USER MOD reduce.3.24.130724 H: found=0, std=0, add=831, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 831 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 Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 142:sc= 0.805 (180deg=0.521!) USER MOD Single : A 3 HIS : no HD1:sc=-0.00974 X(o=-0.0097,f=-0.019) USER MOD Single : A 4 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 5 HIS : no HD1:sc= -0.609 K(o=-0.61,f=0.16) USER MOD Single : A 6 HIS : no HD1:sc= 0 X(o=0,f=-0.0073) USER MOD Single : A 7 HIS : no HD1:sc= -0.0261 X(o=-0.026,f=0) USER MOD Single : A 8 HIS : no HD1:sc= 0 X(o=0,f=-0.032) USER MOD Single : A 9 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 11 THR OG1 : rot 126:sc= 0.353 USER MOD Single : A 15 GLN : amide:sc= -0.0419 K(o=-0.042,f=-0.54) USER MOD Single : A 16 THR OG1 : rot 96:sc= 0.764 USER MOD Single : A 17 GLN : amide:sc= -0.893 K(o=-0.89,f=0) USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 28 THR OG1 : rot 68:sc= 0.751 USER MOD Single : A 40 THR OG1 : rot 180:sc= -0.24 USER MOD Single : A 42 THR OG1 : rot -87:sc= 0.864 USER MOD Single : A 45 GLN : amide:sc= 0 X(o=0,f=-0.0049) USER MOD Single : A 47 GLN : amide:sc= -2.47! C(o=-2.5!,f=-3.3!) USER MOD Single : A 52 LYS NZ :NH3+ 150:sc= 1.02 (180deg=0.496) USER MOD Single : A 54 THR OG1 : rot -76:sc= 0.875 USER MOD Single : A 58 SER OG : rot 180:sc=-0.00207 USER MOD Single : A 59 SER OG : rot 83:sc= 0.0383 USER MOD Single : A 61 GLN : amide:sc= 0 X(o=0,f=-0.27) USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 68 LYS NZ :NH3+ 169:sc=-0.00918 (180deg=-0.132) USER MOD Single : A 73 LYS NZ :NH3+ 171:sc= -0.0226 (180deg=-0.12) USER MOD Single : A 79 THR OG1 : rot 180:sc= 0 USER MOD Single : A 80 LYS NZ :NH3+ -115:sc= 1.84 (180deg=-3.15!) USER MOD Single : A 84 THR OG1 : rot 180:sc= -0.137 USER MOD Single : A 86 GLN : amide:sc= 0 K(o=0,f=-0.51) USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 93 SER OG : rot 66:sc= 1.22 USER MOD Single : A 107 SER OG : rot -29:sc= 0.533 USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 111 ASN : amide:sc= -0.0618 K(o=-0.062,f=-0.92) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -6.642 13.089 -68.549 1.00 42.33 N ATOM 2 CA MET A 1 -7.635 14.134 -68.904 1.00 64.05 C ATOM 3 C MET A 1 -8.129 14.836 -67.642 1.00 13.42 C ATOM 4 O MET A 1 -7.812 14.410 -66.529 1.00 71.30 O ATOM 5 CB MET A 1 -8.821 13.527 -69.673 1.00 34.21 C ATOM 6 CG MET A 1 -8.447 12.948 -71.033 1.00 22.10 C ATOM 7 SD MET A 1 -7.273 11.584 -70.910 1.00 51.33 S ATOM 8 CE MET A 1 -7.052 11.165 -72.641 1.00 62.53 C ATOM 0 H1 MET A 1 -6.777 12.260 -69.162 1.00 42.33 H new ATOM 0 H2 MET A 1 -5.681 13.464 -68.680 1.00 42.33 H new ATOM 0 H3 MET A 1 -6.772 12.810 -67.556 1.00 42.33 H new ATOM 0 HA MET A 1 -7.148 14.864 -69.551 1.00 64.05 H new ATOM 0 HB2 MET A 1 -9.270 12.741 -69.066 1.00 34.21 H new ATOM 0 HB3 MET A 1 -9.581 14.295 -69.813 1.00 34.21 H new ATOM 0 HG2 MET A 1 -9.349 12.601 -71.536 1.00 22.10 H new ATOM 0 HG3 MET A 1 -8.019 13.735 -71.653 1.00 22.10 H new ATOM 0 HE1 MET A 1 -6.351 10.335 -72.728 1.00 62.53 H new ATOM 0 HE2 MET A 1 -8.011 10.876 -73.071 1.00 62.53 H new ATOM 0 HE3 MET A 1 -6.660 12.029 -73.177 1.00 62.53 H new ATOM 20 N ALA A 2 -8.904 15.908 -67.817 1.00 15.35 N ATOM 21 CA ALA A 2 -9.401 16.701 -66.693 1.00 62.22 C ATOM 22 C ALA A 2 -10.367 15.895 -65.820 1.00 54.21 C ATOM 23 O ALA A 2 -11.586 15.965 -65.983 1.00 13.45 O ATOM 24 CB ALA A 2 -10.066 17.980 -67.195 1.00 15.21 C ATOM 0 H ALA A 2 -9.202 16.248 -68.732 1.00 15.35 H new ATOM 0 HA ALA A 2 -8.547 16.972 -66.073 1.00 62.22 H new ATOM 0 HB1 ALA A 2 -10.430 18.558 -66.346 1.00 15.21 H new ATOM 0 HB2 ALA A 2 -9.341 18.572 -67.753 1.00 15.21 H new ATOM 0 HB3 ALA A 2 -10.903 17.724 -67.845 1.00 15.21 H new ATOM 30 N HIS A 3 -9.806 15.100 -64.913 1.00 62.30 N ATOM 31 CA HIS A 3 -10.587 14.318 -63.952 1.00 61.24 C ATOM 32 C HIS A 3 -9.879 14.328 -62.601 1.00 75.23 C ATOM 33 O HIS A 3 -8.782 13.784 -62.467 1.00 31.12 O ATOM 34 CB HIS A 3 -10.776 12.869 -64.440 1.00 53.45 C ATOM 35 CG HIS A 3 -11.565 12.749 -65.711 1.00 10.41 C ATOM 36 ND1 HIS A 3 -11.033 12.263 -66.885 1.00 44.13 N ATOM 37 CD2 HIS A 3 -12.856 13.057 -65.986 1.00 54.24 C ATOM 38 CE1 HIS A 3 -11.958 12.277 -67.825 1.00 44.22 C ATOM 39 NE2 HIS A 3 -13.074 12.752 -67.307 1.00 52.33 N ATOM 0 H HIS A 3 -8.797 14.978 -64.821 1.00 62.30 H new ATOM 0 HA HIS A 3 -11.574 14.769 -63.854 1.00 61.24 H new ATOM 0 HB2 HIS A 3 -9.796 12.416 -64.589 1.00 53.45 H new ATOM 0 HB3 HIS A 3 -11.276 12.296 -63.659 1.00 53.45 H new ATOM 0 HD2 HIS A 3 -13.578 13.466 -65.295 1.00 54.24 H new ATOM 0 HE1 HIS A 3 -11.824 11.954 -68.847 1.00 44.22 H new ATOM 0 HE2 HIS A 3 -13.955 12.873 -67.806 1.00 52.33 H new ATOM 48 N HIS A 4 -10.493 14.968 -61.608 1.00 45.44 N ATOM 49 CA HIS A 4 -9.889 15.104 -60.281 1.00 14.04 C ATOM 50 C HIS A 4 -10.924 14.863 -59.187 1.00 24.20 C ATOM 51 O HIS A 4 -12.129 14.827 -59.455 1.00 32.41 O ATOM 52 CB HIS A 4 -9.254 16.497 -60.111 1.00 31.14 C ATOM 53 CG HIS A 4 -8.051 16.729 -60.980 1.00 25.40 C ATOM 54 ND1 HIS A 4 -6.777 16.352 -60.616 1.00 41.35 N ATOM 55 CD2 HIS A 4 -7.934 17.301 -62.203 1.00 61.12 C ATOM 56 CE1 HIS A 4 -5.932 16.677 -61.574 1.00 25.52 C ATOM 57 NE2 HIS A 4 -6.607 17.256 -62.548 1.00 63.11 N ATOM 0 H HIS A 4 -11.412 15.402 -61.696 1.00 45.44 H new ATOM 0 HA HIS A 4 -9.106 14.351 -60.190 1.00 14.04 H new ATOM 0 HB2 HIS A 4 -10.003 17.256 -60.335 1.00 31.14 H new ATOM 0 HB3 HIS A 4 -8.967 16.630 -59.068 1.00 31.14 H new ATOM 0 HD2 HIS A 4 -8.736 17.715 -62.796 1.00 61.12 H new ATOM 0 HE1 HIS A 4 -4.867 16.499 -61.563 1.00 25.52 H new ATOM 0 HE2 HIS A 4 -6.207 17.612 -63.416 1.00 63.11 H new ATOM 66 N HIS A 5 -10.441 14.712 -57.956 1.00 43.15 N ATOM 67 CA HIS A 5 -11.294 14.423 -56.803 1.00 52.04 C ATOM 68 C HIS A 5 -12.032 15.690 -56.363 1.00 31.33 C ATOM 69 O HIS A 5 -11.398 16.698 -56.037 1.00 44.54 O ATOM 70 CB HIS A 5 -10.428 13.876 -55.651 1.00 13.13 C ATOM 71 CG HIS A 5 -11.205 13.252 -54.525 1.00 51.14 C ATOM 72 ND1 HIS A 5 -11.279 11.888 -54.334 1.00 45.22 N ATOM 73 CD2 HIS A 5 -11.925 13.808 -53.520 1.00 75.11 C ATOM 74 CE1 HIS A 5 -12.013 11.632 -53.264 1.00 22.22 C ATOM 75 NE2 HIS A 5 -12.415 12.779 -52.753 1.00 71.23 N ATOM 0 H HIS A 5 -9.449 14.786 -57.729 1.00 43.15 H new ATOM 0 HA HIS A 5 -12.035 13.673 -57.079 1.00 52.04 H new ATOM 0 HB2 HIS A 5 -9.738 13.134 -56.053 1.00 13.13 H new ATOM 0 HB3 HIS A 5 -9.823 14.690 -55.250 1.00 13.13 H new ATOM 0 HD2 HIS A 5 -12.084 14.863 -53.353 1.00 75.11 H new ATOM 0 HE1 HIS A 5 -12.244 10.651 -52.875 1.00 22.22 H new ATOM 0 HE2 HIS A 5 -12.996 12.885 -51.922 1.00 71.23 H new ATOM 84 N HIS A 6 -13.362 15.645 -56.373 1.00 45.44 N ATOM 85 CA HIS A 6 -14.173 16.787 -55.943 1.00 65.41 C ATOM 86 C HIS A 6 -13.982 17.056 -54.452 1.00 61.41 C ATOM 87 O HIS A 6 -13.789 16.129 -53.665 1.00 42.22 O ATOM 88 CB HIS A 6 -15.655 16.557 -56.274 1.00 63.14 C ATOM 89 CG HIS A 6 -15.989 16.804 -57.718 1.00 1.11 C ATOM 90 ND1 HIS A 6 -17.052 17.581 -58.122 1.00 42.22 N ATOM 91 CD2 HIS A 6 -15.384 16.382 -58.858 1.00 65.43 C ATOM 92 CE1 HIS A 6 -17.090 17.627 -59.440 1.00 42.01 C ATOM 93 NE2 HIS A 6 -16.089 16.907 -59.912 1.00 73.25 N ATOM 0 H HIS A 6 -13.902 14.833 -56.673 1.00 45.44 H new ATOM 0 HA HIS A 6 -13.838 17.668 -56.490 1.00 65.41 H new ATOM 0 HB2 HIS A 6 -15.922 15.532 -56.017 1.00 63.14 H new ATOM 0 HB3 HIS A 6 -16.265 17.211 -55.651 1.00 63.14 H new ATOM 0 HD2 HIS A 6 -14.510 15.751 -58.923 1.00 65.43 H new ATOM 0 HE1 HIS A 6 -17.817 18.163 -60.032 1.00 42.01 H new ATOM 0 HE2 HIS A 6 -15.875 16.764 -60.899 1.00 73.25 H new ATOM 102 N HIS A 7 -14.036 18.329 -54.073 1.00 41.25 N ATOM 103 CA HIS A 7 -13.718 18.750 -52.708 1.00 71.21 C ATOM 104 C HIS A 7 -14.941 18.690 -51.793 1.00 1.31 C ATOM 105 O HIS A 7 -16.034 19.128 -52.163 1.00 43.01 O ATOM 106 CB HIS A 7 -13.136 20.168 -52.715 1.00 4.24 C ATOM 107 CG HIS A 7 -11.826 20.273 -53.438 1.00 51.54 C ATOM 108 ND1 HIS A 7 -10.624 20.477 -52.796 1.00 41.15 N ATOM 109 CD2 HIS A 7 -11.534 20.192 -54.758 1.00 64.14 C ATOM 110 CE1 HIS A 7 -9.653 20.518 -53.688 1.00 54.14 C ATOM 111 NE2 HIS A 7 -10.177 20.348 -54.883 1.00 55.45 N ATOM 0 H HIS A 7 -14.299 19.094 -54.695 1.00 41.25 H new ATOM 0 HA HIS A 7 -12.977 18.055 -52.314 1.00 71.21 H new ATOM 0 HB2 HIS A 7 -13.854 20.845 -53.179 1.00 4.24 H new ATOM 0 HB3 HIS A 7 -13.002 20.502 -51.686 1.00 4.24 H new ATOM 0 HD2 HIS A 7 -12.238 20.034 -55.562 1.00 64.14 H new ATOM 0 HE1 HIS A 7 -8.605 20.666 -53.474 1.00 54.14 H new ATOM 0 HE2 HIS A 7 -9.658 20.334 -55.761 1.00 55.45 H new ATOM 120 N HIS A 8 -14.734 18.150 -50.596 1.00 21.43 N ATOM 121 CA HIS A 8 -15.768 18.061 -49.566 1.00 5.40 C ATOM 122 C HIS A 8 -15.162 18.380 -48.200 1.00 12.40 C ATOM 123 O HIS A 8 -14.163 17.774 -47.807 1.00 22.00 O ATOM 124 CB HIS A 8 -16.392 16.656 -49.548 1.00 32.05 C ATOM 125 CG HIS A 8 -17.268 16.396 -48.355 1.00 21.35 C ATOM 126 ND1 HIS A 8 -16.834 15.713 -47.240 1.00 12.31 N ATOM 127 CD2 HIS A 8 -18.556 16.734 -48.105 1.00 33.13 C ATOM 128 CE1 HIS A 8 -17.813 15.645 -46.359 1.00 71.32 C ATOM 129 NE2 HIS A 8 -18.870 16.258 -46.856 1.00 14.55 N ATOM 0 H HIS A 8 -13.837 17.758 -50.309 1.00 21.43 H new ATOM 0 HA HIS A 8 -16.552 18.784 -49.792 1.00 5.40 H new ATOM 0 HB2 HIS A 8 -16.980 16.518 -50.455 1.00 32.05 H new ATOM 0 HB3 HIS A 8 -15.594 15.914 -49.569 1.00 32.05 H new ATOM 0 HD2 HIS A 8 -19.214 17.278 -48.766 1.00 33.13 H new ATOM 0 HE1 HIS A 8 -17.758 15.167 -45.392 1.00 71.32 H new ATOM 0 HE2 HIS A 8 -19.771 16.361 -46.390 1.00 14.55 H new ATOM 138 N MET A 9 -15.754 19.330 -47.486 1.00 14.33 N ATOM 139 CA MET A 9 -15.254 19.727 -46.172 1.00 10.20 C ATOM 140 C MET A 9 -15.932 18.910 -45.071 1.00 4.43 C ATOM 141 O MET A 9 -17.074 19.171 -44.691 1.00 62.05 O ATOM 142 CB MET A 9 -15.455 21.238 -45.942 1.00 34.12 C ATOM 143 CG MET A 9 -16.898 21.716 -46.077 1.00 74.25 C ATOM 144 SD MET A 9 -17.065 23.493 -45.822 1.00 10.14 S ATOM 145 CE MET A 9 -18.833 23.703 -46.019 1.00 71.55 C ATOM 0 H MET A 9 -16.581 19.841 -47.794 1.00 14.33 H new ATOM 0 HA MET A 9 -14.184 19.523 -46.136 1.00 10.20 H new ATOM 0 HB2 MET A 9 -15.094 21.491 -44.945 1.00 34.12 H new ATOM 0 HB3 MET A 9 -14.837 21.786 -46.653 1.00 34.12 H new ATOM 0 HG2 MET A 9 -17.271 21.458 -47.068 1.00 74.25 H new ATOM 0 HG3 MET A 9 -17.521 21.189 -45.354 1.00 74.25 H new ATOM 0 HE1 MET A 9 -19.091 24.754 -45.889 1.00 71.55 H new ATOM 0 HE2 MET A 9 -19.129 23.377 -47.016 1.00 71.55 H new ATOM 0 HE3 MET A 9 -19.356 23.106 -45.272 1.00 71.55 H new ATOM 155 N GLY A 10 -15.232 17.888 -44.594 1.00 32.43 N ATOM 156 CA GLY A 10 -15.746 17.065 -43.518 1.00 33.53 C ATOM 157 C GLY A 10 -15.680 17.776 -42.182 1.00 23.23 C ATOM 158 O GLY A 10 -14.666 17.703 -41.481 1.00 62.21 O ATOM 0 H GLY A 10 -14.311 17.614 -44.937 1.00 32.43 H new ATOM 0 HA2 GLY A 10 -16.779 16.790 -43.733 1.00 33.53 H new ATOM 0 HA3 GLY A 10 -15.174 16.138 -43.465 1.00 33.53 H new ATOM 162 N THR A 11 -16.753 18.480 -41.842 1.00 34.53 N ATOM 163 CA THR A 11 -16.843 19.203 -40.580 1.00 13.23 C ATOM 164 C THR A 11 -16.622 18.263 -39.391 1.00 32.22 C ATOM 165 O THR A 11 -17.294 17.233 -39.266 1.00 32.32 O ATOM 166 CB THR A 11 -18.218 19.903 -40.446 1.00 72.22 C ATOM 167 OG1 THR A 11 -19.271 18.962 -40.702 1.00 34.23 O ATOM 168 CG2 THR A 11 -18.340 21.076 -41.414 1.00 74.25 C ATOM 0 H THR A 11 -17.582 18.566 -42.431 1.00 34.53 H new ATOM 0 HA THR A 11 -16.059 19.960 -40.576 1.00 13.23 H new ATOM 0 HB THR A 11 -18.302 20.286 -39.429 1.00 72.22 H new ATOM 0 HG1 THR A 11 -19.898 18.959 -39.949 1.00 34.23 H new ATOM 0 HG21 THR A 11 -19.316 21.546 -41.295 1.00 74.25 H new ATOM 0 HG22 THR A 11 -17.558 21.805 -41.202 1.00 74.25 H new ATOM 0 HG23 THR A 11 -18.233 20.716 -42.437 1.00 74.25 H new ATOM 176 N LEU A 12 -15.660 18.605 -38.536 1.00 71.50 N ATOM 177 CA LEU A 12 -15.352 17.800 -37.359 1.00 51.12 C ATOM 178 C LEU A 12 -16.420 18.008 -36.287 1.00 2.41 C ATOM 179 O LEU A 12 -16.403 19.003 -35.558 1.00 51.53 O ATOM 180 CB LEU A 12 -13.962 18.157 -36.809 1.00 41.54 C ATOM 181 CG LEU A 12 -13.500 17.331 -35.594 1.00 1.12 C ATOM 182 CD1 LEU A 12 -13.374 15.852 -35.956 1.00 2.03 C ATOM 183 CD2 LEU A 12 -12.182 17.876 -35.048 1.00 4.44 C ATOM 0 H LEU A 12 -15.079 19.437 -38.638 1.00 71.50 H new ATOM 0 HA LEU A 12 -15.345 16.749 -37.648 1.00 51.12 H new ATOM 0 HB2 LEU A 12 -13.231 18.035 -37.609 1.00 41.54 H new ATOM 0 HB3 LEU A 12 -13.959 19.211 -36.532 1.00 41.54 