USER MOD reduce.3.24.130724 H: found=0, std=0, add=886, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 883 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 97 CYS SG : rot 180:sc= 0.00643 USER MOD Set 1.2: A 101 TYR OH : rot 146:sc= 0.00815 USER MOD Set 2.1: A 71 GLN : amide:sc= -0.777 K(o=-0.27,f=-0.86) USER MOD Set 2.2: A 99 ASN : amide:sc= 0.511 K(o=-0.27,f=-0.86) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot -135:sc= 0.0164 USER MOD Single : A 6 SER OG : rot 180:sc= -0.0784 USER MOD Single : A 8 MET CE :methyl 164:sc= 0 (180deg=-0.0179) USER MOD Single : A 14 ASN : amide:sc= 0.398 X(o=0.4,f=0) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 17 GLN : amide:sc= -2.09 K(o=-2.1,f=-2.7) USER MOD Single : A 25 ASN :FLIP amide:sc= -0.12 F(o=-0.64,f=-0.12) USER MOD Single : A 30 ASN : amide:sc= -0.256 K(o=-0.26,f=-1.7) USER MOD Single : A 31 SER OG : rot 130:sc= -0.0337 USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 THR OG1 : rot 75:sc= 0.446 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 HIS : no HD1:sc= -1.35 X(o=-1.3,f=-0.93) USER MOD Single : A 43 THR OG1 : rot -51:sc= 0.0676 USER MOD Single : A 44 GLN : amide:sc= -0.925 X(o=-0.93,f=-1.4) USER MOD Single : A 46 HIS : no HE2:sc= 0.00223 K(o=0.0022,f=-1.2) USER MOD Single : A 54 SER OG : rot 101:sc= 1.27 USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 57 GLN : amide:sc= -1.47 X(o=-1.5,f=-1.3) USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 63 LYS NZ :NH3+ -168:sc= 0.0648 (180deg=0.0327) USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 67 MET CE :methyl 134:sc= 0 (180deg=-0.765) USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 78 SER OG : rot 180:sc= -0.0946 USER MOD Single : A 80 SER OG : rot 150:sc= -1.3 USER MOD Single : A 84 MET CE :methyl -161:sc=-0.00898 (180deg=-0.495) USER MOD Single : A 85 ASN : amide:sc=-0.000786 X(o=-0.00079,f=-0.12) USER MOD Single : A 87 MET CE :methyl 163:sc= -0.779 (180deg=-1.13) USER MOD Single : A 92 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 ASN : amide:sc= -0.335 X(o=-0.34,f=-0.0017) USER MOD Single : A 95 GLN : amide:sc= -0.101 K(o=-0.1,f=-0.72) USER MOD Single : A 105 TYR OH : rot 180:sc= 0 USER MOD Single : A 108 HIS : no HD1:sc= -0.177 X(o=-0.18,f=-0.31) USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD Single : A 113 SER OG : rot 180:sc= 0.014 USER MOD Single : A 114 SER OG : rot -57:sc= 1.03 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -25.122 -22.565 0.278 1.00 0.00 N ATOM 2 CA GLY A 1 -25.491 -23.195 1.576 1.00 0.00 C ATOM 3 C GLY A 1 -24.490 -22.892 2.673 1.00 0.00 C ATOM 4 O GLY A 1 -23.403 -23.469 2.707 1.00 0.00 O ATOM 0 H1 GLY A 1 -25.837 -22.802 -0.439 1.00 0.00 H new ATOM 0 H2 GLY A 1 -25.077 -21.532 0.394 1.00 0.00 H new ATOM 0 H3 GLY A 1 -24.194 -22.920 -0.029 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -26.477 -22.842 1.880 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -25.565 -24.274 1.444 1.00 0.00 H new ATOM 10 N SER A 2 -24.856 -21.985 3.572 1.00 0.00 N ATOM 11 CA SER A 2 -23.982 -21.606 4.677 1.00 0.00 C ATOM 12 C SER A 2 -22.673 -21.021 4.157 1.00 0.00 C ATOM 13 O SER A 2 -22.458 -20.933 2.948 1.00 0.00 O ATOM 14 CB SER A 2 -23.695 -22.818 5.566 1.00 0.00 C ATOM 15 OG SER A 2 -24.632 -22.906 6.626 1.00 0.00 O ATOM 0 H SER A 2 -25.752 -21.498 3.558 1.00 0.00 H new ATOM 0 HA SER A 2 -24.491 -20.844 5.267 1.00 0.00 H new ATOM 0 HB2 SER A 2 -23.731 -23.728 4.968 1.00 0.00 H new ATOM 0 HB3 SER A 2 -22.687 -22.744 5.973 1.00 0.00 H new ATOM 0 HG SER A 2 -24.428 -23.689 7.179 1.00 0.00 H new ATOM 21 N SER A 3 -21.802 -20.624 5.078 1.00 0.00 N ATOM 22 CA SER A 3 -20.513 -20.047 4.714 1.00 0.00 C ATOM 23 C SER A 3 -20.699 -18.775 3.892 1.00 0.00 C ATOM 24 O SER A 3 -20.957 -18.833 2.690 1.00 0.00 O ATOM 25 CB SER A 3 -19.682 -21.060 3.925 1.00 0.00 C ATOM 26 OG SER A 3 -18.442 -20.502 3.522 1.00 0.00 O ATOM 0 H SER A 3 -21.965 -20.691 6.083 1.00 0.00 H new ATOM 0 HA SER A 3 -19.985 -19.791 5.633 1.00 0.00 H new ATOM 0 HB2 SER A 3 -19.504 -21.944 4.537 1.00 0.00 H new ATOM 0 HB3 SER A 3 -20.239 -21.387 3.047 1.00 0.00 H new ATOM 0 HG SER A 3 -17.930 -21.171 3.021 1.00 0.00 H new ATOM 32 N GLY A 4 -20.566 -17.628 4.549 1.00 0.00 N ATOM 33 CA GLY A 4 -20.722 -16.358 3.862 1.00 0.00 C ATOM 34 C GLY A 4 -19.694 -15.333 4.297 1.00 0.00 C ATOM 35 O GLY A 4 -18.551 -15.678 4.593 1.00 0.00 O ATOM 0 H GLY A 4 -20.353 -17.554 5.544 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -20.639 -16.518 2.787 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -21.722 -15.967 4.050 1.00 0.00 H new ATOM 39 N SER A 5 -20.103 -14.068 4.335 1.00 0.00 N ATOM 40 CA SER A 5 -19.208 -12.988 4.737 1.00 0.00 C ATOM 41 C SER A 5 -19.842 -12.133 5.830 1.00 0.00 C ATOM 42 O SER A 5 -19.237 -11.895 6.875 1.00 0.00 O ATOM 43 CB SER A 5 -18.855 -12.115 3.530 1.00 0.00 C ATOM 44 OG SER A 5 -17.652 -12.550 2.920 1.00 0.00 O ATOM 0 H SER A 5 -21.047 -13.766 4.093 1.00 0.00 H new ATOM 0 HA SER A 5 -18.296 -13.434 5.134 1.00 0.00 H new ATOM 0 HB2 SER A 5 -19.667 -12.148 2.804 1.00 0.00 H new ATOM 0 HB3 SER A 5 -18.751 -11.077 3.846 1.00 0.00 H new ATOM 0 HG SER A 5 -17.086 -11.775 2.723 1.00 0.00 H new ATOM 50 N SER A 6 -21.064 -11.674 5.581 1.00 0.00 N ATOM 51 CA SER A 6 -21.780 -10.846 6.543 1.00 0.00 C ATOM 52 C SER A 6 -21.014 -9.560 6.832 1.00 0.00 C ATOM 53 O SER A 6 -20.208 -9.500 7.760 1.00 0.00 O ATOM 54 CB SER A 6 -22.006 -11.621 7.844 1.00 0.00 C ATOM 55 OG SER A 6 -22.043 -13.017 7.606 1.00 0.00 O ATOM 0 H SER A 6 -21.579 -11.862 4.721 1.00 0.00 H new ATOM 0 HA SER A 6 -22.745 -10.583 6.110 1.00 0.00 H new ATOM 0 HB2 SER A 6 -21.209 -11.391 8.551 1.00 0.00 H new ATOM 0 HB3 SER A 6 -22.942 -11.302 8.303 1.00 0.00 H new ATOM 0 HG SER A 6 -22.187 -13.489 8.452 1.00 0.00 H new ATOM 61 N GLY A 7 -21.270 -8.533 6.028 1.00 0.00 N ATOM 62 CA GLY A 7 -20.595 -7.261 6.213 1.00 0.00 C ATOM 63 C GLY A 7 -19.150 -7.300 5.756 1.00 0.00 C ATOM 64 O GLY A 7 -18.311 -7.949 6.381 1.00 0.00 O ATOM 0 H GLY A 7 -21.932 -8.558 5.252 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -21.127 -6.487 5.660 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -20.632 -6.983 7.266 1.00 0.00 H new ATOM 68 N MET A 8 -18.856 -6.602 4.664 1.00 0.00 N ATOM 69 CA MET A 8 -17.503 -6.560 4.123 1.00 0.00 C ATOM 70 C MET A 8 -16.833 -5.226 4.439 1.00 0.00 C ATOM 71 O MET A 8 -17.272 -4.174 3.976 1.00 0.00 O ATOM 72 CB MET A 8 -17.527 -6.786 2.610 1.00 0.00 C ATOM 73 CG MET A 8 -16.274 -7.460 2.076 1.00 0.00 C ATOM 74 SD MET A 8 -16.174 -9.201 2.535 1.00 0.00 S ATOM 75 CE MET A 8 -14.759 -9.180 3.634 1.00 0.00 C ATOM 0 H MET A 8 -19.538 -6.057 4.136 1.00 0.00 H new ATOM 0 HA MET A 8 -16.926 -7.357 4.592 1.00 0.00 H new ATOM 0 HB2 MET A 8 -18.394 -7.396 2.356 1.00 0.00 H new ATOM 0 HB3 MET A 8 -17.655 -5.826 2.110 1.00 0.00 H new ATOM 0 HG2 MET A 8 -16.254 -7.373 0.990 1.00 0.00 H new ATOM 0 HG3 MET A 8 -15.395 -6.937 2.454 1.00 0.00 H new ATOM 0 HE1 MET A 8 -14.737 -10.101 4.217 1.00 0.00 H new ATOM 0 HE2 MET A 8 -13.844 -9.100 3.047 1.00 0.00 H new ATOM 0 HE3 MET A 8 -14.834 -8.326 4.307 1.00 0.00 H new ATOM 85 N ALA A 9 -15.767 -5.279 5.232 1.00 0.00 N ATOM 86 CA ALA A 9 -15.035 -4.075 5.609 1.00 0.00 C ATOM 87 C ALA A 9 -13.666 -4.423 6.185 1.00 0.00 C ATOM 88 O ALA A 9 -13.238 -5.576 6.140 1.00 0.00 O ATOM 89 CB ALA A 9 -15.840 -3.262 6.611 1.00 0.00 C ATOM 0 H ALA A 9 -15.391 -6.142 5.625 1.00 0.00 H new ATOM 0 HA ALA A 9 -14.881 -3.476 4.711 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -15.283 -2.366 6.884 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -16.792 -2.975 6.165 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -16.023 -3.862 7.503 1.00 0.00 H new ATOM 95 N LEU A 10 -12.984 -3.419 6.725 1.00 0.00 N ATOM 96 CA LEU A 10 -11.663 -3.618 7.311 1.00 0.00 C ATOM 97 C LEU A 10 -11.479 -2.745 8.548 1.00 0.00 C ATOM 98 O LEU A 10 -12.390 -2.020 8.948 1.00 0.00 O ATOM 99 CB LEU A 10 -10.574 -3.303 6.283 1.00 0.00 C ATOM 100 CG LEU A 10 -10.650 -4.115 4.989 1.00 0.00 C ATOM 101 CD1 LEU A 10 -9.712 -3.536 3.941 1.00 0.00 C ATOM 102 CD2 LEU A 10 -10.318 -5.575 5.256 1.00 0.00 C ATOM 0 H LEU A 10 -13.324 -2.458 6.769 1.00 0.00 H new ATOM 0 HA LEU A 10 -11.579 -4.663 7.611 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -10.628 -2.243 6.033 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -9.601 -3.473 6.744 1.00 0.00 H new ATOM 0 HG LEU A 10 -11.669 -4.059 4.606 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -9.779 -4.126 3.027 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -9.995 -2.505 3.729 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -8.688 -3.561 4.315 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -10.377 -6.138 4.324 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -9.309 -5.650 5.662 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -11.029 -5.985 5.973 1.00 0.00 H new ATOM 114 N ALA A 11 -10.297 -2.820 9.147 1.00 0.00 N ATOM 115 CA ALA A 11 -9.993 -2.037 10.339 1.00 0.00 C ATOM 116 C ALA A 11 -9.834 -0.559 9.997 1.00 0.00 C ATOM 117 O ALA A 11 -9.730 -0.189 8.828 1.00 0.00 O ATOM 118 CB ALA A 11 -8.734 -2.563 11.010 1.00 0.00 C ATOM 0 H ALA A 11 -9.533 -3.415 8.827 1.00 0.00 H new ATOM 0 HA ALA A 11 -10.828 -2.136 11.032 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -8.520 -1.969 11.898 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -8.882 -3.604 11.297 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -7.896 -2.494 10.316 1.00 0.00 H new ATOM 124 N ARG A 12 -9.817 0.283 11.026 1.00 0.00 N ATOM 125 CA ARG A 12 -9.669 1.721 10.834 1.00 0.00 C ATOM 126 C ARG A 12 -8.234 2.162 11.100 1.00 0.00 C ATOM 127 O ARG A 12 -7.606 1.720 12.062 1.00 0.00 O ATOM 128 CB ARG A 12 -10.627 2.481 11.753 1.00 0.00 C ATOM 129 CG ARG A 12 -10.868 3.919 11.325 1.00 0.00 C ATOM 130 CD ARG A 12 -11.933 4.587 12.182 1.00 0.00 C ATOM 131 NE ARG A 12 -13.241 3.953 12.025 1.00 0.00 N ATOM 132 CZ ARG A 12 -13.655 2.913 12.748 1.00 0.00 C ATOM 133 NH1 ARG A 12 -12.865 2.377 13.672 1.00 0.00 N ATOM 134 NH2 ARG A 12 -14.862 2.404 12.542 1.00 0.00 N ATOM 0 H ARG A 12 -9.904 -0.006 12.000 1.00 0.00 H new ATOM 0 HA ARG A 12 -9.913 1.950 9.797 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -11.581 1.955 11.784 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -10.226 2.475 12.767 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -9.937 4.481 11.396 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -11.175 3.942 10.279 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -11.634 4.546 13.229 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -12.006 5.641 11.913 1.00 0.00 H new ATOM 0 HE ARG A 12 -13.875 4.329 11.320 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -11.934 2.761 13.832 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -13.190 1.581 14.221 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -15.472 2.809 11.831 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -15.181 1.608 13.094 1.00 0.00 H new ATOM 148 N ALA A 13 -7.719 3.035 10.238 1.00 0.00 N ATOM 149 CA ALA A 13 -6.358 3.535 10.379 1.00 0.00 C ATOM 150 C ALA A 13 -6.350 5.037 10.645 1.00 0.00 C ATOM 151 O ALA A 13 -7.401 5.650 10.831 1.00 0.00 O ATOM 152 CB ALA A 13 -5.547 3.213 9.133 1.00 0.00 C ATOM 0 H ALA A 13 -8.225 3.410 9.435 1.00 0.00 H new ATOM 0 HA ALA A 13 -5.901 3.039 11.235 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -4.532 3.592 9.251 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -5.516 2.133 8.988 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -6.011 3.683 8.266 1.00 0.00 H new ATOM 158 N ASN A 14 -5.157 5.624 10.660 1.00 0.00 N ATOM 159 CA ASN A 14 -5.012 7.054 10.902 1.00 0.00 C ATOM 160 C ASN A 14 -3.928 7.648 10.008 1.00 0.00 C ATOM 161 O ASN A 14 -4.136 8.677 9.365 1.00 0.00 O ATOM 162 CB ASN A 14 -4.678 7.311 12.375 1.00 0.00 C ATOM 163 CG ASN A 14 -5.775 8.075 13.091 1.00 0.00 C ATOM 164 OD1 ASN A 14 -5.535 9.140 13.661 1.00 0.00 O ATOM 165 ND2 ASN A 14 -6.987 7.533 13.066 1.00 0.00 N ATOM 0 H ASN A 14 -4.277 5.131 10.507 1.00 0.00 H new ATOM 0 HA ASN A 14 -5.959 7.538 10.663 1.00 0.00 H new ATOM 0 HB2 ASN A 14 -4.514 6.359 12.879 1.00 0.00 H new ATOM 0 HB3 ASN A 14 -3.746 7.872 12.441 1.00 0.00 H new ATOM 0 HD21 ASN A 14 -7.765 8.001 13.531 1.00 0.00 H new ATOM 0 HD22 ASN A 14 -7.140 6.649 12.581 1.00 0.00 H new ATOM 172 N SER A 15 -2.772 6.993 9.972 1.00 0.00 N ATOM 173 CA SER A 15 -1.656 7.456 9.156 1.00 0.00 C ATOM 174 C SER A 15 -1.511 6.602 7.898 1.00 0.00 C ATOM 175 O SER A 15 -2.041 5.494 7.826 1.00 0.00 O ATOM 176 CB SER A 15 -0.358 7.421 9.964 1.00 0.00 C ATOM 177 OG SER A 15 -0.146 8.645 10.645 1.00 0.00 O ATOM 0 H SER A 15 -2.584 6.140 10.499 1.00 0.00 H new ATOM 0 HA SER A 15 -1.860 8.483 8.854 1.00 0.00 H new ATOM 0 HB2 SER A 15 -0.396 6.603 10.684 1.00 0.00 H new ATOM 0 HB3 SER A 15 0.482 7.221 9.299 1.00 0.00 H new ATOM 0 HG SER A 15 0.689 8.595 11.155 1.00 0.00 H new ATOM 183 N PRO A 16 -0.787 7.111 6.886 1.00 0.00 N ATOM 184 CA PRO A 16 -0.574 6.389 5.628 1.00 0.00 C ATOM 185 C PRO A 16 0.330 5.174 5.803 1.00 0.00 C ATOM 186 O PRO A 16 0.177 4.168 5.108 1.00 0.00 O ATOM 187 CB PRO A 16 0.097 7.430 4.728 1.00 0.00 C ATOM 188 CG PRO A 16 0.760 8.374 5.671 1.00 0.00 C ATOM 189 CD PRO A 16 -0.119 8.426 6.890 1.00 0.00 C ATOM 0 HA PRO A 16 -1.506 5.994 5.223 1.00 0.00 H new ATOM 0 HB2 PRO A 16 0.821 6.966 4.058 1.00 0.00 H new ATOM 0 HB3 PRO A 16 -0.634 7.943 4.103 1.00 0.00 H new ATOM 0 HG2 PRO A 16 1.762 8.031 5.927 1.00 0.00 H new ATOM 0 HG3 PRO A 16 0.866 9.362 5.224 1.00 0.00 H new ATOM 0 HD2 PRO A 16 0.463 8.578 7.799 1.00 0.00 H new ATOM 0 HD3 PRO A 16 -0.839 9.243 6.832 1.00 0.00 H new ATOM 197 N GLN A 17 1.272 5.273 6.733 1.00 0.00 N ATOM 198 CA GLN A 17 2.202 4.181 6.999 1.00 0.00 C ATOM 199 C GLN A 17 1.464 2.953 7.523 1.00 0.00 C ATOM 200 O GLN A 17 1.640 1.848 7.012 1.00 0.00 O ATOM 201 CB GLN A 17 3.264 4.622 8.009 1.00 0.00 C ATOM 202 CG GLN A 17 3.897 5.964 7.679 1.00 0.00 C ATOM 203 CD GLN A 17 3.286 7.106 8.467 1.00 0.00 C ATOM 204 OE1 GLN A 17 2.929 6.948 9.635 1.00 0.00 O ATOM 205 NE2 GLN A 17 3.161 8.265 7.831 1.00 0.00 N ATOM 0 H GLN A 17 1.413 6.098 7.316 1.00 0.00 H new ATOM 0 HA GLN A 17 2.690 3.916 6.061 1.00 0.00 H new ATOM 0 HB2 GLN A 17 2.811 4.677 8.999 1.00 0.00 H new ATOM 0 HB3 GLN A 17 4.045 3.863 8.057 1.00 0.00 H new ATOM 0 HG2 GLN A 17 4.967 5.917 7.884 1.00 0.00 H new ATOM 0 HG3 GLN A 17 3.785 6.162 6.613 1.00 0.00 H new ATOM 0 HE21 GLN A 17 3.470 8.351 6.863 1.00 0.00 H new ATOM 0 HE22 GLN A 17 2.756 9.069 8.311 1.00 0.00 H new ATOM 214 N GLU A 18 0.641 3.155 8.547 1.00 0.00 N ATOM 215 CA GLU A 18 -0.124 2.064 9.140 1.00 0.00 C ATOM 216 C GLU A 18 -1.107 1.478 8.133 1.00 0.00 C ATOM 217 O GLU A 18 -1.330 0.267 8.100 1.00 0.00 O ATOM 218 CB GLU A 18 -0.875 2.554 10.379 1.00 0.00 C ATOM 219 CG GLU A 18 -1.145 1.459 11.399 1.00 0.00 C ATOM 220 CD GLU A 18 -0.341 1.634 12.672 1.00 0.00 C ATOM 221 OE1 GLU A 18 -0.061 2.793 13.043 1.00 0.00 O ATOM 222 OE2 GLU A 18 0.009 0.611 13.299 1.00 0.00 O ATOM 0 H GLU A 18 0.487 4.064 8.983 1.00 0.00 H new ATOM 0 HA GLU A 18 0.575 1.281 9.434 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -0.297 3.347 10.854 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -1.824 2.992 10.069 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -2.207 1.450 11.643 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -0.911 0.491 10.957 1.00 0.00 H new ATOM 229 N ALA A 19 -1.695 2.344 7.314 1.00 0.00 N ATOM 230 CA ALA A 19 -2.655 1.913 6.306 1.00 0.00 C ATOM 231 C ALA A 19 -2.002 0.984 5.287 1.00 0.00 C ATOM 232 O ALA A 19 -2.573 -0.040 4.911 1.00 0.00 O ATOM 233 CB ALA A 19 -3.265 3.119 5.608 1.00 0.00 C ATOM 0 H ALA A 19 -1.523 3.349 7.329 1.00 0.00 H new ATOM 0 HA ALA A 19 -3.447 1.359 6.809 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -3.980 2.782 4.858 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -3.775 3.744 6.341 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -2.477 3.697 5.125 1.00 0.00 H new ATOM 239 N LEU A 20 -0.802 1.347 4.846 1.00 0.00 N ATOM 240 CA LEU A 20 -0.071 0.545 3.873 1.00 0.00 C ATOM 241 C LEU A 20 0.315 -0.807 4.462 1.00 0.00 C ATOM 242 O LEU A 20 0.283 -1.828 3.774 1.00 0.00 O ATOM 243 CB LEU A 20 1.182 1.288 3.405 1.00 0.00 C ATOM 244 CG LEU A 20 2.025 0.547 2.367 1.00 0.00 C ATOM 245 CD1 LEU A 20 1.408 0.680 0.984 1.00 0.00 C ATOM 246 CD2 LEU A 20 3.453 1.072 2.368 1.00 0.00 C ATOM 0 H LEU A 20 -0.316 2.191 5.147 1.00 0.00 H new ATOM 0 HA LEU A 20 -0.724 0.375 3.017 1.00 0.00 H new ATOM 0 HB2 LEU A 20 0.881 2.249 2.987 1.00 0.00 H new ATOM 0 HB3 LEU A 20 1.806 1.499 4.273 1.00 0.00 H new ATOM 0 HG LEU A 20 2.047 -0.510 2.632 1.00 0.00 H new ATOM 0 HD11 LEU A 20 2.022 0.146 0.259 1.00 0.00 H new ATOM 0 HD12 LEU A 20 0.404 0.256 0.991 1.00 0.00 H new ATOM 0 HD13 LEU A 20 1.355 1.733 0.709 1.00 0.00 H new ATOM 0 HD21 LEU A 20 4.039 0.534 1.623 1.00 0.00 H new ATOM 0 HD22 LEU A 20 3.450 2.135 2.128 1.00 0.00 H new ATOM 0 HD23 LEU A 20 3.894 0.924 3.354 1.00 0.00 H new ATOM 258 N LEU A 21 0.681 -0.808 5.741 1.00 0.00 N ATOM 259 CA LEU A 21 1.072 -2.035 6.423 1.00 0.00 C ATOM 260 C LEU A 21 -0.066 -3.048 6.418 1.00 0.00 C ATOM 261 O LEU A 21 0.158 -4.250 6.269 1.00 0.00 O ATOM 262 CB LEU A 21 1.493 -1.731 7.863 1.00 0.00 C ATOM 263 CG LEU A 21 2.111 -2.908 8.619 1.00 0.00 C ATOM 264 CD1 LEU A 21 3.422 -3.327 7.973 1.00 0.00 C ATOM 265 CD2 LEU A 21 2.326 -2.546 10.081 1.00 0.00 C ATOM 0 H LEU A 21 0.714 0.028 6.325 1.00 0.00 H new ATOM 0 HA LEU A 21 1.918 -2.464 5.886 1.00 0.00 H new ATOM 0 HB2 LEU A 21 2.210 -0.910 7.850 1.00 0.00 H new ATOM 0 HB3 LEU A 21 0.620 -1.383 8.415 1.00 0.00 H new ATOM 0 HG LEU A 21 1.421 -3.750 8.571 1.00 0.00 H new ATOM 0 HD11 LEU A 21 3.848 -4.166 8.524 1.00 0.00 H new ATOM 0 HD12 LEU A 21 3.240 -3.626 6.941 1.00 0.00 H new ATOM 0 HD13 LEU A 21 4.120 -2.490 7.990 1.00 0.00 H new ATOM 0 HD21 LEU A 21 2.766 -3.394 10.605 1.00 0.00 H new ATOM 0 HD22 LEU A 21 2.997 -1.690 10.149 1.00 0.00 H new ATOM 0 HD23 LEU A 21 1.369 -2.294 10.538 1.00 0.00 H new ATOM 277 N TRP A 22 -1.290 -2.556 6.580 1.00 0.00 N ATOM 278 CA TRP A 22 -2.466 -3.418 6.593 1.00 0.00 C ATOM 279 C TRP A 22 -2.686 -4.058 5.226 1.00 0.00 C ATOM 280 O TRP A 22 -3.189 -5.178 5.128 1.00 0.00 O ATOM 281 CB TRP A 22 -3.706 -2.620 7.000 1.00 0.00 C ATOM 282 CG TRP A 22 -4.662 -3.399 7.850 1.00 0.00 C ATOM 283 CD1 TRP A 22 -4.786 -3.341 9.209 1.00 0.00 C ATOM 284 CD2 TRP A 22 -5.628 -4.355 7.399 1.00 0.00 C ATOM 285 NE1 TRP A 22 -5.770 -4.203 9.629 1.00 0.00 N ATOM 286 CE2 TRP A 22 -6.302 -4.836 8.537 1.00 0.00 C ATOM 287 CE3 TRP A 22 -5.990 -4.851 6.143 1.00 0.00 C ATOM 288 CZ2 TRP A 22 -7.316 -5.788 8.457 1.00 0.00 C ATOM 289 CZ3 TRP A 22 -6.996 -5.796 6.064 1.00 0.00 C ATOM 290 CH2 TRP A 22 -7.649 -6.255 7.214 1.00 0.00 C ATOM 0 H TRP A 22 -1.493 -1.564 6.704 1.00 0.00 H new ATOM 0 HA TRP A 22 -2.297 -4.210 7.323 1.00 0.00 H new ATOM 0 HB2 TRP A 22 -3.393 -1.728 7.542 1.00 0.00 H new ATOM 0 HB3 TRP A 22 -4.222 -2.282 6.102 1.00 0.00 H new ATOM 0 HD1 TRP A 22 -4.197 -2.710 9.858 1.00 0.00 H new ATOM 0 HE1 TRP A 22 -6.058 -4.348 10.597 1.00 0.00 H new ATOM 0 HE3 TRP A 22 -5.493 -4.502 5.250 1.00 0.00 H new ATOM 0 HZ2 TRP A 22 -7.821 -6.144 9.343 1.00 0.00 H new ATOM 0 HZ3 TRP A 22 -7.283 -6.187 5.099 1.00 0.00 H new ATOM 0 HH2 TRP A 22 -8.432 -6.993 7.119 1.00 0.00 H new ATOM 301 N ALA A 23 -2.306 -3.340 4.175 1.00 0.00 N ATOM 302 CA ALA A 23 -2.460 -3.837 2.814 1.00 0.00 C ATOM 303 C ALA A 23 -1.438 -4.927 2.504 1.00 0.00 C ATOM 304 O ALA A 23 -1.658 -5.763 1.627 1.00 0.00 O ATOM 305 CB ALA A 23 -2.331 -2.692 1.819 1.00 0.00 C ATOM 0 H ALA A 23 -1.889 -2.411 4.240 1.00 0.00 H new ATOM 0 HA ALA A 23 -3.454 -4.275 2.725 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -2.448 -3.076 0.806 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -3.104 -1.949 2.017 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -1.349 -2.230 1.921 1.00 0.00 H new ATOM 311 N LEU A 24 -0.321 -4.911 3.224 1.00 0.00 N ATOM 312 CA LEU A 24 0.733 -5.900 3.021 1.00 0.00 C ATOM 313 C LEU A 24 0.507 -7.129 3.896 1.00 0.00 C ATOM 314 O LEU A 24 0.674 -8.262 3.445 1.00 0.00 O ATOM 315 CB LEU A 24 2.100 -5.287 3.329 1.00 0.00 C ATOM 316 CG LEU A 24 2.414 -3.992 2.575 1.00 0.00 C ATOM 317 CD1 LEU A 24 3.199 -3.036 3.459 1.00 0.00 C ATOM 318 CD2 LEU A 24 3.184 -4.294 1.297 1.00 0.00 C ATOM 0 H LEU A 24 -0.122 -4.225 3.952 1.00 0.00 H new ATOM 0 HA LEU A 24 0.706 -6.212 1.977 1.00 0.00 H new ATOM 0 HB2 LEU A 24 2.160 -5.090 4.399 1.00 0.00 H new ATOM 0 HB3 LEU A 24 2.871 -6.021 3.096 1.00 0.00 H new ATOM 0 HG LEU A 24 1.473 -3.513 2.305 1.00 0.00 H new ATOM 0 HD11 LEU A 24 3.413 -2.121 2.906 1.00 0.00 H new ATOM 0 HD12 LEU A 24 2.612 -2.795 4.345 1.00 0.00 H new ATOM 0 HD13 LEU A 24 4.136 -3.505 3.760 1.00 0.00 H new ATOM 0 HD21 LEU A 24 3.399 -3.363 0.773 1.00 0.00 H new ATOM 0 HD22 LEU A 24 4.120 -4.795 1.546 1.00 0.00 H new ATOM 0 HD23 LEU A 24 2.585 -4.941 0.656 1.00 0.00 H new ATOM 330 N ASN A 25 0.131 -6.897 5.150 1.00 0.00 N ATOM 331 CA ASN A 25 -0.114 -7.986 6.089 1.00 0.00 C ATOM 332 C ASN A 25 -1.314 -8.824 5.656 1.00 0.00 C ATOM 333 O ASN A 25 -1.339 -10.038 5.856 1.00 0.00 O ATOM 334 CB ASN A 25 -0.344 -7.431 7.495 1.00 0.00 C ATOM 335 CG ASN A 25 0.932 -7.377 8.312 1.00 0.00 C ATOM 336 OD1 ASN A 25 1.928 -6.658 7.807 1.00 0.00 O flip ATOM 337 ND2 ASN A 25 1.024 -7.976 9.384 1.00 0.00 N flip ATOM 0 H ASN A 25 -0.011 -5.965 5.539 1.00 0.00 H new ATOM 0 HA ASN A 25 0.767 -8.628 6.098 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -0.768 -6.430 7.422 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -1.077 -8.051 8.012 1.00 0.00 H new ATOM 0 HD21 ASN A 25 0.234 -8.517 9.735 1.00 0.00 H new ATOM 0 HD22 ASN A 25 1.890 -7.931 9.921 1.00 0.00 H new ATOM 344 N ASP A 26 -2.306 -8.168 5.065 1.00 0.00 N ATOM 345 CA ASP A 26 -3.509 -8.854 4.607 1.00 0.00 C ATOM 346 C ASP A 26 -3.180 -9.862 3.509 1.00 0.00 C ATOM 347 O ASP A 26 -3.870 -10.869 3.352 1.00 0.00 O ATOM 348 CB ASP A 26 -4.536 -7.843 4.096 1.00 0.00 C ATOM 349 CG ASP A 26 -5.931 -8.431 4.005 1.00 0.00 C ATOM 350 OD1 ASP A 26 -6.582 -8.579 5.060 1.00 0.00 O ATOM 351 OD2 ASP A 26 -6.372 -8.745 2.879 1.00 0.00 O ATOM 0 H ASP A 26 -2.301 -7.163 4.892 1.00 0.00 H new ATOM 0 HA ASP A 26 -3.931 -9.394 5.454 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -4.552 -6.978 4.760 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -4.231 -7.485 3.113 1.00 0.00 H new ATOM 356 N LEU A 27 -2.125 -9.584 2.750 1.00 0.00 N ATOM 357 CA LEU A 27 -1.707 -10.467 1.667 1.00 0.00 C ATOM 358 C LEU A 27 -1.416 -11.871 2.187 1.00 0.00 C ATOM 359 O LEU A 27 -0.966 -12.043 3.320 1.00 0.00 O ATOM 360 CB LEU A 27 -0.467 -9.904 0.971 1.00 0.00 C ATOM 361 CG LEU A 27 -0.622 -8.489 0.411 1.00 0.00 C ATOM 362 CD1 LEU A 27 0.671 -8.028 -0.240 1.00 0.00 C ATOM 363 CD2 LEU A 27 -1.772 -8.435 -0.584 1.00 0.00 C ATOM 0 H LEU A 27 -1.544 -8.754 2.865 1.00 0.00 H new ATOM 0 HA LEU A 27 -2.524 -10.528 0.949 1.00 0.00 H new ATOM 0 HB2 LEU A 27 0.361 -9.909 1.679 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -0.193 -10.573 0.155 1.00 0.00 H new ATOM 0 HG LEU A 27 -0.849 -7.814 1.236 1.00 0.00 H new ATOM 0 HD11 LEU A 27 0.541 -7.019 -0.632 1.00 0.00 H new ATOM 0 HD12 LEU A 27 1.471 -8.029 0.500 1.00 0.00 H new ATOM 0 HD13 LEU A 27 0.929 -8.704 -1.055 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -1.869 -7.421 -0.973 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -1.574 -9.122 -1.407 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -2.698 -8.723 -0.086 1.00 0.00 H new ATOM 375 N GLU A 28 -1.675 -12.872 1.352 1.00 0.00 N ATOM 376 CA GLU A 28 -1.440 -14.261 1.726 1.00 0.00 C ATOM 377 C GLU A 28 0.010 -14.655 1.460 1.00 0.00 C ATOM 378 O GLU A 28 0.845 -13.809 1.140 1.00 0.00 O ATOM 379 CB GLU A 28 -2.387 -15.186 0.959 1.00 0.00 C ATOM 380 CG GLU A 28 -3.516 -15.741 1.811 1.00 0.00 C ATOM 381 CD GLU A 28 -3.088 -16.939 2.637 1.00 0.00 C ATOM 382 OE1 GLU A 28 -2.360 -17.800 2.101 1.00 0.00 O ATOM 383 OE2 GLU A 28 -3.481 -17.016 3.821 1.00 0.00 O ATOM 0 H GLU A 28 -2.048 -12.746 0.411 1.00 0.00 H new ATOM 0 HA GLU A 28 -1.635 -14.364 2.793 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -2.813 -14.640 0.117 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -1.814 -16.015 0.544 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -3.883 -14.959 2.475 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -4.346 -16.027 1.166 1.00 0.00 H new ATOM 390 N GLU A 29 0.302 -15.944 1.592 1.00 0.00 N ATOM 391 CA GLU A 29 1.651 -16.449 1.364 1.00 0.00 C ATOM 392 C GLU A 29 1.987 -16.455 -0.123 1.00 0.00 C ATOM 393 O GLU A 29 3.079 -16.052 -0.525 1.00 0.00 O ATOM 394 CB GLU A 29 1.793 -17.861 1.936 1.00 0.00 C ATOM 395 CG GLU A 29 3.235 -18.329 2.048 1.00 0.00 C ATOM 396 CD GLU A 29 3.870 -17.948 3.371 1.00 0.00 C ATOM 397 OE1 GLU A 29 3.125 -17.768 4.357 1.00 0.00 O ATOM 398 OE2 GLU A 29 5.113 -17.828 3.420 1.00 0.00 O ATOM 0 H GLU A 29 -0.377 -16.658 1.856 1.00 0.00 H new ATOM 0 HA GLU A 29 2.350 -15.786 1.873 1.00 0.00 H new ATOM 0 HB2 GLU A 29 1.332 -17.892 2.923 1.00 0.00 H new ATOM 0 HB3 GLU A 29 1.242 -18.557 1.304 1.00 0.00 H new ATOM 0 HG2 GLU A 29 3.272 -19.412 1.930 1.00 0.00 H new ATOM 0 HG3 GLU A 29 3.817 -17.899 1.233 1.00 0.00 H new ATOM 405 N ASN A 30 1.042 -16.914 -0.938 1.00 0.00 N ATOM 406 CA ASN A 30 1.239 -16.973 -2.382 1.00 0.00 C ATOM 407 C ASN A 30 1.326 -15.572 -2.980 1.00 0.00 C ATOM 408 O ASN A 30 2.113 -15.325 -3.894 1.00 0.00 O ATOM 409 CB ASN A 30 0.099 -17.751 -3.041 1.00 0.00 C ATOM 410 CG ASN A 30 -0.182 -19.068 -2.345 1.00 0.00 C ATOM 411 OD1 ASN A 30 0.628 -19.550 -1.554 1.00 0.00 O ATOM 412 ND2 ASN A 30 -1.336 -19.657 -2.637 1.00 