1 TYR A 98 3.681 -14.022 7.622 1.00 0.00 C ATOM 1479 CE2 TYR A 98 2.159 -15.733 8.316 1.00 0.00 C ATOM 1480 CZ TYR A 98 3.252 -15.331 7.576 1.00 0.00 C ATOM 1481 OH TYR A 98 3.917 -16.242 6.788 1.00 0.00 O ATOM 0 H TYR A 98 0.914 -13.227 12.854 1.00 0.00 H new ATOM 0 HA TYR A 98 2.965 -12.030 11.135 1.00 0.00 H new ATOM 0 HB2 TYR A 98 0.185 -12.877 10.268 1.00 0.00 H new ATOM 0 HB3 TYR A 98 1.034 -11.567 9.471 1.00 0.00 H new ATOM 0 HD1 TYR A 98 3.353 -12.086 8.450 1.00 0.00 H new ATOM 0 HD2 TYR A 98 0.638 -15.131 9.682 1.00 0.00 H new ATOM 0 HE1 TYR A 98 4.536 -13.711 7.041 1.00 0.00 H new ATOM 0 HE2 TYR A 98 1.825 -16.759 8.279 1.00 0.00 H new ATOM 0 HH TYR A 98 4.786 -15.874 6.524 1.00 0.00 H new ATOM 1491 N SER A 99 2.150 -9.803 11.839 1.00 0.00 N ATOM 1492 CA SER A 99 1.750 -8.504 12.365 1.00 0.00 C ATOM 1493 C SER A 99 1.240 -7.599 11.248 1.00 0.00 C ATOM 1494 O SER A 99 1.572 -7.791 10.078 1.00 0.00 O ATOM 1495 CB SER A 99 2.925 -7.836 13.082 1.00 0.00 C ATOM 1496 OG SER A 99 3.211 -8.486 14.308 1.00 0.00 O ATOM 0 H SER A 99 3.073 -9.816 11.404 1.00 0.00 H new ATOM 0 HA SER A 99 0.941 -8.662 13.078 1.00 0.00 H new ATOM 0 HB2 SER A 99 3.806 -7.858 12.441 1.00 0.00 H new ATOM 0 HB3 SER A 99 2.693 -6.787 13.268 1.00 0.00 H new ATOM 0 HG SER A 99 3.967 -8.041 14.746 1.00 0.00 H new ATOM 1502 N PHE A 100 0.432 -6.611 11.617 1.00 0.00 N ATOM 1503 CA PHE A 100 -0.125 -5.675 10.647 1.00 0.00 C ATOM 1504 C PHE A 100 -0.409 -4.324 11.296 1.00 0.00 C ATOM 1505 O PHE A 100 -0.556 -4.227 12.514 1.00 0.00 O ATOM 1506 CB PHE A 100 -1.411 -6.242 10.041 1.00 0.00 C ATOM 1507 CG PHE A 100 -1.198 -7.510 9.264 1.00 0.00 C ATOM 1508 CD1 PHE A 100 -1.228 -8.741 9.900 1.00 0.00 C ATOM 1509 CD2 PHE A 100 -0.969 -7.472 7.898 1.00 0.00 C ATOM 1510 CE1 PHE A 100 -1.033 -9.910 9.188 1.00 0.00 C ATOM 1511 CE2 PHE A 100 -0.774 -8.637 7.181 1.00 0.00 C ATOM 1512 CZ PHE A 100 -0.805 -9.857 7.827 1.00 0.00 C ATOM 0 H PHE A 100 0.148 -6.437 12.581 1.00 0.00 H new ATOM 0 HA PHE A 100 0.610 -5.531 9.855 1.00 0.00 H new ATOM 0 HB2 PHE A 100 -2.128 -6.431 10.840 1.00 0.00 H new ATOM 0 HB3 PHE A 100 -1.855 -5.493 9.385 1.00 0.00 H new ATOM 0 HD1 PHE A 100 -1.406 -8.788 10.964 1.00 0.00 H new ATOM 0 HD2 PHE A 100 -0.943 -6.521 7.388 1.00 0.00 H new ATOM 0 HE1 PHE A 100 -1.059 -10.863 9.695 1.00 0.00 H new ATOM 0 HE2 PHE A 100 -0.598 -8.593 6.116 1.00 0.00 H new ATOM 0 HZ PHE A 100 -0.651 -10.769 7.269 1.00 0.00 H new ATOM 1522 N GLN A 101 -0.483 -3.283 10.473 1.00 0.00 N ATOM 1523 CA GLN A 101 -0.748 -1.937 10.966 1.00 0.00 C ATOM 1524 C GLN A 101 -1.408 -1.082 9.889 1.00 0.00 C ATOM 1525 O GLN A 101 -1.449 -1.462 8.719 1.00 0.00 O ATOM 1526 CB GLN A 101 0.551 -1.277 11.432 1.00 0.00 C ATOM 1527 CG GLN A 101 1.467 -0.863 10.292 1.00 0.00 C ATOM 1528 CD GLN A 101 2.340 0.325 10.646 1.00 0.00 C ATOM 1529 OE1 GLN A 101 2.216 1.399 10.058 1.00 0.00 O ATOM 1530 NE2 GLN A 101 3.230 0.137 11.614 1.00 0.00 N ATOM 0 H GLN A 101 -0.363 -3.346 9.462 1.00 0.00 H new ATOM 0 HA GLN A 101 -1.432 -2.015 11.811 1.00 0.00 H new ATOM 0 HB2 GLN A 101 0.308 -0.398 12.029 1.00 0.00 H new ATOM 0 HB3 GLN A 101 1.086 -1.968 12.084 1.00 0.00 H new ATOM 0 HG2 GLN A 101 2.101 -1.706 10.016 1.00 0.00 H new ATOM 0 HG3 GLN A 101 0.864 -0.618 9.417 1.00 0.00 H new ATOM 0 HE21 GLN A 101 3.298 -0.770 12.075 1.00 0.00 H new ATOM 0 HE22 GLN A 101 3.845 0.900 11.897 1.00 0.00 H new ATOM 1539 N VAL A 102 -1.923 0.075 10.292 1.00 0.00 N ATOM 1540 CA VAL A 102 -2.581 0.985 9.361 1.00 0.00 C ATOM 1541 C VAL A 102 -2.191 2.432 9.639 1.00 0.00 C ATOM 1542 O VAL A 102 -2.098 2.849 10.793 1.00 0.00 O ATOM 1543 CB VAL A 102 -4.113 0.853 9.436 1.00 0.00 C ATOM 1544 CG1 VAL A 102 -4.779 1.778 8.428 1.00 0.00 C ATOM 1545 CG2 VAL A 102 -4.536 -0.590 9.207 1.00 0.00 C ATOM 0 H VAL A 102 -1.897 0.405 11.257 1.00 0.00 H new ATOM 0 HA VAL A 102 -2.249 0.709 8.360 1.00 0.00 H new ATOM 0 HB VAL A 102 -4.437 1.148 10.434 1.00 0.00 H new ATOM 0 HG11 VAL A 102 -5.862 1.671 8.496 1.00 0.00 H new ATOM 0 HG12 VAL A 102 -4.502 2.810 8.643 1.00 0.00 H new ATOM 0 HG13 VAL A 102 -4.451 1.517 7.422 1.00 0.00 H new ATOM 0 HG21 VAL A 102 -5.622 -0.664 9.264 1.00 0.00 H new ATOM 0 HG22 VAL A 102 -4.201 -0.915 8.222 1.00 0.00 H new ATOM 0 HG23 VAL A 102 -4.089 -1.226 9.971 1.00 0.00 H new ATOM 1555 N SER A 103 -1.966 3.194 8.574 1.00 0.00 N ATOM 1556 CA SER A 103 -1.583 4.595 8.703 1.00 0.00 C ATOM 1557 C SER A 103 -2.317 5.455 7.678 1.00 0.00 C ATOM 1558 O SER A 103 -2.388 5.111 6.499 1.00 0.00 O ATOM 1559 CB SER A 103 -0.072 4.751 8.527 1.00 0.00 C ATOM 1560 OG SER A 103 0.332 4.375 7.222 1.00 0.00 O ATOM 0 H SER A 103 -2.042 2.865 7.612 1.00 0.00 H new ATOM 0 HA SER A 103 -1.862 4.932 9.701 1.00 0.00 H new ATOM 0 HB2 SER A 103 0.214 5.786 8.715 1.00 0.00 H new ATOM 0 HB3 SER A 103 0.448 4.138 9.263 1.00 0.00 H new ATOM 0 HG SER A 103 0.050 3.453 7.045 1.00 0.00 H new ATOM 1566 N ALA A 104 -2.863 6.576 8.139 1.00 0.00 N ATOM 1567 CA ALA A 104 -3.590 7.488 7.264 1.00 0.00 C ATOM 1568 C ALA A 104 -2.642 8.473 6.588 1.00 0.00 C ATOM 1569 O ALA A 104 -1.956 9.246 7.256 1.00 0.00 O ATOM 1570 CB ALA A 104 -4.658 8.234 8.049 1.00 0.00 C ATOM 0 H ALA A 104 -2.816 6.874 9.113 1.00 0.00 H new ATOM 0 HA ALA A 104 -4.073 6.897 6.486 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -5.193 8.911 7.383 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -5.359 7.519 