USER MOD reduce.3.24.130724 H: found=0, std=0, add=789, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 787 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 46 TYR OH : rot 50:sc= 0.978 USER MOD Set 1.2: A 70 THR OG1 : rot 168:sc= 0.988 USER MOD Single : A 1 GLY N :NH3+ -109:sc= 0.0399 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 20:sc= 0.178 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 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 SER OG : rot -11:sc= 0.46! USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 LYS NZ :NH3+ -151:sc= -0.164 (180deg=-1.24) USER MOD Single : A 18 LYS NZ :NH3+ -139:sc= 0.0734 (180deg=0) USER MOD Single : A 22 ASN : amide:sc= -0.033 X(o=-0.033,f=0) USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 MET CE :methyl -163:sc= -0.186 (180deg=-0.931) USER MOD Single : A 51 LYS NZ :NH3+ 150:sc= 0.0181 (180deg=-0.865) USER MOD Single : A 53 SER OG : rot -140:sc= -0.157 USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 MET CE :methyl -126:sc= -2.92 (180deg=-8.67!) USER MOD Single : A 77 SER OG : rot 91:sc= 1.1 USER MOD Single : A 78 SER OG : rot -105:sc= -0.0245 USER MOD Single : A 79 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 84 SER OG : rot -110:sc= 0.558 USER MOD Single : A 94 LYS NZ :NH3+ 152:sc= 1.2 (180deg=0.538) USER MOD Single : A 98 ASN : amide:sc= -1.07 K(o=-1.1,f=-6.3!) USER MOD Single : A 101 HIS : no HD1:sc= 0 X(o=0,f=-0.069) USER MOD Single : A 103 SER OG : rot 19:sc= 0.912 USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 54.151 25.641 -3.142 1.00 0.00 N ATOM 2 CA GLY A 1 52.824 25.355 -3.655 1.00 0.00 C ATOM 3 C GLY A 1 52.556 23.868 -3.773 1.00 0.00 C ATOM 4 O GLY A 1 53.480 23.077 -3.959 1.00 0.00 O ATOM 0 H1 GLY A 1 54.076 26.014 -2.174 1.00 0.00 H new ATOM 0 H2 GLY A 1 54.716 24.768 -3.134 1.00 0.00 H new ATOM 0 H3 GLY A 1 54.613 26.347 -3.750 1.00 0.00 H new ATOM 0 HA2 GLY A 1 52.079 25.804 -2.998 1.00 0.00 H new ATOM 0 HA3 GLY A 1 52.708 25.821 -4.634 1.00 0.00 H new ATOM 8 N SER A 2 51.287 23.487 -3.663 1.00 0.00 N ATOM 9 CA SER A 2 50.900 22.084 -3.753 1.00 0.00 C ATOM 10 C SER A 2 49.386 21.945 -3.883 1.00 0.00 C ATOM 11 O SER A 2 48.629 22.730 -3.313 1.00 0.00 O ATOM 12 CB SER A 2 51.389 21.318 -2.522 1.00 0.00 C ATOM 13 OG SER A 2 51.651 19.961 -2.836 1.00 0.00 O ATOM 0 H SER A 2 50.510 24.130 -3.511 1.00 0.00 H new ATOM 0 HA SER A 2 51.365 21.661 -4.644 1.00 0.00 H new ATOM 0 HB2 SER A 2 52.294 21.786 -2.134 1.00 0.00 H new ATOM 0 HB3 SER A 2 50.639 21.374 -1.733 1.00 0.00 H new ATOM 0 HG SER A 2 51.964 19.494 -2.033 1.00 0.00 H new ATOM 19 N SER A 3 48.953 20.941 -4.639 1.00 0.00 N ATOM 20 CA SER A 3 47.530 20.701 -4.848 1.00 0.00 C ATOM 21 C SER A 3 47.251 19.211 -5.020 1.00 0.00 C ATOM 22 O SER A 3 48.169 18.412 -5.198 1.00 0.00 O ATOM 23 CB SER A 3 47.037 21.468 -6.076 1.00 0.00 C ATOM 24 OG SER A 3 46.767 22.822 -5.757 1.00 0.00 O ATOM 0 H SER A 3 49.567 20.281 -5.117 1.00 0.00 H new ATOM 0 HA SER A 3 46.993 21.055 -3.968 1.00 0.00 H new ATOM 0 HB2 SER A 3 47.788 21.420 -6.865 1.00 0.00 H new ATOM 0 HB3 SER A 3 46.135 20.996 -6.466 1.00 0.00 H new ATOM 0 HG SER A 3 47.232 23.062 -4.928 1.00 0.00 H new ATOM 30 N GLY A 4 45.974 18.844 -4.964 1.00 0.00 N ATOM 31 CA GLY A 4 45.595 17.451 -5.115 1.00 0.00 C ATOM 32 C GLY A 4 44.442 17.063 -4.210 1.00 0.00 C ATOM 33 O GLY A 4 44.535 17.185 -2.988 1.00 0.00 O ATOM 0 H GLY A 4 45.195 19.486 -4.817 1.00 0.00 H new ATOM 0 HA2 GLY A 4 45.318 17.263 -6.152 1.00 0.00 H new ATOM 0 HA3 GLY A 4 46.455 16.818 -4.895 1.00 0.00 H new ATOM 37 N SER A 5 43.352 16.596 -4.810 1.00 0.00 N ATOM 38 CA SER A 5 42.174 16.194 -4.050 1.00 0.00 C ATOM 39 C SER A 5 41.572 14.913 -4.619 1.00 0.00 C ATOM 40 O SER A 5 41.454 14.756 -5.834 1.00 0.00 O ATOM 41 CB SER A 5 41.129 17.311 -4.061 1.00 0.00 C ATOM 42 OG SER A 5 40.489 17.399 -5.322 1.00 0.00 O ATOM 0 H SER A 5 43.260 16.487 -5.820 1.00 0.00 H new ATOM 0 HA SER A 5 42.482 16.004 -3.022 1.00 0.00 H new ATOM 0 HB2 SER A 5 40.386 17.126 -3.285 1.00 0.00 H new ATOM 0 HB3 SER A 5 41.606 18.262 -3.825 1.00 0.00 H new ATOM 0 HG SER A 5 39.825 18.119 -5.302 1.00 0.00 H new ATOM 48 N SER A 6 41.192 14.000 -3.731 1.00 0.00 N ATOM 49 CA SER A 6 40.605 12.731 -4.143 1.00 0.00 C ATOM 50 C SER A 6 39.772 12.126 -3.017 1.00 0.00 C ATOM 51 O SER A 6 39.760 12.634 -1.896 1.00 0.00 O ATOM 52 CB SER A 6 41.702 11.751 -4.564 1.00 0.00 C ATOM 53 OG SER A 6 41.217 10.823 -5.519 1.00 0.00 O ATOM 0 H SER A 6 41.280 14.116 -2.721 1.00 0.00 H new ATOM 0 HA SER A 6 39.950 12.921 -4.994 1.00 0.00 H new ATOM 0 HB2 SER A 6 42.545 12.301 -4.982 1.00 0.00 H new ATOM 0 HB3 SER A 6 42.073 11.217 -3.689 1.00 0.00 H new ATOM 0 HG SER A 6 41.937 10.209 -5.773 1.00 0.00 H new ATOM 59 N GLY A 7 39.076 11.036 -3.324 1.00 0.00 N ATOM 60 CA GLY A 7 38.249 10.379 -2.328 1.00 0.00 C ATOM 61 C GLY A 7 36.894 9.974 -2.874 1.00 0.00 C ATOM 62 O GLY A 7 36.751 9.718 -4.070 1.00 0.00 O ATOM 0 H GLY A 7 39.070 10.596 -4.244 1.00 0.00 H new ATOM 0 HA2 GLY A 7 38.767 9.495 -1.957 1.00 0.00 H new ATOM 0 HA3 GLY A 7 38.110 11.047 -1.478 1.00 0.00 H new ATOM 66 N ASP A 8 35.898 9.916 -1.998 1.00 0.00 N ATOM 67 CA ASP A 8 34.547 9.539 -2.399 1.00 0.00 C ATOM 68 C ASP A 8 34.582 8.484 -3.500 1.00 0.00 C ATOM 69 O ASP A 8 33.782 8.520 -4.435 1.00 0.00 O ATOM 70 CB ASP A 8 33.773 10.768 -2.878 1.00 0.00 C ATOM 71 CG ASP A 8 34.635 11.715 -3.690 1.00 0.00 C ATOM 72 OD1 ASP A 8 35.293 12.587 -3.083 1.00 0.00 O ATOM 73 OD2 ASP A 8 34.652 11.584 -4.931 1.00 0.00 O ATOM 0 H ASP A 8 36.000 10.125 -1.005 1.00 0.00 H new ATOM 0 HA ASP A 8 34.041 9.116 -1.531 1.00 0.00 H new ATOM 0 HB2 ASP A 8 32.924 10.447 -3.481 1.00 0.00 H new ATOM 0 HB3 ASP A 8 33.369 11.298 -2.016 1.00 0.00 H new ATOM 78 N LYS A 9 35.515 7.545 -3.383 1.00 0.00 N ATOM 79 CA LYS A 9 35.655 6.478 -4.367 1.00 0.00 C ATOM 80 C LYS A 9 34.832 5.258 -3.968 1.00 0.00 C ATOM 81 O LYS A 9 35.235 4.484 -3.099 1.00 0.00 O ATOM 82 CB LYS A 9 37.127 6.087 -4.519 1.00 0.00 C ATOM 83 CG LYS A 9 37.919 7.031 -5.407 1.00 0.00 C ATOM 84 CD LYS A 9 39.405 6.977 -5.094 1.00 0.00 C ATOM 85 CE LYS A 9 40.035 5.691 -5.606 1.00 0.00 C ATOM 86 NZ LYS A 9 41.514 5.809 -5.730 1.00 0.00 N ATOM 0 H LYS A 9 36.186 7.501 -2.616 1.00 0.00 H new ATOM 0 HA LYS A 9 35.283 6.848 -5.323 1.00 0.00 H new ATOM 0 HB2 LYS A 9 37.590 6.056 -3.533 1.00 0.00 H new ATOM 0 HB3 LYS A 9 37.186 5.079 -4.931 1.00 0.00 H new ATOM 0 HG2 LYS A 9 37.757 6.770 -6.453 1.00 0.00 H new ATOM 0 HG3 LYS A 9 37.555 8.050 -5.273 1.00 0.00 H new ATOM 0 HD2 LYS A 9 39.905 7.834 -5.546 1.00 0.00 H new ATOM 0 HD3 LYS A 9 39.554 7.053 -4.017 1.00 0.00 H new ATOM 0 HE2 LYS A 9 39.792 4.873 -4.929 1.00 0.00 H new ATOM 0 HE3 LYS A 9 39.608 5.439 -6.577 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 41.906 4.912 -6.082 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 41.747 6.573 -6.396 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 41.924 6.024 -4.799 1.00 0.00 H new ATOM 100 N ILE A 10 33.680 5.091 -4.608 1.00 0.00 N ATOM 101 CA ILE A 10 32.803 3.963 -4.321 1.00 0.00 C ATOM 102 C ILE A 10 32.235 3.367 -5.604 1.00 0.00 C ATOM 103 O ILE A 10 31.675 4.081 -6.436 1.00 0.00 O ATOM 104 CB ILE A 10 31.639 4.375 -3.400 1.00 0.00 C ATOM 105 CG1 ILE A 10 32.176 4.904 -2.069 1.00 0.00 C ATOM 106 CG2 ILE A 10 30.703 3.198 -3.170 1.00 0.00 C ATOM 107 CD1 ILE A 10 32.495 6.383 -2.090 1.00 0.00 C ATOM 0 H ILE A 10 33.332 5.723 -5.329 1.00 0.00 H new ATOM 0 HA ILE A 10 33.410 3.213 -3.813 1.00 0.00 H new ATOM 0 HB ILE A 10 31.076 5.172 -3.885 1.00 0.00 H new ATOM 0 HG12 ILE A 10 31.441 4.710 -1.287 1.00 0.00 H new ATOM 0 HG13 ILE A 10 33.077 4.350 -1.804 1.00 0.00 H new ATOM 0 HG21 ILE A 10 29.886 3.505 -2.517 1.00 0.00 H new ATOM 0 HG22 ILE A 10 30.298 2.863 -4.125 1.00 0.00 H new ATOM 0 HG23 ILE A 10 31.253 2.381 -2.703 1.00 0.00 H new ATOM 0 HD11 ILE A 10 32.871 6.688 -1.113 1.00 0.00 H new ATOM 0 HD12 ILE A 10 33.253 6.581 -2.848 1.00 0.00 H new ATOM 0 HD13 ILE A 10 31.592 6.947 -2.324 1.00 0.00 H new ATOM 119 N GLU A 11 32.382 2.055 -5.757 1.00 0.00 N ATOM 120 CA GLU A 11 31.882 1.364 -6.940 1.00 0.00 C ATOM 121 C GLU A 11 30.764 0.393 -6.570 1.00 0.00 C ATOM 122 O GLU A 11 30.804 -0.246 -5.520 1.00 0.00 O ATOM 123 CB GLU A 11 33.018 0.609 -7.635 1.00 0.00 C ATOM 124 CG GLU A 11 33.504 -0.605 -6.862 1.00 0.00 C ATOM 125 CD GLU A 11 34.498 -0.245 -5.774 1.00 0.00 C ATOM 126 OE1 GLU A 11 35.252 0.732 -5.959 1.00 0.00 O ATOM 127 OE2 GLU A 11 34.519 -0.941 -4.738 1.00 0.00 O ATOM 0 H GLU A 11 32.843 1.450 -5.078 1.00 0.00 H new ATOM 0 HA GLU A 11 31.480 2.112 -7.624 1.00 0.00 H new ATOM 0 HB2 GLU A 11 32.681 0.290 -8.621 1.00 0.00 H new ATOM 0 HB3 GLU A 11 33.855 1.290 -7.789 1.00 0.00 H new ATOM 0 HG2 GLU A 11 32.649 -1.112 -6.415 1.00 0.00 H new ATOM 0 HG3 GLU A 11 33.967 -1.310 -7.553 1.00 0.00 H new ATOM 134 N SER A 12 29.766 0.290 -7.443 1.00 0.00 N ATOM 135 CA SER A 12 28.634 -0.598 -7.207 1.00 0.00 C ATOM 136 C SER A 12 27.849 -0.831 -8.495 1.00 0.00 C ATOM 137 O SER A 12 27.369 0.113 -9.123 1.00 0.00 O ATOM 138 CB SER A 12 27.713 -0.012 -6.135 1.00 0.00 C ATOM 139 OG SER A 12 26.753 0.858 -6.707 1.00 0.00 O ATOM 0 H SER A 12 29.719 0.810 -8.319 1.00 0.00 H new ATOM 0 HA SER A 12 29.022 -1.555 -6.859 1.00 0.00 H new ATOM 0 HB2 SER A 12 27.207 -0.819 -5.605 1.00 0.00 H new ATOM 0 HB3 SER A 12 28.306 0.530 -5.398 1.00 0.00 H new ATOM 0 HG SER A 12 26.986 1.033 -7.643 1.00 0.00 H new ATOM 145 N LYS A 13 27.723 -2.095 -8.883 1.00 0.00 N ATOM 146 CA LYS A 13 26.996 -2.455 -10.094 1.00 0.00 C ATOM 147 C LYS A 13 25.939 -3.515 -9.800 1.00 0.00 C ATOM 148 O LYS A 13 26.245 -4.706 -9.723 1.00 0.00 O ATOM 149 CB LYS A 13 27.965 -2.969 -11.162 1.00 0.00 C ATOM 150 CG LYS A 13 28.830 -1.880 -11.772 1.00 0.00 C ATOM 151 CD LYS A 13 29.302 -2.258 -13.166 1.00 0.00 C ATOM 152 CE LYS A 13 28.175 -2.153 -14.183 1.00 0.00 C ATOM 153 NZ LYS A 13 28.684 -2.199 -15.582 1.00 0.00 N ATOM 0 H LYS A 13 28.115 -2.888 -8.376 1.00 0.00 H new ATOM 0 HA LYS A 13 26.495 -1.561 -10.466 1.00 0.00 H new ATOM 0 HB2 LYS A 13 28.610 -3.729 -10.720 1.00 0.00 H new ATOM 0 HB3 LYS A 13 27.395 -3.455 -11.954 1.00 0.00 H new ATOM 0 HG2 LYS A 13 28.265 -0.949 -11.818 1.00 0.00 H new ATOM 0 HG3 LYS A 13 29.693 -1.698 -11.132 1.00 0.00 H new ATOM 0 HD2 LYS A 13 30.123 -1.606 -13.463 1.00 0.00 H new ATOM 0 HD3 LYS A 13 29.691 -3.276 -13.156 1.00 0.00 H new ATOM 0 HE2 LYS A 13 27.468 -2.968 -14.027 1.00 0.00 H new ATOM 0 HE3 LYS A 13 27.629 -1.223 -14.026 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 27.886 -2.125 -16.244 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 29.339 -1.407 -15.739 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 29.183 -3.098 -15.741 1.00 0.00 H new ATOM 167 N LEU A 14 24.696 -3.076 -9.638 1.00 0.00 N ATOM 168 CA LEU A 14 23.593 -3.987 -9.354 1.00 0.00 C ATOM 169 C LEU A 14 22.250 -3.313 -9.611 1.00 0.00 C ATOM 170 O LEU A 14 22.103 -2.105 -9.420 1.00 0.00 O ATOM 171 CB LEU A 14 23.666 -4.471 -7.904 1.00 0.00 C ATOM 172 CG LEU A 14 23.593 -3.385 -6.831 1.00 0.00 C ATOM 173 CD1 LEU A 14 23.205 -3.986 -5.489 1.00 0.00 C ATOM 174 CD2 LEU A 14 24.922 -2.651 -6.724 1.00 0.00 C ATOM 0 H LEU A 14 24.427 -2.094 -9.698 1.00 0.00 H new ATOM 0 HA LEU A 14 23.681 -4.844 -10.021 1.00 0.00 H new ATOM 0 HB2 LEU A 14 22.852 -5.176 -7.736 1.00 0.00 H new ATOM 0 HB3 LEU A 14 24.597 -5.022 -7.772 1.00 0.00 H new ATOM 0 HG LEU A 14 22.826 -2.667 -7.120 1.00 0.00 H new ATOM 0 HD11 LEU A 14 23.158 -3.198 -4.737 1.00 0.00 H new ATOM 0 HD12 LEU A 14 