H new ATOM 0 HG LEU A 12 -14.255 17.418 -34.813 1.00 1.12 H new ATOM 0 HD11 LEU A 12 -13.046 15.290 -35.081 1.00 2.03 H new ATOM 0 HD12 LEU A 12 -14.341 15.475 -36.288 1.00 2.03 H new ATOM 0 HD13 LEU A 12 -12.644 15.734 -36.757 1.00 2.03 H new ATOM 0 HD21 LEU A 12 -11.870 17.281 -34.190 1.00 4.44 H new ATOM 0 HD22 LEU A 12 -11.418 17.824 -35.823 1.00 4.44 H new ATOM 0 HD23 LEU A 12 -12.317 18.913 -34.741 1.00 4.44 H new ATOM 195 N GLU A 13 -17.370 17.080 -36.227 1.00 71.43 N ATOM 196 CA GLU A 13 -18.467 17.132 -35.263 1.00 21.04 C ATOM 197 C GLU A 13 -18.740 15.726 -34.741 1.00 44.32 C ATOM 198 O GLU A 13 -18.511 14.746 -35.453 1.00 71.34 O ATOM 199 CB GLU A 13 -19.735 17.704 -35.921 1.00 3.43 C ATOM 200 CG GLU A 13 -19.534 19.068 -36.578 1.00 72.42 C ATOM 201 CD GLU A 13 -20.760 19.556 -37.331 1.00 50.02 C ATOM 202 OE1 GLU A 13 -21.163 18.893 -38.311 1.00 21.45 O ATOM 203 OE2 GLU A 13 -21.323 20.607 -36.961 1.00 62.43 O ATOM 0 H GLU A 13 -17.402 16.269 -36.845 1.00 71.43 H new ATOM 0 HA GLU A 13 -18.187 17.783 -34.435 1.00 21.04 H new ATOM 0 HB2 GLU A 13 -20.091 16.999 -36.673 1.00 3.43 H new ATOM 0 HB3 GLU A 13 -20.517 17.788 -35.166 1.00 3.43 H new ATOM 0 HG2 GLU A 13 -19.272 19.798 -35.812 1.00 72.42 H new ATOM 0 HG3 GLU A 13 -18.691 19.012 -37.267 1.00 72.42 H new ATOM 210 N ALA A 14 -19.229 15.625 -33.508 1.00 72.45 N ATOM 211 CA ALA A 14 -19.490 14.328 -32.890 1.00 22.35 C ATOM 212 C ALA A 14 -20.850 14.319 -32.194 1.00 63.12 C ATOM 213 O ALA A 14 -21.039 14.982 -31.175 1.00 72.22 O ATOM 214 CB ALA A 14 -18.379 13.983 -31.900 1.00 2.03 C ATOM 0 H ALA A 14 -19.453 16.426 -32.917 1.00 72.45 H new ATOM 0 HA ALA A 14 -19.508 13.571 -33.674 1.00 22.35 H new ATOM 0 HB1 ALA A 14 -18.585 13.014 -31.446 1.00 2.03 H new ATOM 0 HB2 ALA A 14 -17.424 13.943 -32.424 1.00 2.03 H new ATOM 0 HB3 ALA A 14 -18.334 14.746 -31.123 1.00 2.03 H new ATOM 220 N GLN A 15 -21.803 13.589 -32.769 1.00 2.04 N ATOM 221 CA GLN A 15 -23.129 13.423 -32.170 1.00 24.44 C ATOM 222 C GLN A 15 -23.189 12.102 -31.392 1.00 22.42 C ATOM 223 O GLN A 15 -24.127 11.848 -30.634 1.00 65.33 O ATOM 224 CB GLN A 15 -24.205 13.454 -33.269 1.00 35.54 C ATOM 225 CG GLN A 15 -25.641 13.371 -32.752 1.00 1.34 C ATOM 226 CD GLN A 15 -26.034 14.555 -31.882 1.00 30.44 C ATOM 227 OE1 GLN A 15 -25.543 15.669 -32.065 1.00 73.05 O ATOM 228 NE2 GLN A 15 -26.927 14.327 -30.933 1.00 13.14 N ATOM 0 H GLN A 15 -21.682 13.099 -33.655 1.00 2.04 H new ATOM 0 HA GLN A 15 -23.317 14.242 -31.476 1.00 24.44 H new ATOM 0 HB2 GLN A 15 -24.092 14.373 -33.845 1.00 35.54 H new ATOM 0 HB3 GLN A 15 -24.030 12.625 -33.954 1.00 35.54 H new ATOM 0 HG2 GLN A 15 -26.323 13.310 -33.600 1.00 1.34 H new ATOM 0 HG3 GLN A 15 -25.761 12.452 -32.179 1.00 1.34 H new ATOM 0 HE21 GLN A 15 -27.313 13.391 -30.810 1.00 13.14 H new ATOM 0 HE22 GLN A 15 -27.230 15.087 -30.324 1.00 13.14 H new ATOM 237 N THR A 16 -22.165 11.276 -31.579 1.00 51.14 N ATOM 238 CA THR A 16 -22.098 9.959 -30.962 1.00 52.51 C ATOM 239 C THR A 16 -21.679 10.049 -29.491 1.00 40.13 C ATOM 240 O THR A 16 -20.572 10.494 -29.172 1.00 51.13 O ATOM 241 CB THR A 16 -21.108 9.060 -31.739 1.00 11.31 C ATOM 242 OG1 THR A 16 -19.930 9.811 -32.071 1.00 65.40 O ATOM 243 CG2 THR A 16 -21.740 8.519 -33.019 1.00 41.52 C ATOM 0 H THR A 16 -21.359 11.502 -32.162 1.00 51.14 H new ATOM 0 HA THR A 16 -23.095 9.520 -31.001 1.00 52.51 H new ATOM 0 HB THR A 16 -20.845 8.216 -31.101 1.00 11.31 H new ATOM 0 HG1 THR A 16 -19.238 9.650 -31.396 1.00 65.40 H new ATOM 0 HG21 THR A 16 -21.020 7.891 -33.543 1.00 41.52 H new ATOM 0 HG22 THR A 16 -22.621 7.929 -32.768 1.00 41.52 H new ATOM 0 HG23 THR A 16 -22.031 9.351 -33.661 1.00 41.52 H new ATOM 251 N GLN A 17 -22.573 9.631 -28.599 1.00 32.42 N ATOM 252 CA GLN A 17 -22.281 9.609 -27.169 1.00 51.23 C ATOM 253 C GLN A 17 -21.406 8.403 -26.833 1.00 30.41 C ATOM 254 O GLN A 17 -21.917 7.320 -26.536 1.00 31.24 O ATOM 255 CB GLN A 17 -23.579 9.555 -26.349 1.00 54.23 C ATOM 256 CG GLN A 17 -24.525 10.728 -26.589 1.00 74.01 C ATOM 257 CD GLN A 17 -25.796 10.646 -25.752 1.00 13.51 C ATOM 258 OE1 GLN A 17 -26.858 11.106 -26.170 1.00 30.33 O ATOM 259 NE2 GLN A 17 -25.698 10.072 -24.558 1.00 74.31 N ATOM 0 H GLN A 17 -23.507 9.302 -28.842 1.00 32.42 H new ATOM 0 HA GLN A 17 -21.747 10.524 -26.914 1.00 51.23 H new ATOM 0 HB2 GLN A 17 -24.103 8.628 -26.581 1.00 54.23 H new ATOM 0 HB3 GLN A 17 -23.324 9.520 -25.290 1.00 54.23 H new ATOM 0 HG2 GLN A 17 -24.006 11.659 -26.362 1.00 74.01 H new ATOM 0 HG3 GLN A 17 -24.793 10.762 -27.645 1.00 74.01 H new ATOM 0 HE21 GLN A 17 -24.802 9.701 -24.243 1.00 74.31 H new ATOM 0 HE22 GLN A 17 -26.519 10.002 -23.957 1.00 74.31 H new ATOM 268 N GLY A 18 -20.095 8.582 -26.914 1.00 45.01 N ATOM 269 CA GLY A 18 -19.175 7.498 -26.625 1.00 32.05 C ATOM 270 C GLY A 18 -17.733 7.963 -26.614 1.00 22.41 C ATOM 271 O GLY A 18 -17.464 9.116 -26.277 1.00 30.02 O ATOM 0 H GLY A 18 -19.650 9.462 -27.176 1.00 45.01 H new ATOM 0 HA2 GLY A 18 -19.422 7.061 -25.657 1.00 32.05 H new ATOM 0 HA3 GLY A 18 -19.296 6.712 -27.370 1.00 32.05 H new ATOM 275 N PRO A 19 -16.780 7.089 -26.994 1.00 55.32 N ATOM 276 CA PRO A 19 -15.343 7.422 -27.009 1.00 11.14 C ATOM 277 C PRO A 19 -14.952 8.336 -28.183 1.00 0.34 C ATOM 278 O PRO A 19 -13.916 8.137 -28.825 1.00 64.54 O ATOM 279 CB PRO A 19 -14.682 6.042 -27.138 1.00 61.35 C ATOM 280 CG PRO A 19 -15.675 5.216 -27.885 1.00 20.44 C ATOM 281 CD PRO A 19 -17.030 5.696 -27.433 1.00 71.31 C ATOM 0 HA PRO A 19 -15.037 7.982 -26.125 1.00 11.14 H new ATOM 0 HB2 PRO A 19 -13.735 6.105 -27.675 1.00 61.35 H new ATOM 0 HB3 PRO A 19 -14.466 5.613 -26.159 1.00 61.35 H new ATOM 0 HG2 PRO A 19 -15.555 5.339 -28.961 1.00 20.44 H new ATOM 0 HG3 PRO A 19 -15.543 4.156 -27.669 1.00 20.44 H new ATOM 0 HD2 PRO A 19 -17.760 5.656 -28.242 1.00 71.31 H new ATOM 0 HD3 PRO A 19 -17.421 5.084 -26.620 1.00 71.31 H new ATOM 289 N GLY A 20 -15.775 9.350 -28.442 1.00 10.05 N ATOM 290 CA GLY A 20 -15.495 10.295 -29.509 1.00 74.10 C ATOM 291 C GLY A 20 -16.165 9.909 -30.811 1.00 65.13 C ATOM 292 O GLY A 20 -17.387 9.746 -30.859 1.00 74.44 O ATOM 0 H GLY A 20 -16.636 9.534 -27.927 1.00 10.05 H new ATOM 0 HA2 GLY A 20 -15.832 11.287 -29.210 1.00 74.10 H new ATOM 0 HA3 GLY A 20 -14.418 10.357 -29.662 1.00 74.10 H new ATOM 296 N SER A 21 -15.369 9.749 -31.861 1.00 30.53 N ATOM 297 CA SER A 21 -15.883 9.402 -33.180 1.00 4.43 C ATOM 298 C SER A 21 -15.568 7.937 -33.496 1.00 25.13 C ATOM 299 O SER A 21 -14.413 7.593 -33.758 1.00 5.22 O ATOM 300 CB SER A 21 -15.266 10.328 -34.242 1.00 44.22 C ATOM 301 OG SER A 21 -15.805 10.080 -35.532 1.00 33.34 O ATOM 0 H SER A 21 -14.355 9.855 -31.823 1.00 30.53 H new ATOM 0 HA SER A 21 -16.965 9.533 -33.189 1.00 4.43 H new ATOM 0 HB2 SER A 21 -15.445 11.367 -33.967 1.00 44.22 H new ATOM 0 HB3 SER A 21 -14.186 10.186 -34.265 1.00 44.22 H new ATOM 0 HG SER A 21 -15.392 10.687 -36.181 1.00 33.34 H new ATOM 307 N PRO A 22 -16.582 7.047 -33.443 1.00 74.53 N ATOM 308 CA PRO A 22 -16.405 5.622 -33.752 1.00 53.05 C ATOM 309 C PRO A 22 -16.079 5.388 -35.232 1.00 14.45 C ATOM 310 O PRO A 22 -16.952 5.038 -36.030 1.00 2.32 O ATOM 311 CB PRO A 22 -17.761 4.985 -33.374 1.00 32.50 C ATOM 312 CG PRO A 22 -18.468 6.019 -32.556 1.00 73.23 C ATOM 313 CD PRO A 22 -17.976 7.345 -33.068 1.00 50.00 C ATOM 0 HA PRO A 22 -15.566 5.189 -33.207 1.00 53.05 H new ATOM 0 HB2 PRO A 22 -18.336 4.726 -34.263 1.00 32.50 H new ATOM 0 HB3 PRO A 22 -17.619 4.065 -32.807 1.00 32.50 H new ATOM 0 HG2 PRO A 22 -19.549 5.933 -32.665 1.00 73.23 H new ATOM 0 HG3 PRO A 22 -18.244 5.901 -31.496 1.00 73.23 H new ATOM 0 HD2 PRO A 22 -18.560 7.692 -33.920 1.00 50.00 H new ATOM 0 HD3 PRO A 22 -18.034 8.121 -32.305 1.00 50.00 H new ATOM 321 N GLU A 23 -14.822 5.623 -35.592 1.00 31.13 N ATOM 322 CA GLU A 23 -14.333 5.346 -36.938 1.00 2.43 C ATOM 323 C GLU A 23 -13.465 4.091 -36.918 1.00 50.22 C ATOM 324 O GLU A 23 -12.619 3.927 -36.038 1.00 63.33 O ATOM 325 CB GLU A 23 -13.536 6.540 -37.490 1.00 32.34 C ATOM 326 CG GLU A 23 -12.397 7.004 -36.584 1.00 31.05 C ATOM 327 CD GLU A 23 -11.419 7.923 -37.295 1.00 11.01 C ATOM 328 OE1 GLU A 23 -11.669 9.145 -37.363 1.00 72.13 O ATOM 329 OE2 GLU A 23 -10.395 7.420 -37.804 1.00 31.24 O ATOM 0 H GLU A 23 -14.117 6.008 -34.964 1.00 31.13 H new ATOM 0 HA GLU A 23 -15.188 5.182 -37.594 1.00 2.43 H new ATOM 0 HB2 GLU A 23 -13.125 6.270 -38.463 1.00 32.34 H new ATOM 0 HB3 GLU A 23 -14.219 7.374 -37.653 1.00 32.34 H new ATOM 0 HG2 GLU A 23 -12.814 7.522 -35.720 1.00 31.05 H new ATOM 0 HG3 GLU A 23 -11.861 6.133 -36.206 1.00 31.05 H new ATOM 336 N GLY A 24 -13.702 3.196 -37.871 1.00 33.14 N ATOM 337 CA GLY A 24 -12.955 1.951 -37.938 1.00 73.02 C ATOM 338 C GLY A 24 -13.570 0.871 -37.069 1.00 74.44 C ATOM 339 O GLY A 24 -13.281 -0.316 -37.236 1.00 72.20 O ATOM 0 H GLY A 24 -14.403 3.311 -38.603 1.00 33.14 H new ATOM 0 HA2 GLY A 24 -12.917 1.607 -38.971 1.00 73.02 H new ATOM 0 HA3 GLY A 24 -11.927 2.128 -37.623 1.00 73.02 H new ATOM 343 N VAL A 25 -14.422 1.288 -36.137 1.00 72.40 N ATOM 344 CA VAL A 25 -15.104 0.371 -35.228 1.00 22.33 C ATOM 345 C VAL A 25 -16.607 0.672 -35.261 1.00 61.30 C ATOM 346 O VAL A 25 -17.002 1.839 -35.302 1.00 30.12 O ATOM 347 CB VAL A 25 -14.586 0.515 -33.764 1.00 54.23 C ATOM 348 CG1 VAL A 25 -14.763 -0.778 -32.967 1.00 44.42 C ATOM 349 CG2 VAL A 25 -13.129 0.977 -33.731 1.00 24.31 C ATOM 0 H VAL A 25 -14.659 2.269 -35.990 1.00 72.40 H new ATOM 0 HA VAL A 25 -14.902 -0.649 -35.556 1.00 22.33 H new ATOM 0 HB VAL A 25 -15.195 1.282 -33.286 1.00 54.23 H new ATOM 0 HG11 VAL A 25 -14.390 -0.634 -31.953 1.00 44.42 H new ATOM 0 HG12 VAL A 25 -15.820 -1.041 -32.930 1.00 44.42 H new ATOM 0 HG13 VAL A 25 -14.206 -1.581 -33.449 1.00 44.42 H new ATOM 0 HG21 VAL A 25 -12.799 1.067 -32.696 1.00 24.31 H new ATOM 0 HG22 VAL A 25 -12.505 0.249 -34.249 1.00 24.31 H new ATOM 0 HG23 VAL A 25 -13.043 1.945 -34.225 1.00 24.31 H new ATOM 359 N PRO A 26 -17.459 -0.364 -35.254 1.00 53.20 N ATOM 360 CA PRO A 26 -18.915 -0.189 -35.283 1.00 53.23 C ATOM 361 C PRO A 26 -19.452 0.367 -33.959 1.00 63.22 C ATOM 362 O PRO A 26 -19.087 -0.121 -32.884 1.00 4.41 O ATOM 363 CB PRO A 26 -19.436 -1.614 -35.517 1.00 71.45 C ATOM 364 CG PRO A 26 -18.376 -2.493 -34.943 1.00 61.30 C ATOM 365 CD PRO A 26 -17.072 -1.782 -35.198 1.00 20.30 C ATOM 0 HA PRO A 26 -19.231 0.524 -36.044 1.00 53.23 H new ATOM 0 HB2 PRO A 26 -20.395 -1.773 -35.024 1.00 71.45 H new ATOM 0 HB3 PRO A 26 -19.587 -1.813 -36.578 1.00 71.45 H new ATOM 0 HG2 PRO A 26 -18.534 -2.650 -33.876 1.00 61.30 H new ATOM 0 HG3 PRO A 26 -18.385 -3.476 -35.415 1.00 61.30 H new ATOM 0 HD2 PRO A 26 -16.350 -1.970 -34.403 1.00 20.30 H new ATOM 0 HD3 PRO A 26 -16.612 -2.110 -36.130 1.00 20.30 H new ATOM 373 N PRO A 27 -20.315 1.402 -34.013 1.00 22.12 N ATOM 374 CA PRO A 27 -20.935 1.980 -32.815 1.00 12.14 C ATOM 375 C PRO A 27 -21.637 0.914 -31.972 1.00 32.44 C ATOM 376 O PRO A 27 -22.639 0.333 -32.398 1.00 51.44 O ATOM 377 CB PRO A 27 -21.947 2.989 -33.383 1.00 2.02 C ATOM 378 CG PRO A 27 -21.401 3.348 -34.723 1.00 33.14 C ATOM 379 CD PRO A 27 -20.741 2.097 -35.243 1.00 24.33 C ATOM 0 HA PRO A 27 -20.204 2.437 -32.148 1.00 12.14 H new ATOM 0 HB2 PRO A 27 -22.942 2.551 -33.464 1.00 2.02 H new ATOM 0 HB3 PRO A 27 -22.036 3.866 -32.742 1.00 2.02 H new ATOM 0 HG2 PRO A 27 -22.194 3.680 -35.393 1.00 33.14 H new ATOM 0 HG3 PRO A 27 -20.685 4.166 -34.648 1.00 33.14 H new ATOM 0 HD2 PRO A 27 -21.432 1.491 -35.829 1.00 24.33 H new ATOM 0 HD3 PRO A 27 -19.894 2.328 -35.889 1.00 24.33 H new ATOM 387 N THR A 28 -21.086 0.646 -30.791 1.00 45.53 N ATOM 388 CA THR A 28 -21.621 -0.366 -29.892 1.00 23.35 C ATOM 389 C THR A 28 -21.574 0.139 -28.450 1.00 32.41 C ATOM 390 O THR A 28 -20.522 0.125 -27.807 1.00 52.34 O ATOM 391 CB THR A 28 -20.825 -1.688 -29.998 1.00 42.45 C ATOM 392 OG1 THR A 28 -20.636 -2.039 -31.379 1.00 3.44 O ATOM 393 CG2 THR A 28 -21.543 -2.829 -29.277 1.00 14.13 C ATOM 0 H THR A 28 -20.259 1.124 -30.433 1.00 45.53 H new ATOM 0 HA THR A 28 -22.654 -0.559 -30.183 1.00 23.35 H new ATOM 0 HB THR A 28 -19.857 -1.534 -29.521 1.00 42.45 H new ATOM 0 HG1 THR A 28 -20.040 -1.387 -31.804 1.00 3.44 H new ATOM 0 HG21 THR A 28 -20.958 -3.744 -29.370 1.00 14.13 H new ATOM 0 HG22 THR A 28 -21.658 -2.578 -28.223 1.00 14.13 H new ATOM 0 HG23 THR A 28 -22.526 -2.980 -29.723 1.00 14.13 H new ATOM 401 N ASP A 29 -22.719 0.585 -27.956 1.00 43.22 N ATOM 402 CA ASP A 29 -22.821 1.173 -26.617 1.00 33.15 C ATOM 403 C ASP A 29 -22.746 