0.00 N ATOM 0 H ASN A 30 0.132 -17.250 -0.623 1.00 0.00 H new ATOM 0 HA ASN A 30 2.181 -17.488 -2.573 1.00 0.00 H new ATOM 0 HB2 ASN A 30 -0.804 -17.141 -3.035 1.00 0.00 H new ATOM 0 HB3 ASN A 30 0.349 -17.941 -4.085 1.00 0.00 H new ATOM 0 HD21 ASN A 30 -1.580 -20.545 -2.199 1.00 0.00 H new ATOM 0 HD22 ASN A 30 -1.978 -19.221 -3.299 1.00 0.00 H new ATOM 419 N SER A 31 0.513 -14.660 -2.458 1.00 0.00 N ATOM 420 CA SER A 31 0.498 -13.284 -2.941 1.00 0.00 C ATOM 421 C SER A 31 1.831 -12.594 -2.671 1.00 0.00 C ATOM 422 O SER A 31 2.478 -12.090 -3.589 1.00 0.00 O ATOM 423 CB SER A 31 -0.637 -12.501 -2.278 1.00 0.00 C ATOM 424 OG SER A 31 -0.486 -11.108 -2.487 1.00 0.00 O ATOM 0 H SER A 31 -0.144 -14.849 -1.701 1.00 0.00 H new ATOM 0 HA SER A 31 0.335 -13.308 -4.018 1.00 0.00 H new ATOM 0 HB2 SER A 31 -1.594 -12.831 -2.681 1.00 0.00 H new ATOM 0 HB3 SER A 31 -0.652 -12.712 -1.209 1.00 0.00 H new ATOM 0 HG SER A 31 -1.328 -10.734 -2.822 1.00 0.00 H new ATOM 430 N PHE A 32 2.235 -12.573 -1.405 1.00 0.00 N ATOM 431 CA PHE A 32 3.490 -11.943 -1.011 1.00 0.00 C ATOM 432 C PHE A 32 4.675 -12.574 -1.736 1.00 0.00 C ATOM 433 O PHE A 32 5.706 -11.930 -1.936 1.00 0.00 O ATOM 434 CB PHE A 32 3.686 -12.054 0.502 1.00 0.00 C ATOM 435 CG PHE A 32 4.402 -10.878 1.102 1.00 0.00 C ATOM 436 CD1 PHE A 32 4.013 -9.584 0.796 1.00 0.00 C ATOM 437 CD2 PHE A 32 5.464 -11.067 1.973 1.00 0.00 C ATOM 438 CE1 PHE A 32 4.669 -8.500 1.347 1.00 0.00 C ATOM 439 CE2 PHE A 32 6.124 -9.986 2.526 1.00 0.00 C ATOM 440 CZ PHE A 32 5.726 -8.701 2.213 1.00 0.00 C ATOM 0 H PHE A 32 1.711 -12.986 -0.633 1.00 0.00 H new ATOM 0 HA PHE A 32 3.439 -10.891 -1.290 1.00 0.00 H new ATOM 0 HB2 PHE A 32 2.712 -12.158 0.980 1.00 0.00 H new ATOM 0 HB3 PHE A 32 4.248 -12.962 0.722 1.00 0.00 H new ATOM 0 HD1 PHE A 32 3.188 -9.421 0.119 1.00 0.00 H new ATOM 0 HD2 PHE A 32 5.779 -12.070 2.222 1.00 0.00 H new ATOM 0 HE1 PHE A 32 4.355 -7.496 1.101 1.00 0.00 H new ATOM 0 HE2 PHE A 32 6.951 -10.146 3.203 1.00 0.00 H new ATOM 0 HZ PHE A 32 6.240 -7.855 2.645 1.00 0.00 H new ATOM 450 N LYS A 33 4.525 -13.837 -2.125 1.00 0.00 N ATOM 451 CA LYS A 33 5.588 -14.551 -2.824 1.00 0.00 C ATOM 452 C LYS A 33 5.756 -14.031 -4.250 1.00 0.00 C ATOM 453 O LYS A 33 6.870 -13.965 -4.768 1.00 0.00 O ATOM 454 CB LYS A 33 5.291 -16.054 -2.846 1.00 0.00 C ATOM 455 CG LYS A 33 6.353 -16.894 -2.152 1.00 0.00 C ATOM 456 CD LYS A 33 5.753 -17.786 -1.075 1.00 0.00 C ATOM 457 CE LYS A 33 5.865 -19.258 -1.441 1.00 0.00 C ATOM 458 NZ LYS A 33 4.928 -19.631 -2.536 1.00 0.00 N ATOM 0 H LYS A 33 3.680 -14.386 -1.968 1.00 0.00 H new ATOM 0 HA LYS A 33 6.520 -14.378 -2.286 1.00 0.00 H new ATOM 0 HB2 LYS A 33 4.328 -16.233 -2.368 1.00 0.00 H new ATOM 0 HB3 LYS A 33 5.199 -16.383 -3.881 1.00 0.00 H new ATOM 0 HG2 LYS A 33 6.868 -17.510 -2.889 1.00 0.00 H new ATOM 0 HG3 LYS A 33 7.101 -16.238 -1.706 1.00 0.00 H new ATOM 0 HD2 LYS A 33 6.262 -17.606 -0.128 1.00 0.00 H new ATOM 0 HD3 LYS A 33 4.705 -17.526 -0.928 1.00 0.00 H new ATOM 0 HE2 LYS A 33 6.887 -19.479 -1.747 1.00 0.00 H new ATOM 0 HE3 LYS A 33 5.657 -19.868 -0.562 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 5.035 -20.642 -2.756 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 3.950 -19.444 -2.235 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 5.143 -19.068 -3.384 1.00 0.00 H new ATOM 472 N THR A 34 4.643 -13.665 -4.878 1.00 0.00 N ATOM 473 CA THR A 34 4.671 -13.155 -6.245 1.00 0.00 C ATOM 474 C THR A 34 4.761 -11.633 -6.262 1.00 0.00 C ATOM 475 O THR A 34 5.332 -11.046 -7.182 1.00 0.00 O ATOM 476 CB THR A 34 3.425 -13.612 -7.006 1.00 0.00 C ATOM 477 OG1 THR A 34 3.121 -14.963 -6.706 1.00 0.00 O ATOM 478 CG2 THR A 34 3.566 -13.495 -8.507 1.00 0.00 C ATOM 0 H THR A 34 3.712 -13.712 -4.463 1.00 0.00 H new ATOM 0 HA THR A 34 5.558 -13.556 -6.735 1.00 0.00 H new ATOM 0 HB THR A 34 2.626 -12.946 -6.679 1.00 0.00 H new ATOM 0 HG1 THR A 34 2.725 -15.018 -5.811 1.00 0.00 H new ATOM 0 HG21 THR A 34 2.648 -13.835 -8.986 1.00 0.00 H new ATOM 0 HG22 THR A 34 3.752 -12.455 -8.775 1.00 0.00 H new ATOM 0 HG23 THR A 34 4.400 -14.111 -8.843 1.00 0.00 H new ATOM 486 N LEU A 35 4.194 -10.998 -5.242 1.00 0.00 N ATOM 487 CA LEU A 35 4.210 -9.543 -5.144 1.00 0.00 C ATOM 488 C LEU A 35 5.617 -9.027 -4.860 1.00 0.00 C ATOM 489 O LEU A 35 5.984 -7.930 -5.285 1.00 0.00 O ATOM 490 CB LEU A 35 3.253 -9.076 -4.045 1.00 0.00 C ATOM 491 CG LEU A 35 3.093 -7.560 -3.926 1.00 0.00 C ATOM 492 CD1 LEU A 35 1.899 -7.084 -4.739 1.00 0.00 C ATOM 493 CD2 LEU A 35 2.944 -7.151 -2.468 1.00 0.00 C ATOM 0 H LEU A 35 3.718 -11.468 -4.472 1.00 0.00 H new ATOM 0 HA LEU A 35 3.883 -9.138 -6.102 1.00 0.00 H new ATOM 0 HB2 LEU A 35 2.273 -9.516 -4.227 1.00 0.00 H new ATOM 0 HB3 LEU A 35 3.604 -9.465 -3.089 1.00 0.00 H new ATOM 0 HG LEU A 35 3.991 -7.088 -4.325 1.00 0.00 H new ATOM 0 HD11 LEU A 35 1.801 -6.003 -4.642 1.00 0.00 H new ATOM 0 HD12 LEU A 35 2.046 -7.343 -5.788 1.00 0.00 H new ATOM 0 HD13 LEU A 35 0.993 -7.565 -4.371 1.00 0.00 H new ATOM 0 HD21 LEU A 35 2.831 -6.069 -2.403 1.00 0.00 H new ATOM 0 HD22 LEU A 35 2.064 -7.634 -2.043 1.00 0.00 H new ATOM 0 HD23 LEU A 35 3.830 -7.457 -1.912 1.00 0.00 H new ATOM 505 N LYS A 36 6.399 -9.821 -4.137 1.00 0.00 N ATOM 506 CA LYS A 36 7.766 -9.443 -3.793 1.00 0.00 C ATOM 507 C LYS A 36 8.606 -9.212 -5.047 1.00 0.00 C ATOM 508 O LYS A 36 9.534 -8.403 -5.043 1.00 0.00 O ATOM 509 CB LYS A 36 8.411 -10.525 -2.922 1.00 0.00 C ATOM 510 CG LYS A 36 8.867 -10.018 -1.562 1.00 0.00 C ATOM 511 CD LYS A 36 8.345 -10.893 -0.433 1.00 0.00 C ATOM 512 CE LYS A 36 9.079 -12.224 -0.372 1.00 0.00 C ATOM 513 NZ LYS A 36 9.984 -12.307 0.809 1.00 0.00 N ATOM 0 H LYS A 36 6.110 -10.731 -3.777 1.00 0.00 H new ATOM 0 HA LYS A 36 7.726 -8.509 -3.233 1.00 0.00 H new ATOM 0 HB2 LYS A 36 7.698 -11.337 -2.778 1.00 0.00 H new ATOM 0 HB3 LYS A 36 9.268 -10.943 -3.451 1.00 0.00 H new ATOM 0 HG2 LYS A 36 9.956 -9.993 -1.529 1.00 0.00 H new ATOM 0 HG3 LYS A 36 8.520 -8.995 -1.420 1.00 0.00 H new ATOM 0 HD2 LYS A 36 8.459 -10.370 0.516 1.00 0.00 H new ATOM 0 HD3 LYS A 36 7.279 -11.071 -0.573 1.00 0.00 H new ATOM 0 HE2 LYS A 36 8.354 -13.037 -0.331 1.00 0.00 H new ATOM 0 HE3 LYS A 36 9.660 -12.360 -1.284 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 10.465 -13.229 0.814 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 10.692 -11.547 0.758 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 9.427 -12.203 1.681 1.00 0.00 H new ATOM 527 N PHE A 37 8.276 -9.928 -6.118 1.00 0.00 N ATOM 528 CA PHE A 37 9.004 -9.800 -7.375 1.00 0.00 C ATOM 529 C PHE A 37 8.503 -8.603 -8.180 1.00 0.00 C ATOM 530 O PHE A 37 9.259 -7.990 -8.932 1.00 0.00 O ATOM 531 CB PHE A 37 8.865 -11.083 -8.198 1.00 0.00 C ATOM 532 CG PHE A 37 10.181 -11.733 -8.522 1.00 0.00 C ATOM 533 CD1 PHE A 37 11.012 -11.198 -9.491 1.00 0.00 C ATOM 534 CD2 PHE A 37 10.585 -12.879 -7.855 1.00 0.00 C ATOM 535 CE1 PHE A 37 12.224 -11.792 -9.791 1.00 0.00 C ATOM 536 CE2 PHE A 37 11.795 -13.478 -8.150 1.00 0.00 C ATOM 537 CZ PHE A 37 12.615 -12.934 -9.119 1.00 0.00 C ATOM 0 H PHE A 37 7.510 -10.602 -6.140 1.00 0.00 H new ATOM 0 HA PHE A 37 10.056 -9.637 -7.142 1.00 0.00 H new ATOM 0 HB2 PHE A 37 8.244 -11.791 -7.650 1.00 0.00 H new ATOM 0 HB3 PHE A 37 8.343 -10.854 -9.127 1.00 0.00 H new ATOM 0 HD1 PHE A 37 10.710 -10.306 -10.019 1.00 0.00 H new ATOM 0 HD2 PHE A 37 9.947 -13.308 -7.097 1.00 0.00 H new ATOM 0 HE1 PHE A 37 12.864 -11.364 -10.549 1.00 0.00 H new ATOM 0 HE2 PHE A 37 12.099 -14.371 -7.623 1.00 0.00 H new ATOM 0 HZ PHE A 37 13.561 -13.401 -9.351 1.00 0.00 H new ATOM 547 N HIS A 38 7.225 -8.277 -8.017 1.00 0.00 N ATOM 548 CA HIS A 38 6.626 -7.155 -8.730 1.00 0.00 C ATOM 549 C HIS A 38 7.231 -5.829 -8.276 1.00 0.00 C ATOM 550 O HIS A 38 7.294 -4.869 -9.045 1.00 0.00 O ATOM 551 CB HIS A 38 5.111 -7.140 -8.517 1.00 0.00 C ATOM 552 CG HIS A 38 4.359 -7.950 -9.526 1.00 0.00 C ATOM 553 ND1 HIS A 38 3.216 -7.518 -10.161 1.00 0.00 N ATOM 554 CD2 HIS A 38 4.607 -9.195 -10.008 1.00 0.00 C ATOM 555 CE1 HIS A 38 2.813 -8.491 -10.990 1.00 0.00 C ATOM 556 NE2 HIS A 38 3.624 -9.530 -10.936 1.00 0.00 N ATOM 0 H HIS A 38 6.585 -8.774 -7.398 1.00 0.00 H new ATOM 0 HA HIS A 38 6.836 -7.280 -9.792 1.00 0.00 H new ATOM 0 HB2 HIS A 38 4.888 -7.519 -7.520 1.00 0.00 H new ATOM 0 HB3 HIS A 38 4.757 -6.110 -8.553 1.00 0.00 H new ATOM 0 HD2 HIS A 38 5.435 -9.825 -9.718 1.00 0.00 H new ATOM 0 HE1 HIS A 38 1.938 -8.432 -11.620 1.00 0.00 H new ATOM 0 HE2 HIS A 38 3.547 -10.399 -11.465 1.00 0.00 H new ATOM 564 N LEU A 39 7.675 -5.781 -7.024 1.00 0.00 N ATOM 565 CA LEU A 39 8.273 -4.570 -6.471 1.00 0.00 C ATOM 566 C LEU A 39 9.498 -4.149 -7.278 1.00 0.00 C ATOM 567 O LEU A 39 9.615 -2.996 -7.691 1.00 0.00 O ATOM 568 CB LEU A 39 8.667 -4.791 -5.009 1.00 0.00 C ATOM 569 CG LEU A 39 7.534 -5.264 -4.096 1.00 0.00 C ATOM 570 CD1 LEU A 39 8.094 -5.832 -2.802 1.00 0.00 C ATOM 571 CD2 LEU A 39 6.571 -4.121 -3.807 1.00 0.00 C ATOM 0 H LEU A 39 7.632 -6.566 -6.374 1.00 0.00 H new ATOM 0 HA LEU A 39 7.531 -3.773 -6.525 1.00 0.00 H new ATOM 0 HB2 LEU A 39 9.472 -5.525 -4.973 1.00 0.00 H new ATOM 0 HB3 LEU A 39 9.068 -3.858 -4.612 1.00 0.00 H new ATOM 0 HG LEU A 39 6.985 -6.055 -4.608 1.00 0.00 H new ATOM 0 HD11 LEU A 39 7.274 -6.163 -2.165 1.00 0.00 H new ATOM 0 HD12 LEU A 39 8.743 -6.678 -3.027 1.00 0.00 H new ATOM 0 HD13 LEU A 39 8.667 -5.062 -2.285 1.00 0.00 H new ATOM 0 HD21 LEU A 39 5.771 -4.475 -3.156 1.00 0.00 H new ATOM 0 HD22 LEU A 39 7.107 -3.309 -3.315 1.00 0.00 H new ATOM 0 HD23 LEU A 39 6.144 -3.759 -4.743 1.00 0.00 H new ATOM 583 N ARG A 40 10.410 -5.092 -7.492 1.00 0.00 N ATOM 584 CA ARG A 40 11.630 -4.823 -8.246 1.00 0.00 C ATOM 585 C ARG A 40 11.318 -4.292 -9.643 1.00 0.00 C ATOM 586 O ARG A 40 12.141 -3.610 -10.253 1.00 0.00 O ATOM 587 CB ARG A 40 12.476 -6.094 -8.352 1.00 0.00 C ATOM 588 CG ARG A 40 13.969 -5.822 -8.432 1.00 0.00 C ATOM 589 CD ARG A 40 14.743 -7.074 -8.811 1.00 0.00 C ATOM 590 NE ARG A 40 14.939 -7.182 -10.255 1.00 0.00 N ATOM 591 CZ ARG A 40 15.677 -6.336 -10.969 1.00 0.00 C ATOM 592 NH1 ARG A 40 16.284 -5.313 -10.381 1.00 0.00 N ATOM 593 NH2 ARG A 40 15.808 -6.513 -12.278 1.00 0.00 N ATOM 0 H ARG A 40 10.327 -6.051 -7.153 1.00 0.00 H new ATOM 0 HA ARG A 40 12.190 -4.057 -7.709 1.00 0.00 H new ATOM 0 HB2 ARG A 40 12.276 -6.728 -7.488 1.00 0.00 H new ATOM 0 HB3 ARG A 40 12.169 -6.653 -9.236 1.00 0.00 H new ATOM 0 HG2 ARG A 40 14.159 -5.039 -9.167 1.00 0.00 H new ATOM 0 HG3 ARG A 40 14.324 -5.450 -7.471 1.00 0.00 H new ATOM 0 HD2 ARG A 40 15.713 -7.065 -8.313 1.00 0.00 H new ATOM 0 HD3 ARG A 40 14.208 -7.953 -8.451 1.00 0.00 H new ATOM 0 HE ARG A 40 14.483 -7.952 -10.745 1.00 0.00 H new ATOM 0 HH11 ARG A 40 16.186 -5.171 -9.376 1.00 0.00 H new ATOM 0 HH12 ARG A 40 16.848 -4.668 -10.934 1.00 0.00 H new ATOM 0 HH21 ARG A 40 15.343 -7.297 -12.736 1.00 0.00 H new ATOM 0 HH22 ARG A 40 16.374 -5.865 -12.826 1.00 0.00 H new ATOM 607 N ASP A 41 10.129 -4.608 -10.146 1.00 0.00 N ATOM 608 CA ASP A 41 9.719 -4.163 -11.474 1.00 0.00 C ATOM 609 C ASP A 41 9.256 -2.709 -11.448 1.00 0.00 C ATOM 610 O ASP A 41 9.667 -1.901 -12.280 1.00 0.00 O ATOM 611 CB ASP A 41 8.601 -5.057 -12.010 1.00 0.00 C ATOM 612 CG ASP A 41 8.717 -5.297 -13.502 1.00 0.00 C ATOM 613 OD1 ASP A 41 9.841 -5.189 -14.035 1.00 0.00 O ATOM 614 OD2 ASP A 41 7.685 -5.595 -14.138 1.00 0.00 O ATOM 0 H ASP A 41 9.433 -5.170 -9.655 1.00 0.00 H new ATOM 0 HA ASP A 41 10.583 -4.235 -12.135 1.00 0.00 H new ATOM 0 HB2 ASP A 41 8.623 -6.014 -11.488 1.00 0.00 H new ATOM 0 HB3 ASP A 41 7.637 -4.598 -11.793 1.00 0.00 H new ATOM 619 N VAL A 42 8.392 -2.384 -10.492 1.00 0.00 N ATOM 620 CA VAL A 42 7.869 -1.028 -10.363 1.00 0.00 C ATOM 621 C VAL A 42 8.889 -0.100 -9.713 1.00 0.00 C ATOM 622 O VAL A 42 8.929 1.095 -10.005 1.00 0.00 O ATOM 623 CB VAL A 42 6.572 -1.005 -9.532 1.00 0.00 C ATOM 624 CG1 VAL A 42 5.418 -1.603 -10.325 1.00 0.00 C ATOM 625 CG2 VAL A 42 6.766 -1.746 -8.218 1.00 0.00 C ATOM 0 H VAL A 42 8.039 -3.040 -9.795 1.00 0.00 H new ATOM 0 HA VAL A 42 7.655 -0.676 -11.372 1.00 0.00 H new ATOM 0 HB VAL A 42 6.327 0.032 -9.304 1.00 0.00 H new ATOM 0 HG11 VAL A 42 4.511 -1.578 -9.722 1.00 0.00 H new ATOM 0 HG12 VAL A 42 5.264 -1.025 -11.236 1.00 0.00 H new ATOM 0 HG13 VAL A 42 5.652 -2.635 -10.586 1.00 0.00 H new ATOM 0 HG21 VAL A 42 5.839 -1.719 -7.645 1.00 0.00 H new ATOM 0 HG22 VAL A 42 7.037 -2.782 -8.421 1.00 0.00 H new ATOM 0 HG23 VAL A 42 7.561 -1.269 -7.645 1.00 0.00 H new ATOM 635 N THR A 43 9.711 -0.656 -8.830 1.00 0.00 N ATOM 636 CA THR A 43 10.730 0.124 -8.137 1.00 0.00 C ATOM 637 C THR A 43 11.933 0.374 -9.040 1.00 0.00 C ATOM 638 O THR A 43 12.231 1.516 -9.389 1.00 0.00 O ATOM 639 CB THR A 43 11.174 -0.596 -6.862 1.00 0.00 C ATOM 640 OG1 THR A 43 11.804 -1.824 -7.175 1.00 0.00 O ATOM 641 CG2 THR A 43 10.032 -0.893 -5.916 1.00 0.00 C ATOM 0 H THR A 43 9.692 -1.644 -8.577 1.00 0.00 H new ATOM 0 HA THR A 43 10.295 