USER MOD reduce.3.24.130724 H: found=0, std=0, add=809, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 806 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 62 SER OG : rot -109:sc= 0.734 USER MOD Set 1.2: A 69 THR OG1 : rot 180:sc= -0.211 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 ASN : amide:sc= -0.0228 K(o=-0.023,f=-0.87) USER MOD Single : A 7 SER OG : rot 180:sc= 0.0347 USER MOD Single : A 8 SER OG : rot -84:sc= 0.185 USER MOD Single : A 14 SER OG : rot 44:sc= 0.00556 USER MOD Single : A 21 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 THR OG1 : rot 180:sc= -0.0285 USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 THR OG1 : rot -157:sc= 0.633 USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 ASN : amide:sc= -0.248 X(o=-0.25,f=-0.21) USER MOD Single : A 52 SER OG : rot 7:sc= 1.05 USER MOD Single : A 53 SER OG : rot 180:sc= 0 USER MOD Single : A 55 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 56 GLN : amide:sc= 0 K(o=0,f=-1.8) USER MOD Single : A 58 LYS NZ :NH3+ -166:sc= 0.0389 (180deg=0.0144) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 68 GLN : amide:sc= -0.337 X(o=-0.34,f=0) USER MOD Single : A 71 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 79 LYS NZ :NH3+ -144:sc= 0.077 (180deg=0) USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 GLN : amide:sc= 0 X(o=0,f=-0.36) USER MOD Single : A 86 THR OG1 : rot -170:sc= -2.33 USER MOD Single : A 89 GLN : amide:sc=-0.00212 X(o=-0.0021,f=0) USER MOD Single : A 90 HIS : no HD1:sc= -0.828 X(o=-0.83,f=-1) USER MOD Single : A 93 HIS : no HD1:sc= -0.605 K(o=-0.61,f=0) USER MOD Single : A 97 THR OG1 : rot 180:sc= 0 USER MOD Single : A 99 HIS : no HD1:sc= -1.89 K(o=-1.9,f=-0.61) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -2.971 -47.432 -10.555 1.00 0.00 N ATOM 2 CA MET A 1 -1.668 -48.039 -10.954 1.00 0.00 C ATOM 3 C MET A 1 -0.669 -46.942 -11.332 1.00 0.00 C ATOM 4 O MET A 1 -0.396 -46.713 -12.494 1.00 0.00 O ATOM 5 CB MET A 1 -1.991 -48.914 -12.166 1.00 0.00 C ATOM 6 CG MET A 1 -2.159 -50.367 -11.719 1.00 0.00 C ATOM 7 SD MET A 1 -3.137 -51.267 -12.946 1.00 0.00 S ATOM 8 CE MET A 1 -4.317 -52.011 -11.794 1.00 0.00 C ATOM 0 H1 MET A 1 -3.641 -48.185 -10.301 1.00 0.00 H new ATOM 0 H2 MET A 1 -2.826 -46.806 -9.737 1.00 0.00 H new ATOM 0 H3 MET A 1 -3.355 -46.881 -11.349 1.00 0.00 H new ATOM 0 HA MET A 1 -1.216 -48.615 -10.147 1.00 0.00 H new ATOM 0 HB2 MET A 1 -2.904 -48.563 -12.648 1.00 0.00 H new ATOM 0 HB3 MET A 1 -1.192 -48.840 -12.904 1.00 0.00 H new ATOM 0 HG2 MET A 1 -1.183 -50.837 -11.601 1.00 0.00 H new ATOM 0 HG3 MET A 1 -2.651 -50.405 -10.747 1.00 0.00 H new ATOM 0 HE1 MET A 1 -5.030 -52.623 -12.347 1.00 0.00 H new ATOM 0 HE2 MET A 1 -3.782 -52.635 -11.078 1.00 0.00 H new ATOM 0 HE3 MET A 1 -4.851 -51.224 -11.261 1.00 0.00 H new ATOM 20 N ALA A 2 -0.120 -46.266 -10.359 1.00 0.00 N ATOM 21 CA ALA A 2 0.862 -45.184 -10.659 1.00 0.00 C ATOM 22 C ALA A 2 2.291 -45.705 -10.479 1.00 0.00 C ATOM 23 O ALA A 2 3.197 -44.961 -10.157 1.00 0.00 O ATOM 24 CB ALA A 2 0.561 -44.081 -9.645 1.00 0.00 C ATOM 0 H ALA A 2 -0.309 -46.416 -9.368 1.00 0.00 H new ATOM 0 HA ALA A 2 0.781 -44.825 -11.685 1.00 0.00 H new ATOM 0 HB1 ALA A 2 1.245 -43.247 -9.801 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -0.466 -43.738 -9.774 1.00 0.00 H new ATOM 0 HB3 ALA A 2 0.689 -44.470 -8.635 1.00 0.00 H new ATOM 30 N GLU A 3 2.497 -46.978 -10.684 1.00 0.00 N ATOM 31 CA GLU A 3 3.866 -47.552 -10.525 1.00 0.00 C ATOM 32 C GLU A 3 4.366 -48.102 -11.864 1.00 0.00 C ATOM 33 O GLU A 3 5.543 -48.048 -12.165 1.00 0.00 O ATOM 34 CB GLU A 3 3.706 -48.680 -9.507 1.00 0.00 C ATOM 35 CG GLU A 3 5.085 -49.114 -9.004 1.00 0.00 C ATOM 36 CD GLU A 3 5.460 -48.289 -7.771 1.00 0.00 C ATOM 37 OE1 GLU A 3 5.051 -48.665 -6.685 1.00 0.00 O ATOM 38 OE2 GLU A 3 6.149 -47.296 -7.933 1.00 0.00 O ATOM 0 H GLU A 3 1.776 -47.647 -10.955 1.00 0.00 H new ATOM 0 HA GLU A 3 4.592 -46.808 -10.197 1.00 0.00 H new ATOM 0 HB2 GLU A 3 3.091 -48.345 -8.671 1.00 0.00 H new ATOM 0 HB3 GLU A 3 3.191 -49.525 -9.963 1.00 0.00 H new ATOM 0 HG2 GLU A 3 5.076 -50.175 -8.756 1.00 0.00 H new ATOM 0 HG3 GLU A 3 5.830 -48.976 -9.788 1.00 0.00 H new ATOM 45 N ASN A 4 3.482 -48.630 -12.667 1.00 0.00 N ATOM 46 CA ASN A 4 3.904 -49.184 -13.986 1.00 0.00 C ATOM 47 C ASN A 4 3.309 -48.349 -15.125 1.00 0.00 C ATOM 48 O ASN A 4 2.155 -48.495 -15.475 1.00 0.00 O ATOM 49 CB ASN A 4 3.344 -50.607 -14.016 1.00 0.00 C ATOM 50 CG ASN A 4 4.248 -51.527 -13.193 1.00 0.00 C ATOM 51 OD1 ASN A 4 5.456 -51.427 -13.256 1.00 0.00 O ATOM 52 ND2 ASN A 4 3.708 -52.428 -12.418 1.00 0.00 N ATOM 0 H ASN A 4 2.485 -48.702 -12.466 1.00 0.00 H new ATOM 0 HA ASN A 4 4.987 -49.169 -14.113 1.00 0.00 H new ATOM 0 HB2 ASN A 4 2.331 -50.619 -13.614 1.00 0.00 H new ATOM 0 HB3 ASN A 4 3.283 -50.964 -15.044 1.00 0.00 H new ATOM 0 HD21 ASN A 4 4.301 -53.047 -11.866 1.00 0.00 H new ATOM 0 HD22 ASN A 4 2.693 -52.513 -12.365 1.00 0.00 H new ATOM 59 N GLY A 5 4.091 -47.477 -15.703 1.00 0.00 N ATOM 60 CA GLY A 5 3.575 -46.632 -16.819 1.00 0.00 C ATOM 61 C GLY A 5 3.283 -47.514 -18.035 1.00 0.00 C ATOM 62 O GLY A 5 3.726 -48.642 -18.116 1.00 0.00 O ATOM 0 H GLY A 5 5.066 -47.313 -15.450 1.00 0.00 H new ATOM 0 HA2 GLY A 5 2.669 -46.113 -16.507 1.00 0.00 H new ATOM 0 HA3 GLY A 5 4.307 -45.867 -17.079 1.00 0.00 H new ATOM 66 N GLU A 6 2.540 -47.005 -18.983 1.00 0.00 N ATOM 67 CA GLU A 6 2.218 -47.812 -20.196 1.00 0.00 C ATOM 68 C GLU A 6 2.321 -46.940 -21.452 1.00 0.00 C ATOM 69 O GLU A 6 3.176 -47.143 -22.291 1.00 0.00 O ATOM 70 CB GLU A 6 0.778 -48.288 -19.987 1.00 0.00 C ATOM 71 CG GLU A 6 0.763 -49.804 -19.782 1.00 0.00 C ATOM 72 CD GLU A 6 -0.683 -50.302 -19.755 1.00 0.00 C ATOM 73 OE1 GLU A 6 -1.342 -50.095 -18.749 1.00 0.00 O ATOM 74 OE2 GLU A 6 -1.107 -50.883 -20.741 1.00 0.00 O ATOM 0 H GLU A 6 2.143 -46.066 -18.969 1.00 0.00 H new ATOM 0 HA GLU A 6 2.905 -48.647 -20.332 1.00 0.00 H new ATOM 0 HB2 GLU A 6 0.342 -47.790 -19.121 1.00 0.00 H new ATOM 0 HB3 GLU A 6 0.167 -48.022 -20.850 1.00 0.00 H new ATOM 0 HG2 GLU A 6 1.313 -50.295 -20.585 1.00 0.00 H new ATOM 0 HG3 GLU A 6 1.264 -50.060 -18.849 1.00 0.00 H new ATOM 81 N SER A 7 1.454 -45.972 -21.585 1.00 0.00 N ATOM 82 CA SER A 7 1.499 -45.087 -22.785 1.00 0.00 C ATOM 83 C SER A 7 1.911 -43.668 -22.382 1.00 0.00 C ATOM 84 O SER A 7 2.536 -42.954 -23.142 1.00 0.00 O ATOM 85 CB SER A 7 0.075 -45.094 -23.336 1.00 0.00 C ATOM 86 OG SER A 7 -0.846 -44.966 -22.260 1.00 0.00 O ATOM 0 H SER A 7 0.716 -45.756 -20.914 1.00 0.00 H new ATOM 0 HA SER A 7 2.224 -45.430 -23.523 1.00 0.00 H new ATOM 0 HB2 SER A 7 -0.058 -44.275 -24.043 1.00 0.00 H new ATOM 0 HB3 SER A 7 -0.112 -46.019 -23.881 1.00 0.00 H new ATOM 0 HG SER A 7 -1.761 -44.968 -22.611 1.00 0.00 H new ATOM 92 N SER A 8 1.566 -43.255 -21.192 1.00 0.00 N ATOM 93 CA SER A 8 1.936 -41.883 -20.738 1.00 0.00 C ATOM 94 C SER A 8 1.907 -41.805 -19.210 1.00 0.00 C ATOM 95 O SER A 8 0.921 -42.141 -18.581 1.00 0.00 O ATOM 96 CB SER A 8 0.873 -40.967 -21.343 1.00 0.00 C ATOM 97 OG SER A 8 1.187 -39.615 -21.031 1.00 0.00 O ATOM 0 H SER A 8 1.043 -43.809 -20.514 1.00 0.00 H new ATOM 0 HA SER A 8 2.942 -41.602 -21.050 1.00 0.00 H new ATOM 0 HB2 SER A 8 0.831 -41.103 -22.424 1.00 0.00 H new ATOM 0 HB3 SER A 8 -0.111 -41.224 -20.951 1.00 0.00 H new ATOM 0 HG SER A 8 0.842 -39.396 -20.140 1.00 0.00 H new ATOM 103 N GLY A 9 2.980 -41.363 -18.609 1.00 0.00 N ATOM 104 CA GLY A 9 3.015 -41.261 -17.122 1.00 0.00 C ATOM 105 C GLY A 9 1.962 -40.253 -16.652 1.00 0.00 C ATOM 106 O GLY A 9 0.861 -40.629 -16.302 1.00 0.00 O ATOM 0 H GLY A 9 3.833 -41.068 -19.084 1.00 0.00 H new ATOM 0 HA2 GLY A 9 2.824 -42.237 -16.676 1.00 0.00 H new ATOM 0 HA3 GLY A 9 4.006 -40.948 -16.792 1.00 0.00 H new ATOM 110 N PRO A 10 2.334 -38.998 -16.664 1.00 0.00 N ATOM 111 CA PRO A 10 1.401 -37.928 -16.233 1.00 0.00 C ATOM 112 C PRO A 10 0.323 -37.701 -17.300 1.00 0.00 C ATOM 113 O PRO A 10 0.472 -38.127 -18.428 1.00 0.00 O ATOM 114 CB PRO A 10 2.300 -36.701 -16.099 1.00 0.00 C ATOM 115 CG PRO A 10 3.459 -36.966 -17.005 1.00 0.00 C ATOM 116 CD PRO A 10 3.640 -38.461 -17.070 1.00 0.00 C ATOM 0 HA PRO A 10 0.872 -38.165 -15.310 1.00 0.00 H new ATOM 0 HB2 PRO A 10 1.773 -35.792 -16.389 1.00 0.00 H new ATOM 0 HB3 PRO A 10 2.628 -36.564 -15.069 1.00 0.00 H new ATOM 0 HG2 PRO A 10 3.272 -36.557 -17.998 1.00 0.00 H new ATOM 0 HG3 PRO A 10 4.361 -36.485 -16.627 1.00 0.00 H new ATOM 0 HD2 PRO A 10 3.910 -38.787 -18.075 1.00 0.00 H new ATOM 0 HD3 PRO A 10 4.434 -38.796 -16.402 1.00 0.00 H new ATOM 124 N PRO A 11 -0.731 -37.031 -16.908 1.00 0.00 N ATOM 125 CA PRO A 11 -1.841 -36.747 -17.851 1.00 0.00 C ATOM 126 C PRO A 11 -1.420 -35.681 -18.867 1.00 0.00 C ATOM 127 O PRO A 11 -1.971 -35.588 -19.946 1.00 0.00 O ATOM 128 CB PRO A 11 -2.956 -36.229 -16.947 1.00 0.00 C ATOM 129 CG PRO A 11 -2.258 -35.686 -15.741 1.00 0.00 C ATOM 130 CD PRO A 11 -0.990 -36.483 -15.570 1.00 0.00 C ATOM 0 HA PRO A 11 -2.142 -37.618 -18.433 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -3.541 -35.456 -17.446 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -3.647 -37.027 -16.677 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -2.034 -34.627 -15.869 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -2.890 -35.773 -14.857 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -0.167 -35.855 -15.230 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -1.113 -37.275 -14.831 1.00 0.00 H new ATOM 138 N ARG A 12 -0.447 -34.877 -18.529 1.00 0.00 N ATOM 139 CA ARG A 12 0.011 -33.817 -19.474 1.00 0.00 C ATOM 140 C ARG A 12 1.403 -34.161 -20.023 1.00 0.00 C ATOM 141 O ARG A 12 2.397 -33.944 -19.360 1.00 0.00 O ATOM 142 CB ARG A 12 0.069 -32.540 -18.635 1.00 0.00 C ATOM 143 CG ARG A 12 0.380 -31.346 -19.540 1.00 0.00 C ATOM 144 CD ARG A 12 0.152 -30.043 -18.768 1.00 0.00 C ATOM 145 NE ARG A 12 1.367 -29.223 -19.030 1.00 0.00 N ATOM 146 CZ ARG A 12 1.353 -28.317 -19.969 1.00 0.00 C ATOM 147 NH1 ARG A 12 1.526 -28.666 -21.215 1.00 0.00 N ATOM 148 NH2 ARG A 12 1.164 -27.064 -19.663 1.00 0.00 N ATOM 0 H ARG A 12 0.050 -34.909 -17.639 1.00 0.00 H new ATOM 0 HA ARG A 12 -0.653 -33.714 -20.332 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -0.881 -32.385 -18.124 1.00 0.00 H new ATOM 0 HB3 ARG A 12 0.834 -32.634 -17.864 1.00 0.00 H new ATOM 0 HG2 ARG A 12 1.412 -31.399 -19.887 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -0.256 -31.372 -20.425 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -0.749 -29.534 -19.110 1.00 0.00 H new ATOM 0 HD3 ARG A 12 0.026 -30.233 -17.702 1.00 0.00 H new ATOM 0 HE ARG A 12 2.210 -29.370 -18.475 1.00 0.00 H new ATOM 0 HH11 ARG A 12 1.672 -29.647 -21.454 1.00 0.00 H new ATOM 0 HH12 ARG A 12 1.515 -27.958 -21.949 1.00 0.00 H new ATOM 0 HH21 ARG A 12 1.027 -26.792 -18.690 1.00 0.00 H new ATOM 0 HH22 ARG A 12 1.153 -26.356 -20.397 1.00 0.00 H new ATOM 162 N PRO A 13 1.430 -34.693 -21.220 1.00 0.00 N ATOM 163 CA PRO A 13 2.720 -35.069 -21.852 1.00 0.00 C ATOM 164 C PRO A 13 3.495 -33.817 -22.271 1.00 0.00 C ATOM 165 O PRO A 13 2.919 -32.789 -22.572 1.00 0.00 O ATOM 166 CB PRO A 13 2.298 -35.882 -23.073 1.00 0.00 C ATOM 167 CG PRO A 13 0.915 -35.413 -23.392 1.00 0.00 C ATOM 168 CD PRO A 13 0.283 -34.992 -22.090 1.00 0.00 C ATOM 0 HA PRO A 13 3.379 -35.624 -21.184 1.00 0.00 H new ATOM 0 HB2 PRO A 13 2.974 -35.715 -23.911 1.00 0.00 H new ATOM 0 HB3 PRO A 13 2.313 -36.951 -22.860 1.00 0.00 H new ATOM 0 HG2 PRO A 13 0.942 -34.580 -24.095 1.00 0.00 H new ATOM 0 HG3 PRO A 13 0.337 -36.208 -23.862 