22.230 -4.466 -5.573 1.00 0.00 H new ATOM 0 HD13 LEU A 14 23.949 -4.726 -5.193 1.00 0.00 H new ATOM 0 HD21 LEU A 14 24.852 -1.881 -5.955 1.00 0.00 H new ATOM 0 HD22 LEU A 14 25.708 -3.358 -6.459 1.00 0.00 H new ATOM 0 HD23 LEU A 14 25.159 -2.187 -7.681 1.00 0.00 H new ATOM 186 N LEU A 15 21.271 -4.101 -10.042 1.00 0.00 N ATOM 187 CA LEU A 15 19.937 -3.581 -10.323 1.00 0.00 C ATOM 188 C LEU A 15 18.906 -4.705 -10.337 1.00 0.00 C ATOM 189 O LEU A 15 18.978 -5.616 -11.160 1.00 0.00 O ATOM 190 CB LEU A 15 19.927 -2.847 -11.665 1.00 0.00 C ATOM 191 CG LEU A 15 18.721 -1.945 -11.927 1.00 0.00 C ATOM 192 CD1 LEU A 15 17.430 -2.658 -11.557 1.00 0.00 C ATOM 193 CD2 LEU A 15 18.852 -0.641 -11.154 1.00 0.00 C ATOM 0 H LEU A 15 21.376 -5.102 -10.205 1.00 0.00 H new ATOM 0 HA LEU A 15 19.672 -2.881 -9.531 1.00 0.00 H new ATOM 0 HB2 LEU A 15 20.830 -2.241 -11.732 1.00 0.00 H new ATOM 0 HB3 LEU A 15 19.981 -3.588 -12.462 1.00 0.00 H new ATOM 0 HG LEU A 15 18.691 -1.712 -12.991 1.00 0.00 H new ATOM 0 HD11 LEU A 15 16.583 -2.000 -11.750 1.00 0.00 H new ATOM 0 HD12 LEU A 15 17.330 -3.564 -12.155 1.00 0.00 H new ATOM 0 HD13 LEU A 15 17.450 -2.922 -10.500 1.00 0.00 H new ATOM 0 HD21 LEU A 15 17.985 -0.012 -11.353 1.00 0.00 H new ATOM 0 HD22 LEU A 15 18.908 -0.855 -10.087 1.00 0.00 H new ATOM 0 HD23 LEU A 15 19.757 -0.121 -11.468 1.00 0.00 H new ATOM 205 N ALA A 16 17.946 -4.631 -9.421 1.00 0.00 N ATOM 206 CA ALA A 16 16.898 -5.640 -9.331 1.00 0.00 C ATOM 207 C ALA A 16 15.663 -5.087 -8.626 1.00 0.00 C ATOM 208 O ALA A 16 15.647 -3.935 -8.192 1.00 0.00 O ATOM 209 CB ALA A 16 17.414 -6.874 -8.605 1.00 0.00 C ATOM 0 H ALA A 16 17.872 -3.883 -8.731 1.00 0.00 H new ATOM 0 HA ALA A 16 16.611 -5.922 -10.344 1.00 0.00 H new ATOM 0 HB1 ALA A 16 16.621 -7.619 -8.545 1.00 0.00 H new ATOM 0 HB2 ALA A 16 18.262 -7.289 -9.150 1.00 0.00 H new ATOM 0 HB3 ALA A 16 17.730 -6.599 -7.599 1.00 0.00 H new ATOM 215 N LYS A 17 14.630 -5.915 -8.517 1.00 0.00 N ATOM 216 CA LYS A 17 13.390 -5.510 -7.865 1.00 0.00 C ATOM 217 C LYS A 17 13.195 -6.261 -6.552 1.00 0.00 C ATOM 218 O LYS A 17 12.998 -5.653 -5.500 1.00 0.00 O ATOM 219 CB LYS A 17 12.197 -5.761 -8.791 1.00 0.00 C ATOM 220 CG LYS A 17 12.219 -4.917 -10.054 1.00 0.00 C ATOM 221 CD LYS A 17 10.915 -5.035 -10.825 1.00 0.00 C ATOM 222 CE LYS A 17 9.904 -3.993 -10.373 1.00 0.00 C ATOM 223 NZ LYS A 17 9.134 -4.447 -9.182 1.00 0.00 N ATOM 0 H LYS A 17 14.627 -6.871 -8.872 1.00 0.00 H new ATOM 0 HA LYS A 17 13.455 -4.444 -7.647 1.00 0.00 H new ATOM 0 HB2 LYS A 17 12.179 -6.815 -9.069 1.00 0.00 H new ATOM 0 HB3 LYS A 17 11.275 -5.559 -8.245 1.00 0.00 H new ATOM 0 HG2 LYS A 17 12.395 -3.874 -9.793 1.00 0.00 H new ATOM 0 HG3 LYS A 17 13.048 -5.231 -10.688 1.00 0.00 H new ATOM 0 HD2 LYS A 17 11.109 -4.916 -11.891 1.00 0.00 H new ATOM 0 HD3 LYS A 17 10.498 -6.032 -10.686 1.00 0.00 H new ATOM 0 HE2 LYS A 17 10.422 -3.063 -10.138 1.00 0.00 H new ATOM 0 HE3 LYS A 17 9.215 -3.777 -11.190 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 8.191 -4.008 -9.190 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 9.035 -5.482 -9.207 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 9.638 -4.168 -8.316 1.00 0.00 H new ATOM 237 N LYS A 18 13.253 -7.587 -6.620 1.00 0.00 N ATOM 238 CA LYS A 18 13.085 -8.422 -5.437 1.00 0.00 C ATOM 239 C LYS A 18 13.426 -9.877 -5.745 1.00 0.00 C ATOM 240 O LYS A 18 13.117 -10.381 -6.824 1.00 0.00 O ATOM 241 CB LYS A 18 11.650 -8.323 -4.916 1.00 0.00 C ATOM 242 CG LYS A 18 10.611 -8.850 -5.892 1.00 0.00 C ATOM 243 CD LYS A 18 9.257 -8.196 -5.671 1.00 0.00 C ATOM 244 CE LYS A 18 8.294 -8.514 -6.804 1.00 0.00 C ATOM 245 NZ LYS A 18 7.663 -9.853 -6.637 1.00 0.00 N ATOM 0 H LYS A 18 13.415 -8.106 -7.483 1.00 0.00 H new ATOM 0 HA LYS A 18 13.769 -8.061 -4.669 1.00 0.00 H new ATOM 0 HB2 LYS A 18 11.573 -8.878 -3.981 1.00 0.00 H new ATOM 0 HB3 LYS A 18 11.426 -7.281 -4.688 1.00 0.00 H new ATOM 0 HG2 LYS A 18 10.943 -8.665 -6.914 1.00 0.00 H new ATOM 0 HG3 LYS A 18 10.518 -9.930 -5.778 1.00 0.00 H new ATOM 0 HD2 LYS A 18 8.835 -8.540 -4.726 1.00 0.00 H new ATOM 0 HD3 LYS A 18 9.382 -7.116 -5.590 1.00 0.00 H new ATOM 0 HE2 LYS A 18 7.518 -7.750 -6.846 1.00 0.00 H new ATOM 0 HE3 LYS A 18 8.827 -8.480 -7.754 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 7.617 -10.333 -7.559 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 8.229 -10.424 -5.977 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 6.701 -9.739 -6.258 1.00 0.00 H new ATOM 259 N ALA A 19 14.064 -10.545 -4.790 1.00 0.00 N ATOM 260 CA ALA A 19 14.443 -11.943 -4.958 1.00 0.00 C ATOM 261 C ALA A 19 13.399 -12.872 -4.348 1.00 0.00 C ATOM 262 O ALA A 19 13.739 -13.891 -3.747 1.00 0.00 O ATOM 263 CB ALA A 19 15.808 -12.198 -4.336 1.00 0.00 C ATOM 0 H ALA A 19 14.329 -10.141 -3.892 1.00 0.00 H new ATOM 0 HA ALA A 19 14.498 -12.153 -6.026 1.00 0.00 H new ATOM 0 HB1 ALA A 19 16.078 -13.246 -4.469 1.00 0.00 H new ATOM 0 HB2 ALA A 19 16.553 -11.567 -4.821 1.00 0.00 H new ATOM 0 HB3 ALA A 19 15.772 -11.965 -3.272 1.00 0.00 H new ATOM 269 N GLU A 20 12.129 -12.513 -4.506 1.00 0.00 N ATOM 270 CA GLU A 20 11.037 -13.316 -3.968 1.00 0.00 C ATOM 271 C GLU A 20 9.713 -12.947 -4.632 1.00 0.00 C ATOM 272 O GLU A 20 9.247 -11.813 -4.527 1.00 0.00 O ATOM 273 CB GLU A 20 10.931 -13.124 -2.454 1.00 0.00 C ATOM 274 CG GLU A 20 10.650 -11.689 -2.040 1.00 0.00 C ATOM 275 CD GLU A 20 10.823 -11.467 -0.550 1.00 0.00 C ATOM 276 OE1 GLU A 20 11.717 -12.105 0.044 1.00 0.00 O ATOM 277 OE2 GLU A 20 10.065 -10.656 0.022 1.00 0.00 O ATOM 0 H GLU A 20 11.831 -11.673 -5.001 1.00 0.00 H new ATOM 0 HA GLU A 20 11.251 -14.363 -4.180 1.00 0.00 H new ATOM 0 HB2 GLU A 20 10.138 -13.766 -2.070 1.00 0.00 H new ATOM 0 HB3 GLU A 20 11.861 -13.452 -1.989 1.00 0.00 H new ATOM 0 HG2 GLU A 20 11.318 -11.021 -2.583 1.00 0.00 H new ATOM 0 HG3 GLU A 20 9.632 -11.425 -2.327 1.00 0.00 H new ATOM 284 N VAL A 21 9.112 -13.915 -5.317 1.00 0.00 N ATOM 285 CA VAL A 21 7.842 -13.694 -5.998 1.00 0.00 C ATOM 286 C VAL A 21 6.669 -14.139 -5.131 1.00 0.00 C ATOM 287 O VAL A 21 5.672 -14.655 -5.635 1.00 0.00 O ATOM 288 CB VAL A 21 7.787 -14.445 -7.341 1.00 0.00 C ATOM 289 CG1 VAL A 21 8.835 -13.902 -8.300 1.00 0.00 C ATOM 290 CG2 VAL A 21 7.975 -15.939 -7.124 1.00 0.00 C ATOM 0 H VAL A 21 9.484 -14.860 -5.415 1.00 0.00 H new ATOM 0 HA VAL A 21 7.766 -12.623 -6.186 1.00 0.00 H new ATOM 0 HB VAL A 21 6.805 -14.286 -7.786 1.00 0.00 H new ATOM 0 HG11 VAL A 21 8.781 -14.445 -9.244 1.00 0.00 H new ATOM 0 HG12 VAL A 21 8.650 -12.843 -8.480 1.00 0.00 H new ATOM 0 HG13 VAL A 21 9.826 -14.028 -7.865 1.00 0.00 H new ATOM 0 HG21 VAL A 21 7.933 -16.454 -8.084 1.00 0.00 H new ATOM 0 HG22 VAL A 21 8.943 -16.120 -6.657 1.00 0.00 H new ATOM 0 HG23 VAL A 21 7.183 -16.315 -6.476 1.00 0.00 H new ATOM 300 N ASN A 22 6.795 -13.935 -3.824 1.00 0.00 N ATOM 301 CA ASN A 22 5.745 -14.315 -2.886 1.00 0.00 C ATOM 302 C ASN A 22 4.722 -13.193 -2.731 1.00 0.00 C ATOM 303 O ASN A 22 3.564 -13.335 -3.123 1.00 0.00 O ATOM 304 CB ASN A 22 6.350 -14.661 -1.524 1.00 0.00 C ATOM 305 CG ASN A 22 6.998 -16.032 -1.511 1.00 0.00 C ATOM 306 OD1 ASN A 22 6.396 -17.011 -1.069 1.00 0.00 O ATOM 307 ND2 ASN A 22 8.231 -16.108 -1.997 1.00 0.00 N ATOM 0 H ASN A 22 7.614 -13.509 -3.390 1.00 0.00 H new ATOM 0 HA ASN A 22 5.237 -15.193 -3.284 1.00 0.00 H new ATOM 0 HB2 ASN A 22 7.092 -13.909 -1.258 1.00 0.00 H new ATOM 0 HB3 ASN A 22 5.571 -14.623 -0.763 1.00 0.00 H new ATOM 0 HD21 ASN A 22 8.718 -17.004 -2.014 1.00 0.00 H new ATOM 0 HD22 ASN A 22 8.691 -15.270 -2.353 1.00 0.00 H new ATOM 314 N THR A 23 5.159 -12.077 -2.155 1.00 0.00 N ATOM 315 CA THR A 23 4.283 -10.931 -1.947 1.00 0.00 C ATOM 316 C THR A 23 4.947 -9.640 -2.410 1.00 0.00 C ATOM 317 O THR A 23 6.071 -9.655 -2.913 1.00 0.00 O ATOM 318 CB THR A 23 3.886 -10.789 -0.465 1.00 0.00 C ATOM 319 OG1 THR A 23 5.050 -10.882 0.364 1.00 0.00 O ATOM 320 CG2 THR A 23 2.886 -11.864 -0.067 1.00 0.00 C ATOM 0 H THR A 23 6.115 -11.943 -1.824 1.00 0.00 H new ATOM 0 HA THR A 23 3.386 -11.107 -2.540 1.00 0.00 H new ATOM 0 HB THR A 23 3.419 -9.813 -0.328 1.00 0.00 H new ATOM 0 HG1 THR A 23 4.790 -10.789 1.304 1.00 0.00 H new ATOM 0 HG21 THR A 23 2.621 -11.743 0.983 1.00 0.00 H new ATOM 0 HG22 THR A 23 1.990 -11.772 -0.680 1.00 0.00 H new ATOM 0 HG23 THR A 23 3.330 -12.848 -0.218 1.00 0.00 H new ATOM 328 N ILE A 24 4.246 -8.524 -2.236 1.00 0.00 N ATOM 329 CA ILE A 24 4.770 -7.224 -2.635 1.00 0.00 C ATOM 330 C ILE A 24 5.611 -6.606 -1.523 1.00 0.00 C ATOM 331 O ILE A 24 5.243 -6.624 -0.348 1.00 0.00 O ATOM 332 CB ILE A 24 3.636 -6.250 -3.007 1.00 0.00 C ATOM 333 CG1 ILE A 24 2.537 -6.985 -3.778 1.00 0.00 C ATOM 334 CG2 ILE A 24 4.182 -5.091 -3.828 1.00 0.00 C ATOM 335 CD1 ILE A 24 1.295 -6.151 -4.000 1.00 0.00 C ATOM 0 H ILE A 24 3.314 -8.495 -1.822 1.00 0.00 H new ATOM 0 HA ILE A 24 5.396 -7.391 -3.511 1.00 0.00 H new ATOM 0 HB ILE A 24 3.205 -5.849 -2.090 1.00 0.00 H new ATOM 0 HG12 ILE A 24 2.931 -7.300 -4.744 1.00 0.00 H new ATOM 0 HG13 ILE A 24 2.265 -7.890 -3.234 1.00 0.00 H new ATOM 0 HG21 ILE A 24 3.369 -4.411 -4.083 1.00 0.00 H new ATOM 0 HG22 ILE A 24 4.934 -4.556 -3.247 1.00 0.00 H new ATOM 0 HG23 ILE A 24 4.635 -5.474 -4.742 1.00 0.00 H new ATOM 0 HD11 ILE A 24 0.559 -6.735 -4.552 1.00 0.00 H new ATOM 0 HD12 ILE A 24 0.877 -5.857 -3.037 1.00 0.00 H new ATOM 0 HD13 ILE A 24 1.553 -5.259 -4.571 1.00 0.00 H new ATOM 347 N PRO A 25 6.768 -6.042 -1.900 1.00 0.00 N ATOM 348 CA PRO A 25 7.685 -5.405 -0.950 1.00 0.00 C ATOM 349 C PRO A 25 7.123 -4.105 -0.386 1.00 0.00 C ATOM 350 O PRO A 25 7.787 -3.413 0.385 1.00 0.00 O ATOM 351 CB PRO A 25 8.932 -5.127 -1.793 1.00 0.00 C ATOM 352 CG PRO A 25 8.430 -5.030 -3.192 1.00 0.00 C ATOM 353 CD PRO A 25 7.271 -5.984 -3.283 1.00 0.00 C ATOM 0 HA PRO A 25 7.873 -6.034 -0.080 1.00 0.00 H new ATOM 0 HB2 PRO A 25 9.421 -4.204 -1.483 1.00 0.00 H new ATOM 0 HB3 PRO A 25 9.666 -5.927 -1.690 1.00 0.00 H new ATOM 0 HG2 PRO A 25 8.117 -4.012 -3.425 1.00 0.00 H new ATOM 0 HG3 PRO A 25 9.210 -5.294 -3.906 1.00 0.00 H new ATOM 0 HD2 PRO A 25 6.508 -5.625 -3.973 1.00 0.00 H new ATOM 0 HD3 PRO A 25 7.585 -6.966 -3.638 1.00 0.00 H new ATOM 361 N GLY A 26 5.894 -3.778 -0.775 1.00 0.00 N ATOM 362 CA GLY A 26 5.264 -2.561 -0.297 1.00 0.00 C ATOM 363 C GLY A 26 4.554 -1.804 -1.402 1.00 0.00 C ATOM 364 O GLY A 26 5.006 -1.795 -2.547 1.00 0.00 O ATOM 0 H GLY A 26 5.324 -4.334 -1.412 1.00 0.00 H new ATOM 0 HA2 GLY A 26 4.549 -2.809 0.487 1.00 0.00 H new ATOM 0 HA3 GLY A 26 6.019 -1.917 0.153 1.00 0.00 H new ATOM 368 N PHE A 27 3.439 -1.167 -1.059 1.00 0.00 N ATOM 369 CA PHE A 27 2.664 -0.406 -2.031 1.00 0.00 C ATOM 370 C PHE A 27 2.685 1.083 -1.697 1.00 0.00 C ATOM 371 O PHE A 27 1.946 1.546 -0.828 1.00 0.00 O ATOM 372 CB PHE A 27 1.220 -0.910 -2.072 1.00 0.00 C ATOM 373 CG PHE A 27 0.261 0.068 -2.688 1.00 0.00 C ATOM 374 CD1 PHE A 27 0.282 0.314 -4.051 1.00 0.00 C ATOM 375 CD2 PHE A 27 -0.663 0.740 -1.904 1.00 0.00 C ATOM 376 CE1 PHE A 27 -0.599 1.213 -4.621 1.00 0.00 C ATOM 377 CE2 PHE A 27 -1.547 1.640 -2.468 1.00 0.00 C ATOM 378 CZ PHE A 27 -1.516 1.877 -3.828 1.00 0.00 C ATOM 0 H PHE A 27 3.052 -1.163 -0.115 1.00 0.00 H new ATOM 0 HA PHE A 27 3.119 -0.548 -3.011 1.00 0.00 H new ATOM 0 HB2 PHE A 27 1.185 -1.844 -2.634 1.00 0.00 H new ATOM 0 HB3 PHE A 27 0.894 -1.136 -1.057 1.00 0.00 H new ATOM 0 HD1 PHE A 27 0.995 -0.203 -4.676 1.00 0.00 H new ATOM 0 HD2 PHE A 27 -0.693 0.558 -0.840 1.00 0.00 H new ATOM 0 HE1 PHE A 27 -0.571 1.397 -5.685 1.00 0.00 H new ATOM 0 HE2 PHE A 27 -2.262 2.158 -1.845 1.00 0.00 H new ATOM 0 HZ PHE A 27 -2.206 2.579 -4.271 1.00 0.00 H new ATOM 388 N ASP A 28 3.538 1.827 -2.393 1.00 0.00 N ATOM 389 CA ASP A 28 3.656 3.264 -2.172 1.00 0.00 C ATOM 390 C ASP A 28 2.677 4.032 -3.054 1.00 0.00 C ATOM 391 O ASP A 28 3.062 4.959 -3.765 1.00 0.00 O ATOM 392 CB ASP A 28 5.086 3.728 -2.452 1.00 0.00 C ATOM 393 CG ASP A 28 6.106 3.019 -1.582 1.00 0.00 C ATOM 394 OD1 ASP A 28 5.895 2.956 -0.353 1.00 0.00 O ATOM 395 OD2 ASP A 28 7.115 2.528 -2.131 1.00 0.00 O ATOM 0 H ASP A 28 4.158 1.459 -3.115 1.00 0.00 H new ATOM 0 HA ASP A 28 3.413 3.468 -1.129 1.00 0.00 H new ATOM 0 HB2 ASP A 28 5.323 3.552 -3.501 1.00 0.00 H new ATOM 0 HB3 ASP A 28 5.155 4.803 -2.285 1.00 0.00 H new ATOM 400 N GLY A 29 1.408 3.639 -3.002 1.00 0.00 N ATOM 401 CA GLY A 29 0.393 4.300 -3.802 1.00 0.00 C ATOM 402 C GLY A 29 -0.734 4.863 -2.959 1.00 0.00 C ATOM 403 O GLY A 29 -1.718 4.175 -2.685 1.00 0.00 O ATOM 0 H GLY A 29 1.065 2.875 -2.420 1.00 0.00 H new ATOM 0 HA2 GLY A 29 0.853 5.106 -4.373 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -0.015 3.592 -4.523 1.00 0.00 H new ATOM 407 N VAL A 30 -0.591 6.117 -2.543 1.00 0.00 N ATOM 408 CA VAL A 30 -1.605 6.772 -1.725 1.00 0.00 C ATOM 409 C VAL A 30 -3.006 6.321 -2.122 1.00 0.00 C ATOM 410 O VAL A 30 -3.330 6.233 -3.306 1.00 0.00 O ATOM 411 CB VAL A 30 -1.518 8.305 -1.845 1.00 0.00 C ATOM 412 CG1 VAL A 30 -2.630 8.967 -1.045 1.00 0.00 C ATOM 413 CG2 VAL A 30 -0.154 8.798 -1.385 1.00 0.00 C ATOM 0 H VAL A 30 0.218 6.700 -2.759 1.00 0.00 H new ATOM 0 HA VAL A 30 -1.413 6.484 -0.691 1.00 0.00 H new ATOM 0 HB VAL A 30 -1.644 8.578 -2.893 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -2.553 10.050 -1.142 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -3.597 8.637 -1.424 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -2.538 8.689 0.005 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -0.110 9.883 -1.476 1.00 0.00 H new ATOM 0 HG22 VAL A 30 0.003 8.515 -0.344 1.00 0.00 H new ATOM 0 HG23 VAL A 30 0.623 8.350 -2.004 1.00 0.00 H new ATOM 423 N VAL A 31 -3.836 6.037 -1.123 1.00 0.00 N ATOM 424 CA VAL A 31 -5.204 5.596 -1.366 1.00 0.00 C ATOM 425 C VAL A 31 -6.145 6.786 -1.522 1.00 0.00 C ATOM 426 O VAL A 31 -5.968 7.820 -0.878 1.00 0.00 O ATOM 427 CB VAL A 31 -5.716 4.697 -0.226 1.00 0.00 C ATOM 428 CG1 VAL A 31 -6.979 3.964 -0.650 1.00 0.00 C ATOM 429 CG2 VAL A 31 -4.637 3.713 0.201 1.00 0.00 C ATOM 0 H VAL A 31 -3.584 6.105 -0.137 1.00 0.00 H new ATOM 0 HA VAL A 31 -5.191 5.022 -2.292 1.00 0.00 H new ATOM 0 HB VAL A 31 -5.960 5.328 0.629 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -7.326 3.334 0.169 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -7.753 4.689 -0.903 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -6.765 3.343 -1.520 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -5.016 3.085 1.008 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -4.360 3.086 -0.647 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -3.761 4.261 0.549 1.00 0.00 H new ATOM 439 N LYS A 32 -7.147 6.633 -2.381 1.00 0.00 N ATOM 440 CA LYS A 32 -8.118 7.693 -2.621 1.00 0.00 C ATOM 441 C LYS A 32 -9.373 7.482 -1.779 1.00 0.00 C ATOM 442 O LYS A 32 -9.914 8.428 -1.207 1.00 0.00 O ATOM 443 CB LYS A 32 -8.490 7.746 -4.105 1.00 0.00 C ATOM 444 CG LYS A 32 -7.288 7.733 -5.034 1.00 0.00 C ATOM 445 CD LYS A 32 -6.601 9.088 -5.075 1.00 0.00 C ATOM 446 CE LYS A 32 -5.541 9.208 -3.991 1.00 0.00 C ATOM 447 NZ LYS A 32 -5.371 10.615 -3.535 1.00 0.00 N ATOM 0 H LYS A 32 -7.308 5.784 -2.923 1.00 0.00 H new ATOM 0 HA LYS A 32 -7.663 8.640 -2.333 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -9.130 6.896 -4.341 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -9.074 8.647 -4.293 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -6.579 6.974 -4.703 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -7.606 7.455 -6.039 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -6.142 9.235 -6.053 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -7.342 9.877 -4.949 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -5.817 8.582 -3.142 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -4.591 8.831 -4.369 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -4.640 10.655 -2.796 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -5.083 11.208 -4.339 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -6.271 10.966 -3.151 1.00 0.00 H new ATOM 461 N ASP A 33 -9.829 6.236 -1.708 1.00 0.00 N ATOM 462 CA ASP A 33 -11.018 5.901 -0.933 1.00 0.00 C ATOM 463 C ASP A 33 -10.886 4.517 -0.307 1.00 0.00 C ATOM 464 O ASP A 33 -10.117 3.681 -0.780 1.00 0.00 O ATOM 465 CB ASP A 33 -12.263 5.957 -1.820 1.00 0.00 C ATOM 466 CG ASP A 33 -12.316 7.214 -2.665 1.00 0.00 C ATOM 467 OD1 ASP A 33 -12.469 8.311 -2.088 1.00 0.00 O ATOM 468 OD2 ASP A 33 -12.206 7.102 -3.904 1.00 0.00 O ATOM 0 H ASP A 33 -9.394 5.442 -2.177 1.00 0.00 H new ATOM 0 HA ASP A 33 -11.119 6.634 -0.132 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -12.281 5.084 -2.472 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -13.154 5.906 -1.194 1.00 0.00 H new ATOM 473 N ALA A 34 -11.641 4.282 0.762 1.00 0.00 N ATOM 474 CA ALA A 34 -11.610 2.999 1.453 1.00 0.00 C ATOM 475 C ALA A 34 -11.708 1.841 0.465 1.00 0.00 C ATOM 476 O ALA A 34 -10.905 0.910 0.505 1.00 0.00 O ATOM 477 CB ALA A 34 -12.735 2.921 2.474 1.00 0.00 C ATOM 0 H ALA A 34 -12.282 4.964 1.168 1.00 0.00 H new ATOM 0 HA ALA A 34 -10.656 2.918 1.974 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -12.699 1.957 2.982 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -12.619 3.721 3.205 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -13.694 3.029 1.967 1.00 0.00 H new ATOM 483 N GLU A 35 -12.698 1.906 -0.420 1.00 0.00 N ATOM 484 CA GLU A 35 -12.901 0.862 -1.416 1.00 0.00 C ATOM 485 C GLU A 35 -11.582 0.481 -2.082 1.00 0.00 C ATOM 486 O GLU A 35 -11.221 -0.694 -2.140 1.00 0.00 O ATOM 487 CB GLU A 35 -13.905 1.324 -2.475 1.00 0.00 C ATOM 488 CG GLU A 35 -15.340 1.360 -1.978 1.00 0.00 C ATOM 489 CD GLU A 35 -16.013 0.002 -2.038 1.00 0.00 C ATOM 490 OE1 GLU A 35 -15.790 -0.813 -1.119 1.00 0.00 O ATOM 491 OE2 GLU A 35 -16.763 -0.245 -3.006 1.00 0.00 O ATOM 0 H GLU A 35 -13.371 2.671 -0.467 1.00 0.00 H new ATOM 0 HA GLU A 35 -13.298 -0.016 -0.908 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -13.624 2.319 -2.821 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -13.844 0.659 -3.336 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -15.356 1.724 -0.951 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -15.910 2.071 -2.577 1.00 0.00 H new ATOM 498 N GLU A 36 -10.868 1.484 -2.584 1.00 0.00 N ATOM 499 CA GLU A 36 -9.590 1.254 -3.247 1.00 0.00 C ATOM 500 C GLU A 36 -8.585 0.623 -2.287 1.00 0.00 C ATOM 501 O GLU A 36 -7.778 -0.219 -2.682 1.00 0.00 O ATOM 502 CB GLU A 36 -9.031 2.568 -3.796 1.00 0.00 C ATOM 503 CG GLU A 36 -7.634 2.439 -4.380 1.00 0.00 C ATOM 504 CD GLU A 36 -7.649 2.078 -5.852 1.00 0.00 C ATOM 505 OE1 GLU A 36 -8.030 2.941 -6.671 1.00 0.00 O ATOM 506 OE2 GLU A 36 -7.279 0.933 -6.187 1.00 0.00 O ATOM 0 H GLU A 36 -11.153 2.463 -2.544 1.00 0.00 H new ATOM 0 HA GLU A 36 -9.758 0.565 -4.075 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -9.704 2.946 -4.566 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -9.014 3.308 -2.996 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -7.100 3.380 -4.246 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -7.082 1.678 -3.828 1.00 0.00 H new ATOM 513 N ALA A 37 -8.640 1.036 -1.026 1.00 0.00 N ATOM 514 CA ALA A 37 -7.737 0.511 -0.009 1.00 0.00 C ATOM 515 C ALA A 37 -7.928 -0.991 0.172 1.00 0.00 C ATOM 516 O ALA A 37 -6.964 -1.731 0.366 1.00 0.00 O ATOM 517 CB ALA A 37 -7.950 1.235 1.312 1.00 0.00 C ATOM 0 H ALA A 37 -9.301 1.733 -0.683 1.00 0.00 H new ATOM 0 HA ALA A 37 -6.714 0.683 -0.344 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -7.269 0.832 2.062 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -7.755 2.299 1.179 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -8.979 1.093 1.643 1.00 0.00 H new ATOM 523 N VAL A 38 -9.179 -1.436 0.108 1.00 0.00 N ATOM 524 CA VAL A 38 -9.497 -2.850 0.264 1.00 0.00 C ATOM 525 C VAL A 38 -8.913 -3.674 -0.877 1.00 0.00 C ATOM 526 O VAL A 38 -8.210 -4.659 -0.649 1.00 0.00 O ATOM 527 CB VAL A 38 -11.019 -3.080 0.323 1.00 0.00 C ATOM 528 CG1 VAL A 38 -11.333 -4.568 0.357 1.00 0.00 C ATOM 529 CG2 VAL A 38 -11.619 -2.373 1.528 1.00 0.00 C ATOM 0 H VAL A 38 -9.989 -0.837 -0.051 1.00 0.00 H new ATOM 0 HA VAL A 38 -9.052 -3.172 1.205 1.00 0.00 H new ATOM 0 HB VAL A 38 -11.467 -2.658 -0.577 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -12.413 -4.711 0.399 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -10.938 -5.044 -0.541 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -10.873 -5.017 1.238 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -12.695 -2.547 1.553 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -11.167 -2.762 2.440 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -11.426 -1.303 1.455 1.00 0.00 H new ATOM 539 N ARG A 39 -9.207 -3.264 -2.107 1.00 0.00 N ATOM 540 CA ARG A 39 -8.711 -3.965 -3.285 1.00 0.00 C ATOM 541 C ARG A 39 -7.191 -4.085 -3.247 1.00 0.00 C ATOM 542 O ARG A 39 -6.637 -5.162 -3.467 1.00 0.00 O ATOM 543 CB ARG A 39 -9.145 -3.237 -4.558 1.00 0.00 C ATOM 544 CG ARG A 39 -10.650 -3.069 -4.682 1.00 0.00 C ATOM 545 CD ARG A 39 -11.074 -2.886 -6.131 1.00 0.00 C ATOM 546 NE ARG A 39 -10.597 -3.973 -6.982 1.00 0.00 N ATOM 547 CZ ARG A 39 -10.599 -3.923 -8.309 1.00 0.00 C ATOM 548 NH1 ARG A 39 -11.050 -2.844 -8.934 1.00 0.00 N ATOM 549 NH2 ARG A 39 -10.149 -4.953 -9.014 1.00 0.00 N ATOM 0 H ARG A 39 -9.786 -2.450 -2.313 1.00 0.00 H new ATOM 0 HA ARG A 39 -9.137 -4.968 -3.286 1.00 0.00 H new ATOM 0 HB2 ARG A 39 -8.675 -2.254 -4.582 1.00 0.00 H new ATOM 0 HB3 ARG A 39 -8.777 -3.787 -5.424 1.00 0.00 H new ATOM 0 HG2 ARG A 39 -11.150 -3.942 -4.263 1.00 0.00 H new ATOM 0 HG3 ARG A 39 -10.970 -2.207 -4.097 1.00 0.00 H new ATOM 0 HD2 ARG A 39 -12.161 -2.832 -6.187 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -10.689 -1.937 -6.505 1.00 0.00 H new ATOM 0 HE ARG A 39 -10.243 -4.817 -6.532 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -11.396 -2.050 -8.395 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -11.051 -2.808 -9.953 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -9.801 -5.785 -8.537 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -10.151 -4.913 -10.033 1.00 0.00 H new ATOM 563 N ILE A 40 -6.522 -2.971 -2.967 1.00 0.00 N ATOM 564 CA ILE A 40 -5.066 -2.951 -2.900 1.00 0.00 C ATOM 565 C ILE A 40 -4.553 -3.899 -1.821 1.00 0.00 C ATOM 566 O ILE A 40 -3.663 -4.713 -2.068 1.00 0.00 O ATOM 567 CB ILE A 40 -4.535 -1.534 -2.617 1.00 0.00 C ATOM 568 CG1 ILE A 40 -4.942 -0.579 -3.741 1.00 0.00 C ATOM 569 CG2 ILE A 40 -3.022 -1.557 -2.457 1.00 0.00 C ATOM 570 CD1 ILE A 40 -4.842 0.881 -3.359 1.00 0.00 C ATOM 0 H ILE A 40 -6.965 -2.071 -2.783 1.00 0.00 H new ATOM 0 HA ILE A 40 -4.700 -3.279 -3.873 1.00 0.00 H new ATOM 0 HB ILE A 40 -4.974 -1.177 -1.685 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -4.310 -0.763 -4.610 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -5.967 -0.799 -4.040 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -2.662 -0.548 -2.257 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -2.754 -2.209 -1.626 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -2.565 -1.931 -3.373 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -5.146 1.500 -4.203 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -5.495 