0.105 -25.531 1.00 10.15 C ATOM 404 O ASP A 29 -22.600 0.429 -24.351 1.00 40.43 O ATOM 405 CB ASP A 29 -24.124 1.975 -26.478 1.00 41.45 C ATOM 406 CG ASP A 29 -24.130 3.239 -27.324 1.00 41.33 C ATOM 407 OD1 ASP A 29 -24.143 3.132 -28.570 1.00 72.33 O ATOM 408 OD2 ASP A 29 -24.137 4.349 -26.750 1.00 53.41 O ATOM 0 H ASP A 29 -23.603 0.553 -28.464 1.00 43.22 H new ATOM 0 HA ASP A 29 -21.973 1.846 -26.488 1.00 33.15 H new ATOM 0 HB2 ASP A 29 -24.966 1.346 -26.767 1.00 41.45 H new ATOM 0 HB3 ASP A 29 -24.271 2.243 -25.432 1.00 41.45 H new ATOM 413 N ARG A 30 -22.861 -1.166 -25.929 1.00 41.34 N ATOM 414 CA ARG A 30 -22.718 -2.287 -24.995 1.00 50.12 C ATOM 415 C ARG A 30 -21.437 -2.166 -24.205 1.00 1.41 C ATOM 416 O ARG A 30 -21.426 -2.023 -22.982 1.00 73.43 O ATOM 417 CB ARG A 30 -22.765 -3.637 -25.738 1.00 54.12 C ATOM 418 CG ARG A 30 -24.145 -4.000 -26.280 1.00 21.54 C ATOM 419 CD ARG A 30 -24.118 -5.274 -27.126 1.00 40.24 C ATOM 420 NE ARG A 30 -23.621 -6.441 -26.383 1.00 70.52 N ATOM 421 CZ ARG A 30 -24.028 -7.699 -26.600 1.00 52.34 C ATOM 422 NH1 ARG A 30 -24.972 -7.956 -27.497 1.00 32.25 N ATOM 423 NH2 ARG A 30 -23.483 -8.704 -25.924 1.00 22.53 N ATOM 0 H ARG A 30 -23.053 -1.444 -26.891 1.00 41.34 H new ATOM 0 HA ARG A 30 -23.558 -2.251 -24.301 1.00 50.12 H new ATOM 0 HB2 ARG A 30 -22.057 -3.609 -26.566 1.00 54.12 H new ATOM 0 HB3 ARG A 30 -22.433 -4.424 -25.061 1.00 54.12 H new ATOM 0 HG2 ARG A 30 -24.836 -4.133 -25.448 1.00 21.54 H new ATOM 0 HG3 ARG A 30 -24.526 -3.175 -26.882 1.00 21.54 H new ATOM 0 HD2 ARG A 30 -25.123 -5.483 -27.492 1.00 40.24 H new ATOM 0 HD3 ARG A 30 -23.488 -5.111 -28.001 1.00 40.24 H new ATOM 0 HE ARG A 30 -22.922 -6.283 -25.657 1.00 70.52 H new ATOM 0 HH11 ARG A 30 -25.393 -7.193 -28.027 1.00 32.25 H new ATOM 0 HH12 ARG A 30 -25.276 -8.916 -27.656 1.00 32.25 H new ATOM 0 HH21 ARG A 30 -22.752 -8.519 -25.237 1.00 22.53 H new ATOM 0 HH22 ARG A 30 -23.795 -9.660 -26.092 1.00 22.53 H new ATOM 437 N PHE A 31 -20.382 -2.206 -24.951 1.00 5.02 N ATOM 438 CA PHE A 31 -19.020 -2.087 -24.432 1.00 30.21 C ATOM 439 C PHE A 31 -18.147 -1.316 -25.425 1.00 11.12 C ATOM 440 O PHE A 31 -17.558 -1.904 -26.330 1.00 60.42 O ATOM 441 CB PHE A 31 -18.401 -3.466 -24.158 1.00 54.15 C ATOM 442 CG PHE A 31 -19.160 -4.296 -23.149 1.00 41.22 C ATOM 443 CD1 PHE A 31 -18.976 -4.098 -21.787 1.00 64.33 C ATOM 444 CD2 PHE A 31 -20.066 -5.265 -23.562 1.00 24.24 C ATOM 445 CE1 PHE A 31 -19.672 -4.856 -20.861 1.00 34.10 C ATOM 446 CE2 PHE A 31 -20.764 -6.023 -22.639 1.00 62.10 C ATOM 447 CZ PHE A 31 -20.569 -5.815 -21.289 1.00 23.03 C ATOM 0 H PHE A 31 -20.422 -2.324 -25.963 1.00 5.02 H new ATOM 0 HA PHE A 31 -19.068 -1.544 -23.488 1.00 30.21 H new ATOM 0 HB2 PHE A 31 -18.343 -4.018 -25.096 1.00 54.15 H new ATOM 0 HB3 PHE A 31 -17.379 -3.329 -23.804 1.00 54.15 H new ATOM 0 HD1 PHE A 31 -18.282 -3.344 -21.446 1.00 64.33 H new ATOM 0 HD2 PHE A 31 -20.227 -5.429 -24.617 1.00 24.24 H new ATOM 0 HE1 PHE A 31 -19.514 -4.698 -19.804 1.00 34.10 H new ATOM 0 HE2 PHE A 31 -21.461 -6.777 -22.975 1.00 62.10 H new ATOM 0 HZ PHE A 31 -21.118 -6.402 -20.567 1.00 23.03 H new ATOM 457 N PRO A 32 -18.082 0.017 -25.275 1.00 23.40 N ATOM 458 CA PRO A 32 -17.298 0.894 -26.153 1.00 61.21 C ATOM 459 C PRO A 32 -15.877 1.127 -25.631 1.00 12.12 C ATOM 460 O PRO A 32 -15.256 2.152 -25.917 1.00 45.31 O ATOM 461 CB PRO A 32 -18.114 2.184 -26.084 1.00 34.33 C ATOM 462 CG PRO A 32 -18.576 2.233 -24.662 1.00 12.11 C ATOM 463 CD PRO A 32 -18.794 0.794 -24.241 1.00 51.11 C ATOM 0 HA PRO A 32 -17.155 0.488 -27.154 1.00 61.21 H new ATOM 0 HB2 PRO A 32 -17.510 3.055 -26.339 1.00 34.33 H new ATOM 0 HB3 PRO A 32 -18.954 2.164 -26.778 1.00 34.33 H new ATOM 0 HG2 PRO A 32 -17.833 2.716 -24.027 1.00 12.11 H new ATOM 0 HG3 PRO A 32 -19.497 2.809 -24.571 1.00 12.11 H new ATOM 0 HD2 PRO A 32 -18.391 0.602 -23.247 1.00 51.11 H new ATOM 0 HD3 PRO A 32 -19.854 0.542 -24.209 1.00 51.11 H new ATOM 471 N LEU A 33 -15.371 0.165 -24.872 1.00 21.14 N ATOM 472 CA LEU A 33 -14.077 0.298 -24.205 1.00 43.40 C ATOM 473 C LEU A 33 -12.971 -0.426 -24.971 1.00 31.24 C ATOM 474 O LEU A 33 -13.241 -1.221 -25.875 1.00 3.30 O ATOM 475 CB LEU A 33 -14.174 -0.222 -22.757 1.00 65.01 C ATOM 476 CG LEU A 33 -15.018 -1.497 -22.548 1.00 10.43 C ATOM 477 CD1 LEU A 33 -14.295 -2.736 -23.063 1.00 12.42 C ATOM 478 CD2 LEU A 33 -15.388 -1.658 -21.076 1.00 72.02 C ATOM 0 H LEU A 33 -15.839 -0.725 -24.700 1.00 21.14 H new ATOM 0 HA LEU A 33 -13.814 1.356 -24.183 1.00 43.40 H new ATOM 0 HB2 LEU A 33 -13.165 -0.415 -22.394 1.00 65.01 H new ATOM 0 HB3 LEU A 33 -14.590 0.571 -22.135 1.00 65.01 H new ATOM 0 HG LEU A 33 -15.935 -1.388 -23.126 1.00 10.43 H new ATOM 0 HD11 LEU A 33 -14.918 -3.615 -22.900 1.00 12.42 H new ATOM 0 HD12 LEU A 33 -14.097 -2.625 -24.129 1.00 12.42 H new ATOM 0 HD13 LEU A 33 -13.352 -2.855 -22.529 1.00 12.42 H new ATOM 0 HD21 LEU A 33 -15.983 -2.562 -20.947 1.00 72.02 H new ATOM 0 HD22 LEU A 33 -14.479 -1.733 -20.479 1.00 72.02 H new ATOM 0 HD23 LEU A 33 -15.966 -0.794 -20.750 1.00 72.02 H new ATOM 490 N LEU A 34 -11.725 -0.150 -24.592 1.00 14.54 N ATOM 491 CA LEU A 34 -10.571 -0.770 -25.231 1.00 1.15 C ATOM 492 C LEU A 34 -10.408 -2.202 -24.733 1.00 23.24 C ATOM 493 O LEU A 34 -9.654 -2.468 -23.793 1.00 75.43 O ATOM 494 CB LEU A 34 -9.280 0.036 -24.970 1.00 54.33 C ATOM 495 CG LEU A 34 -9.195 1.420 -25.641 1.00 63.34 C ATOM 496 CD1 LEU A 34 -9.398 1.304 -27.153 1.00 52.15 C ATOM 497 CD2 LEU A 34 -10.196 2.398 -25.024 1.00 55.35 C ATOM 0 H LEU A 34 -11.490 0.501 -23.843 1.00 14.54 H new ATOM 0 HA LEU A 34 -10.745 -0.779 -26.307 1.00 1.15 H new ATOM 0 HB2 LEU A 34 -9.171 0.170 -23.894 1.00 54.33 H new ATOM 0 HB3 LEU A 34 -8.431 -0.560 -25.304 1.00 54.33 H new ATOM 0 HG LEU A 34 -8.196 1.817 -25.464 1.00 63.34 H new ATOM 0 HD11 LEU A 34 -9.334 2.293 -27.606 1.00 52.15 H new ATOM 0 HD12 LEU A 34 -8.626 0.661 -27.575 1.00 52.15 H new ATOM 0 HD13 LEU A 34 -10.379 0.875 -27.357 1.00 52.15 H new ATOM 0 HD21 LEU A 34 -10.112 3.366 -25.519 1.00 55.35 H new ATOM 0 HD22 LEU A 34 -11.207 2.012 -25.152 1.00 55.35 H new ATOM 0 HD23 LEU A 34 -9.983 2.514 -23.961 1.00 55.35 H new ATOM 509 N ALA A 35 -11.170 -3.107 -25.327 1.00 40.20 N ATOM 510 CA ALA A 35 -11.062 -4.525 -25.018 1.00 32.23 C ATOM 511 C ALA A 35 -9.803 -5.123 -25.648 1.00 54.11 C ATOM 512 O ALA A 35 -9.807 -5.525 -26.813 1.00 20.41 O ATOM 513 CB ALA A 35 -12.309 -5.267 -25.489 1.00 0.34 C ATOM 0 H ALA A 35 -11.874 -2.883 -26.030 1.00 40.20 H new ATOM 0 HA ALA A 35 -10.983 -4.637 -23.937 1.00 32.23 H new ATOM 0 HB1 ALA A 35 -12.214 -6.326 -25.251 1.00 0.34 H new ATOM 0 HB2 ALA A 35 -13.186 -4.860 -24.986 1.00 0.34 H new ATOM 0 HB3 ALA A 35 -12.419 -5.146 -26.567 1.00 0.34 H new ATOM 519 N LEU A 36 -8.719 -5.139 -24.878 1.00 11.44 N ATOM 520 CA LEU A 36 -7.467 -5.766 -25.301 1.00 70.21 C ATOM 521 C LEU A 36 -6.949 -6.662 -24.177 1.00 54.41 C ATOM 522 O LEU A 36 -7.723 -7.068 -23.304 1.00 32.22 O ATOM 523 CB LEU A 36 -6.407 -4.712 -25.705 1.00 21.24 C ATOM 524 CG LEU A 36 -5.732 -3.920 -24.560 1.00 12.54 C ATOM 525 CD1 LEU A 36 -4.535 -3.129 -25.085 1.00 32.02 C ATOM 526 CD2 LEU A 36 -6.718 -2.980 -23.874 1.00 4.31 C ATOM 0 H LEU A 36 -8.681 -4.721 -23.948 1.00 11.44 H new ATOM 0 HA LEU A 36 -7.661 -6.372 -26.186 1.00 70.21 H new ATOM 0 HB2 LEU A 36 -5.626 -5.217 -26.273 1.00 21.24 H new ATOM 0 HB3 LEU A 36 -6.880 -3.997 -26.379 1.00 21.24 H new ATOM 0 HG LEU A 36 -5.384 -4.644 -23.823 1.00 12.54 H new ATOM 0 HD11 LEU A 36 -4.074 -2.579 -24.264 1.00 32.02 H new ATOM 0 HD12 LEU A 36 -3.806 -3.815 -25.516 1.00 32.02 H new ATOM 0 HD13 LEU A 36 -4.869 -2.428 -25.849 1.00 32.02 H new ATOM 0 HD21 LEU A 36 -6.210 -2.440 -23.075 1.00 4.31 H new ATOM 0 HD22 LEU A 36 -7.109 -2.269 -24.602 1.00 4.31 H new ATOM 0 HD23 LEU A 36 -7.541 -3.559 -23.454 1.00 4.31 H new ATOM 538 N LEU A 37 -5.657 -6.980 -24.200 1.00 13.52 N ATOM 539 CA LEU A 37 -5.063 -7.850 -23.188 1.00 21.25 C ATOM 540 C LEU A 37 -5.183 -7.214 -21.797 1.00 14.11 C ATOM 541 O LEU A 37 -4.379 -6.361 -21.414 1.00 53.31 O ATOM 542 CB LEU A 37 -3.588 -8.149 -23.537 1.00 71.04 C ATOM 543 CG LEU A 37 -2.953 -9.386 -22.854 1.00 45.01 C ATOM 544 CD1 LEU A 37 -1.599 -9.701 -23.485 1.00 73.25 C ATOM 545 CD2 LEU A 37 -2.798 -9.189 -21.344 1.00 10.31 C ATOM 0 H LEU A 37 -5.002 -6.649 -24.908 1.00 13.52 H new ATOM 0 HA LEU A 37 -5.607 -8.795 -23.174 1.00 21.25 H new ATOM 0 HB2 LEU A 37 -3.513 -8.279 -24.617 1.00 71.04 H new ATOM 0 HB3 LEU A 37 -2.992 -7.273 -23.279 1.00 71.04 H new ATOM 0 HG LEU A 37 -3.628 -10.228 -23.008 1.00 45.01 H new ATOM 0 HD11 LEU A 37 -1.164 -10.572 -22.996 1.00 73.25 H new ATOM 0 HD12 LEU A 37 -1.732 -9.909 -24.547 1.00 73.25 H new ATOM 0 HD13 LEU A 37 -0.933 -8.846 -23.364 1.00 73.25 H new ATOM 0 HD21 LEU A 37 -2.349 -10.080 -20.905 1.00 10.31 H new ATOM 0 HD22 LEU A 37 -2.157 -8.328 -21.153 1.00 10.31 H new ATOM 0 HD23 LEU A 37 -3.777 -9.018 -20.897 1.00 10.31 H new ATOM 557 N ARG A 38 -6.225 -7.604 -21.073 1.00 2.14 N ATOM 558 CA ARG A 38 -6.385 -7.240 -19.670 1.00 45.54 C ATOM 559 C ARG A 38 -6.063 -8.450 -18.818 1.00 2.05 C ATOM 560 O ARG A 38 -6.581 -9.537 -19.074 1.00 21.04 O ATOM 561 CB ARG A 38 -7.817 -6.764 -19.386 1.00 41.41 C ATOM 562 CG ARG A 38 -8.274 -5.581 -20.240 1.00 14.00 C ATOM 563 CD ARG A 38 -7.433 -4.326 -20.007 1.00 71.31 C ATOM 564 NE ARG A 38 -8.000 -3.159 -20.688 1.00 2.14 N ATOM 565 CZ ARG A 38 -7.472 -1.934 -20.656 1.00 52.02 C ATOM 566 NH1 ARG A 38 -6.351 -1.696 -19.984 1.00 34.34 N ATOM 567 NH2 ARG A 38 -8.070 -0.946 -21.304 1.00 41.24 N ATOM 0 H ARG A 38 -6.982 -8.180 -21.441 1.00 2.14 H new ATOM 0 HA ARG A 38 -5.708 -6.420 -19.432 1.00 45.54 H new ATOM 0 HB2 ARG A 38 -8.502 -7.597 -19.546 1.00 41.41 H new ATOM 0 HB3 ARG A 38 -7.892 -6.487 -18.334 1.00 41.41 H new ATOM 0 HG2 ARG A 38 -8.223 -5.857 -21.293 1.00 14.00 H new ATOM 0 HG3 ARG A 38 -9.318 -5.360 -20.019 1.00 14.00 H new ATOM 0 HD2 ARG A 38 -7.366 -4.126 -18.938 1.00 71.31 H new ATOM 0 HD3 ARG A 38 -6.417 -4.497 -20.363 1.00 71.31 H new ATOM 0 HE ARG A 38 -8.858 -3.292 -21.224 1.00 2.14 H new ATOM 0 HH11 ARG A 38 -5.885 -2.454 -19.485 1.00 34.34 H new ATOM 0 HH12 ARG A 38 -5.957 -0.755 -19.967 1.00 34.34 H new ATOM 0 HH21 ARG A 38 -8.929 -1.124 -21.824 1.00 41.24 H new ATOM 0 HH22 ARG A 38 -7.671 -0.007 -21.283 1.00 41.24 H new ATOM 581 N ARG A 39 -5.195 -8.282 -17.824 1.00 13.43 N ATOM 582 CA ARG A 39 -4.795 -9.410 -17.001 1.00 31.22 C ATOM 583 C ARG A 39 -5.951 -9.849 -16.104 1.00 12.54 C ATOM 584 O ARG A 39 -6.140 -9.423 -14.965 1.00 64.51 O ATOM 585 CB ARG A 39 -3.531 -9.128 -16.200 1.00 71.22 C ATOM 586 CG ARG A 39 -3.729 -8.217 -15.012 1.00 25.23 C ATOM 587 CD ARG A 39 -2.478 -8.185 -14.171 1.00 12.21 C ATOM 588 NE ARG A 39 -2.725 -7.683 -12.814 1.00 64.14 N ATOM 589 CZ ARG A 39 -1.799 -7.104 -12.046 1.00 40.21 C ATOM 590 NH1 ARG A 39 -0.579 -6.879 -12.516 1.00 72.51 N ATOM 591 NH2 ARG A 39 -2.092 -6.759 -10.801 1.00 72.23 N ATOM 0 H ARG A 39 -4.764 -7.392 -17.575 1.00 13.43 H new ATOM 0 HA ARG A 39 -4.548 -10.235 -17.669 1.00 31.22 H new ATOM 0 HB2 ARG A 39 -3.120 -10.075 -15.850 1.00 71.22 H new ATOM 0 HB3 ARG A 39 -2.789 -8.683 -16.863 1.00 71.22 H new ATOM 0 HG2 ARG A 39 -3.974 -7.211 -15.352 1.00 25.23 H new ATOM 0 HG3 ARG A 39 -4.571 -8.565 -14.413 1.00 25.23 H new ATOM 0 HD2 ARG A 39 -2.058 -9.189 -14.112 1.00 12.21 H new ATOM 0 HD3 ARG A 39 -1.733 -7.556 -14.658 1.00 12.21 H new ATOM 0 HE ARG A 39 -3.666 -7.783 -12.433 1.00 64.14 H new ATOM 0 HH11 ARG A 39 -0.343 -7.149 -13.471 1.00 72.51 H new ATOM 0 HH12 ARG A 39 0.123 -6.436 -11.923 1.00 72.51 H new ATOM 0 HH21 ARG A 39 -3.025 -6.936 -10.429 1.00 72.23 H new ATOM 0 HH22 ARG A 39 -1.384 -6.317 -10.214 1.00 72.23 H new ATOM 605 N THR A 40 -6.757 -10.657 -16.699 1.00 21.32 N ATOM 606 CA THR A 40 -7.906 -11.266 -16.046 1.00 31.44 C ATOM 607 C THR A 40 -8.359 -12.510 -16.801 1.00 32.23 C ATOM 608 O THR A 40 -7.916 -12.774 -17.919 1.00 70.14 O ATOM 609 CB THR A 40 -9.088 -10.273 -15.919 1.00 25.32 C ATOM 610 OG1 THR A 40 -10.175 -10.886 -15.206 1.00 2.42 O ATOM 611 CG2 THR A 40 -9.567 -9.802 -17.292 1.00 5.33 C ATOM 0 H THR A 40 -6.650 -10.931 -17.676 1.00 21.32 H new ATOM 0 HA THR A 40 -7.591 -11.549 -15.042 1.00 31.44 H new ATOM 0 HB THR A 40 -8.737 -9.403 -15.364 1.00 25.32 H new ATOM 0 HG1 THR A 40 -10.916 -10.250 -15.130 1.00 2.42 H new ATOM 0 HG21 THR A 40 -10.397 -9.106 -17.169 1.00 5.33 H new ATOM 0 HG22 THR A 40 -8.749 -9.303 -17.811 1.00 5.33 H new