USER MOD reduce.3.24.130724 H: found=0, std=0, add=844, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 856 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 63 CYS SG : rot -93:sc= 1.27 USER MOD Set 1.2: A 90 CYS SG : rot -33:sc= 0.793 USER MOD Set 2.1: A 43 TYR OH : rot 1:sc= 1.28 USER MOD Set 2.2: A 46 THR OG1 : rot -125:sc= 2.3 USER MOD Set 3.1: A 32 THR OG1 : rot 180:sc= 0.994 USER MOD Set 3.2: A 50 THR OG1 : rot -62:sc= 1.19 USER MOD Single : A 26 GLN : amide:sc= 0.196 K(o=0.2,f=-3.2!) USER MOD Single : A 33 TYR OH : rot -15:sc= -0.177 USER MOD Single : A 38 TYR OH : rot 180:sc= 0 USER MOD Single : A 40 ASN : amide:sc= 1.18 K(o=1.2,f=-8.4!) USER MOD Single : A 41 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 44 MET CE :methyl -137:sc= -0.201 (180deg=-1.55!) USER MOD Single : A 52 ASN : amide:sc= 0 X(o=0,f=-0.0086) USER MOD Single : A 53 THR OG1 : rot -137:sc= 1.24 USER MOD Single : A 56 SER OG : rot 20:sc= 1.17 USER MOD Single : A 58 GLN : amide:sc= 0.234 K(o=0.23,f=-6.6!) USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 GLN : amide:sc= -0.044 X(o=-0.044,f=-0.044) USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 72 MET CE :methyl 178:sc= 0 (180deg=-0.00684) USER MOD Single : A 75 ASN : amide:sc= -1.06 K(o=-1.1,f=-4.1!) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 82 MET CE :methyl 155:sc= -1.38 (180deg=-4.28!) USER MOD Single : A 83 ASN : amide:sc= -0.47 X(o=-0.47,f=-0.23) USER MOD Single : A 94 THR OG1 : rot -38:sc= 0.104 USER MOD Single : A 95 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 MET CE :methyl -159:sc=-0.00983 (180deg=-0.761) USER MOD Single : A 98 GLN : amide:sc= 0.719 K(o=0.72,f=0) USER MOD Single : A 101 THR OG1 : rot 180:sc= -0.234 USER MOD Single : A 103 HIS : no HE2:sc= -0.16 K(o=-0.16,f=-3.3!) USER MOD Single : A 108 GLN : amide:sc= 0 K(o=0,f=-0.92) USER MOD Single : A 109 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 112 ASN : amide:sc= -0.234 K(o=-0.23,f=-1.1) USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 117 GLN : amide:sc= -2.16! C(o=-2.2!,f=-2.9!) USER MOD Single : A 120 MET CE :methyl -156:sc= 0 (180deg=-0.544) USER MOD Single : A 121 SER OG : rot -4:sc= 0.352 USER MOD Single : A 122 ASN : amide:sc= 0.456 K(o=0.46,f=-4.3!) USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 138 ASN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 25 -6.813 -17.539 1.870 1.00 0.00 N ATOM 2 CA GLY A 25 -5.529 -17.086 2.411 1.00 0.00 C ATOM 3 C GLY A 25 -5.357 -17.574 3.840 1.00 0.00 C ATOM 4 O GLY A 25 -6.214 -18.294 4.353 1.00 0.00 O ATOM 0 HA2 GLY A 25 -4.714 -17.459 1.791 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -5.478 -15.998 2.383 1.00 0.00 H new ATOM 8 N GLN A 26 -4.220 -17.267 4.456 1.00 0.00 N ATOM 9 CA GLN A 26 -3.806 -17.661 5.798 1.00 0.00 C ATOM 10 C GLN A 26 -2.827 -16.581 6.266 1.00 0.00 C ATOM 11 O GLN A 26 -2.268 -15.857 5.440 1.00 0.00 O ATOM 12 CB GLN A 26 -3.147 -19.057 5.705 1.00 0.00 C ATOM 13 CG GLN A 26 -2.440 -19.586 6.966 1.00 0.00 C ATOM 14 CD GLN A 26 -3.382 -19.823 8.145 1.00 0.00 C ATOM 15 OE1 GLN A 26 -3.559 -18.969 9.013 1.00 0.00 O ATOM 16 NE2 GLN A 26 -4.019 -20.983 8.197 1.00 0.00 N ATOM 0 H GLN A 26 -3.512 -16.694 3.996 1.00 0.00 H new ATOM 0 HA GLN A 26 -4.629 -17.738 6.508 1.00 0.00 H new ATOM 0 HB2 GLN A 26 -3.916 -19.776 5.422 1.00 0.00 H new ATOM 0 HB3 GLN A 26 -2.419 -19.034 4.894 1.00 0.00 H new ATOM 0 HG2 GLN A 26 -1.934 -20.520 6.723 1.00 0.00 H new ATOM 0 HG3 GLN A 26 -1.670 -18.875 7.265 1.00 0.00 H new ATOM 0 HE21 GLN A 26 -3.864 -21.683 7.471 1.00 0.00 H new ATOM 0 HE22 GLN A 26 -4.665 -21.176 8.963 1.00 0.00 H new ATOM 25 N GLU A 27 -2.578 -16.467 7.566 1.00 0.00 N ATOM 26 CA GLU A 27 -1.578 -15.559 8.081 1.00 0.00 C ATOM 27 C GLU A 27 -0.188 -16.108 7.790 1.00 0.00 C ATOM 28 O GLU A 27 0.146 -17.242 8.136 1.00 0.00 O ATOM 29 CB GLU A 27 -1.816 -15.295 9.576 1.00 0.00 C ATOM 30 CG GLU A 27 -0.700 -14.408 10.153 1.00 0.00 C ATOM 31 CD GLU A 27 -0.759 -14.152 11.651 1.00 0.00 C ATOM 32 OE1 GLU A 27 0.119 -13.422 12.161 1.00 0.00 O ATOM 33 OE2 GLU A 27 -1.615 -14.716 12.360 1.00 0.00 O ATOM 0 H GLU A 27 -3.065 -17.002 8.284 1.00 0.00 H new ATOM 0 HA GLU A 27 -1.656 -14.595 7.579 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -2.782 -14.810 9.716 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -1.852 -16.241 10.117 1.00 0.00 H new ATOM 0 HG2 GLU A 27 0.260 -14.869 9.921 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -0.725 -13.447 9.639 1.00 0.00 H new ATOM 41 N LEU A 28 0.618 -15.277 7.136 1.00 0.00 N ATOM 42 CA LEU A 28 2.003 -15.558 6.772 1.00 0.00 C ATOM 43 C LEU A 28 2.846 -14.287 6.565 1.00 0.00 C ATOM 44 O LEU A 28 3.231 -13.981 5.434 1.00 0.00 O ATOM 45 CB LEU A 28 2.085 -16.503 5.556 1.00 0.00 C ATOM 46 CG LEU A 28 0.979 -16.287 4.497 1.00 0.00 C ATOM 47 CD1 LEU A 28 1.496 -15.909 3.118 1.00 0.00 C ATOM 48 CD2 LEU A 28 0.147 -17.561 4.443 1.00 0.00 C ATOM 0 H LEU A 28 0.312 -14.352 6.833 1.00 0.00 H new ATOM 0 HA LEU A 28 2.444 -16.072 7.626 1.00 0.00 H new ATOM 0 HB2 LEU A 28 3.057 -16.376 5.079 1.00 0.00 H new ATOM 0 HB3 LEU A 28 2.036 -17.533 5.909 1.00 0.00 H new ATOM 0 HG LEU A 28 0.379 -15.429 4.801 1.00 0.00 H new ATOM 0 HD11 LEU A 28 0.655 -15.777 2.438 1.00 0.00 H new ATOM 0 HD12 LEU A 28 2.060 -14.978 3.183 1.00 0.00 H new ATOM 0 HD13 LEU A 28 2.145 -16.701 2.743 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -0.646 -17.446 3.704 1.00 0.00 H new ATOM 0 HD22 LEU A 28 0.784 -18.400 4.164 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -0.293 -17.750 5.422 1.00 0.00 H new ATOM 60 N PRO A 29 3.131 -13.516 7.627 1.00 0.00 N ATOM 61 CA PRO A 29 4.179 -12.510 7.651 1.00 0.00 C ATOM 62 C PRO A 29 5.537 -13.175 7.926 1.00 0.00 C ATOM 63 O PRO A 29 5.723 -13.767 8.993 1.00 0.00 O ATOM 64 CB PRO A 29 3.817 -11.559 8.789 1.00 0.00 C ATOM 65 CG PRO A 29 3.048 -12.460 9.762 1.00 0.00 C ATOM 66 CD PRO A 29 2.433 -13.549 8.892 1.00 0.00 C ATOM 0 HA PRO A 29 4.257 -11.984 6.700 1.00 0.00 H new ATOM 0 HB2 PRO A 29 4.705 -11.129 9.253 1.00 0.00 H new ATOM 0 HB3 PRO A 29 3.205 -10.727 8.440 1.00 0.00 H new ATOM 0 HG2 PRO A 29 3.712 -12.885 10.515 1.00 0.00 H new ATOM 0 HG3 PRO A 29 2.279 -11.900 10.295 1.00 0.00 H new ATOM 0 HD2 PRO A 29 2.536 -14.526 9.365 1.00 0.00 H new ATOM 0 HD3 PRO A 29 1.367 -13.374 8.750 1.00 0.00 H new ATOM 74 N PRO A 30 6.502 -13.054 7.005 1.00 0.00 N ATOM 75 CA PRO A 30 7.925 -13.175 7.246 1.00 0.00 C ATOM 76 C PRO A 30 8.554 -11.783 7.500 1.00 0.00 C ATOM 77 O PRO A 30 9.755 -11.594 7.285 1.00 0.00 O ATOM 78 CB PRO A 30 8.418 -13.824 5.960 1.00 0.00 C ATOM 79 CG PRO A 30 7.654 -13.025 4.906 1.00 0.00 C ATOM 80 CD PRO A 30 6.324 -12.742 5.602 1.00 0.00 C ATOM 0 HA PRO A 30 8.189 -13.756 8.130 1.00 0.00 H new ATOM 0 HB2 PRO A 30 9.498 -13.733 5.842 1.00 0.00 H new ATOM 0 HB3 PRO A 30 8.182 -14.887 5.920 1.00 0.00 H new ATOM 0 HG2 PRO A 30 8.175 -12.106 4.638 1.00 0.00 H new ATOM 0 HG3 PRO A 30 7.517 -13.594 3.986 1.00 0.00 H new ATOM 0 HD2 PRO A 30 6.036 -11.699 5.473 1.00 0.00 H new ATOM 0 HD3 PRO A 30 5.527 -13.348 5.171 1.00 0.00 H new ATOM 88 N GLY A 31 7.749 -10.751 7.788 1.00 0.00 N ATOM 89 CA GLY A 31 8.204 -9.425 8.145 1.00 0.00 C ATOM 90 C GLY A 31 8.096 -8.519 6.945 1.00 0.00 C ATOM 91 O GLY A 31 7.278 -7.601 6.943 1.00 0.00 O ATOM 0 H GLY A 31 6.732 -10.832 7.775 1.00 0.00 H new ATOM 0 HA2 GLY A 31 7.605 -9.032 8.966 1.00 0.00 H new ATOM 0 HA3 GLY A 31 9.236 -9.464 8.493 1.00 0.00 H new ATOM 95 N THR A 32 8.890 -8.817 5.925 1.00 0.00 N ATOM 96 CA THR A 32 9.020 -8.054 4.699 1.00 0.00 C ATOM 97 C THR A 32 9.201 -9.068 3.575 1.00 0.00 C ATOM 98 O THR A 32 9.691 -10.182 3.800 1.00 0.00 O ATOM 99 CB THR A 32 10.196 -7.060 4.821 1.00 0.00 C ATOM 100 OG1 THR A 32 10.110 -6.357 6.048 1.00 0.00 O ATOM 101 CG2 THR A 32 10.265 -6.031 3.689 1.00 0.00 C ATOM 0 H THR A 32 9.490 -9.641 5.935 1.00 0.00 H new ATOM 0 HA THR A 32 8.141 -7.445 4.491 1.00 0.00 H new ATOM 0 HB THR A 32 11.098 -7.669 4.765 1.00 0.00 H new ATOM 0 HG1 THR A 32 10.860 -5.730 6.119 1.00 0.00 H new ATOM 0 HG21 THR A 32 11.118 -5.371 3.849 1.00 0.00 H new ATOM 0 HG22 THR A 32 10.379 -6.546 2.735 1.00 0.00 H new ATOM 0 HG23 THR A 32 9.348 -5.442 3.676 1.00 0.00 H new ATOM 109 N TYR A 33 8.728 -8.704 2.389 1.00 0.00 N ATOM 110 CA TYR A 33 8.835 -9.473 1.166 1.00 0.00 C ATOM 111 C TYR A 33 8.969 -8.458 0.023 1.00 0.00 C ATOM 112 O TYR A 33 8.517 -7.319 0.183 1.00 0.00 O ATOM 113 CB TYR A 33 7.609 -10.394 1.038 1.00 0.00 C ATOM 114 CG TYR A 33 6.325 -9.779 0.512 1.00 0.00 C ATOM 115 CD1 TYR A 33 5.708 -8.683 1.147 1.00 0.00 C ATOM 116 CD2 TYR A 33 5.722 -10.325 -0.628 1.00 0.00 C ATOM 117 CE1 TYR A 33 4.479 -8.175 0.698 1.00 0.00 C ATOM 118 CE2 TYR A 33 4.535 -9.769 -1.121 1.00 0.00 C ATOM 119 CZ TYR A 33 3.873 -8.749 -0.422 1.00 0.00 C ATOM 120 OH TYR A 33 2.617 -8.371 -0.759 1.00 0.00 O ATOM 0 H TYR A 33 8.236 -7.821 2.253 1.00 0.00 H new ATOM 0 HA TYR A 33 9.704 -10.131 1.148 1.00 0.00 H new ATOM 0 HB2 TYR A 33 7.878 -11.223 0.384 1.00 0.00 H new ATOM 0 HB3 TYR A 33 7.402 -10.817 2.021 1.00 0.00 H new ATOM 0 HD1 TYR A 33 6.191 -8.224 1.997 1.00 0.00 H new ATOM 0 HD2 TYR A 33 6.171 -11.172 -1.125 1.00 0.00 H new ATOM 0 HE1 TYR A 33 4.008 -7.350 1.212 1.00 0.00 H new ATOM 0 HE2 TYR A 33 4.124 -10.130 -2.052 1.00 0.00 H new ATOM 0 HH TYR A 33 2.206 -7.896 -0.007 1.00 0.00 H new ATOM 130 N ARG A 34 9.547 -8.811 -1.130 1.00 0.00 N ATOM 131 CA ARG A 34 9.618 -7.891 -2.271 1.00 0.00 C ATOM 132 C ARG A 34 9.034 -8.535 -3.502 1.00 0.00 C ATOM 133 O ARG A 34 9.327 -9.694 -3.787 1.00 0.00 O ATOM 134 CB ARG A 34 11.049 -7.412 -2.524 1.00 0.00 C ATOM 135 CG ARG A 34 11.059 -6.228 -3.506 1.00 0.00 C ATOM 136 CD ARG A 34 11.283 -6.584 -4.970 1.00 0.00 C ATOM 137 NE ARG A 34 12.680 -6.933 -5.194 1.00 0.00 N ATOM 138 CZ ARG A 34 13.590 -6.225 -5.865 1.00 0.00 C ATOM 139 NH1 ARG A 34 13.358 -4.996 -6.320 1.00 0.00 N ATOM 140 NH2 ARG A 34 14.765 -6.780 -6.078 1.00 0.00 N ATOM 0 H ARG A 34 9.971 -9.723 -1.298 1.00 0.00 H new ATOM 0 HA ARG A 34 9.024 -7.010 -2.028 1.00 0.00 H new ATOM 0 HB2 ARG A 34 11.510 -7.114 -1.582 1.00 0.00 H new ATOM 0 HB3 ARG A 34 11.646 -8.230 -2.927 1.00 0.00 H new ATOM 0 HG2 ARG A 34 10.108 -5.702 -3.421 1.00 0.00 H new ATOM 0 HG3 ARG A 34 11.838 -5.531 -3.198 1.00 0.00 H new ATOM 0 HD2 ARG A 34 10.642 -7.420 -5.251 1.00 0.00 H new ATOM 0 HD3 ARG A 34 11.005 -5.742 -5.604 1.00 0.00 H new ATOM 0 HE ARG A 34 12.997 -7.816 -4.794 1.00 0.00 H new ATOM 0 HH11 ARG A 34 12.452 -4.556 -6.161 1.00 0.00 H new ATOM 0 HH12 ARG A 34 14.086 -4.494 -6.828 1.00 0.00 H new ATOM 0 HH21 ARG A 34 14.954 -7.721 -5.734 1.00 0.00 H new ATOM 0 HH22 ARG A 34 15.486 -6.269 -6.587 1.00 0.00 H new ATOM 154 N VAL A 35 8.206 -7.773 -4.204 1.00 0.00 N ATOM 155 CA VAL A 35 7.310 -8.239 -5.246 1.00 0.00 C ATOM 156 C VAL A 35 7.016 -7.086 -6.198 1.00 0.00 C ATOM 157 O VAL A 35 7.483 -5.965 -5.961 1.00 0.00 O ATOM 158 CB VAL A 35 6.028 -8.768 -4.592 1.00 0.00 C ATOM 159 CG1 VAL A 35 6.339 -10.050 -3.819 1.00 0.00 C ATOM 160 CG2 VAL A 35 5.361 -7.758 -3.650 1.00 0.00 C ATOM 0 H VAL A 35 8.140 -6.766 -4.053 1.00 0.00 H new ATOM 0 HA VAL A 35 7.764 -9.047 -5.819 1.00 0.00 H new ATOM 0 HB VAL A 35 5.323 -8.961 -5.401 1.00 0.00 H new ATOM 0 HG11 VAL A 35 5.427 -10.425 -3.355 1.00 0.00 H new ATOM 0 HG12 VAL A 35 6.733 -10.801 -4.504 1.00 0.00 H new ATOM 0 HG13 VAL A 35 7.079 -9.839 -3.047 1.00 0.00 H new ATOM 0 HG21 VAL A 35 4.460 -8.199 -3.223 1.00 0.00 H new ATOM 0 HG22 VAL A 35 6.052 -7.496 -2.849 1.00 0.00 H new ATOM 0 HG23 VAL A 35 5.096 -6.860 -4.208 1.00 0.00 H new ATOM 170 N ASP A 36 6.211 -7.337 -7.232 1.00 0.00 N ATOM 171 CA ASP A 36 5.685 -6.286 -8.086 1.00 0.00 C ATOM 172 C ASP A 36 4.397 -5.825 -7.420 1.00 0.00 C ATOM 173 O ASP A 36 3.464 -6.598 -7.191 1.00 0.00 O ATOM 174 CB ASP A 36 5.503 -6.757 -9.540 1.00 0.00 C ATOM 175 CG ASP A 36 6.703 -6.354 -10.410 1.00 0.00 C ATOM 176 OD1 ASP A 36 6.514 -5.907 -11.566 1.00 0.00 O ATOM 177 OD2 ASP A 36 7.858 -6.336 -9.928 1.00 0.00 O ATOM 0 H ASP A 36 5.909 -8.275 -7.496 1.00 0.00 H new ATOM 0 HA ASP A 36 6.378 -5.450 -8.179 1.00 0.00 H new ATOM 0 HB2 ASP A 36 5.383 -7.840 -9.562 1.00 0.00 H new ATOM 0 HB3 ASP A 36 4.591 -6.327 -9.953 1.00 0.00 H new ATOM 183 N ILE A 37 4.400 -4.569 -7.000 1.00 0.00 N ATOM 184 CA ILE A 37 3.276 -3.871 -6.413 1.00 0.00 C ATOM 185 C ILE A 37 2.350 -3.538 -7.583 1.00 0.00 C ATOM 186 O ILE A 37 2.788 -2.963 -8.589 1.00 0.00 O ATOM 187 CB ILE A 37 3.792 -2.597 -5.700 1.00 0.00 C ATOM 188 CG1 ILE A 37 4.789 -2.946 -4.566 1.00 0.00 C ATOM 189 CG2 ILE A 37 2.634 -1.734 -5.162 1.00 0.00 C ATOM 190 CD1 ILE A 37 5.707 -1.777 -4.201 1.00 0.00 C ATOM 0 H ILE A 37 5.232 -3.982 -7.065 1.00 0.00 H new ATOM 0 HA ILE A 37 2.745 -4.459 -5.665 1.00 0.00 H new ATOM 0 HB ILE A 37 4.324 -2.009 -6.448 1.00 0.00 H new ATOM 0 HG12 ILE A 37 4.232 -3.254 -3.681 1.00 0.00 H new ATOM 0 HG13 ILE A 37 5.397 -3.797 -4.873 1.00 0.00 H new ATOM 0 HG21 ILE A 37 3.038 -0.850 -4.669 1.00 0.00 H new ATOM 0 HG22 ILE A 37 1.994 -1.428 -5.989 1.00 0.00 H new ATOM 0 HG23 ILE A 37 2.050 -2.313 -4.447 1.00 0.00 H new ATOM 0 HD11 ILE A 37 6.383 -2.081 -3.402 1.00 0.00 H new ATOM 0 HD12 ILE A 37 6.288 -1.484 -5.075 1.00 0.00 H new ATOM 0 HD13 ILE A 37 5.105 -0.933 -3.866 1.00 0.00 H new ATOM 202 N TYR A 38 1.077 -3.879 -7.437 1.00 0.00 N ATOM 203 CA TYR A 38 0.039 -3.733 -8.445 1.00 0.00 C ATOM 204 C TYR A 38 -1.151 -3.041 -7.793 1.00 0.00 C ATOM 205 O TYR A 38 -1.545 -3.409 -6.690 1.00 0.00 O ATOM 206 CB TYR A 38 -0.361 -5.121 -8.973 1.00 0.00 C ATOM 207 CG TYR A 38 0.108 -5.397 -10.386 1.00 0.00 C ATOM 208 CD1 TYR A 38 1.437 -5.780 -10.636 1.00 0.00 C ATOM 209 CD2 TYR A 38 -0.794 -5.254 -11.457 1.00 0.00 C ATOM 210 CE1 TYR A 38 1.863 -6.010 -11.959 1.00 0.00 C ATOM 211 CE2 TYR A 38 -0.378 -5.490 -12.775 1.00 0.00 C ATOM 212 CZ TYR A 38 0.956 -5.862 -13.037 1.00 0.00 C ATOM 213 OH TYR A 38 1.335 -6.078 -14.326 1.00 0.00 O ATOM 0 H TYR A 38 0.724 -4.284 -6.570 1.00 0.00 H new ATOM 0 HA TYR A 38 0.394 -3.139 -9.287 1.00 0.00 H new ATOM 0 HB2 TYR A 38 0.047 -5.883 -8.309 1.00 0.00 H new ATOM 0 HB3 TYR A 38 -1.446 -5.214 -8.936 1.00 0.00 H new ATOM 0 HD1 TYR A 38 2.130 -5.898 -9.816 1.00 0.00 H new ATOM 0 HD2 TYR A 38 -1.815 -4.960 -11.262 1.00 0.00 H new ATOM 0 HE1 TYR A 38 2.885 -6.300 -12.152 1.00 0.00 H new ATOM 0 HE2 TYR A 38 -1.080 -5.387 -13.589 1.00 0.00 H new ATOM 0 HH TYR A 38 0.571 -5.927 -14.921 1.00 0.00 H new ATOM 223 N LEU A 39 -1.750 -2.065 -8.472 1.00 0.00 N ATOM 224 CA LEU A 39 -3.000 -1.437 -8.072 1.00 0.00 C ATOM 225 C LEU A 39 -3.883 -1.284 -9.278 1.00 0.00 C ATOM 226 O LEU A 39 -3.427 -0.911 -10.351 1.00 0.00 O ATOM 