1.080 -2.510 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -3.813 1.117 -3.088 1.00 0.00 H new ATOM 582 N ALA A 41 -5.120 -3.788 -0.625 1.00 0.00 N ATOM 583 CA ALA A 41 -4.723 -4.638 0.491 1.00 0.00 C ATOM 584 C ALA A 41 -4.752 -6.111 0.096 1.00 0.00 C ATOM 585 O ALA A 41 -3.756 -6.821 0.238 1.00 0.00 O ATOM 586 CB ALA A 41 -5.628 -4.393 1.689 1.00 0.00 C ATOM 0 H ALA A 41 -5.856 -3.118 -0.403 1.00 0.00 H new ATOM 0 HA ALA A 41 -3.699 -4.382 0.765 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -5.320 -5.034 2.515 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -5.554 -3.349 1.993 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -6.659 -4.620 1.418 1.00 0.00 H new ATOM 592 N ARG A 42 -5.899 -6.564 -0.398 1.00 0.00 N ATOM 593 CA ARG A 42 -6.057 -7.954 -0.811 1.00 0.00 C ATOM 594 C ARG A 42 -4.885 -8.399 -1.680 1.00 0.00 C ATOM 595 O ARG A 42 -4.386 -9.515 -1.540 1.00 0.00 O ATOM 596 CB ARG A 42 -7.370 -8.134 -1.574 1.00 0.00 C ATOM 597 CG ARG A 42 -8.606 -8.029 -0.695 1.00 0.00 C ATOM 598 CD ARG A 42 -9.873 -7.907 -1.527 1.00 0.00 C ATOM 599 NE ARG A 42 -10.384 -9.212 -1.940 1.00 0.00 N ATOM 600 CZ ARG A 42 -9.938 -9.874 -3.001 1.00 0.00 C ATOM 601 NH1 ARG A 42 -8.976 -9.356 -3.754 1.00 0.00 N ATOM 602 NH2 ARG A 42 -10.453 -11.056 -3.312 1.00 0.00 N ATOM 0 H ARG A 42 -6.733 -5.990 -0.522 1.00 0.00 H new ATOM 0 HA ARG A 42 -6.078 -8.574 0.085 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -7.429 -7.382 -2.360 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -7.365 -9.108 -2.064 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -8.674 -8.908 -0.054 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -8.515 -7.163 -0.040 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -10.636 -7.385 -0.951 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -9.670 -7.301 -2.410 1.00 0.00 H new ATOM 0 HE ARG A 42 -11.124 -9.638 -1.382 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -8.577 -8.447 -3.518 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -8.635 -9.867 -4.569 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -11.193 -11.458 -2.736 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -10.109 -11.563 -4.127 1.00 0.00 H new ATOM 616 N GLU A 43 -4.452 -7.519 -2.577 1.00 0.00 N ATOM 617 CA GLU A 43 -3.340 -7.823 -3.470 1.00 0.00 C ATOM 618 C GLU A 43 -2.049 -8.022 -2.682 1.00 0.00 C ATOM 619 O GLU A 43 -1.284 -8.951 -2.946 1.00 0.00 O ATOM 620 CB GLU A 43 -3.158 -6.702 -4.494 1.00 0.00 C ATOM 621 CG GLU A 43 -4.010 -6.871 -5.741 1.00 0.00 C ATOM 622 CD GLU A 43 -3.547 -8.023 -6.612 1.00 0.00 C ATOM 623 OE1 GLU A 43 -2.471 -7.901 -7.234 1.00 0.00 O ATOM 624 OE2 GLU A 43 -4.261 -9.045 -6.672 1.00 0.00 O ATOM 0 H GLU A 43 -4.854 -6.590 -2.705 1.00 0.00 H new ATOM 0 HA GLU A 43 -3.572 -8.750 -3.995 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -3.402 -5.749 -4.024 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -2.109 -6.654 -4.785 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -5.047 -7.036 -5.448 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -3.985 -5.949 -6.321 1.00 0.00 H new ATOM 631 N ILE A 44 -1.812 -7.144 -1.713 1.00 0.00 N ATOM 632 CA ILE A 44 -0.614 -7.222 -0.886 1.00 0.00 C ATOM 633 C ILE A 44 -0.609 -8.495 -0.047 1.00 0.00 C ATOM 634 O ILE A 44 0.420 -9.156 0.091 1.00 0.00 O ATOM 635 CB ILE A 44 -0.494 -6.004 0.048 1.00 0.00 C ATOM 636 CG1 ILE A 44 -0.257 -4.731 -0.767 1.00 0.00 C ATOM 637 CG2 ILE A 44 0.631 -6.215 1.051 1.00 0.00 C ATOM 638 CD1 ILE A 44 -0.136 -3.484 0.081 1.00 0.00 C ATOM 0 H ILE A 44 -2.434 -6.370 -1.481 1.00 0.00 H new ATOM 0 HA ILE A 44 0.239 -7.233 -1.565 1.00 0.00 H new ATOM 0 HB ILE A 44 -1.428 -5.892 0.598 1.00 0.00 H new ATOM 0 HG12 ILE A 44 0.653 -4.850 -1.355 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -1.078 -4.603 -1.472 1.00 0.00 H new ATOM 0 HG21 ILE A 44 0.704 -5.346 1.704 1.00 0.00 H new ATOM 0 HG22 ILE A 44 0.423 -7.102 1.649 1.00 0.00 H new ATOM 0 HG23 ILE A 44 1.573 -6.348 0.519 1.00 0.00 H new ATOM 0 HD11 ILE A 44 0.031 -2.621 -0.563 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -1.055 -3.340 0.650 1.00 0.00 H new ATOM 0 HD13 ILE A 44 0.703 -3.591 0.768 1.00 0.00 H new ATOM 650 N GLY A 45 -1.767 -8.834 0.512 1.00 0.00 N ATOM 651 CA GLY A 45 -1.874 -10.028 1.330 1.00 0.00 C ATOM 652 C GLY A 45 -1.893 -9.715 2.813 1.00 0.00 C ATOM 653 O GLY A 45 -0.846 -9.486 3.419 1.00 0.00 O ATOM 0 H GLY A 45 -2.632 -8.303 0.413 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -2.783 -10.567 1.064 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -1.036 -10.690 1.112 1.00 0.00 H new ATOM 657 N TYR A 46 -3.085 -9.704 3.399 1.00 0.00 N ATOM 658 CA TYR A 46 -3.235 -9.412 4.820 1.00 0.00 C ATOM 659 C TYR A 46 -2.329 -10.308 5.659 1.00 0.00 C ATOM 660 O TYR A 46 -1.966 -11.415 5.261 1.00 0.00 O ATOM 661 CB TYR A 46 -4.692 -9.598 5.248 1.00 0.00 C ATOM 662 CG TYR A 46 -5.630 -8.563 4.669 1.00 0.00 C ATOM 663 CD1 TYR A 46 -6.187 -8.731 3.407 1.00 0.00 C ATOM 664 CD2 TYR A 46 -5.960 -7.418 5.383 1.00 0.00 C ATOM 665 CE1 TYR A 46 -7.043 -7.787 2.873 1.00 0.00 C ATOM 666 CE2 TYR A 46 -6.817 -6.470 4.858 1.00 0.00 C ATOM 667 CZ TYR A 46 -7.356 -6.659 3.603 1.00 0.00 C ATOM 668 OH TYR A 46 -8.210 -5.718 3.075 1.00 0.00 O ATOM 0 H TYR A 46 -3.961 -9.894 2.912 1.00 0.00 H new ATOM 0 HA TYR A 46 -2.943 -8.375 4.985 1.00 0.00 H new ATOM 0 HB2 TYR A 46 -5.027 -10.590 4.945 1.00 0.00 H new ATOM 0 HB3 TYR A 46 -4.750 -9.561 6.336 1.00 0.00 H new ATOM 0 HD1 TYR A 46 -5.947 -9.614 2.834 1.00 0.00 H new ATOM 0 HD2 TYR A 46 -5.539 -7.266 6.366 1.00 0.00 H new ATOM 0 HE1 TYR A 46 -7.465 -7.931 1.889 1.00 0.00 H new ATOM 0 HE2 TYR A 46 -7.063 -5.586 5.427 1.00 0.00 H new ATOM 0 HH TYR A 46 -9.019 -6.160 2.743 1.00 0.00 H new ATOM 678 N PRO A 47 -1.953 -9.818 6.850 1.00 0.00 N ATOM 679 CA PRO A 47 -2.378 -8.501 7.333 1.00 0.00 C ATOM 680 C PRO A 47 -1.734 -7.361 6.552 1.00 0.00 C ATOM 681 O PRO A 47 -0.647 -7.513 5.995 1.00 0.00 O ATOM 682 CB PRO A 47 -1.902 -8.487 8.788 1.00 0.00 C ATOM 683 CG PRO A 47 -0.761 -9.444 8.823 1.00 0.00 C ATOM 684 CD PRO A 47 -1.085 -10.512 7.815 1.00 0.00 C ATOM 0 HA PRO A 47 -3.452 -8.352 7.219 1.00 0.00 H new ATOM 0 HB2 PRO A 47 -1.590 -7.488 9.093 1.00 0.00 H new ATOM 0 HB3 PRO A 47 -2.697 -8.794 9.468 1.00 0.00 H new ATOM 0 HG2 PRO A 47 0.175 -8.944 8.575 1.00 0.00 H new ATOM 0 HG3 PRO A 47 -0.640 -9.871 9.819 1.00 0.00 H new ATOM 0 HD2 PRO A 47 -0.185 -10.901 7.339 1.00 0.00 H new ATOM 0 HD3 PRO A 47 -1.593 -11.359 8.276 1.00 0.00 H new ATOM 692 N VAL A 48 -2.412 -6.218 6.515 1.00 0.00 N ATOM 693 CA VAL A 48 -1.905 -5.051 5.803 1.00 0.00 C ATOM 694 C VAL A 48 -1.919 -3.814 6.694 1.00 0.00 C ATOM 695 O VAL A 48 -2.953 -3.454 7.256 1.00 0.00 O ATOM 696 CB VAL A 48 -2.730 -4.766 4.534 1.00 0.00 C ATOM 697 CG1 VAL A 48 -2.716 -5.971 3.606 1.00 0.00 C ATOM 698 CG2 VAL A 48 -4.155 -4.382 4.901 1.00 0.00 C ATOM 0 H VAL A 48 -3.314 -6.076 6.970 1.00 0.00 H new ATOM 0 HA VAL A 48 -0.878 -5.277 5.517 1.00 0.00 H new ATOM 0 HB VAL A 48 -2.276 -3.927 4.007 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -3.304 -5.751 2.715 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -1.689 -6.196 3.317 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -3.145 -6.831 4.120 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -4.724 -4.184 3.993 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -4.622 -5.199 5.451 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -4.142 -3.487 5.523 1.00 0.00 H new ATOM 708 N MET A 49 -0.765 -3.167 6.818 1.00 0.00 N ATOM 709 CA MET A 49 -0.645 -1.969 7.640 1.00 0.00 C ATOM 710 C MET A 49 -1.051 -0.727 6.852 1.00 0.00 C ATOM 711 O MET A 49 -0.903 -0.680 5.631 1.00 0.00 O ATOM 712 CB MET A 49 0.788 -1.817 8.152 1.00 0.00 C ATOM 713 CG MET A 49 1.042 -0.498 8.864 1.00 0.00 C ATOM 714 SD MET A 49 2.789 -0.224 9.215 1.00 0.00 S ATOM 715 CE MET A 49 3.207 -1.744 10.065 1.00 0.00 C ATOM 0 H MET A 49 0.100 -3.452 6.360 1.00 0.00 H new ATOM 0 HA MET A 49 -1.317 -2.074 8.492 1.00 0.00 H new ATOM 0 HB2 MET A 49 1.010 -2.638 8.834 1.00 0.00 H new ATOM 0 HB3 MET A 49 1.477 -1.906 7.312 1.00 0.00 H new ATOM 0 HG2 MET A 49 0.666 0.320 8.250 1.00 0.00 H new ATOM 0 HG3 MET A 49 0.480 -0.480 9.798 1.00 0.00 H new ATOM 0 HE1 MET A 49 4.145 -1.613 10.605 1.00 0.00 H new ATOM 0 HE2 MET A 49 2.415 -1.997 10.770 1.00 0.00 H new ATOM 0 HE3 MET A 49 3.316 -2.549 9.338 1.00 0.00 H new ATOM 725 N ILE A 50 -1.562 0.276 7.559 1.00 0.00 N ATOM 726 CA ILE A 50 -1.988 1.517 6.925 1.00 0.00 C ATOM 727 C ILE A 50 -1.452 2.730 7.678 1.00 0.00 C ATOM 728 O ILE A 50 -1.813 2.969 8.831 1.00 0.00 O ATOM 729 CB ILE A 50 -3.523 1.612 6.847 1.00 0.00 C ATOM 730 CG1 ILE A 50 -4.089 0.429 6.060 1.00 0.00 C ATOM 731 CG2 ILE A 50 -3.940 2.929 6.209 1.00 0.00 C ATOM 732 CD1 ILE A 50 -5.510 0.075 6.440 1.00 0.00 C ATOM 0 H ILE A 50 -1.691 0.253 8.571 1.00 0.00 H new ATOM 0 HA ILE A 50 -1.581 1.511 5.914 1.00 0.00 H new ATOM 0 HB ILE A 50 -3.927 1.577 7.859 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -4.053 0.661 4.996 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -3.452 -0.441 6.219 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -5.028 2.982 6.161 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -3.563 3.759 6.807 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -3.529 2.992 5.202 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -5.846 -0.772 5.842 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -5.549 -0.188 7.497 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -6.160 0.930 6.255 1.00 0.00 H new ATOM 744 N LYS A 51 -0.590 3.496 7.018 1.00 0.00 N ATOM 745 CA LYS A 51 -0.006 4.688 7.622 1.00 0.00 C ATOM 746 C LYS A 51 -0.460 5.947 6.891 1.00 0.00 C ATOM 747 O LYS A 51 -1.003 5.874 5.789 1.00 0.00 O ATOM 748 CB LYS A 51 1.522 4.597 7.604 1.00 0.00 C ATOM 749 CG LYS A 51 2.056 3.243 8.038 1.00 0.00 C ATOM 750 CD LYS A 51 2.223 2.305 6.855 1.00 0.00 C ATOM 751 CE LYS A 51 3.611 2.420 6.243 1.00 0.00 C ATOM 752 NZ LYS A 51 4.679 2.075 7.222 1.00 0.00 N ATOM 0 H LYS A 51 -0.280 3.312 6.064 1.00 0.00 H new ATOM 0 HA LYS A 51 -0.348 4.746 8.655 1.00 0.00 H new ATOM 0 HB2 LYS A 51 1.879 4.813 6.597 1.00 0.00 H new ATOM 0 HB3 LYS A 51 1.931 5.366 8.259 1.00 0.00 H new ATOM 0 HG2 LYS A 51 3.015 3.373 8.539 1.00 0.00 H new ATOM 0 HG3 LYS A 51 1.375 2.798 8.763 1.00 0.00 H new ATOM 0 HD2 LYS A 51 2.050 1.278 7.177 1.00 0.00 H new ATOM 0 HD3 LYS A 51 1.471 2.533 6.100 1.00 0.00 H new ATOM 0 HE2 LYS A 51 3.683 1.759 5.379 1.00 0.00 H new ATOM 0 HE3 LYS A 51 3.765 3.436 5.881 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 5.495 1.674 6.718 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 4.974 2.933 7.731 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 4.315 1.377 7.902 1.00 0.00 H new ATOM 766 N ALA A 52 -0.233 7.100 7.511 1.00 0.00 N ATOM 767 CA ALA A 52 -0.615 8.375 6.917 1.00 0.00 C ATOM 768 C ALA A 52 0.492 8.917 6.019 1.00 0.00 C ATOM 769 O ALA A 52 1.530 9.369 6.502 1.00 0.00 O ATOM 770 CB ALA A 52 -0.956 9.383 8.004 1.00 0.00 C ATOM 0 H ALA A 52 0.214 7.177 8.425 1.00 0.00 H new ATOM 0 HA ALA A 52 -1.498 8.209 6.300 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -1.239 10.330 7.546 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -1.786 9.007 8.602 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -0.087 9.535 8.644 1.00 0.00 H new ATOM 776 N SER A 53 0.264 8.867 4.710 1.00 0.00 N ATOM 777 CA SER A 53 1.245 9.349 3.745 1.00 0.00 C ATOM 778 C SER A 53 1.864 10.663 4.209 