ATOM 0 HG23 THR A 40 -9.897 -10.661 -17.877 1.00 5.33 H new ATOM 619 N LEU A 41 -9.249 -13.263 -16.170 1.00 51.33 N ATOM 620 CA LEU A 41 -9.765 -14.512 -16.728 1.00 34.14 C ATOM 621 C LEU A 41 -11.231 -14.356 -17.116 1.00 43.22 C ATOM 622 O LEU A 41 -12.077 -14.086 -16.258 1.00 22.33 O ATOM 623 CB LEU A 41 -9.638 -15.664 -15.708 1.00 61.14 C ATOM 624 CG LEU A 41 -8.255 -16.341 -15.596 1.00 40.42 C ATOM 625 CD1 LEU A 41 -7.158 -15.332 -15.274 1.00 4.32 C ATOM 626 CD2 LEU A 41 -8.293 -17.442 -14.538 1.00 50.44 C ATOM 0 H LEU A 41 -9.636 -13.028 -15.256 1.00 51.33 H new ATOM 0 HA LEU A 41 -9.174 -14.748 -17.613 1.00 34.14 H new ATOM 0 HB2 LEU A 41 -9.909 -15.280 -14.725 1.00 61.14 H new ATOM 0 HB3 LEU A 41 -10.371 -16.428 -15.965 1.00 61.14 H new ATOM 0 HG LEU A 41 -8.021 -16.783 -16.564 1.00 40.42 H new ATOM 0 HD11 LEU A 41 -6.200 -15.847 -15.203 1.00 4.32 H new ATOM 0 HD12 LEU A 41 -7.110 -14.582 -16.064 1.00 4.32 H new ATOM 0 HD13 LEU A 41 -7.379 -14.845 -14.324 1.00 4.32 H new ATOM 0 HD21 LEU A 41 -7.312 -17.913 -14.467 1.00 50.44 H new ATOM 0 HD22 LEU A 41 -8.559 -17.010 -13.573 1.00 50.44 H new ATOM 0 HD23 LEU A 41 -9.035 -18.190 -14.818 1.00 50.44 H new ATOM 638 N THR A 42 -11.531 -14.506 -18.403 1.00 31.45 N ATOM 639 CA THR A 42 -12.916 -14.608 -18.841 1.00 23.21 C ATOM 640 C THR A 42 -13.424 -16.012 -18.509 1.00 63.23 C ATOM 641 O THR A 42 -12.630 -16.874 -18.111 1.00 44.05 O ATOM 642 CB THR A 42 -13.074 -14.310 -20.354 1.00 20.41 C ATOM 643 OG1 THR A 42 -14.464 -14.169 -20.683 1.00 73.40 O ATOM 644 CG2 THR A 42 -12.451 -15.409 -21.209 1.00 34.51 C ATOM 0 H THR A 42 -10.841 -14.559 -19.152 1.00 31.45 H new ATOM 0 HA THR A 42 -13.508 -13.858 -18.317 1.00 23.21 H new ATOM 0 HB THR A 42 -12.550 -13.378 -20.567 1.00 20.41 H new ATOM 0 HG1 THR A 42 -14.844 -15.050 -20.884 1.00 73.40 H new ATOM 0 HG21 THR A 42 -12.581 -15.167 -22.264 1.00 34.51 H new ATOM 0 HG22 THR A 42 -11.388 -15.487 -20.983 1.00 34.51 H new ATOM 0 HG23 THR A 42 -12.939 -16.359 -20.992 1.00 34.51 H new ATOM 652 N GLU A 43 -14.719 -16.250 -18.683 1.00 15.15 N ATOM 653 CA GLU A 43 -15.336 -17.498 -18.243 1.00 71.31 C ATOM 654 C GLU A 43 -14.559 -18.710 -18.765 1.00 12.12 C ATOM 655 O GLU A 43 -14.217 -19.603 -17.996 1.00 32.21 O ATOM 656 CB GLU A 43 -16.802 -17.563 -18.693 1.00 43.41 C ATOM 657 CG GLU A 43 -17.612 -18.665 -18.013 1.00 4.44 C ATOM 658 CD GLU A 43 -17.650 -18.522 -16.495 1.00 44.01 C ATOM 659 OE1 GLU A 43 -17.877 -17.396 -15.999 1.00 20.13 O ATOM 660 OE2 GLU A 43 -17.455 -19.535 -15.788 1.00 43.34 O ATOM 0 H GLU A 43 -15.363 -15.595 -19.126 1.00 15.15 H new ATOM 0 HA GLU A 43 -15.307 -17.522 -17.154 1.00 71.31 H new ATOM 0 HB2 GLU A 43 -17.276 -16.602 -18.493 1.00 43.41 H new ATOM 0 HB3 GLU A 43 -16.834 -17.716 -19.772 1.00 43.41 H new ATOM 0 HG2 GLU A 43 -18.631 -18.652 -18.400 1.00 4.44 H new ATOM 0 HG3 GLU A 43 -17.186 -19.634 -18.271 1.00 4.44 H new ATOM 667 N GLU A 44 -14.236 -18.705 -20.061 1.00 24.15 N ATOM 668 CA GLU A 44 -13.516 -19.825 -20.682 1.00 42.15 C ATOM 669 C GLU A 44 -12.218 -20.125 -19.933 1.00 51.42 C ATOM 670 O GLU A 44 -11.885 -21.282 -19.663 1.00 31.32 O ATOM 671 CB GLU A 44 -13.177 -19.520 -22.145 1.00 42.11 C ATOM 672 CG GLU A 44 -14.382 -19.272 -23.037 1.00 54.42 C ATOM 673 CD GLU A 44 -13.993 -19.153 -24.502 1.00 75.51 C ATOM 674 OE1 GLU A 44 -13.530 -18.069 -24.917 1.00 13.55 O ATOM 675 OE2 GLU A 44 -14.131 -20.152 -25.240 1.00 0.14 O ATOM 0 H GLU A 44 -14.460 -17.942 -20.700 1.00 24.15 H new ATOM 0 HA GLU A 44 -14.174 -20.693 -20.634 1.00 42.15 H new ATOM 0 HB2 GLU A 44 -12.530 -18.643 -22.179 1.00 42.11 H new ATOM 0 HB3 GLU A 44 -12.605 -20.354 -22.553 1.00 42.11 H new ATOM 0 HG2 GLU A 44 -15.096 -20.087 -22.917 1.00 54.42 H new ATOM 0 HG3 GLU A 44 -14.885 -18.358 -22.720 1.00 54.42 H new ATOM 682 N GLN A 45 -11.495 -19.064 -19.604 1.00 31.04 N ATOM 683 CA GLN A 45 -10.198 -19.174 -18.944 1.00 14.15 C ATOM 684 C GLN A 45 -10.381 -19.666 -17.514 1.00 53.01 C ATOM 685 O GLN A 45 -9.586 -20.458 -17.014 1.00 14.13 O ATOM 686 CB GLN A 45 -9.499 -17.809 -18.967 1.00 51.21 C ATOM 687 CG GLN A 45 -9.409 -17.202 -20.364 1.00 30.54 C ATOM 688 CD GLN A 45 -8.368 -17.876 -21.243 1.00 41.25 C ATOM 689 OE1 GLN A 45 -7.217 -17.443 -21.299 1.00 64.40 O ATOM 690 NE2 GLN A 45 -8.757 -18.944 -21.919 1.00 1.34 N ATOM 0 H GLN A 45 -11.788 -18.104 -19.786 1.00 31.04 H new ATOM 0 HA GLN A 45 -9.576 -19.896 -19.474 1.00 14.15 H new ATOM 0 HB2 GLN A 45 -10.037 -17.122 -18.314 1.00 51.21 H new ATOM 0 HB3 GLN A 45 -8.494 -17.916 -18.559 1.00 51.21 H new ATOM 0 HG2 GLN A 45 -10.384 -17.272 -20.847 1.00 30.54 H new ATOM 0 HG3 GLN A 45 -9.171 -16.142 -20.278 1.00 30.54 H new ATOM 0 HE21 GLN A 45 -9.720 -19.271 -21.846 1.00 1.34 H new ATOM 0 HE22 GLN A 45 -8.094 -19.441 -22.514 1.00 1.34 H new ATOM 699 N VAL A 46 -11.447 -19.203 -16.866 1.00 64.44 N ATOM 700 CA VAL A 46 -11.785 -19.654 -15.519 1.00 2.55 C ATOM 701 C VAL A 46 -12.050 -21.157 -15.527 1.00 12.42 C ATOM 702 O VAL A 46 -11.494 -21.901 -14.718 1.00 73.15 O ATOM 703 CB VAL A 46 -13.030 -18.913 -14.959 1.00 31.43 C ATOM 704 CG1 VAL A 46 -13.404 -19.434 -13.570 1.00 64.04 C ATOM 705 CG2 VAL A 46 -12.788 -17.403 -14.917 1.00 15.10 C ATOM 0 H VAL A 46 -12.093 -18.515 -17.253 1.00 64.44 H new ATOM 0 HA VAL A 46 -10.937 -19.427 -14.872 1.00 2.55 H new ATOM 0 HB VAL A 46 -13.866 -19.111 -15.630 1.00 31.43 H new ATOM 0 HG11 VAL A 46 -14.279 -18.897 -13.203 1.00 64.04 H new ATOM 0 HG12 VAL A 46 -13.630 -20.499 -13.630 1.00 64.04 H new ATOM 0 HG13 VAL A 46 -12.570 -19.278 -12.886 1.00 64.04 H new ATOM 0 HG21 VAL A 46 -13.673 -16.904 -14.522 1.00 15.10 H new ATOM 0 HG22 VAL A 46 -11.933 -17.189 -14.275 1.00 15.10 H new ATOM 0 HG23 VAL A 46 -12.586 -17.039 -15.924 1.00 15.10 H new ATOM 715 N GLN A 47 -12.879 -21.598 -16.471 1.00 74.22 N ATOM 716 CA GLN A 47 -13.253 -23.004 -16.572 1.00 73.34 C ATOM 717 C GLN A 47 -12.047 -23.844 -16.967 1.00 25.01 C ATOM 718 O GLN A 47 -11.929 -25.005 -16.574 1.00 54.32 O ATOM 719 CB GLN A 47 -14.393 -23.195 -17.579 1.00 71.34 C ATOM 720 CG GLN A 47 -15.516 -22.183 -17.399 1.00 23.23 C ATOM 721 CD GLN A 47 -16.831 -22.612 -18.017 1.00 21.44 C ATOM 722 OE1 GLN A 47 -16.867 -23.381 -18.975 1.00 4.54 O ATOM 723 NE2 GLN A 47 -17.925 -22.089 -17.486 1.00 3.44 N ATOM 0 H GLN A 47 -13.305 -20.999 -17.178 1.00 74.22 H new ATOM 0 HA GLN A 47 -13.605 -23.336 -15.595 1.00 73.34 H new ATOM 0 HB2 GLN A 47 -13.995 -23.113 -18.591 1.00 71.34 H new ATOM 0 HB3 GLN A 47 -14.798 -24.202 -17.476 1.00 71.34 H new ATOM 0 HG2 GLN A 47 -15.666 -22.007 -16.334 1.00 23.23 H new ATOM 0 HG3 GLN A 47 -15.211 -21.234 -17.839 1.00 23.23 H new ATOM 0 HE21 GLN A 47 -17.853 -21.454 -16.691 1.00 3.44 H new ATOM 0 HE22 GLN A 47 -18.840 -22.321 -17.872 1.00 3.44 H new ATOM 732 N GLU A 48 -11.143 -23.245 -17.730 1.00 35.04 N ATOM 733 CA GLU A 48 -9.895 -23.902 -18.091 1.00 64.51 C ATOM 734 C GLU A 48 -9.057 -24.155 -16.836 1.00 55.04 C ATOM 735 O GLU A 48 -8.573 -25.270 -16.613 1.00 73.40 O ATOM 736 CB GLU A 48 -9.125 -23.063 -19.131 1.00 43.20 C ATOM 737 CG GLU A 48 -7.612 -23.076 -18.942 1.00 42.23 C ATOM 738 CD GLU A 48 -6.846 -22.555 -20.147 1.00 41.42 C ATOM 739 OE1 GLU A 48 -7.080 -21.401 -20.561 1.00 52.21 O ATOM 740 OE2 GLU A 48 -6.008 -23.309 -20.700 1.00 51.14 O ATOM 0 H GLU A 48 -11.251 -22.305 -18.111 1.00 35.04 H new ATOM 0 HA GLU A 48 -10.115 -24.866 -18.549 1.00 64.51 H new ATOM 0 HB2 GLU A 48 -9.359 -23.435 -20.128 1.00 43.20 H new ATOM 0 HB3 GLU A 48 -9.478 -22.033 -19.084 1.00 43.20 H new ATOM 0 HG2 GLU A 48 -7.357 -22.472 -18.071 1.00 42.23 H new ATOM 0 HG3 GLU A 48 -7.289 -24.095 -18.729 1.00 42.23 H new ATOM 747 N VAL A 49 -8.917 -23.123 -16.005 1.00 34.21 N ATOM 748 CA VAL A 49 -8.184 -23.238 -14.747 1.00 32.22 C ATOM 749 C VAL A 49 -8.795 -24.305 -13.850 1.00 34.13 C ATOM 750 O VAL A 49 -8.080 -25.147 -13.317 1.00 25.13 O ATOM 751 CB VAL A 49 -8.132 -21.887 -13.986 1.00 3.23 C ATOM 752 CG1 VAL A 49 -7.488 -22.051 -12.608 1.00 62.33 C ATOM 753 CG2 VAL A 49 -7.383 -20.846 -14.812 1.00 71.11 C ATOM 0 H VAL A 49 -9.303 -22.196 -16.182 1.00 34.21 H new ATOM 0 HA VAL A 49 -7.165 -23.529 -15.003 1.00 32.22 H new ATOM 0 HB VAL A 49 -9.155 -21.543 -13.833 1.00 3.23 H new ATOM 0 HG11 VAL A 49 -7.466 -21.087 -12.100 1.00 62.33 H new ATOM 0 HG12 VAL A 49 -8.068 -22.760 -12.017 1.00 62.33 H new ATOM 0 HG13 VAL A 49 -6.470 -22.423 -12.724 1.00 62.33 H new ATOM 0 HG21 VAL A 49 -7.353 -19.902 -14.267 1.00 71.11 H new ATOM 0 HG22 VAL A 49 -6.366 -21.191 -14.996 1.00 71.11 H new ATOM 0 HG23 VAL A 49 -7.894 -20.700 -15.763 1.00 71.11 H new ATOM 763 N VAL A 50 -10.115 -24.287 -13.701 1.00 60.22 N ATOM 764 CA VAL A 50 -10.790 -25.225 -12.805 1.00 11.40 C ATOM 765 C VAL A 50 -10.685 -26.651 -13.337 1.00 72.34 C ATOM 766 O VAL A 50 -10.583 -27.608 -12.569 1.00 53.42 O ATOM 767 CB VAL A 50 -12.278 -24.848 -12.574 1.00 41.25 C ATOM 768 CG1 VAL A 50 -12.406 -23.358 -12.280 1.00 15.52 C ATOM 769 CG2 VAL A 50 -13.175 -25.250 -13.739 1.00 15.52 C ATOM 0 H VAL A 50 -10.737 -23.639 -14.184 1.00 60.22 H new ATOM 0 HA VAL A 50 -10.283 -25.165 -11.842 1.00 11.40 H new ATOM 0 HB VAL A 50 -12.622 -25.414 -11.708 1.00 41.25 H new ATOM 0 HG11 VAL A 50 -13.455 -23.107 -12.120 1.00 15.52 H new ATOM 0 HG12 VAL A 50 -11.834 -23.113 -11.385 1.00 15.52 H new ATOM 0 HG13 VAL A 50 -12.021 -22.786 -13.124 1.00 15.52 H new ATOM 0 HG21 VAL A 50 -14.204 -24.962 -13.522 1.00 15.52 H new ATOM 0 HG22 VAL A 50 -12.841 -24.747 -14.646 1.00 15.52 H new ATOM 0 HG23 VAL A 50 -13.123 -26.329 -13.883 1.00 15.52 H new ATOM 779 N ALA A 51 -10.701 -26.779 -14.660 1.00 31.45 N ATOM 780 CA ALA A 51 -10.538 -28.073 -15.316 1.00 42.34 C ATOM 781 C ALA A 51 -9.149 -28.642 -15.040 1.00 31.41 C ATOM 782 O ALA A 51 -9.000 -29.817 -14.711 1.00 25.24 O ATOM 783 CB ALA A 51 -10.773 -27.946 -16.817 1.00 44.10 C ATOM 0 H ALA A 51 -10.826 -25.997 -15.303 1.00 31.45 H new ATOM 0 HA ALA A 51 -11.280 -28.760 -14.908 1.00 42.34 H new ATOM 0 HB1 ALA A 51 -10.647 -28.921 -17.289 1.00 44.10 H new ATOM 0 HB2 ALA A 51 -11.785 -27.584 -16.997 1.00 44.10 H new ATOM 0 HB3 ALA A 51 -10.055 -27.243 -17.239 1.00 44.10 H new ATOM 789 N LYS A 52 -8.132 -27.793 -15.167 1.00 53.45 N ATOM 790 CA LYS A 52 -6.755 -28.210 -14.918 1.00 42.14 C ATOM 791 C LYS A 52 -6.503 -28.384 -13.424 1.00 3.33 C ATOM 792 O LYS A 52 -5.703 -29.225 -13.018 1.00 33.40 O ATOM 793 CB LYS A 52 -5.764 -27.208 -15.524 1.00 40.33 C ATOM 794 CG LYS A 52 -5.846 -27.106 -17.046 1.00 30.34 C ATOM 795 CD LYS A 52 -5.673 -28.468 -17.722 1.00 44.14 C ATOM 796 CE LYS A 52 -4.308 -29.089 -17.426 1.00 31.32 C ATOM 797 NZ LYS A 52 -4.165 -30.439 -18.036 1.00 11.24 N ATOM 0 H LYS A 52 -8.235 -26.816 -15.440 1.00 53.45 H new ATOM 0 HA LYS A 52 -6.601 -29.174 -15.402 1.00 42.14 H new ATOM 0 HB2 LYS A 52 -5.947 -26.224 -15.093 1.00 40.33 H new ATOM 0 HB3 LYS A 52 -4.751 -27.497 -15.242 1.00 40.33 H new ATOM 0 HG2 LYS A 52 -6.809 -26.680 -17.329 1.00 30.34 H new ATOM 0 HG3 LYS A 52 -5.077 -26.422 -17.406 1.00 30.34 H new ATOM 0 HD2 LYS A 52 -6.459 -29.143 -17.383 1.00 44.14 H new ATOM 0 HD3 LYS A 52 -5.793 -28.355 -18.799 1.00 44.14 H new ATOM 0 HE2 LYS A 52 -3.523 -28.435 -17.805 1.00 31.32 H new ATOM 0 HE3 LYS A 52 -4.169 -29.162 -16.347 1.00 31.32 H new ATOM 0 HZ1 LYS A 52 -3.166 -30.611 -18.268 1.00 11.24 H new ATOM 0 HZ2 LYS A 52 -4.494 -31.161 -17.363 1.00 11.24 H new ATOM 0 HZ3 LYS A 52 -4.736 -30.490 -18.904 1.00 11.24 H new ATOM 811 N LEU A 53 -7.200 -27.599 -12.611 1.00 5.45 N ATOM 812 CA LEU A 53 -7.120 -27.730 -11.158 1.00 72.44 C ATOM 813 C LEU A 53 -7.613 -29.106 -10.721 1.00 43.14 C ATOM 814 O LEU A 53 -7.176 -29.646 -9.705 1.00 30.51 O ATOM 815 CB LEU A 53 -7.941 -26.630 -10.461 1.00 61.32 C ATOM 816 CG LEU A 53 -7.248 -25.265 -10.300 1.00 62.23 C ATOM 817 CD1 LEU A 53 -8.088 -24.347 -9.424 1.00 3.31 C ATOM 818 CD2 LEU A 53 -5.844 -25.429 -9.722 1.00 15.34 C ATOM 0 H LEU A 53 -7.829 -26.863 -12.933 1.00 5.45 H new ATOM 0 HA LEU A 53 -6.076 -27.618 -10.866 1.00 72.44 H new ATOM 0 HB2 LEU A 53 -8.863 -26.482 -11.023 1.00 61.32 H new ATOM 0 HB3 LEU A 53 -8.225 -26.989 -9.472 1.00 61.32 H new ATOM 0 HG LEU A 53 -7.152 -24.811 -11.286 1.00 62.23 H new ATOM 0 HD11 LEU A 53 -7.586 -23.385 -9.319 1.00 3.31 H new ATOM 0 HD12 LEU A 53 -9.065 -24.198 -9.885 1.00 3.31 H new ATOM 0 HD13 LEU A 53 -8.216 -24.799 -8.441 1.00 3.31 H new ATOM 0 HD21 LEU A 53 -5.376 -24.450 -9.618 1.00 15.34 H new ATOM 0 HD22 LEU A 53 -5.907 -25.906 -8.744 1.00 15.34 