1.087 -7.869 1.00 0.00 H new ATOM 0 HB THR A 43 11.865 0.087 -6.368 1.00 0.00 H new ATOM 0 HG1 THR A 43 11.231 -2.341 -7.779 1.00 0.00 H new ATOM 0 HG21 THR A 43 10.415 -1.404 -5.033 1.00 0.00 H new ATOM 0 HG22 THR A 43 9.555 0.040 -5.617 1.00 0.00 H new ATOM 0 HG23 THR A 43 9.302 -1.530 -6.416 1.00 0.00 H new ATOM 649 N GLN A 44 12.622 -0.699 -9.412 1.00 0.00 N ATOM 650 CA GLN A 44 13.794 -0.596 -10.273 1.00 0.00 C ATOM 651 C GLN A 44 14.889 0.228 -9.601 1.00 0.00 C ATOM 652 O GLN A 44 15.641 0.939 -10.267 1.00 0.00 O ATOM 653 CB GLN A 44 13.415 0.037 -11.613 1.00 0.00 C ATOM 654 CG GLN A 44 12.251 -0.655 -12.305 1.00 0.00 C ATOM 655 CD GLN A 44 11.254 0.325 -12.891 1.00 0.00 C ATOM 656 OE1 GLN A 44 10.612 1.085 -12.165 1.00 0.00 O ATOM 657 NE2 GLN A 44 11.120 0.315 -14.212 1.00 0.00 N ATOM 0 H GLN A 44 12.389 -1.651 -9.130 1.00 0.00 H new ATOM 0 HA GLN A 44 14.175 -1.602 -10.449 1.00 0.00 H new ATOM 0 HB2 GLN A 44 13.160 1.084 -11.452 1.00 0.00 H new ATOM 0 HB3 GLN A 44 14.282 0.018 -12.273 1.00 0.00 H new ATOM 0 HG2 GLN A 44 12.634 -1.296 -13.099 1.00 0.00 H new ATOM 0 HG3 GLN A 44 11.742 -1.302 -11.591 1.00 0.00 H new ATOM 0 HE21 GLN A 44 11.672 -0.331 -14.776 1.00 0.00 H new ATOM 0 HE22 GLN A 44 10.465 0.954 -14.663 1.00 0.00 H new ATOM 666 N PHE A 45 14.972 0.123 -8.279 1.00 0.00 N ATOM 667 CA PHE A 45 15.975 0.857 -7.516 1.00 0.00 C ATOM 668 C PHE A 45 17.219 0.003 -7.291 1.00 0.00 C ATOM 669 O PHE A 45 17.289 -1.140 -7.744 1.00 0.00 O ATOM 670 CB PHE A 45 15.397 1.303 -6.171 1.00 0.00 C ATOM 671 CG PHE A 45 15.744 2.720 -5.809 1.00 0.00 C ATOM 672 CD1 PHE A 45 15.538 3.749 -6.714 1.00 0.00 C ATOM 673 CD2 PHE A 45 16.275 3.021 -4.565 1.00 0.00 C ATOM 674 CE1 PHE A 45 15.856 5.054 -6.384 1.00 0.00 C ATOM 675 CE2 PHE A 45 16.594 4.323 -4.230 1.00 0.00 C ATOM 676 CZ PHE A 45 16.385 5.341 -5.142 1.00 0.00 C ATOM 0 H PHE A 45 14.357 -0.463 -7.714 1.00 0.00 H new ATOM 0 HA PHE A 45 16.260 1.738 -8.091 1.00 0.00 H new ATOM 0 HB2 PHE A 45 14.312 1.199 -6.198 1.00 0.00 H new ATOM 0 HB3 PHE A 45 15.762 0.637 -5.389 1.00 0.00 H new ATOM 0 HD1 PHE A 45 15.125 3.530 -7.687 1.00 0.00 H new ATOM 0 HD2 PHE A 45 16.441 2.229 -3.849 1.00 0.00 H new ATOM 0 HE1 PHE A 45 15.691 5.848 -7.098 1.00 0.00 H new ATOM 0 HE2 PHE A 45 17.006 4.545 -3.257 1.00 0.00 H new ATOM 0 HZ PHE A 45 16.635 6.359 -4.883 1.00 0.00 H new ATOM 686 N HIS A 46 18.198 0.564 -6.589 1.00 0.00 N ATOM 687 CA HIS A 46 19.438 -0.146 -6.304 1.00 0.00 C ATOM 688 C HIS A 46 19.236 -1.170 -5.191 1.00 0.00 C ATOM 689 O HIS A 46 19.611 -0.937 -4.042 1.00 0.00 O ATOM 690 CB HIS A 46 20.537 0.842 -5.911 1.00 0.00 C ATOM 691 CG HIS A 46 21.912 0.251 -5.941 1.00 0.00 C ATOM 692 ND1 HIS A 46 22.342 -0.739 -5.085 1.00 0.00 N ATOM 693 CD2 HIS A 46 22.965 0.527 -6.752 1.00 0.00 C ATOM 694 CE1 HIS A 46 23.614 -1.027 -5.394 1.00 0.00 C ATOM 695 NE2 HIS A 46 24.039 -0.286 -6.400 1.00 0.00 N ATOM 0 H HIS A 46 18.156 1.509 -6.207 1.00 0.00 H new ATOM 0 HA HIS A 46 19.741 -0.674 -7.208 1.00 0.00 H new ATOM 0 HB2 HIS A 46 20.503 1.697 -6.586 1.00 0.00 H new ATOM 0 HB3 HIS A 46 20.334 1.219 -4.908 1.00 0.00 H new ATOM 0 HD1 HIS A 46 21.790 -1.176 -4.347 1.00 0.00 H new ATOM 0 HD2 HIS A 46 22.969 1.261 -7.544 1.00 0.00 H new ATOM 0 HE1 HIS A 46 24.213 -1.769 -4.886 1.00 0.00 H new ATOM 703 N LEU A 47 18.640 -2.306 -5.541 1.00 0.00 N ATOM 704 CA LEU A 47 18.386 -3.367 -4.573 1.00 0.00 C ATOM 705 C LEU A 47 18.889 -4.710 -5.094 1.00 0.00 C ATOM 706 O LEU A 47 18.248 -5.742 -4.897 1.00 0.00 O ATOM 707 CB LEU A 47 16.891 -3.454 -4.261 1.00 0.00 C ATOM 708 CG LEU A 47 16.209 -2.112 -3.986 1.00 0.00 C ATOM 709 CD1 LEU A 47 14.703 -2.291 -3.876 1.00 0.00 C ATOM 710 CD2 LEU A 47 16.766 -1.482 -2.719 1.00 0.00 C ATOM 0 H LEU A 47 18.324 -2.515 -6.488 1.00 0.00 H new ATOM 0 HA LEU A 47 18.927 -3.128 -3.658 1.00 0.00 H new ATOM 0 HB2 LEU A 47 16.388 -3.935 -5.099 1.00 0.00 H new ATOM 0 HB3 LEU A 47 16.753 -4.099 -3.393 1.00 0.00 H new ATOM 0 HG LEU A 47 16.415 -1.443 -4.822 1.00 0.00 H new ATOM 0 HD11 LEU A 47 14.235 -1.326 -3.680 1.00 0.00 H new ATOM 0 HD12 LEU A 47 14.316 -2.699 -4.810 1.00 0.00 H new ATOM 0 HD13 LEU A 47 14.477 -2.976 -3.059 1.00 0.00 H new ATOM 0 HD21 LEU A 47 16.270 -0.528 -2.538 1.00 0.00 H new ATOM 0 HD22 LEU A 47 16.591 -2.148 -1.874 1.00 0.00 H new ATOM 0 HD23 LEU A 47 17.837 -1.317 -2.835 1.00 0.00 H new ATOM 722 N ALA A 48 20.040 -4.687 -5.758 1.00 0.00 N ATOM 723 CA ALA A 48 20.628 -5.902 -6.307 1.00 0.00 C ATOM 724 C ALA A 48 21.669 -6.487 -5.357 1.00 0.00 C ATOM 725 O ALA A 48 22.734 -6.931 -5.784 1.00 0.00 O ATOM 726 CB ALA A 48 21.252 -5.618 -7.666 1.00 0.00 C ATOM 0 H ALA A 48 20.583 -3.841 -5.929 1.00 0.00 H new ATOM 0 HA ALA A 48 19.833 -6.637 -6.430 1.00 0.00 H new ATOM 0 HB1 ALA A 48 21.688 -6.534 -8.065 1.00 0.00 H new ATOM 0 HB2 ALA A 48 20.485 -5.253 -8.349 1.00 0.00 H new ATOM 0 HB3 ALA A 48 22.031 -4.863 -7.558 1.00 0.00 H new ATOM 732 N ARG A 49 21.351 -6.484 -4.067 1.00 0.00 N ATOM 733 CA ARG A 49 22.258 -7.016 -3.055 1.00 0.00 C ATOM 734 C ARG A 49 21.515 -7.924 -2.082 1.00 0.00 C ATOM 735 O ARG A 49 21.872 -8.017 -0.907 1.00 0.00 O ATOM 736 CB ARG A 49 22.931 -5.873 -2.293 1.00 0.00 C ATOM 737 CG ARG A 49 23.921 -5.082 -3.131 1.00 0.00 C ATOM 738 CD ARG A 49 25.302 -5.720 -3.116 1.00 0.00 C ATOM 739 NE ARG A 49 25.617 -6.372 -4.384 1.00 0.00 N ATOM 740 CZ ARG A 49 26.022 -5.722 -5.472 1.00 0.00 C ATOM 741 NH1 ARG A 49 26.161 -4.402 -5.452 1.00 0.00 N ATOM 742 NH2 ARG A 49 26.289 -6.393 -6.585 1.00 0.00 N ATOM 0 H ARG A 49 20.473 -6.120 -3.697 1.00 0.00 H new ATOM 0 HA ARG A 49 23.022 -7.606 -3.561 1.00 0.00 H new ATOM 0 HB2 ARG A 49 22.163 -5.196 -1.918 1.00 0.00 H new ATOM 0 HB3 ARG A 49 23.448 -6.281 -1.425 1.00 0.00 H new ATOM 0 HG2 ARG A 49 23.560 -5.018 -4.158 1.00 0.00 H new ATOM 0 HG3 ARG A 49 23.986 -4.062 -2.752 1.00 0.00 H new ATOM 0 HD2 ARG A 49 26.051 -4.957 -2.904 1.00 0.00 H new ATOM 0 HD3 ARG A 49 25.355 -6.451 -2.309 1.00 0.00 H new ATOM 0 HE ARG A 49 25.521 -7.386 -4.439 1.00 0.00 H new ATOM 0 HH11 ARG A 49 25.957 -3.881 -4.599 1.00 0.00 H new ATOM 0 HH12 ARG A 49 26.472 -3.909 -6.289 1.00 0.00 H new ATOM 0 HH21 ARG A 49 26.184 -7.407 -6.607 1.00 0.00 H new ATOM 0 HH22 ARG A 49 26.599 -5.895 -7.419 1.00 0.00 H new ATOM 756 N GLY A 50 20.480 -8.594 -2.579 1.00 0.00 N ATOM 757 CA GLY A 50 19.703 -9.486 -1.739 1.00 0.00 C ATOM 758 C GLY A 50 18.863 -8.741 -0.721 1.00 0.00 C ATOM 759 O GLY A 50 18.850 -9.091 0.460 1.00 0.00 O ATOM 0 H GLY A 50 20.166 -8.535 -3.548 1.00 0.00 H new ATOM 0 HA2 GLY A 50 19.052 -10.095 -2.366 1.00 0.00 H new ATOM 0 HA3 GLY A 50 20.376 -10.169 -1.220 1.00 0.00 H new ATOM 763 N GLU A 51 18.159 -7.711 -1.177 1.00 0.00 N ATOM 764 CA GLU A 51 17.313 -6.913 -0.299 1.00 0.00 C ATOM 765 C GLU A 51 15.847 -7.305 -0.452 1.00 0.00 C ATOM 766 O GLU A 51 15.097 -7.336 0.523 1.00 0.00 O ATOM 767 CB GLU A 51 17.489 -5.424 -0.600 1.00 0.00 C ATOM 768 CG GLU A 51 18.885 -4.903 -0.298 1.00 0.00 C ATOM 769 CD GLU A 51 18.869 -3.608 0.489 1.00 0.00 C ATOM 770 OE1 GLU A 51 18.683 -3.665 1.722 1.00 0.00 O ATOM 771 OE2 GLU A 51 19.041 -2.536 -0.129 1.00 0.00 O ATOM 0 H GLU A 51 18.158 -7.409 -2.151 1.00 0.00 H new ATOM 0 HA GLU A 51 17.617 -7.106 0.730 1.00 0.00 H new ATOM 0 HB2 GLU A 51 17.263 -5.245 -1.651 1.00 0.00 H new ATOM 0 HB3 GLU A 51 16.764 -4.856 -0.017 1.00 0.00 H new ATOM 0 HG2 GLU A 51 19.436 -5.657 0.263 1.00 0.00 H new ATOM 0 HG3 GLU A 51 19.421 -4.748 -1.234 1.00 0.00 H new ATOM 778 N LEU A 52 15.446 -7.605 -1.683 1.00 0.00 N ATOM 779 CA LEU A 52 14.070 -7.996 -1.966 1.00 0.00 C ATOM 780 C LEU A 52 13.693 -9.254 -1.190 1.00 0.00 C ATOM 781 O LEU A 52 12.550 -9.411 -0.759 1.00 0.00 O ATOM 782 CB LEU A 52 13.880 -8.231 -3.466 1.00 0.00 C ATOM 783 CG LEU A 52 12.507 -7.841 -4.013 1.00 0.00 C ATOM 784 CD1 LEU A 52 12.292 -6.340 -3.898 1.00 0.00 C ATOM 785 CD2 LEU A 52 12.364 -8.292 -5.459 1.00 0.00 C ATOM 0 H LEU A 52 16.055 -7.585 -2.501 1.00 0.00 H new ATOM 0 HA LEU A 52 13.416 -7.184 -1.649 1.00 0.00 H new ATOM 0 HB2 LEU A 52 14.642 -7.669 -4.006 1.00 0.00 H new ATOM 0 HB3 LEU A 52 14.052 -9.286 -3.678 1.00 0.00 H new ATOM 0 HG LEU A 52 11.744 -8.342 -3.418 1.00 0.00 H new ATOM 0 HD11 LEU A 52 11.309 -6.082 -4.293 1.00 0.00 H new ATOM 0 HD12 LEU A 52 12.352 -6.043 -2.851 1.00 0.00 H new ATOM 0 HD13 LEU A 52 13.060 -5.818 -4.468 1.00 0.00 H new ATOM 0 HD21 LEU A 52 11.381 -8.007 -5.834 1.00 0.00 H new ATOM 0 HD22 LEU A 52 13.135 -7.818 -6.066 1.00 0.00 H new ATOM 0 HD23 LEU A 52 12.473 -9.375 -5.515 1.00 0.00 H new ATOM 797 N GLU A 53 14.660 -10.149 -1.017 1.00 0.00 N ATOM 798 CA GLU A 53 14.431 -11.393 -0.293 1.00 0.00 C ATOM 799 C GLU A 53 14.447 -11.156 1.214 1.00 0.00 C ATOM 800 O GLU A 53 13.752 -11.839 1.967 1.00 0.00 O ATOM 801 CB GLU A 53 15.491 -12.430 -0.670 1.00 0.00 C ATOM 802 CG GLU A 53 15.193 -13.825 -0.143 1.00 0.00 C ATOM 803 CD GLU A 53 16.150 -14.252 0.954 1.00 0.00 C ATOM 804 OE1 GLU A 53 17.373 -14.071 0.777 1.00 0.00 O ATOM 805 OE2 GLU A 53 15.675 -14.767 1.988 1.00 0.00 O ATOM 0 H GLU A 53 15.611 -10.035 -1.369 1.00 0.00 H new ATOM 0 HA GLU A 53 13.448 -11.771 -0.573 1.00 0.00 H new ATOM 0 HB2 GLU A 53 15.576 -12.472 -1.756 1.00 0.00 H new ATOM 0 HB3 GLU A 53 16.458 -12.105 -0.286 1.00 0.00 H new ATOM 0 HG2 GLU A 53 14.172 -13.855 0.239 1.00 0.00 H new ATOM 0 HG3 GLU A 53 15.247 -14.539 -0.965 1.00 0.00 H new ATOM 812 N SER A 54 15.243 -10.185 1.645 1.00 0.00 N ATOM 813 CA SER A 54 15.351 -9.856 3.062 1.00 0.00 C ATOM 814 C SER A 54 14.190 -8.973 3.509 1.00 0.00 C ATOM 815 O SER A 54 13.814 -8.971 4.681 1.00 0.00 O ATOM 816 CB SER A 54 16.681 -9.154 3.345 1.00 0.00 C ATOM 817 OG SER A 54 17.765 -9.867 2.774 1.00 0.00 O ATOM 0 H SER A 54 15.824 -9.611 1.034 1.00 0.00 H new ATOM 0 HA SER A 54 15.312 -10.787 3.628 1.00 0.00 H new ATOM 0 HB2 SER A 54 16.655 -8.142 2.942 1.00 0.00 H new ATOM 0 HB3 SER A 54 16.827 -9.065 4.421 1.00 0.00 H new ATOM 0 HG SER A 54 18.039 -9.432 1.939 1.00 0.00 H new ATOM 823 N LEU A 55 13.626 -8.220 2.568 1.00 0.00 N ATOM 824 CA LEU A 55 12.507 -7.331 2.867 1.00 0.00 C ATOM 825 C LEU A 55 11.349 -8.103 3.493 1.00 0.00 C ATOM 826 O LEU A 55 10.826 -9.046 2.900 1.00 0.00 O ATOM 827 CB LEU A 55 12.035 -6.624 1.595 1.00 0.00 C ATOM 828 CG LEU A 55 12.745 -5.305 1.286 1.00 0.00 C ATOM 829 CD1 LEU A 55 12.533 -4.913 -0.168 1.00 0.00 C ATOM 830 CD2 LEU A 55 12.251 -4.207 2.215 1.00 0.00 C ATOM 0 H LEU A 55 13.925 -8.208 1.593 1.00 0.00 H new ATOM 0 HA LEU A 55 12.851 -6.585 3.583 1.00 0.00 H new ATOM 0 HB2 LEU A 55 12.172 -7.299 0.750 1.00 0.00 H new ATOM 0 HB3 LEU A 55 10.965 -6.432 1.680 1.00 0.00 H new ATOM 0 HG LEU A 55 13.814 -5.440 1.451 1.00 0.00 H new ATOM 0 HD11 LEU A 55 13.045 -3.972 -0.370 1.00 0.00 H new ATOM 0 HD12 LEU A 55 12.935 -5.691 -0.817 1.00 0.00 H new ATOM 0 HD13 LEU A 55 11.467 -4.794 -0.361 1.00 0.00 H new ATOM 0 HD21 LEU A 55 12.766 -3.275 1.982 1.00 0.00 H new ATOM 0 HD22 LEU A 55 11.178 -4.072 2.081 1.00 0.00 H new ATOM 0 HD23 LEU A 55 12.455 -4.486 3.249 1.00 0.00 H new ATOM 842 N SER A 56 10.954 -7.695 4.695 1.00 0.00 N ATOM 843 CA SER A 56 9.858 -8.348 5.401 1.00 0.00 C ATOM 844 C SER A 56 8.544 -7.607 5.173 1.00 0.00 C ATOM 845 O SER A 56 8.463 -6.713 4.331 1.00 0.00 O ATOM 846 CB SER A 56 10.162 -8.424 6.899 1.00 0.00 C ATOM 847 OG SER A 56 9.851 -9.705 7.419 1.00 0.00 O ATOM 0 H SER A 56 11.376 -6.916 5.200 1.00 0.00 H new ATOM 0 HA SER A 56 9.756 -9.359 5.006 1.00 0.00 H new ATOM 0 HB2 SER A 56 11.216 -8.205 7.071 1.00 0.00 H new ATOM 0 HB3 SER A 56 9.588 -7.664 7.429 1.00 0.00 H new ATOM 0 HG SER A 56 10.056 -9.728 8.377 1.00 0.00 H new ATOM 853 N GLN A 57 7.518 -7.984 5.928 1.00 0.00 N ATOM 854 CA GLN A 57 6.209 -7.354 5.808 1.00 0.00 C ATOM 855 C GLN A 57 6.192 -5.995 6.500 1.00 0.00 C ATOM 856 O GLN A 57 5.471 -5.086 6.088 1.00 0.00 O ATOM 857 CB GLN A 57 5.128 -8.259 6.405 1.00 0.00 C ATOM 858 CG GLN A 57 3.843 -8.288 5.594 1.00 0.00 C ATOM 859 CD GLN A 57 3.053 -9.566 5.801 1.00 0.00 C ATOM 860 OE1 GLN A 57 2.707 -10.258 4.844 1.00 0.00 O ATOM 861 NE2 GLN A 57 2.763 -9.884 7.058 1.00 0.00 N ATOM 0 H GLN A 57 7.568 -8.723 6.630 1.00 0.00 H new ATOM 0 HA GLN A 57 6.002 -7.203 4.749 1.00 0.00 H new ATOM 0 HB2 GLN A 57 5.519 -9.273 6.487 1.00 0.00 H new ATOM 0 HB3 GLN A 57 4.902 -7.922 7.417 1.00 0.00 H new ATOM 0 HG2 GLN A 57 3.224 -7.434 5.869 1.00 0.00 H new ATOM 0 HG3 GLN A 57 4.083 -8.180 4.536 1.00 0.00 H new ATOM 0 HE21 GLN A 57 3.070 -9.280 7.821 1.00 0.00 H new ATOM 0 HE22 GLN A 57 2.233 -10.732 7.260 1.00 0.00 H new ATOM 870 N VAL A 58 6.991 -5.862 7.554 1.00 0.00 N ATOM 871 CA VAL A 58 7.067 -4.614 8.303 1.00 0.00 C ATOM 872 C VAL A 58 8.121 -3.683 7.715 1.00 0.00 C ATOM 873 O VAL A 58 7.904 -2.476 7.602 1.00 0.00 O ATOM 874 CB VAL A 58 7.394 -4.868 9.787 1.00 0.00 C ATOM 875 CG1 VAL A 58 7.273 -3.581 10.589 1.00 0.00 C ATOM 876 CG2 VAL A 58 6.486 -5.948 10.356 1.00 0.00 C