227 CB LEU A 39 -2.754 -0.069 -7.444 1.00 0.00 C ATOM 228 CG LEU A 39 -4.021 0.780 -7.177 1.00 0.00 C ATOM 229 CD1 LEU A 39 -4.482 1.696 -8.311 1.00 0.00 C ATOM 230 CD2 LEU A 39 -5.097 0.133 -6.319 1.00 0.00 C ATOM 0 H LEU A 39 -1.367 -1.682 -9.336 1.00 0.00 H new ATOM 0 HA LEU A 39 -3.483 -2.070 -7.328 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -2.228 -0.211 -6.500 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -2.090 0.497 -8.097 1.00 0.00 H new ATOM 0 HG LEU A 39 -3.641 1.527 -6.480 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -5.377 2.236 -8.002 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -3.692 2.409 -8.547 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -4.707 1.097 -9.194 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -5.933 0.823 -6.203 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -5.445 -0.781 -6.800 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -4.685 -0.107 -5.339 1.00 0.00 H new ATOM 242 N ASN A 40 -5.164 -1.492 -9.040 1.00 0.00 N ATOM 243 CA ASN A 40 -6.260 -1.464 -9.973 1.00 0.00 C ATOM 244 C ASN A 40 -5.925 -2.279 -11.205 1.00 0.00 C ATOM 245 O ASN A 40 -6.073 -1.843 -12.347 1.00 0.00 O ATOM 246 CB ASN A 40 -6.875 -0.078 -10.241 1.00 0.00 C ATOM 247 CG ASN A 40 -7.720 0.431 -9.078 1.00 0.00 C ATOM 248 OD1 ASN A 40 -8.030 -0.305 -8.146 1.00 0.00 O ATOM 249 ND2 ASN A 40 -8.106 1.691 -9.080 1.00 0.00 N ATOM 0 H ASN A 40 -5.487 -1.705 -8.096 1.00 0.00 H new ATOM 0 HA ASN A 40 -7.100 -1.958 -9.484 1.00 0.00 H new ATOM 0 HB2 ASN A 40 -6.076 0.636 -10.443 1.00 0.00 H new ATOM 0 HB3 ASN A 40 -7.492 -0.127 -11.138 1.00 0.00 H new ATOM 0 HD21 ASN A 40 -8.663 2.055 -8.307 1.00 0.00 H new ATOM 0 HD22 ASN A 40 -7.848 2.302 -9.855 1.00 0.00 H new ATOM 256 N ASN A 41 -5.401 -3.478 -10.939 1.00 0.00 N ATOM 257 CA ASN A 41 -4.867 -4.407 -11.919 1.00 0.00 C ATOM 258 C ASN A 41 -3.859 -3.772 -12.886 1.00 0.00 C ATOM 259 O ASN A 41 -3.669 -4.274 -13.995 1.00 0.00 O ATOM 260 CB ASN A 41 -6.023 -5.097 -12.638 1.00 0.00 C ATOM 261 CG ASN A 41 -6.668 -6.185 -11.813 1.00 0.00 C ATOM 262 OD1 ASN A 41 -6.106 -7.261 -11.618 1.00 0.00 O ATOM 263 ND2 ASN A 41 -7.847 -5.905 -11.302 1.00 0.00 N ATOM 0 H ASN A 41 -5.338 -3.838 -9.987 1.00 0.00 H new ATOM 0 HA ASN A 41 -4.283 -5.158 -11.387 1.00 0.00 H new ATOM 0 HB2 ASN A 41 -6.776 -4.353 -12.900 1.00 0.00 H new ATOM 0 HB3 ASN A 41 -5.659 -5.525 -13.572 1.00 0.00 H new ATOM 0 HD21 ASN A 41 -8.327 -6.592 -10.721 1.00 0.00 H new ATOM 0 HD22 ASN A 41 -8.281 -5.001 -11.487 1.00 0.00 H new ATOM 270 N GLY A 42 -3.201 -2.687 -12.489 1.00 0.00 N ATOM 271 CA GLY A 42 -2.126 -2.044 -13.223 1.00 0.00 C ATOM 272 C GLY A 42 -0.861 -2.070 -12.371 1.00 0.00 C ATOM 273 O GLY A 42 -0.920 -2.203 -11.144 1.00 0.00 O ATOM 0 H GLY A 42 -3.414 -2.215 -11.610 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -1.954 -2.559 -14.168 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -2.397 -1.016 -13.465 1.00 0.00 H new ATOM 277 N TYR A 43 0.298 -1.996 -13.012 1.00 0.00 N ATOM 278 CA TYR A 43 1.582 -2.085 -12.332 1.00 0.00 C ATOM 279 C TYR A 43 1.936 -0.740 -11.696 1.00 0.00 C ATOM 280 O TYR A 43 1.570 0.303 -12.235 1.00 0.00 O ATOM 281 CB TYR A 43 2.632 -2.497 -13.367 1.00 0.00 C ATOM 282 CG TYR A 43 4.062 -2.451 -12.877 1.00 0.00 C ATOM 283 CD1 TYR A 43 4.434 -3.109 -11.687 1.00 0.00 C ATOM 284 CD2 TYR A 43 5.017 -1.710 -13.598 1.00 0.00 C ATOM 285 CE1 TYR A 43 5.754 -3.015 -11.218 1.00 0.00 C ATOM 286 CE2 TYR A 43 6.342 -1.629 -13.144 1.00 0.00 C ATOM 287 CZ TYR A 43 6.716 -2.284 -11.950 1.00 0.00 C ATOM 288 OH TYR A 43 7.996 -2.194 -11.499 1.00 0.00 O ATOM 0 H TYR A 43 0.374 -1.872 -14.022 1.00 0.00 H