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -0.357 -34.120 -22.221 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -0.339 -35.784 -21.673 1.00 0.00 H new ATOM 176 N SER A 14 4.799 -33.896 -22.293 1.00 0.00 N ATOM 177 CA SER A 14 5.616 -32.713 -22.691 1.00 0.00 C ATOM 178 C SER A 14 6.976 -33.166 -23.230 1.00 0.00 C ATOM 179 O SER A 14 7.319 -34.331 -23.174 1.00 0.00 O ATOM 180 CB SER A 14 5.790 -31.898 -21.408 1.00 0.00 C ATOM 181 OG SER A 14 5.034 -30.699 -21.508 1.00 0.00 O ATOM 0 H SER A 14 5.334 -34.730 -22.052 1.00 0.00 H new ATOM 0 HA SER A 14 5.140 -32.131 -23.480 1.00 0.00 H new ATOM 0 HB2 SER A 14 5.460 -32.479 -20.547 1.00 0.00 H new ATOM 0 HB3 SER A 14 6.843 -31.666 -21.251 1.00 0.00 H new ATOM 0 HG SER A 14 4.148 -30.900 -21.876 1.00 0.00 H new ATOM 187 N ARG A 15 7.752 -32.254 -23.751 1.00 0.00 N ATOM 188 CA ARG A 15 9.091 -32.630 -24.293 1.00 0.00 C ATOM 189 C ARG A 15 10.179 -31.753 -23.668 1.00 0.00 C ATOM 190 O ARG A 15 9.934 -31.015 -22.733 1.00 0.00 O ATOM 191 CB ARG A 15 8.995 -32.376 -25.800 1.00 0.00 C ATOM 192 CG ARG A 15 9.465 -33.618 -26.561 1.00 0.00 C ATOM 193 CD ARG A 15 9.542 -33.302 -28.057 1.00 0.00 C ATOM 194 NE ARG A 15 8.245 -33.772 -28.619 1.00 0.00 N ATOM 195 CZ ARG A 15 8.037 -33.725 -29.906 1.00 0.00 C ATOM 196 NH1 ARG A 15 8.972 -34.111 -30.732 1.00 0.00 N ATOM 197 NH2 ARG A 15 6.896 -33.292 -30.369 1.00 0.00 N ATOM 0 H ARG A 15 7.517 -31.264 -23.825 1.00 0.00 H new ATOM 0 HA ARG A 15 9.351 -33.665 -24.071 1.00 0.00 H new ATOM 0 HB2 ARG A 15 7.968 -32.136 -26.074 1.00 0.00 H new ATOM 0 HB3 ARG A 15 9.607 -31.516 -26.074 1.00 0.00 H new ATOM 0 HG2 ARG A 15 10.442 -33.934 -26.195 1.00 0.00 H new ATOM 0 HG3 ARG A 15 8.777 -34.445 -26.388 1.00 0.00 H new ATOM 0 HD2 ARG A 15 9.682 -32.235 -28.228 1.00 0.00 H new ATOM 0 HD3 ARG A 15 10.383 -33.813 -28.525 1.00 0.00 H new ATOM 0 HE ARG A 15 7.520 -34.130 -27.998 1.00 0.00 H new ATOM 0 HH11 ARG A 15 9.864 -34.449 -30.371 1.00 0.00 H new ATOM 0 HH12 ARG A 15 8.810 -34.075 -31.738 1.00 0.00 H new ATOM 0 HH21 ARG A 15 6.166 -32.990 -29.724 1.00 0.00 H new ATOM 0 HH22 ARG A 15 6.735 -33.256 -31.376 1.00 0.00 H new ATOM 211 N GLY A 16 11.381 -31.830 -24.176 1.00 0.00 N ATOM 212 CA GLY A 16 12.486 -31.004 -23.614 1.00 0.00 C ATOM 213 C GLY A 16 13.752 -31.204 -24.453 1.00 0.00 C ATOM 214 O GLY A 16 14.675 -31.869 -24.028 1.00 0.00 O ATOM 0 H GLY A 16 11.644 -32.431 -24.957 1.00 0.00 H new ATOM 0 HA2 GLY A 16 12.202 -29.952 -23.610 1.00 0.00 H new ATOM 0 HA3 GLY A 16 12.675 -31.287 -22.578 1.00 0.00 H new ATOM 218 N PRO A 17 13.755 -30.617 -25.624 1.00 0.00 N ATOM 219 CA PRO A 17 14.924 -30.738 -26.529 1.00 0.00 C ATOM 220 C PRO A 17 16.093 -29.898 -26.007 1.00 0.00 C ATOM 221 O PRO A 17 16.079 -29.427 -24.887 1.00 0.00 O ATOM 222 CB PRO A 17 14.409 -30.187 -27.855 1.00 0.00 C ATOM 223 CG PRO A 17 13.287 -29.269 -27.485 1.00 0.00 C ATOM 224 CD PRO A 17 12.685 -29.798 -26.210 1.00 0.00 C ATOM 0 HA PRO A 17 15.297 -31.759 -26.613 1.00 0.00 H new ATOM 0 HB2 PRO A 17 15.194 -29.654 -28.392 1.00 0.00 H new ATOM 0 HB3 PRO A 17 14.064 -30.989 -28.508 1.00 0.00 H new ATOM 0 HG2 PRO A 17 13.652 -28.251 -27.346 1.00 0.00 H new ATOM 0 HG3 PRO A 17 12.540 -29.234 -28.278 1.00 0.00 H new ATOM 0 HD2 PRO A 17 12.391 -28.989 -25.542 1.00 0.00 H new ATOM 0 HD3 PRO A 17 11.791 -30.390 -26.406 1.00 0.00 H new ATOM 232 N ALA A 18 17.104 -29.708 -26.812 1.00 0.00 N ATOM 233 CA ALA A 18 18.275 -28.900 -26.366 1.00 0.00 C ATOM 234 C ALA A 18 18.028 -27.414 -26.646 1.00 0.00 C ATOM 235 O ALA A 18 18.362 -26.560 -25.848 1.00 0.00 O ATOM 236 CB ALA A 18 19.452 -29.413 -27.197 1.00 0.00 C ATOM 0 H ALA A 18 17.169 -30.078 -27.760 1.00 0.00 H new ATOM 0 HA ALA A 18 18.460 -28.997 -25.296 1.00 0.00 H new ATOM 0 HB1 ALA A 18 20.355 -28.866 -26.926 1.00 0.00 H new ATOM 0 HB2 ALA A 18 19.600 -30.475 -27.002 1.00 0.00 H new ATOM 0 HB3 ALA A 18 19.242 -29.264 -28.256 1.00 0.00 H new ATOM 242 N ALA A 19 17.445 -27.104 -27.773 1.00 0.00 N ATOM 243 CA ALA A 19 17.173 -25.675 -28.107 1.00 0.00 C ATOM 244 C ALA A 19 15.671 -25.454 -28.296 1.00 0.00 C ATOM 245 O ALA A 19 15.176 -25.400 -29.405 1.00 0.00 O ATOM 246 CB ALA A 19 17.922 -25.426 -29.417 1.00 0.00 C ATOM 0 H ALA A 19 17.145 -27.778 -28.477 1.00 0.00 H new ATOM 0 HA ALA A 19 17.496 -24.996 -27.318 1.00 0.00 H new ATOM 0 HB1 ALA A 19 17.772 -24.393 -29.731 1.00 0.00 H new ATOM 0 HB2 ALA A 19 18.986 -25.609 -29.268 1.00 0.00 H new ATOM 0 HB3 ALA A 19 17.543 -26.098 -30.187 1.00 0.00 H new ATOM 252 N ALA A 20 14.941 -25.328 -27.219 1.00 0.00 N ATOM 253 CA ALA A 20 13.469 -25.113 -27.333 1.00 0.00 C ATOM 254 C ALA A 20 13.162 -23.619 -27.480 1.00 0.00 C ATOM 255 O ALA A 20 14.050 -22.808 -27.656 1.00 0.00 O ATOM 256 CB ALA A 20 12.887 -25.653 -26.027 1.00 0.00 C ATOM 0 H ALA A 20 15.301 -25.365 -26.265 1.00 0.00 H new ATOM 0 HA ALA A 20 13.046 -25.612 -28.205 1.00 0.00 H new ATOM 0 HB1 ALA A 20 11.804 -25.531 -26.033 1.00 0.00 H new ATOM 0 HB2 ALA A 20 13.132 -26.711 -25.929 1.00 0.00 H new ATOM 0 HB3 ALA A 20 13.309 -25.103 -25.186 1.00 0.00 H new ATOM 262 N GLN A 21 11.910 -23.253 -27.409 1.00 0.00 N ATOM 263 CA GLN A 21 11.542 -21.813 -27.544 1.00 0.00 C ATOM 264 C GLN A 21 10.891 -21.312 -26.251 1.00 0.00 C ATOM 265 O GLN A 21 9.941 -21.889 -25.760 1.00 0.00 O ATOM 266 CB GLN A 21 10.543 -21.766 -28.701 1.00 0.00 C ATOM 267 CG GLN A 21 10.855 -20.569 -29.601 1.00 0.00 C ATOM 268 CD GLN A 21 9.801 -20.470 -30.704 1.00 0.00 C ATOM 269 OE1 GLN A 21 9.004 -19.553 -30.718 1.00 0.00 O ATOM 270 NE2 GLN A 21 9.760 -21.384 -31.636 1.00 0.00 N ATOM 0 H GLN A 21 11.126 -23.889 -27.263 1.00 0.00 H new ATOM 0 HA GLN A 21 12.409 -21.180 -27.730 1.00 0.00 H new ATOM 0 HB2 GLN A 21 10.595 -22.690 -29.277 1.00 0.00 H new ATOM 0 HB3 GLN A 21 9.527 -21.688 -28.314 1.00 0.00 H new ATOM 0 HG2 GLN A 21 10.868 -19.652 -29.012 1.00 0.00 H new ATOM 0 HG3 GLN A 21 11.847 -20.680 -30.040 1.00 0.00 H new ATOM 0 HE21 GLN A 21 10.429 -22.154 -31.625 1.00 0.00 H new ATOM 0 HE22 GLN A 21 9.059 -21.328 -32.375 1.00 0.00 H new ATOM 279 N GLY A 22 11.397 -20.242 -25.698 1.00 0.00 N ATOM 280 CA GLY A 22 10.809 -19.703 -24.438 1.00 0.00 C ATOM 281 C GLY A 22 10.688 -18.181 -24.539 1.00 0.00 C ATOM 282 O GLY A 22 11.642 -17.459 -24.331 1.00 0.00 O ATOM 0 H GLY A 22 12.192 -19.718 -26.064 1.00 0.00 H new ATOM 0 HA2 GLY A 22 9.828 -20.145 -24.264 1.00 0.00 H new ATOM 0 HA3 GLY A 22 11.436 -19.973 -23.588 1.00 0.00 H new ATOM 286 N SER A 23 9.520 -17.691 -24.858 1.00 0.00 N ATOM 287 CA SER A 23 9.334 -16.214 -24.976 1.00 0.00 C ATOM 288 C SER A 23 7.845 -15.863 -24.916 1.00 0.00 C ATOM 289 O SER A 23 7.187 -15.736 -25.930 1.00 0.00 O ATOM 290 CB SER A 23 9.917 -15.849 -26.338 1.00 0.00 C ATOM 291 OG SER A 23 9.677 -14.471 -26.597 1.00 0.00 O ATOM 0 H SER A 23 8.686 -18.249 -25.042 1.00 0.00 H new ATOM 0 HA SER A 23 9.821 -15.670 -24.167 1.00 0.00 H new ATOM 0 HB2 SER A 23 10.988 -16.053 -26.355 1.00 0.00 H new ATOM 0 HB3 SER A 23 9.463 -16.462 -27.117 1.00 0.00 H new ATOM 0 HG SER A 23 10.051 -14.232 -27.471 1.00 0.00 H new ATOM 297 N ALA A 24 7.311 -15.703 -23.735 1.00 0.00 N ATOM 298 CA ALA A 24 5.864 -15.358 -23.609 1.00 0.00 C ATOM 299 C ALA A 24 5.599 -13.968 -24.192 1.00 0.00 C ATOM 300 O ALA A 24 6.422 -13.077 -24.096 1.00 0.00 O ATOM 301 CB ALA A 24 5.580 -15.372 -22.106 1.00 0.00 C ATOM 0 H ALA A 24 7.813 -15.796 -22.852 1.00 0.00 H new ATOM 0 HA ALA A 24 5.226 -16.057 -24.150 1.00 0.00 H new ATOM 0 HB1 ALA A 24 4.532 -15.127 -21.931 1.00 0.00 H new ATOM 0 HB2 ALA A 24 5.793 -16.363 -21.705 1.00 0.00 H new ATOM 0 HB3 ALA A 24 6.212 -14.636 -21.609 1.00 0.00 H new ATOM 307 N ALA A 25 4.457 -13.775 -24.797 1.00 0.00 N ATOM 308 CA ALA A 25 4.138 -12.443 -25.387 1.00 0.00 C ATOM 309 C ALA A 25 3.647 -11.487 -24.296 1.00 0.00 C ATOM 310 O ALA A 25 2.544 -10.977 -24.353 1.00 0.00 O ATOM 311 CB ALA A 25 3.029 -12.714 -26.404 1.00 0.00 C ATOM 0 H ALA A 25 3.731 -14.483 -24.908 1.00 0.00 H new ATOM 0 HA ALA A 25 5.008 -11.977 -25.850 1.00 0.00 H new ATOM 0 HB1 ALA A 25 2.738 -11.779 -26.883 1.00 0.00 H new ATOM 0 HB2 ALA A 25 3.391 -13.412 -27.159 1.00 0.00 H new ATOM 0 HB3 ALA A 25 2.166 -13.145 -25.896 1.00 0.00 H new ATOM 317 N ALA A 26 4.458 -11.241 -23.302 1.00 0.00 N ATOM 318 CA ALA A 26 4.042 -10.318 -22.205 1.00 0.00 C ATOM 319 C ALA A 26 5.274 -9.770 -21.474 1.00 0.00 C ATOM 320 O ALA A 26 5.548 -10.149 -20.353 1.00 0.00 O ATOM 321 CB ALA A 26 3.197 -11.180 -21.265 1.00 0.00 C ATOM 0 H ALA A 26 5.392 -11.639 -23.202 1.00 0.00 H new ATOM 0 HA ALA A 26 3.488 -9.456 -22.577 1.00 0.00 H new ATOM 0 HB1 ALA A 26 2.851 -10.574 -20.428 1.00 0.00 H new ATOM 0 HB2 ALA A 26 2.338 -11.575 -21.807 1.00 0.00 H new ATOM 0 HB3 ALA A 26 3.800 -12.007 -20.889 1.00 0.00 H new ATOM 327 N PRO A 27 5.980 -8.891 -22.139 1.00 0.00 N ATOM 328 CA PRO A 27 7.196 -8.288 -21.539 1.00 0.00 C ATOM 329 C PRO A 27 6.812 -7.280 -20.451 1.00 0.00 C ATOM 330 O PRO A 27 7.569 -7.024 -19.534 1.00 0.00 O ATOM 331 CB PRO A 27 7.868 -7.587 -22.716 1.00 0.00 C ATOM 332 CG PRO A 27 6.763 -7.308 -23.685 1.00 0.00 C ATOM 333 CD PRO A 27 5.722 -8.380 -23.491 1.00 0.00 C ATOM 0 HA PRO A 27 7.845 -9.021 -21.059 1.00 0.00 H new ATOM 0 HB2 PRO A 27 8.357 -6.666 -22.399 1.00 0.00 H new ATOM 0 HB3 PRO A 27 8.636 -8.217 -23.164 1.00 0.00 H new ATOM 0 HG2 PRO A 27 6.336 -6.321 -23.509 1.00 0.00 H new ATOM 0 HG3 PRO A 27 7.137 -7.315 -24.709 1.00 0.00 H new ATOM 0 HD2 PRO A 27 4.713 -7.976 -23.579 1.00 0.00 H new ATOM 0 HD3 PRO A 27 5.816 -9.167 -24.239 1.00 0.00 H new ATOM 341 N ALA A 28 5.641 -6.707 -20.546 1.00 0.00 N ATOM 342 CA ALA A 28 5.208 -5.715 -19.518 1.00 0.00 C ATOM 343 C ALA A 28 5.114 -6.384 -18.144 1.00 0.00 C ATOM 344 O ALA A 28 4.305 -7.264 -17.926 1.00 0.00 O ATOM 345 CB ALA A 28 3.829 -5.241 -19.978 1.00 0.00 C ATOM 0 H ALA A 28 4.966 -6.883 -21.290 1.00 0.00 H new ATOM 0 HA ALA A 28 5.911 -4.888 -19.422 1.00 0.00 H new ATOM 0 HB1 ALA A 28 3.442 -4.507 -19.271 1.00 0.00 H new ATOM 0 HB2 ALA A 28 3.911 -4.786 -20.965 1.00 0.00 H new ATOM 0 HB3 ALA A 28 3.149 -6.092 -20.026 1.00 0.00 H new ATOM 351 N GLU A 29 5.936 -5.971 -17.216 1.00 0.00 N ATOM 352 CA GLU A 29 5.895 -6.581 -15.854 1.00 0.00 C ATOM 353 C GLU A 29 5.208 -5.628 -14.870 1.00 0.00 C ATOM 354 O GLU A 29 5.144 -4.438 -15.106 1.00 0.00 O ATOM 355 CB GLU A 29 7.361 -6.787 -15.469 1.00 0.00 C ATOM 356 CG GLU A 29 7.980 -7.859 -16.369 1.00 0.00 C ATOM 357 CD GLU A 29 7.535 -9.243 -15.893 1.00 0.00 C ATOM 358 OE1 GLU A 29 7.498 -9.452 -14.692 1.00 0.00 O ATOM 359 OE2 GLU A 29 7.238 -10.071 -16.738 1.00 0.00 O ATOM 0 H GLU A 29 6.634 -5.238 -17.342 1.00 0.00 H new ATOM 0 HA GLU A 29 5.334 -7.515 -15.835 1.00 0.00 H new ATOM 0 HB2 GLU A 29 7.910 -5.851 -15.571 1.00 0.00 H new ATOM 0 HB3 GLU A 29 7.435 -7.088 -14.424 1.00 0.00 H new ATOM 0 HG2 GLU A 29 7.673 -7.702 -17.403 1.00 0.00 H new ATOM 0 HG3 GLU A 29 9.067 -7.786 -16.344 1.00 0.00 H new ATOM 366 N PRO A 30 4.715 -6.183 -13.792 1.00 0.00 N ATOM 367 CA PRO A 30 4.027 -5.364 -12.765 1.00 0.00 C ATOM 368 C PRO A 30 5.033 -4.509 -11.995 1.00 0.00 C ATOM 369 O PRO A 30 5.347 -3.411 -12.413 1.00 0.00 O ATOM 370 CB PRO A 30 3.358 -6.402 -11.866 1.00 0.00 C ATOM 371 CG PRO A 30 4.171 -7.646 -12.038 1.00 0.00 C ATOM 372 CD PRO A 30 4.749 -7.607 -13.429 1.00 0.00 C ATOM 0 HA PRO A 30 3.309 -4.659 -13.184 1.00 0.00 H new ATOM 0 HB2 PRO A 30 3.350 -6.077 -10.826 1.00 0.00 H new ATOM 0 HB3 PRO A 30 2.320 -6.566 -12.157 1.00 0.00 H new ATOM 0 HG2 PRO A 30 4.964 -7.694 -11.292 1.00 0.00 H new ATOM 0 HG3 PRO A 30 3.552 -8.533 -11.903 1.00 0.00 H new ATOM 0 HD2 PRO A 30 