ATOM 0 H VAL A 58 7.595 -6.604 7.908 1.00 0.00 H new ATOM 0 HA VAL A 58 6.087 -4.142 8.230 1.00 0.00 H new ATOM 0 HB VAL A 58 8.424 -5.217 9.859 1.00 0.00 H new ATOM 0 HG11 VAL A 58 7.508 -3.780 11.635 1.00 0.00 H new ATOM 0 HG12 VAL A 58 7.969 -2.840 10.196 1.00 0.00 H new ATOM 0 HG13 VAL A 58 6.255 -3.199 10.512 1.00 0.00 H new ATOM 0 HG21 VAL A 58 6.731 -6.114 11.405 1.00 0.00 H new ATOM 0 HG22 VAL A 58 5.447 -5.631 10.272 1.00 0.00 H new ATOM 0 HG23 VAL A 58 6.629 -6.874 9.799 1.00 0.00 H new ATOM 886 N ASP A 59 9.263 -4.251 7.343 1.00 0.00 N ATOM 887 CA ASP A 59 10.352 -3.470 6.766 1.00 0.00 C ATOM 888 C ASP A 59 9.974 -2.946 5.385 1.00 0.00 C ATOM 889 O ASP A 59 10.327 -1.826 5.016 1.00 0.00 O ATOM 890 CB ASP A 59 11.622 -4.316 6.673 1.00 0.00 C ATOM 891 CG ASP A 59 12.246 -4.573 8.031 1.00 0.00 C ATOM 892 OD1 ASP A 59 11.540 -5.088 8.922 1.00 0.00 O ATOM 893 OD2 ASP A 59 13.444 -4.259 8.203 1.00 0.00 O ATOM 0 H ASP A 59 9.459 -5.248 7.430 1.00 0.00 H new ATOM 0 HA ASP A 59 10.539 -2.618 7.419 1.00 0.00 H new ATOM 0 HB2 ASP A 59 11.387 -5.269 6.198 1.00 0.00 H new ATOM 0 HB3 ASP A 59 12.346 -3.811 6.033 1.00 0.00 H new ATOM 898 N LEU A 60 9.253 -3.764 4.625 1.00 0.00 N ATOM 899 CA LEU A 60 8.827 -3.383 3.282 1.00 0.00 C ATOM 900 C LEU A 60 7.969 -2.122 3.320 1.00 0.00 C ATOM 901 O LEU A 60 8.059 -1.271 2.435 1.00 0.00 O ATOM 902 CB LEU A 60 8.045 -4.525 2.629 1.00 0.00 C ATOM 903 CG LEU A 60 7.489 -4.217 1.238 1.00 0.00 C ATOM 904 CD1 LEU A 60 8.613 -3.833 0.288 1.00 0.00 C ATOM 905 CD2 LEU A 60 6.716 -5.411 0.698 1.00 0.00 C ATOM 0 H LEU A 60 8.951 -4.694 4.915 1.00 0.00 H new ATOM 0 HA LEU A 60 9.719 -3.177 2.690 1.00 0.00 H new ATOM 0 HB2 LEU A 60 8.696 -5.397 2.559 1.00 0.00 H new ATOM 0 HB3 LEU A 60 7.216 -4.798 3.283 1.00 0.00 H new ATOM 0 HG LEU A 60 6.805 -3.372 1.319 1.00 0.00 H new ATOM 0 HD11 LEU A 60 8.199 -3.617 -0.697 1.00 0.00 H new ATOM 0 HD12 LEU A 60 9.125 -2.949 0.668 1.00 0.00 H new ATOM 0 HD13 LEU A 60 9.322 -4.657 0.211 1.00 0.00 H new ATOM 0 HD21 LEU A 60 6.327 -5.175 -0.293 1.00 0.00 H new ATOM 0 HD22 LEU A 60 7.379 -6.274 0.631 1.00 0.00 H new ATOM 0 HD23 LEU A 60 5.887 -5.641 1.368 1.00 0.00 H new ATOM 917 N ALA A 61 7.138 -2.008 4.351 1.00 0.00 N ATOM 918 CA ALA A 61 6.265 -0.852 4.503 1.00 0.00 C ATOM 919 C ALA A 61 7.073 0.417 4.757 1.00 0.00 C ATOM 920 O ALA A 61 6.764 1.480 4.217 1.00 0.00 O ATOM 921 CB ALA A 61 5.277 -1.084 5.637 1.00 0.00 C ATOM 0 H ALA A 61 7.052 -2.703 5.093 1.00 0.00 H new ATOM 0 HA ALA A 61 5.712 -0.720 3.573 1.00 0.00 H new ATOM 0 HB1 ALA A 61 4.630 -0.213 5.740 1.00 0.00 H new ATOM 0 HB2 ALA A 61 4.670 -1.962 5.417 1.00 0.00 H new ATOM 0 HB3 ALA A 61 5.822 -1.244 6.567 1.00 0.00 H new ATOM 927 N SER A 62 8.109 0.298 5.580 1.00 0.00 N ATOM 928 CA SER A 62 8.962 1.435 5.905 1.00 0.00 C ATOM 929 C SER A 62 9.948 1.718 4.776 1.00 0.00 C ATOM 930 O SER A 62 10.334 2.863 4.548 1.00 0.00 O ATOM 931 CB SER A 62 9.721 1.175 7.208 1.00 0.00 C ATOM 932 OG SER A 62 9.805 2.351 7.994 1.00 0.00 O ATOM 0 H SER A 62 8.378 -0.575 6.034 1.00 0.00 H new ATOM 0 HA SER A 62 8.324 2.310 6.033 1.00 0.00 H new ATOM 0 HB2 SER A 62 9.219 0.391 7.774 1.00 0.00 H new ATOM 0 HB3 SER A 62 10.724 0.813 6.982 1.00 0.00 H new ATOM 0 HG SER A 62 10.293 2.157 8.821 1.00 0.00 H new ATOM 938 N LYS A 63 10.353 0.664 4.074 1.00 0.00 N ATOM 939 CA LYS A 63 11.295 0.799 2.969 1.00 0.00 C ATOM 940 C LYS A 63 10.710 1.668 1.858 1.00 0.00 C ATOM 941 O LYS A 63 11.429 2.422 1.202 1.00 0.00 O ATOM 942 CB LYS A 63 11.667 -0.580 2.417 1.00 0.00 C ATOM 943 CG LYS A 63 13.157 -0.879 2.487 1.00 0.00 C ATOM 944 CD LYS A 63 13.753 -1.084 1.104 1.00 0.00 C ATOM 945 CE LYS A 63 14.808 -2.178 1.109 1.00 0.00 C ATOM 946 NZ LYS A 63 15.965 -1.831 1.980 1.00 0.00 N ATOM 0 H LYS A 63 10.044 -0.292 4.251 1.00 0.00 H new ATOM 0 HA LYS A 63 12.195 1.284 3.347 1.00 0.00 H new ATOM 0 HB2 LYS A 63 11.124 -1.344 2.974 1.00 0.00 H new ATOM 0 HB3 LYS A 63 11.339 -0.648 1.380 1.00 0.00 H new ATOM 0 HG2 LYS A 63 13.670 -0.057 2.987 1.00 0.00 H new ATOM 0 HG3 LYS A 63 13.321 -1.772 3.090 1.00 0.00 H new ATOM 0 HD2 LYS A 63 12.962 -1.343 0.400 1.00 0.00 H new ATOM 0 HD3 LYS A 63 14.196 -0.151 0.756 1.00 0.00 H new ATOM 0 HE2 LYS A 63 14.362 -3.111 1.453 1.00 0.00 H new ATOM 0 HE3 LYS A 63 15.158 -2.349 0.091 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 16.745 -2.495 1.802 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 16.280 -0.863 1.769 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 15.679 -1.892 2.978 1.00 0.00 H new ATOM 960 N LEU A 64 9.401 1.558 1.655 1.00 0.00 N ATOM 961 CA LEU A 64 8.719 2.333 0.626 1.00 0.00 C ATOM 962 C LEU A 64 8.770 3.824 0.945 1.00 0.00 C ATOM 963 O LEU A 64 8.872 4.658 0.046 1.00 0.00 O ATOM 964 CB LEU A 64 7.264 1.878 0.494 1.00 0.00 C ATOM 965 CG LEU A 64 7.057 0.593 -0.309 1.00 0.00 C ATOM 966 CD1 LEU A 64 5.574 0.281 -0.443 1.00 0.00 C ATOM 967 CD2 LEU A 64 7.704 0.713 -1.680 1.00 0.00 C ATOM 0 H LEU A 64 8.792 0.939 2.190 1.00 0.00 H new ATOM 0 HA LEU A 64 9.232 2.164 -0.320 1.00 0.00 H new ATOM 0 HB2 LEU A 64 6.852 1.734 1.493 1.00 0.00 H new ATOM 0 HB3 LEU A 64 6.691 2.678 0.025 1.00 0.00 H new ATOM 0 HG LEU A 64 7.533 -0.229 0.226 1.00 0.00 H new ATOM 0 HD11 LEU A 64 5.446 -0.637 -1.017 1.00 0.00 H new ATOM 0 HD12 LEU A 64 5.138 0.153 0.548 1.00 0.00 H new ATOM 0 HD13 LEU A 64 5.074 1.103 -0.956 1.00 0.00 H new ATOM 0 HD21 LEU A 64 7.547 -0.210 -2.238 1.00 0.00 H new ATOM 0 HD22 LEU A 64 7.256 1.546 -2.222 1.00 0.00 H new ATOM 0 HD23 LEU A 64 8.773 0.889 -1.564 1.00 0.00 H new ATOM 979 N ILE A 65 8.696 4.149 2.231 1.00 0.00 N ATOM 980 CA ILE A 65 8.732 5.539 2.671 1.00 0.00 C ATOM 981 C ILE A 65 10.164 6.056 2.738 1.00 0.00 C ATOM 982 O ILE A 65 10.418 7.240 2.513 1.00 0.00 O ATOM 983 CB ILE A 65 8.070 5.707 4.053 1.00 0.00 C ATOM 984 CG1 ILE A 65 6.688 5.051 4.065 1.00 0.00 C ATOM 985 CG2 ILE A 65 7.965 7.181 4.415 1.00 0.00 C ATOM 986 CD1 ILE A 65 6.224 4.645 5.447 1.00 0.00 C ATOM 0 H ILE A 65 8.611 3.469 2.987 1.00 0.00 H new ATOM 0 HA ILE A 65 8.174 6.119 1.937 1.00 0.00 H new ATOM 0 HB ILE A 65 8.692 5.213 4.799 1.00 0.00 H new ATOM 0 HG12 ILE A 65 5.963 5.742 3.636 1.00 0.00 H new ATOM 0 HG13 ILE A 65 6.707 4.170 3.424 1.00 0.00 H new ATOM 0 HG21 ILE A 65 7.495 7.283 5.393 1.00 0.00 H new ATOM 0 HG22 ILE A 65 8.962 7.621 4.443 1.00 0.00 H new ATOM 0 HG23 ILE A 65 7.362 7.697 3.668 1.00 0.00 H new ATOM 0 HD11 ILE A 65 5.237 4.187 5.380 1.00 0.00 H new ATOM 0 HD12 ILE A 65 6.928 3.929 5.872 1.00 0.00 H new ATOM 0 HD13 ILE A 65 6.172 5.526 6.087 1.00 0.00 H new ATOM 998 N SER A 66 11.097 5.164 3.052 1.00 0.00 N ATOM 999 CA SER A 66 12.505 5.531 3.149 1.00 0.00 C ATOM 1000 C SER A 66 13.106 5.759 1.765 1.00 0.00 C ATOM 1001 O SER A 66 14.020 6.567 1.601 1.00 0.00 O ATOM 1002 CB SER A 66 13.288 4.442 3.886 1.00 0.00 C ATOM 1003 OG SER A 66 14.288 5.006 4.716 1.00 0.00 O ATOM 0 H SER A 66 10.904 4.181 3.244 1.00 0.00 H new ATOM 0 HA SER A 66 12.574 6.462 3.712 1.00 0.00 H new ATOM 0 HB2 SER A 66 12.605 3.844 4.489 1.00 0.00 H new ATOM 0 HB3 SER A 66 13.748 3.768 3.163 1.00 0.00 H new ATOM 0 HG SER A 66 14.773 4.290 5.177 1.00 0.00 H new ATOM 1009 N MET A 67 12.587 5.041 0.775 1.00 0.00 N ATOM 1010 CA MET A 67 13.074 5.167 -0.595 1.00 0.00 C ATOM 1011 C MET A 67 12.441 6.368 -1.290 1.00 0.00 C ATOM 1012 O MET A 67 13.141 7.234 -1.813 1.00 0.00 O ATOM 1013 CB MET A 67 12.775 3.890 -1.383 1.00 0.00 C ATOM 1014 CG MET A 67 13.652 2.712 -0.990 1.00 0.00 C ATOM 1015 SD MET A 67 14.092 1.675 -2.398 1.00 0.00 S ATOM 1016 CE MET A 67 12.543 0.825 -2.689 1.00 0.00 C ATOM 0 H MET A 67 11.831 4.367 0.894 1.00 0.00 H new ATOM 0 HA MET A 67 14.153 5.320 -0.558 1.00 0.00 H new ATOM 0 HB2 MET A 67 11.730 3.619 -1.236 1.00 0.00 H new ATOM 0 HB3 MET A 67 12.906 4.090 -2.446 1.00 0.00 H new ATOM 0 HG2 MET A 67 14.562 3.083 -0.518 1.00 0.00 H new ATOM 0 HG3 MET A 67 13.131 2.108 -0.247 1.00 0.00 H new ATOM 0 HE1 MET A 67 12.316 0.838 -3.755 1.00 0.00 H new ATOM 0 HE2 MET A 67 12.625 -0.207 -2.348 1.00 0.00 H new ATOM 0 HE3 MET A 67 11.745 1.326 -2.142 1.00 0.00 H new ATOM 1026 N TYR A 68 11.112 6.411 -1.291 1.00 0.00 N ATOM 1027 CA TYR A 68 10.384 7.507 -1.923 1.00 0.00 C ATOM 1028 C TYR A 68 9.677 8.364 -0.879 1.00 0.00 C ATOM 1029 O TYR A 68 10.023 9.529 -0.679 1.00 0.00 O ATOM 1030 CB TYR A 68 9.366 6.961 -2.926 1.00 0.00 C ATOM 1031 CG TYR A 68 9.906 5.848 -3.796 1.00 0.00 C ATOM 1032 CD1 TYR A 68 9.839 4.523 -3.384 1.00 0.00 C ATOM 1033 CD2 TYR A 68 10.482 6.122 -5.030 1.00 0.00 C ATOM 1034 CE1 TYR A 68 10.330 3.503 -4.177 1.00 0.00 C ATOM 1035 CE2 TYR A 68 10.975 5.108 -5.829 1.00 0.00 C ATOM 1036 CZ TYR A 68 10.897 3.800 -5.398 1.00 0.00 C ATOM 1037 OH TYR A 68 11.387 2.788 -6.190 1.00 0.00 O ATOM 0 H TYR A 68 10.518 5.701 -0.862 1.00 0.00 H new ATOM 0 HA TYR A 68 11.105 8.131 -2.451 1.00 0.00 H new ATOM 0 HB2 TYR A 68 8.494 6.595 -2.383 1.00 0.00 H new ATOM 0 HB3 TYR A 68 9.025 7.776 -3.564 1.00 0.00 H new ATOM 0 HD1 TYR A 68 9.396 4.286 -2.428 1.00 0.00 H new ATOM 0 HD2 TYR A 68 10.546 7.145 -5.371 1.00 0.00 H new ATOM 0 HE1 TYR A 68 10.270 2.478 -3.842 1.00 0.00 H new ATOM 0 HE2 TYR A 68 11.419 5.338 -6.786 1.00 0.00 H new ATOM 0 HH TYR A 68 11.752 3.167 -7.017 1.00 0.00 H new ATOM 1047 N GLY A 69 8.685 7.780 -0.215 1.00 0.00 N ATOM 1048 CA GLY A 69 7.943 8.505 0.800 1.00 0.00 C ATOM 1049 C GLY A 69 6.601 7.869 1.102 1.00 0.00 C ATOM 1050 O GLY A 69 6.240 6.854 0.506 1.00 0.00 O ATOM 0 H GLY A 69 8.382 6.817 -0.362 1.00 0.00 H new ATOM 0 HA2 GLY A 69 8.534 8.551 1.715 1.00 0.00 H new ATOM 0 HA3 GLY A 69 7.789 9.532 0.469 1.00 0.00 H new ATOM 1054 N ALA A 70 5.861 8.465 2.030 1.00 0.00 N ATOM 1055 CA ALA A 70 4.551 7.950 2.411 1.00 0.00 C ATOM 1056 C ALA A 70 3.519 8.205 1.317 1.00 0.00 C ATOM 1057 O ALA A 70 2.573 7.434 1.150 1.00 0.00 O ATOM 1058 CB ALA A 70 4.099 8.579 3.720 1.00 0.00 C ATOM 0 H ALA A 70 6.146 9.306 2.533 1.00 0.00 H new ATOM 0 HA ALA A 70 4.638 6.872 2.547 1.00 0.00 H new ATOM 0 HB1 ALA A 70 3.120 8.186 3.993 1.00 0.00 H new ATOM 0 HB2 ALA A 70 4.817 8.342 4.505 1.00 0.00 H new ATOM 0 HB3 ALA A 70 4.036 9.661 3.601 1.00 0.00 H new ATOM 1064 N GLN A 71 3.707 9.291 0.573 1.00 0.00 N ATOM 1065 CA GLN A 71 2.791 9.646 -0.505 1.00 0.00 C ATOM 1066 C GLN A 71 2.988 8.734 -1.711 1.00 0.00 C ATOM 1067 O GLN A 71 2.038 8.424 -2.431 1.00 0.00 O ATOM 1068 CB GLN A 71 2.996 11.104 -0.918 1.00 0.00 C ATOM 1069 CG GLN A 71 2.152 12.088 -0.122 1.00 0.00 C ATOM 1070 CD GLN A 71 1.941 13.399 -0.853 1.00 0.00 C ATOM 1071 OE1 GLN A 71 2.484 14.434 -0.465 1.00 0.00 O ATOM 1072 NE2 GLN A 71 1.150 13.361 -1.919 1.00 0.00 N ATOM 0 H GLN A 71 4.485 9.939 0.697 1.00 0.00 H new ATOM 0 HA GLN A 71 1.773 9.518 -0.137 1.00 0.00 H new ATOM 0 HB2 GLN A 71 4.048 11.362 -0.799 1.00 0.00 H new ATOM 0 HB3 GLN A 71 2.760 11.209 -1.977 1.00 0.00 H new ATOM 0 HG2 GLN A 71 1.184 11.638 0.095 1.00 0.00 H new ATOM 0 HG3 GLN A 71 2.635 12.284 0.835 1.00 0.00 H new ATOM 0 HE21 GLN A 71 0.721 12.481 -2.205 1.00 0.00 H new ATOM 0 HE22 GLN A 71 0.972 14.212 -2.452 1.00 0.00 H new ATOM 1081 N GLU A 72 4.228 8.308 -1.928 1.00 0.00 N ATOM 1082 CA GLU A 72 4.550 7.432 -3.048 1.00 0.00 C ATOM 1083 C GLU A 72 4.557 5.967 -2.619 1.00 0.00 C ATOM 1084 O GLU A 72 4.357 5.071 -3.438 1.00 0.00 O ATOM 1085 CB GLU A 72 5.911 7.808 -3.640 1.00 0.00 C ATOM 1086 CG GLU A 72 5.963 7.710 -5.157 1.00 0.00 C ATOM 1087 CD GLU A 72 6.237 9.046 -5.820 1.00 0.00 C ATOM 1088 OE1 GLU A 72 5.798 10.080 -5.275 1.00 0.00 O ATOM 1089 OE2 GLU A 72 6.890 9.058 -6.884 1.00 0.00 O ATOM 0 H GLU A 72 5.026 8.555 -1.343 1.00 0.00 H new ATOM 0 HA GLU A 72 3.779 7.562 -3.807 1.00 0.00 H new ATOM 0 HB2 GLU A 72 6.159 8.827 -3.341 1.00 0.00 H new ATOM 0 HB3 GLU A 72 6.675 7.157 -3.216 1.00 0.00 H new ATOM 0 HG2 GLU A 72 6.738 7.000 -5.445 1.00 0.00 H new ATOM 0 HG3 GLU A 72 5.016 7.314 -5.524 1.00 0.00 H new ATOM 1096 N ALA A 73 4.791 5.730 -1.330 1.00 0.00 N ATOM 1097 CA ALA A 73 4.825 4.374 -0.793 1.00 0.00 C ATOM 1098 C ALA A 73 3.559 3.602 -1.156 1.00 0.00 C ATOM 1099 O ALA A 73 3.624 2.444 -1.570 1.00 0.00 O ATOM 1100 CB ALA A 73 5.009 4.409 0.716 1.00 0.00 C ATOM 0 H ALA A 73 4.960 6.461 -0.639 1.00 0.00 H new ATOM 0 HA ALA A 73 5.673 3.856 -1.241 1.00 0.00 H new ATOM 0 HB1 ALA A 73 5.033 3.390 1.103 1.00 0.00 H new ATOM 0 HB2 ALA A 73 5.946 4.911 0.957 1.00 0.00 H new ATOM 0 HB3 ALA A 73 4.180 4.951 1.171 1.00 0.00 H new ATOM 1106 N VAL A 74 2.410 4.249 -0.998 1.00 0.00 N ATOM 1107 CA VAL A 74 1.132 3.622 -1.308 1.00 0.00 C ATOM 1108 C VAL A 74 0.912 3.539 -2.816 1.00 0.00 C ATOM 1109 O VAL A 74 0.248 2.626 -3.307 1.00 0.00 O ATOM 1110 CB VAL A 74 -0.042 4.388 -0.669 1.00 0.00 C ATOM 1111 CG1 VAL A 74 -1.345 3.626 -0.857 1.00 0.00 C ATOM 1112 CG2 VAL A 74 0.227 4.642 0.807 1.00 0.00 C ATOM 0 H VAL A 74 2.338 5.208 -0.657 1.00 0.00 H new ATOM 0 HA VAL A 74 1.165 2.615 -0.892 1.00 