H new ATOM 0 HD23 LEU A 53 -5.245 -26.048 -10.390 1.00 15.34 H new ATOM 830 N THR A 54 -8.525 -29.673 -11.500 1.00 2.31 N ATOM 831 CA THR A 54 -9.063 -30.995 -11.214 1.00 74.25 C ATOM 832 C THR A 54 -8.348 -32.064 -12.041 1.00 12.24 C ATOM 833 O THR A 54 -8.824 -33.198 -12.156 1.00 11.50 O ATOM 834 CB THR A 54 -10.590 -31.038 -11.462 1.00 54.25 C ATOM 835 OG1 THR A 54 -10.907 -30.450 -12.731 1.00 2.43 O ATOM 836 CG2 THR A 54 -11.336 -30.296 -10.354 1.00 33.32 C ATOM 0 H THR A 54 -8.908 -29.235 -12.338 1.00 2.31 H new ATOM 0 HA THR A 54 -8.887 -31.208 -10.160 1.00 74.25 H new ATOM 0 HB THR A 54 -10.904 -32.082 -11.463 1.00 54.25 H new ATOM 0 HG1 THR A 54 -10.844 -29.474 -12.664 1.00 2.43 H new ATOM 0 HG21 THR A 54 -12.408 -30.337 -10.546 1.00 33.32 H new ATOM 0 HG22 THR A 54 -11.121 -30.765 -9.394 1.00 33.32 H new ATOM 0 HG23 THR A 54 -11.012 -29.256 -10.331 1.00 33.32 H new ATOM 844 N ASP A 55 -7.192 -31.696 -12.598 1.00 13.25 N ATOM 845 CA ASP A 55 -6.325 -32.646 -13.291 1.00 1.54 C ATOM 846 C ASP A 55 -5.465 -33.356 -12.242 1.00 20.51 C ATOM 847 O ASP A 55 -4.465 -32.804 -11.771 1.00 75.23 O ATOM 848 CB ASP A 55 -5.442 -31.912 -14.314 1.00 3.22 C ATOM 849 CG ASP A 55 -4.734 -32.845 -15.287 1.00 40.30 C ATOM 850 OD1 ASP A 55 -3.928 -33.689 -14.843 1.00 52.23 O ATOM 851 OD2 ASP A 55 -4.965 -32.723 -16.513 1.00 74.12 O ATOM 0 H ASP A 55 -6.835 -30.741 -12.581 1.00 13.25 H new ATOM 0 HA ASP A 55 -6.923 -33.377 -13.835 1.00 1.54 H new ATOM 0 HB2 ASP A 55 -6.059 -31.212 -14.878 1.00 3.22 H new ATOM 0 HB3 ASP A 55 -4.696 -31.322 -13.781 1.00 3.22 H new ATOM 856 N PRO A 56 -5.844 -34.593 -11.860 1.00 62.43 N ATOM 857 CA PRO A 56 -5.310 -35.264 -10.659 1.00 43.13 C ATOM 858 C PRO A 56 -3.793 -35.434 -10.689 1.00 2.34 C ATOM 859 O PRO A 56 -3.148 -35.518 -9.641 1.00 53.10 O ATOM 860 CB PRO A 56 -6.010 -36.636 -10.669 1.00 74.10 C ATOM 861 CG PRO A 56 -6.451 -36.831 -12.082 1.00 74.41 C ATOM 862 CD PRO A 56 -6.790 -35.458 -12.590 1.00 55.11 C ATOM 0 HA PRO A 56 -5.500 -34.678 -9.760 1.00 43.13 H new ATOM 0 HB2 PRO A 56 -5.331 -37.428 -10.354 1.00 74.10 H new ATOM 0 HB3 PRO A 56 -6.858 -36.652 -9.984 1.00 74.10 H new ATOM 0 HG2 PRO A 56 -5.662 -37.287 -12.680 1.00 74.41 H new ATOM 0 HG3 PRO A 56 -7.315 -37.494 -12.136 1.00 74.41 H new ATOM 0 HD2 PRO A 56 -6.656 -35.382 -13.669 1.00 55.11 H new ATOM 0 HD3 PRO A 56 -7.826 -35.193 -12.378 1.00 55.11 H new ATOM 870 N GLU A 57 -3.233 -35.477 -11.885 1.00 53.21 N ATOM 871 CA GLU A 57 -1.817 -35.703 -12.060 1.00 31.20 C ATOM 872 C GLU A 57 -1.052 -34.381 -12.114 1.00 11.32 C ATOM 873 O GLU A 57 0.007 -34.249 -11.497 1.00 40.10 O ATOM 874 CB GLU A 57 -1.582 -36.531 -13.331 1.00 11.23 C ATOM 875 CG GLU A 57 -2.776 -36.580 -14.279 1.00 74.52 C ATOM 876 CD GLU A 57 -2.494 -37.370 -15.541 1.00 43.42 C ATOM 877 OE1 GLU A 57 -1.889 -36.804 -16.479 1.00 10.41 O ATOM 878 OE2 GLU A 57 -2.874 -38.556 -15.606 1.00 15.41 O ATOM 0 H GLU A 57 -3.749 -35.356 -12.757 1.00 53.21 H new ATOM 0 HA GLU A 57 -1.440 -36.260 -11.202 1.00 31.20 H new ATOM 0 HB2 GLU A 57 -0.726 -36.119 -13.865 1.00 11.23 H new ATOM 0 HB3 GLU A 57 -1.319 -37.549 -13.044 1.00 11.23 H new ATOM 0 HG2 GLU A 57 -3.627 -37.023 -13.761 1.00 74.52 H new ATOM 0 HG3 GLU A 57 -3.061 -35.563 -14.549 1.00 74.52 H new ATOM 885 N SER A 58 -1.600 -33.400 -12.827 1.00 43.04 N ATOM 886 CA SER A 58 -0.909 -32.129 -13.046 1.00 14.11 C ATOM 887 C SER A 58 -0.786 -31.312 -11.753 1.00 64.34 C ATOM 888 O SER A 58 0.309 -30.857 -11.405 1.00 15.34 O ATOM 889 CB SER A 58 -1.640 -31.316 -14.121 1.00 53.34 C ATOM 890 OG SER A 58 -1.731 -32.050 -15.331 1.00 0.11 O ATOM 0 H SER A 58 -2.520 -33.459 -13.263 1.00 43.04 H new ATOM 0 HA SER A 58 0.102 -32.355 -13.385 1.00 14.11 H new ATOM 0 HB2 SER A 58 -2.639 -31.057 -13.771 1.00 53.34 H new ATOM 0 HB3 SER A 58 -1.111 -30.379 -14.297 1.00 53.34 H new ATOM 0 HG SER A 58 -2.202 -31.515 -16.004 1.00 0.11 H new ATOM 896 N SER A 59 -1.904 -31.139 -11.048 1.00 11.31 N ATOM 897 CA SER A 59 -1.953 -30.289 -9.857 1.00 64.13 C ATOM 898 C SER A 59 -0.993 -30.778 -8.769 1.00 74.10 C ATOM 899 O SER A 59 -0.201 -30.005 -8.231 1.00 53.43 O ATOM 900 CB SER A 59 -3.384 -30.250 -9.312 1.00 5.10 C ATOM 901 OG SER A 59 -4.304 -29.905 -10.332 1.00 31.55 O ATOM 0 H SER A 59 -2.794 -31.579 -11.283 1.00 11.31 H new ATOM 0 HA SER A 59 -1.639 -29.286 -10.147 1.00 64.13 H new ATOM 0 HB2 SER A 59 -3.645 -31.223 -8.895 1.00 5.10 H new ATOM 0 HB3 SER A 59 -3.448 -29.527 -8.499 1.00 5.10 H new ATOM 0 HG SER A 59 -4.529 -30.704 -10.853 1.00 31.55 H new ATOM 907 N ALA A 60 -1.050 -32.067 -8.462 1.00 52.35 N ATOM 908 CA ALA A 60 -0.230 -32.639 -7.395 1.00 44.05 C ATOM 909 C ALA A 60 1.255 -32.634 -7.766 1.00 65.01 C ATOM 910 O ALA A 60 2.125 -32.561 -6.894 1.00 55.43 O ATOM 911 CB ALA A 60 -0.695 -34.057 -7.078 1.00 33.33 C ATOM 0 H ALA A 60 -1.655 -32.739 -8.935 1.00 52.35 H new ATOM 0 HA ALA A 60 -0.351 -32.018 -6.508 1.00 44.05 H new ATOM 0 HB1 ALA A 60 -0.077 -34.473 -6.282 1.00 33.33 H new ATOM 0 HB2 ALA A 60 -1.736 -34.035 -6.756 1.00 33.33 H new ATOM 0 HB3 ALA A 60 -0.604 -34.677 -7.970 1.00 33.33 H new ATOM 917 N GLN A 61 1.534 -32.677 -9.063 1.00 51.35 N ATOM 918 CA GLN A 61 2.899 -32.849 -9.561 1.00 31.01 C ATOM 919 C GLN A 61 3.732 -31.574 -9.416 1.00 42.21 C ATOM 920 O GLN A 61 4.953 -31.618 -9.570 1.00 61.11 O ATOM 921 CB GLN A 61 2.871 -33.274 -11.038 1.00 62.35 C ATOM 922 CG GLN A 61 4.237 -33.672 -11.595 1.00 12.53 C ATOM 923 CD GLN A 61 4.236 -33.855 -13.104 1.00 33.44 C ATOM 924 OE1 GLN A 61 3.223 -34.212 -13.702 1.00 35.13 O ATOM 925 NE2 GLN A 61 5.380 -33.616 -13.728 1.00 62.21 N ATOM 0 H GLN A 61 0.830 -32.595 -9.796 1.00 51.35 H new ATOM 0 HA GLN A 61 3.367 -33.625 -8.956 1.00 31.01 H new ATOM 0 HB2 GLN A 61 2.185 -34.114 -11.151 1.00 62.35 H new ATOM 0 HB3 GLN A 61 2.472 -32.454 -11.634 1.00 62.35 H new ATOM 0 HG2 GLN A 61 4.968 -32.909 -11.328 1.00 12.53 H new ATOM 0 HG3 GLN A 61 4.559 -34.600 -11.123 1.00 12.53 H new ATOM 0 HE21 GLN A 61 6.199 -33.321 -13.196 1.00 62.21 H new ATOM 0 HE22 GLN A 61 5.442 -33.727 -14.740 1.00 62.21 H new ATOM 934 N ILE A 62 3.087 -30.440 -9.118 1.00 4.23 N ATOM 935 CA ILE A 62 3.790 -29.153 -9.138 1.00 32.12 C ATOM 936 C ILE A 62 5.057 -29.207 -8.270 1.00 0.54 C ATOM 937 O ILE A 62 6.148 -28.875 -8.731 1.00 12.44 O ATOM 938 CB ILE A 62 2.882 -27.999 -8.634 1.00 60.44 C ATOM 939 CG1 ILE A 62 1.565 -27.939 -9.433 1.00 42.11 C ATOM 940 CG2 ILE A 62 3.616 -26.658 -8.700 1.00 4.10 C ATOM 941 CD1 ILE A 62 1.741 -27.726 -10.919 1.00 43.34 C ATOM 0 H ILE A 62 2.100 -30.386 -8.865 1.00 4.23 H new ATOM 0 HA ILE A 62 4.065 -28.959 -10.175 1.00 32.12 H new ATOM 0 HB ILE A 62 2.635 -28.201 -7.592 1.00 60.44 H new ATOM 0 HG12 ILE A 62 1.016 -28.867 -9.275 1.00 42.11 H new ATOM 0 HG13 ILE A 62 0.949 -27.133 -9.034 1.00 42.11 H new ATOM 0 HG21 ILE A 62 2.959 -25.866 -8.342 1.00 4.10 H new ATOM 0 HG22 ILE A 62 4.508 -26.700 -8.075 1.00 4.10 H new ATOM 0 HG23 ILE A 62 3.905 -26.452 -9.731 1.00 4.10 H new ATOM 0 HD11 ILE A 62 0.764 -27.697 -11.401 1.00 43.34 H new ATOM 0 HD12 ILE A 62 2.259 -26.783 -11.093 1.00 43.34 H new ATOM 0 HD13 ILE A 62 2.327 -28.544 -11.337 1.00 43.34 H new ATOM 953 N ASP A 63 4.907 -29.646 -7.022 1.00 4.21 N ATOM 954 CA ASP A 63 6.060 -29.933 -6.157 1.00 24.12 C ATOM 955 C ASP A 63 6.021 -31.368 -5.651 1.00 32.11 C ATOM 956 O ASP A 63 6.942 -31.817 -4.970 1.00 51.03 O ATOM 957 CB ASP A 63 6.136 -28.948 -4.977 1.00 63.41 C ATOM 958 CG ASP A 63 6.916 -27.688 -5.326 1.00 3.22 C ATOM 959 OD1 ASP A 63 8.165 -27.741 -5.330 1.00 1.22 O ATOM 960 OD2 ASP A 63 6.289 -26.643 -5.607 1.00 51.45 O ATOM 0 H ASP A 63 4.001 -29.812 -6.583 1.00 4.21 H new ATOM 0 HA ASP A 63 6.959 -29.806 -6.760 1.00 24.12 H new ATOM 0 HB2 ASP A 63 5.127 -28.674 -4.669 1.00 63.41 H new ATOM 0 HB3 ASP A 63 6.606 -29.440 -4.126 1.00 63.41 H new ATOM 965 N GLY A 64 4.964 -32.091 -5.999 1.00 4.34 N ATOM 966 CA GLY A 64 4.704 -33.374 -5.370 1.00 4.15 C ATOM 967 C GLY A 64 3.869 -33.186 -4.122 1.00 21.32 C ATOM 968 O GLY A 64 4.137 -33.780 -3.073 1.00 74.55 O ATOM 0 H GLY A 64 4.282 -31.813 -6.705 1.00 4.34 H new ATOM 0 HA2 GLY A 64 4.185 -34.031 -6.068 1.00 4.15 H new ATOM 0 HA3 GLY A 64 5.646 -33.860 -5.116 1.00 4.15 H new ATOM 972 N VAL A 65 2.861 -32.329 -4.247 1.00 53.23 N ATOM 973 CA VAL A 65 1.984 -31.963 -3.142 1.00 5.12 C ATOM 974 C VAL A 65 0.721 -31.293 -3.687 1.00 22.24 C ATOM 975 O VAL A 65 0.773 -30.590 -4.698 1.00 34.45 O ATOM 976 CB VAL A 65 2.696 -31.007 -2.142 1.00 20.52 C ATOM 977 CG1 VAL A 65 3.143 -29.721 -2.837 1.00 63.22 C ATOM 978 CG2 VAL A 65 1.798 -30.695 -0.943 1.00 11.54 C ATOM 0 H VAL A 65 2.628 -31.866 -5.125 1.00 53.23 H new ATOM 0 HA VAL A 65 1.718 -32.874 -2.606 1.00 5.12 H new ATOM 0 HB VAL A 65 3.585 -31.516 -1.771 1.00 20.52 H new ATOM 0 HG11 VAL A 65 3.638 -29.071 -2.116 1.00 63.22 H new ATOM 0 HG12 VAL A 65 3.837 -29.965 -3.642 1.00 63.22 H new ATOM 0 HG13 VAL A 65 2.274 -29.210 -3.250 1.00 63.22 H new ATOM 0 HG21 VAL A 65 2.321 -30.025 -0.261 1.00 11.54 H new ATOM 0 HG22 VAL A 65 0.882 -30.217 -1.289 1.00 11.54 H new ATOM 0 HG23 VAL A 65 1.550 -31.621 -0.423 1.00 11.54 H new ATOM 988 N VAL A 66 -0.410 -31.526 -3.029 1.00 30.32 N ATOM 989 CA VAL A 66 -1.685 -30.943 -3.444 1.00 1.42 C ATOM 990 C VAL A 66 -2.215 -29.996 -2.361 1.00 32.13 C ATOM 991 O VAL A 66 -2.525 -30.421 -1.244 1.00 51.15 O ATOM 992 CB VAL A 66 -2.726 -32.052 -3.769 1.00 14.41 C ATOM 993 CG1 VAL A 66 -2.913 -33.008 -2.589 1.00 5.23 C ATOM 994 CG2 VAL A 66 -4.058 -31.445 -4.208 1.00 34.45 C ATOM 0 H VAL A 66 -0.471 -32.118 -2.201 1.00 30.32 H new ATOM 0 HA VAL A 66 -1.518 -30.367 -4.354 1.00 1.42 H new ATOM 0 HB VAL A 66 -2.336 -32.636 -4.602 1.00 14.41 H new ATOM 0 HG11 VAL A 66 -3.647 -33.770 -2.851 1.00 5.23 H new ATOM 0 HG12 VAL A 66 -1.962 -33.486 -2.354 1.00 5.23 H new ATOM 0 HG13 VAL A 66 -3.263 -32.450 -1.721 1.00 5.23 H new ATOM 0 HG21 VAL A 66 -4.767 -32.243 -4.429 1.00 34.45 H new ATOM 0 HG22 VAL A 66 -4.454 -30.819 -3.408 1.00 34.45 H new ATOM 0 HG23 VAL A 66 -3.905 -30.839 -5.101 1.00 34.45 H new ATOM 1004 N SER A 67 -2.265 -28.702 -2.679 1.00 53.53 N ATOM 1005 CA SER A 67 -2.693 -27.678 -1.724 1.00 63.30 C ATOM 1006 C SER A 67 -3.449 -26.552 -2.439 1.00 25.11 C ATOM 1007 O SER A 67 -3.188 -26.283 -3.606 1.00 45.11 O ATOM 1008 CB SER A 67 -1.474 -27.112 -0.982 1.00 44.10 C ATOM 1009 OG SER A 67 -0.759 -28.142 -0.316 1.00 1.41 O ATOM 0 H SER A 67 -2.013 -28.336 -3.597 1.00 53.53 H new ATOM 0 HA SER A 67 -3.368 -28.137 -1.001 1.00 63.30 H new ATOM 0 HB2 SER A 67 -0.816 -26.607 -1.689 1.00 44.10 H new ATOM 0 HB3 SER A 67 -1.799 -26.364 -0.259 1.00 44.10 H new ATOM 0 HG SER A 67 0.014 -27.757 0.148 1.00 1.41 H new ATOM 1015 N LYS A 68 -4.347 -25.868 -1.717 1.00 41.35 N ATOM 1016 CA LYS A 68 -5.202 -24.813 -2.302 1.00 53.40 C ATOM 1017 C LYS A 68 -4.381 -23.759 -3.060 1.00 61.41 C ATOM 1018 O LYS A 68 -4.900 -23.068 -3.938 1.00 72.23 O ATOM 1019 CB LYS A 68 -6.049 -24.106 -1.220 1.00 10.32 C ATOM 1020 CG LYS A 68 -7.105 -24.987 -0.543 1.00 71.13 C ATOM 1021 CD LYS A 68 -6.502 -25.940 0.489 1.00 22.42 C ATOM 1022 CE LYS A 68 -5.860 -25.190 1.653 1.00 22.41 C ATOM 1023 NZ LYS A 68 -6.847 -24.379 2.416 1.00 5.02 N ATOM 0 H LYS A 68 -4.504 -26.024 -0.721 1.00 41.35 H new ATOM 0 HA LYS A 68 -5.863 -25.317 -3.007 1.00 53.40 H new ATOM 0 HB2 LYS A 68 -5.379 -23.715 -0.454 1.00 10.32 H new ATOM 0 HB3 LYS A 68 -6.549 -23.250 -1.674 1.00 10.32 H new ATOM 0 HG2 LYS A 68 -7.845 -24.352 -0.056 1.00 71.13 H new ATOM 0 HG3 LYS A 68 -7.631 -25.565 -1.302 1.00 71.13 H new ATOM 0 HD2 LYS A 68 -7.280 -26.602 0.869 1.00 22.42 H new ATOM 0 HD3 LYS A 68 -5.754 -26.570 0.007 1.00 22.42 H new ATOM 0 HE2 LYS A 68 -5.384 -25.905 2.324 1.00 22.41 H new ATOM 0 HE3 LYS A 68 -5.074 -24.538 1.273 1.00 22.41 H new ATOM 0 HZ1 LYS A 68 -6.411 -24.040 3.297 1.00 5.02 H new ATOM 0 HZ2 LYS A 68 -7.145 -23.565 1.842 1.00 5.02 H new ATOM 0 HZ3 LYS A 68 -7.676 -24.965 2.643 1.00 5.02 H new ATOM 1037 N ASP A 69 -3.100 -23.649 -2.715 1.00 15.13 N ATOM 1038 CA ASP A 69 -2.197 -22.670 -3.333 1.00 73.13 C ATOM 1039 C ASP A 69 -2.150 -22.839 -4.852 1.00 2.11 C ATOM 1040 O ASP A 69 -1.832 -21.898 -5.586 1.00 71.50 O ATOM 1041 CB ASP A 69 -0.781 -22.817 -2.754 1.00 3.14 C ATOM 1042 CG ASP A 69 -0.772 -22.759 -1.235 1.00 33.44 C ATOM 1043 OD1 ASP A 69 -1.021 -23.806 -0.594 1.00 53.11 O ATOM 1044 OD2 ASP A 69 -0.535 -21.672 -0.670 1.00 3.03 O ATOM 0 H ASP A 69 -2.657 -24.231 -2.004 1.00 15.13 H new ATOM 