5.766 -7.999 -13.449 1.00 0.00 H new ATOM 0 HD3 PRO A 30 4.161 -8.209 -14.122 1.00 0.00 H new ATOM 380 N LYS A 31 5.532 -4.976 -10.872 1.00 0.00 N ATOM 381 CA LYS A 31 6.495 -4.144 -10.091 1.00 0.00 C ATOM 382 C LYS A 31 5.961 -2.714 -10.046 1.00 0.00 C ATOM 383 O LYS A 31 6.676 -1.757 -10.262 1.00 0.00 O ATOM 384 CB LYS A 31 7.811 -4.211 -10.869 1.00 0.00 C ATOM 385 CG LYS A 31 8.582 -5.469 -10.464 1.00 0.00 C ATOM 386 CD LYS A 31 9.272 -6.066 -11.693 1.00 0.00 C ATOM 387 CE LYS A 31 10.543 -6.803 -11.262 1.00 0.00 C ATOM 388 NZ LYS A 31 11.665 -5.951 -11.745 1.00 0.00 N ATOM 0 H LYS A 31 5.315 -5.888 -10.469 1.00 0.00 H new ATOM 0 HA LYS A 31 6.633 -4.487 -9.066 1.00 0.00 H new ATOM 0 HB2 LYS A 31 7.612 -4.223 -11.941 1.00 0.00 H new ATOM 0 HB3 LYS A 31 8.411 -3.324 -10.667 1.00 0.00 H new ATOM 0 HG2 LYS A 31 9.322 -5.225 -9.702 1.00 0.00 H new ATOM 0 HG3 LYS A 31 7.902 -6.199 -10.026 1.00 0.00 H new ATOM 0 HD2 LYS A 31 8.597 -6.753 -12.204 1.00 0.00 H new ATOM 0 HD3 LYS A 31 9.520 -5.277 -12.402 1.00 0.00 H new ATOM 0 HE2 LYS A 31 10.579 -6.927 -10.180 1.00 0.00 H new ATOM 0 HE3 LYS A 31 10.588 -7.800 -11.699 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 12.571 -6.391 -11.487 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 11.608 -5.856 -12.779 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 11.600 -5.010 -11.307 1.00 0.00 H new ATOM 402 N ILE A 32 4.683 -2.581 -9.810 1.00 0.00 N ATOM 403 CA ILE A 32 4.058 -1.233 -9.799 1.00 0.00 C ATOM 404 C ILE A 32 4.735 -0.332 -8.756 1.00 0.00 C ATOM 405 O ILE A 32 4.614 -0.548 -7.565 1.00 0.00 O ATOM 406 CB ILE A 32 2.587 -1.478 -9.439 1.00 0.00 C ATOM 407 CG1 ILE A 32 1.863 -2.081 -10.646 1.00 0.00 C ATOM 408 CG2 ILE A 32 1.913 -0.156 -9.058 1.00 0.00 C ATOM 409 CD1 ILE A 32 1.790 -3.601 -10.496 1.00 0.00 C ATOM 0 H ILE A 32 4.044 -3.354 -9.624 1.00 0.00 H new ATOM 0 HA ILE A 32 4.161 -0.725 -10.758 1.00 0.00 H new ATOM 0 HB ILE A 32 2.537 -2.164 -8.594 1.00 0.00 H new ATOM 0 HG12 ILE A 32 0.859 -1.665 -10.725 1.00 0.00 H new ATOM 0 HG13 ILE A 32 2.389 -1.821 -11.565 1.00 0.00 H new ATOM 0 HG21 ILE A 32 0.869 -0.340 -8.804 1.00 0.00 H new ATOM 0 HG22 ILE A 32 2.424 0.279 -8.199 1.00 0.00 H new ATOM 0 HG23 ILE A 32 1.965 0.535 -9.899 1.00 0.00 H new ATOM 0 HD11 ILE A 32 1.274 -4.027 -11.356 1.00 0.00 H new ATOM 0 HD12 ILE A 32 2.799 -4.010 -10.439 1.00 0.00 H new ATOM 0 HD13 ILE A 32 1.245 -3.851 -9.586 1.00 0.00 H new ATOM 421 N ILE A 33 5.440 0.678 -9.197 1.00 0.00 N ATOM 422 CA ILE A 33 6.118 1.595 -8.231 1.00 0.00 C ATOM 423 C ILE A 33 5.180 2.746 -7.853 1.00 0.00 C ATOM 424 O ILE A 33 4.284 3.100 -8.597 1.00 0.00 O ATOM 425 CB ILE A 33 7.366 2.112 -8.956 1.00 0.00 C ATOM 426 CG1 ILE A 33 6.954 2.998 -10.142 1.00 0.00 C ATOM 427 CG2 ILE A 33 8.188 0.920 -9.456 1.00 0.00 C ATOM 428 CD1 ILE A 33 8.177 3.310 -11.006 1.00 0.00 C ATOM 0 H ILE A 33 5.576 0.907 -10.182 1.00 0.00 H new ATOM 0 HA ILE A 33 6.386 1.090 -7.303 1.00 0.00 H new ATOM 0 HB ILE A 33 7.967 2.706 -8.267 1.00 0.00 H new ATOM 0 HG12 ILE A 33 6.195 2.492 -10.739 1.00 0.00 H new ATOM 0 HG13 ILE A 33 6.509 3.924 -9.778 1.00 0.00 H new ATOM 0 HG21 ILE A 33 9.077 1.282 -9.973 1.00 0.00 H new ATOM 0 HG22 ILE A 33 8.487 0.303 -8.609 1.00 0.00 H new ATOM 0 HG23 ILE A 33 7.586 0.326 -10.143 1.00 0.00 H new ATOM 0 HD11 ILE A 33 7.879 3.938 -11.845 1.00 0.00 H new ATOM 0 HD12 ILE A 33 8.922 3.834 -10.407 1.00 0.00 H new ATOM 0 HD13 ILE A 33 8.603 2.380 -11.382 1.00 0.00 H new ATOM 440 N LYS A 34 5.373 3.324 -6.698 1.00 0.00 N ATOM 441 CA LYS A 34 4.491 4.445 -6.260 1.00 0.00 C ATOM 442 C LYS A 34 5.112 5.795 -6.632 1.00 0.00 C ATOM 443 O LYS A 34 6.315 5.967 -6.598 1.00 0.00 O ATOM 444 CB LYS A 34 4.393 4.298 -4.742 1.00 0.00 C ATOM 445 CG LYS A 34 3.176 5.073 -4.230 1.00 0.00 C ATOM 446 CD LYS A 34 2.665 4.428 -2.940 1.00 0.00 C ATOM 447 CE LYS A 34 1.529 3.457 -3.267 1.00 0.00 C ATOM 448 NZ LYS A 34 0.740 3.348 -2.009 1.00 0.00 N ATOM 0 H LYS A 34 6.106 3.067 -6.037 1.00 0.00 H new ATOM 0 HA LYS A 34 3.513 4.410 -6.739 1.00 0.00 H new ATOM 0 HB2 LYS A 34 4.306 3.245 -4.473 1.00 0.00 H new ATOM 0 HB3 LYS A 34 5.301 4.674 -4.270 1.00 0.00 H new ATOM 0 HG2 LYS A 34 3.445 6.113 -4.047 1.00 0.00 H new ATOM 0 HG3 LYS A 34 2.389 5.075 -4.984 1.00 0.00 H new ATOM 0 HD2 LYS A 34 3.476 3.899 -2.440 1.00 0.00 H new ATOM 0 HD3 LYS A 34 2.313 5.197 -2.252 1.00 0.00 H new ATOM 0 HE2 LYS A 34 0.915 3.830 -4.087 1.00 0.00 H new ATOM 0 HE3 LYS A 34 1.916 2.486 -3.575 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -0.058 2.698 -2.155 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 1.348 2.984 -1.248 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 0.378 4.286 -1.744 1.00 0.00 H new ATOM 462 N VAL A 35 4.297 6.754 -6.982 1.00 0.00 N ATOM 463 CA VAL A 35 4.833 8.098 -7.350 1.00 0.00 C ATOM 464 C VAL A 35 3.953 9.198 -6.750 1.00 0.00 C ATOM 465 O VAL A 35 2.779 9.298 -7.050 1.00 0.00 O ATOM 466 CB VAL A 35 4.792 8.146 -8.881 1.00 0.00 C ATOM 467 CG1 VAL A 35 3.356 7.935 -9.373 1.00 0.00 C ATOM 468 CG2 VAL A 35 5.299 9.509 -9.359 1.00 0.00 C ATOM 0 H VAL A 35 3.282 6.665 -7.029 1.00 0.00 H new ATOM 0 HA VAL A 35 5.843 8.256 -6.971 1.00 0.00 H new ATOM 0 HB VAL A 35 5.426 7.356 -9.282 1.00 0.00 H new ATOM 0 HG11 VAL A 35 3.336 7.971 -10.462 1.00 0.00 H new ATOM 0 HG12 VAL A 35 2.995 6.964 -9.035 1.00 0.00 H new ATOM 0 HG13 VAL A 35 2.715 8.720 -8.972 1.00 0.00 H new ATOM 0 HG21 VAL A 35 5.271 9.546 -10.448 1.00 0.00 H new ATOM 0 HG22 VAL A 35 4.664 10.296 -8.953 1.00 0.00 H new ATOM 0 HG23 VAL A 35 6.323 9.656 -9.017 1.00 0.00 H new ATOM 478 N THR A 36 4.512 10.025 -5.907 1.00 0.00 N ATOM 479 CA THR A 36 3.710 11.119 -5.288 1.00 0.00 C ATOM 480 C THR A 36 3.717 12.354 -6.194 1.00 0.00 C ATOM 481 O THR A 36 4.678 13.099 -6.239 1.00 0.00 O ATOM 482 CB THR A 36 4.407 11.421 -3.960 1.00 0.00 C ATOM 483 OG1 THR A 36 4.607 10.208 -3.247 1.00 0.00 O ATOM 484 CG2 THR A 36 3.539 12.367 -3.129 1.00 0.00 C ATOM 0 H THR A 36 5.490 9.990 -5.620 1.00 0.00 H new ATOM 0 HA THR A 36 2.667 10.837 -5.143 1.00 0.00 H new ATOM 0 HB THR A 36 5.370 11.893 -4.153 1.00 0.00 H new ATOM 0 HG1 THR A 36 5.055 10.399 -2.396 1.00 0.00 H new ATOM 0 HG21 THR A 36 4.037 12.581 -2.183 1.00 0.00 H new ATOM 0 HG22 THR A 36 3.386 13.297 -3.677 1.00 0.00 H new ATOM 0 HG23 THR A 36 2.575 11.898 -2.933 1.00 0.00 H new ATOM 492 N VAL A 37 2.650 12.575 -6.915 1.00 0.00 N ATOM 493 CA VAL A 37 2.589 13.760 -7.819 1.00 0.00 C ATOM 494 C VAL A 37 1.867 14.917 -7.122 1.00 0.00 C ATOM 495 O VAL A 37 0.776 14.759 -6.610 1.00 0.00 O ATOM 496 CB VAL A 37 1.795 13.292 -9.042 1.00 0.00 C ATOM 497 CG1 VAL A 37 1.701 14.431 -10.059 1.00 0.00 C ATOM 498 CG2 VAL A 37 2.505 12.097 -9.684 1.00 0.00 C ATOM 0 H VAL A 37 1.818 11.986 -6.917 1.00 0.00 H new ATOM 0 HA VAL A 37 3.581 14.120 -8.093 1.00 0.00 H new ATOM 0 HB VAL A 37 0.792 12.998 -8.731 1.00 0.00 H new ATOM 0 HG11 VAL A 37 1.136 14.096 -10.929 1.00 0.00 H new ATOM 0 HG12 VAL A 37 1.197 15.284 -9.605 1.00 0.00 H new ATOM 0 HG13 VAL A 37 2.704 14.725 -10.369 1.00 0.00 H new ATOM 0 HG21 VAL A 37 1.941 11.763 -10.555 1.00 0.00 H new ATOM 0 HG22 VAL A 37 3.508 12.393 -9.993 1.00 0.00 H new ATOM 0 HG23 VAL A 37 2.573 11.283 -8.962 1.00 0.00 H new ATOM 508 N LYS A 38 2.467 16.076 -7.099 1.00 0.00 N ATOM 509 CA LYS A 38 1.815 17.241 -6.435 1.00 0.00 C ATOM 510 C LYS A 38 1.366 18.267 -7.482 1.00 0.00 C ATOM 511 O LYS A 38 2.144 18.713 -8.303 1.00 0.00 O ATOM 512 CB LYS A 38 2.887 17.832 -5.513 1.00 0.00 C ATOM 513 CG LYS A 38 4.030 18.417 -6.347 1.00 0.00 C ATOM 514 CD LYS A 38 3.848 19.932 -6.471 1.00 0.00 C ATOM 515 CE LYS A 38 4.431 20.620 -5.235 1.00 0.00 C ATOM 516 NZ LYS A 38 3.565 21.813 -5.015 1.00 0.00 N ATOM 0 H LYS A 38 3.380 16.267 -7.511 1.00 0.00 H new ATOM 0 HA LYS A 38 0.923 16.952 -5.879 1.00 0.00 H new ATOM 0 HB2 LYS A 38 2.450 18.608 -4.884 1.00 0.00 H new ATOM 0 HB3 LYS A 38 3.271 17.060 -4.846 1.00 0.00 H new ATOM 0 HG2 LYS A 38 4.988 18.192 -5.879 1.00 0.00 H new ATOM 0 HG3 LYS A 38 4.044 17.959 -7.336 1.00 0.00 H new ATOM 0 HD2 LYS A 38 4.344 20.296 -7.371 1.00 0.00 H new ATOM 0 HD3 LYS A 38 2.790 20.175 -6.570 1.00 0.00 H new ATOM 0 HE2 LYS A 38 4.417 19.957 -4.370 1.00 0.00 H new ATOM 0 HE3 LYS A 38 5.469 20.910 -5.397 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 3.902 22.338 -4.183 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 3.604 22.429 -5.852 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 2.584 21.506 -4.857 1.00 0.00 H new ATOM 530 N THR A 39 0.115 18.639 -7.452 1.00 0.00 N ATOM 531 CA THR A 39 -0.398 19.633 -8.439 1.00 0.00 C ATOM 532 C THR A 39 -1.015 20.826 -7.698 1.00 0.00 C ATOM 533 O THR A 39 -1.101 20.819 -6.487 1.00 0.00 O ATOM 534 CB THR A 39 -1.470 18.887 -9.245 1.00 0.00 C ATOM 535 OG1 THR A 39 -1.809 17.672 -8.589 1.00 0.00 O ATOM 536 CG2 THR A 39 -0.937 18.581 -10.646 1.00 0.00 C ATOM 0 H THR A 39 -0.576 18.297 -6.785 1.00 0.00 H new ATOM 0 HA THR A 39 0.390 20.023 -9.084 1.00 0.00 H new ATOM 0 HB THR A 39 -2.359 19.512 -9.323 1.00 0.00 H new ATOM 0 HG1 THR A 39 -2.183 17.042 -9.240 1.00 0.00 H new ATOM 0 HG21 THR A 39 -1.699 18.051 -11.218 1.00 0.00 H new ATOM 0 HG22 THR A 39 -0.687 19.514 -11.152 1.00 0.00 H new ATOM 0 HG23 THR A 39 -0.045 17.960 -10.568 1.00 0.00 H new ATOM 544 N PRO A 40 -1.428 21.817 -8.449 1.00 0.00 N ATOM 545 CA PRO A 40 -2.044 23.021 -7.836 1.00 0.00 C ATOM 546 C PRO A 40 -3.437 22.689 -7.290 1.00 0.00 C ATOM 547 O PRO A 40 -4.431 23.240 -7.722 1.00 0.00 O ATOM 548 CB PRO A 40 -2.128 24.011 -8.995 1.00 0.00 C ATOM 549 CG PRO A 40 -2.150 23.165 -10.226 1.00 0.00 C ATOM 550 CD PRO A 40 -1.366 21.916 -9.914 1.00 0.00 C ATOM 0 HA PRO A 40 -1.476 23.413 -6.992 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -3.024 24.627 -8.924 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -1.275 24.689 -8.997 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -3.174 22.918 -10.506 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -1.708 23.698 -11.068 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -1.803 21.040 -10.393 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -0.337 21.991 -10.266 1.00 0.00 H new ATOM 558 N LYS A 41 -3.512 21.792 -6.341 1.00 0.00 N ATOM 559 CA LYS A 41 -4.835 21.417 -5.758 1.00 0.00 C ATOM 560 C LYS A 41 -4.633 20.474 -4.570 1.00 0.00 C ATOM 561 O LYS A 41 -5.170 20.684 -3.499 1.00 0.00 O ATOM 562 CB LYS A 41 -5.585 20.702 -6.885 1.00 0.00 C ATOM 563 CG LYS A 41 -7.083 20.984 -6.762 1.00 0.00 C ATOM 564 CD LYS A 41 -7.461 22.153 -7.674 1.00 0.00 C ATOM 565 CE LYS A 41 -8.953 22.080 -8.009 1.00 0.00 C ATOM 566 NZ LYS A 41 -9.609 23.013 -7.051 1.00 0.00 N ATOM 0 H LYS A 41 -2.711 21.301 -5.943 1.00 0.00 H new ATOM 0 HA LYS A 41 -5.385 22.284 -5.393 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -5.219 21.043 -7.853 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -5.401 19.629 -6.835 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -7.654 20.097 -7.035 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -7.335 21.220 -5.728 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -7.234 23.099 -7.183 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -6.870 22.119 -8.589 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -9.141 22.377 -9.041 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -9.334 21.065 -7.895 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -10.635 23.018 -7.219 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -9.419 22.701 -6.077 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -9.232 23.972 -7.187 1.00 