0.00 H new ATOM 0 HB VAL A 74 -0.137 5.352 -1.169 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -2.162 4.183 -0.399 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -1.543 3.501 -1.922 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -1.265 2.646 -0.386 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -0.613 5.184 1.242 1.00 0.00 H new ATOM 0 HG22 VAL A 74 0.351 3.690 1.323 1.00 0.00 H new ATOM 0 HG23 VAL A 74 1.136 5.234 0.915 1.00 0.00 H new ATOM 1122 N ARG A 75 1.473 4.500 -3.544 1.00 0.00 N ATOM 1123 CA ARG A 75 1.338 4.534 -4.996 1.00 0.00 C ATOM 1124 C ARG A 75 2.062 3.356 -5.639 1.00 0.00 C ATOM 1125 O ARG A 75 1.648 2.856 -6.685 1.00 0.00 O ATOM 1126 CB ARG A 75 1.892 5.849 -5.550 1.00 0.00 C ATOM 1127 CG ARG A 75 0.958 7.034 -5.355 1.00 0.00 C ATOM 1128 CD ARG A 75 0.647 7.725 -6.673 1.00 0.00 C ATOM 1129 NE ARG A 75 1.490 8.898 -6.889 1.00 0.00 N ATOM 1130 CZ ARG A 75 1.302 9.776 -7.872 1.00 0.00 C ATOM 1131 NH1 ARG A 75 0.301 9.618 -8.729 1.00 0.00 N ATOM 1132 NH2 ARG A 75 2.116 10.816 -7.996 1.00 0.00 N ATOM 0 H ARG A 75 2.024 5.264 -3.153 1.00 0.00 H new ATOM 0 HA ARG A 75 0.278 4.462 -5.238 1.00 0.00 H new ATOM 0 HB2 ARG A 75 2.845 6.065 -5.066 1.00 0.00 H new ATOM 0 HB3 ARG A 75 2.095 5.728 -6.614 1.00 0.00 H new ATOM 0 HG2 ARG A 75 0.030 6.695 -4.894 1.00 0.00 H new ATOM 0 HG3 ARG A 75 1.413 7.747 -4.668 1.00 0.00 H new ATOM 0 HD2 ARG A 75 0.788 7.021 -7.493 1.00 0.00 H new ATOM 0 HD3 ARG A 75 -0.401 8.024 -6.687 1.00 0.00 H new ATOM 0 HE ARG A 75 2.269 9.054 -6.249 1.00 0.00 H new ATOM 0 HH11 ARG A 75 -0.329 8.821 -8.636 1.00 0.00 H new ATOM 0 HH12 ARG A 75 0.161 10.294 -9.480 1.00 0.00 H new ATOM 0 HH21 ARG A 75 2.885 10.943 -7.338 1.00 0.00 H new ATOM 0 HH22 ARG A 75 1.973 11.489 -8.749 1.00 0.00 H new ATOM 1146 N VAL A 76 3.145 2.918 -5.007 1.00 0.00 N ATOM 1147 CA VAL A 76 3.929 1.799 -5.517 1.00 0.00 C ATOM 1148 C VAL A 76 3.124 0.504 -5.486 1.00 0.00 C ATOM 1149 O VAL A 76 3.031 -0.204 -6.489 1.00 0.00 O ATOM 1150 CB VAL A 76 5.225 1.603 -4.708 1.00 0.00 C ATOM 1151 CG1 VAL A 76 6.120 0.570 -5.374 1.00 0.00 C ATOM 1152 CG2 VAL A 76 5.955 2.928 -4.540 1.00 0.00 C ATOM 0 H VAL A 76 3.500 3.321 -4.140 1.00 0.00 H new ATOM 0 HA VAL A 76 4.187 2.040 -6.548 1.00 0.00 H new ATOM 0 HB VAL A 76 4.961 1.233 -3.717 1.00 0.00 H new ATOM 0 HG11 VAL A 76 7.030 0.445 -4.788 1.00 0.00 H new ATOM 0 HG12 VAL A 76 5.594 -0.383 -5.434 1.00 0.00 H new ATOM 0 HG13 VAL A 76 6.378 0.906 -6.378 1.00 0.00 H new ATOM 0 HG21 VAL A 76 6.868 2.770 -3.966 1.00 0.00 H new ATOM 0 HG22 VAL A 76 6.208 3.331 -5.521 1.00 0.00 H new ATOM 0 HG23 VAL A 76 5.312 3.633 -4.013 1.00 0.00 H new ATOM 1162 N VAL A 77 2.545 0.199 -4.329 1.00 0.00 N ATOM 1163 CA VAL A 77 1.750 -1.012 -4.170 1.00 0.00 C ATOM 1164 C VAL A 77 0.547 -1.008 -5.106 1.00 0.00 C ATOM 1165 O VAL A 77 0.154 -2.049 -5.632 1.00 0.00 O ATOM 1166 CB VAL A 77 1.257 -1.176 -2.720 1.00 0.00 C ATOM 1167 CG1 VAL A 77 0.605 -2.536 -2.526 1.00 0.00 C ATOM 1168 CG2 VAL A 77 2.406 -0.983 -1.741 1.00 0.00 C ATOM 0 H VAL A 77 2.612 0.774 -3.489 1.00 0.00 H new ATOM 0 HA VAL A 77 2.400 -1.850 -4.422 1.00 0.00 H new ATOM 0 HB VAL A 77 0.508 -0.410 -2.522 1.00 0.00 H new ATOM 0 HG11 VAL A 77 0.264 -2.632 -1.495 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -0.246 -2.631 -3.201 1.00 0.00 H new ATOM 0 HG13 VAL A 77 1.329 -3.321 -2.743 1.00 0.00 H new ATOM 0 HG21 VAL A 77 2.039 -1.102 -0.722 1.00 0.00 H new ATOM 0 HG22 VAL A 77 3.180 -1.725 -1.937 1.00 0.00 H new ATOM 0 HG23 VAL A 77 2.823 0.017 -1.862 1.00 0.00 H new ATOM 1178 N SER A 78 -0.033 0.170 -5.312 1.00 0.00 N ATOM 1179 CA SER A 78 -1.192 0.309 -6.187 1.00 0.00 C ATOM 1180 C SER A 78 -0.866 -0.154 -7.604 1.00 0.00 C ATOM 1181 O SER A 78 -1.737 -0.643 -8.324 1.00 0.00 O ATOM 1182 CB SER A 78 -1.669 1.763 -6.211 1.00 0.00 C ATOM 1183 OG SER A 78 -2.853 1.899 -6.977 1.00 0.00 O ATOM 0 H SER A 78 0.280 1.042 -4.885 1.00 0.00 H new ATOM 0 HA SER A 78 -1.989 -0.322 -5.793 1.00 0.00 H new ATOM 0 HB2 SER A 78 -1.850 2.106 -5.192 1.00 0.00 H new ATOM 0 HB3 SER A 78 -0.888 2.398 -6.628 1.00 0.00 H new ATOM 0 HG SER A 78 -3.138 2.837 -6.975 1.00 0.00 H new ATOM 1189 N ARG A 79 0.394 0.003 -7.998 1.00 0.00 N ATOM 1190 CA ARG A 79 0.834 -0.399 -9.329 1.00 0.00 C ATOM 1191 C ARG A 79 1.064 -1.906 -9.394 1.00 0.00 C ATOM 1192 O ARG A 79 0.876 -2.529 -10.439 1.00 0.00 O ATOM 1193 CB ARG A 79 2.116 0.342 -9.712 1.00 0.00 C ATOM 1194 CG ARG A 79 1.871 1.594 -10.538 1.00 0.00 C ATOM 1195 CD ARG A 79 3.091 1.962 -11.366 1.00 0.00 C ATOM 1196 NE ARG A 79 2.725 2.476 -12.685 1.00 0.00 N ATOM 1197 CZ ARG A 79 2.308 3.721 -12.906 1.00 0.00 C ATOM 1198 NH1 ARG A 79 2.204 4.582 -11.901 1.00 0.00 N ATOM 1199 NH2 ARG A 79 1.994 4.106 -14.135 1.00 0.00 N ATOM 0 H ARG A 79 1.128 0.405 -7.415 1.00 0.00 H new ATOM 0 HA ARG A 79 0.048 -0.139 -10.038 1.00 0.00 H new ATOM 0 HB2 ARG A 79 2.653 0.615 -8.804 1.00 0.00 H new ATOM 0 HB3 ARG A 79 2.762 -0.333 -10.273 1.00 0.00 H new ATOM 0 HG2 ARG A 79 1.017 1.435 -11.197 1.00 0.00 H new ATOM 0 HG3 ARG A 79 1.615 2.422 -9.878 1.00 0.00 H new ATOM 0 HD2 ARG A 79 3.677 2.712 -10.835 1.00 0.00 H new ATOM 0 HD3 ARG A 79 3.727 1.085 -11.483 1.00 0.00 H new ATOM 0 HE ARG A 79 2.793 1.844 -13.483 1.00 0.00 H new ATOM 0 HH11 ARG A 79 2.444 4.291 -10.953 1.00 0.00 H new ATOM 0 HH12 ARG A 79 1.884 5.534 -12.076 1.00 0.00 H new ATOM 0 HH21 ARG A 79 2.072 3.449 -14.911 1.00 0.00 H new ATOM 0 HH22 ARG A 79 1.674 5.060 -14.305 1.00 0.00 H new ATOM 1213 N SER A 80 1.472 -2.486 -8.270 1.00 0.00 N ATOM 1214 CA SER A 80 1.728 -3.920 -8.200 1.00 0.00 C ATOM 1215 C SER A 80 0.421 -4.703 -8.124 1.00 0.00 C ATOM 1216 O SER A 80 0.327 -5.822 -8.629 1.00 0.00 O ATOM 1217 CB SER A 80 2.602 -4.245 -6.986 1.00 0.00 C ATOM 1218 OG SER A 80 3.173 -5.536 -7.099 1.00 0.00 O ATOM 0 H SER A 80 1.632 -1.985 -7.396 1.00 0.00 H new ATOM 0 HA SER A 80 2.255 -4.214 -9.108 1.00 0.00 H new ATOM 0 HB2 SER A 80 3.393 -3.501 -6.894 1.00 0.00 H new ATOM 0 HB3 SER A 80 2.003 -4.187 -6.077 1.00 0.00 H new ATOM 0 HG SER A 80 4.037 -5.553 -6.637 1.00 0.00 H new ATOM 1224 N LEU A 81 -0.584 -4.107 -7.492 1.00 0.00 N ATOM 1225 CA LEU A 81 -1.887 -4.749 -7.351 1.00 0.00 C ATOM 1226 C LEU A 81 -2.586 -4.862 -8.702 1.00 0.00 C ATOM 1227 O LEU A 81 -3.164 -5.899 -9.029 1.00 0.00 O ATOM 1228 CB LEU A 81 -2.764 -3.963 -6.374 1.00 0.00 C ATOM 1229 CG LEU A 81 -2.262 -3.937 -4.930 1.00 0.00 C ATOM 1230 CD1 LEU A 81 -3.026 -2.901 -4.119 1.00 0.00 C ATOM 1231 CD2 LEU A 81 -2.391 -5.313 -4.297 1.00 0.00 C ATOM 0 H LEU A 81 -0.522 -3.181 -7.069 1.00 0.00 H new ATOM 0 HA LEU A 81 -1.729 -5.753 -6.958 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -2.850 -2.937 -6.731 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -3.767 -4.389 -6.386 1.00 0.00 H new ATOM 0 HG LEU A 81 -1.208 -3.659 -4.936 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -2.656 -2.896 -3.094 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -2.883 -1.915 -4.561 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -4.088 -3.149 -4.120 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -2.029 -5.276 -3.269 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -3.437 -5.619 -4.303 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -1.799 -6.031 -4.864 1.00 0.00 H new ATOM 1243 N LEU A 82 -2.532 -3.788 -9.482 1.00 0.00 N ATOM 1244 CA LEU A 82 -3.161 -3.765 -10.798 1.00 0.00 C ATOM 1245 C LEU A 82 -2.576 -4.848 -11.701 1.00 0.00 C ATOM 1246 O LEU A 82 -3.293 -5.469 -12.486 1.00 0.00 O ATOM 1247 CB LEU A 82 -2.986 -2.392 -11.448 1.00 0.00 C ATOM 1248 CG LEU A 82 -3.936 -1.308 -10.938 1.00 0.00 C ATOM 1249 CD1 LEU A 82 -3.724 -0.009 -11.702 1.00 0.00 C ATOM 1250 CD2 LEU A 82 -5.381 -1.769 -11.056 1.00 0.00 C ATOM 0 H LEU A 82 -2.059 -2.921 -9.226 1.00 0.00 H new ATOM 0 HA LEU A 82 -4.225 -3.963 -10.667 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -1.960 -2.059 -11.288 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -3.123 -2.496 -12.524 1.00 0.00 H new ATOM 0 HG LEU A 82 -3.718 -1.125 -9.886 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -4.409 0.751 -11.325 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -2.697 0.329 -11.567 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -3.914 -0.175 -12.762 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -6.044 -0.986 -10.689 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -5.612 -1.979 -12.100 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -5.524 -2.673 -10.464 1.00 0.00 H new ATOM 1262 N ALA A 83 -1.271 -5.068 -11.582 1.00 0.00 N ATOM 1263 CA ALA A 83 -0.591 -6.076 -12.388 1.00 0.00 C ATOM 1264 C ALA A 83 -1.031 -7.482 -11.992 1.00 0.00 C ATOM 1265 O ALA A 83 -1.084 -8.385 -12.826 1.00 0.00 O ATOM 1266 CB ALA A 83 0.917 -5.934 -12.248 1.00 0.00 C ATOM 0 H ALA A 83 -0.664 -4.563 -10.937 1.00 0.00 H new ATOM 0 HA ALA A 83 -0.864 -5.918 -13.431 1.00 0.00 H new ATOM 0 HB1 ALA A 83 1.412 -6.692 -12.855 1.00 0.00 H new ATOM 0 HB2 ALA A 83 1.222 -4.943 -12.586 1.00 0.00 H new ATOM 0 HB3 ALA A 83 1.199 -6.064 -11.203 1.00 0.00 H new ATOM 1272 N MET A 84 -1.346 -7.659 -10.713 1.00 0.00 N ATOM 1273 CA MET A 84 -1.782 -8.955 -10.204 1.00 0.00 C ATOM 1274 C MET A 84 -3.307 -9.053 -10.164 1.00 0.00 C ATOM 1275 O MET A 84 -3.859 -10.077 -9.761 1.00 0.00 O ATOM 1276 CB MET A 84 -1.209 -9.194 -8.806 1.00 0.00 C ATOM 1277 CG MET A 84 0.306 -9.085 -8.741 1.00 0.00 C ATOM 1278 SD MET A 84 1.089 -10.583 -8.113 1.00 0.00 S ATOM 1279 CE MET A 84 0.675 -10.478 -6.373 1.00 0.00 C ATOM 0 H MET A 84 -1.308 -6.921 -10.010 1.00 0.00 H new ATOM 0 HA MET A 84 -1.410 -9.722 -10.883 1.00 0.00 H new ATOM 0 HB2 MET A 84 -1.646 -8.473 -8.115 1.00 0.00 H new ATOM 0 HB3 MET A 84 -1.508 -10.185 -8.465 1.00 0.00 H new ATOM 0 HG2 MET A 84 0.693 -8.868 -9.737 1.00 0.00 H new ATOM 0 HG3 MET A 84 0.578 -8.244 -8.103 1.00 0.00 H new ATOM 0 HE1 MET A 84 1.346 -11.118 -5.800 1.00 0.00 H new ATOM 0 HE2 MET A 84 0.781 -9.447 -6.035 1.00 0.00 H new ATOM 0 HE3 MET A 84 -0.354 -10.805 -6.224 1.00 0.00 H new ATOM 1289 N ASN A 85 -3.985 -7.987 -10.583 1.00 0.00 N ATOM 1290 CA ASN A 85 -5.444 -7.963 -10.591 1.00 0.00 C ATOM 1291 C ASN A 85 -5.998 -8.061 -9.172 1.00 0.00 C ATOM 1292 O ASN A 85 -6.358 -9.142 -8.707 1.00 0.00 O ATOM 1293 CB ASN A 85 -5.990 -9.108 -11.449 1.00 0.00 C ATOM 1294 CG ASN A 85 -7.107 -8.658 -12.370 1.00 0.00 C ATOM 1295 OD1 ASN A 85 -6.943 -7.721 -13.151 1.00 0.00 O ATOM 1296 ND2 ASN A 85 -8.251 -9.326 -12.283 1.00 0.00 N ATOM 0 H ASN A 85 -3.547 -7.130 -10.921 1.00 0.00 H new ATOM 0 HA ASN A 85 -5.765 -7.014 -11.020 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -5.180 -9.531 -12.044 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -6.356 -9.903 -10.799 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -9.038 -9.069 -12.878 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -8.343 -10.097 -11.621 1.00 0.00 H new ATOM 1303 N LEU A 86 -6.062 -6.922 -8.490 1.00 0.00 N ATOM 1304 CA LEU A 86 -6.571 -6.876 -7.123 1.00 0.00 C ATOM 1305 C LEU A 86 -7.171 -5.507 -6.813 1.00 0.00 C ATOM 1306 O LEU A 86 -6.692 -4.791 -5.933 1.00 0.00 O ATOM 1307 CB LEU A 86 -5.451 -7.195 -6.129 1.00 0.00 C ATOM 1308 CG LEU A 86 -4.935 -8.634 -6.175 1.00 0.00 C ATOM 1309 CD1 LEU A 86 -3.651 -8.766 -5.371 1.00 0.00 C ATOM 1310 CD2 LEU A 86 -5.993 -9.596 -5.656 1.00 0.00 C ATOM 0 H LEU A 86 -5.768 -6.019 -8.861 1.00 0.00 H new ATOM 0 HA LEU A 86 -7.356 -7.626 -7.027 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -4.616 -6.520 -6.317 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -5.810 -6.986 -5.121 1.00 0.00 H new ATOM 0 HG LEU A 86 -4.718 -8.889 -7.212 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -3.298 -9.796 -5.415 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -2.891 -8.104 -5.787 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -3.842 -8.492 -4.333 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -5.609 -10.615 -5.696 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -6.242 -9.342 -4.626 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -6.888 -9.521 -6.274 1.00 0.00 H new ATOM 1322 N MET A 87 -8.222 -5.149 -7.543 1.00 0.00 N ATOM 1323 CA MET A 87 -8.890 -3.866 -7.350 1.00 0.00 C ATOM 1324 C MET A 87 -9.371 -3.707 -5.909 1.00 0.00 C ATOM 1325 O MET A 87 -9.541 -2.589 -5.424 1.00 0.00 O ATOM 1326 CB MET A 87 -10.073 -3.736 -8.310 1.00 0.00 C ATOM 1327 CG MET A 87 -9.671 -3.325 -9.718 1.00 0.00 C ATOM 1328 SD MET A 87 -10.198 -1.651 -10.135 1.00 0.00 S ATOM 1329 CE MET A 87 -8.660 -0.950 -10.727 1.00 0.00 C ATOM 0 H MET A 87 -8.631 -5.730 -8.275 1.00 0.00 H new ATOM 0 HA MET A 87 -8.168 -3.077 -7.560 1.00 0.00 H new ATOM 0 HB2 MET A 87 -10.600 -4.689 -8.355 1.00 0.00 H new ATOM 0 HB3 MET A 87 -10.774 -3.002 -7.912 1.00 0.00 H new ATOM 0 HG2 MET A 87 -8.588 -3.395 -9.817 1.00 0.00 H new ATOM 0 HG3 MET A 87 -10.102 -4.026 -10.433 1.00 0.00 H