8.479 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -4.188 8.807 8.848 1.00 0.00 H new ATOM 1576 N MET A 105 -2.609 8.439 5.260 1.00 0.00 N ATOM 1577 CA MET A 105 -1.745 9.330 4.495 1.00 0.00 C ATOM 1578 C MET A 105 -2.523 10.543 3.992 1.00 0.00 C ATOM 1579 O MET A 105 -3.657 10.418 3.530 1.00 0.00 O ATOM 1580 CB MET A 105 -1.124 8.583 3.313 1.00 0.00 C ATOM 1581 CG MET A 105 0.206 7.925 3.641 1.00 0.00 C ATOM 1582 SD MET A 105 1.028 7.253 2.183 1.00 0.00 S ATOM 1583 CE MET A 105 -0.302 6.301 1.454 1.00 0.00 C ATOM 0 H MET A 105 -3.170 7.805 4.692 1.00 0.00 H new ATOM 0 HA MET A 105 -0.950 9.678 5.154 1.00 0.00 H new ATOM 0 HB2 MET A 105 -1.822 7.820 2.969 1.00 0.00 H new ATOM 0 HB3 MET A 105 -0.981 9.280 2.488 1.00 0.00 H new ATOM 0 HG2 MET A 105 0.860 8.655 4.118 1.00 0.00 H new ATOM 0 HG3 MET A 105 0.043 7.124 4.362 1.00 0.00 H new ATOM 0 HE1 MET A 105 0.112 5.440 0.930 1.00 0.00 H new ATOM 0 HE2 MET A 105 -0.977 5.958 2.239 1.00 0.00 H new ATOM 0 HE3 MET A 105 -0.852 6.925 0.749 1.00 0.00 H new ATOM 1593 N THR A 106 -1.906 11.717 4.087 1.00 0.00 N ATOM 1594 CA THR A 106 -2.541 12.951 3.644 1.00 0.00 C ATOM 1595 C THR A 106 -1.649 13.708 2.666 1.00 0.00 C ATOM 1596 O THR A 106 -0.528 13.288 2.380 1.00 0.00 O ATOM 1597 CB THR A 106 -2.874 13.870 4.834 1.00 0.00 C ATOM 1598 OG1 THR A 106 -1.703 14.084 5.630 1.00 0.00 O ATOM 1599 CG2 THR A 106 -3.974 13.266 5.693 1.00 0.00 C ATOM 0 H THR A 106 -0.967 11.838 4.467 1.00 0.00 H new ATOM 0 HA THR A 106 -3.467 12.668 3.143 1.00 0.00 H new ATOM 0 HB THR A 106 -3.225 14.824 4.441 1.00 0.00 H new ATOM 0 HG1 THR A 106 -1.807 14.908 6.150 1.00 0.00 H new ATOM 0 HG21 THR A 106 -4.192 13.933 6.527 1.00 0.00 H new ATOM 0 HG22 THR A 106 -4.873 13.132 5.091 1.00 0.00 H new ATOM 0 HG23 THR A 106 -3.647 12.300 6.077 1.00 0.00 H new ATOM 1607 N VAL A 107 -2.154 14.826 2.155 1.00 0.00 N ATOM 1608 CA VAL A 107 -1.402 15.643 1.210 1.00 0.00 C ATOM 1609 C VAL A 107 -0.046 16.038 1.783 1.00 0.00 C ATOM 1610 O VAL A 107 0.857 16.436 1.049 1.00 0.00 O ATOM 1611 CB VAL A 107 -2.178 16.918 0.829 1.00 0.00 C ATOM 1612 CG1 VAL A 107 -2.264 17.866 2.016 1.00 0.00 C ATOM 1613 CG2 VAL A 107 -1.525 17.602 -0.363 1.00 0.00 C ATOM 0 H VAL A 107 -3.081 15.187 2.380 1.00 0.00 H new ATOM 0 HA VAL A 107 -1.253 15.037 0.316 1.00 0.00 H new ATOM 0 HB VAL A 107 -3.192 16.635 0.547 1.00 0.00 H new ATOM 0 HG11 VAL A 107 -2.816 18.761 1.728 1.00 0.00 H new ATOM 0 HG12 VAL A 107 -2.779 17.372 2.840 1.00 0.00 H new ATOM 0 HG13 VAL A 107 -1.259 18.145 2.332 1.00 0.00 H new ATOM 0 HG21 VAL A 107 -2.086 18.501 -0.619 1.00 0.00 H new ATOM 0 HG22 VAL A 107 -0.500 17.873 -0.110 1.00 0.00 H new ATOM 0 HG23 VAL A 107 -1.521 16.922 -1.215 1.00 0.00 H new ATOM 1623 N ASN A 108 0.089 15.925 3.100 1.00 0.00 N ATOM 1624 CA ASN A 108 1.337 16.271 3.773 1.00 0.00 C ATOM 1625 C ASN A 108 2.278 15.071 3.824 1.00 0.00 C ATOM 1626 O ASN A 108 3.383 15.112 3.285 1.00 0.00 O ATOM 1627 CB ASN A 108 1.054 16.772 5.191 1.00 0.00 C ATOM 1628 CG ASN A 108 0.104 17.954 5.207 1.00 0.00 C ATOM 1629 OD1 ASN A 108 0.532 19.109 5.221 1.00 0.00 O ATOM 1630 ND2 ASN A 108 -1.194 17.671 5.206 1.00 0.00 N ATOM 0 H ASN A 108 -0.649 15.597 3.723 1.00 0.00 H new ATOM 0 HA ASN A 108 1.820 17.065 3.204 1.00 0.00 H new ATOM 0 HB2 ASN A 108 0.630 15.960 5.782 1.00 0.00 H new ATOM 0 HB3 ASN A 108 1.992 17.057 5.667 1.00 0.00 H new ATOM 0 HD21 ASN A 108 -1.880 18.425 5.217 1.00 0.00 H new ATOM 0 HD22 ASN A 108 -1.504 16.699 5.194 1.00 0.00 H new ATOM 1637 N GLY A 109 1.831 14.002 4.477 1.00 0.00 N ATOM 1638 CA GLY A 109 2.645 12.806 4.586 1.00 0.00 C ATOM 1639 C GLY A 109 1.868 11.624 5.131 1.00 0.00 C ATOM 1640 O GLY A 109 0.812 11.269 4.605 1.00 0.00 O ATOM 0 H GLY A 109 0.920 13.943 4.932 1.00 0.00 H new ATOM 0 HA2 GLY A 109 3.046 12.552 3.605 1.00 0.00 H new ATOM 0 HA3 GLY A 109 3.497 13.008 5.236 1.00 0.00 H new ATOM 1644 N THR A 110 2.391 11.009 6.187 1.00 0.00 N ATOM 1645 CA THR A 110 1.741 9.859 6.802 1.00 0.00 C ATOM 1646 C THR A 110 1.661 10.016 8.316 1.00 0.00 C ATOM 1647 O THR A 110 2.564 10.570 8.941 1.00 0.00 O ATOM 1648 CB THR A 110 2.485 8.551 6.472 1.00 0.00 C ATOM 1649 OG1 THR A 110 2.872 8.542 5.093 1.00 0.00 O ATOM 1650 CG2 THR A 110 1.610 7.342 6.765 1.00 0.00 C ATOM 0 H THR A 110 3.264 11.289 6.634 1.00 0.00 H new ATOM 0 HA THR A 110 0.733 9.809 6.391 1.00 0.00 H new ATOM 0 HB THR A 110 3.375 8.497 7.100 1.00 0.00 H new ATOM 0 HG1 THR A 110 3.762 8.942 5.000 1.00 0.00 H new ATOM 0 HG21 THR A 110 2.157 6.430 6.524 1.00 0.00 H new ATOM 0 HG22 THR A 110 1.340 7.335 7.821 1.00 0.00 H new ATOM 0 HG23 THR A 110 0.705 7.393 6.160 1.00 0.00 H new ATOM 1658 N GLY A 111 0.572 9.524 8.900 1.00 0.00 N ATOM 1659 CA GLY A 111 0.395 9.620 10.337 1.00 0.00 C ATOM 1660 C GLY A 111 1.103 8.508 11.085 1.00 0.00 C ATOM 1661 O GLY A 111 1.836 7.708 10.502 1.00 0.00 O ATOM 0 H GLY A 111 -0.190 9.061 8.404 1.00 0.00 H new ATOM 0 HA2 GLY A 111 0.771 10.583 10.683 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -0.669 9.591 10.571 1.00 0.00 H new ATOM 1665 N PRO A 112 0.888 8.448 12.407 1.00 0.00 N ATOM 1666 CA PRO A 112 1.504 7.430 13.264 1.00 0.00 C ATOM 1667 C PRO A 112 0.937 6.037 13.009 1.00 0.00 C ATOM 1668 O PRO A 112 -0.247 5.867 12.718 1.00 0.00 O ATOM 1669 CB PRO A 112 1.156 7.899 14.679 1.00 0.00 C ATOM 1670 CG PRO A 112 -0.084 8.708 14.515 1.00 0.00 C ATOM 1671 CD PRO A 112 0.027 