0.00 H new ATOM 580 N GLU A 42 -3.860 19.436 -4.752 1.00 0.00 N ATOM 581 CA GLU A 42 -3.616 18.473 -3.636 1.00 0.00 C ATOM 582 C GLU A 42 -2.492 17.502 -4.013 1.00 0.00 C ATOM 583 O GLU A 42 -1.938 17.569 -5.093 1.00 0.00 O ATOM 584 CB GLU A 42 -4.939 17.722 -3.461 1.00 0.00 C ATOM 585 CG GLU A 42 -5.604 18.152 -2.151 1.00 0.00 C ATOM 586 CD GLU A 42 -5.264 17.144 -1.051 1.00 0.00 C ATOM 587 OE1 GLU A 42 -4.089 16.980 -0.768 1.00 0.00 O ATOM 588 OE2 GLU A 42 -6.186 16.554 -0.511 1.00 0.00 O ATOM 0 H GLU A 42 -3.386 19.212 -5.627 1.00 0.00 H new ATOM 0 HA GLU A 42 -3.309 18.974 -2.718 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -5.601 17.930 -4.302 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -4.760 16.647 -3.454 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -5.261 19.147 -1.866 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -6.684 18.213 -2.282 1.00 0.00 H new ATOM 595 N LYS A 43 -2.153 16.600 -3.130 1.00 0.00 N ATOM 596 CA LYS A 43 -1.066 15.623 -3.433 1.00 0.00 C ATOM 597 C LYS A 43 -1.626 14.197 -3.444 1.00 0.00 C ATOM 598 O LYS A 43 -2.200 13.740 -2.474 1.00 0.00 O ATOM 599 CB LYS A 43 -0.054 15.791 -2.299 1.00 0.00 C ATOM 600 CG LYS A 43 0.716 17.099 -2.491 1.00 0.00 C ATOM 601 CD LYS A 43 1.056 17.696 -1.123 1.00 0.00 C ATOM 602 CE LYS A 43 2.076 16.802 -0.411 1.00 0.00 C ATOM 603 NZ LYS A 43 1.492 16.546 0.936 1.00 0.00 N ATOM 0 H LYS A 43 -2.583 16.498 -2.211 1.00 0.00 H new ATOM 0 HA LYS A 43 -0.616 15.796 -4.410 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -0.567 15.797 -1.337 1.00 0.00 H new ATOM 0 HB3 LYS A 43 0.637 14.948 -2.286 1.00 0.00 H new ATOM 0 HG2 LYS A 43 1.629 16.916 -3.057 1.00 0.00 H new ATOM 0 HG3 LYS A 43 0.118 17.804 -3.069 1.00 0.00 H new ATOM 0 HD2 LYS A 43 1.460 18.701 -1.244 1.00 0.00 H new ATOM 0 HD3 LYS A 43 0.153 17.786 -0.520 1.00 0.00 H new ATOM 0 HE2 LYS A 43 2.233 15.871 -0.956 1.00 0.00 H new ATOM 0 HE3 LYS A 43 3.046 17.294 -0.334 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 2.135 15.939 1.484 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 1.360 17.449 1.434 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 0.573 16.071 0.831 1.00 0.00 H new ATOM 617 N GLU A 44 -1.464 13.492 -4.532 1.00 0.00 N ATOM 618 CA GLU A 44 -1.989 12.096 -4.602 1.00 0.00 C ATOM 619 C GLU A 44 -0.946 11.163 -5.224 1.00 0.00 C ATOM 620 O GLU A 44 -0.334 11.479 -6.226 1.00 0.00 O ATOM 621 CB GLU A 44 -3.230 12.183 -5.496 1.00 0.00 C ATOM 622 CG GLU A 44 -4.450 11.662 -4.733 1.00 0.00 C ATOM 623 CD GLU A 44 -5.222 12.841 -4.136 1.00 0.00 C ATOM 624 OE1 GLU A 44 -5.961 13.473 -4.871 1.00 0.00 O ATOM 625 OE2 GLU A 44 -5.061 13.091 -2.953 1.00 0.00 O ATOM 0 H GLU A 44 -0.992 13.821 -5.374 1.00 0.00 H new ATOM 0 HA GLU A 44 -2.222 11.696 -3.615 1.00 0.00 H new ATOM 0 HB2 GLU A 44 -3.396 13.215 -5.806 1.00 0.00 H new ATOM 0 HB3 GLU A 44 -3.079 11.598 -6.403 1.00 0.00 H new ATOM 0 HG2 GLU A 44 -5.095 11.093 -5.403 1.00 0.00 H new ATOM 0 HG3 GLU A 44 -4.134 10.983 -3.941 1.00 0.00 H new ATOM 632 N GLU A 45 -0.747 10.010 -4.641 1.00 0.00 N ATOM 633 CA GLU A 45 0.248 9.049 -5.200 1.00 0.00 C ATOM 634 C GLU A 45 -0.407 8.204 -6.296 1.00 0.00 C ATOM 635 O GLU A 45 -1.593 7.940 -6.259 1.00 0.00 O ATOM 636 CB GLU A 45 0.660 8.171 -4.018 1.00 0.00 C ATOM 637 CG GLU A 45 1.945 8.723 -3.396 1.00 0.00 C ATOM 638 CD GLU A 45 2.184 8.052 -2.041 1.00 0.00 C ATOM 639 OE1 GLU A 45 1.259 8.023 -1.246 1.00 0.00 O ATOM 640 OE2 GLU A 45 3.287 7.580 -1.822 1.00 0.00 O ATOM 0 H GLU A 45 -1.231 9.692 -3.801 1.00 0.00 H new ATOM 0 HA GLU A 45 1.106 9.550 -5.649 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -0.136 8.148 -3.274 1.00 0.00 H new ATOM 0 HB3 GLU A 45 0.816 7.145 -4.350 1.00 0.00 H new ATOM 0 HG2 GLU A 45 2.791 8.540 -4.059 1.00 0.00 H new ATOM 0 HG3 GLU A 45 1.866 9.803 -3.270 1.00 0.00 H new ATOM 647 N PHE A 46 0.350 7.781 -7.273 1.00 0.00 N ATOM 648 CA PHE A 46 -0.238 6.960 -8.369 1.00 0.00 C ATOM 649 C PHE A 46 0.512 5.634 -8.509 1.00 0.00 C ATOM 650 O PHE A 46 1.713 5.565 -8.331 1.00 0.00 O ATOM 651 CB PHE A 46 -0.068 7.804 -9.632 1.00 0.00 C ATOM 652 CG PHE A 46 -1.361 8.522 -9.937 1.00 0.00 C ATOM 653 CD1 PHE A 46 -1.748 9.625 -9.167 1.00 0.00 C ATOM 654 CD2 PHE A 46 -2.173 8.084 -10.991 1.00 0.00 C ATOM 655 CE1 PHE A 46 -2.946 10.290 -9.450 1.00 0.00 C ATOM 656 CE2 PHE A 46 -3.371 8.748 -11.274 1.00 0.00 C ATOM 657 CZ PHE A 46 -3.759 9.852 -10.503 1.00 0.00 C ATOM 0 H PHE A 46 1.349 7.969 -7.359 1.00 0.00 H new ATOM 0 HA PHE A 46 -1.282 6.712 -8.178 1.00 0.00 H new ATOM 0 HB2 PHE A 46 0.737 8.526 -9.494 1.00 0.00 H new ATOM 0 HB3 PHE A 46 0.214 7.168 -10.471 1.00 0.00 H new ATOM 0 HD1 PHE A 46 -1.122 9.963 -8.354 1.00 0.00 H new ATOM 0 HD2 PHE A 46 -1.874 7.233 -11.585 1.00 0.00 H new ATOM 0 HE1 PHE A 46 -3.244 11.141 -8.856 1.00 0.00 H new ATOM 0 HE2 PHE A 46 -3.997 8.410 -12.087 1.00 0.00 H new ATOM 0 HZ PHE A 46 -4.684 10.365 -10.721 1.00 0.00 H new ATOM 667 N ALA A 47 -0.190 4.584 -8.840 1.00 0.00 N ATOM 668 CA ALA A 47 0.473 3.259 -9.009 1.00 0.00 C ATOM 669 C ALA A 47 0.706 2.996 -10.496 1.00 0.00 C ATOM 670 O ALA A 47 -0.192 3.132 -11.304 1.00 0.00 O ATOM 671 CB ALA A 47 -0.512 2.244 -8.429 1.00 0.00 C ATOM 0 H ALA A 47 -1.197 4.587 -9.001 1.00 0.00 H new ATOM 0 HA ALA A 47 1.442 3.205 -8.512 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -0.095 1.241 -8.517 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -0.692 2.471 -7.378 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -1.452 2.295 -8.978 1.00 0.00 H new ATOM 677 N VAL A 48 1.902 2.631 -10.869 1.00 0.00 N ATOM 678 CA VAL A 48 2.179 2.373 -12.309 1.00 0.00 C ATOM 679 C VAL A 48 3.155 1.203 -12.449 1.00 0.00 C ATOM 680 O VAL A 48 4.043 1.047 -11.636 1.00 0.00 O ATOM 681 CB VAL A 48 2.796 3.676 -12.827 1.00 0.00 C ATOM 682 CG1 VAL A 48 1.806 4.825 -12.613 1.00 0.00 C ATOM 683 CG2 VAL A 48 4.091 3.976 -12.064 1.00 0.00 C ATOM 0 H VAL A 48 2.696 2.501 -10.242 1.00 0.00 H new ATOM 0 HA VAL A 48 1.285 2.102 -12.871 1.00 0.00 H new ATOM 0 HB VAL A 48 3.018 3.572 -13.889 1.00 0.00 H new ATOM 0 HG11 VAL A 48 2.242 5.754 -12.981 1.00 0.00 H new ATOM 0 HG12 VAL A 48 0.884 4.617 -13.156 1.00 0.00 H new ATOM 0 HG13 VAL A 48 1.587 4.923 -11.550 1.00 0.00 H new ATOM 0 HG21 VAL A 48 4.526 4.904 -12.436 1.00 0.00 H new ATOM 0 HG22 VAL A 48 3.872 4.079 -11.001 1.00 0.00 H new ATOM 0 HG23 VAL A 48 4.798 3.159 -12.211 1.00 0.00 H new ATOM 693 N PRO A 49 2.958 0.410 -13.473 1.00 0.00 N ATOM 694 CA PRO A 49 3.836 -0.762 -13.696 1.00 0.00 C ATOM 695 C PRO A 49 5.255 -0.324 -14.052 1.00 0.00 C ATOM 696 O PRO A 49 5.480 0.382 -15.014 1.00 0.00 O ATOM 697 CB PRO A 49 3.170 -1.499 -14.857 1.00 0.00 C ATOM 698 CG PRO A 49 2.371 -0.454 -15.564 1.00 0.00 C ATOM 699 CD PRO A 49 1.926 0.528 -14.513 1.00 0.00 C ATOM 0 HA PRO A 49 3.941 -1.388 -12.810 1.00 0.00 H new ATOM 0 HB2 PRO A 49 3.911 -1.946 -15.519 1.00 0.00 H new ATOM 0 HB3 PRO A 49 2.534 -2.308 -14.499 1.00 0.00 H new ATOM 0 HG2 PRO A 49 2.970 0.041 -16.329 1.00 0.00 H new ATOM 0 HG3 PRO A 49 1.513 -0.897 -16.069 1.00 0.00 H new ATOM 0 HD2 PRO A 49 1.870 1.542 -14.909 1.00 0.00 H new ATOM 0 HD3 PRO A 49 0.937 0.282 -14.127 1.00 0.00 H new ATOM 707 N GLU A 50 6.210 -0.745 -13.261 1.00 0.00 N ATOM 708 CA GLU A 50 7.643 -0.379 -13.502 1.00 0.00 C ATOM 709 C GLU A 50 7.973 -0.345 -15.002 1.00 0.00 C ATOM 710 O GLU A 50 8.768 0.456 -15.452 1.00 0.00 O ATOM 711 CB GLU A 50 8.445 -1.491 -12.816 1.00 0.00 C ATOM 712 CG GLU A 50 9.204 -0.925 -11.611 1.00 0.00 C ATOM 713 CD GLU A 50 10.686 -1.285 -11.722 1.00 0.00 C ATOM 714 OE1 GLU A 50 10.977 -2.403 -12.115 1.00 0.00 O ATOM 715 OE2 GLU A 50 11.507 -0.436 -11.412 1.00 0.00 O ATOM 0 H GLU A 50 6.056 -1.337 -12.445 1.00 0.00 H new ATOM 0 HA GLU A 50 7.872 0.614 -13.116 1.00 0.00 H new ATOM 0 HB2 GLU A 50 7.775 -2.287 -12.492 1.00 0.00 H new ATOM 0 HB3 GLU A 50 9.147 -1.933 -13.523 1.00 0.00 H new ATOM 0 HG2 GLU A 50 9.085 0.158 -11.569 1.00 0.00 H new ATOM 0 HG3 GLU A 50 8.790 -1.327 -10.686 1.00 0.00 H new ATOM 722 N ASN A 51 7.375 -1.208 -15.776 1.00 0.00 N ATOM 723 CA ASN A 51 7.668 -1.222 -17.239 1.00 0.00 C ATOM 724 C ASN A 51 6.757 -0.238 -17.980 1.00 0.00 C ATOM 725 O ASN A 51 6.150 -0.574 -18.979 1.00 0.00 O ATOM 726 CB ASN A 51 7.388 -2.656 -17.687 1.00 0.00 C ATOM 727 CG ASN A 51 8.042 -2.901 -19.049 1.00 0.00 C ATOM 728 OD1 ASN A 51 9.182 -3.316 -19.124 1.00 0.00 O ATOM 729 ND2 ASN A 51 7.362 -2.662 -20.137 1.00 0.00 N ATOM 0 H ASN A 51 6.698 -1.903 -15.461 1.00 0.00 H new ATOM 0 HA ASN A 51 8.693 -0.920 -17.453 1.00 0.00 H new ATOM 0 HB2 ASN A 51 7.778 -3.361 -16.952 1.00 0.00 H new ATOM 0 HB3 ASN A 51 6.313 -2.825 -17.752 1.00 0.00 H new ATOM 0 HD21 ASN A 51 7.787 -2.823 -21.050 1.00 0.00 H new ATOM 0 HD22 ASN A 51 6.405 -2.314 -20.074 1.00 0.00 H new ATOM 736 N SER A 52 6.663 0.974 -17.503 1.00 0.00 N ATOM 737 CA SER A 52 5.798 1.981 -18.183 1.00 0.00 C ATOM 738 C SER A 52 6.593 3.260 -18.461 1.00 0.00 C ATOM 739 O SER A 52 6.912 4.011 -17.561 1.00 0.00 O ATOM 740 CB SER A 52 4.665 2.260 -17.196 1.00 0.00 C ATOM 741 OG SER A 52 5.161 3.044 -16.119 1.00 0.00 O ATOM 0 H SER A 52 7.148 1.311 -16.671 1.00 0.00 H new ATOM 0 HA SER A 52 5.425 1.624 -19.143 1.00 0.00 H new ATOM 0 HB2 SER A 52 3.851 2.784 -17.698 1.00 0.00 H new ATOM 0 HB3 SER A 52 4.256 1.322 -16.820 1.00 0.00 H new ATOM 0 HG SER A 52 6.082 3.319 -16.312 1.00 0.00 H new ATOM 747 N SER A 53 6.913 3.513 -19.704 1.00 0.00 N ATOM 748 CA SER A 53 7.684 4.746 -20.040 1.00 0.00 C ATOM 749 C SER A 53 6.898 5.986 -19.604 1.00 0.00 C ATOM 750 O SER A 53 5.685 5.961 -19.520 1.00 0.00 O ATOM 751 CB SER A 53 7.841 4.717 -21.559 1.00 0.00 C ATOM 752 OG SER A 53 8.733 5.749 -21.959 1.00 0.00 O ATOM 0 H SER A 53 6.674 2.920 -20.499 1.00 0.00 H new ATOM 0 HA SER A 53 8.649 4.783 -19.535 1.00 0.00 H new ATOM 0 HB2 SER A 53 8.222 3.747 -21.878 1.00 0.00 H new ATOM 0 HB3 SER A 53 6.872 4.852 -22.039 1.00 0.00 H new ATOM 0 HG SER A 53 8.837 5.732 -22.933 1.00 0.00 H new ATOM 758 N VAL A 54 7.575 7.067 -19.320 1.00 0.00 N ATOM 759 CA VAL A 54 6.855 8.301 -18.884 1.00 0.00 C ATOM 760 C VAL A 54 5.808 8.715 -19.919 1.00 0.00 C ATOM 761 O VAL A 54 4.768 9.219 -19.571 1.00 0.00 O ATOM 762 CB VAL A 54 7.918 9.383 -18.722 1.00 0.00 C ATOM 763 CG1 VAL A 54 7.247 10.688 -18.269 1.00 0.00 C ATOM 764 CG2 VAL A 54 8.930 8.934 -17.662 1.00 0.00 C ATOM 0 H VAL A 54 8.590 7.150 -19.370 1.00 0.00 H new ATOM 0 HA VAL A 54 6.319 8.134 -17.949 1.00 0.00 H new ATOM 0 HB VAL A 54 8.428 9.547 -19.671 1.00 0.00 H new ATOM 0 HG11 VAL A 54 8.003 11.464 -18.152 1.00 0.00 H new ATOM 0 HG12 VAL A 54 6.518 11.001 -19.017 1.00 0.00 H new ATOM 0 HG13 VAL A 54 6.743 10.526 -17.316 1.00 0.00 H new ATOM 0 HG21 VAL A 54 9.694 9.702 -17.540 1.00 0.00 H new ATOM 0 HG22 VAL A 54 8.417 8.778 -16.713 1.00 0.00 H new ATOM 0 HG23 VAL A 54 9.399 8.003 -17.979 1.00 0.00 H new ATOM 774 N GLN A 55 6.064 8.523 -21.184 1.00 0.00 N ATOM 775 CA GLN A 55 5.051 8.930 -22.209 1.00 0.00 C ATOM 776 C GLN A 55 3.665 8.399 -21.812 1.00 0.00 C ATOM 777 O GLN A 55 2.674 9.103 -21.884 1.00 0.00 O ATOM 778 CB GLN A 55 5.521 8.283 -23.514 1.00 0.00 C ATOM 779 CG GLN A 55 4.743 8.880 -24.689 1.00 0.00 C ATOM 780 CD GLN A 55 4.504 7.799 -25.745 1.00 0.00 C ATOM 781 OE1 GLN A 55 5.406 7.436 -26.474 1.00 0.00 O ATOM 782 NE2 GLN A 55 3.318 7.268 -25.859 1.00 0.00 N ATOM 0 H GLN A 55 6.919 8.107 -21.553 1.00 0.00 H new ATOM 0 HA GLN A 55 4.966 10.013 -22.303 1.00 0.00 H new ATOM 0 HB2 GLN A 55 6.590 8.449 -23.650 1.00 0.00 H new ATOM 0 HB3 GLN A 55 5.368 7.205 -23.473 1.00 0.00 H new