1.00 0.00 C ATOM 779 O SER A 53 3.054 10.906 4.009 1.00 0.00 O ATOM 780 CB SER A 53 0.593 9.536 2.373 1.00 0.00 C ATOM 781 OG SER A 53 1.541 9.377 1.332 1.00 0.00 O ATOM 0 H SER A 53 -0.591 8.498 4.294 1.00 0.00 H new ATOM 0 HA SER A 53 2.036 8.603 3.665 1.00 0.00 H new ATOM 0 HB2 SER A 53 -0.213 8.813 2.248 1.00 0.00 H new ATOM 0 HB3 SER A 53 0.144 10.527 2.312 1.00 0.00 H new ATOM 0 HG SER A 53 1.374 10.043 0.633 1.00 0.00 H new ATOM 787 N ALA A 54 1.048 11.508 4.830 1.00 0.00 N ATOM 788 CA ALA A 54 1.514 12.797 5.326 1.00 0.00 C ATOM 789 C ALA A 54 2.059 12.676 6.745 1.00 0.00 C ATOM 790 O ALA A 54 1.796 13.524 7.596 1.00 0.00 O ATOM 791 CB ALA A 54 0.390 13.820 5.276 1.00 0.00 C ATOM 0 H ALA A 54 0.060 11.323 5.002 1.00 0.00 H new ATOM 0 HA ALA A 54 2.326 13.134 4.681 1.00 0.00 H new ATOM 0 HB1 ALA A 54 0.753 14.778 5.649 1.00 0.00 H new ATOM 0 HB2 ALA A 54 0.050 13.937 4.247 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -0.440 13.480 5.896 1.00 0.00 H new ATOM 797 N GLY A 55 2.819 11.613 6.993 1.00 0.00 N ATOM 798 CA GLY A 55 3.388 11.400 8.311 1.00 0.00 C ATOM 799 C GLY A 55 3.302 9.953 8.753 1.00 0.00 C ATOM 800 O GLY A 55 2.693 9.643 9.776 1.00 0.00 O ATOM 0 H GLY A 55 3.050 10.896 6.305 1.00 0.00 H new ATOM 0 HA2 GLY A 55 4.432 11.714 8.308 1.00 0.00 H new ATOM 0 HA3 GLY A 55 2.868 12.029 9.034 1.00 0.00 H new ATOM 804 N GLY A 56 3.913 9.062 7.977 1.00 0.00 N ATOM 805 CA GLY A 56 3.889 7.649 8.309 1.00 0.00 C ATOM 806 C GLY A 56 5.020 7.253 9.237 1.00 0.00 C ATOM 807 O GLY A 56 5.074 7.693 10.385 1.00 0.00 O ATOM 0 H GLY A 56 4.424 9.293 7.125 1.00 0.00 H new ATOM 0 HA2 GLY A 56 2.936 7.405 8.778 1.00 0.00 H new ATOM 0 HA3 GLY A 56 3.953 7.062 7.393 1.00 0.00 H new ATOM 811 N GLY A 57 5.926 6.416 8.740 1.00 0.00 N ATOM 812 CA GLY A 57 7.048 5.973 9.547 1.00 0.00 C ATOM 813 C GLY A 57 6.608 5.286 10.824 1.00 0.00 C ATOM 814 O GLY A 57 7.325 5.299 11.824 1.00 0.00 O ATOM 0 H GLY A 57 5.903 6.037 7.793 1.00 0.00 H new ATOM 0 HA2 GLY A 57 7.663 5.288 8.963 1.00 0.00 H new ATOM 0 HA3 GLY A 57 7.673 6.830 9.796 1.00 0.00 H new ATOM 818 N GLY A 58 5.422 4.684 10.793 1.00 0.00 N ATOM 819 CA GLY A 58 4.907 3.999 11.964 1.00 0.00 C ATOM 820 C GLY A 58 4.631 4.946 13.115 1.00 0.00 C ATOM 821 O GLY A 58 5.121 4.745 14.227 1.00 0.00 O ATOM 0 H GLY A 58 4.809 4.659 9.978 1.00 0.00 H new ATOM 0 HA2 GLY A 58 3.988 3.475 11.700 1.00 0.00 H new ATOM 0 HA3 GLY A 58 5.624 3.243 12.284 1.00 0.00 H new ATOM 825 N LYS A 59 3.844 5.984 12.850 1.00 0.00 N ATOM 826 CA LYS A 59 3.503 6.967 13.871 1.00 0.00 C ATOM 827 C LYS A 59 2.055 6.803 14.323 1.00 0.00 C ATOM 828 O LYS A 59 1.134 7.305 13.680 1.00 0.00 O ATOM 829 CB LYS A 59 3.725 8.384 13.339 1.00 0.00 C ATOM 830 CG LYS A 59 5.162 8.861 13.457 1.00 0.00 C ATOM 831 CD LYS A 59 5.435 10.041 12.540 1.00 0.00 C ATOM 832 CE LYS A 59 6.927 10.248 12.327 1.00 0.00 C ATOM 833 NZ LYS A 59 7.581 10.845 13.524 1.00 0.00 N ATOM 0 H LYS A 59 3.430 6.166 11.936 1.00 0.00 H new ATOM 0 HA LYS A 59 4.154 6.802 14.730 1.00 0.00 H new ATOM 0 HB2 LYS A 59 3.424 8.421 12.292 1.00 0.00 H new ATOM 0 HB3 LYS A 59 3.077 9.072 13.882 1.00 0.00 H new ATOM 0 HG2 LYS A 59 5.368 9.146 14.489 1.00 0.00 H new ATOM 0 HG3 LYS A 59 5.839 8.043 13.210 1.00 0.00 H new ATOM 0 HD2 LYS A 59 4.949 9.876 11.579 1.00 0.00 H new ATOM 0 HD3 LYS A 59 4.999 10.944 12.967 1.00 0.00 H new ATOM 0 HE2 LYS A 59 7.397 9.292 12.096 1.00 0.00 H new ATOM 0 HE3 LYS A 59 7.084 10.897 11.466 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 8.597 10.970 13.339 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 7.150 11.769 13.730 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 7.453 10.214 14.340 1.00 0.00 H new ATOM 847 N GLY A 60 1.862 6.097 15.433 1.00 0.00 N ATOM 848 CA GLY A 60 0.524 5.881 15.951 1.00 0.00 C ATOM 849 C GLY A 60 -0.473 5.546 14.860 1.00 0.00 C ATOM 850 O GLY A 60 -1.589 6.064 14.850 1.00 0.00 O ATOM 0 H GLY A 60 2.608 5.671 15.982 1.00 0.00 H new ATOM 0 HA2 GLY A 60 0.546 5.071 16.680 1.00 0.00 H new ATOM 0 HA3 GLY A 60 0.193 6.775 16.479 1.00 0.00 H new ATOM 854 N MET A 61 -0.070 4.678 13.938 1.00 0.00 N ATOM 855 CA MET A 61 -0.937 4.275 12.837 1.00 0.00 C ATOM 856 C MET A 61 -1.777 3.062 13.223 1.00 0.00 C ATOM 857 O MET A 61 -1.717 2.588 14.358 1.00 0.00 O ATOM 858 CB MET A 61 -0.104 3.958 11.594 1.00 0.00 C ATOM 859 CG MET A 61 0.392 2.522 11.544 1.00 0.00 C ATOM 860 SD MET A 61 1.366 2.074 12.993 1.00 0.00 S ATOM 861 CE MET A 61 0.307 0.840 13.745 1.00 0.00 C ATOM 0 H MET A 61 0.851 4.240 13.931 1.00 0.00 H new ATOM 0 HA MET A 61 -1.609 5.104 12.614 1.00 0.00 H new ATOM 0 HB2 MET A 61 -0.702 4.158 10.705 1.00 0.00 H new ATOM 0 HB3 MET A 61 0.753 4.631 11.560 1.00 0.00 H new ATOM 0 HG2 MET A 61 -0.462 1.849 11.463 1.00 0.00 H new ATOM 0 HG3 MET A 61 0.996 2.381 10.647 1.00 0.00 H new ATOM 0 HE1 MET A 61 0.113 1.111 14.783 1.00 0.00 H new ATOM 0 HE2 MET A 61 -0.636 0.789 13.200 1.00 0.00 H new ATOM 0 HE3 MET A 61 0.799 -0.132 13.710 1.00 0.00 H new ATOM 871 N ARG A 62 -2.560 2.563 12.272 1.00 0.00 N ATOM 872 CA ARG A 62 -3.414 1.406 12.514 1.00 0.00 C ATOM 873 C ARG A 62 -3.160 0.317 11.476 1.00 0.00 C ATOM 874 O ARG A 62 -2.723 0.599 10.360 1.00 0.00 O ATOM 875 CB ARG A 62 -4.887 1.817 12.486 1.00 0.00 C ATOM 876 CG ARG A 62 -5.804 0.847 13.213 1.00 0.00 C ATOM 877 CD ARG A 62 -7.195 0.828 12.598 1.00 0.00 C ATOM 878 NE ARG A 62 -7.880 -0.440 12.834 1.00 0.00 N ATOM 879 CZ ARG A 62 -9.197 -0.589 12.753 1.00 0.00 C ATOM 880 NH1 ARG A 62 -9.967 0.444 12.443 1.00 0.00 N ATOM 881 NH2 ARG A 62 -9.747 -1.776 12.981 1.00 0.00 N ATOM 0 H ARG A 62 -2.621 2.942 11.327 1.00 0.00 H new ATOM 0 HA ARG A 62 -3.173 1.009 13.500 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -4.988 2.805 12.935 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -5.212 1.903 11.449 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -5.376 -0.155 13.179 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -5.873 1.128 14.264 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -7.787 1.643 13.015 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -7.120 1.005 11.525 1.00 0.00 H new ATOM 0 HE ARG A 62 -7.316 -1.255 13.074 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -9.548 1.357 12.266 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -10.978 0.326 12.382 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -9.158 -2.574 13.219 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -10.759 -1.890 12.919 1.00 0.00 H new ATOM 895 N ILE A 63 -3.435 -0.927 11.852 1.00 0.00 N ATOM 896 CA ILE A 63 -3.237 -2.058 10.954 1.00 0.00 C ATOM 897 C ILE A 63 -4.542 -2.814 10.725 1.00 0.00 C ATOM 898 O ILE A 63 -5.369 -2.932 11.628 1.00 0.00 O ATOM 899 CB ILE A 63 -2.181 -3.035 11.503 1.00 0.00 C ATOM 900 CG1 ILE A 63 -0.883 -2.290 11.822 1.00 0.00 C ATOM 901 CG2 ILE A 63 -1.924 -4.154 10.504 1.00 0.00 C ATOM 902 CD1 ILE A 63 0.139 -3.139 12.545 1.00 0.00 C ATOM 0 H ILE A 63 -3.796 -1.178 12.773 1.00 0.00 H new ATOM 0 HA ILE A 63 -2.885 -1.650 10.007 1.00 0.00 H new ATOM 0 HB ILE A 63 -2.560 -3.477 12.424 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -0.447 -1.923 10.893 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -1.115 -1.417 12.432 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -1.175 -4.836 10.907 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -2.850 -4.699 10.321 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -1.562 -3.730 9.568 1.00 0.00 H new ATOM 0 HD11 ILE A 63 1.033 -2.546 12.739 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -0.279 -3.485 13.490 1.00 0.00 H new ATOM 0 HD13 ILE A 63 0.400 -3.999 11.928 1.00 0.00 H new ATOM 914 N ALA A 64 -4.718 -3.325 9.511 1.00 0.00 N ATOM 915 CA ALA A 64 -5.920 -4.073 9.164 1.00 0.00 C ATOM 916 C ALA A 64 -5.581 -5.511 8.786 1.00 0.00 C ATOM 917 O ALA A 64 -4.522 -5.781 8.221 1.00 0.00 O ATOM 918 CB ALA A 64 -6.659 -3.386 8.025 1.00 0.00 C ATOM 0 H ALA A 64 -4.043 -3.235 8.751 1.00 0.00 H new ATOM 0 HA ALA A 64 -6.568 -4.098 10.040 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -7.554 -3.956 7.776 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -6.943 -2.379 8.330 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -6.010 -3.331 7.151 1.00 0.00 H new ATOM 924 N TRP A 65 -6.487 -6.430 9.102 1.00 0.00 N ATOM 925 CA TRP A 65 -6.283 -7.841 8.796 1.00 0.00 C ATOM 926 C TRP A 65 -7.290 -8.324 7.757 1.00 0.00 C ATOM 927 O TRP A 65 -7.091 -9.358 7.120 1.00 0.00 O ATOM 928 CB TRP A 65 -6.401 -8.682 10.068 1.00 0.00 C ATOM 929 CG TRP A 65 -5.265 -8.476 11.024 1.00 0.00 C ATOM 930 CD1 TRP A 65 -5.066 -7.399 11.840 1.00 0.00 C ATOM 931 CD2 TRP A 65 -4.172 -9.369 11.261 1.00 0.00 C ATOM 932 NE1 TRP A 65 -3.915 -7.569 12.570 1.00 0.00 N ATOM 933 CE2 TRP A 65 -3.348 -8.770 12.234 1.00 0.00 C ATOM 934 CE3 TRP A 65 -3.809 -10.617 10.748 1.00 0.00 C ATOM 935 CZ2 TRP A 65 -2.185 -9.377 12.701 1.00 0.00 C ATOM 936 CZ3 TRP A 65 -2.655 -11.218 11.212 1.00 0.00 C ATOM 937 CH2 TRP A 65 -1.854 -10.599 12.181 1.00 0.00 C ATOM 0 H TRP A 65 -7.369 -6.223 9.570 1.00 0.00 H new ATOM 0 HA TRP A 65 -5.280 -7.957 8.384 1.00 0.00 H new ATOM 0 HB2 TRP A 65 -7.337 -8.439 10.570 1.00 0.00 H new ATOM 0 HB3 TRP A 65 -6.450 -9.736 9.795 1.00 0.00 H new ATOM 0 HD1 TRP A 65 -5.718 -6.540 11.902 1.00 0.00 H new ATOM 0 HE1 TRP A 65 -3.543 -6.908 13.252 1.00 0.00 H new ATOM 0 HE3 TRP A 65 -4.420 -11.103 10.002 1.00 0.00 H new ATOM 0 HZ2 TRP A 65 -1.566 -8.900 13.447 1.00 0.00 H new ATOM 0 HZ3 TRP A 65 -2.365 -12.182 10.821 1.00 0.00 H new ATOM 0 HH2 TRP A 65 -0.958 -11.096 12.524 1.00 0.00 H new ATOM 948 N ASP A 66 -8.371 -7.569 7.592 1.00 0.00 N ATOM 949 CA ASP A 66 -9.408 -7.920 6.629 1.00 0.00 C ATOM 950 C ASP A 66 -10.049 -6.667 6.041 1.00 0.00 C ATOM 951 O ASP A 66 -9.888 -5.567 6.571 1.00 0.00 O ATOM 952 CB ASP A 66 -10.476 -8.791 7.293 1.00 0.00 C ATOM 953 CG ASP A 66 -9.878 -9.913 8.118 1.00 0.00 C ATOM 954 OD1 ASP A 66 -9.532 -9.667 9.292 1.00 0.00 O ATOM 955 OD2 ASP A 66 -9.754 -11.038 7.589 1.00 0.00 O ATOM 0 H ASP A 66 -8.552 -6.711 8.112 1.00 0.00 H new ATOM 0 HA ASP A 66 -8.943 -8.483 5.819 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -11.103 -8.169 7.932 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -11.124 -9.214 6.526 1.00 0.00 H new ATOM 960 N ASP A 67 -10.775 -6.840 4.942 1.00 0.00 N ATOM 961 CA ASP A 67 -11.441 -5.724 4.281 1.00 0.00 C ATOM 962 C ASP A 67 -12.150 -4.835 5.298 1.00 0.00 C ATOM 963 O ASP A 67 -11.986 -3.615 5.291 1.00 0.00 O ATOM 964 CB ASP A 67 -12.444 -6.239 3.248 1.00 0.00 C ATOM 965 CG ASP A 67 -13.553 -7.060 3.878 1.00 0.00 C ATOM 966 OD1 ASP A 67 -13.374 -8.287 4.024 1.00 0.00 O ATOM 967 OD2 ASP A 67 -14.600 -6.474 4.225 1.00 0.00 O ATOM 0 H ASP A 67 -10.917 -7.743 4.490 1.00 0.00 H new ATOM 0 HA ASP A 67 -10.682 -5.130 3.773 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -12.879 -5.393 2.715 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -11.921 -6.846 2.509 1.00 0.00 H new ATOM 972 N GLU A 68 -12.939 -5.455 6.170 1.00 0.00 N ATOM 973 CA GLU A 68 -13.675 -4.719 7.191 1.00 0.00 C ATOM 974 C GLU A 68 -12.745 -3.794 7.971 1.00 0.00 C ATOM 975 O GLU A 68 -13.082 -2.642 8.240 1.00 0.00 O ATOM 976 CB GLU A 68 -14.369 -5.688 8.150 1.00 0.00 C ATOM 977 CG GLU A 68 -13.409 -6.602 8.893 1.00 0.00 C ATOM 978 CD GLU A 68 -14.125 -7.659 9.711 1.00 0.00 C ATOM 979 OE1 GLU A 68 -14.609 -8.644 9.115 1.00 0.00 O ATOM 980 OE2 GLU A 68 -14.201 -7.501 10.947 1.00 0.00 O ATOM 0 H GLU A 68 -13.085 -6.464 6.190 1.00 0.00 H new ATOM 0 HA GLU A 68 -14.429 -4.111 6.691 