new ATOM 0 HA TYR A 43 1.543 -2.824 -11.532 1.00 0.00 H new ATOM 0 HB2 TYR A 43 2.411 -3.510 -13.704 1.00 0.00 H new ATOM 0 HB3 TYR A 43 2.540 -1.845 -14.236 1.00 0.00 H new ATOM 0 HD1 TYR A 43 3.704 -3.685 -11.137 1.00 0.00 H new ATOM 0 HD2 TYR A 43 4.728 -1.201 -14.506 1.00 0.00 H new ATOM 0 HE1 TYR A 43 6.034 -3.502 -10.296 1.00 0.00 H new ATOM 0 HE2 TYR A 43 7.074 -1.067 -13.706 1.00 0.00 H new ATOM 0 HH TYR A 43 8.086 -2.704 -10.667 1.00 0.00 H new ATOM 298 N MET A 44 2.700 -0.750 -10.596 1.00 0.00 N ATOM 299 CA MET A 44 3.206 0.456 -9.944 1.00 0.00 C ATOM 300 C MET A 44 4.723 0.425 -9.824 1.00 0.00 C ATOM 301 O MET A 44 5.409 1.214 -10.472 1.00 0.00 O ATOM 302 CB MET A 44 2.521 0.690 -8.582 1.00 0.00 C ATOM 303 CG MET A 44 1.018 0.922 -8.746 1.00 0.00 C ATOM 304 SD MET A 44 0.639 2.289 -9.876 1.00 0.00 S ATOM 305 CE MET A 44 -0.995 1.744 -10.383 1.00 0.00 C ATOM 0 H MET A 44 2.986 -1.611 -10.130 1.00 0.00 H new ATOM 0 HA MET A 44 2.953 1.307 -10.576 1.00 0.00 H new ATOM 0 HB2 MET A 44 2.689 -0.171 -7.936 1.00 0.00 H new ATOM 0 HB3 MET A 44 2.972 1.551 -8.089 1.00 0.00 H new ATOM 0 HG2 MET A 44 0.552 0.009 -9.118 1.00 0.00 H new ATOM 0 HG3 MET A 44 0.578 1.130 -7.771 1.00 0.00 H new ATOM 0 HE1 MET A 44 -1.105 1.878 -11.459 1.00 0.00 H new ATOM 0 HE2 MET A 44 -1.121 0.690 -10.133 1.00 0.00 H new ATOM 0 HE3 MET A 44 -1.752 2.333 -9.865 1.00 0.00 H new ATOM 315 N ALA A 45 5.251 -0.429 -8.947 1.00 0.00 N ATOM 316 CA ALA A 45 6.680 -0.460 -8.617 1.00 0.00 C ATOM 317 C ALA A 45 7.094 -1.804 -8.014 1.00 0.00 C ATOM 318 O ALA A 45 6.266 -2.698 -7.870 1.00 0.00 O ATOM 319 CB ALA A 45 7.007 0.679 -7.642 1.00 0.00 C ATOM 0 H ALA A 45 4.699 -1.123 -8.442 1.00 0.00 H new ATOM 0 HA ALA A 45 7.243 -0.328 -9.541 1.00 0.00 H new ATOM 0 HB1 ALA A 45 8.069 0.655 -7.397 1.00 0.00 H new ATOM 0 HB2 ALA A 45 6.763 1.635 -8.105 1.00 0.00 H new ATOM 0 HB3 ALA A 45 6.422 0.557 -6.730 1.00 0.00 H new ATOM 325 N THR A 46 8.369 -1.948 -7.643 1.00 0.00 N ATOM 326 CA THR A 46 8.966 -3.221 -7.249 1.00 0.00 C ATOM 327 C THR A 46 9.894 -2.993 -6.043 1.00 0.00 C ATOM 328 O THR A 46 11.117 -3.127 -6.138 1.00 0.00 O ATOM 329 CB THR A 46 9.643 -3.821 -8.504 1.00 0.00 C ATOM 330 OG1 THR A 46 8.695 -3.900 -9.552 1.00 0.00 O ATOM 331 CG2 THR A 46 10.220 -5.222 -8.326 1.00 0.00 C ATOM 0 H THR A 46 9.025 -1.167 -7.608 1.00 0.00 H new ATOM 0 HA THR A 46 8.235 -3.953 -6.905 1.00 0.00 H new ATOM 0 HB THR A 46 10.476 -3.151 -8.718 1.00 0.00 H new ATOM 0 HG1 THR A 46 8.655 -4.820 -9.889 1.00 0.00 H new ATOM 0 HG21 THR A 46 10.671 -5.551 -9.262 1.00 0.00 H new ATOM 0 HG22 THR A 46 10.978 -5.206 -7.543 1.00 0.00 H new ATOM 0 HG23 THR A 46 9.423 -5.911 -8.045 1.00 0.00 H new ATOM 339 N ARG A 47 9.328 -2.600 -4.895 1.00 0.00 N ATOM 340 CA ARG A 47 10.064 -2.316 -3.656 1.00 0.00 C ATOM 341 C ARG A 47 9.696 -3.341 -2.594 1.00 0.00 C ATOM 342 O ARG A 47 8.652 -3.985 -2.718 1.00 0.00 O ATOM 343 CB ARG A 47 9.712 -0.924 -3.110 1.00 0.00 C ATOM 344 CG ARG A 47 10.011 0.247 -4.047 1.00 0.00 C ATOM 345 CD ARG A 47 11.494 0.397 -4.402 1.00 0.00 C ATOM 346 NE ARG A 47 11.849 -0.185 -5.700 1.00 0.00 N ATOM 347 CZ ARG A 47 11.718 0.426 -6.881 1.00 0.00 C ATOM 348 NH1 ARG A 47 10.925 1.493 -7.016 1.00 0.00 N ATOM 349 NH2 ARG A 47 12.361 -0.053 -7.937 1.00 0.00 N ATOM 0 H ARG A 47 8.321 -2.467 -4.799 1.00 0.00 H new ATOM 0 HA ARG A 47 11.129 -2.359 -3.886 1.00 0.00 H new ATOM 0 HB2 ARG A 47 8.650 -0.907 -2.864 1.00 0.00 H new ATOM 0 HB3 ARG A 47 10.257 -0.770 -2.179 1.00 0.00 H new ATOM 0 HG2 ARG A 47 9.439 0.119 -4.966 1.00 0.00 H new ATOM 0 HG3 ARG A 47 9.664 1.169 -3.581 1.00 0.00 H new ATOM 0 HD2 ARG A 47 11.753 1.456 -4.405 1.00 0.00 