ATOM 0 HG2 GLN A 55 3.791 9.281 -24.342 1.00 0.00 H new ATOM 0 HG3 GLN A 55 5.300 9.711 -25.123 1.00 0.00 H new ATOM 0 HE21 GLN A 55 2.562 7.573 -25.247 1.00 0.00 H new ATOM 0 HE22 GLN A 55 3.147 6.547 -26.560 1.00 0.00 H new ATOM 791 N GLN A 56 3.595 7.169 -21.378 1.00 0.00 N ATOM 792 CA GLN A 56 2.282 6.595 -20.960 1.00 0.00 C ATOM 793 C GLN A 56 1.890 7.117 -19.571 1.00 0.00 C ATOM 794 O GLN A 56 0.745 7.440 -19.323 1.00 0.00 O ATOM 795 CB GLN A 56 2.508 5.082 -20.921 1.00 0.00 C ATOM 796 CG GLN A 56 1.203 4.377 -20.543 1.00 0.00 C ATOM 797 CD GLN A 56 0.407 4.062 -21.809 1.00 0.00 C ATOM 798 OE1 GLN A 56 0.541 4.739 -22.810 1.00 0.00 O ATOM 799 NE2 GLN A 56 -0.425 3.056 -21.810 1.00 0.00 N ATOM 0 H GLN A 56 4.391 6.536 -21.295 1.00 0.00 H new ATOM 0 HA GLN A 56 1.476 6.871 -21.640 1.00 0.00 H new ATOM 0 HB2 GLN A 56 2.854 4.731 -21.893 1.00 0.00 H new ATOM 0 HB3 GLN A 56 3.287 4.839 -20.198 1.00 0.00 H new ATOM 0 HG2 GLN A 56 1.419 3.458 -19.998 1.00 0.00 H new ATOM 0 HG3 GLN A 56 0.615 5.010 -19.879 1.00 0.00 H new ATOM 0 HE21 GLN A 56 -0.538 2.487 -20.971 1.00 0.00 H new ATOM 0 HE22 GLN A 56 -0.962 2.839 -22.650 1.00 0.00 H new ATOM 808 N PHE A 57 2.830 7.196 -18.664 1.00 0.00 N ATOM 809 CA PHE A 57 2.507 7.692 -17.291 1.00 0.00 C ATOM 810 C PHE A 57 2.152 9.182 -17.332 1.00 0.00 C ATOM 811 O PHE A 57 1.133 9.600 -16.821 1.00 0.00 O ATOM 812 CB PHE A 57 3.784 7.464 -16.474 1.00 0.00 C ATOM 813 CG PHE A 57 3.635 8.082 -15.100 1.00 0.00 C ATOM 814 CD1 PHE A 57 2.484 7.836 -14.340 1.00 0.00 C ATOM 815 CD2 PHE A 57 4.650 8.898 -14.587 1.00 0.00 C ATOM 816 CE1 PHE A 57 2.348 8.407 -13.069 1.00 0.00 C ATOM 817 CE2 PHE A 57 4.514 9.470 -13.316 1.00 0.00 C ATOM 818 CZ PHE A 57 3.364 9.224 -12.557 1.00 0.00 C ATOM 0 H PHE A 57 3.806 6.939 -18.814 1.00 0.00 H new ATOM 0 HA PHE A 57 1.650 7.176 -16.859 1.00 0.00 H new ATOM 0 HB2 PHE A 57 3.981 6.396 -16.382 1.00 0.00 H new ATOM 0 HB3 PHE A 57 4.639 7.903 -16.989 1.00 0.00 H new ATOM 0 HD1 PHE A 57 1.701 7.205 -14.735 1.00 0.00 H new ATOM 0 HD2 PHE A 57 5.538 9.087 -15.172 1.00 0.00 H new ATOM 0 HE1 PHE A 57 1.460 8.218 -12.484 1.00 0.00 H new ATOM 0 HE2 PHE A 57 5.297 10.101 -12.921 1.00 0.00 H new ATOM 0 HZ PHE A 57 3.260 9.664 -11.576 1.00 0.00 H new ATOM 828 N LYS A 58 2.989 9.984 -17.934 1.00 0.00 N ATOM 829 CA LYS A 58 2.711 11.446 -18.007 1.00 0.00 C ATOM 830 C LYS A 58 1.358 11.687 -18.685 1.00 0.00 C ATOM 831 O LYS A 58 0.662 12.638 -18.383 1.00 0.00 O ATOM 832 CB LYS A 58 3.855 12.041 -18.839 1.00 0.00 C ATOM 833 CG LYS A 58 3.735 11.602 -20.304 1.00 0.00 C ATOM 834 CD LYS A 58 2.890 12.620 -21.077 1.00 0.00 C ATOM 835 CE LYS A 58 3.554 12.920 -22.424 1.00 0.00 C ATOM 836 NZ LYS A 58 2.846 12.053 -23.405 1.00 0.00 N ATOM 0 H LYS A 58 3.857 9.687 -18.380 1.00 0.00 H new ATOM 0 HA LYS A 58 2.659 11.906 -17.020 1.00 0.00 H new ATOM 0 HB2 LYS A 58 3.832 13.129 -18.776 1.00 0.00 H new ATOM 0 HB3 LYS A 58 4.814 11.719 -18.433 1.00 0.00 H new ATOM 0 HG2 LYS A 58 4.725 11.521 -20.752 1.00 0.00 H new ATOM 0 HG3 LYS A 58 3.277 10.615 -20.362 1.00 0.00 H new ATOM 0 HD2 LYS A 58 1.885 12.229 -21.235 1.00 0.00 H new ATOM 0 HD3 LYS A 58 2.788 13.538 -20.498 1.00 0.00 H new ATOM 0 HE2 LYS A 58 3.456 13.974 -22.686 1.00 0.00 H new ATOM 0 HE3 LYS A 58 4.620 12.696 -22.397 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 3.387 12.020 -24.293 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 2.756 11.092 -23.018 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 1.899 12.441 -23.591 1.00 0.00 H new ATOM 850 N GLU A 59 0.975 10.822 -19.589 1.00 0.00 N ATOM 851 CA GLU A 59 -0.338 10.991 -20.274 1.00 0.00 C ATOM 852 C GLU A 59 -1.445 10.339 -19.439 1.00 0.00 C ATOM 853 O GLU A 59 -2.594 10.732 -19.497 1.00 0.00 O ATOM 854 CB GLU A 59 -0.178 10.272 -21.617 1.00 0.00 C ATOM 855 CG GLU A 59 -1.488 10.350 -22.403 1.00 0.00 C ATOM 856 CD GLU A 59 -1.384 9.481 -23.658 1.00 0.00 C ATOM 857 OE1 GLU A 59 -0.807 9.943 -24.628 1.00 0.00 O ATOM 858 OE2 GLU A 59 -1.883 8.367 -23.627 1.00 0.00 O ATOM 0 H GLU A 59 1.515 10.008 -19.881 1.00 0.00 H new ATOM 0 HA GLU A 59 -0.611 12.038 -20.407 1.00 0.00 H new ATOM 0 HB2 GLU A 59 0.629 10.728 -22.191 1.00 0.00 H new ATOM 0 HB3 GLU A 59 0.097 9.230 -21.452 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -2.318 10.012 -21.782 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -1.697 11.383 -22.680 1.00 0.00 H new ATOM 865 N ALA A 60 -1.102 9.349 -18.659 1.00 0.00 N ATOM 866 CA ALA A 60 -2.124 8.671 -17.809 1.00 0.00 C ATOM 867 C ALA A 60 -2.597 9.625 -16.714 1.00 0.00 C ATOM 868 O ALA A 60 -3.780 9.809 -16.498 1.00 0.00 O ATOM 869 CB ALA A 60 -1.405 7.468 -17.200 1.00 0.00 C ATOM 0 H ALA A 60 -0.155 8.979 -18.574 1.00 0.00 H new ATOM 0 HA ALA A 60 -3.004 8.368 -18.377 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -2.095 6.918 -16.560 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -1.050 6.815 -17.997 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -0.557 7.812 -16.608 1.00 0.00 H new ATOM 875 N ILE A 61 -1.672 10.233 -16.024 1.00 0.00 N ATOM 876 CA ILE A 61 -2.044 11.184 -14.936 1.00 0.00 C ATOM 877 C ILE A 61 -2.868 12.343 -15.511 1.00 0.00 C ATOM 878 O ILE A 61 -3.695 12.922 -14.835 1.00 0.00 O ATOM 879 CB ILE A 61 -0.704 11.670 -14.343 1.00 0.00 C ATOM 880 CG1 ILE A 61 -0.950 12.844 -13.377 1.00 0.00 C ATOM 881 CG2 ILE A 61 0.262 12.100 -15.459 1.00 0.00 C ATOM 882 CD1 ILE A 61 -1.143 14.156 -14.150 1.00 0.00 C ATOM 0 H ILE A 61 -0.669 10.112 -16.167 1.00 0.00 H new ATOM 0 HA ILE A 61 -2.663 10.722 -14.167 1.00 0.00 H new ATOM 0 HB ILE A 61 -0.251 10.844 -13.795 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -1.832 12.642 -12.769 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -0.107 12.941 -12.693 1.00 0.00 H new ATOM 0 HG21 ILE A 61 1.200 12.439 -15.018 1.00 0.00 H new ATOM 0 HG22 ILE A 61 0.456 11.254 -16.118 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -0.184 12.913 -16.033 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -1.315 14.971 -13.447 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -0.250 14.367 -14.738 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -2.001 14.063 -14.815 1.00 0.00 H new ATOM 894 N SER A 62 -2.647 12.688 -16.752 1.00 0.00 N ATOM 895 CA SER A 62 -3.417 13.811 -17.365 1.00 0.00 C ATOM 896 C SER A 62 -4.908 13.461 -17.432 1.00 0.00 C ATOM 897 O SER A 62 -5.758 14.272 -17.121 1.00 0.00 O ATOM 898 CB SER A 62 -2.836 13.977 -18.771 1.00 0.00 C ATOM 899 OG SER A 62 -3.445 13.040 -19.649 1.00 0.00 O ATOM 0 H SER A 62 -1.967 12.241 -17.368 1.00 0.00 H new ATOM 0 HA SER A 62 -3.336 14.729 -16.784 1.00 0.00 H new ATOM 0 HB2 SER A 62 -3.008 14.992 -19.129 1.00 0.00 H new ATOM 0 HB3 SER A 62 -1.757 13.824 -18.751 1.00 0.00 H new ATOM 0 HG SER A 62 -2.793 12.351 -19.896 1.00 0.00 H new ATOM 905 N LYS A 63 -5.231 12.264 -17.844 1.00 0.00 N ATOM 906 CA LYS A 63 -6.669 11.865 -17.940 1.00 0.00 C ATOM 907 C LYS A 63 -7.374 12.041 -16.589 1.00 0.00 C ATOM 908 O LYS A 63 -8.490 12.518 -16.521 1.00 0.00 O ATOM 909 CB LYS A 63 -6.645 10.389 -18.341 1.00 0.00 C ATOM 910 CG LYS A 63 -6.281 10.269 -19.822 1.00 0.00 C ATOM 911 CD LYS A 63 -7.545 10.409 -20.672 1.00 0.00 C ATOM 912 CE LYS A 63 -7.178 10.309 -22.154 1.00 0.00 C ATOM 913 NZ LYS A 63 -7.267 8.857 -22.475 1.00 0.00 N ATOM 0 H LYS A 63 -4.563 11.544 -18.119 1.00 0.00 H new ATOM 0 HA LYS A 63 -7.213 12.478 -18.658 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -5.921 9.847 -17.732 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -7.619 9.935 -18.157 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -5.560 11.040 -20.094 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -5.806 9.307 -20.014 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -8.260 9.629 -20.410 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -8.028 11.365 -20.470 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -7.862 10.892 -22.770 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -6.175 10.694 -22.339 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -7.029 8.708 -23.476 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -6.600 8.328 -21.878 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -8.235 8.520 -22.295 1.00 0.00 H new ATOM 927 N ARG A 64 -6.734 11.655 -15.516 1.00 0.00 N ATOM 928 CA ARG A 64 -7.373 11.798 -14.172 1.00 0.00 C ATOM 929 C ARG A 64 -7.450 13.274 -13.770 1.00 0.00 C ATOM 930 O ARG A 64 -8.497 13.774 -13.406 1.00 0.00 O ATOM 931 CB ARG A 64 -6.461 11.028 -13.215 1.00 0.00 C ATOM 932 CG ARG A 64 -7.261 10.598 -11.983 1.00 0.00 C ATOM 933 CD ARG A 64 -7.798 9.181 -12.190 1.00 0.00 C ATOM 934 NE ARG A 64 -7.816 8.574 -10.829 1.00 0.00 N ATOM 935 CZ ARG A 64 -7.509 7.316 -10.671 1.00 0.00 C ATOM 936 NH1 ARG A 64 -6.258 6.957 -10.569 1.00 0.00 N ATOM 937 NH2 ARG A 64 -8.453 6.416 -10.614 1.00 0.00 N ATOM 0 H ARG A 64 -5.799 11.248 -15.511 1.00 0.00 H new ATOM 0 HA ARG A 64 -8.394 11.416 -14.160 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -6.046 10.153 -13.716 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -5.620 11.653 -12.916 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -6.629 10.632 -11.096 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -8.086 11.289 -11.813 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -8.796 9.197 -12.628 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -7.161 8.612 -12.868 1.00 0.00 H new ATOM 0 HE ARG A 64 -8.068 9.142 -10.021 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -5.520 7.660 -10.613 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -6.018 5.973 -10.445 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -9.430 6.696 -10.693 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -8.213 5.432 -10.490 1.00 0.00 H new ATOM 951 N PHE A 65 -6.348 13.971 -13.829 1.00 0.00 N ATOM 952 CA PHE A 65 -6.349 15.416 -13.449 1.00 0.00 C ATOM 953 C PHE A 65 -7.172 16.232 -14.449 1.00 0.00 C ATOM 954 O PHE A 65 -7.839 17.181 -14.087 1.00 0.00 O ATOM 955 CB PHE A 65 -4.880 15.839 -13.488 1.00 0.00 C ATOM 956 CG PHE A 65 -4.286 15.722 -12.104 1.00 0.00 C ATOM 957 CD1 PHE A 65 -4.528 16.718 -11.151 1.00 0.00 C ATOM 958 CD2 PHE A 65 -3.494 14.616 -11.775 1.00 0.00 C ATOM 959 CE1 PHE A 65 -3.978 16.608 -9.869 1.00 0.00 C ATOM 960 CE2 PHE A 65 -2.942 14.506 -10.493 1.00 0.00 C ATOM 961 CZ PHE A 65 -3.185 15.502 -9.540 1.00 0.00 C ATOM 0 H PHE A 65 -5.444 13.603 -14.125 1.00 0.00 H new ATOM 0 HA PHE A 65 -6.794 15.582 -12.468 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -4.328 15.211 -14.187 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -4.795 16.865 -13.846 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -5.139 17.571 -11.405 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -3.309 13.847 -12.510 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -4.165 17.376 -9.133 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -2.329 13.653 -10.240 1.00 0.00 H new ATOM 0 HZ PHE A 65 -2.761 15.417 -8.550 1.00 0.00 H new ATOM 971 N LYS A 66 -7.115 15.874 -15.707 1.00 0.00 N ATOM 972 CA LYS A 66 -7.879 16.624 -16.756 1.00 0.00 C ATOM 973 C LYS A 66 -7.357 18.058 -16.865 1.00 0.00 C ATOM 974 O LYS A 66 -7.944 18.986 -16.341 1.00 0.00 O ATOM 975 CB LYS A 66 -9.347 16.614 -16.309 1.00 0.00 C ATOM 976 CG LYS A 66 -9.807 15.172 -16.081 1.00 0.00 C ATOM 977 CD LYS A 66 -11.336 15.112 -16.113 1.00 0.00 C ATOM 978 CE LYS A 66 -11.896 15.656 -14.798 1.00 0.00 C ATOM 979 NZ LYS A 66 -13.374 15.527 -14.926 1.00 0.00 N ATOM 0 H LYS A 66 -6.568 15.088 -16.057 1.00 0.00 H new ATOM 0 HA LYS A 66 -7.766 