9.368 13.168 1.00 0.00 C ATOM 0 HA PRO A 112 2.575 7.338 13.082 1.00 0.00 H new ATOM 0 HB2 PRO A 112 0.992 7.054 15.347 1.00 0.00 H new ATOM 0 HB3 PRO A 112 1.962 8.493 15.109 1.00 0.00 H new ATOM 0 HG2 PRO A 112 -0.971 8.077 14.569 1.00 0.00 H new ATOM 0 HG3 PRO A 112 -0.173 9.451 15.308 1.00 0.00 H new ATOM 0 HD2 PRO A 112 -0.949 9.487 12.697 1.00 0.00 H new ATOM 0 HD3 PRO A 112 0.468 10.362 13.243 1.00 0.00 H new ATOM 1679 N PRO A 113 1.800 5.017 13.121 1.00 0.00 N ATOM 1680 CA PRO A 113 1.407 3.621 12.907 1.00 0.00 C ATOM 1681 C PRO A 113 0.496 3.100 14.013 1.00 0.00 C ATOM 1682 O PRO A 113 0.924 2.930 15.155 1.00 0.00 O ATOM 1683 CB PRO A 113 2.741 2.871 12.916 1.00 0.00 C ATOM 1684 CG PRO A 113 3.652 3.728 13.725 1.00 0.00 C ATOM 1685 CD PRO A 113 3.226 5.147 13.464 1.00 0.00 C ATOM 0 HA PRO A 113 0.838 3.495 11.986 1.00 0.00 H new ATOM 0 HB2 PRO A 113 2.635 1.880 13.357 1.00 0.00 H new ATOM 0 HB3 PRO A 113 3.123 2.731 11.905 1.00 0.00 H new ATOM 0 HG2 PRO A 113 3.576 3.486 14.785 1.00 0.00 H new ATOM 0 HG3 PRO A 113 4.692 3.573 13.437 1.00 0.00 H new ATOM 0 HD2 PRO A 113 3.373 5.778 14.340 1.00 0.00 H new ATOM 0 HD3 PRO A 113 3.796 5.594 12.650 1.00 0.00 H new ATOM 1693 N SER A 114 -0.762 2.847 13.667 1.00 0.00 N ATOM 1694 CA SER A 114 -1.735 2.348 14.632 1.00 0.00 C ATOM 1695 C SER A 114 -1.175 1.155 15.400 1.00 0.00 C ATOM 1696 O SER A 114 -0.215 0.519 14.967 1.00 0.00 O ATOM 1697 CB SER A 114 -3.031 1.950 13.923 1.00 0.00 C ATOM 1698 OG SER A 114 -2.814 0.868 13.034 1.00 0.00 O ATOM 0 H SER A 114 -1.132 2.979 12.726 1.00 0.00 H new ATOM 0 HA SER A 114 -1.949 3.147 15.342 1.00 0.00 H new ATOM 0 HB2 SER A 114 -3.783 1.673 14.662 1.00 0.00 H new ATOM 0 HB3 SER A 114 -3.425 2.804 13.372 1.00 0.00 H new ATOM 0 HG SER A 114 -3.495 0.882 12.329 1.00 0.00 H new ATOM 1704 N ASN A 115 -1.784 0.857 16.544 1.00 0.00 N ATOM 1705 CA ASN A 115 -1.346 -0.260 17.374 1.00 0.00 C ATOM 1706 C ASN A 115 -0.912 -1.441 16.512 1.00 0.00 C ATOM 1707 O ASN A 115 -1.471 -1.680 15.442 1.00 0.00 O ATOM 1708 CB ASN A 115 -2.470 -0.689 18.320 1.00 0.00 C ATOM 1709 CG ASN A 115 -2.829 0.392 19.320 1.00 0.00 C ATOM 1710 OD1 ASN A 115 -1.963 0.926 20.013 1.00 0.00 O ATOM 1711 ND2 ASN A 115 -4.113 0.721 19.399 1.00 0.00 N ATOM 0 H ASN A 115 -2.581 1.373 16.917 1.00 0.00 H new ATOM 0 HA ASN A 115 -0.490 0.070 17.963 1.00 0.00 H new ATOM 0 HB2 ASN A 115 -3.353 -0.948 17.736 1.00 0.00 H new ATOM 0 HB3 ASN A 115 -2.167 -1.589 18.855 1.00 0.00 H new ATOM 0 HD21 ASN A 115 -4.415 1.443 20.054 1.00 0.00 H new ATOM 0 HD22 ASN A 115 -4.797 0.252 18.805 1.00 0.00 H new ATOM 1718 N TRP A 116 0.087 -2.176 16.987 1.00 0.00 N ATOM 1719 CA TRP A 116 0.596 -3.334 16.260 