0 HA ASP A 69 -2.581 -21.675 -3.110 1.00 73.13 H new ATOM 0 HB2 ASP A 69 -0.353 -23.764 -3.082 1.00 3.14 H new ATOM 0 HB3 ASP A 69 -0.145 -22.025 -3.150 1.00 3.14 H new ATOM 1049 N GLU A 70 -2.475 -24.043 -5.315 1.00 14.54 N ATOM 1050 CA GLU A 70 -2.457 -24.366 -6.740 1.00 21.21 C ATOM 1051 C GLU A 70 -3.395 -23.456 -7.533 1.00 20.22 C ATOM 1052 O GLU A 70 -3.084 -23.071 -8.658 1.00 62.31 O ATOM 1053 CB GLU A 70 -2.839 -25.837 -6.948 1.00 43.43 C ATOM 1054 CG GLU A 70 -4.220 -26.198 -6.411 1.00 54.45 C ATOM 1055 CD GLU A 70 -4.487 -27.695 -6.426 1.00 72.43 C ATOM 1056 OE1 GLU A 70 -4.077 -28.386 -5.468 1.00 33.23 O ATOM 1057 OE2 GLU A 70 -5.112 -28.185 -7.390 1.00 53.25 O ATOM 0 H GLU A 70 -2.757 -24.819 -4.717 1.00 14.54 H new ATOM 0 HA GLU A 70 -1.445 -24.201 -7.111 1.00 21.21 H new ATOM 0 HB2 GLU A 70 -2.803 -26.064 -8.013 1.00 43.43 H new ATOM 0 HB3 GLU A 70 -2.095 -26.468 -6.462 1.00 43.43 H new ATOM 0 HG2 GLU A 70 -4.316 -25.827 -5.391 1.00 54.45 H new ATOM 0 HG3 GLU A 70 -4.980 -25.692 -7.007 1.00 54.45 H new ATOM 1064 N ILE A 71 -4.525 -23.080 -6.926 1.00 21.23 N ATOM 1065 CA ILE A 71 -5.529 -22.266 -7.611 1.00 21.42 C ATOM 1066 C ILE A 71 -4.897 -20.950 -8.060 1.00 5.33 C ATOM 1067 O ILE A 71 -4.983 -20.565 -9.230 1.00 63.22 O ATOM 1068 CB ILE A 71 -6.756 -21.970 -6.697 1.00 25.30 C ATOM 1069 CG1 ILE A 71 -7.256 -23.266 -6.029 1.00 51.32 C ATOM 1070 CG2 ILE A 71 -7.891 -21.318 -7.498 1.00 34.21 C ATOM 1071 CD1 ILE A 71 -8.420 -23.062 -5.077 1.00 41.44 C ATOM 0 H ILE A 71 -4.765 -23.326 -5.966 1.00 21.23 H new ATOM 0 HA ILE A 71 -5.884 -22.828 -8.475 1.00 21.42 H new ATOM 0 HB ILE A 71 -6.438 -21.274 -5.921 1.00 25.30 H new ATOM 0 HG12 ILE A 71 -7.554 -23.971 -6.805 1.00 51.32 H new ATOM 0 HG13 ILE A 71 -6.430 -23.723 -5.484 1.00 51.32 H new ATOM 0 HG21 ILE A 71 -8.736 -21.121 -6.838 1.00 34.21 H new ATOM 0 HG22 ILE A 71 -7.540 -20.380 -7.928 1.00 34.21 H new ATOM 0 HG23 ILE A 71 -8.204 -21.989 -8.298 1.00 34.21 H new ATOM 0 HD11 ILE A 71 -8.712 -24.021 -4.649 1.00 41.44 H new ATOM 0 HD12 ILE A 71 -8.122 -22.384 -4.278 1.00 41.44 H new ATOM 0 HD13 ILE A 71 -9.263 -22.635 -5.620 1.00 41.44 H new ATOM 1083 N GLU A 72 -4.214 -20.304 -7.118 1.00 15.22 N ATOM 1084 CA GLU A 72 -3.545 -19.030 -7.365 1.00 53.51 C ATOM 1085 C GLU A 72 -2.556 -19.156 -8.524 1.00 55.15 C ATOM 1086 O GLU A 72 -2.538 -18.331 -9.438 1.00 64.43 O ATOM 1087 CB GLU A 72 -2.783 -18.575 -6.110 1.00 52.51 C ATOM 1088 CG GLU A 72 -3.541 -18.760 -4.800 1.00 33.15 C ATOM 1089 CD GLU A 72 -2.731 -18.291 -3.599 1.00 43.24 C ATOM 1090 OE1 GLU A 72 -2.760 -17.081 -3.287 1.00 52.10 O ATOM 1091 OE2 GLU A 72 -2.040 -19.125 -2.975 1.00 15.35 O ATOM 0 H GLU A 72 -4.109 -20.649 -6.164 1.00 15.22 H new ATOM 0 HA GLU A 72 -4.309 -18.295 -7.619 1.00 53.51 H new ATOM 0 HB2 GLU A 72 -1.845 -19.127 -6.052 1.00 52.51 H new ATOM 0 HB3 GLU A 72 -2.527 -17.521 -6.220 1.00 52.51 H new ATOM 0 HG2 GLU A 72 -4.479 -18.206 -4.843 1.00 33.15 H new ATOM 0 HG3 GLU A 72 -3.797 -19.812 -4.675 1.00 33.15 H new ATOM 1098 N LYS A 73 -1.743 -20.211 -8.473 1.00 41.33 N ATOM 1099 CA LYS A 73 -0.664 -20.406 -9.434 1.00 45.24 C ATOM 1100 C LYS A 73 -1.225 -20.627 -10.839 1.00 24.45 C ATOM 1101 O LYS A 73 -0.759 -20.021 -11.808 1.00 4.23 O ATOM 1102 CB LYS A 73 0.209 -21.596 -9.007 1.00 73.41 C ATOM 1103 CG LYS A 73 1.543 -21.686 -9.745 1.00 61.01 C ATOM 1104 CD LYS A 73 2.411 -20.451 -9.492 1.00 25.10 C ATOM 1105 CE LYS A 73 3.777 -20.560 -10.164 1.00 44.05 C ATOM 1106 NZ LYS A 73 3.664 -20.747 -11.632 1.00 4.13 N ATOM 0 H LYS A 73 -1.814 -20.947 -7.770 1.00 41.33 H new ATOM 0 HA LYS A 73 -0.047 -19.507 -9.455 1.00 45.24 H new ATOM 0 HB2 LYS A 73 0.402 -21.526 -7.937 1.00 73.41 H new ATOM 0 HB3 LYS A 73 -0.348 -22.519 -9.171 1.00 73.41 H new ATOM 0 HG2 LYS A 73 2.078 -22.580 -9.423 1.00 61.01 H new ATOM 0 HG3 LYS A 73 1.361 -21.791 -10.815 1.00 61.01 H new ATOM 0 HD2 LYS A 73 1.896 -19.565 -9.862 1.00 25.10 H new ATOM 0 HD3 LYS A 73 2.545 -20.317 -8.419 1.00 25.10 H new ATOM 0 HE2 LYS A 73 4.355 -19.659 -9.957 1.00 44.05 H new ATOM 0 HE3 LYS A 73 4.326 -21.397 -9.734 1.00 44.05 H new ATOM 0 HZ1 LYS A 73 4.605 -20.664 -12.066 1.00 4.13 H new ATOM 0 HZ2 LYS A 73 3.272 -21.689 -11.833 1.00 4.13 H new ATOM 0 HZ3 LYS A 73 3.035 -20.019 -12.027 1.00 4.13 H new ATOM 1120 N PHE A 74 -2.239 -21.484 -10.936 1.00 11.22 N ATOM 1121 CA PHE A 74 -2.878 -21.783 -12.215 1.00 22.20 C ATOM 1122 C PHE A 74 -3.555 -20.540 -12.790 1.00 73.02 C ATOM 1123 O PHE A 74 -3.520 -20.317 -14.001 1.00 45.14 O ATOM 1124 CB PHE A 74 -3.891 -22.930 -12.067 1.00 10.05 C ATOM 1125 CG PHE A 74 -3.263 -24.307 -12.065 1.00 14.54 C ATOM 1126 CD1 PHE A 74 -2.408 -24.701 -11.045 1.00 44.33 C ATOM 1127 CD2 PHE A 74 -3.542 -25.210 -13.083 1.00 44.31 C ATOM 1128 CE1 PHE A 74 -1.839 -25.960 -11.044 1.00 1.45 C ATOM 1129 CE2 PHE A 74 -2.972 -26.470 -13.086 1.00 73.32 C ATOM 1130 CZ PHE A 74 -2.124 -26.847 -12.064 1.00 62.40 C ATOM 0 H PHE A 74 -2.637 -21.985 -10.141 1.00 11.22 H new ATOM 0 HA PHE A 74 -2.102 -22.101 -12.911 1.00 22.20 H new ATOM 0 HB2 PHE A 74 -4.446 -22.793 -11.139 1.00 10.05 H new ATOM 0 HB3 PHE A 74 -4.613 -22.872 -12.882 1.00 10.05 H new ATOM 0 HD1 PHE A 74 -2.185 -24.015 -10.242 1.00 44.33 H new ATOM 0 HD2 PHE A 74 -4.212 -24.925 -13.881 1.00 44.31 H new ATOM 0 HE1 PHE A 74 -1.172 -26.251 -10.246 1.00 1.45 H new ATOM 0 HE2 PHE A 74 -3.190 -27.159 -13.888 1.00 73.32 H new ATOM 0 HZ PHE A 74 -1.684 -27.833 -12.062 1.00 62.40 H new ATOM 1140 N ILE A 75 -4.156 -19.725 -11.923 1.00 65.43 N ATOM 1141 CA ILE A 75 -4.786 -18.484 -12.362 1.00 31.44 C ATOM 1142 C ILE A 75 -3.732 -17.525 -12.916 1.00 22.43 C ATOM 1143 O ILE A 75 -3.859 -17.015 -14.034 1.00 22.03 O ATOM 1144 CB ILE A 75 -5.561 -17.803 -11.203 1.00 14.34 C ATOM 1145 CG1 ILE A 75 -6.750 -18.678 -10.770 1.00 51.04 C ATOM 1146 CG2 ILE A 75 -6.033 -16.406 -11.606 1.00 31.23 C ATOM 1147 CD1 ILE A 75 -7.511 -18.135 -9.580 1.00 30.54 C ATOM 0 H ILE A 75 -4.219 -19.901 -10.920 1.00 65.43 H new ATOM 0 HA ILE A 75 -5.499 -18.732 -13.148 1.00 31.44 H new ATOM 0 HB ILE A 75 -4.884 -17.694 -10.355 1.00 14.34 H new ATOM 0 HG12 ILE A 75 -7.436 -18.783 -11.610 1.00 51.04 H new ATOM 0 HG13 ILE A 75 -6.385 -19.677 -10.530 1.00 51.04 H new ATOM 0 HG21 ILE A 75 -6.573 -15.951 -10.776 1.00 31.23 H new ATOM 0 HG22 ILE A 75 -5.170 -15.789 -11.859 1.00 31.23 H new ATOM 0 HG23 ILE A 75 -6.692 -16.480 -12.471 1.00 31.23 H new ATOM 0 HD11 ILE A 75 -8.333 -18.808 -9.336 1.00 30.54 H new ATOM 0 HD12 ILE A 75 -6.840 -18.057 -8.724 1.00 30.54 H new ATOM 0 HD13 ILE A 75 -7.908 -17.149 -9.821 1.00 30.54 H new ATOM 1159 N ALA A 76 -2.674 -17.314 -12.137 1.00 52.44 N ATOM 1160 CA ALA A 76 -1.593 -16.410 -12.521 1.00 4.04 C ATOM 1161 C ALA A 76 -0.965 -16.834 -13.846 1.00 21.11 C ATOM 1162 O ALA A 76 -0.499 -15.991 -14.621 1.00 25.25 O ATOM 1163 CB ALA A 76 -0.537 -16.354 -11.422 1.00 5.44 C ATOM 0 H ALA A 76 -2.542 -17.760 -11.229 1.00 52.44 H new ATOM 0 HA ALA A 76 -2.014 -15.414 -12.655 1.00 4.04 H new ATOM 0 HB1 ALA A 76 0.263 -15.677 -11.721 1.00 5.44 H new ATOM 0 HB2 ALA A 76 -0.991 -15.994 -10.499 1.00 5.44 H new ATOM 0 HB3 ALA A 76 -0.127 -17.351 -11.260 1.00 5.44 H new ATOM 1169 N ASP A 77 -0.970 -18.143 -14.104 1.00 61.03 N ATOM 1170 CA ASP A 77 -0.408 -18.701 -15.336 1.00 42.01 C ATOM 1171 C ASP A 77 -1.118 -18.129 -16.564 1.00 61.43 C ATOM 1172 O ASP A 77 -0.503 -17.939 -17.617 1.00 2.14 O ATOM 1173 CB ASP A 77 -0.524 -20.234 -15.335 1.00 63.45 C ATOM 1174 CG ASP A 77 0.220 -20.887 -16.495 1.00 43.21 C ATOM 1175 OD1 ASP A 77 -0.336 -20.961 -17.611 1.00 14.33 O ATOM 1176 OD2 ASP A 77 1.371 -21.334 -16.294 1.00 31.32 O ATOM 0 H ASP A 77 -1.360 -18.841 -13.471 1.00 61.03 H new ATOM 0 HA ASP A 77 0.645 -18.425 -15.380 1.00 42.01 H new ATOM 0 HB2 ASP A 77 -0.133 -20.622 -14.395 1.00 63.45 H new ATOM 0 HB3 ASP A 77 -1.576 -20.514 -15.382 1.00 63.45 H new ATOM 1181 N VAL A 78 -2.401 -17.805 -16.406 1.00 0.21 N ATOM 1182 CA VAL A 78 -3.231 -17.328 -17.518 1.00 54.41 C ATOM 1183 C VAL A 78 -3.017 -15.821 -17.739 1.00 22.23 C ATOM 1184 O VAL A 78 -3.926 -15.094 -18.131 1.00 42.11 O ATOM 1185 CB VAL A 78 -4.735 -17.629 -17.254 1.00 74.43 C ATOM 1186 CG1 VAL A 78 -5.583 -17.414 -18.514 1.00 55.44 C ATOM 1187 CG2 VAL A 78 -4.913 -19.051 -16.721 1.00 24.11 C ATOM 0 H VAL A 78 -2.893 -17.864 -15.514 1.00 0.21 H new ATOM 0 HA VAL A 78 -2.930 -17.859 -18.421 1.00 54.41 H new ATOM 0 HB VAL A 78 -5.085 -16.927 -16.497 1.00 74.43 H new ATOM 0 HG11 VAL A 78 -6.627 -17.634 -18.292 1.00 55.44 H new ATOM 0 HG12 VAL A 78 -5.492 -16.378 -18.842 1.00 55.44 H new ATOM 0 HG13 VAL A 78 -5.233 -18.077 -19.305 1.00 55.44 H new ATOM 0 HG21 VAL A 78 -5.971 -19.243 -16.542 1.00 24.11 H new ATOM 0 HG22 VAL A 78 -4.533 -19.764 -17.453 1.00 24.11 H new ATOM 0 HG23 VAL A 78 -4.362 -19.161 -15.787 1.00 24.11 H new ATOM 1197 N THR A 79 -1.788 -15.368 -17.482 1.00 30.41 N ATOM 1198 CA THR A 79 -1.397 -13.969 -17.664 1.00 54.12 C ATOM 1199 C THR A 79 -2.138 -13.058 -16.673 1.00 71.50 C ATOM 1200 O THR A 79 -2.160 -11.835 -16.817 1.00 33.50 O ATOM 1201 CB THR A 79 -1.646 -13.508 -19.127 1.00 72.30 C ATOM 1202 OG1 THR A 79 -1.123 -14.494 -20.032 1.00 53.21 O ATOM 1203 CG2 THR A 79 -0.979 -12.163 -19.420 1.00 22.22 C ATOM 0 H THR A 79 -1.034 -15.964 -17.141 1.00 30.41 H new ATOM 0 HA THR A 79 -0.329 -13.891 -17.462 1.00 54.12 H new ATOM 0 HB THR A 79 -2.721 -13.392 -19.261 1.00 72.30 H new ATOM 0 HG1 THR A 79 -1.280 -14.206 -20.956 1.00 53.21 H new ATOM 0 HG21 THR A 79 -1.177 -11.876 -20.453 1.00 22.22 H new ATOM 0 HG22 THR A 79 -1.381 -11.404 -18.749 1.00 22.22 H new ATOM 0 HG23 THR A 79 0.097 -12.249 -19.267 1.00 22.22 H new ATOM 1211 N LYS A 80 -2.710 -13.668 -15.636 1.00 61.35 N ATOM 1212 CA LYS A 80 -3.354 -12.914 -14.567 1.00 2.22 C ATOM 1213 C LYS A 80 -2.280 -12.263 -13.702 1.00 73.41 C ATOM 1214 O LYS A 80 -2.504 -11.202 -13.122 1.00 21.42 O ATOM 1215 CB LYS A 80 -4.259 -13.833 -13.726 1.00 2.02 C ATOM 1216 CG LYS A 80 -5.002 -13.135 -12.587 1.00 21.24 C ATOM 1217 CD LYS A 80 -5.889 -11.998 -13.087 1.00 33.52 C ATOM 1218 CE LYS A 80 -6.922 -11.577 -12.043 1.00 30.34 C ATOM 1219 NZ LYS A 80 -6.300 -11.199 -10.745 1.00 71.14 N ATOM 0 H LYS A 80 -2.740 -14.680 -15.515 1.00 61.35 H new ATOM 0 HA LYS A 80 -3.986 -12.137 -14.997 1.00 2.22 H new ATOM 0 HB2 LYS A 80 -4.990 -14.301 -14.385 1.00 2.02 H new ATOM 0 HB3 LYS A 80 -3.650 -14.634 -13.307 1.00 2.02 H new ATOM 0 HG2 LYS A 80 -5.614 -13.863 -12.055 1.00 21.24 H new ATOM 0 HG3 LYS A 80 -4.280 -12.742 -11.872 1.00 21.24 H new ATOM 0 HD2 LYS A 80 -5.268 -11.141 -13.348 1.00 33.52 H new ATOM 0 HD3 LYS A 80 -6.400 -12.310 -13.998 1.00 33.52 H new ATOM 0 HE2 LYS A 80 -7.497 -10.734 -12.425 1.00 30.34 H new ATOM 0 HE3 LYS A 80 -7.624 -12.395 -11.881 1.00 30.34 H new ATOM 0 HZ1 LYS A 80 -6.594 -11.873 -10.010 1.00 71.14 H new ATOM 0 HZ2 LYS A 80 -5.264 -11.218 -10.838 1.00 71.14 H new ATOM 0 HZ3 LYS A 80 -6.606 -10.241 -10.479 1.00 71.14 H new ATOM 1233 N ASP A 81 -1.105 -12.910 -13.660 1.00 15.43 N ATOM 1234 CA ASP A 81 0.059 -12.428 -12.899 1.00 70.42 C ATOM 1235 C ASP A 81 -0.260 -12.327 -11.410 1.00 63.31 C ATOM 1236 O ASP A 81 0.217 -13.129 -10.605 1.00 51.31 O ATOM 1237 CB ASP A 81 0.546 -11.071 -13.431 1.00 15.35 C ATOM 1238 CG ASP A 81 1.754 -10.542 -12.664 1.00 71.41 C ATOM 1239 OD1 ASP A 81 2.842 -11.147 -12.764 1.00 21.22 O ATOM 1240 OD2 ASP A 81 1.623 -9.514 -11.966 1.00 53.32 O ATOM 0 H ASP A 81 -0.935 -13.786 -14.155 1.00 15.43 H new ATOM 0 HA ASP A 81 0.859 -13.156 -13.031 1.00 70.42 H new ATOM 0 HB2 ASP A 81 0.804 -11.169 -14.486 1.00 15.35 H new ATOM 0 HB3 ASP A 81 -0.266 -10.347 -13.368 1.00 15.35 H new ATOM 1245 N GLU A 82 -1.066 -11.333 -11.067 1.00 51.11 N ATOM 1246 CA GLU A 82 -1.539 -11.123 -9.710 1.00 23.24 C ATOM 1247 C GLU A 82 -2.931 -11.735 -9.550 1.00 62.30 C ATOM 1248 O GLU A 82 -3.914 -11.188 -10.051 1.00 24.41 O ATOM 1249 CB GLU A 82 -1.547 -9.609 -9.415 1.00 2.34 C ATOM 1250 CG GLU A 82 -2.250 -9.186 -8.118 1.00 51.23 C ATOM 1251 CD GLU A 82 -3.701 -8.751 -8.328 1.00 42.24 C ATOM 1252 OE1 GLU A 82 -3.950 -7.889 -9.203 1.00 21.23 O ATOM 1253 OE2 GLU A 82 -4.597 -9.260 -7.621 1.00 14.04 O ATOM 0 H GLU A 82 -1.413 -10.642 -11.732 1.00 51.11 H new ATOM 0 HA GLU A 82 -0.878 -11.612 -8.995 1.00 23.24 H new ATOM 0 HB2 GLU A 82 -0.515 -9.260 -9.378 1.00 2.34 H new ATOM 0 HB3 GLU A 82 -2.027 -9.098 -10.250 1.00 2.34 H new ATOM 0 HG2 GLU A 82 -2.226 -10.017 -7.413 1.00 51.23 H new ATOM 0 HG3 