16.165 -17.738 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -9.462 17.192 -15.392 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -9.971 17.090 -17.066 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -9.391 14.521 -16.850 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -9.438 14.809 -15.122 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -11.716 15.696 -16.951 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -11.667 14.085 -16.264 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -11.523 15.089 -13.945 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -11.602 16.694 -14.643 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -13.830 15.881 -14.061 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -13.702 16.083 -15.742 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -13.624 14.527 -15.065 1.00 0.00 H new ATOM 993 N SER A 67 -6.257 18.243 -17.544 1.00 0.00 N ATOM 994 CA SER A 67 -5.685 19.612 -17.699 1.00 0.00 C ATOM 995 C SER A 67 -4.833 19.684 -18.968 1.00 0.00 C ATOM 996 O SER A 67 -5.098 20.463 -19.862 1.00 0.00 O ATOM 997 CB SER A 67 -4.819 19.822 -16.457 1.00 0.00 C ATOM 998 OG SER A 67 -4.684 21.215 -16.209 1.00 0.00 O ATOM 0 H SER A 67 -5.727 17.501 -18.001 1.00 0.00 H new ATOM 0 HA SER A 67 -6.457 20.377 -17.790 1.00 0.00 H new ATOM 0 HB2 SER A 67 -5.272 19.330 -15.596 1.00 0.00 H new ATOM 0 HB3 SER A 67 -3.838 19.370 -16.603 1.00 0.00 H new ATOM 0 HG SER A 67 -4.131 21.353 -15.412 1.00 0.00 H new ATOM 1004 N GLN A 68 -3.813 18.871 -19.053 1.00 0.00 N ATOM 1005 CA GLN A 68 -2.941 18.884 -20.265 1.00 0.00 C ATOM 1006 C GLN A 68 -1.992 17.681 -20.241 1.00 0.00 C ATOM 1007 O GLN A 68 -1.949 16.933 -19.284 1.00 0.00 O ATOM 1008 CB GLN A 68 -2.154 20.195 -20.178 1.00 0.00 C ATOM 1009 CG GLN A 68 -2.250 20.939 -21.512 1.00 0.00 C ATOM 1010 CD GLN A 68 -1.930 22.418 -21.296 1.00 0.00 C ATOM 1011 OE1 GLN A 68 -2.760 23.273 -21.536 1.00 0.00 O ATOM 1012 NE2 GLN A 68 -0.752 22.760 -20.849 1.00 0.00 N ATOM 0 H GLN A 68 -3.546 18.198 -18.335 1.00 0.00 H new ATOM 0 HA GLN A 68 -3.515 18.819 -21.189 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -2.549 20.816 -19.374 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -1.111 19.990 -19.938 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -1.555 20.507 -22.232 1.00 0.00 H new ATOM 0 HG3 GLN A 68 -3.251 20.830 -21.930 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -0.055 22.043 -20.647 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -0.529 23.744 -20.701 1.00 0.00 H new ATOM 1021 N THR A 69 -1.232 17.492 -21.288 1.00 0.00 N ATOM 1022 CA THR A 69 -0.286 16.338 -21.325 1.00 0.00 C ATOM 1023 C THR A 69 1.013 16.736 -22.032 1.00 0.00 C ATOM 1024 O THR A 69 2.097 16.422 -21.581 1.00 0.00 O ATOM 1025 CB THR A 69 -1.015 15.252 -22.118 1.00 0.00 C ATOM 1026 OG1 THR A 69 -2.298 15.032 -21.547 1.00 0.00 O ATOM 1027 CG2 THR A 69 -0.206 13.956 -22.074 1.00 0.00 C ATOM 0 H THR A 69 -1.225 18.086 -22.117 1.00 0.00 H new ATOM 0 HA THR A 69 -0.012 16.000 -20.326 1.00 0.00 H new ATOM 0 HB THR A 69 -1.128 15.572 -23.154 1.00 0.00 H new ATOM 0 HG1 THR A 69 -2.767 14.337 -22.055 1.00 0.00 H new ATOM 0 HG21 THR A 69 -0.726 13.183 -22.639 1.00 0.00 H new ATOM 0 HG22 THR A 69 0.778 14.126 -22.512 1.00 0.00 H new ATOM 0 HG23 THR A 69 -0.091 13.634 -21.039 1.00 0.00 H new ATOM 1035 N ASP A 70 0.911 17.425 -23.139 1.00 0.00 N ATOM 1036 CA ASP A 70 2.141 17.843 -23.878 1.00 0.00 C ATOM 1037 C ASP A 70 3.073 18.634 -22.954 1.00 0.00 C ATOM 1038 O ASP A 70 4.169 18.204 -22.650 1.00 0.00 O ATOM 1039 CB ASP A 70 1.637 18.731 -25.017 1.00 0.00 C ATOM 1040 CG ASP A 70 1.074 17.855 -26.137 1.00 0.00 C ATOM 1041 OD1 ASP A 70 0.257 16.998 -25.839 1.00 0.00 O ATOM 1042 OD2 ASP A 70 1.468 18.054 -27.274 1.00 0.00 O ATOM 0 H ASP A 70 0.030 17.716 -23.563 1.00 0.00 H new ATOM 0 HA ASP A 70 2.710 16.989 -24.247 1.00 0.00 H new ATOM 0 HB2 ASP A 70 0.867 19.409 -24.650 1.00 0.00 H new ATOM 0 HB3 ASP A 70 2.450 19.348 -25.398 1.00 0.00 H new ATOM 1047 N GLN A 71 2.646 19.784 -22.508 1.00 0.00 N ATOM 1048 CA GLN A 71 3.505 20.602 -21.604 1.00 0.00 C ATOM 1049 C GLN A 71 3.535 19.986 -20.201 1.00 0.00 C ATOM 1050 O GLN A 71 4.478 20.164 -19.455 1.00 0.00 O ATOM 1051 CB GLN A 71 2.844 21.981 -21.568 1.00 0.00 C ATOM 1052 CG GLN A 71 2.873 22.598 -22.969 1.00 0.00 C ATOM 1053 CD GLN A 71 1.597 23.411 -23.196 1.00 0.00 C ATOM 1054 OE1 GLN A 71 0.815 23.106 -24.075 1.00 0.00 O ATOM 1055 NE2 GLN A 71 1.352 24.442 -22.434 1.00 0.00 N ATOM 0 H GLN A 71 1.739 20.193 -22.731 1.00 0.00 H new ATOM 0 HA GLN A 71 4.537 20.653 -21.951 1.00 0.00 H new ATOM 0 HB2 GLN A 71 1.815 21.894 -21.219 1.00 0.00 H new ATOM 0 HB3 GLN A 71 3.366 22.628 -20.863 1.00 0.00 H new ATOM 0 HG2 GLN A 71 3.749 23.238 -23.078 1.00 0.00 H new ATOM 0 HG3 GLN A 71 2.956 21.814 -23.722 1.00 0.00 H new ATOM 0 HE21 GLN A 71 2.008 24.698 -21.696 1.00 0.00 H new ATOM 0 HE22 GLN A 71 0.504 24.991 -22.576 1.00 0.00 H new ATOM 1064 N LEU A 72 2.508 19.262 -19.838 1.00 0.00 N ATOM 1065 CA LEU A 72 2.470 18.632 -18.483 1.00 0.00 C ATOM 1066 C LEU A 72 3.739 17.807 -18.238 1.00 0.00 C ATOM 1067 O LEU A 72 4.228 17.125 -19.118 1.00 0.00 O ATOM 1068 CB LEU A 72 1.239 17.725 -18.501 1.00 0.00 C ATOM 1069 CG LEU A 72 0.628 17.666 -17.101 1.00 0.00 C ATOM 1070 CD1 LEU A 72 -0.424 18.767 -16.955 1.00 0.00 C ATOM 1071 CD2 LEU A 72 -0.032 16.301 -16.892 1.00 0.00 C ATOM 0 H LEU A 72 1.692 19.079 -20.422 1.00 0.00 H new ATOM 0 HA LEU A 72 2.420 19.376 -17.688 1.00 0.00 H new ATOM 0 HB2 LEU A 72 0.506 18.103 -19.214 1.00 0.00 H new ATOM 0 HB3 LEU A 72 1.517 16.724 -18.831 1.00 0.00 H new ATOM 0 HG LEU A 72 1.411 17.811 -16.357 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -0.859 18.724 -15.957 1.00 0.00 H new ATOM 0 HD12 LEU A 72 0.044 19.740 -17.105 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -1.208 18.622 -17.699 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -0.468 16.257 -15.894 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -0.815 16.157 -17.637 1.00 0.00 H new ATOM 0 HD23 LEU A 72 0.716 15.515 -16.996 1.00 0.00 H new ATOM 1083 N VAL A 73 4.274 17.868 -17.047 1.00 0.00 N ATOM 1084 CA VAL A 73 5.512 17.095 -16.734 1.00 0.00 C ATOM 1085 C VAL A 73 5.827 17.197 -15.239 1.00 0.00 C ATOM 1086 O VAL A 73 5.244 17.996 -14.533 1.00 0.00 O ATOM 1087 CB VAL A 73 6.615 17.758 -17.565 1.00 0.00 C ATOM 1088 CG1 VAL A 73 6.751 19.231 -17.175 1.00 0.00 C ATOM 1089 CG2 VAL A 73 7.945 17.044 -17.315 1.00 0.00 C ATOM 0 H VAL A 73 3.905 18.422 -16.274 1.00 0.00 H new ATOM 0 HA VAL A 73 5.412 16.035 -16.968 1.00 0.00 H new ATOM 0 HB VAL A 73 6.353 17.688 -18.621 1.00 0.00 H new ATOM 0 HG11 VAL A 73 7.537 19.694 -17.771 1.00 0.00 H new ATOM 0 HG12 VAL A 73 5.807 19.744 -17.358 1.00 0.00 H new ATOM 0 HG13 VAL A 73 7.005 19.305 -16.118 1.00 0.00 H new ATOM 0 HG21 VAL A 73 8.729 17.517 -17.907 1.00 0.00 H new ATOM 0 HG22 VAL A 73 8.200 17.109 -16.257 1.00 0.00 H new ATOM 0 HG23 VAL A 73 7.855 15.996 -17.603 1.00 0.00 H new ATOM 1099 N LEU A 74 6.747 16.407 -14.749 1.00 0.00 N ATOM 1100 CA LEU A 74 7.087 16.487 -13.302 1.00 0.00 C ATOM 1101 C LEU A 74 8.553 16.888 -13.149 1.00 0.00 C ATOM 1102 O LEU A 74 9.438 16.195 -13.599 1.00 0.00 O ATOM 1103 CB LEU A 74 6.850 15.079 -12.756 1.00 0.00 C ATOM 1104 CG LEU A 74 5.623 15.078 -11.846 1.00 0.00 C ATOM 1105 CD1 LEU A 74 5.330 13.648 -11.393 1.00 0.00 C ATOM 1106 CD2 LEU A 74 5.901 15.955 -10.622 1.00 0.00 C ATOM 0 H LEU A 74 7.272 15.716 -15.285 1.00 0.00 H new ATOM 0 HA LEU A 74 6.489 17.226 -12.768 1.00 0.00 H new ATOM 0 HB2 LEU A 74 6.705 14.379 -13.579 1.00 0.00 H new ATOM 0 HB3 LEU A 74 7.726 14.742 -12.202 1.00 0.00 H new ATOM 0 HG LEU A 74 4.763 15.471 -12.388 1.00 0.00 H new ATOM 0 HD11 LEU A 74 4.455 13.644 -10.743 1.00 0.00 H new ATOM 0 HD12 LEU A 74 5.138 13.022 -12.265 1.00 0.00 H new ATOM 0 HD13 LEU A 74 6.188 13.256 -10.847 1.00 0.00 H new ATOM 0 HD21 LEU A 74 5.028 15.957 -9.970 1.00 0.00 H new ATOM 0 HD22 LEU A 74 6.759 15.559 -10.078 1.00 0.00 H new ATOM 0 HD23 LEU A 74 6.115 16.974 -10.945 1.00 0.00 H new ATOM 1118 N ILE A 75 8.819 18.003 -12.525 1.00 0.00 N ATOM 1119 CA ILE A 75 10.235 18.433 -12.364 1.00 0.00 C ATOM 1120 C ILE A 75 10.855 17.761 -11.129 1.00 0.00 C ATOM 1121 O ILE A 75 10.604 18.135 -9.998 1.00 0.00 O ATOM 1122 CB ILE A 75 10.182 19.969 -12.241 1.00 0.00 C ATOM 1123 CG1 ILE A 75 11.572 20.564 -12.516 1.00 0.00 C ATOM 1124 CG2 ILE A 75 9.705 20.389 -10.849 1.00 0.00 C ATOM 1125 CD1 ILE A 75 12.585 20.055 -11.485 1.00 0.00 C ATOM 0 H ILE A 75 8.122 18.630 -12.123 1.00 0.00 H new ATOM 0 HA ILE A 75 10.865 18.141 -13.204 1.00 0.00 H new ATOM 0 HB ILE A 75 9.473 20.347 -12.977 1.00 0.00 H new ATOM 0 HG12 ILE A 75 11.898 20.293 -13.520 1.00 0.00 H new ATOM 0 HG13 ILE A 75 11.522 21.652 -12.480 1.00 0.00 H new ATOM 0 HG21 ILE A 75 9.676 21.477 -10.787 1.00 0.00 H new ATOM 0 HG22 ILE A 75 8.707 19.989 -10.670 1.00 0.00 H new ATOM 0 HG23 ILE A 75 10.392 20.001 -10.097 1.00 0.00 H new ATOM 0 HD11 ILE A 75 13.564 20.486 -11.694 1.00 0.00 H new ATOM 0 HD12 ILE A 75 12.265 20.348 -10.485 1.00 0.00 H new ATOM 0 HD13 ILE A 75 12.647 18.968 -11.542 1.00 0.00 H new ATOM 1137 N PHE A 76 11.664 16.760 -11.355 1.00 0.00 N ATOM 1138 CA PHE A 76 12.319 16.044 -10.220 1.00 0.00 C ATOM 1139 C PHE A 76 13.680 16.687 -9.928 1.00 0.00 C ATOM 1140 O PHE A 76 14.517 16.796 -10.800 1.00 0.00 O ATOM 1141 CB PHE A 76 12.498 14.601 -10.716 1.00 0.00 C ATOM 1142 CG PHE A 76 12.551 13.629 -9.549 1.00 0.00 C ATOM 1143 CD1 PHE A 76 12.914 14.068 -8.266 1.00 0.00 C ATOM 1144 CD2 PHE A 76 12.244 12.276 -9.759 1.00 0.00 C ATOM 1145 CE1 PHE A 76 12.965 13.160 -7.201 1.00 0.00 C ATOM 1146 CE2 PHE A 76 12.298 11.371 -8.691 1.00 0.00 C ATOM 1147 CZ PHE A 76 12.658 11.813 -7.414 1.00 0.00 C ATOM 0 H PHE A 76 11.901 16.405 -12.282 1.00 0.00 H new ATOM 0 HA PHE A 76 11.736 16.086 -9.300 1.00 0.00 H new ATOM 0 HB2 PHE A 76 11.674 14.335 -11.379 1.00 0.00 H new ATOM 0 HB3 PHE A 76 13.415 14.524 -11.300 1.00 0.00 H new ATOM 0 HD1 PHE A 76 13.154 15.108 -8.100 1.00 0.00 H new ATOM 0 HD2 PHE A 76 11.966 11.932 -10.744 1.00 0.00 H new ATOM 0 HE1 PHE A 76 13.242 13.501 -6.214 1.00 0.00 H new ATOM 0 HE2 PHE A 76 12.061 10.330 -8.854 1.00 0.00 H new ATOM 0 HZ PHE A 76 12.699 11.113 -6.592 1.00 0.00 H new ATOM 1157 N ALA A 77 13.904 17.118 -8.712 1.00 0.00 N ATOM 1158 CA ALA A 77 15.212 17.758 -8.363 1.00 0.00 C ATOM 1159 C ALA A 77 16.382 16.922 -8.898 1.00 0.00 C ATOM 1160 O ALA A 77 16.733 15.899 -8.344 1.00 0.00 O ATOM 1161 CB ALA A 77 15.239 17.798 -6.835 1.00 0.00 C ATOM 0 H ALA A 77 13.237 17.055 -7.943 1.00 0.00 H new ATOM 0 HA ALA A 77 15.310 18.751 -8.801 1.00 0.00 H new ATOM 0 HB1 ALA A 77 16.170 18.255 -6.499 1.00 0.00 H new ATOM 0 HB2 ALA A 77 14.395 18.384 -6.471 1.00 0.00 H new ATOM 0 HB3 ALA A 77 15.171 16.783 -6.443 1.00 0.00 H new ATOM 1167 N GLY A 78 16.980 17.353 -9.977 1.00 0.00 N ATOM 1168 CA GLY A 78 18.121 16.591 -10.561 1.00 0.00 C ATOM 1169 C GLY A 78 17.880 16.397 -12.059 1.00 0.00 C ATOM 1170 O GLY A 78 18.803 16.342 -12.847 1.00 0.00 O ATOM 0 H GLY A 78 16.726 18.203 -10.480 1.00 0.00 H new ATOM 0 HA2 GLY A 78 19.055 17.128 -10.397 1.00 0.00 H new ATOM 0 HA3 GLY A 78 18.219 15.624 -10.068 1.00 0.00 H new ATOM 1174 N LYS A 79 16.639 16.300 -12.454 1.00 0.00 N ATOM 1175 CA LYS A 79 16.315 16.115 -13.897 1.00 0.00 C ATOM 1176 C LYS A 79 14.821 16.363 -14.127 1.00 0.00 C ATOM 1177 O LYS A 79 14.133 16.885 -13.272 1.00 0.00 O ATOM 1178 CB LYS A 79 16.678 14.660 -14.206 1.00 0.00 C ATOM 1179 CG LYS A 79 17.447 14.593 -15.529 1.00 0.00 C ATOM 1180 CD LYS A 79 18.535 13.521 -15.435 1.00 0.00 C ATOM 1181 CE LYS A 79 19.783 13.994 -16.184 1.00 0.00 C ATOM 1182 NZ LYS A 79 20.504 14.869 -15.217 1.00 0.00 N ATOM 0 H LYS A 79 15.830 16.341 -11.834 1.00 0.00 H new ATOM 0 HA LYS A 79 16.858 16.808 -14.540 1.00 0.00 H new ATOM 0 HB2 LYS A 79 17.284 14.247 -13.400 1.00 0.00 H new ATOM 0 HB3 LYS A 79 15.774 14.054 -14.268 1.00 0.00 H new ATOM 0 HG2 LYS A 79 16.764 14.362 -16.347 1.00 0.00 H new ATOM 0 HG3 LYS A 79 17.895 15.562 -15.751 1.00 0.00 H new ATOM 0 HD2 LYS A 79 18.777 13.324 -14.391 1.00 0.00 H new ATOM 0 HD3 LYS A 79 18.175 12.584 -15.861 1.00 0.00 H new ATOM 0 HE2 LYS A 79 20.402 13.151 -16.491 1.00 0.00 H new ATOM 0 HE3 LYS A 79 19.517 14.541 -17.089 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 20.948 15.659 -15.728 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 19.831 15.243 -14.518 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 21.238 14.317 -14.729 1.00 0.00 H new ATOM 1196 N ILE A 80 14.312 15.992 -15.272 1.00 0.00 N ATOM 1197 CA ILE A 80 12.859 16.212 -15.542 1.00 0.00 C ATOM 1198 C ILE A 80 12.115 14.882 -15.534 1.00 0.00 C ATOM 1199 O ILE A 80 12.375 14.018 -16.347 1.00 0.00 O ATOM 1200 CB ILE A 80 12.761 16.847 -16.941 1.00 0.00 C ATOM 1201 CG1 ILE A 80 14.040 17.630 -17.273 1.00 0.00 C ATOM 1202 CG2 ILE A 80 11.567 17.803 -16.973 1.00 0.00 C ATOM 1203 CD1 ILE A 80 14.302 18.674 -16.185 1.00 0.00 C ATOM 0 H ILE A 80 14.834 15.549 -16.028 1.00 0.00 H new ATOM 0 HA ILE A 80 12.415 16.853 -14.780 1.00 0.00 H new ATOM 0 HB ILE A 80 12.634 16.054 -17.678 1.00 0.00 H new ATOM 0 HG12 ILE A 80 14.887 16.948 -17.347 1.00 0.00 H new ATOM 0 HG13 ILE A 80 13.938 18.118 -18.242 1.00 0.00 H new ATOM 0 HG21 ILE A 80 11.491 18.257 -17.961 1.00 0.00 H new ATOM 0 HG22 ILE A 80 10.653 17.251 -16.756 1.00 0.00 H new ATOM 0 HG23 ILE A 80 11.706 18.583 -16.225 1.00 0.00 H new ATOM 0 HD11 ILE A 80 15.210 19.228 -16.423 1.00 0.00 H new ATOM 0 HD12 ILE A 80 13.460 19.364 -16.132 1.00 0.00 H new ATOM 0 HD13 ILE A 80 14.423 18.175 -15.224 1.00 0.00 H new ATOM 1215 N LEU A 81 11.179 14.713 -14.639 1.00 0.00 N ATOM 1216 CA LEU A 81 10.412 13.442 -14.617 1.00 0.00 C ATOM 1217 C LEU A 81 9.509 13.391 -15.848 1.00 0.00 C ATOM 1218 O LEU A 81 8.301 13.526 -15.756 1.00 0.00 O ATOM 1219 CB LEU A 81 9.576 13.483 -13.335 1.00 0.00 C ATOM 1220 CG LEU A 81 9.604 12.114 -12.649 1.00 0.00 C ATOM 1221 CD1 LEU A 81 8.635 12.115 -11.464 1.00 0.00 C ATOM 1222 CD2 LEU A 81 9.179 11.030 -13.645 1.00 0.00 C ATOM 0 H LEU A 81 10.916 15.396 -13.929 1.00 0.00 H new ATOM 0 HA LEU A 81 11.055 12.562 -14.634 1.00 0.00 H new ATOM 0 HB2 LEU A 81 9.966 14.245 -12.661 1.00 0.00 H new ATOM 0 HB3 LEU A 81 8.548 13.761 -13.570 1.00 0.00 H new ATOM 0 HG LEU A 81 10.615 11.910 -12.296 1.00 0.00 H new ATOM 0 HD11 LEU A 81 8.656 11.140 -10.976 1.00 0.00 H new ATOM 0 HD12 LEU A 81 8.933 12.884 -10.751 1.00 0.00 H new ATOM 0 HD13 LEU A 81 7.626 12.322 -11.820 1.00 0.00 H new ATOM 0 HD21 LEU A 81 9.200 10.057 -13.154 1.00 0.00 H new ATOM 0 HD22 LEU A 81 8.169 11.237 -13.999 1.00 0.00 H new ATOM 0 HD23 LEU A 81 9.866 11.024 -14.492 1.00 0.00 H new ATOM 1234 N LYS A 82 10.094 13.214 -17.006 1.00 0.00 N ATOM 1235 CA LYS A 82 9.280 13.160 -18.249 1.00 0.00 C ATOM 1236 C LYS A 82 9.758 12.009 -19.153 1.00 0.00 C ATOM 1237 O LYS A 82 10.268 11.012 -18.684 1.00 0.00 O ATOM 1238 CB LYS A 82 9.459 14.534 -18.915 1.00 0.00 C ATOM 1239 CG LYS A 82 10.799 14.614 -19.648 1.00 0.00 C ATOM 1240 CD LYS A 82 11.232 16.077 -19.762 1.00 0.00 C ATOM 1241 CE LYS A 82 10.840 16.621 -21.139 1.00 0.00 C ATOM 1242 NZ LYS A 82 11.907 17.602 -21.481 1.00 0.00 N ATOM 0 H LYS A 82 11.099 13.105 -17.140 1.00 0.00 H new ATOM 0 HA LYS A 82 8.227 12.963 -18.050 1.00 0.00 H new ATOM 0 HB2 LYS A 82 8.644 14.711 -19.617 1.00 0.00 H new ATOM 0 HB3 LYS A 82 9.405 15.318 -18.160 1.00 0.00 H new ATOM 0 HG2 LYS A 82 11.554 14.041 -19.110 1.00 0.00 H new ATOM 0 HG3 LYS A 82 10.710 14.172 -20.640 1.00 0.00 H new ATOM 0 HD2 LYS A 82 10.760 16.669 -18.978 1.00 0.00 H new ATOM 0 HD3 LYS A 82 12.309 16.160 -19.620 1.00 0.00 H new ATOM 0 HE2 LYS A 82 10.786 15.822 -21.879 1.00 0.00 H new ATOM 0 HE3 LYS A 82 9.860 17.097 -21.111 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 11.709 18.019 -22.413 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 11.930 18.354 -20.763 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 12.828 17.119 -21.506 1.00 0.00 H new ATOM 1256 N ASP A 83 9.569 12.133 -20.436 1.00 0.00 N ATOM 1257 CA ASP A 83 9.975 11.038 -21.377 1.00 0.00 C ATOM 1258 C ASP A 83 11.499 10.947 -21.550 1.00 0.00 C ATOM 1259 O ASP A 83 12.005 9.988 -22.099 1.00 0.00 O ATOM 1260 CB ASP A 83 9.294 11.384 -22.700 1.00 0.00 C ATOM 1261 CG ASP A 83 9.777 12.752 -23.189 1.00 0.00 C ATOM 1262 OD1 ASP A 83 10.805 12.796 -23.843 1.00 0.00 O ATOM 1263 OD2 ASP A 83 9.110 13.731 -22.899 1.00 0.00 O ATOM 0 H ASP A 83 9.149 12.949 -20.882 1.00 0.00 H new ATOM 0 HA ASP A 83 9.675 10.062 -20.995 1.00 0.00 H new ATOM 0 HB2 ASP A 83 9.518 10.621 -23.445 1.00 0.00 H new ATOM 0 HB3 ASP A 83 8.212 11.395 -22.571 1.00 0.00 H new ATOM 1268 N GLN A 84 12.231 11.931 -21.107 1.00 0.00 N ATOM 1269 CA GLN A 84 13.719 11.894 -21.267 1.00 0.00 C ATOM 1270 C GLN A 84 14.292 10.574 -20.738 1.00 0.00 C ATOM 1271 O GLN A 84 15.262 10.058 -21.257 1.00 0.00 O ATOM 1272 CB GLN A 84 14.237 13.070 -20.438 1.00 0.00 C ATOM 1273 CG GLN A 84 15.677 13.385 -20.843 1.00 0.00 C ATOM 1274 CD GLN A 84 16.369 14.151 -19.714 1.00 0.00 C ATOM 1275 OE1 GLN A 84 15.739 14.910 -19.004 1.00 0.00 O ATOM 1276 NE2 GLN A 84 17.648 13.983 -19.516 1.00 0.00 N ATOM 0 H GLN A 84 11.866 12.761 -20.640 1.00 0.00 H new ATOM 0 HA GLN A 84 14.015 11.965 -22.314 1.00 0.00 H new ATOM 0 HB2 GLN A 84 13.605 13.944 -20.593 1.00 0.00 H new ATOM 0 HB3 GLN A 84 14.191 12.828 -19.376 1.00 0.00 H new ATOM 0 HG2 GLN A 84 16.217 12.462 -21.054 1.00 0.00 H new ATOM 0 HG3 GLN A 84 15.687 13.977 -21.758 1.00 0.00 H new ATOM 0 HE21 GLN A 84 18.177 13.346 -20.112 1.00 0.00 H new ATOM 0 HE22 GLN A 84 18.119 14.489 -18.766 1.00 0.00 H new ATOM 1285 N ASP A 85 13.699 10.022 -19.713 1.00 0.00 N ATOM 1286 CA ASP A 85 14.211 8.734 -19.159 1.00 0.00 C ATOM 1287 C ASP A 85 13.041 7.854 -18.716 1.00 0.00 C ATOM 1288 O ASP A 85 11.965 8.339 -18.429 1.00 0.00 O ATOM 1289 CB ASP A 85 15.069 9.133 -17.957 1.00 0.00 C ATOM 1290 CG ASP A 85 16.535 9.228 -18.386 1.00 0.00 C ATOM 1291 OD1 ASP A 85 17.159 8.190 -18.528 1.00 0.00 O ATOM 1292 OD2 ASP A 85 17.008 10.338 -18.563 1.00 0.00 O ATOM 0 H ASP A 85 12.884 10.406 -19.236 1.00 0.00 H new ATOM 0 HA ASP A 85 14.781 8.163 -19.892 1.00 0.00 H new ATOM 0 HB2 ASP A 85 14.733 10.090 -17.558 1.00 0.00 H new ATOM 0 HB3 ASP A 85 14.959 8.399 -17.159 1.00 0.00 H new ATOM 1297 N THR A 86 13.240 6.563 -18.656 1.00 0.00 N ATOM 1298 CA THR A 86 12.130 5.661 -18.229 1.00 0.00 C ATOM 1299 C THR A 86 11.722 5.991 -16.791 1.00 0.00 C ATOM 1300 O THR A 86 12.525 6.439 -15.994 1.00 0.00 O ATOM 1301 CB THR A 86 12.687 4.235 -18.324 1.00 0.00 C ATOM 1302 OG1 THR A 86 14.091 4.278 -18.538 1.00 0.00 O ATOM 1303 CG2 THR A 86 12.017 3.500 -19.487 1.00 0.00 C ATOM 0 H THR A 86 14.118 6.096 -18.883 1.00 0.00 H new ATOM 0 HA THR A 86 11.244 5.777 -18.853 1.00 0.00 H new ATOM 0 HB THR A 86 12.481 3.708 -17.392 1.00 0.00 H new ATOM 0 HG1 THR A 86 14.417 3.379 -18.755 1.00 0.00 H new ATOM 0 HG21 THR A 86 12.413 2.487 -19.554 1.00 0.00 H new ATOM 0 HG22 THR A 86 10.941 3.458 -19.319 1.00 0.00 H new ATOM 0 HG23 THR A 86 12.219 4.031 -20.417 1.00 0.00 H new ATOM 1311 N LEU A 87 10.477 5.786 -16.459 1.00 0.00 N ATOM 1312 CA LEU A 87 10.010 6.104 -15.079 1.00 0.00 C ATOM 1313 C LEU A 87 10.839 5.346 -14.033 1.00 0.00 C ATOM 1314 O LEU A 87 11.308 5.923 -13.072 1.00 0.00 O ATOM 1315 CB LEU A 87 8.546 5.651 -15.054 1.00 0.00 C ATOM 1316 CG LEU A 87 7.836 6.221 -13.823 1.00 0.00 C ATOM 1317 CD1 LEU A 87 8.040 7.739 -13.753 1.00 0.00 C ATOM 1318 CD2 LEU A 87 6.340 5.917 -13.918 1.00 0.00 C ATOM 0 H LEU A 87 9.762 5.412 -17.083 1.00 0.00 H new ATOM 0 HA LEU A 87 10.118 7.162 -14.839 1.00 0.00 H new ATOM 0 HB2 LEU A 87 8.040 5.983 -15.961 1.00 0.00 H new ATOM 0 HB3 LEU A 87 8.495 4.562 -15.040 1.00 0.00 H new ATOM 0 HG LEU A 87 8.253 5.763 -12.926 1.00 0.00 H new ATOM 0 HD11 LEU A 87 7.531 8.134 -12.874 1.00 0.00 H new ATOM 0 HD12 LEU A 87 9.105 7.960 -13.686 1.00 0.00 H new ATOM 0 HD13 LEU A 87 7.629 8.203 -14.650 1.00 0.00 H new ATOM 0 HD21 LEU A 87 5.830 6.321 -13.043 1.00 0.00 H new ATOM 0 HD22 LEU A 87 5.932 6.375 -14.819 1.00 0.00 H new ATOM 0 HD23 LEU A 87 6.190 4.838 -13.959 1.00 0.00 H new ATOM 1330 N ILE A 88 11.032 4.068 -14.214 1.00 0.00 N ATOM 1331 CA ILE A 88 11.842 3.291 -13.224 1.00 0.00 C ATOM 1332 C ILE A 88 13.331 3.627 -13.355 1.00 0.00 C ATOM 1333 O ILE A 88 14.116 3.354 -12.468 1.00 0.00 O ATOM 1334 CB ILE A 88 11.599 1.822 -13.565 1.00 0.00 C ATOM 1335 CG1 ILE A 88 12.021 1.545 -15.014 1.00 0.00 C ATOM 1336 CG2 ILE A 88 10.116 1.505 -13.394 1.00 0.00 C ATOM 1337 CD1 ILE A 88 13.366 0.814 -15.025 1.00 0.00 C ATOM 0 H ILE A 88 10.668 3.528 -14.999 1.00 0.00 H new ATOM 0 HA ILE A 88 11.555 3.527 -12.199 1.00 0.00 H new ATOM 0 HB ILE A 88 12.188 1.193 -12.897 1.00 0.00 H new ATOM 0 HG12 ILE A 88 11.264 0.942 -15.515 1.00 0.00 H new ATOM 0 HG13 ILE A 88 12.100 2.482 -15.566 1.00 0.00 H new ATOM 0 HG21 ILE A 88 9.938 0.457 -13.636 1.00 0.00 H new ATOM 0 HG22 ILE A 88 9.820 1.694 -12.362 1.00 0.00 H new ATOM 0 HG23 ILE A 88 9.530 2.137 -14.061 1.00 0.00 H new ATOM 0 HD11 ILE A 88 13.665 0.618 -16.055 1.00 0.00 H new ATOM 0 HD12 ILE A 88 14.121 1.433 -14.540 1.00 0.00 H new ATOM 0 HD13 ILE A 88 13.271 -0.130 -14.488 1.00 0.00 H new ATOM 1349 N GLN A 89 13.730 4.191 -14.463 1.00 0.00 N ATOM 1350 CA GLN A 89 15.173 4.514 -14.659 1.00 0.00 C ATOM 1351 C GLN A 89 15.538 5.872 -14.052 1.00 0.00 C ATOM 1352 O GLN A 89 16.700 6.216 -13.966 1.00 0.00 O ATOM 1353 CB GLN A 89 15.367 4.540 -16.172 1.00 0.00 C ATOM 1354 CG GLN A 89 16.857 4.666 -16.495 1.00 0.00 C ATOM 1355 CD GLN A 89 17.131 4.078 -17.880 1.00 0.00 C ATOM 1356 OE1 GLN A 89 17.389 4.804 -18.821 1.00 0.00 O ATOM 1357 NE2 GLN A 89 17.086 2.784 -18.048 1.00 0.00 N ATOM 0 H GLN A 89 13.120 4.442 -15.241 1.00 0.00 H new ATOM 0 HA GLN A 89 15.813 3.783 -14.165 1.00 0.00 H new ATOM 0 HB2 GLN A 89 14.964 3.630 -16.616 1.00 0.00 H new ATOM 0 HB3 GLN A 89 14.818 5.376 -16.605 1.00 0.00 H new ATOM 0 HG2 GLN A 89 17.159 5.713 -16.467 1.00 0.00 H new ATOM 0 HG3 GLN A 89 17.448 4.143 -15.743 1.00 0.00 H new ATOM 0 HE21 GLN A 89 16.870 2.175 -17.259 1.00 0.00 H new ATOM 0 HE22 GLN A 89 17.267 2.383 -18.968 1.00 0.00 H new ATOM 1366 N HIS A 90 14.574 6.657 -13.634 1.00 0.00 N ATOM 1367 CA HIS A 90 14.927 7.987 -13.050 1.00 0.00 C ATOM 1368 C HIS A 90 13.695 8.668 -12.459 1.00 0.00 C ATOM 1369 O HIS A 90 13.765 9.319 -11.434 1.00 0.00 O ATOM 1370 CB HIS A 90 15.458 8.805 -14.229 1.00 0.00 C ATOM 1371 CG HIS A 90 16.932 9.054 -14.051 1.00 0.00 C ATOM 1372 ND1 HIS A 90 17.464 9.519 -12.859 1.00 0.00 N ATOM 1373 CD2 HIS A 90 17.996 8.907 -14.905 1.00 0.00 C ATOM 1374 CE1 HIS A 90 18.794 9.635 -13.027 1.00 0.00 C ATOM 1375 NE2 HIS A 90 19.172 9.274 -14.256 1.00 0.00 N ATOM 0 H HIS A 90 13.578 6.440 -13.671 1.00 0.00 H new ATOM 0 HA HIS A 90 15.653 7.892 -12.243 1.00 0.00 H new ATOM 0 HB2 HIS A 90 15.280 8.273 -15.163 1.00 0.00 H new ATOM 0 HB3 HIS A 90 14.925 9.753 -14.296 1.00 0.00 H new ATOM 0 HD2 HIS A 90 17.931 8.559 -15.925 1.00 0.00 H new ATOM 0 HE1 HIS A 90 19.473 9.978 -12.261 1.00 0.00 H new