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -14.947 -5.116 8.875 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -15.076 -6.298 7.588 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -12.748 -7.089 8.176 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -12.779 -6.003 9.551 1.00 0.00 H new ATOM 987 N GLU A 69 -11.573 -4.309 8.331 1.00 0.00 N ATOM 988 CA GLU A 69 -10.595 -3.530 9.082 1.00 0.00 C ATOM 989 C GLU A 69 -9.946 -2.472 8.194 1.00 0.00 C ATOM 990 O GLU A 69 -9.649 -1.365 8.643 1.00 0.00 O ATOM 991 CB GLU A 69 -9.522 -4.448 9.669 1.00 0.00 C ATOM 992 CG GLU A 69 -9.999 -5.256 10.865 1.00 0.00 C ATOM 993 CD GLU A 69 -8.854 -5.768 11.717 1.00 0.00 C ATOM 994 OE1 GLU A 69 -7.951 -4.969 12.040 1.00 0.00 O ATOM 995 OE2 GLU A 69 -8.862 -6.968 12.061 1.00 0.00 O ATOM 0 H GLU A 69 -11.278 -5.261 8.115 1.00 0.00 H new ATOM 0 HA GLU A 69 -11.116 -3.026 9.896 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -9.177 -5.132 8.893 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -8.664 -3.846 9.967 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -10.655 -4.638 11.478 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -10.592 -6.101 10.515 1.00 0.00 H new ATOM 1002 N THR A 70 -9.727 -2.822 6.930 1.00 0.00 N ATOM 1003 CA THR A 70 -9.111 -1.905 5.979 1.00 0.00 C ATOM 1004 C THR A 70 -9.924 -0.623 5.846 1.00 0.00 C ATOM 1005 O THR A 70 -9.371 0.477 5.848 1.00 0.00 O ATOM 1006 CB THR A 70 -8.964 -2.553 4.589 1.00 0.00 C ATOM 1007 OG1 THR A 70 -8.326 -3.829 4.709 1.00 0.00 O ATOM 1008 CG2 THR A 70 -8.154 -1.661 3.660 1.00 0.00 C ATOM 0 H THR A 70 -9.967 -3.734 6.541 1.00 0.00 H new ATOM 0 HA THR A 70 -8.121 -1.665 6.367 1.00 0.00 H new ATOM 0 HB THR A 70 -9.960 -2.683 4.165 1.00 0.00 H new ATOM 0 HG1 THR A 70 -8.410 -4.317 3.863 1.00 0.00 H new ATOM 0 HG21 THR A 70 -8.063 -2.139 2.685 1.00 0.00 H new ATOM 0 HG22 THR A 70 -8.657 -0.700 3.548 1.00 0.00 H new ATOM 0 HG23 THR A 70 -7.161 -1.504 4.081 1.00 0.00 H new ATOM 1016 N ARG A 71 -11.240 -0.771 5.732 1.00 0.00 N ATOM 1017 CA ARG A 71 -12.129 0.376 5.598 1.00 0.00 C ATOM 1018 C ARG A 71 -12.215 1.154 6.908 1.00 0.00 C ATOM 1019 O ARG A 71 -12.026 2.370 6.933 1.00 0.00 O ATOM 1020 CB ARG A 71 -13.526 -0.081 5.172 1.00 0.00 C ATOM 1021 CG ARG A 71 -13.520 -1.031 3.985 1.00 0.00 C ATOM 1022 CD ARG A 71 -14.912 -1.568 3.695 1.00 0.00 C ATOM 1023 NE ARG A 71 -14.871 -2.901 3.098 1.00 0.00 N ATOM 1024 CZ ARG A 71 -15.942 -3.673 2.950 1.00 0.00 C ATOM 1025 NH1 ARG A 71 -17.131 -3.247 3.353 1.00 0.00 N ATOM 1026 NH2 ARG A 71 -15.824 -4.874 2.398 1.00 0.00 N ATOM 0 H ARG A 71 -11.714 -1.674 5.730 1.00 0.00 H new ATOM 0 HA ARG A 71 -11.719 1.033 4.831 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -14.012 -0.570 6.016 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -14.125 0.795 4.923 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -13.138 -0.513 3.105 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -12.843 -1.861 4.185 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -15.487 -1.603 4.620 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -15.431 -0.885 3.022 1.00 0.00 H new ATOM 0 HE ARG A 71 -13.971 -3.258 2.777 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -17.225 -2.324 3.778 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -17.952 -3.842 3.238 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -14.911 -5.205 2.087 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -16.647 -5.466 2.285 1.00 0.00 H new ATOM 1040 N ASP A 72 -12.502 0.444 7.994 1.00 0.00 N ATOM 1041 CA ASP A 72 -12.612 1.067 9.308 1.00 0.00 C ATOM 1042 C ASP A 72 -11.308 1.759 9.692 1.00 0.00 C ATOM 1043 O ASP A 72 -11.315 2.795 10.355 1.00 0.00 O ATOM 1044 CB ASP A 72 -12.980 0.021 10.362 1.00 0.00 C ATOM 1045 CG ASP A 72 -14.478 -0.175 10.485 1.00 0.00 C ATOM 1046 OD1 ASP A 72 -15.147 -0.301 9.439 1.00 0.00 O ATOM 1047 OD2 ASP A 72 -14.981 -0.201 11.628 1.00 0.00 O ATOM 0 H ASP A 72 -12.663 -0.563 7.990 1.00 0.00 H new ATOM 0 HA ASP A 72 -13.400 1.818 9.263 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -12.512 -0.929 10.105 1.00 0.00 H new ATOM 0 HB3 ASP A 72 -12.576 0.325 11.328 1.00 0.00 H new ATOM 1052 N GLY A 73 -10.189 1.177 9.272 1.00 0.00 N ATOM 1053 CA GLY A 73 -8.893 1.750 9.583 1.00 0.00 C ATOM 1054 C GLY A 73 -8.518 2.880 8.644 1.00 0.00 C ATOM 1055 O GLY A 73 -7.805 3.807 9.030 1.00 0.00 O ATOM 0 H GLY A 73 -10.157 0.319 8.722 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -8.900 2.121 10.608 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -8.133 0.971 9.531 1.00 0.00 H new ATOM 1059 N PHE A 74 -8.998 2.803 7.408 1.00 0.00 N ATOM 1060 CA PHE A 74 -8.708 3.826 6.410 1.00 0.00 C ATOM 1061 C PHE A 74 -9.460 5.117 6.719 1.00 0.00 C ATOM 1062 O PHE A 74 -8.975 6.213 6.438 1.00 0.00 O ATOM 1063 CB PHE A 74 -9.081 3.326 5.013 1.00 0.00 C ATOM 1064 CG PHE A 74 -9.242 4.428 4.005 1.00 0.00 C ATOM 1065 CD1 PHE A 74 -10.469 5.045 3.823 1.00 0.00 C ATOM 1066 CD2 PHE A 74 -8.166 4.846 3.239 1.00 0.00 C ATOM 1067 CE1 PHE A 74 -10.620 6.060 2.897 1.00 0.00 C ATOM 1068 CE2 PHE A 74 -8.311 5.861 2.311 1.00 0.00 C ATOM 1069 CZ PHE A 74 -9.540 6.468 2.139 1.00 0.00 C ATOM 0 H PHE A 74 -9.590 2.043 7.073 1.00 0.00 H new ATOM 0 HA PHE A 74 -7.638 4.034 6.440 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -8.312 2.636 4.665 1.00 0.00 H new ATOM 0 HB3 PHE A 74 -10.012 2.762 5.074 1.00 0.00 H new ATOM 0 HD1 PHE A 74 -11.318 4.729 4.412 1.00 0.00 H new ATOM 0 HD2 PHE A 74 -7.203 4.374 3.368 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -11.582 6.534 2.766 1.00 0.00 H new ATOM 0 HE2 PHE A 74 -7.464 6.179 1.721 1.00 0.00 H new ATOM 0 HZ PHE A 74 -9.656 7.260 1.414 1.00 0.00 H new ATOM 1079 N ARG A 75 -10.649 4.978 7.297 1.00 0.00 N ATOM 1080 CA ARG A 75 -11.470 6.132 7.643 1.00 0.00 C ATOM 1081 C ARG A 75 -10.873 6.889 8.826 1.00 0.00 C ATOM 1082 O ARG A 75 -10.748 8.114 8.793 1.00 0.00 O ATOM 1083 CB ARG A 75 -12.896 5.689 7.974 1.00 0.00 C ATOM 1084 CG ARG A 75 -13.658 5.144 6.777 1.00 0.00 C ATOM 1085 CD ARG A 75 -15.156 5.113 7.037 1.00 0.00 C ATOM 1086 NE ARG A 75 -15.711 6.454 7.204 1.00 0.00 N ATOM 1087 CZ ARG A 75 -16.911 6.693 7.720 1.00 0.00 C ATOM 1088 NH1 ARG A 75 -17.678 5.688 8.118 1.00 0.00 N ATOM 1089 NH2 ARG A 75 -17.346 7.941 7.839 1.00 0.00 N ATOM 0 H ARG A 75 -11.065 4.078 7.535 1.00 0.00 H new ATOM 0 HA ARG A 75 -11.495 6.800 6.782 1.00 0.00 H new ATOM 0 HB2 ARG A 75 -12.859 4.924 8.749 1.00 0.00 H new ATOM 0 HB3 ARG A 75 -13.444 6.536 8.388 1.00 0.00 H new ATOM 0 HG2 ARG A 75 -13.452 5.761 5.902 1.00 0.00 H new ATOM 0 HG3 ARG A 75 -13.307 4.138 6.548 1.00 0.00 H new ATOM 0 HD2 ARG A 75 -15.657 4.614 6.208 1.00 0.00 H new ATOM 0 HD3 ARG A 75 -15.356 4.524 7.932 1.00 0.00 H new ATOM 0 HE ARG A 75 -15.146 7.250 6.908 1.00 0.00 H new ATOM 0 HH11 ARG A 75 -17.347 4.727 8.028 1.00 0.00 H new ATOM 0 HH12 ARG A 75 -18.599 5.875 8.514 1.00 0.00 H new ATOM 0 HH21 ARG A 75 -16.759 8.717 7.534 1.00 0.00 H new ATOM 0 HH22 ARG A 75 -18.268 8.124 8.235 1.00 0.00 H new ATOM 1103 N LEU A 76 -10.507 6.152 9.869 1.00 0.00 N ATOM 1104 CA LEU A 76 -9.924 6.754 11.063 1.00 0.00 C ATOM 1105 C LEU A 76 -8.498 7.223 10.795 1.00 0.00 C ATOM 1106 O LEU A 76 -8.063 8.249 11.318 1.00 0.00 O ATOM 1107 CB LEU A 76 -9.936 5.753 12.220 1.00 0.00 C ATOM 1108 CG LEU A 76 -11.224 4.949 12.399 1.00 0.00 C ATOM 1109 CD1 LEU A 76 -10.931 3.612 13.062 1.00 0.00 C ATOM 1110 CD2 LEU A 76 -12.237 5.740 13.213 1.00 0.00 C ATOM 0 H LEU A 76 -10.604 5.137 9.912 1.00 0.00 H new ATOM 0 HA LEU A 76 -10.526 7.621 11.335 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -9.112 5.054 12.078 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -9.738 6.295 13.145 1.00 0.00 H new ATOM 0 HG LEU A 76 -11.650 4.757 11.414 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -11.860 3.054 13.181 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -10.241 3.041 12.440 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -10.482 3.782 14.040 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -13.148 5.153 13.331 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -11.820 5.963 14.195 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -12.470 6.672 12.697 1.00 0.00 H new ATOM 1122 N SER A 77 -7.775 6.466 9.976 1.00 0.00 N ATOM 1123 CA SER A 77 -6.397 6.803 9.640 1.00 0.00 C ATOM 1124 C SER A 77 -6.340 8.056 8.772 1.00 0.00 C ATOM 1125 O SER A 77 -5.359 8.799 8.799 1.00 0.00 O ATOM 1126 CB SER A 77 -5.727 5.635 8.913 1.00 0.00 C ATOM 1127 OG SER A 77 -5.443 4.573 9.808 1.00 0.00 O ATOM 0 H SER A 77 -8.121 5.615 9.533 1.00 0.00 H new ATOM 0 HA SER A 77 -5.861 7.000 10.568 1.00 0.00 H new ATOM 0 HB2 SER A 77 -6.378 5.278 8.115 1.00 0.00 H new ATOM 0 HB3 SER A 77 -4.804 5.976 8.444 1.00 0.00 H new ATOM 0 HG SER A 77 -6.198 3.949 9.825 1.00 0.00 H new ATOM 1133 N SER A 78 -7.401 8.285 8.004 1.00 0.00 N ATOM 1134 CA SER A 78 -7.472 9.446 7.125 1.00 0.00 C ATOM 1135 C SER A 78 -7.749 10.716 7.924 1.00 0.00 C ATOM 1136 O SER A 78 -7.023 11.703 7.811 1.00 0.00 O ATOM 1137 CB SER A 78 -8.560 9.246 6.068 1.00 0.00 C ATOM 1138 OG SER A 78 -9.708 8.632 6.628 1.00 0.00 O ATOM 0 H SER A 78 -8.223 7.682 7.973 1.00 0.00 H new ATOM 0 HA SER A 78 -6.508 9.554 6.627 1.00 0.00 H new ATOM 0 HB2 SER A 78 -8.833 10.209 5.636 1.00 0.00 H new ATOM 0 HB3 SER A 78 -8.174 8.630 5.256 1.00 0.00 H new ATOM 0 HG SER A 78 -9.744 7.692 6.352 1.00 0.00 H new ATOM 1144 N GLN A 79 -8.805 10.681 8.730 1.00 0.00 N ATOM 1145 CA GLN A 79 -9.180 11.830 9.547 1.00 0.00 C ATOM 1146 C GLN A 79 -7.994 12.321 10.371 1.00 0.00 C ATOM 1147 O GLN A 79 -7.858 13.517 10.627 1.00 0.00 O ATOM 1148 CB GLN A 79 -10.344 11.467 10.471 1.00 0.00 C ATOM 1149 CG GLN A 79 -9.980 10.442 11.533 1.00 0.00 C ATOM 1150 CD GLN A 79 -11.032 10.329 12.619 1.00 0.00 C ATOM 1151 OE1 GLN A 79 -12.084 9.720 12.420 1.00 0.00 O ATOM 1152 NE2 GLN A 79 -10.753 10.917 13.777 1.00 0.00 N ATOM 0 H GLN A 79 -9.416 9.871 8.835 1.00 0.00 H new ATOM 0 HA GLN A 79 -9.493 12.633 8.880 1.00 0.00 H new ATOM 0 HB2 GLN A 79 -10.705 12.372 10.960 1.00 0.00 H new ATOM 0 HB3 GLN A 79 -11.167 11.079 9.870 1.00 0.00 H new ATOM 0 HG2 GLN A 79 -9.844 9.469 11.062 1.00 0.00 H new ATOM 0 HG3 GLN A 79 -9.026 10.714 11.984 1.00 0.00 H new ATOM 0 HE21 GLN A 79 -9.869 11.411 13.898 1.00 0.00 H new ATOM 0 HE22 GLN A 79 -11.423 10.874 14.545 1.00 0.00 H new ATOM 1161 N GLU A 80 -7.140 11.389 10.784 1.00 0.00 N ATOM 1162 CA GLU A 80 -5.967 11.729 11.581 1.00 0.00 C ATOM 1163 C GLU A 80 -5.009 12.614 10.789 1.00 0.00 C ATOM 1164 O GLU A 80 -4.705 13.735 11.194 1.00 0.00 O ATOM 1165 CB GLU A 80 -5.247 10.458 12.036 1.00 0.00 C ATOM 1166 CG GLU A 80 -5.899 9.783 13.231 1.00 0.00 C ATOM 1167 CD GLU A 80 -5.276 8.439 13.554 1.00 0.00 C ATOM 1168 OE1 GLU A 80 -4.032 8.365 13.628 1.00 0.00 O ATOM 1169 OE2 GLU A 80 -6.033 7.462 13.733 1.00 0.00 O ATOM 0 H GLU A 80 -7.238 10.394 10.580 1.00 0.00 H new ATOM 0 HA GLU A 80 -6.303 12.282 12.458 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -5.213 9.753 11.205 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -4.216 10.705 12.287 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -5.818 10.435 14.101 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -6.962 9.648 13.032 1.00 0.00 H new ATOM 1176 N ALA A 81 -4.536 12.100 9.658 1.00 0.00 N ATOM 1177 CA ALA A 81 -3.614 12.842 8.808 1.00 0.00 C ATOM 1178 C ALA A 81 -4.250 14.135 8.306 1.00 0.00 C ATOM 1179 O ALA A 81 -3.575 15.153 8.160 1.00 0.00 O ATOM 1180 CB ALA A 81 -3.167 11.982 7.636 1.00 0.00 C ATOM 0 H ALA