GLU A 82 -1.695 -8.366 -7.663 1.00 51.23 H new ATOM 1260 N PRO A 83 -3.029 -12.918 -8.915 1.00 41.20 N ATOM 1261 CA PRO A 83 -4.311 -13.532 -8.593 1.00 1.43 C ATOM 1262 C PRO A 83 -4.857 -12.995 -7.269 1.00 63.44 C ATOM 1263 O PRO A 83 -4.092 -12.718 -6.341 1.00 23.54 O ATOM 1264 CB PRO A 83 -3.966 -15.021 -8.495 1.00 4.40 C ATOM 1265 CG PRO A 83 -2.547 -15.055 -8.023 1.00 51.24 C ATOM 1266 CD PRO A 83 -1.898 -13.760 -8.469 1.00 42.23 C ATOM 0 HA PRO A 83 -5.088 -13.324 -9.329 1.00 1.43 H new ATOM 0 HB2 PRO A 83 -4.627 -15.535 -7.797 1.00 4.40 H new ATOM 0 HB3 PRO A 83 -4.074 -15.516 -9.460 1.00 4.40 H new ATOM 0 HG2 PRO A 83 -2.504 -15.154 -6.938 1.00 51.24 H new ATOM 0 HG3 PRO A 83 -2.022 -15.913 -8.442 1.00 51.24 H new ATOM 0 HD2 PRO A 83 -1.349 -13.289 -7.654 1.00 42.23 H new ATOM 0 HD3 PRO A 83 -1.186 -13.930 -9.277 1.00 42.23 H new ATOM 1274 N THR A 84 -6.168 -12.848 -7.189 1.00 62.44 N ATOM 1275 CA THR A 84 -6.808 -12.293 -6.006 1.00 64.50 C ATOM 1276 C THR A 84 -8.051 -13.094 -5.638 1.00 62.30 C ATOM 1277 O THR A 84 -8.518 -13.943 -6.408 1.00 22.53 O ATOM 1278 CB THR A 84 -7.196 -10.806 -6.200 1.00 74.30 C ATOM 1279 OG1 THR A 84 -7.738 -10.280 -4.980 1.00 4.04 O ATOM 1280 CG2 THR A 84 -8.217 -10.630 -7.321 1.00 32.20 C ATOM 0 H THR A 84 -6.815 -13.107 -7.934 1.00 62.44 H new ATOM 0 HA THR A 84 -6.080 -12.354 -5.197 1.00 64.50 H new ATOM 0 HB THR A 84 -6.292 -10.263 -6.474 1.00 74.30 H new ATOM 0 HG1 THR A 84 -7.980 -9.339 -5.108 1.00 4.04 H new ATOM 0 HG21 THR A 84 -8.464 -9.573 -7.426 1.00 32.20 H new ATOM 0 HG22 THR A 84 -7.797 -10.999 -8.257 1.00 32.20 H new ATOM 0 HG23 THR A 84 -9.120 -11.191 -7.082 1.00 32.20 H new ATOM 1288 N ALA A 85 -8.597 -12.790 -4.470 1.00 11.33 N ATOM 1289 CA ALA A 85 -9.737 -13.515 -3.927 1.00 53.25 C ATOM 1290 C ALA A 85 -10.890 -13.593 -4.927 1.00 55.44 C ATOM 1291 O ALA A 85 -11.664 -14.540 -4.895 1.00 52.34 O ATOM 1292 CB ALA A 85 -10.198 -12.876 -2.626 1.00 13.24 C ATOM 0 H ALA A 85 -8.263 -12.034 -3.872 1.00 11.33 H new ATOM 0 HA ALA A 85 -9.414 -14.536 -3.725 1.00 53.25 H new ATOM 0 HB1 ALA A 85 -11.051 -13.428 -2.231 1.00 13.24 H new ATOM 0 HB2 ALA A 85 -9.384 -12.899 -1.901 1.00 13.24 H new ATOM 0 HB3 ALA A 85 -10.490 -11.842 -2.812 1.00 13.24 H new ATOM 1298 N GLN A 86 -10.998 -12.600 -5.812 1.00 34.21 N ATOM 1299 CA GLN A 86 -12.073 -12.583 -6.805 1.00 11.51 C ATOM 1300 C GLN A 86 -11.932 -13.746 -7.790 1.00 50.40 C ATOM 1301 O GLN A 86 -12.857 -14.553 -7.951 1.00 71.31 O ATOM 1302 CB GLN A 86 -12.077 -11.253 -7.572 1.00 50.03 C ATOM 1303 CG GLN A 86 -13.154 -11.174 -8.651 1.00 41.24 C ATOM 1304 CD GLN A 86 -13.129 -9.867 -9.422 1.00 21.50 C ATOM 1305 OE1 GLN A 86 -12.746 -8.823 -8.894 1.00 41.43 O ATOM 1306 NE2 GLN A 86 -13.547 -9.910 -10.678 1.00 55.22 N ATOM 0 H GLN A 86 -10.361 -11.805 -5.862 1.00 34.21 H new ATOM 0 HA GLN A 86 -13.018 -12.692 -6.272 1.00 11.51 H new ATOM 0 HB2 GLN A 86 -12.222 -10.436 -6.865 1.00 50.03 H new ATOM 0 HB3 GLN A 86 -11.100 -11.106 -8.033 1.00 50.03 H new ATOM 0 HG2 GLN A 86 -13.024 -12.002 -9.347 1.00 41.24 H new ATOM 0 HG3 GLN A 86 -14.133 -11.297 -8.188 1.00 41.24 H new ATOM 0 HE21 GLN A 86 -13.857 -10.794 -11.082 1.00 55.22 H new ATOM 0 HE22 GLN A 86 -13.559 -9.060 -11.241 1.00 55.22 H new ATOM 1315 N ASP A 87 -10.764 -13.856 -8.422 1.00 24.32 N ATOM 1316 CA ASP A 87 -10.537 -14.912 -9.404 1.00 32.24 C ATOM 1317 C ASP A 87 -10.493 -16.267 -8.715 1.00 42.21 C ATOM 1318 O ASP A 87 -11.117 -17.219 -9.183 1.00 5.42 O ATOM 1319 CB ASP A 87 -9.274 -14.662 -10.257 1.00 62.23 C ATOM 1320 CG ASP A 87 -8.110 -14.079 -9.485 1.00 31.03 C ATOM 1321 OD1 ASP A 87 -8.011 -12.835 -9.410 1.00 21.13 O ATOM 1322 OD2 ASP A 87 -7.287 -14.842 -8.962 1.00 14.52 O ATOM 0 H ASP A 87 -9.969 -13.234 -8.273 1.00 24.32 H new ATOM 0 HA ASP A 87 -11.376 -14.905 -10.100 1.00 32.24 H new ATOM 0 HB2 ASP A 87 -8.961 -15.604 -10.708 1.00 62.23 H new ATOM 0 HB3 ASP A 87 -9.529 -13.987 -11.074 1.00 62.23 H new ATOM 1327 N ILE A 88 -9.787 -16.341 -7.587 1.00 41.24 N ATOM 1328 CA ILE A 88 -9.827 -17.540 -6.744 1.00 12.41 C ATOM 1329 C ILE A 88 -11.276 -17.910 -6.406 1.00 62.53 C ATOM 1330 O ILE A 88 -11.638 -19.083 -6.424 1.00 0.14 O ATOM 1331 CB ILE A 88 -9.013 -17.384 -5.415 1.00 4.11 C ATOM 1332 CG1 ILE A 88 -7.499 -17.549 -5.654 1.00 4.15 C ATOM 1333 CG2 ILE A 88 -9.480 -18.386 -4.356 1.00 3.10 C ATOM 1334 CD1 ILE A 88 -6.837 -16.363 -6.306 1.00 42.04 C ATOM 0 H ILE A 88 -9.186 -15.595 -7.237 1.00 41.24 H new ATOM 0 HA ILE A 88 -9.359 -18.335 -7.325 1.00 12.41 H new ATOM 0 HB ILE A 88 -9.198 -16.374 -5.049 1.00 4.11 H new ATOM 0 HG12 ILE A 88 -7.012 -17.741 -4.698 1.00 4.15 H new ATOM 0 HG13 ILE A 88 -7.336 -18.428 -6.277 1.00 4.15 H new ATOM 0 HG21 ILE A 88 -8.896 -18.252 -3.446 1.00 3.10 H new ATOM 0 HG22 ILE A 88 -10.535 -18.220 -4.138 1.00 3.10 H new ATOM 0 HG23 ILE A 88 -9.342 -19.401 -4.729 1.00 3.10 H new ATOM 0 HD11 ILE A 88 -5.774 -16.566 -6.436 1.00 42.04 H new ATOM 0 HD12 ILE A 88 -7.293 -16.181 -7.279 1.00 42.04 H new ATOM 0 HD13 ILE A 88 -6.964 -15.483 -5.675 1.00 42.04 H new ATOM 1346 N SER A 89 -12.104 -16.903 -6.120 1.00 54.03 N ATOM 1347 CA SER A 89 -13.497 -17.133 -5.727 1.00 31.54 C ATOM 1348 C SER A 89 -14.293 -17.774 -6.864 1.00 63.41 C ATOM 1349 O SER A 89 -14.950 -18.797 -6.666 1.00 50.42 O ATOM 1350 CB SER A 89 -14.160 -15.815 -5.300 1.00 55.52 C ATOM 1351 OG SER A 89 -15.521 -16.000 -4.957 1.00 41.44 O ATOM 0 H SER A 89 -11.834 -15.920 -6.153 1.00 54.03 H new ATOM 0 HA SER A 89 -13.495 -17.820 -4.881 1.00 31.54 H new ATOM 0 HB2 SER A 89 -13.624 -15.397 -4.448 1.00 55.52 H new ATOM 0 HB3 SER A 89 -14.084 -15.090 -6.111 1.00 55.52 H new ATOM 0 HG SER A 89 -15.910 -15.142 -4.689 1.00 41.44 H new ATOM 1357 N ARG A 90 -14.216 -17.187 -8.061 1.00 23.34 N ATOM 1358 CA ARG A 90 -14.955 -17.717 -9.214 1.00 54.03 C ATOM 1359 C ARG A 90 -14.476 -19.128 -9.537 1.00 24.50 C ATOM 1360 O ARG A 90 -15.280 -20.067 -9.652 1.00 24.11 O ATOM 1361 CB ARG A 90 -14.814 -16.797 -10.444 1.00 2.20 C ATOM 1362 CG ARG A 90 -15.742 -15.579 -10.425 1.00 50.34 C ATOM 1363 CD ARG A 90 -15.548 -14.734 -9.175 1.00 62.12 C ATOM 1364 NE ARG A 90 -16.424 -13.564 -9.146 1.00 24.24 N ATOM 1365 CZ ARG A 90 -16.688 -12.857 -8.046 1.00 75.25 C ATOM 1366 NH1 ARG A 90 -16.191 -13.233 -6.873 1.00 2.51 N ATOM 1367 NH2 ARG A 90 -17.463 -11.786 -8.123 1.00 40.20 N ATOM 0 H ARG A 90 -13.658 -16.356 -8.258 1.00 23.34 H new ATOM 0 HA ARG A 90 -16.013 -17.754 -8.953 1.00 54.03 H new ATOM 0 HB2 ARG A 90 -13.782 -16.453 -10.510 1.00 2.20 H new ATOM 0 HB3 ARG A 90 -15.014 -17.379 -11.344 1.00 2.20 H new ATOM 0 HG2 ARG A 90 -15.556 -14.968 -11.308 1.00 50.34 H new ATOM 0 HG3 ARG A 90 -16.778 -15.912 -10.480 1.00 50.34 H new ATOM 0 HD2 ARG A 90 -15.737 -15.347 -8.294 1.00 62.12 H new ATOM 0 HD3 ARG A 90 -14.510 -14.407 -9.119 1.00 62.12 H new ATOM 0 HE ARG A 90 -16.860 -13.270 -10.020 1.00 24.24 H new ATOM 0 HH11 ARG A 90 -15.605 -14.065 -6.811 1.00 2.51 H new ATOM 0 HH12 ARG A 90 -16.396 -12.689 -6.035 1.00 2.51 H new ATOM 0 HH21 ARG A 90 -17.856 -11.504 -9.021 1.00 40.20 H new ATOM 0 HH22 ARG A 90 -17.667 -11.243 -7.284 1.00 40.20 H new ATOM 1381 N VAL A 91 -13.158 -19.277 -9.645 1.00 13.22 N ATOM 1382 CA VAL A 91 -12.550 -20.574 -9.895 1.00 73.33 C ATOM 1383 C VAL A 91 -13.026 -21.579 -8.849 1.00 11.43 C ATOM 1384 O VAL A 91 -13.485 -22.666 -9.193 1.00 41.13 O ATOM 1385 CB VAL A 91 -10.999 -20.482 -9.881 1.00 22.24 C ATOM 1386 CG1 VAL A 91 -10.353 -21.864 -9.973 1.00 73.11 C ATOM 1387 CG2 VAL A 91 -10.509 -19.592 -11.023 1.00 44.15 C ATOM 0 H VAL A 91 -12.491 -18.510 -9.562 1.00 13.22 H new ATOM 0 HA VAL A 91 -12.857 -20.909 -10.886 1.00 73.33 H new ATOM 0 HB VAL A 91 -10.702 -20.038 -8.931 1.00 22.24 H new ATOM 0 HG11 VAL A 91 -9.268 -21.760 -9.961 1.00 73.11 H new ATOM 0 HG12 VAL A 91 -10.669 -22.471 -9.124 1.00 73.11 H new ATOM 0 HG13 VAL A 91 -10.660 -22.348 -10.900 1.00 73.11 H new ATOM 0 HG21 VAL A 91 -9.421 -19.537 -11.000 1.00 44.15 H new ATOM 0 HG22 VAL A 91 -10.831 -20.012 -11.976 1.00 44.15 H new ATOM 0 HG23 VAL A 91 -10.925 -18.591 -10.909 1.00 44.15 H new ATOM 1397 N ALA A 92 -12.963 -21.175 -7.582 1.00 14.51 N ATOM 1398 CA ALA A 92 -13.375 -22.027 -6.466 1.00 51.41 C ATOM 1399 C ALA A 92 -14.853 -22.395 -6.570 1.00 45.24 C ATOM 1400 O ALA A 92 -15.246 -23.524 -6.262 1.00 41.04 O ATOM 1401 CB ALA A 92 -13.079 -21.351 -5.135 1.00 45.23 C ATOM 0 H ALA A 92 -12.627 -20.254 -7.300 1.00 14.51 H new ATOM 0 HA ALA A 92 -12.797 -22.950 -6.517 1.00 51.41 H new ATOM 0 HB1 ALA A 92 -13.393 -22.002 -4.319 1.00 45.23 H new ATOM 0 HB2 ALA A 92 -12.009 -21.159 -5.055 1.00 45.23 H new ATOM 0 HB3 ALA A 92 -13.623 -20.408 -5.077 1.00 45.23 H new ATOM 1407 N SER A 93 -15.668 -21.442 -7.015 1.00 15.05 N ATOM 1408 CA SER A 93 -17.090 -21.677 -7.195 1.00 62.23 C ATOM 1409 C SER A 93 -17.311 -22.754 -8.251 1.00 73.41 C ATOM 1410 O SER A 93 -18.191 -23.601 -8.110 1.00 13.21 O ATOM 1411 CB SER A 93 -17.794 -20.383 -7.604 1.00 70.15 C ATOM 1412 OG SER A 93 -17.612 -19.362 -6.631 1.00 11.51 O ATOM 0 H SER A 93 -15.363 -20.499 -7.257 1.00 15.05 H new ATOM 0 HA SER A 93 -17.512 -22.018 -6.250 1.00 62.23 H new ATOM 0 HB2 SER A 93 -17.407 -20.045 -8.565 1.00 70.15 H new ATOM 0 HB3 SER A 93 -18.859 -20.573 -7.739 1.00 70.15 H new ATOM 0 HG SER A 93 -16.665 -19.112 -6.592 1.00 11.51 H new ATOM 1418 N ARG A 94 -16.500 -22.725 -9.309 1.00 41.15 N ATOM 1419 CA ARG A 94 -16.583 -23.746 -10.359 1.00 3.43 C ATOM 1420 C ARG A 94 -16.138 -25.095 -9.813 1.00 32.51 C ATOM 1421 O ARG A 94 -16.749 -26.122 -10.098 1.00 40.31 O ATOM 1422 CB ARG A 94 -15.707 -23.389 -11.557 1.00 52.53 C ATOM 1423 CG ARG A 94 -15.812 -21.942 -12.001 1.00 61.23 C ATOM 1424 CD ARG A 94 -17.257 -21.525 -12.290 1.00 13.22 C ATOM 1425 NE ARG A 94 -17.332 -20.247 -13.007 1.00 3.54 N ATOM 1426 CZ ARG A 94 -18.009 -19.174 -12.587 1.00 23.02 C ATOM 1427 NH1 ARG A 94 -18.704 -19.205 -11.457 1.00 3.12 N ATOM 1428 NH2 ARG A 94 -18.015 -18.073 -13.326 1.00 21.02 N ATOM 0 H ARG A 94 -15.785 -22.014 -9.463 1.00 41.15 H new ATOM 0 HA ARG A 94 -17.622 -23.795 -10.685 1.00 3.43 H new ATOM 0 HB2 ARG A 94 -14.668 -23.606 -11.309 1.00 52.53 H new ATOM 0 HB3 ARG A 94 -15.976 -24.034 -12.394 1.00 52.53 H new ATOM 0 HG2 ARG A 94 -15.398 -21.296 -11.227 1.00 61.23 H new ATOM 0 HG3 ARG A 94 -15.208 -21.794 -12.896 1.00 61.23 H new ATOM 0 HD2 ARG A 94 -17.746 -22.300 -12.880 1.00 13.22 H new ATOM 0 HD3 ARG A 94 -17.805 -21.446 -11.351 1.00 13.22 H new ATOM 0 HE ARG A 94 -16.830 -20.172 -13.892 1.00 3.54 H new ATOM 0 HH11 ARG A 94 -18.727 -20.056 -10.895 1.00 3.12 H new ATOM 0 HH12 ARG A 94 -19.215 -18.378 -11.150 1.00 3.12 H new ATOM 0 HH21 ARG A 94 -17.505 -18.049 -14.209 1.00 21.02 H new ATOM 0 HH22 ARG A 94 -18.530 -17.250 -13.011 1.00 21.02 H new ATOM 1442 N LEU A 95 -15.046 -25.082 -9.047 1.00 55.01 N ATOM 1443 CA LEU A 95 -14.563 -26.298 -8.376 1.00 15.52 C ATOM 1444 C LEU A 95 -15.713 -26.951 -7.601 1.00 70.41 C ATOM 1445 O LEU A 95 -15.938 -28.156 -7.683 1.00 61.13 O ATOM 1446 CB LEU A 95 -13.422 -26.006 -7.375 1.00 62.31 C ATOM 1447 CG LEU A 95 -12.311 -25.036 -7.816 1.00 10.41 C ATOM 1448 CD1 LEU A 95 -11.241 -24.930 -6.733 1.00 12.14 C ATOM 1449 CD2 LEU A 95 -11.689 -25.435 -9.144 1.00 73.21 C ATOM 0 H LEU A 95 -14.480 -24.251 -8.874 1.00 55.01 H new ATOM 0 HA LEU A 95 -14.182 -26.958 -9.156 1.00 15.52 H new ATOM 0 HB2 LEU A 95 -13.869 -25.610 -6.463 1.00 62.31 H new ATOM 0 HB3 LEU A 95 -12.954 -26.955 -7.115 1.00 62.31 H new ATOM 0 HG LEU A 95 -12.772 -24.059 -7.961 1.00 10.41 H new ATOM 0 HD11 LEU A 95 -10.461 -24.241 -7.058 1.00 12.14 H new ATOM 0 HD12 LEU A 95 -11.691 -24.560 -5.812 1.00 12.14 H new ATOM 0 HD13 LEU A 95 -10.805 -25.913 -6.555 1.00 12.14 H new ATOM 0 HD21 LEU A 95 -10.911 -24.720 -9.411 1.00 73.21 H new ATOM 0 HD22 LEU A 95 -11.252 -26.430 -9.057 1.00 73.21 H new ATOM 0 HD23 LEU A 95 -12.457 -25.442 -9.918 1.00 73.21 H new ATOM 1461 N ALA A 96 -16.441 -26.130 -6.856 1.00 40.45 N ATOM 1462 CA ALA A 96 -17.541 -26.605 -6.019 1.00 52.43 C ATOM 1463 C ALA A 96 -18.755 -27.037 -6.848 1.00 51.03 C ATOM 1464 O ALA A 96 -19.202 -28.185 -6.775 1.00 52.32 O ATOM 1465 CB ALA A 96 -17.937 -25.509 -5.033 1.00 5.15 C ATOM 0 H ALA A 96 -16.289 -25.122 -6.813 1.00 40.45 H new ATOM 0 HA ALA A 96 -17.195 -27.486 -5.478 1.00 52.43 H new ATOM 0 HB1 ALA A 96 -18.757 -25.861 -4.408 1.00 5.15 H new ATOM 0 HB2 ALA A 96 -17.083 -25.259 -4.404 1.00 5.15 H new ATOM 0 HB3 ALA A 96 -18.254 -24.623 -5.582 1.00 5.15 