ATOM 0 HE2 HIS A 90 20.118 9.268 -14.637 1.00 0.00 H new ATOM 1383 N GLY A 91 12.573 8.540 -13.106 1.00 0.00 N ATOM 1384 CA GLY A 91 11.343 9.198 -12.593 1.00 0.00 C ATOM 1385 C GLY A 91 11.024 8.689 -11.187 1.00 0.00 C ATOM 1386 O GLY A 91 10.733 9.460 -10.296 1.00 0.00 O ATOM 0 H GLY A 91 12.455 8.008 -13.968 1.00 0.00 H new ATOM 0 HA2 GLY A 91 11.480 10.279 -12.575 1.00 0.00 H new ATOM 0 HA3 GLY A 91 10.506 8.994 -13.261 1.00 0.00 H new ATOM 1390 N ILE A 92 11.061 7.400 -10.981 1.00 0.00 N ATOM 1391 CA ILE A 92 10.743 6.854 -9.627 1.00 0.00 C ATOM 1392 C ILE A 92 11.596 5.617 -9.340 1.00 0.00 C ATOM 1393 O ILE A 92 12.043 4.932 -10.239 1.00 0.00 O ATOM 1394 CB ILE A 92 9.257 6.453 -9.653 1.00 0.00 C ATOM 1395 CG1 ILE A 92 8.557 7.006 -10.909 1.00 0.00 C ATOM 1396 CG2 ILE A 92 8.562 6.973 -8.391 1.00 0.00 C ATOM 1397 CD1 ILE A 92 8.208 8.490 -10.735 1.00 0.00 C ATOM 0 H ILE A 92 11.296 6.703 -11.687 1.00 0.00 H new ATOM 0 HA ILE A 92 10.948 7.594 -8.853 1.00 0.00 H new ATOM 0 HB ILE A 92 9.192 5.365 -9.682 1.00 0.00 H new ATOM 0 HG12 ILE A 92 9.205 6.880 -11.776 1.00 0.00 H new ATOM 0 HG13 ILE A 92 7.649 6.436 -11.105 1.00 0.00 H new ATOM 0 HG21 ILE A 92 7.510 6.688 -8.411 1.00 0.00 H new ATOM 0 HG22 ILE A 92 9.038 6.542 -7.510 1.00 0.00 H new ATOM 0 HG23 ILE A 92 8.643 8.059 -8.352 1.00 0.00 H new ATOM 0 HD11 ILE A 92 7.715 8.856 -11.636 1.00 0.00 H new ATOM 0 HD12 ILE A 92 7.540 8.609 -9.882 1.00 0.00 H new ATOM 0 HD13 ILE A 92 9.121 9.061 -10.564 1.00 0.00 H new ATOM 1409 N HIS A 93 11.796 5.316 -8.088 1.00 0.00 N ATOM 1410 CA HIS A 93 12.589 4.111 -7.721 1.00 0.00 C ATOM 1411 C HIS A 93 11.669 3.119 -7.005 1.00 0.00 C ATOM 1412 O HIS A 93 11.701 1.930 -7.251 1.00 0.00 O ATOM 1413 CB HIS A 93 13.678 4.620 -6.774 1.00 0.00 C ATOM 1414 CG HIS A 93 14.800 5.227 -7.571 1.00 0.00 C ATOM 1415 ND1 HIS A 93 16.053 5.453 -7.024 1.00 0.00 N ATOM 1416 CD2 HIS A 93 14.876 5.664 -8.872 1.00 0.00 C ATOM 1417 CE1 HIS A 93 16.822 6.002 -7.982 1.00 0.00 C ATOM 1418 NE2 HIS A 93 16.154 6.152 -9.128 1.00 0.00 N ATOM 0 H HIS A 93 11.442 5.856 -7.299 1.00 0.00 H new ATOM 0 HA HIS A 93 13.022 3.604 -8.583 1.00 0.00 H new ATOM 0 HB2 HIS A 93 13.262 5.361 -6.091 1.00 0.00 H new ATOM 0 HB3 HIS A 93 14.055 3.800 -6.164 1.00 0.00 H new ATOM 0 HD2 HIS A 93 14.067 5.633 -9.587 1.00 0.00 H new ATOM 0 HE1 HIS A 93 17.854 6.287 -7.841 1.00 0.00 H new ATOM 0 HE2 HIS A 93 16.505 6.541 -10.003 1.00 0.00 H new ATOM 1426 N ASP A 94 10.839 3.620 -6.127 1.00 0.00 N ATOM 1427 CA ASP A 94 9.887 2.746 -5.379 1.00 0.00 C ATOM 1428 C ASP A 94 9.021 3.609 -4.455 1.00 0.00 C ATOM 1429 O ASP A 94 8.665 3.206 -3.364 1.00 0.00 O ATOM 1430 CB ASP A 94 10.762 1.794 -4.561 1.00 0.00 C ATOM 1431 CG ASP A 94 9.874 0.819 -3.786 1.00 0.00 C ATOM 1432 OD1 ASP A 94 9.069 0.152 -4.415 1.00 0.00 O ATOM 1433 OD2 ASP A 94 10.015 0.754 -2.576 1.00 0.00 O ATOM 0 H ASP A 94 10.780 4.611 -5.894 1.00 0.00 H new ATOM 0 HA ASP A 94 9.217 2.198 -6.041 1.00 0.00 H new ATOM 0 HB2 ASP A 94 11.434 1.244 -5.220 1.00 0.00 H new ATOM 0 HB3 ASP A 94 11.386 2.361 -3.870 1.00 0.00 H new ATOM 1438 N GLY A 95 8.687 4.799 -4.884 1.00 0.00 N ATOM 1439 CA GLY A 95 7.852 5.696 -4.034 1.00 0.00 C ATOM 1440 C GLY A 95 8.570 7.036 -3.853 1.00 0.00 C ATOM 1441 O GLY A 95 8.975 7.388 -2.762 1.00 0.00 O ATOM 0 H GLY A 95 8.957 5.188 -5.788 1.00 0.00 H new ATOM 0 HA2 GLY A 95 6.878 5.852 -4.498 1.00 0.00 H new ATOM 0 HA3 GLY A 95 7.672 5.233 -3.064 1.00 0.00 H new ATOM 1445 N LEU A 96 8.734 7.786 -4.914 1.00 0.00 N ATOM 1446 CA LEU A 96 9.431 9.100 -4.796 1.00 0.00 C ATOM 1447 C LEU A 96 8.449 10.246 -5.054 1.00 0.00 C ATOM 1448 O LEU A 96 7.405 10.061 -5.649 1.00 0.00 O ATOM 1449 CB LEU A 96 10.514 9.071 -5.876 1.00 0.00 C ATOM 1450 CG LEU A 96 11.816 8.533 -5.278 1.00 0.00 C ATOM 1451 CD1 LEU A 96 12.831 8.295 -6.397 1.00 0.00 C ATOM 1452 CD2 LEU A 96 12.382 9.552 -4.282 1.00 0.00 C ATOM 0 H LEU A 96 8.416 7.545 -5.853 1.00 0.00 H new ATOM 0 HA LEU A 96 9.849 9.258 -3.802 1.00 0.00 H new ATOM 0 HB2 LEU A 96 10.196 8.442 -6.708 1.00 0.00 H new ATOM 0 HB3 LEU A 96 10.671 10.073 -6.275 1.00 0.00 H new ATOM 0 HG LEU A 96 11.617 7.594 -4.762 1.00 0.00 H new ATOM 0 HD11 LEU A 96 13.758 7.912 -5.971 1.00 0.00 H new ATOM 0 HD12 LEU A 96 12.429 7.569 -7.104 1.00 0.00 H new ATOM 0 HD13 LEU A 96 13.030 9.234 -6.914 1.00 0.00 H new ATOM 0 HD21 LEU A 96 13.309 9.168 -3.856 1.00 0.00 H new ATOM 0 HD22 LEU A 96 12.581 10.492 -4.797 1.00 0.00 H new ATOM 0 HD23 LEU A 96 11.659 9.721 -3.484 1.00 0.00 H new ATOM 1464 N THR A 97 8.778 11.430 -4.610 1.00 0.00 N ATOM 1465 CA THR A 97 7.867 12.593 -4.829 1.00 0.00 C ATOM 1466 C THR A 97 8.535 13.623 -5.742 1.00 0.00 C ATOM 1467 O THR A 97 9.735 13.810 -5.708 1.00 0.00 O ATOM 1468 CB THR A 97 7.627 13.180 -3.434 1.00 0.00 C ATOM 1469 OG1 THR A 97 6.793 14.326 -3.543 1.00 0.00 O ATOM 1470 CG2 THR A 97 8.962 13.580 -2.797 1.00 0.00 C ATOM 0 H THR A 97 9.638 11.643 -4.105 1.00 0.00 H new ATOM 0 HA THR A 97 6.934 12.302 -5.312 1.00 0.00 H new ATOM 0 HB THR A 97 7.143 12.430 -2.808 1.00 0.00 H new ATOM 0 HG1 THR A 97 6.636 14.703 -2.652 1.00 0.00 H new ATOM 0 HG21 THR A 97 8.782 13.996 -1.806 1.00 0.00 H new ATOM 0 HG22 THR A 97 9.602 12.702 -2.711 1.00 0.00 H new ATOM 0 HG23 THR A 97 9.453 14.327 -3.420 1.00 0.00 H new ATOM 1478 N VAL A 98 7.766 14.288 -6.563 1.00 0.00 N ATOM 1479 CA VAL A 98 8.357 15.304 -7.485 1.00 0.00 C ATOM 1480 C VAL A 98 7.381 16.469 -7.680 1.00 0.00 C ATOM 1481 O VAL A 98 6.193 16.334 -7.462 1.00 0.00 O ATOM 1482 CB VAL A 98 8.584 14.559 -8.802 1.00 0.00 C ATOM 1483 CG1 VAL A 98 9.251 15.495 -9.810 1.00 0.00 C ATOM 1484 CG2 VAL A 98 9.492 13.351 -8.556 1.00 0.00 C ATOM 0 H VAL A 98 6.755 14.172 -6.636 1.00 0.00 H new ATOM 0 HA VAL A 98 9.282 15.730 -7.097 1.00 0.00 H new ATOM 0 HB VAL A 98 7.625 14.221 -9.196 1.00 0.00 H new ATOM 0 HG11 VAL A 98 9.413 14.964 -10.748 1.00 0.00 H new ATOM 0 HG12 VAL A 98 8.608 16.357 -9.987 1.00 0.00 H new ATOM 0 HG13 VAL A 98 10.209 15.832 -9.415 1.00 0.00 H new ATOM 0 HG21 VAL A 98 9.654 12.820 -9.494 1.00 0.00 H new ATOM 0 HG22 VAL A 98 10.450 13.690 -8.161 1.00 0.00 H new ATOM 0 HG23 VAL A 98 9.020 12.681 -7.837 1.00 0.00 H new ATOM 1494 N HIS A 99 7.871 17.616 -8.080 1.00 0.00 N ATOM 1495 CA HIS A 99 6.961 18.784 -8.277 1.00 0.00 C ATOM 1496 C HIS A 99 6.399 18.791 -9.703 1.00 0.00 C ATOM 1497 O HIS A 99 7.134 18.755 -10.668 1.00 0.00 O ATOM 1498 CB HIS A 99 7.838 20.014 -8.031 1.00 0.00 C ATOM 1499 CG HIS A 99 8.220 20.080 -6.578 1.00 0.00 C ATOM 1500 ND1 HIS A 99 9.405 20.660 -6.152 1.00 0.00 N ATOM 1501 CD2 HIS A 99 7.585 19.645 -5.440 1.00 0.00 C ATOM 1502 CE1 HIS A 99 9.446 20.558 -4.810 1.00 0.00 C ATOM 1503 NE2 HIS A 99 8.362 19.948 -4.326 1.00 0.00 N ATOM 0 H HIS A 99 8.856 17.793 -8.277 1.00 0.00 H new ATOM 0 HA HIS A 99 6.103 18.756 -7.606 1.00 0.00 H new ATOM 0 HB2 HIS A 99 8.733 19.964 -8.651 1.00 0.00 H new ATOM 0 HB3 HIS A 99 7.302 20.919 -8.318 1.00 0.00 H new ATOM 0 HD2 HIS A 99 6.628 19.144 -5.414 1.00 0.00 H new ATOM 0 HE1 HIS A 99 10.258 20.925 -4.199 1.00 0.00 H new ATOM 0 HE2 HIS A 99 8.149 19.747 -3.349 1.00 0.00 H new ATOM 1511 N LEU A 100 5.099 18.832 -9.844 1.00 0.00 N ATOM 1512 CA LEU A 100 4.496 18.837 -11.212 1.00 0.00 C ATOM 1513 C LEU A 100 4.480 20.256 -11.784 1.00 0.00 C ATOM 1514 O LEU A 100 4.310 21.223 -11.067 1.00 0.00 O ATOM 1515 CB LEU A 100 3.070 18.320 -11.021 1.00 0.00 C ATOM 1516 CG LEU A 100 2.524 17.822 -12.362 1.00 0.00 C ATOM 1517 CD1 LEU A 100 1.441 16.767 -12.119 1.00 0.00 C ATOM 1518 CD2 LEU A 100 1.928 19.000 -13.142 1.00 0.00 C ATOM 0 H LEU A 100 4.430 18.862 -9.074 1.00 0.00 H new ATOM 0 HA LEU A 100 5.063 18.222 -11.911 1.00 0.00 H new ATOM 0 HB2 LEU A 100 3.060 17.512 -10.289 1.00 0.00 H new ATOM 0 HB3 LEU A 100 2.434 19.113 -10.629 1.00 0.00 H new ATOM 0 HG LEU A 100 3.335 17.378 -12.939 1.00 0.00 H new ATOM 0 HD11 LEU A 100 1.055 16.415 -13.076 1.00 0.00 H new ATOM 0 HD12 LEU A 100 1.867 15.928 -11.569 1.00 0.00 H new ATOM 0 HD13 LEU A 100 0.629 17.206 -11.539 1.00 0.00 H new ATOM 0 HD21 LEU A 100 1.539 18.645 -14.097 1.00 0.00 H new ATOM 0 HD22 LEU A 100 1.119 19.447 -12.564 1.00 0.00 H new ATOM 0 HD23 LEU A 100 2.702 19.747 -13.320 1.00 0.00 H new ATOM 1530 N VAL A 101 4.655 20.388 -13.074 1.00 0.00 N ATOM 1531 CA VAL A 101 4.649 21.746 -13.695 1.00 0.00 C ATOM 1532 C VAL A 101 4.556 21.625 -15.220 1.00 0.00 C ATOM 1533 O VAL A 101 4.874 20.601 -15.789 1.00 0.00 O ATOM 1534 CB VAL A 101 5.981 22.379 -13.280 1.00 0.00 C ATOM 1535 CG1 VAL A 101 7.143 21.521 -13.785 1.00 0.00 C ATOM 1536 CG2 VAL A 101 6.087 23.783 -13.880 1.00 0.00 C ATOM 0 H VAL A 101 4.802 19.615 -13.723 1.00 0.00 H new ATOM 0 HA VAL A 101 3.799 22.347 -13.373 1.00 0.00 H new ATOM 0 HB VAL A 101 6.026 22.441 -12.193 1.00 0.00 H new ATOM 0 HG11 VAL A 101 8.088 21.976 -13.487 1.00 0.00 H new ATOM 0 HG12 VAL A 101 7.070 20.521 -13.356 1.00 0.00 H new ATOM 0 HG13 VAL A 101 7.100 21.453 -14.872 1.00 0.00 H new ATOM 0 HG21 VAL A 101 7.034 24.234 -13.585 1.00 0.00 H new ATOM 0 HG22 VAL A 101 6.038 23.719 -14.967 1.00 0.00 H new ATOM 0 HG23 VAL A 101 5.264 24.397 -13.516 1.00 0.00 H new ATOM 1546 N ILE A 102 4.127 22.665 -15.883 1.00 0.00 N ATOM 1547 CA ILE A 102 4.023 22.608 -17.372 1.00 0.00 C ATOM 1548 C ILE A 102 5.117 23.468 -18.012 1.00 0.00 C ATOM 1549 O ILE A 102 5.393 24.568 -17.570 1.00 0.00 O ATOM 1550 CB ILE A 102 2.631 23.146 -17.727 1.00 0.00 C ATOM 1551 CG1 ILE A 102 2.406 24.518 -17.058 1.00 0.00 C ATOM 1552 CG2 ILE A 102 1.564 22.145 -17.271 1.00 0.00 C ATOM 1553 CD1 ILE A 102 1.656 24.358 -15.730 1.00 0.00 C ATOM 0 H ILE A 102 3.845 23.550 -15.461 1.00 0.00 H new ATOM 0 HA ILE A 102 4.155 21.592 -17.744 1.00 0.00 H new ATOM 0 HB ILE A 102 2.558 23.275 -18.807 1.00 0.00 H new ATOM 0 HG12 ILE A 102 3.366 25.004 -16.883 1.00 0.00 H new ATOM 0 HG13 ILE A 102 1.838 25.165 -17.726 1.00 0.00 H new ATOM 0 HG21 ILE A 102 0.575 22.527 -17.523 1.00 0.00 H new ATOM 0 HG22 ILE A 102 1.723 21.190 -17.772 1.00 0.00 H new ATOM 0 HG23 ILE A 102 1.634 22.004 -16.192 1.00 0.00 H new ATOM 0 HD11 ILE A 102 1.508 25.338 -15.275 1.00 0.00 H new ATOM 0 HD12 ILE A 102 0.687 23.893 -15.913 1.00 0.00 H new ATOM 0 HD13 ILE A 102 2.239 23.730 -15.056 1.00 0.00 H new ATOM 1565 N LYS A 103 5.744 22.976 -19.046 1.00 0.00 N ATOM 1566 CA LYS A 103 6.821 23.764 -19.713 1.00 0.00 C ATOM 1567 C LYS A 103 6.334 24.291 -21.066 1.00 0.00 C ATOM 1568 O LYS A 103 6.379 25.494 -21.262 1.00 0.00 O ATOM 1569 CB LYS A 103 7.973 22.776 -19.905 1.00 0.00 C ATOM 1570 CG LYS A 103 8.808 22.710 -18.624 1.00 0.00 C ATOM 1571 CD LYS A 103 10.284 22.538 -18.985 1.00 0.00 C ATOM 1572 CE LYS A 103 10.976 21.691 -17.914 1.00 0.00 C ATOM 1573 NZ LYS A 103 12.234 21.215 -18.553 1.00 0.00 N ATOM 0 H LYS A 103 5.557 22.062 -19.458 1.00 0.00 H new ATOM 0 HA LYS A 103 7.121 24.632 -19.126 1.00 0.00 H new ATOM 0 HB2 LYS A 103 7.582 21.788 -20.148 1.00 0.00 H new ATOM 0 HB3 LYS A 103 8.597 23.087 -20.743 1.00 0.00 H new ATOM 0 HG2 LYS A 103 8.669 23.620 -18.040 1.00 0.00 H new ATOM 0 HG3 LYS A 103 8.475 21.878 -18.003 1.00 0.00 H new ATOM 0 HD2 LYS A 103 10.378 22.059 -19.959 1.00 0.00 H new ATOM 0 HD3 LYS A 103 10.767 23.512 -19.061 1.00 0.00 H new ATOM 0 HE2 LYS A 103 11.185 22.279 -17.020 1.00 0.00 H new ATOM 0 HE3 LYS A 103 10.349 20.855 -17.606 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 12.764 20.626 -17.879 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 12.003 20.653 -19.397 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 12.814 22.033 -18.829 1.00 0.00 H new TER 1587 LYS A 103