A 81 -4.777 11.172 9.310 1.00 0.00 H new ATOM 0 HA ALA A 81 -2.741 13.105 9.405 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -2.479 12.550 7.010 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -2.665 11.090 8.010 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -4.036 11.690 7.047 1.00 0.00 H new ATOM 1186 N ALA A 82 -5.552 14.085 8.043 1.00 0.00 N ATOM 1187 CA ALA A 82 -6.278 15.252 7.559 1.00 0.00 C ATOM 1188 C ALA A 82 -6.079 16.447 8.486 1.00 0.00 C ATOM 1189 O ALA A 82 -5.801 17.557 8.032 1.00 0.00 O ATOM 1190 CB ALA A 82 -7.759 14.932 7.419 1.00 0.00 C ATOM 0 H ALA A 82 -6.125 13.249 8.157 1.00 0.00 H new ATOM 0 HA ALA A 82 -5.880 15.515 6.579 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -8.289 15.813 7.057 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -7.889 14.114 6.711 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -8.161 14.640 8.389 1.00 0.00 H new ATOM 1196 N SER A 83 -6.223 16.211 9.786 1.00 0.00 N ATOM 1197 CA SER A 83 -6.063 17.269 10.777 1.00 0.00 C ATOM 1198 C SER A 83 -4.612 17.366 11.239 1.00 0.00 C ATOM 1199 O SER A 83 -3.991 18.425 11.151 1.00 0.00 O ATOM 1200 CB SER A 83 -6.977 17.015 11.977 1.00 0.00 C ATOM 1201 OG SER A 83 -7.189 18.205 12.717 1.00 0.00 O ATOM 0 H SER A 83 -6.450 15.297 10.178 1.00 0.00 H new ATOM 0 HA SER A 83 -6.341 18.214 10.311 1.00 0.00 H new ATOM 0 HB2 SER A 83 -7.934 16.622 11.633 1.00 0.00 H new ATOM 0 HB3 SER A 83 -6.534 16.256 12.622 1.00 0.00 H new ATOM 0 HG SER A 83 -7.778 18.017 13.478 1.00 0.00 H new ATOM 1207 N SER A 84 -4.079 16.253 11.730 1.00 0.00 N ATOM 1208 CA SER A 84 -2.702 16.212 12.210 1.00 0.00 C ATOM 1209 C SER A 84 -1.805 17.109 11.364 1.00 0.00 C ATOM 1210 O SER A 84 -1.313 18.136 11.834 1.00 0.00 O ATOM 1211 CB SER A 84 -2.174 14.776 12.187 1.00 0.00 C ATOM 1212 OG SER A 84 -0.845 14.714 12.673 1.00 0.00 O ATOM 0 H SER A 84 -4.579 15.367 11.806 1.00 0.00 H new ATOM 0 HA SER A 84 -2.690 16.580 13.236 1.00 0.00 H new ATOM 0 HB2 SER A 84 -2.817 14.139 12.795 1.00 0.00 H new ATOM 0 HB3 SER A 84 -2.211 14.388 11.169 1.00 0.00 H new ATOM 0 HG SER A 84 -0.236 14.507 11.934 1.00 0.00 H new ATOM 1218 N PHE A 85 -1.596 16.715 10.112 1.00 0.00 N ATOM 1219 CA PHE A 85 -0.757 17.482 9.199 1.00 0.00 C ATOM 1220 C PHE A 85 -1.602 18.424 8.345 1.00 0.00 C ATOM 1221 O PHE A 85 -1.304 19.612 8.231 1.00 0.00 O ATOM 1222 CB PHE A 85 0.046 16.542 8.298 1.00 0.00 C ATOM 1223 CG PHE A 85 0.940 15.604 9.057 1.00 0.00 C ATOM 1224 CD1 PHE A 85 0.446 14.414 9.567 1.00 0.00 C ATOM 1225 CD2 PHE A 85 2.276 15.912 9.260 1.00 0.00 C ATOM 1226 CE1 PHE A 85 1.267 13.550 10.266 1.00 0.00 C ATOM 1227 CE2 PHE A 85 3.102 15.051 9.958 1.00 0.00 C ATOM 1228 CZ PHE A 85 2.597 13.868 10.461 1.00 0.00 C ATOM 0 H PHE A 85 -1.996 15.869 9.707 1.00 0.00 H new ATOM 0 HA PHE A 85 -0.067 18.080 9.795 1.00 0.00 H new ATOM 0 HB2 PHE A 85 -0.644 15.960 7.687 1.00 0.00 H new ATOM 0 HB3 PHE A 85 0.653 17.136 7.615 1.00 0.00 H new ATOM 0 HD1 PHE A 85 -0.593 14.159 9.416 1.00 0.00 H new ATOM 0 HD2 PHE A 85 2.676 16.835 8.868 1.00 0.00 H new ATOM 0 HE1 PHE A 85 0.869 12.626 10.660 1.00 0.00 H new ATOM 0 HE2 PHE A 85 4.141 15.303 10.110 1.00 0.00 H new ATOM 0 HZ PHE A 85 3.241 13.193 11.006 1.00 0.00 H new ATOM 1238 N GLY A 86 -2.659 17.882 7.746 1.00 0.00 N ATOM 1239 CA GLY A 86 -3.531 18.687 6.910 1.00 0.00 C ATOM 1240 C GLY A 86 -4.165 17.883 5.792 1.00 0.00 C ATOM 1241 O GLY A 86 -5.308 18.135 5.409 1.00 0.00 O ATOM 0 H GLY A 86 -2.926 16.901 7.825 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -4.315 19.128 7.526 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -2.960 19.511 6.482 1.00 0.00 H new ATOM 1245 N ASP A 87 -3.423 16.914 5.268 1.00 0.00 N ATOM 1246 CA ASP A 87 -3.920 16.071 4.186 1.00 0.00 C ATOM 1247 C ASP A 87 -4.386 14.721 4.721 1.00 0.00 C ATOM 1248 O ASP A 87 -3.943 14.274 5.779 1.00 0.00 O ATOM 1249 CB ASP A 87 -2.833 15.868 3.129 1.00 0.00 C ATOM 1250 CG ASP A 87 -2.863 16.936 2.055 1.00 0.00 C ATOM 1251 OD1 ASP A 87 -2.282 18.019 2.277 1.00 0.00 O ATOM 1252 OD2 ASP A 87 -3.467 16.690 0.990 1.00 0.00 O ATOM 0 H ASP A 87 -2.476 16.692 5.574 1.00 0.00 H new ATOM 0 HA ASP A 87 -4.772 16.574 3.727 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -1.856 15.870 3.612 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -2.958 14.889 2.667 1.00 0.00 H new ATOM 1257 N ASP A 88 -5.284 14.076 3.983 1.00 0.00 N ATOM 1258 CA ASP A 88 -5.811 12.777 4.382 1.00 0.00 C ATOM 1259 C ASP A 88 -5.101 11.650 3.637 1.00 0.00 C ATOM 1260 O ASP A 88 -5.588 10.520 3.591 1.00 0.00 O ATOM 1261 CB ASP A 88 -7.316 12.710 4.119 1.00 0.00 C ATOM 1262 CG ASP A 88 -7.644 12.665 2.640 1.00 0.00 C ATOM 1263 OD1 ASP A 88 -6.847 13.197 1.838 1.00 0.00 O ATOM 1264 OD2 ASP A 88 -8.697 12.097 2.283 1.00 0.00 O ATOM 0 H ASP A 88 -5.662 14.432 3.105 1.00 0.00 H new ATOM 0 HA ASP A 88 -5.631 12.652 5.450 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -7.728 11.826 4.607 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -7.799 13.577 4.569 1.00 0.00 H new ATOM 1269 N ARG A 89 -3.950 11.967 3.054 1.00 0.00 N ATOM 1270 CA ARG A 89 -3.175 10.982 2.308 1.00 0.00 C ATOM 1271 C ARG A 89 -2.796 9.802 3.198 1.00 0.00 C ATOM 1272 O ARG A 89 -2.170 9.975 4.245 1.00 0.00 O ATOM 1273 CB ARG A 89 -1.913 11.625 1.732 1.00 0.00 C ATOM 1274 CG ARG A 89 -2.190 12.850 0.875 1.00 0.00 C ATOM 1275 CD ARG A 89 -2.421 12.471 -0.580 1.00 0.00 C ATOM 1276 NE ARG A 89 -1.171 12.181 -1.275 1.00 0.00 N ATOM 1277 CZ ARG A 89 -1.096 11.922 -2.576 1.00 0.00 C ATOM 1278 NH1 ARG A 89 -2.194 11.920 -3.319 1.00 0.00 N ATOM 1279 NH2 ARG A 89 0.080 11.667 -3.136 1.00 0.00 N ATOM 0 H ARG A 89 -3.533 12.898 3.083 1.00 0.00 H new ATOM 0 HA ARG A 89 -3.793 10.614 1.489 1.00 0.00 H new ATOM 0 HB2 ARG A 89 -1.253 11.907 2.552 1.00 0.00 H new ATOM 0 HB3 ARG A 89 -1.380 10.886 1.133 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -3.065 13.374 1.259 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -1.350 13.541 0.943 1.00 0.00 H new ATOM 0 HD2 ARG A 89 -3.073 11.599 -0.628 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -2.938 13.284 -1.089 1.00 0.00 H new ATOM 0 HE ARG A 89 -0.307 12.177 -0.732 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -3.099 12.118 -2.892 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -2.134 11.721 -4.318 1.00 0.00 H new ATOM 0 HH21 ARG A 89 0.927 11.670 -2.568 1.00 0.00 H new ATOM 0 HH22 ARG A 89 0.137 11.468 -4.135 1.00 0.00 H new ATOM 1293 N LEU A 90 -3.179 8.602 2.776 1.00 0.00 N ATOM 1294 CA LEU A 90 -2.881 7.392 3.534 1.00 0.00 C ATOM 1295 C LEU A 90 -1.950 6.473 2.749 1.00 0.00 C ATOM 1296 O LEU A 90 -1.615 6.749 1.596 1.00 0.00 O ATOM 1297 CB LEU A 90 -4.173 6.652 3.882 1.00 0.00 C ATOM 1298 CG LEU A 90 -4.957 7.196 5.077 1.00 0.00 C ATOM 1299 CD1 LEU A 90 -6.033 6.209 5.504 1.00 0.00 C ATOM 1300 CD2 LEU A 90 -4.020 7.500 6.236 1.00 0.00 C ATOM 0 H LEU A 90 -3.697 8.441 1.912 1.00 0.00 H new ATOM 0 HA LEU A 90 -2.379 7.685 4.456 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -4.824 6.668 3.008 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -3.929 5.608 4.078 1.00 0.00 H new ATOM 0 HG LEU A 90 -5.443 8.124 4.776 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -6.580 6.613 6.355 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -6.722 6.041 4.676 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -5.569 5.264 5.787 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -4.595 7.886 7.077 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -3.505 6.587 6.537 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -3.287 8.245 5.926 1.00 0.00 H new ATOM 1312 N LEU A 91 -1.538 5.379 3.380 1.00 0.00 N ATOM 1313 CA LEU A 91 -0.648 4.417 2.739 1.00 0.00 C ATOM 1314 C LEU A 91 -0.994 2.992 3.159 1.00 0.00 C ATOM 1315 O LEU A 91 -1.741 2.780 4.115 1.00 0.00 O ATOM 1316 CB LEU A 91 0.808 4.725 3.093 1.00 0.00 C ATOM 1317 CG LEU A 91 1.432 5.925 2.379 1.00 0.00 C ATOM 1318 CD1 LEU A 91 2.849 6.164 2.878 1.00 0.00 C ATOM 1319 CD2 LEU A 91 1.424 5.712 0.873 1.00 0.00 C ATOM 0 H LEU A 91 -1.806 5.136 4.334 1.00 0.00 H new ATOM 0 HA LEU A 91 -0.779 4.501 1.660 1.00 0.00 H new ATOM 0 HB2 LEU A 91 0.872 4.893 4.168 1.00 0.00 H new ATOM 0 HB3 LEU A 91 1.409 3.843 2.872 1.00 0.00 H new ATOM 0 HG LEU A 91 0.835 6.809 2.604 1.00 0.00 H new ATOM 0 HD11 LEU A 91 3.278 7.021 2.359 1.00 0.00 H new ATOM 0 HD12 LEU A 91 2.829 6.361 3.950 1.00 0.00 H new ATOM 0 HD13 LEU A 91 3.457 5.281 2.683 1.00 0.00 H new ATOM 0 HD21 LEU A 91 1.872 6.576 0.381 1.00 0.00 H new ATOM 0 HD22 LEU A 91 1.997 4.818 0.629 1.00 0.00 H new ATOM 0 HD23 LEU A 91 0.397 5.590 0.528 1.00 0.00 H new ATOM 1331 N ILE A 92 -0.445 2.019 2.440 1.00 0.00 N ATOM 1332 CA ILE A 92 -0.694 0.614 2.740 1.00 0.00 C ATOM 1333 C ILE A 92 0.539 -0.236 2.452 1.00 0.00 C ATOM 1334 O ILE A 92 0.990 -0.326 1.311 1.00 0.00 O ATOM 1335 CB ILE A 92 -1.882 0.067 1.927 1.00 0.00 C ATOM 1336 CG1 ILE A 92 -3.090 0.995 2.061 1.00 0.00 C ATOM 1337 CG2 ILE A 92 -2.234 -1.340 2.387 1.00 0.00 C ATOM 1338 CD1 ILE A 92 -4.327 0.483 1.355 1.00 0.00 C ATOM 0 H ILE A 92 0.175 2.177 1.646 1.00 0.00 H new ATOM 0 HA ILE A 92 -0.933 0.555 3.802 1.00 0.00 H new ATOM 0 HB ILE A 92 -1.596 0.024 0.876 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -3.316 1.133 3.118 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -2.832 1.975 1.659 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -3.075 -1.714 1.804 1.00 0.00 H new ATOM 0 HG22 ILE A 92 -1.374 -1.995 2.245 1.00 0.00 H new ATOM 0 HG23 ILE A 92 -2.505 -1.321 3.443 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -5.144 1.192 1.492 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -4.119 0.371 0.291 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -4.611 -0.483 1.773 1.00 0.00 H new ATOM 1350 N GLU A 93 1.079 -0.858 3.496 1.00 0.00 N ATOM 1351 CA GLU A 93 2.260 -1.702 3.354 1.00 0.00 C ATOM 1352 C GLU A 93 2.021 -3.079 3.966 1.00 0.00 C ATOM 1353 O GLU A 93 1.209 -3.234 4.878 1.00 0.00 O ATOM 1354 CB GLU A 93 3.470 -1.040 4.017 1.00 0.00 C ATOM 1355 CG GLU A 93 3.933 0.224 3.313 1.00 0.00 C ATOM 1356 CD GLU A 93 2.821 1.242 3.150 1.00 0.00 C ATOM 1357 OE1 GLU A 93 1.976 1.348 4.063 1.00 0.00 O ATOM 1358 OE2 GLU A 93 2.795 1.932 2.109 1.00 0.00 O ATOM 0 H GLU A 93 0.718 -0.793 4.448 1.00 0.00 H new ATOM 0 HA GLU A 93 2.461 -1.826 2.290 1.00 0.00 H new ATOM 0 HB2 GLU A 93 3.221 -0.800 5.051 1.00 0.00 H new ATOM 0 HB3 GLU A 93 4.294 -1.753 4.045 1.00 0.00 H new ATOM 0 HG2 GLU A 93 4.750 0.672 3.878 1.00 0.00 H new ATOM 0 HG3 GLU A 93 4.329 -0.036 2.331 1.00 0.00 H new ATOM 1365 N LYS A 94 2.734 -4.078 3.457 1.00 0.00 N ATOM 1366 CA LYS A 94 2.602 -5.443 3.952 1.00 0.00 C ATOM 1367 C LYS A 94 3.059 -5.542 5.403 1.00 0.00 C ATOM 1368 O LYS A 94 4.090 -4.984 5.779 1.00 0.00 O ATOM 1369 CB LYS A 94 3.416 -6.404 3.083 1.00 0.00 C ATOM 1370 CG LYS A 94 3.576 -7.787 3.690 1.00 0.00 C ATOM 1371 CD LYS A 94 2.325 -8.628 3.499 1.00 0.00 C ATOM 1372 CE LYS A 94 2.650 -10.114 3.482 1.00 0.00 C ATOM 1373 NZ LYS A 94 1.516 -10.936 3.989 1.00 0.00 N ATOM 0 H LYS A 94 3.410 -3.968 2.701 1.00 0.00 H new ATOM 0 HA LYS A 94 1.549 -5.721 3.901 1.00 0.00 H new ATOM 0 HB2 LYS A 94 2.934 -6.497 2.110 1.00 0.00 H new ATOM 0 HB3 LYS A 94 4.403 -5.976 2.910 1.00 0.00 H new ATOM 0 HG2 LYS A 94 4.427 -8.290 3.232 1.00 0.00 H new ATOM 0 HG3 LYS A 94 3.795 -7.695 4.754 1.00 0.00 H new ATOM 0 HD2 LYS A 94 1.618 -8.418 4.302 1.00 0.00 H new ATOM 0 HD3 LYS A 94 1.838 -8.350 2.564 1.00 0.00 H new ATOM 0 HE2 LYS A 94 2.894 -10.421 2.465 1.00 