H new ATOM 1471 N ALA A 97 -19.271 -26.112 -7.646 1.00 43.02 N ATOM 1472 CA ALA A 97 -20.532 -26.298 -8.366 1.00 4.04 C ATOM 1473 C ALA A 97 -20.369 -27.146 -9.628 1.00 60.22 C ATOM 1474 O ALA A 97 -21.355 -27.650 -10.170 1.00 2.12 O ATOM 1475 CB ALA A 97 -21.130 -24.938 -8.718 1.00 52.53 C ATOM 0 H ALA A 97 -18.829 -25.208 -7.815 1.00 43.02 H new ATOM 0 HA ALA A 97 -21.207 -26.841 -7.705 1.00 4.04 H new ATOM 0 HB1 ALA A 97 -22.068 -25.081 -9.254 1.00 52.53 H new ATOM 0 HB2 ALA A 97 -21.316 -24.375 -7.804 1.00 52.53 H new ATOM 0 HB3 ALA A 97 -20.433 -24.386 -9.348 1.00 52.53 H new ATOM 1481 N GLY A 98 -19.129 -27.308 -10.085 1.00 10.24 N ATOM 1482 CA GLY A 98 -18.877 -27.935 -11.378 1.00 71.13 C ATOM 1483 C GLY A 98 -19.260 -29.405 -11.437 1.00 75.14 C ATOM 1484 O GLY A 98 -19.305 -29.989 -12.523 1.00 24.30 O ATOM 0 H GLY A 98 -18.290 -27.016 -9.583 1.00 10.24 H new ATOM 0 HA2 GLY A 98 -19.430 -27.395 -12.146 1.00 71.13 H new ATOM 0 HA3 GLY A 98 -17.818 -27.836 -11.618 1.00 71.13 H new ATOM 1488 N GLY A 99 -19.541 -30.003 -10.282 1.00 44.44 N ATOM 1489 CA GLY A 99 -19.941 -31.399 -10.241 1.00 11.31 C ATOM 1490 C GLY A 99 -18.868 -32.320 -10.793 1.00 2.41 C ATOM 1491 O GLY A 99 -19.103 -33.071 -11.742 1.00 24.34 O ATOM 0 H GLY A 99 -19.499 -29.544 -9.372 1.00 44.44 H new ATOM 0 HA2 GLY A 99 -20.165 -31.681 -9.212 1.00 11.31 H new ATOM 0 HA3 GLY A 99 -20.859 -31.529 -10.814 1.00 11.31 H new ATOM 1495 N TRP A 100 -17.685 -32.251 -10.196 1.00 33.12 N ATOM 1496 CA TRP A 100 -16.541 -33.056 -10.627 1.00 54.53 C ATOM 1497 C TRP A 100 -16.773 -34.547 -10.279 1.00 63.43 C ATOM 1498 O TRP A 100 -17.836 -34.867 -9.741 1.00 14.14 O ATOM 1499 CB TRP A 100 -15.271 -32.448 -10.029 1.00 53.11 C ATOM 1500 CG TRP A 100 -15.033 -31.059 -10.539 1.00 53.11 C ATOM 1501 CD1 TRP A 100 -15.203 -29.893 -9.858 1.00 62.25 C ATOM 1502 CD2 TRP A 100 -14.617 -30.696 -11.859 1.00 74.21 C ATOM 1503 NE1 TRP A 100 -14.908 -28.826 -10.671 1.00 50.24 N ATOM 1504 CE2 TRP A 100 -14.544 -29.292 -11.903 1.00 71.24 C ATOM 1505 CE3 TRP A 100 -14.290 -31.423 -13.009 1.00 61.55 C ATOM 1506 CZ2 TRP A 100 -14.159 -28.602 -13.048 1.00 14.04 C ATOM 1507 CZ3 TRP A 100 -13.912 -30.735 -14.147 1.00 44.10 C ATOM 1508 CH2 TRP A 100 -13.848 -29.337 -14.158 1.00 25.43 C ATOM 0 H TRP A 100 -17.488 -31.640 -9.403 1.00 33.12 H new ATOM 0 HA TRP A 100 -16.421 -33.038 -11.710 1.00 54.53 H new ATOM 0 HB2 TRP A 100 -15.353 -32.428 -8.942 1.00 53.11 H new ATOM 0 HB3 TRP A 100 -14.415 -33.078 -10.273 1.00 53.11 H new ATOM 0 HD1 TRP A 100 -15.523 -29.818 -8.829 1.00 62.25 H new ATOM 0 HE1 TRP A 100 -14.953 -27.844 -10.399 1.00 50.24 H new ATOM 0 HE3 TRP A 100 -14.332 -32.502 -13.008 1.00 61.55 H new ATOM 0 HZ2 TRP A 100 -14.108 -27.523 -13.060 1.00 14.04 H new ATOM 0 HZ3 TRP A 100 -13.662 -31.285 -15.042 1.00 44.10 H new ATOM 0 HH2 TRP A 100 -13.547 -28.828 -15.062 1.00 25.43 H new ATOM 1519 N PRO A 101 -15.782 -35.476 -10.485 1.00 54.45 N ATOM 1520 CA PRO A 101 -16.024 -36.887 -10.779 1.00 61.44 C ATOM 1521 C PRO A 101 -17.500 -37.272 -10.929 1.00 74.42 C ATOM 1522 O PRO A 101 -17.999 -38.194 -10.279 1.00 34.13 O ATOM 1523 CB PRO A 101 -15.331 -37.512 -9.572 1.00 45.13 C ATOM 1524 CG PRO A 101 -14.105 -36.636 -9.386 1.00 52.13 C ATOM 1525 CD PRO A 101 -14.352 -35.357 -10.189 1.00 25.12 C ATOM 0 HA PRO A 101 -15.652 -37.217 -11.749 1.00 61.44 H new ATOM 0 HB2 PRO A 101 -15.971 -37.502 -8.690 1.00 45.13 H new ATOM 0 HB3 PRO A 101 -15.059 -38.551 -9.757 1.00 45.13 H new ATOM 0 HG2 PRO A 101 -13.949 -36.407 -8.332 1.00 52.13 H new ATOM 0 HG3 PRO A 101 -13.208 -37.146 -9.737 1.00 52.13 H new ATOM 0 HD2 PRO A 101 -14.125 -34.460 -9.613 1.00 25.12 H new ATOM 0 HD3 PRO A 101 -13.747 -35.317 -11.095 1.00 25.12 H new ATOM 1533 N LEU A 102 -18.184 -36.525 -11.795 1.00 10.31 N ATOM 1534 CA LEU A 102 -19.540 -36.829 -12.226 1.00 74.21 C ATOM 1535 C LEU A 102 -19.634 -36.596 -13.732 1.00 33.31 C ATOM 1536 O LEU A 102 -19.778 -35.458 -14.185 1.00 3.42 O ATOM 1537 CB LEU A 102 -20.562 -35.962 -11.472 1.00 54.21 C ATOM 1538 CG LEU A 102 -22.031 -36.153 -11.893 1.00 73.13 C ATOM 1539 CD1 LEU A 102 -22.458 -37.609 -11.730 1.00 1.32 C ATOM 1540 CD2 LEU A 102 -22.945 -35.228 -11.091 1.00 12.44 C ATOM 0 H LEU A 102 -17.802 -35.680 -12.221 1.00 10.31 H new ATOM 0 HA LEU A 102 -19.772 -37.870 -12.001 1.00 74.21 H new ATOM 0 HB2 LEU A 102 -20.477 -36.175 -10.406 1.00 54.21 H new ATOM 0 HB3 LEU A 102 -20.296 -34.914 -11.610 1.00 54.21 H new ATOM 0 HG LEU A 102 -22.119 -35.891 -12.947 1.00 73.13 H new ATOM 0 HD11 LEU A 102 -23.499 -37.719 -12.034 1.00 1.32 H new ATOM 0 HD12 LEU A 102 -21.829 -38.245 -12.353 1.00 1.32 H new ATOM 0 HD13 LEU A 102 -22.351 -37.905 -10.686 1.00 1.32 H new ATOM 0 HD21 LEU A 102 -23.979 -35.378 -11.403 1.00 12.44 H new ATOM 0 HD22 LEU A 102 -22.850 -35.454 -10.029 1.00 12.44 H new ATOM 0 HD23 LEU A 102 -22.659 -34.191 -11.268 1.00 12.44 H new ATOM 1552 N ALA A 103 -19.509 -37.664 -14.507 1.00 35.13 N ATOM 1553 CA ALA A 103 -19.499 -37.562 -15.962 1.00 1.22 C ATOM 1554 C ALA A 103 -20.897 -37.255 -16.496 1.00 44.52 C ATOM 1555 O ALA A 103 -21.653 -38.163 -16.855 1.00 71.31 O ATOM 1556 CB ALA A 103 -18.945 -38.843 -16.581 1.00 34.24 C ATOM 0 H ALA A 103 -19.413 -38.615 -14.152 1.00 35.13 H new ATOM 0 HA ALA A 103 -18.847 -36.736 -16.245 1.00 1.22 H new ATOM 0 HB1 ALA A 103 -18.944 -38.751 -17.667 1.00 34.24 H new ATOM 0 HB2 ALA A 103 -17.926 -39.006 -16.230 1.00 34.24 H new ATOM 0 HB3 ALA A 103 -19.569 -39.688 -16.289 1.00 34.24 H new ATOM 1562 N GLY A 104 -21.246 -35.971 -16.510 1.00 1.03 N ATOM 1563 CA GLY A 104 -22.540 -35.547 -17.014 1.00 34.40 C ATOM 1564 C GLY A 104 -22.599 -34.061 -17.262 1.00 2.44 C ATOM 1565 O GLY A 104 -23.512 -33.380 -16.792 1.00 60.53 O ATOM 0 H GLY A 104 -20.650 -35.212 -16.179 1.00 1.03 H new ATOM 0 HA2 GLY A 104 -22.757 -36.077 -17.941 1.00 34.40 H new ATOM 0 HA3 GLY A 104 -23.315 -35.825 -16.299 1.00 34.40 H new ATOM 1569 N VAL A 105 -21.630 -33.555 -18.010 1.00 75.25 N ATOM 1570 CA VAL A 105 -21.579 -32.139 -18.340 1.00 23.35 C ATOM 1571 C VAL A 105 -20.639 -31.901 -19.523 1.00 14.03 C ATOM 1572 O VAL A 105 -19.621 -32.584 -19.662 1.00 43.04 O ATOM 1573 CB VAL A 105 -21.134 -31.292 -17.119 1.00 43.11 C ATOM 1574 CG1 VAL A 105 -19.683 -31.573 -16.735 1.00 54.52 C ATOM 1575 CG2 VAL A 105 -21.358 -29.812 -17.389 1.00 71.45 C ATOM 0 H VAL A 105 -20.866 -34.106 -18.401 1.00 75.25 H new ATOM 0 HA VAL A 105 -22.584 -31.824 -18.619 1.00 23.35 H new ATOM 0 HB VAL A 105 -21.750 -31.582 -16.268 1.00 43.11 H new ATOM 0 HG11 VAL A 105 -19.409 -30.961 -15.876 1.00 54.52 H new ATOM 0 HG12 VAL A 105 -19.572 -32.627 -16.480 1.00 54.52 H new ATOM 0 HG13 VAL A 105 -19.031 -31.332 -17.575 1.00 54.52 H new ATOM 0 HG21 VAL A 105 -21.041 -29.232 -16.522 1.00 71.45 H new ATOM 0 HG22 VAL A 105 -20.778 -29.509 -18.261 1.00 71.45 H new ATOM 0 HG23 VAL A 105 -22.416 -29.633 -17.578 1.00 71.45 H new ATOM 1585 N ASP A 106 -20.993 -30.946 -20.380 1.00 34.34 N ATOM 1586 CA ASP A 106 -20.197 -30.642 -21.569 1.00 34.40 C ATOM 1587 C ASP A 106 -19.477 -29.308 -21.397 1.00 44.13 C ATOM 1588 O ASP A 106 -19.898 -28.464 -20.605 1.00 12.44 O ATOM 1589 CB ASP A 106 -21.081 -30.607 -22.825 1.00 3.44 C ATOM 1590 CG ASP A 106 -21.964 -29.375 -22.904 1.00 44.43 C ATOM 1591 OD1 ASP A 106 -23.026 -29.349 -22.247 1.00 25.55 O ATOM 1592 OD2 ASP A 106 -21.609 -28.434 -23.640 1.00 61.24 O ATOM 0 H ASP A 106 -21.827 -30.368 -20.274 1.00 34.34 H new ATOM 0 HA ASP A 106 -19.455 -31.431 -21.693 1.00 34.40 H new ATOM 0 HB2 ASP A 106 -20.445 -30.647 -23.709 1.00 3.44 H new ATOM 0 HB3 ASP A 106 -21.709 -31.498 -22.844 1.00 3.44 H new ATOM 1597 N SER A 107 -18.400 -29.123 -22.152 1.00 25.45 N ATOM 1598 CA SER A 107 -17.554 -27.936 -22.030 1.00 20.22 C ATOM 1599 C SER A 107 -17.695 -27.021 -23.256 1.00 62.13 C ATOM 1600 O SER A 107 -16.947 -26.052 -23.403 1.00 71.25 O ATOM 1601 CB SER A 107 -16.091 -28.376 -21.845 1.00 31.03 C ATOM 1602 OG SER A 107 -15.227 -27.279 -21.586 1.00 63.21 O ATOM 0 H SER A 107 -18.088 -29.785 -22.862 1.00 25.45 H new ATOM 0 HA SER A 107 -17.875 -27.363 -21.160 1.00 20.22 H new ATOM 0 HB2 SER A 107 -16.029 -29.087 -21.021 1.00 31.03 H new ATOM 0 HB3 SER A 107 -15.754 -28.897 -22.741 1.00 31.03 H new ATOM 0 HG SER A 107 -15.588 -26.472 -22.008 1.00 63.21 H new ATOM 1608 N THR A 108 -18.653 -27.324 -24.131 1.00 52.43 N ATOM 1609 CA THR A 108 -18.833 -26.549 -25.360 1.00 65.30 C ATOM 1610 C THR A 108 -19.983 -25.546 -25.219 1.00 75.14 C ATOM 1611 O THR A 108 -20.003 -24.511 -25.889 1.00 15.14 O ATOM 1612 CB THR A 108 -19.059 -27.472 -26.589 1.00 33.03 C ATOM 1613 OG1 THR A 108 -19.184 -26.692 -27.786 1.00 25.35 O ATOM 1614 CG2 THR A 108 -20.296 -28.346 -26.421 1.00 32.14 C ATOM 0 H THR A 108 -19.312 -28.094 -24.014 1.00 52.43 H new ATOM 0 HA THR A 108 -17.912 -25.990 -25.527 1.00 65.30 H new ATOM 0 HB THR A 108 -18.189 -28.124 -26.666 1.00 33.03 H new ATOM 0 HG1 THR A 108 -19.324 -27.288 -28.551 1.00 25.35 H new ATOM 0 HG21 THR A 108 -20.419 -28.976 -27.302 1.00 32.14 H new ATOM 0 HG22 THR A 108 -20.180 -28.975 -25.538 1.00 32.14 H new ATOM 0 HG23 THR A 108 -21.175 -27.713 -26.303 1.00 32.14 H new ATOM 1622 N ALA A 109 -20.918 -25.833 -24.316 1.00 54.00 N ATOM 1623 CA ALA A 109 -22.067 -24.956 -24.079 1.00 24.21 C ATOM 1624 C ALA A 109 -21.707 -23.798 -23.164 1.00 11.04 C ATOM 1625 O ALA A 109 -22.546 -22.956 -22.844 1.00 23.33 O ATOM 1626 CB ALA A 109 -23.228 -25.751 -23.494 1.00 14.02 C ATOM 0 H ALA A 109 -20.904 -26.670 -23.733 1.00 54.00 H new ATOM 0 HA ALA A 109 -22.369 -24.539 -25.039 1.00 24.21 H new ATOM 0 HB1 ALA A 109 -24.075 -25.086 -23.323 1.00 14.02 H new ATOM 0 HB2 ALA A 109 -23.519 -26.537 -24.191 1.00 14.02 H new ATOM 0 HB3 ALA A 109 -22.922 -26.199 -22.549 1.00 14.02 H new ATOM 1632 N LEU A 110 -20.453 -23.754 -22.764 1.00 1.22 N ATOM 1633 CA LEU A 110 -19.976 -22.771 -21.815 1.00 62.21 C ATOM 1634 C LEU A 110 -18.727 -22.121 -22.378 1.00 32.34 C ATOM 1635 O LEU A 110 -17.611 -22.573 -22.134 1.00 74.23 O ATOM 1636 CB LEU A 110 -19.692 -23.429 -20.457 1.00 35.40 C ATOM 1637 CG LEU A 110 -20.927 -23.888 -19.645 1.00 12.11 C ATOM 1638 CD1 LEU A 110 -21.493 -25.205 -20.176 1.00 12.33 C ATOM 1639 CD2 LEU A 110 -20.582 -24.017 -18.162 1.00 71.20 C ATOM 0 H LEU A 110 -19.734 -24.401 -23.089 1.00 1.22 H new ATOM 0 HA LEU A 110 -20.738 -22.009 -21.655 1.00 62.21 H new ATOM 0 HB2 LEU A 110 -19.051 -24.295 -20.624 1.00 35.40 H new ATOM 0 HB3 LEU A 110 -19.125 -22.725 -19.848 1.00 35.40 H new ATOM 0 HG LEU A 110 -21.696 -23.124 -19.761 1.00 12.11 H new ATOM 0 HD11 LEU A 110 -22.359 -25.495 -19.581 1.00 12.33 H new ATOM 0 HD12 LEU A 110 -21.793 -25.079 -21.216 1.00 12.33 H new ATOM 0 HD13 LEU A 110 -20.731 -25.981 -20.110 1.00 12.33 H new ATOM 0 HD21 LEU A 110 -21.464 -24.341 -17.610 1.00 71.20 H new ATOM 0 HD22 LEU A 110 -19.786 -24.751 -18.036 1.00 71.20 H new ATOM 0 HD23 LEU A 110 -20.249 -23.052 -17.781 1.00 71.20 H new ATOM 1651 N ASN A 111 -18.935 -21.091 -23.184 1.00 2.03 N ATOM 1652 CA ASN A 111 -17.838 -20.389 -23.826 1.00 51.20 C ATOM 1653 C ASN A 111 -18.146 -18.894 -23.893 1.00 3.43 C ATOM 1654 O ASN A 111 -18.969 -18.440 -24.690 1.00 20.31 O ATOM 1655 CB ASN A 111 -17.543 -20.991 -25.218 1.00 51.14 C ATOM 1656 CG ASN A 111 -18.657 -20.796 -26.242 1.00 45.04 C ATOM 1657 OD1 ASN A 111 -18.660 -19.823 -26.996 1.00 64.14 O ATOM 1658 ND2 ASN A 111 -19.596 -21.732 -26.297 1.00 71.21 N ATOM 0 H ASN A 111 -19.859 -20.722 -23.409 1.00 2.03 H new ATOM 0 HA ASN A 111 -16.933 -20.514 -23.232 1.00 51.20 H new ATOM 0 HB2 ASN A 111 -16.628 -20.544 -25.606 1.00 51.14 H new ATOM 0 HB3 ASN A 111 -17.354 -22.058 -25.105 1.00 51.14 H new ATOM 0 HD21 ASN A 111 -20.351 -21.658 -26.979 1.00 71.21 H new ATOM 0 HD22 ASN A 111 -19.563 -22.526 -25.657 1.00 71.21 H new ATOM 1665 N ALA A 112 -17.520 -18.151 -22.990 1.00 65.35 N ATOM 1666 CA ALA A 112 -17.683 -16.706 -22.905 1.00 3.51 C ATOM 1667 C ALA A 112 -16.354 -16.053 -22.533 1.00 55.23 C ATOM 1668 O ALA A 112 -15.925 -15.115 -23.237 1.00 20.44 O ATOM 1669 CB ALA A 112 -18.765 -16.353 -21.888 1.00 24.13 C ATOM 1670 OXT ALA A 112 -15.726 -16.503 -21.549 1.00 0.00 O ATOM 0 H ALA A 112 -16.882 -18.535 -22.293 1.00 65.35 H new ATOM 0 HA ALA A 112 -17.995 -16.326 -23.878 1.00 3.51 H new ATOM 0 HB1 ALA A 112 -18.875 -15.270 -21.835 1.00 24.13 H new ATOM 0 HB2 ALA A 112 -19.711 -16.800 -22.193 1.00 24.13 H new ATOM 0 HB3 ALA A 112 -18.482 -16.737 -20.908 1.00 24.13 H new TER 1676 ALA A 112