1.00 0.00 C ATOM 1720 C TRP A 116 -0.293 -4.552 16.485 1.00 0.00 C ATOM 1721 O TRP A 116 -0.090 -5.314 17.430 1.00 0.00 O ATOM 1722 CB TRP A 116 2.029 -3.645 16.695 1.00 0.00 C ATOM 1723 CG TRP A 116 3.059 -2.833 15.971 1.00 0.00 C ATOM 1724 CD1 TRP A 116 3.845 -1.848 16.498 1.00 0.00 C ATOM 1725 CD2 TRP A 116 3.414 -2.934 14.588 1.00 0.00 C ATOM 1726 NE1 TRP A 116 4.667 -1.331 15.526 1.00 0.00 N ATOM 1727 CE2 TRP A 116 4.422 -1.980 14.345 1.00 0.00 C ATOM 1728 CE3 TRP A 116 2.979 -3.737 13.531 1.00 0.00 C ATOM 1729 CZ2 TRP A 116 4.999 -1.811 13.089 1.00 0.00 C ATOM 1730 CZ3 TRP A 116 3.552 -3.568 12.285 1.00 0.00 C ATOM 1731 CH2 TRP A 116 4.554 -2.611 12.073 1.00 0.00 C ATOM 0 H TRP A 116 0.560 -1.991 17.871 1.00 0.00 H new ATOM 0 HA TRP A 116 0.590 -3.096 15.196 1.00 0.00 H new ATOM 0 HB2 TRP A 116 2.123 -3.466 17.766 1.00 0.00 H new ATOM 0 HB3 TRP A 116 2.230 -4.704 16.530 1.00 0.00 H new ATOM 0 HD1 TRP A 116 3.823 -1.523 17.528 1.00 0.00 H new ATOM 0 HE1 TRP A 116 5.349 -0.585 15.662 1.00 0.00 H new ATOM 0 HE3 TRP A 116 2.208 -4.477 13.685 1.00 0.00 H new ATOM 0 HZ2 TRP A 116 5.771 -1.074 12.923 1.00 0.00 H new ATOM 0 HZ3 TRP A 116 3.222 -4.183 11.461 1.00 0.00 H new ATOM 0 HH2 TRP A 116 4.983 -2.503 11.088 1.00 0.00 H new ATOM 1742 N TYR A 117 -1.278 -4.730 15.611 1.00 0.00 N ATOM 1743 CA TYR A 117 -2.199 -5.855 15.717 1.00 0.00 C ATOM 1744 C TYR A 117 -1.569 -7.129 15.162 1.00 0.00 C ATOM 1745 O TYR A 117 -0.790 -7.087 14.209 1.00 0.00 O ATOM 1746 CB TYR A 117 -3.499 -5.548 14.971 1.00 0.00 C ATOM 1747 CG TYR A 117 -4.208 -4.311 15.472 1.00 0.00 C ATOM 1748 CD1 TYR A 117 -3.794 -3.043 15.082 1.00 0.00 C ATOM 1749 CD2 TYR A 117 -5.292 -4.409 16.336 1.00 0.00 C ATOM 1750 CE1 TYR A 117 -4.438 -1.909 15.539 1.00 0.00 C ATOM 1751 CE2 TYR A 117 -5.943 -3.281 16.796 1.00 0.00 C ATOM 1752 CZ TYR A 117 -5.512 -2.033 16.395 1.00 0.00 C ATOM 1753 OH TYR A 117 -6.157 -0.907 16.851 1.00 0.00 O ATOM 0 H TYR A 117 -1.459 -4.110 14.822 1.00 0.00 H new ATOM 0 HA TYR A 117 -2.422 -6.012 16.772 1.00 0.00 H new ATOM 0 HB2 TYR A 117 -3.279 -5.426 13.910 1.00 0.00 H new ATOM 0 HB3 TYR A 117 -4.170 -6.402 15.061 1.00 0.00 H new ATOM 0 HD1 TYR A 117 -2.954 -2.942 14.410 1.00 0.00 H new ATOM 0 HD2 TYR A 117 -5.631 -5.384 16.653 1.00 0.00 H new ATOM 0 HE1 TYR A 117 -4.102 -0.931 15.227 1.00 0.00 H new ATOM 0 HE2 TYR A 117 -6.785 -3.375 17.466 1.00 0.00 H new ATOM 0 HH TYR A 117 -6.892 -1.169 17.444 1.00 0.00 H new ATOM 1763 N THR A 118 -1.913 -8.263 15.765 1.00 0.00 N ATOM 1764 CA THR A 118 -1.382 -9.549 15.333 1.00 0.00 C ATOM 1765 C THR A 118 -2.487 -10.595 15.234 1.00 0.00 C ATOM 1766 O THR A 118 -3.471 -10.543 15.972 1.00 0.00 O ATOM 1767 CB THR A 