new ATOM 0 HE1 MET A 87 -8.868 -0.043 -11.295 1.00 0.00 H new ATOM 0 HE2 MET A 87 -8.020 -0.708 -9.878 1.00 0.00 H new ATOM 0 HE3 MET A 87 -8.154 -1.672 -11.368 1.00 0.00 H new ATOM 1339 N GLU A 88 -9.589 -4.830 -5.231 1.00 0.00 N ATOM 1340 CA GLU A 88 -10.052 -4.811 -3.847 1.00 0.00 C ATOM 1341 C GLU A 88 -9.105 -4.002 -2.964 1.00 0.00 C ATOM 1342 O GLU A 88 -9.542 -3.174 -2.165 1.00 0.00 O ATOM 1343 CB GLU A 88 -10.178 -6.239 -3.311 1.00 0.00 C ATOM 1344 CG GLU A 88 -11.617 -6.705 -3.151 1.00 0.00 C ATOM 1345 CD GLU A 88 -11.864 -7.389 -1.821 1.00 0.00 C ATOM 1346 OE1 GLU A 88 -11.906 -6.686 -0.790 1.00 0.00 O ATOM 1347 OE2 GLU A 88 -12.017 -8.629 -1.812 1.00 0.00 O ATOM 0 H GLU A 88 -9.453 -5.764 -5.617 1.00 0.00 H new ATOM 0 HA GLU A 88 -11.032 -4.334 -3.824 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -9.658 -6.919 -3.986 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -9.675 -6.302 -2.346 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -12.285 -5.849 -3.244 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -11.865 -7.392 -3.960 1.00 0.00 H new ATOM 1354 N LEU A 89 -7.809 -4.250 -3.112 1.00 0.00 N ATOM 1355 CA LEU A 89 -6.802 -3.545 -2.327 1.00 0.00 C ATOM 1356 C LEU A 89 -6.552 -2.148 -2.887 1.00 0.00 C ATOM 1357 O LEU A 89 -6.298 -1.205 -2.137 1.00 0.00 O ATOM 1358 CB LEU A 89 -5.494 -4.339 -2.305 1.00 0.00 C ATOM 1359 CG LEU A 89 -5.455 -5.491 -1.301 1.00 0.00 C ATOM 1360 CD1 LEU A 89 -4.193 -6.319 -1.488 1.00 0.00 C ATOM 1361 CD2 LEU A 89 -5.540 -4.959 0.122 1.00 0.00 C ATOM 0 H LEU A 89 -7.431 -4.933 -3.768 1.00 0.00 H new ATOM 0 HA LEU A 89 -7.177 -3.446 -1.308 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -5.313 -4.740 -3.302 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -4.675 -3.655 -2.083 1.00 0.00 H new ATOM 0 HG LEU A 89 -6.317 -6.134 -1.480 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -4.182 -7.134 -0.765 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -4.173 -6.729 -2.498 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -3.318 -5.688 -1.336 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -5.511 -5.792 0.824 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -4.698 -4.294 0.313 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -6.472 -4.409 0.250 1.00 0.00 H new ATOM 1373 N VAL A 90 -6.626 -2.023 -4.208 1.00 0.00 N ATOM 1374 CA VAL A 90 -6.408 -0.741 -4.867 1.00 0.00 C ATOM 1375 C VAL A 90 -7.514 0.251 -4.516 1.00 0.00 C ATOM 1376 O VAL A 90 -7.288 1.462 -4.486 1.00 0.00 O ATOM 1377 CB VAL A 90 -6.340 -0.899 -6.398 1.00 0.00 C ATOM 1378 CG1 VAL A 90 -5.999 0.426 -7.062 1.00 0.00 C ATOM 1379 CG2 VAL A 90 -5.325 -1.968 -6.778 1.00 0.00 C ATOM 0 H VAL A 90 -6.835 -2.794 -4.843 1.00 0.00 H new ATOM 0 HA VAL A 90 -5.452 -0.359 -4.508 1.00 0.00 H new ATOM 0 HB VAL A 90 -7.321 -1.214 -6.754 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -5.956 0.291 -8.143 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -6.764 1.163 -6.818 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -5.031 0.775 -6.701 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -5.290 -2.067 -7.863 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -4.340 -1.683 -6.407 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -5.617 -2.921 -6.336 1.00 0.00 H new ATOM 1389 N ASP A 91 -8.708 -0.268 -4.251 1.00 0.00 N ATOM 1390 CA ASP A 91 -9.847 0.573 -3.903 1.00 0.00 C ATOM 1391 C ASP A 91 -9.635 1.243 -2.549 1.00 0.00 C ATOM 1392 O ASP A 91 -10.121 2.348 -2.309 1.00 0.00 O ATOM 1393 CB ASP A 91 -11.132 -0.257 -3.881 1.00 0.00 C ATOM 1394 CG ASP A 91 -12.322 0.505 -4.430 1.00 0.00 C ATOM 1395 OD1 ASP A 91 -12.116 1.383 -5.295 1.00 0.00 O ATOM 1396 OD2 ASP A 91 -13.459 0.224 -3.997 1.00 0.00 O ATOM 0 H ASP A 91 -8.912 -1.267 -4.271 1.00 0.00 H new ATOM 0 HA ASP A 91 -9.939 1.351 -4.661 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -10.985 -1.165 -4.465 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -11.343 -0.567 -2.858 1.00 0.00 H new ATOM 1401 N TYR A 92 -8.906 0.566 -1.667 1.00 0.00 N ATOM 1402 CA TYR A 92 -8.630 1.095 -0.337 1.00 0.00 C ATOM 1403 C TYR A 92 -7.436 2.044 -0.364 1.00 0.00 C ATOM 1404 O TYR A 92 -7.396 3.029 0.374 1.00 0.00 O ATOM 1405 CB TYR A 92 -8.364 -0.047 0.646 1.00 0.00 C ATOM 1406 CG TYR A 92 -8.108 0.416 2.062 1.00 0.00 C ATOM 1407 CD1 TYR A 92 -9.159 0.777 2.896 1.00 0.00 C ATOM 1408 CD2 TYR A 92 -6.815 0.494 2.564 1.00 0.00 C ATOM 1409 CE1 TYR A 92 -8.929 1.203 4.190 1.00 0.00 C ATOM 1410 CE2 TYR A 92 -6.577 0.918 3.858 1.00 0.00 C ATOM 1411 CZ TYR A 92 -7.637 1.270 4.666 1.00 0.00 C ATOM 1412 OH TYR A 92 -7.404 1.692 5.955 1.00 0.00 O ATOM 0 H TYR A 92 -8.496 -0.350 -1.850 1.00 0.00 H new ATOM 0 HA TYR A 92 -9.507 1.652 -0.008 1.00 0.00 H new ATOM 0 HB2 TYR A 92 -9.219 -0.723 0.643 1.00 0.00 H new ATOM 0 HB3 TYR A 92 -7.504 -0.620 0.299 1.00 0.00 H new ATOM 0 HD1 TYR A 92 -10.172 0.724 2.527 1.00 0.00 H new ATOM 0 HD2 TYR A 92 -5.983 0.219 1.933 1.00 0.00 H new ATOM 0 HE1 TYR A 92 -9.757 1.482 4.825 1.00 0.00 H new ATOM 0 HE2 TYR A 92 -5.566 0.973 4.234 1.00 0.00 H new ATOM 0 HH TYR A 92 -6.441 1.681 6.134 1.00 0.00 H new ATOM 1422 N LEU A 93 -6.464 1.741 -1.219 1.00 0.00 N ATOM 1423 CA LEU A 93 -5.268 2.567 -1.342 1.00 0.00 C ATOM 1424 C LEU A 93 -5.564 3.842 -2.124 1.00 0.00 C ATOM 1425 O LEU A 93 -4.968 4.889 -1.872 1.00 0.00 O ATOM 1426 CB LEU A 93 -4.149 1.782 -2.030 1.00 0.00 C ATOM 1427 CG LEU A 93 -3.692 0.523 -1.290 1.00 0.00 C ATOM 1428 CD1 LEU A 93 -2.535 -0.137 -2.023 1.00 0.00 C ATOM 1429 CD2 LEU A 93 -3.297 0.862 0.140 1.00 0.00 C ATOM 0 H LEU A 93 -6.481 0.930 -1.837 1.00 0.00 H new ATOM 0 HA LEU A 93 -4.945 2.845 -0.339 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -4.486 1.497 -3.027 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -3.290 2.441 -2.160 1.00 0.00 H new ATOM 0 HG LEU A 93 -4.523 -0.181 -1.260 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -2.224 -1.031 -1.482 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -2.852 -0.414 -3.029 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -1.699 0.559 -2.085 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -2.974 -0.044 0.653 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -2.480 1.584 0.130 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -4.153 1.289 0.662 1.00 0.00 H new ATOM 1441 N ASN A 94 -6.490 3.747 -3.073 1.00 0.00 N ATOM 1442 CA ASN A 94 -6.866 4.893 -3.891 1.00 0.00 C ATOM 1443 C ASN A 94 -7.601 5.939 -3.059 1.00 0.00 C ATOM 1444 O ASN A 94 -7.455 7.140 -3.283 1.00 0.00 O ATOM 1445 CB ASN A 94 -7.743 4.445 -5.062 1.00 0.00 C ATOM 1446 CG ASN A 94 -6.952 4.279 -6.345 1.00 0.00 C ATOM 1447 OD1 ASN A 94 -7.298 4.849 -7.380 1.00 0.00 O ATOM 1448 ND2 ASN A 94 -5.883 3.493 -6.284 1.00 0.00 N ATOM 0 H ASN A 94 -6.993 2.888 -3.294 1.00 0.00 H new ATOM 0 HA ASN A 94 -5.954 5.343 -4.282 1.00 0.00 H new ATOM 0 HB2 ASN A 94 -8.225 3.500 -4.811 1.00 0.00 H new ATOM 0 HB3 ASN A 94 -8.536 5.176 -5.219 1.00 0.00 H new ATOM 0 HD21 ASN A 94 -5.313 3.342 -7.116 1.00 0.00 H new ATOM 0 HD22 ASN A 94 -5.632 3.040 -5.405 1.00 0.00 H new ATOM 1455 N GLN A 95 -8.392 5.473 -2.097 1.00 0.00 N ATOM 1456 CA GLN A 95 -9.150 6.368 -1.231 1.00 0.00 C ATOM 1457 C GLN A 95 -8.223 7.128 -0.288 1.00 0.00 C ATOM 1458 O GLN A 95 -8.497 8.271 0.081 1.00 0.00 O ATOM 1459 CB GLN A 95 -10.182 5.580 -0.424 1.00 0.00 C ATOM 1460 CG GLN A 95 -11.506 5.395 -1.145 1.00 0.00 C ATOM 1461 CD GLN A 95 -12.687 5.347 -0.194 1.00 0.00 C ATOM 1462 OE1 GLN A 95 -12.761 6.121 0.761 1.00 0.00 O ATOM 1463 NE2 GLN A 95 -13.616 4.435 -0.450 1.00 0.00 N ATOM 0 H GLN A 95 -8.524 4.481 -1.898 1.00 0.00 H new ATOM 0 HA GLN A 95 -9.668 7.090 -1.863 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -9.770 4.600 -0.181 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -10.361 6.093 0.521 1.00 0.00 H new ATOM 0 HG2 GLN A 95 -11.647 6.212 -1.853 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -11.474 4.473 -1.725 1.00 0.00 H new ATOM 0 HE21 GLN A 95 -13.514 3.814 -1.253 1.00 0.00 H new ATOM 0 HE22 GLN A 95 -14.433 4.355 0.156 1.00 0.00 H new ATOM 1472 N VAL A 96 -7.124 6.487 0.098 1.00 0.00 N ATOM 1473 CA VAL A 96 -6.157 7.103 0.997 1.00 0.00 C ATOM 1474 C VAL A 96 -5.110 7.894 0.219 1.00 0.00 C ATOM 1475 O VAL A 96 -4.354 7.332 -0.572 1.00 0.00 O ATOM 1476 CB VAL A 96 -5.444 6.048 1.864 1.00 0.00 C ATOM 1477 CG1 VAL A 96 -4.590 6.719 2.929 1.00 0.00 C ATOM 1478 CG2 VAL A 96 -6.457 5.106 2.497 1.00 0.00 C ATOM 0 H VAL A 96 -6.882 5.541 -0.198 1.00 0.00 H new ATOM 0 HA VAL A 96 -6.714 7.779 1.645 1.00 0.00 H new ATOM 0 HB VAL A 96 -4.787 5.461 1.223 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -4.095 5.957 3.531 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -3.840 7.348 2.450 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -5.223 7.333 3.570 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -5.936 4.367 3.106 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -7.141 5.676 3.125 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -7.021 4.598 1.714 1.00 0.00 H new ATOM 1488 N CYS A 97 -5.074 9.203 0.450 1.00 0.00 N ATOM 1489 CA CYS A 97 -4.119 10.073 -0.228 1.00 0.00 C ATOM 1490 C CYS A 97 -4.121 11.468 0.388 1.00 0.00 C ATOM 1491 O CYS A 97 -4.737 12.391 -0.143 1.00 0.00 O ATOM 1492 CB CYS A 97 -4.448 10.159 -1.719 1.00 0.00 C ATOM 1493 SG CYS A 97 -3.186 10.998 -2.706 1.00 0.00 S ATOM 0 H CYS A 97 -5.695 9.684 1.101 1.00 0.00 H new ATOM 0 HA CYS A 97 -3.124 9.645 -0.107 1.00 0.00 H new ATOM 0 HB2 CYS A 97 -4.587 9.150 -2.108 1.00 0.00 H new ATOM 0 HB3 CYS A 97 -5.397 10.682 -1.841 1.00 0.00 H new ATOM 0 HG CYS A 97 -3.553 11.019 -3.953 1.00 0.00 H new ATOM 1499 N LEU A 98 -3.427 11.614 1.512 1.00 0.00 N ATOM 1500 CA LEU A 98 -3.349 12.896 2.201 1.00 0.00 C ATOM 1501 C LEU A 98 -1.971 13.097 2.823 1.00 0.00 C ATOM 1502 O LEU A 98 -1.440 12.204 3.483 1.00 0.00 O ATOM 1503 CB LEU A 98 -4.428 12.985 3.282 1.00 0.00 C ATOM 1504 CG LEU A 98 -5.864 13.060 2.759 1.00 0.00 C ATOM 1505 CD1 LEU A 98 -6.817 12.358 3.714 1.00 0.00 C ATOM 1506 CD2 LEU A 98 -6.280 14.509 2.555 1.00 0.00 C ATOM 0 H LEU A 98 -2.911 10.860 1.965 1.00 0.00 H new ATOM 0 HA LEU A 98 -3.515 13.685 1.467 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -4.340 12.116 3.934 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -4.234 13.865 3.895 1.00 0.00 H new ATOM 0 HG LEU A 98 -5.908 12.551 1.796 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -7.834 12.422 3.326 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -6.530 11.311 3.810 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -6.771 12.838 4.692 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -7.304 14.545 2.183 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -6.220 15.042 3.504 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -5.614 14.980 1.832 1.00 0.00 H new ATOM 1518 N ASN A 99 -1.398 14.276 2.609 1.00 0.00 N ATOM 1519 CA ASN A 99 -0.080 14.596 3.148 1.00 0.00 C ATOM 1520 C ASN A 99 0.212 16.087 3.022 1.00 0.00 C ATOM 1521 O ASN A 99 0.378 16.784 4.022 1.00 0.00 O ATOM 1522 CB ASN A 99 0.999 13.788 2.426 1.00 0.00 C ATOM 1523 CG ASN A 99 2.363 13.942 3.070 1.00 0.00 C ATOM 1524 OD1 ASN A 99 2.570 13.546 4.216 1.00 0.00 O ATOM 1525 ND2 ASN A 99 3.303 14.523 2.332 1.00 0.00 N ATOM 0 H ASN A 99 -1.825 15.027 2.066 1.00 0.00 H new ATOM 0 HA ASN A 99 -0.073 14.332 4.206 1.00 0.00 H new ATOM 0 HB2 ASN A 99 0.719 12.735 2.422 1.00 0.00 H new ATOM 0 HB3 ASN A 99 1.053 14.107 1.385 1.00 0.00 H new ATOM 0 HD21 ASN A 99 4.240 14.656 2.712 1.00 0.00 H new ATOM 0 HD22 ASN A 99 3.087 14.836 1.386 1.00 0.00 H new ATOM 1532 N ASP A 100 0.274 16.569 1.785 1.00 0.00 N ATOM 1533 CA ASP A 100 0.547 17.978 1.527 1.00 0.00 C ATOM 1534 C ASP A 100 0.025 18.391 0.154 1.00 0.00 C ATOM 1535 O ASP A 100 0.670 18.148 -0.865 1.00 0.00 O ATOM 1536 CB ASP A 100 2.049 18.254 1.620 1.00 0.00 C ATOM 1537 CG ASP A 100 2.450 18.820 2.968 1.00 0.00 C ATOM 1538 OD1 ASP A 100 2.757 18.022 3.879 1.00 0.00 O ATOM 1539 OD2 ASP A 100 2.460 20.060 3.112 1.00 0.00 O ATOM 0 H ASP A 100 0.139 16.005 0.946 1.00 0.00 H new ATOM 0 HA ASP A 100 0.030 18.567 2.284 1.00 0.00 H new ATOM 0 HB2 ASP A 100 2.597 17.329 1.439 1.00 0.00 H new ATOM 0 HB3 ASP A 100 2.336 18.954 0.835 1.00 0.00 H new ATOM 1544 N TYR A 101 -1.147 19.017 0.136 1.00 0.00 N ATOM 1545 CA TYR A 101 -1.756 19.464 -1.110 1.00 0.00 C ATOM 1546 C TYR A 101 -1.554 20.963 -1.307 1.00 0.00 C ATOM 1547 O TYR A 101 -1.386 21.436 -2.432 1.00 0.00 O ATOM 1548 CB TYR A 101 -3.250 19.133 -1.121 1.00 0.00 C ATOM 1549 CG TYR A 101 -3.579 17.840 -1.833 1.00 0.00 C ATOM 1550 CD1 TYR A 101 -3.710 17.799 -3.215 1.00 0.00 C ATOM 1551 CD2 TYR A 101 -3.759 16.660 -1.121 1.00 0.00 C ATOM 1552 CE1 TYR A 101 -4.011 16.618 -3.868 1.00 0.00 C ATOM 1553 CE2 TYR A 101 -4.059 15.476 -1.767 1.00 0.00 C ATOM 1554 CZ TYR A 101 -4.184 15.461 -3.140 1.00 0.00 