0.00 H new ATOM 0 HE3 LYS A 94 3.534 -10.299 4.092 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 1.548 -11.879 3.551 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 1.591 -11.031 5.022 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 0.617 -10.473 3.748 1.00 0.00 H new ATOM 1387 N PHE A 95 2.287 -6.257 6.215 1.00 0.00 N ATOM 1388 CA PHE A 95 2.614 -6.430 7.626 1.00 0.00 C ATOM 1389 C PHE A 95 3.010 -7.874 7.919 1.00 0.00 C ATOM 1390 O PHE A 95 2.228 -8.800 7.703 1.00 0.00 O ATOM 1391 CB PHE A 95 1.424 -6.028 8.500 1.00 0.00 C ATOM 1392 CG PHE A 95 1.690 -6.161 9.972 1.00 0.00 C ATOM 1393 CD1 PHE A 95 1.610 -7.397 10.595 1.00 0.00 C ATOM 1394 CD2 PHE A 95 2.020 -5.052 10.733 1.00 0.00 C ATOM 1395 CE1 PHE A 95 1.853 -7.522 11.949 1.00 0.00 C ATOM 1396 CE2 PHE A 95 2.264 -5.171 12.088 1.00 0.00 C ATOM 1397 CZ PHE A 95 2.181 -6.408 12.697 1.00 0.00 C ATOM 0 H PHE A 95 1.431 -6.726 5.920 1.00 0.00 H new ATOM 0 HA PHE A 95 3.461 -5.785 7.859 1.00 0.00 H new ATOM 0 HB2 PHE A 95 1.154 -4.995 8.280 1.00 0.00 H new ATOM 0 HB3 PHE A 95 0.565 -6.645 8.237 1.00 0.00 H new ATOM 0 HD1 PHE A 95 1.355 -8.272 10.015 1.00 0.00 H new ATOM 0 HD2 PHE A 95 2.087 -4.083 10.262 1.00 0.00 H new ATOM 0 HE1 PHE A 95 1.787 -8.490 12.423 1.00 0.00 H new ATOM 0 HE2 PHE A 95 2.519 -4.298 12.670 1.00 0.00 H new ATOM 0 HZ PHE A 95 2.372 -6.504 13.756 1.00 0.00 H new ATOM 1407 N ILE A 96 4.231 -8.057 8.412 1.00 0.00 N ATOM 1408 CA ILE A 96 4.731 -9.388 8.736 1.00 0.00 C ATOM 1409 C ILE A 96 5.357 -9.416 10.126 1.00 0.00 C ATOM 1410 O ILE A 96 6.389 -8.788 10.367 1.00 0.00 O ATOM 1411 CB ILE A 96 5.773 -9.863 7.706 1.00 0.00 C ATOM 1412 CG1 ILE A 96 5.226 -9.706 6.286 1.00 0.00 C ATOM 1413 CG2 ILE A 96 6.159 -11.310 7.974 1.00 0.00 C ATOM 1414 CD1 ILE A 96 6.187 -10.171 5.214 1.00 0.00 C ATOM 0 H ILE A 96 4.891 -7.302 8.596 1.00 0.00 H new ATOM 0 HA ILE A 96 3.875 -10.062 8.712 1.00 0.00 H new ATOM 0 HB ILE A 96 6.666 -9.245 7.801 1.00 0.00 H new ATOM 0 HG12 ILE A 96 4.297 -10.269 6.199 1.00 0.00 H new ATOM 0 HG13 ILE A 96 4.981 -8.658 6.113 1.00 0.00 H new ATOM 0 HG21 ILE A 96 6.896 -11.632 7.238 1.00 0.00 H new ATOM 0 HG22 ILE A 96 6.584 -11.394 8.974 1.00 0.00 H new ATOM 0 HG23 ILE A 96 5.274 -11.942 7.902 1.00 0.00 H new ATOM 0 HD11 ILE A 96 5.733 -10.030 4.233 1.00 0.00 H new ATOM 0 HD12 ILE A 96 7.108 -9.591 5.274 1.00 0.00 H new ATOM 0 HD13 ILE A 96 6.413 -11.227 5.361 1.00 0.00 H new ATOM 1426 N ASP A 97 4.728 -10.150 11.038 1.00 0.00 N ATOM 1427 CA ASP A 97 5.225 -10.263 12.404 1.00 0.00 C ATOM 1428 C ASP A 97 6.686 -10.702 12.416 1.00 0.00 C ATOM 1429 O ASP A 97 7.494 -10.181 13.184 1.00 0.00 O ATOM 1430 CB ASP A 97 4.374 -11.256 13.198 1.00 0.00 C ATOM 1431 CG ASP A 97 5.103 -11.803 14.409 1.00 0.00 C ATOM 1432 OD1 ASP A 97 6.006 -11.109 14.923 1.00 0.00 O ATOM 1433 OD2 ASP A 97 4.770 -12.925 14.844 1.00 0.00 O ATOM 0 H ASP A 97 3.873 -10.675 10.856 1.00 0.00 H new ATOM 0 HA ASP A 97 5.156 -9.281 12.872 1.00 0.00 H new ATOM 0 HB2 ASP A 97 3.455 -10.766 13.521 1.00 0.00 H new ATOM 0 HB3 ASP A 97 4.083 -12.082 12.549 1.00 0.00 H new ATOM 1438 N ASN A 98 7.017 -11.664 11.561 1.00 0.00 N ATOM 1439 CA ASN A 98 8.380 -12.174 11.475 1.00 0.00 C ATOM 1440 C ASN A 98 8.608 -12.897 10.151 1.00 0.00 C ATOM 1441 O ASN A 98 7.735 -13.598 9.640 1.00 0.00 O ATOM 1442 CB ASN A 98 8.667 -13.122 12.642 1.00 0.00 C ATOM 1443 CG ASN A 98 7.625 -14.217 12.767 1.00 0.00 C ATOM 1444 OD1 ASN A 98 6.531 -13.992 13.285 1.00 0.00 O ATOM 1445 ND2 ASN A 98 7.962 -15.410 12.292 1.00 0.00 N ATOM 0 H ASN A 98 6.360 -12.106 10.918 1.00 0.00 H new ATOM 0 HA ASN A 98 9.062 -11.326 11.528 1.00 0.00 H new ATOM 0 HB2 ASN A 98 9.650 -13.573 12.507 1.00 0.00 H new ATOM 0 HB3 ASN A 98 8.703 -12.551 13.570 1.00 0.00 H new ATOM 0 HD21 ASN A 98 7.303 -16.186 12.348 1.00 0.00 H new ATOM 0 HD22 ASN A 98 8.880 -15.550 11.871 1.00 0.00 H new ATOM 1452 N PRO A 99 9.809 -12.723 9.581 1.00 0.00 N ATOM 1453 CA PRO A 99 10.181 -13.351 8.309 1.00 0.00 C ATOM 1454 C PRO A 99 10.351 -14.861 8.437 1.00 0.00 C ATOM 1455 O PRO A 99 10.656 -15.372 9.514 1.00 0.00 O ATOM 1456 CB PRO A 99 11.518 -12.690 7.964 1.00 0.00 C ATOM 1457 CG PRO A 99 12.079 -12.264 9.277 1.00 0.00 C ATOM 1458 CD PRO A 99 10.898 -11.901 10.134 1.00 0.00 C ATOM 0 HA PRO A 99 9.414 -13.214 7.547 1.00 0.00 H new ATOM 0 HB2 PRO A 99 12.185 -13.387 7.456 1.00 0.00 H new ATOM 0 HB3 PRO A 99 11.379 -11.839 7.298 1.00 0.00 H new ATOM 0 HG2 PRO A 99 12.659 -13.067 9.732 1.00 0.00 H new ATOM 0 HG3 PRO A 99 12.750 -11.414 9.157 1.00 0.00 H new ATOM 0 HD2 PRO A 99 11.079 -12.128 11.185 1.00 0.00 H new ATOM 0 HD3 PRO A 99 10.669 -10.837 10.073 1.00 0.00 H new ATOM 1466 N ARG A 100 10.151 -15.570 7.330 1.00 0.00 N ATOM 1467 CA ARG A 100 10.282 -17.022 7.319 1.00 0.00 C ATOM 1468 C ARG A 100 10.862 -17.505 5.993 1.00 0.00 C ATOM 1469 O ARG A 100 10.974 -16.738 5.036 1.00 0.00 O ATOM 1470 CB ARG A 100 8.922 -17.679 7.563 1.00 0.00 C ATOM 1471 CG ARG A 100 8.516 -17.714 9.027 1.00 0.00 C ATOM 1472 CD ARG A 100 7.236 -18.509 9.231 1.00 0.00 C ATOM 1473 NE ARG A 100 6.046 -17.672 9.104 1.00 0.00 N ATOM 1474 CZ ARG A 100 4.855 -18.009 9.587 1.00 0.00 C ATOM 1475 NH1 ARG A 100 4.697 -19.161 10.225 1.00 0.00 N ATOM 1476 NH2 ARG A 100 3.819 -17.194 9.431 1.00 0.00 N ATOM 0 H ARG A 100 9.898 -15.162 6.430 1.00 0.00 H new ATOM 0 HA ARG A 100 10.965 -17.307 8.120 1.00 0.00 H new ATOM 0 HB2 ARG A 100 8.162 -17.141 6.997 1.00 0.00 H new ATOM 0 HB3 ARG A 100 8.946 -18.698 7.177 1.00 0.00 H new ATOM 0 HG2 ARG A 100 9.318 -18.156 9.618 1.00 0.00 H new ATOM 0 HG3 ARG A 100 8.376 -16.696 9.391 1.00 0.00 H new ATOM 0 HD2 ARG A 100 7.191 -19.317 8.501 1.00 0.00 H new ATOM 0 HD3 ARG A 100 7.250 -18.972 10.218 1.00 0.00 H new ATOM 0 HE ARG A 100 6.134 -16.780 8.618 1.00 0.00 H new ATOM 0 HH11 ARG A 100 5.491 -19.790 10.346 1.00 0.00 H new ATOM 0 HH12 ARG A 100 3.782 -19.418 10.595 1.00 0.00 H new ATOM 0 HH21 ARG A 100 3.937 -16.308 8.940 1.00 0.00 H new ATOM 0 HH22 ARG A 100 2.905 -17.454 9.802 1.00 0.00 H new ATOM 1490 N HIS A 101 11.230 -18.782 5.944 1.00 0.00 N ATOM 1491 CA HIS A 101 11.799 -19.368 4.736 1.00 0.00 C ATOM 1492 C HIS A 101 10.876 -20.440 4.165 1.00 0.00 C ATOM 1493 O HIS A 101 11.019 -21.624 4.474 1.00 0.00 O ATOM 1494 CB HIS A 101 13.174 -19.967 5.033 1.00 0.00 C ATOM 1495 CG HIS A 101 13.907 -20.419 3.808 1.00 0.00 C ATOM 1496 ND1 HIS A 101 13.826 -21.703 3.313 1.00 0.00 N ATOM 1497 CD2 HIS A 101 14.739 -19.749 2.976 1.00 0.00 C ATOM 1498 CE1 HIS A 101 14.576 -21.804 2.230 1.00 0.00 C ATOM 1499 NE2 HIS A 101 15.141 -20.632 2.004 1.00 0.00 N ATOM 0 H HIS A 101 11.144 -19.430 6.727 1.00 0.00 H new ATOM 0 HA HIS A 101 11.909 -18.576 3.995 1.00 0.00 H new ATOM 0 HB2 HIS A 101 13.779 -19.226 5.556 1.00 0.00 H new ATOM 0 HB3 HIS A 101 13.054 -20.814 5.708 1.00 0.00 H new ATOM 0 HD2 HIS A 101 15.032 -18.713 3.061 1.00 0.00 H new ATOM 0 HE1 HIS A 101 14.705 -22.694 1.631 1.00 0.00 H new ATOM 0 HE2 HIS A 101 15.773 -20.417 1.233 1.00 0.00 H new ATOM 1508 N ILE A 102 9.930 -20.018 3.334 1.00 0.00 N ATOM 1509 CA ILE A 102 8.984 -20.943 2.721 1.00 0.00 C ATOM 1510 C ILE A 102 9.026 -20.844 1.200 1.00 0.00 C ATOM 1511 O ILE A 102 9.479 -19.843 0.645 1.00 0.00 O ATOM 1512 CB ILE A 102 7.545 -20.678 3.202 1.00 0.00 C ATOM 1513 CG1 ILE A 102 6.571 -21.642 2.522 1.00 0.00 C ATOM 1514 CG2 ILE A 102 7.151 -19.235 2.923 1.00 0.00 C ATOM 1515 CD1 ILE A 102 5.195 -21.654 3.151 1.00 0.00 C ATOM 0 H ILE A 102 9.798 -19.042 3.069 1.00 0.00 H new ATOM 0 HA ILE A 102 9.281 -21.946 3.026 1.00 0.00 H new ATOM 0 HB ILE A 102 7.501 -20.845 4.278 1.00 0.00 H new ATOM 0 HG12 ILE A 102 6.479 -21.371 1.470 1.00 0.00 H new ATOM 0 HG13 ILE A 102 6.986 -22.649 2.556 1.00 0.00 H new ATOM 0 HG21 ILE A 102 6.132 -19.063 3.268 1.00 0.00 H new ATOM 0 HG22 ILE A 102 7.830 -18.564 3.449 1.00 0.00 H new ATOM 0 HG23 ILE A 102 7.208 -19.043 1.852 1.00 0.00 H new ATOM 0 HD11 ILE A 102 4.557 -22.359 2.618 1.00 0.00 H new ATOM 0 HD12 ILE A 102 5.275 -21.955 4.196 1.00 0.00 H new ATOM 0 HD13 ILE A 102 4.760 -20.656 3.093 1.00 0.00 H new ATOM 1527 N SER A 103 8.548 -21.888 0.531 1.00 0.00 N ATOM 1528 CA SER A 103 8.532 -21.920 -0.927 1.00 0.00 C ATOM 1529 C SER A 103 7.514 -22.935 -1.437 1.00 0.00 C ATOM 1530 O SER A 103 7.297 -23.978 -0.821 1.00 0.00 O ATOM 1531 CB SER A 103 9.923 -22.261 -1.466 1.00 0.00 C ATOM 1532 OG SER A 103 10.790 -21.143 -1.383 1.00 0.00 O ATOM 0 H SER A 103 8.167 -22.723 0.975 1.00 0.00 H new ATOM 0 HA SER A 103 8.244 -20.931 -1.284 1.00 0.00 H new ATOM 0 HB2 SER A 103 10.342 -23.093 -0.900 1.00 0.00 H new ATOM 0 HB3 SER A 103 9.845 -22.588 -2.503 1.00 0.00 H new ATOM 0 HG SER A 103 10.430 -20.497 -0.740 1.00 0.00 H new ATOM 1538 N GLY A 104 6.891 -22.622 -2.569 1.00 0.00 N ATOM 1539 CA GLY A 104 5.902 -23.515 -3.144 1.00 0.00 C ATOM 1540 C GLY A 104 4.482 -23.057 -2.879 1.00 0.00 C ATOM 1541 O GLY A 104 4.226 -21.883 -2.608 1.00 0.00 O ATOM 0 H GLY A 104 7.054 -21.765 -3.098 1.00 0.00 H new ATOM 0 HA2 GLY A 104 6.063 -23.585 -4.220 1.00 0.00 H new ATOM 0 HA3 GLY A 104 6.040 -24.516 -2.735 1.00 0.00 H new ATOM 1545 N PRO A 105 3.528 -23.996 -2.959 1.00 0.00 N ATOM 1546 CA PRO A 105 2.110 -23.706 -2.730 1.00 0.00 C ATOM 1547 C PRO A 105 1.812 -23.387 -1.269 1.00 0.00 C ATOM 1548 O PRO A 105 2.722 -23.295 -0.445 1.00 0.00 O ATOM 1549 CB PRO A 105 1.410 -25.001 -3.148 1.00 0.00 C ATOM 1550 CG PRO A 105 2.440 -26.063 -2.968 1.00 0.00 C ATOM 1551 CD PRO A 105 3.761 -25.415 -3.278 1.00 0.00 C ATOM 0 HA PRO A 105 1.779 -22.829 -3.286 1.00 0.00 H new ATOM 0 HB2 PRO A 105 0.532 -25.193 -2.532 1.00 0.00 H new ATOM 0 HB3 PRO A 105 1.069 -24.951 -4.182 1.00 0.00 H new ATOM 0 HG2 PRO A 105 2.426 -26.452 -1.950 1.00 0.00 H new ATOM 0 HG3 PRO A 105 2.253 -26.905 -3.634 1.00 0.00 H new ATOM 0 HD2 PRO A 105 4.566 -25.835 -2.675 1.00 0.00 H new ATOM 0 HD3 PRO A 105 4.040 -25.551 -4.323 1.00 0.00 H new ATOM 1559 N SER A 106 0.531 -23.221 -0.953 1.00 0.00 N ATOM 1560 CA SER A 106 0.114 -22.909 0.409 1.00 0.00 C ATOM 1561 C SER A 106 -1.018 -23.830 0.854 1.00 0.00 C ATOM 1562 O SER A 106 -1.529 -24.628 0.069 1.00 0.00 O ATOM 1563 CB SER A 106 -0.334 -21.449 0.506 1.00 0.00 C ATOM 1564 OG SER A 106 0.776 -20.587 0.689 1.00 0.00 O ATOM 0 H SER A 106 -0.235 -23.297 -1.622 1.00 0.00 H new ATOM 0 HA SER A 106 0.967 -23.065 1.069 1.00 0.00 H new ATOM 0 HB2 SER A 106 -0.871 -21.169 -0.400 1.00 0.00 H new ATOM 0 HB3 SER A 106 -1.030 -21.333 1.337 1.00 0.00 H new ATOM 0 HG SER A 106 0.464 -19.660 0.746 1.00 0.00 H new ATOM 1570 N SER A 107 -1.403 -23.714 2.121 1.00 0.00 N ATOM 1571 CA SER A 107 -2.472 -24.538 2.674 1.00 0.00 C ATOM 1572 C SER A 107 -2.195 -26.019 2.433 1.00 0.00 C ATOM 1573 O SER A 107 -3.095 -26.781 2.082 1.00 0.00 O ATOM 1574 CB SER A 107 -3.816 -24.152 2.054 1.00 0.00 C ATOM 1575 OG SER A 107 -4.892 -24.514 2.902 1.00 0.00 O ATOM 0 H SER A 107 -0.991 -23.058 2.784 1.00 0.00 H new ATOM 0 HA SER A 107 -2.513 -24.363 3.749 1.00 0.00 H new ATOM 0 HB2 SER A 107 -3.840 -23.078 1.870 1.00 0.00 H new ATOM 0 HB3 SER A 107 -3.929 -24.644 1.088 1.00 0.00 H new ATOM 0 HG SER A 107 -5.740 -24.255 2.484 1.00 0.00 H new ATOM 1581 N GLY A 108 -0.941 -26.419 2.624 1.00 0.00 N ATOM 1582 CA GLY A 108 -0.567 -27.807 2.423 1.00 0.00 C ATOM 1583 C GLY A 108 0.936 -28.004 2.399 1.00 0.00 C ATOM 1584 O GLY A 108 1.684 -27.196 2.950 1.00 0.00 O ATOM 0 H GLY A 108 -0.178 -25.807 2.914 1.00 0.00 H new ATOM 0 HA2 GLY A 108 -0.998 -28.415 3.219 1.00 0.00 H new ATOM 0 HA3 GLY A 108 -0.992 -28.163 1.484 1.00 0.00 H new TER 1588 GLY A 108