118 -0.293 -10.059 16.295 1.00 0.00 C ATOM 1768 OG1 THR A 118 0.662 -9.022 16.547 1.00 0.00 O ATOM 1769 CG2 THR A 118 0.413 -11.276 15.717 1.00 0.00 C ATOM 0 H THR A 118 -2.557 -8.316 16.554 1.00 0.00 H new ATOM 0 HA THR A 118 -0.942 -9.394 14.348 1.00 0.00 H new ATOM 0 HB THR A 118 -0.772 -10.347 17.231 1.00 0.00 H new ATOM 0 HG1 THR A 118 1.350 -9.353 17.161 1.00 0.00 H new ATOM 0 HG21 THR A 118 1.178 -11.618 16.414 1.00 0.00 H new ATOM 0 HG22 THR A 118 -0.312 -12.073 15.553 1.00 0.00 H new ATOM 0 HG23 THR A 118 0.880 -11.010 14.769 1.00 0.00 H new ATOM 1777 N ALA A 119 -2.318 -11.543 14.319 1.00 0.00 N ATOM 1778 CA ALA A 119 -3.300 -12.603 14.126 1.00 0.00 C ATOM 1779 C ALA A 119 -2.623 -13.921 13.768 1.00 0.00 C ATOM 1780 O ALA A 119 -1.758 -13.967 12.894 1.00 0.00 O ATOM 1781 CB ALA A 119 -4.297 -12.209 13.046 1.00 0.00 C ATOM 0 H ALA A 119 -1.510 -11.599 13.699 1.00 0.00 H new ATOM 0 HA ALA A 119 -3.835 -12.743 15.065 1.00 0.00 H new ATOM 0 HB1 ALA A 119 -5.024 -13.010 12.913 1.00 0.00 H new ATOM 0 HB2 ALA A 119 -4.813 -11.296 13.343 1.00 0.00 H new ATOM 0 HB3 ALA A 119 -3.769 -12.039 12.108 1.00 0.00 H new ATOM 1787 N GLU A 120 -3.021 -14.991 14.450 1.00 0.00 N ATOM 1788 CA GLU A 120 -2.450 -16.310 14.203 1.00 0.00 C ATOM 1789 C GLU A 120 -3.282 -17.081 13.182 1.00 0.00 C ATOM 1790 O GLU A 120 -4.495 -17.227 13.336 1.00 0.00 O ATOM 1791 CB GLU A 120 -2.360 -17.103 15.508 1.00 0.00 C ATOM 1792 CG GLU A 120 -1.350 -16.541 16.494 1.00 0.00 C ATOM 1793 CD GLU A 120 -1.584 -17.028 17.911 1.00 0.00 C ATOM 1794 OE1 GLU A 120 -1.715 -18.256 18.101 1.00 0.00 O ATOM 1795 OE2 GLU A 120 -1.635 -16.184 18.829 1.00 0.00 O ATOM 0 H GLU A 120 -3.736 -14.970 15.177 1.00 0.00 H new ATOM 0 HA GLU A 120 -1.447 -16.174 13.799 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -3.343 -17.123 15.979 1.00 0.00 H new ATOM 0 HB3 GLU A 120 -2.095 -18.135 15.278 1.00 0.00 H new ATOM 0 HG2 GLU A 120 -0.345 -16.822 16.179 1.00 0.00 H new ATOM 0 HG3 GLU A 120 -1.397 -15.452 16.476 1.00 0.00 H new ATOM 1802 N THR A 121 -2.621 -17.572 12.138 1.00 0.00 N ATOM 1803 CA THR A 121 -3.298 -18.326 11.091 1.00 0.00 C ATOM 1804 C THR A 121 -3.653 -19.730 11.566 1.00 0.00 C ATOM 1805 O THR A 121 -2.906 -20.367 12.310 1.00 0.00 O ATOM 1806 CB THR A 121 -2.431 -18.429 9.823 1.00 0.00 C ATOM 1807 OG1 THR A 121 -1.245 -19.182 10.100 1.00 0.00 O ATOM 1808 CG2 THR A 121 -2.052 -17.048 9.312 1.00 0.00 C ATOM 0 H THR A 121 -1.617 -17.461 11.996 1.00 0.00 H new ATOM 0 HA THR A 121 -4.213 -17.784 10.853 1.00 0.00 H new ATOM 0 HB THR A 121 -3.012 -18.937 9.053 1.00 0.00 H new ATOM 0 HG1 THR A 121 -0.460 -18.680 9.795 1.00 0.00 H new ATOM 0 HG21 THR A 121 -1.440 -17.147 8.416 