C ATOM 1555 OH TYR A 101 -4.484 14.284 -3.787 1.00 0.00 O ATOM 0 H TYR A 101 -1.694 19.226 0.971 1.00 0.00 H new ATOM 0 HA TYR A 101 -1.269 18.939 -1.932 1.00 0.00 H new ATOM 0 HB2 TYR A 101 -3.608 19.073 -0.093 1.00 0.00 H new ATOM 0 HB3 TYR A 101 -3.791 19.949 -1.600 1.00 0.00 H new ATOM 0 HD1 TYR A 101 -3.575 18.704 -3.789 1.00 0.00 H new ATOM 0 HD2 TYR A 101 -3.663 16.669 -0.045 1.00 0.00 H new ATOM 0 HE1 TYR A 101 -4.110 16.602 -4.943 1.00 0.00 H new ATOM 0 HE2 TYR A 101 -4.195 14.567 -1.200 1.00 0.00 H new ATOM 0 HH TYR A 101 -4.062 13.535 -3.317 1.00 0.00 H new ATOM 1565 N ARG A 102 -1.570 21.707 -0.205 1.00 0.00 N ATOM 1566 CA ARG A 102 -1.388 23.152 -0.256 1.00 0.00 C ATOM 1567 C ARG A 102 0.056 23.507 -0.596 1.00 0.00 C ATOM 1568 O ARG A 102 0.858 23.806 0.289 1.00 0.00 O ATOM 1569 CB ARG A 102 -1.778 23.784 1.081 1.00 0.00 C ATOM 1570 CG ARG A 102 -2.341 25.191 0.948 1.00 0.00 C ATOM 1571 CD ARG A 102 -2.683 25.785 2.305 1.00 0.00 C ATOM 1572 NE ARG A 102 -4.110 25.687 2.602 1.00 0.00 N ATOM 1573 CZ ARG A 102 -4.643 25.980 3.786 1.00 0.00 C ATOM 1574 NH1 ARG A 102 -3.872 26.390 4.786 1.00 0.00 N ATOM 1575 NH2 ARG A 102 -5.950 25.863 3.972 1.00 0.00 N ATOM 0 H ARG A 102 -1.707 21.332 0.734 1.00 0.00 H new ATOM 0 HA ARG A 102 -2.035 23.547 -1.039 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -2.517 23.151 1.571 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -0.902 23.812 1.729 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -1.615 25.828 0.443 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -3.234 25.169 0.324 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -2.115 25.270 3.080 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -2.379 26.831 2.330 1.00 0.00 H new ATOM 0 HE ARG A 102 -4.735 25.376 1.858 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -2.865 26.482 4.649 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -4.286 26.613 5.691 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -6.548 25.548 3.208 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -6.358 26.088 4.879 1.00 0.00 H new ATOM 1589 N GLU A 103 0.381 23.471 -1.884 1.00 0.00 N ATOM 1590 CA GLU A 103 1.729 23.788 -2.342 1.00 0.00 C ATOM 1591 C GLU A 103 1.741 24.072 -3.841 1.00 0.00 C ATOM 1592 O GLU A 103 2.646 23.643 -4.557 1.00 0.00 O ATOM 1593 CB GLU A 103 2.684 22.637 -2.020 1.00 0.00 C ATOM 1594 CG GLU A 103 2.204 21.287 -2.531 1.00 0.00 C ATOM 1595 CD GLU A 103 3.234 20.191 -2.337 1.00 0.00 C ATOM 1596 OE1 GLU A 103 3.363 19.692 -1.199 1.00 0.00 O ATOM 1597 OE2 GLU A 103 3.910 19.831 -3.324 1.00 0.00 O ATOM 0 H GLU A 103 -0.271 23.225 -2.629 1.00 0.00 H new ATOM 0 HA GLU A 103 2.063 24.684 -1.818 1.00 0.00 H new ATOM 0 HB2 GLU A 103 3.660 22.854 -2.453 1.00 0.00 H new ATOM 0 HB3 GLU A 103 2.820 22.580 -0.940 1.00 0.00 H new ATOM 0 HG2 GLU A 103 1.285 21.013 -2.013 1.00 0.00 H new ATOM 0 HG3 GLU A 103 1.961 21.369 -3.590 1.00 0.00 H new ATOM 1604 N ILE A 104 0.731 24.800 -4.308 1.00 0.00 N ATOM 1605 CA ILE A 104 0.625 25.142 -5.721 1.00 0.00 C ATOM 1606 C ILE A 104 1.255 26.500 -6.014 1.00 0.00 C ATOM 1607 O ILE A 104 1.588 26.806 -7.159 1.00 0.00 O ATOM 1608 CB ILE A 104 -0.843 25.158 -6.187 1.00 0.00 C ATOM 1609 CG1 ILE A 104 -1.675 26.084 -5.296 1.00 0.00 C ATOM 1610 CG2 ILE A 104 -1.417 23.750 -6.180 1.00 0.00 C ATOM 1611 CD1 ILE A 104 -3.060 26.357 -5.837 1.00 0.00 C ATOM 0 H ILE A 104 -0.025 25.164 -3.728 1.00 0.00 H new ATOM 0 HA ILE A 104 1.166 24.371 -6.270 1.00 0.00 H new ATOM 0 HB ILE A 104 -0.880 25.539 -7.208 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -1.762 25.640 -4.305 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -1.147 27.030 -5.176 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -2.455 23.779 -6.512 1.00 0.00 H new ATOM 0 HG22 ILE A 104 -0.838 23.118 -6.853 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -1.370 23.343 -5.170 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -3.593 27.020 -5.155 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -2.982 26.830 -6.816 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -3.606 25.418 -5.931 1.00 0.00 H new ATOM 1623 N TYR A 105 1.415 27.313 -4.975 1.00 0.00 N ATOM 1624 CA TYR A 105 2.005 28.639 -5.125 1.00 0.00 C ATOM 1625 C TYR A 105 2.998 28.923 -4.004 1.00 0.00 C ATOM 1626 O TYR A 105 4.131 29.336 -4.254 1.00 0.00 O ATOM 1627 CB TYR A 105 0.910 29.707 -5.138 1.00 0.00 C ATOM 1628 CG TYR A 105 1.080 30.737 -6.233 1.00 0.00 C ATOM 1629 CD1 TYR A 105 2.119 31.657 -6.190 1.00 0.00 C ATOM 1630 CD2 TYR A 105 0.201 30.787 -7.308 1.00 0.00 C ATOM 1631 CE1 TYR A 105 2.278 32.600 -7.188 1.00 0.00 C ATOM 1632 CE2 TYR A 105 0.354 31.726 -8.311 1.00 0.00 C ATOM 1633 CZ TYR A 105 1.394 32.630 -8.246 1.00 0.00 C ATOM 1634 OH TYR A 105 1.549 33.567 -9.242 1.00 0.00 O ATOM 0 H TYR A 105 1.145 27.077 -4.020 1.00 0.00 H new ATOM 0 HA TYR A 105 2.541 28.667 -6.074 1.00 0.00 H new ATOM 0 HB2 TYR A 105 -0.058 29.221 -5.256 1.00 0.00 H new ATOM 0 HB3 TYR A 105 0.897 30.214 -4.173 1.00 0.00 H new ATOM 0 HD1 TYR A 105 2.814 31.635 -5.364 1.00 0.00 H new ATOM 0 HD2 TYR A 105 -0.615 30.081 -7.361 1.00 0.00 H new ATOM 0 HE1 TYR A 105 3.091 33.310 -7.139 1.00 0.00 H new ATOM 0 HE2 TYR A 105 -0.337 31.752 -9.141 1.00 0.00 H new ATOM 0 HH TYR A 105 0.844 33.451 -9.913 1.00 0.00 H new ATOM 1644 N ARG A 106 2.567 28.700 -2.767 1.00 0.00 N ATOM 1645 CA ARG A 106 3.419 28.932 -1.606 1.00 0.00 C ATOM 1646 C ARG A 106 4.170 27.661 -1.219 1.00 0.00 C ATOM 1647 O ARG A 106 3.894 27.054 -0.183 1.00 0.00 O ATOM 1648 CB ARG A 106 2.581 29.431 -0.425 1.00 0.00 C ATOM 1649 CG ARG A 106 2.673 30.933 -0.206 1.00 0.00 C ATOM 1650 CD ARG A 106 3.420 31.269 1.076 1.00 0.00 C ATOM 1651 NE ARG A 106 4.437 32.297 0.864 1.00 0.00 N ATOM 1652 CZ ARG A 106 5.366 32.616 1.762 1.00 0.00 C ATOM 1653 NH1 ARG A 106 5.411 31.991 2.932 1.00 0.00 N ATOM 1654 NH2 ARG A 106 6.255 33.562 1.489 1.00 0.00 N ATOM 0 H ARG A 106 1.632 28.359 -2.542 1.00 0.00 H new ATOM 0 HA ARG A 106 4.152 29.695 -1.868 1.00 0.00 H new ATOM 0 HB2 ARG A 106 1.538 29.159 -0.589 1.00 0.00 H new ATOM 0 HB3 ARG A 106 2.905 28.919 0.481 1.00 0.00 H new ATOM 0 HG2 ARG A 106 3.179 31.394 -1.054 1.00 0.00 H new ATOM 0 HG3 ARG A 106 1.670 31.357 -0.165 1.00 0.00 H new ATOM 0 HD2 ARG A 106 2.711 31.611 1.830 1.00 0.00 H new ATOM 0 HD3 ARG A 106 3.892 30.368 1.468 1.00 0.00 H new ATOM 0 HE ARG A 106 4.435 32.799 -0.024 1.00 0.00 H new ATOM 0 HH11 ARG A 106 4.731 31.262 3.147 1.00 0.00 H new ATOM 0 HH12 ARG A 106 6.125 32.240 3.616 1.00 0.00 H new ATOM 0 HH21 ARG A 106 6.226 34.045 0.591 1.00 0.00 H new ATOM 0 HH22 ARG A 106 6.967 33.807 2.177 1.00 0.00 H new ATOM 1668 N GLU A 107 5.120 27.261 -2.059 1.00 0.00 N ATOM 1669 CA GLU A 107 5.912 26.062 -1.806 1.00 0.00 C ATOM 1670 C GLU A 107 6.929 25.839 -2.921 1.00 0.00 C ATOM 1671 O GLU A 107 6.871 26.486 -3.966 1.00 0.00 O ATOM 1672 CB GLU A 107 5.001 24.839 -1.678 1.00 0.00 C ATOM 1673 CG GLU A 107 5.439 23.865 -0.597 1.00 0.00 C ATOM 1674 CD GLU A 107 4.728 24.099 0.722 1.00 0.00 C ATOM 1675 OE1 GLU A 107 3.546 23.712 0.835 1.00 0.00 O ATOM 1676 OE2 GLU A 107 5.353 24.670 1.641 1.00 0.00 O ATOM 0 H GLU A 107 5.360 27.750 -2.921 1.00 0.00 H new ATOM 0 HA GLU A 107 6.450 26.203 -0.869 1.00 0.00 H new ATOM 0 HB2 GLU A 107 3.986 25.173 -1.464 1.00 0.00 H new ATOM 0 HB3 GLU A 107 4.970 24.317 -2.635 1.00 0.00 H new ATOM 0 HG2 GLU A 107 5.248 22.846 -0.933 1.00 0.00 H new ATOM 0 HG3 GLU A 107 6.515 23.955 -0.447 1.00 0.00 H new ATOM 1683 N HIS A 108 7.858 24.917 -2.690 1.00 0.00 N ATOM 1684 CA HIS A 108 8.889 24.606 -3.675 1.00 0.00 C ATOM 1685 C HIS A 108 9.764 25.824 -3.953 1.00 0.00 C ATOM 1686 O HIS A 108 9.284 26.848 -4.438 1.00 0.00 O ATOM 1687 CB HIS A 108 8.250 24.115 -4.975 1.00 0.00 C ATOM 1688 CG HIS A 108 9.044 23.049 -5.666 1.00 0.00 C ATOM 1689 ND1 HIS A 108 10.358 22.759 -5.376 1.00 0.00 N ATOM 1690 CD2 HIS A 108 8.682 22.194 -6.656 1.00 0.00 C ATOM 1691 CE1 HIS A 108 10.746 21.760 -6.180 1.00 0.00 C ATOM 1692 NE2 HIS A 108 9.765 21.381 -6.976 1.00 0.00 N ATOM 0 H HIS A 108 7.918 24.372 -1.830 1.00 0.00 H new ATOM 0 HA HIS A 108 9.519 23.816 -3.266 1.00 0.00 H new ATOM 0 HB2 HIS A 108 7.253 23.731 -4.758 1.00 0.00 H new ATOM 0 HB3 HIS A 108 8.126 24.961 -5.652 1.00 0.00 H new ATOM 0 HD2 HIS A 108 7.708 22.151 -7.121 1.00 0.00 H new ATOM 0 HE1 HIS A 108 11.733 21.322 -6.177 1.00 0.00 H new ATOM 0 HE2 HIS A 108 9.794 20.644 -7.681 1.00 0.00 H new ATOM 1700 N VAL A 109 11.051 25.705 -3.642 1.00 0.00 N ATOM 1701 CA VAL A 109 11.993 26.795 -3.860 1.00 0.00 C ATOM 1702 C VAL A 109 13.399 26.262 -4.119 1.00 0.00 C ATOM 1703 O VAL A 109 13.990 25.598 -3.268 1.00 0.00 O ATOM 1704 CB VAL A 109 12.033 27.750 -2.651 1.00 0.00 C ATOM 1705 CG1 VAL A 109 10.771 28.594 -2.595 1.00 0.00 C ATOM 1706 CG2 VAL A 109 12.220 26.969 -1.359 1.00 0.00 C ATOM 0 H VAL A 109 11.464 24.864 -3.238 1.00 0.00 H new ATOM 0 HA VAL A 109 11.648 27.343 -4.737 1.00 0.00 H new ATOM 0 HB VAL A 109 12.884 28.420 -2.769 1.00 0.00 H new ATOM 0 HG11 VAL A 109 10.818 29.262 -1.735 1.00 0.00 H new ATOM 0 HG12 VAL A 109 10.687 29.184 -3.508 1.00 0.00 H new ATOM 0 HG13 VAL A 109 9.902 27.943 -2.502 1.00 0.00 H new ATOM 0 HG21 VAL A 109 12.246 27.660 -0.517 1.00 0.00 H new ATOM 0 HG22 VAL A 109 11.391 26.273 -1.232 1.00 0.00 H new ATOM 0 HG23 VAL A 109 13.157 26.414 -1.402 1.00 0.00 H new ATOM 1716 N SER A 110 13.929 26.559 -5.301 1.00 0.00 N ATOM 1717 CA SER A 110 15.265 26.110 -5.675 1.00 0.00 C ATOM 1718 C SER A 110 16.235 27.285 -5.743 1.00 0.00 C ATOM 1719 O SER A 110 17.130 27.318 -6.589 1.00 0.00 O ATOM 1720 CB SER A 110 15.225 25.388 -7.023 1.00 0.00 C ATOM 1721 OG SER A 110 16.216 24.378 -7.091 1.00 0.00 O ATOM 0 H SER A 110 13.453 27.109 -6.016 1.00 0.00 H new ATOM 0 HA SER A 110 15.615 25.417 -4.910 1.00 0.00 H new ATOM 0 HB2 SER A 110 14.240 24.946 -7.173 1.00 0.00 H new ATOM 0 HB3 SER A 110 15.378 26.106 -7.828 1.00 0.00 H new ATOM 0 HG SER A 110 16.168 23.931 -7.962 1.00 0.00 H new ATOM 1727 N GLY A 111 16.053 28.249 -4.845 1.00 0.00 N ATOM 1728 CA GLY A 111 16.919 29.413 -4.820 1.00 0.00 C ATOM 1729 C GLY A 111 16.792 30.205 -3.532 1.00 0.00 C ATOM 1730 O GLY A 111 15.748 30.169 -2.881 1.00 0.00 O ATOM 0 H GLY A 111 15.321 28.244 -4.135 1.00 0.00 H new ATOM 0 HA2 GLY A 111 17.954 29.095 -4.946 1.00 0.00 H new ATOM 0 HA3 GLY A 111 16.679 30.059 -5.665 1.00 0.00 H new ATOM 1734 N PRO A 112 17.848 30.937 -3.136 1.00 0.00 N ATOM 1735 CA PRO A 112 17.834 31.739 -1.908 1.00 0.00 C ATOM 1736 C PRO A 112 16.917 32.952 -2.020 1.00 0.00 C ATOM 1737 O PRO A 112 16.222 33.128 -3.020 1.00 0.00 O ATOM 1738 CB PRO A 112 19.291 32.183 -1.757 1.00 0.00 C ATOM 1739 CG PRO A 112 19.840 32.161 -3.142 1.00 0.00 C ATOM 1740 CD PRO A 112 19.134 31.038 -3.850 1.00 0.00 C ATOM 0 HA PRO A 112 17.456 31.174 -1.056 1.00 0.00 H new ATOM 0 HB2 PRO A 112 19.358 33.180 -1.321 1.00 0.00 H new ATOM 0 HB3 PRO A 112 19.844 31.510 -1.101 1.00 0.00 H new ATOM 0 HG2 PRO A 112 19.665 33.111 -3.646 1.00 0.00 H new ATOM 0 HG3 PRO A 112 20.918 31.999 -3.132 1.00 0.00 H new ATOM 0 HD2 PRO A 112 18.990 31.258 -4.908 1.00 0.00 H new ATOM 0 HD3 PRO A 112 19.700 30.108 -3.792 1.00 0.00 H new ATOM 1748 N SER A 113 16.920 33.785 -0.983 1.00 0.00 N ATOM 1749 CA SER A 113 16.087 34.981 -0.962 1.00 0.00 C ATOM 1750 C SER A 113 16.727 36.106 -1.770 1.00 0.00 C ATOM 1751 O SER A 113 17.950 36.197 -1.866 1.00 0.00 O ATOM 1752 CB SER A 113 15.855 35.441 0.480 1.00 0.00 C ATOM 1753 OG SER A 113 16.047 34.376 1.396 1.00 0.00 O ATOM 0 H SER A 113 17.490 33.653 -0.147 1.00 0.00 H new ATOM 0 HA SER A 113 15.128 34.733 -1.416 1.00 0.00 H new ATOM 0 HB2 SER A 113 16.538 36.257 0.718 1.00 0.00 H new ATOM 0 HB3 SER A 113 14.843 35.833 0.581 1.00 0.00 H new ATOM 0 HG SER A 113 15.894 34.698 2.309 1.00 0.00 H new ATOM 1759 N SER A 114 15.890 36.961 -2.350 1.00 0.00 N ATOM 1760 CA SER A 114 16.370 38.083 -3.151 1.00 0.00 C ATOM 1761 C SER A 114 17.266 37.600 -4.287 1.00 0.00 C ATOM 1762 O SER A 114 17.458 36.398 -4.472 1.00 0.00 O ATOM 1763 CB SER A 114 17.132 39.076 -2.272 1.00 0.00 C ATOM 1764 OG SER A 114 18.453 38.627 -2.020 1.00 0.00 O ATOM 0 H SER A 114 14.874 36.898 -2.280 1.00 0.00 H new ATOM 0 HA SER A 114 15.503 38.582 -3.585 1.00 0.00 H new ATOM 0 HB2 SER A 114 17.163 40.050 -2.761 1.00 0.00 H new ATOM 0 HB3 SER A 114 16.604 39.210 -1.328 1.00 0.00 H new ATOM 0 HG SER A 114 18.423 37.741 -1.602 1.00 0.00 H new ATOM 1770 N GLY A 115 17.814 38.544 -5.043 1.00 0.00 N ATOM 1771 CA GLY A 115 18.684 38.196 -6.151 1.00 0.00 C ATOM 1772 C GLY A 115 18.956 39.371 -7.066 1.00 0.00 C ATOM 1773 O GLY A 115 18.098 40.277 -7.142 1.00 0.00 O ATOM 1774 OXT GLY A 115 20.028 39.390 -7.707 1.00 0.00 O ATOM 0 H GLY A 115 17.671 39.545 -4.909 1.00 0.00 H new ATOM 0 HA2 GLY A 115 19.629 37.817 -5.762 1.00 0.00 H new ATOM 0 HA3 GLY A 115 18.229 37.389 -6.726 1.00 0.00 H new TER 1778 GLY A 115