1.00 0.00 H new ATOM 0 HG22 THR A 121 -2.956 -16.487 9.074 1.00 0.00 H new ATOM 0 HG23 THR A 121 -1.488 -16.518 10.080 1.00 0.00 H new ATOM 1816 N PRO A 122 -4.819 -20.227 11.129 1.00 0.00 N ATOM 1817 CA PRO A 122 -5.299 -21.562 11.497 1.00 0.00 C ATOM 1818 C PRO A 122 -4.473 -22.672 10.855 1.00 0.00 C ATOM 1819 O PRO A 122 -4.328 -22.722 9.634 1.00 0.00 O ATOM 1820 CB PRO A 122 -6.733 -21.585 10.961 1.00 0.00 C ATOM 1821 CG PRO A 122 -6.736 -20.597 9.846 1.00 0.00 C ATOM 1822 CD PRO A 122 -5.760 -19.523 10.241 1.00 0.00 C ATOM 0 HA PRO A 122 -5.228 -21.739 12.570 1.00 0.00 H new ATOM 0 HB2 PRO A 122 -7.008 -22.579 10.610 1.00 0.00 H new ATOM 0 HB3 PRO A 122 -7.450 -21.311 11.735 1.00 0.00 H new ATOM 0 HG2 PRO A 122 -6.441 -21.067 8.908 1.00 0.00 H new ATOM 0 HG3 PRO A 122 -7.733 -20.182 9.695 1.00 0.00 H new ATOM 0 HD2 PRO A 122 -5.254 -19.101 9.373 1.00 0.00 H new ATOM 0 HD3 PRO A 122 -6.256 -18.698 10.753 1.00 0.00 H new ATOM 1830 N GLU A 123 -3.935 -23.559 11.685 1.00 0.00 N ATOM 1831 CA GLU A 123 -3.123 -24.668 11.197 1.00 0.00 C ATOM 1832 C GLU A 123 -3.807 -25.368 10.026 1.00 0.00 C ATOM 1833 O GLU A 123 -3.160 -25.738 9.047 1.00 0.00 O ATOM 1834 CB GLU A 123 -2.860 -25.671 12.322 1.00 0.00 C ATOM 1835 CG GLU A 123 -1.608 -25.367 13.127 1.00 0.00 C ATOM 1836 CD GLU A 123 -0.371 -26.032 12.556 1.00 0.00 C ATOM 1837 OE1 GLU A 123 0.218 -25.476 11.606 1.00 0.00 O ATOM 1838 OE2 GLU A 123 0.008 -27.110 13.060 1.00 0.00 O ATOM 0 H GLU A 123 -4.046 -23.532 12.699 1.00 0.00 H new ATOM 0 HA GLU A 123 -2.172 -24.264 10.851 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -3.719 -25.685 12.993 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -2.773 -26.670 11.894 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -1.454 -24.288 13.159 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -1.752 -25.699 14.155 1.00 0.00 H new ATOM 1845 N ASN A 124 -5.120 -25.546 10.135 1.00 0.00 N ATOM 1846 CA ASN A 124 -5.892 -26.203 9.087 1.00 0.00 C ATOM 1847 C ASN A 124 -6.415 -25.185 8.078 1.00 0.00 C ATOM 1848 O ASN A 124 -7.438 -24.540 8.306 1.00 0.00 O ATOM 1849 CB ASN A 124 -7.060 -26.981 9.696 1.00 0.00 C ATOM 1850 CG ASN A 124 -6.643 -28.347 10.205 1.00 0.00 C ATOM 1851 OD1 ASN A 124 -5.835 -29.034 9.579 1.00 0.00 O ATOM 1852 ND2 ASN A 124 -7.193 -28.747 11.345 1.00 0.00 N ATOM 0 H ASN A 124 -5.671 -25.244 10.939 1.00 0.00 H new ATOM 0 HA ASN A 124 -5.233 -26.899 8.567 1.00 0.00 H new ATOM 0 HB2 ASN A 124 -7.487 -26.405 10.517 1.00 0.00 H new ATOM 0 HB3 ASN A 124 -7.844 -27.099 8.948 1.00 0.00 H new ATOM 0 HD21 ASN A 124 -6.951 -29.657 11.736 1.00 0.00 H new ATOM 0 HD22 ASN A 124 -7.858 -28.144 11.830 1.00 0.00 H new TER 1859 ASN A 124