H new ATOM 0 HD3 ARG A 47 12.095 -0.076 -3.625 1.00 0.00 H new ATOM 0 HE ARG A 47 12.226 -1.133 -5.702 1.00 0.00 H new ATOM 0 HH11 ARG A 47 10.410 1.851 -6.211 1.00 0.00 H new ATOM 0 HH12 ARG A 47 10.834 1.950 -7.924 1.00 0.00 H new ATOM 0 HH21 ARG A 47 12.949 -0.881 -7.844 1.00 0.00 H new ATOM 0 HH22 ARG A 47 12.267 0.406 -8.843 1.00 0.00 H new ATOM 363 N ASP A 48 10.538 -3.468 -1.565 1.00 0.00 N ATOM 364 CA ASP A 48 10.242 -4.280 -0.385 1.00 0.00 C ATOM 365 C ASP A 48 8.952 -3.747 0.250 1.00 0.00 C ATOM 366 O ASP A 48 8.710 -2.536 0.236 1.00 0.00 O ATOM 367 CB ASP A 48 11.415 -4.279 0.613 1.00 0.00 C ATOM 368 CG ASP A 48 12.366 -5.451 0.367 1.00 0.00 C ATOM 369 OD1 ASP A 48 13.077 -5.432 -0.665 1.00 0.00 O ATOM 370 OD2 ASP A 48 12.351 -6.419 1.156 1.00 0.00 O ATOM 0 H ASP A 48 11.448 -3.008 -1.528 1.00 0.00 H new ATOM 0 HA ASP A 48 10.101 -5.320 -0.679 1.00 0.00 H new ATOM 0 HB2 ASP A 48 11.964 -3.341 0.529 1.00 0.00 H new ATOM 0 HB3 ASP A 48 11.028 -4.332 1.630 1.00 0.00 H new ATOM 376 N VAL A 49 8.118 -4.636 0.788 1.00 0.00 N ATOM 377 CA VAL A 49 6.845 -4.322 1.428 1.00 0.00 C ATOM 378 C VAL A 49 6.839 -5.044 2.785 1.00 0.00 C ATOM 379 O VAL A 49 6.927 -6.266 2.834 1.00 0.00 O ATOM 380 CB VAL A 49 5.674 -4.749 0.507 1.00 0.00 C ATOM 381 CG1 VAL A 49 4.321 -4.201 0.996 1.00 0.00 C ATOM 382 CG2 VAL A 49 5.845 -4.322 -0.961 1.00 0.00 C ATOM 0 H VAL A 49 8.321 -5.636 0.789 1.00 0.00 H new ATOM 0 HA VAL A 49 6.719 -3.252 1.595 1.00 0.00 H new ATOM 0 HB VAL A 49 5.689 -5.838 0.558 1.00 0.00 H new ATOM 0 HG11 VAL A 49 3.531 -4.526 0.319 1.00 0.00 H new ATOM 0 HG12 VAL A 49 4.117 -4.577 1.999 1.00 0.00 H new ATOM 0 HG13 VAL A 49 4.356 -3.112 1.017 1.00 0.00 H new ATOM 0 HG21 VAL A 49 4.985 -4.658 -1.540 1.00 0.00 H new ATOM 0 HG22 VAL A 49 5.919 -3.236 -1.018 1.00 0.00 H new ATOM 0 HG23 VAL A 49 6.752 -4.769 -1.367 1.00 0.00 H new ATOM 392 N THR A 50 6.787 -4.321 3.897 1.00 0.00 N ATOM 393 CA THR A 50 6.712 -4.868 5.257 1.00 0.00 C ATOM 394 C THR A 50 5.235 -5.004 5.638 1.00 0.00 C ATOM 395 O THR A 50 4.424 -4.130 5.317 1.00 0.00 O ATOM 396 CB THR A 50 7.487 -3.919 6.191 1.00 0.00 C ATOM 397 OG1 THR A 50 8.849 -3.898 5.808 1.00 0.00 O ATOM 398 CG2 THR A 50 7.454 -4.314 7.664 1.00 0.00 C ATOM 0 H THR A 50 6.796 -3.301 3.882 1.00 0.00 H new ATOM 0 HA THR A 50 7.163 -5.857 5.336 1.00 0.00 H new ATOM 0 HB THR A 50 6.995 -2.952 6.091 1.00 0.00 H new ATOM 0 HG1 THR A 50 9.229 -4.796 5.902 1.00 0.00 H new ATOM 0 HG21 THR A 50 8.024 -3.591 8.247 1.00 0.00 H new ATOM 0 HG22 THR A 50 6.422 -4.329 8.014 1.00 0.00 H new ATOM 0 HG23 THR A 50 7.892 -5.305 7.785 1.00 0.00 H new ATOM 406 N PHE A 51 4.849 -6.112 6.283 1.00 0.00 N ATOM 407 CA PHE A 51 3.484 -6.407 6.653 1.00 0.00 C ATOM 408 C PHE A 51 3.489 -7.310 7.877 1.00 0.00 C ATOM 409 O PHE A 51 4.400 -8.110 8.088 1.00 0.00 O ATOM 410 CB PHE A 51 2.757 -7.098 5.498 1.00 0.00 C ATOM 411 CG PHE A 51 3.382 -8.377 4.978 1.00 0.00 C ATOM 412 CD1 PHE A 51 4.700 -8.437 4.477 1.00 0.00 C ATOM 413 CD2 PHE A 51 2.572 -9.513 4.923 1.00 0.00 C ATOM 414 CE1 PHE A 51 5.231 -9.653 4.028 1.00 0.00 C ATOM 415 CE2 PHE A 51 3.074 -10.714 4.392 1.00 0.00 C ATOM 416 CZ PHE A 51 4.407 -10.781 3.986 1.00 0.00 C ATOM 0 H PHE A 51 5.506 -6.840 6.564 1.00 0.00 H new ATOM 0 HA PHE A 51 2.962 -5.478 6.881 1.00 0.00 H new ATOM 0 HB2 PHE A 51 1.740 -7.321 5.819 1.00 0.00 H new ATOM 0 HB3 PHE A 51 2.683 -6.393 4.670 1.00 0.00 H new ATOM 0 HD1 PHE A 51 5.302 -7.541 4.440 1.00 0.00 H new ATOM 0 HD2 PHE A 51 1.557 -9.469 5.289 1.00 0.00 H new ATOM 0 HE1 PHE A 51 6.264 -9.718 3.718 1.00 0.00 H new ATOM 0 HE2 PHE A 51 2.433 -11.578 4.299 1.00 0.00 H new ATOM 0 HZ PHE A 51 4.809 -11.720 3.634 1.00 0.00 H new ATOM 426 N ASN A 52 2.460 -7.139 8.691 1.00 0.00 N ATOM 427 CA ASN A 52 2.356 -7.601 10.066 1.00 0.00 C ATOM 428 C ASN A 52 0.881 -7.602 10.430 1.00 0.00 C ATOM 429 O ASN A 52 0.056 -7.089 9.671 1.00 0.00 O ATOM 430 CB ASN A 52 3.116 -6.665 11.014 1.00 0.00 C ATOM 431 CG ASN A 52 2.983 -5.202 10.626 1.00 0.00 C ATOM 432 OD1 ASN A 52 1.946 -4.584 10.814 1.00 0.00 O ATOM 433 ND2 ASN A 52 4.004 -4.634 10.003 1.00 0.00 N ATOM 0 H ASN A 52 1.622 -6.642 8.390 1.00 0.00 H new ATOM 0 HA ASN A 52 2.790 -8.597 10.160 1.00 0.00 H new ATOM 0 HB2 ASN A 52 2.744 -6.803 12.029 1.00 0.00 H new ATOM 0 HB3 ASN A 52 4.171 -6.940 11.021 1.00 0.00 H new ATOM 0 HD21 ASN A 52 3.929 -3.671 9.675 1.00 0.00 H new ATOM 0 HD22 ASN A 52 4.865 -5.159 9.851 1.00 0.00 H new ATOM 440 N THR A 53 0.543 -8.265 11.526 1.00 0.00 N ATOM 441 CA THR A 53 -0.805 -8.748 11.763 1.00 0.00 C ATOM 442 C THR A 53 -1.692 -7.596 12.245 1.00 0.00 C ATOM 443 O THR A 53 -1.226 -6.709 12.965 1.00 0.00 O ATOM 444 CB THR A 53 -0.719 -9.987 12.672 1.00 0.00 C ATOM 445 OG1 THR A 53 0.409 -10.760 12.271 1.00 0.00 O ATOM 446 CG2 THR A 53 -1.961 -10.862 12.540 1.00 0.00 C ATOM 0 H THR A 53 1.199 -8.483 12.276 1.00 0.00 H new ATOM 0 HA THR A 53 -1.301 -9.090 10.855 1.00 0.00 H new ATOM 0 HB THR A 53 -0.634 -9.651 13.706 1.00 0.00 H new ATOM 0 HG1 THR A 53 0.167 -11.710 12.258 1.00 0.00 H new ATOM 0 HG21 THR A 53 -1.867 -11.728 13.195 1.00 0.00 H new ATOM 0 HG22 THR A 53 -2.843 -10.287 12.822 1.00 0.00 H new ATOM 0 HG23 THR A 53 -2.062 -11.197 11.508 1.00 0.00 H new ATOM 454 N GLY A 54 -2.947 -7.588 11.790 1.00 0.00 N ATOM 455 CA GLY A 54 -3.924 -6.551 12.053 1.00 0.00 C ATOM 456 C GLY A 54 -5.299 -7.115 11.722 1.00 0.00 C ATOM 457 O GLY A 54 -5.816 -7.927 12.494 1.00 0.00 O ATOM 0 H GLY A 54 -3.316 -8.338 11.206 1.00 0.00 H new ATOM 0 HA2 GLY A 54 -3.880 -6.240 13.097 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -3.717 -5.668 11.448 1.00 0.00 H new ATOM 461 N ASP A 55 -5.890 -6.727 10.587 1.00 0.00 N ATOM 462 CA ASP A 55 -7.218 -7.191 10.187 1.00 0.00 C ATOM 463 C ASP A 55 -7.392 -7.123 8.666 1.00 0.00 C ATOM 464 O ASP A 55 -7.439 -6.022 8.105 1.00 0.00 O ATOM 465 CB ASP A 55 -8.275 -6.323 10.872 1.00 0.00 C ATOM 466 CG ASP A 55 -9.666 -6.803 10.488 1.00 0.00 C ATOM 467 OD1 ASP A 55 -10.360 -6.090 9.733 1.00 0.00 O ATOM 468 OD2 ASP A 55 -10.070 -7.896 10.941 1.00 0.00 O ATOM 0 H ASP A 55 -5.460 -6.084 9.922 1.00 0.00 H new ATOM 0 HA ASP A 55 -7.334 -8.231 10.491 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -8.151 -6.369 11.954 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -8.147 -5.281 10.580 1.00 0.00 H new ATOM 474 N SER A 56 -7.428 -8.281 7.994 1.00 0.00 N ATOM 475 CA SER A 56 -7.662 -8.513 6.562 1.00 0.00 C ATOM 476 C SER A 56 -7.666 -10.042 6.313 1.00 0.00 C ATOM 477 O SER A 56 -7.446 -10.805 7.248 1.00 0.00 O ATOM 478 CB SER A 56 -6.543 -7.861 5.734 1.00 0.00 C ATOM 479 OG SER A 56 -6.606 -6.451 5.692 1.00 0.00 O ATOM 0 H SER A 56 -7.280 -9.163 8.485 1.00 0.00 H new ATOM 0 HA SER A 56 -8.616 -8.076 6.265 1.00 0.00 H new ATOM 0 HB2 SER A 56 -5.579 -8.159 6.147 1.00 0.00 H new ATOM 0 HB3 SER A 56 -6.587 -8.247 4.716 1.00 0.00 H new ATOM 0 HG SER A 56 -7.146 -6.125 6.442 1.00 0.00 H new ATOM 485 N GLU A 57 -7.814 -10.494 5.061 1.00 0.00 N ATOM 486 CA GLU A 57 -7.785 -11.885 4.566 1.00 0.00 C ATOM 487 C GLU A 57 -6.734 -12.757 5.260 1.00 0.00 C ATOM 488 O GLU A 57 -7.077 -13.676 6.001 1.00 0.00 O ATOM 489 CB GLU A 57 -7.600 -11.826 3.034 1.00 0.00 C ATOM 490 CG GLU A 57 -7.357 -13.154 2.292 1.00 0.00 C ATOM 491 CD GLU A 57 -8.498 -14.157 2.453 1.00 0.00 C ATOM 492 OE1 GLU A 57 -9.675 -13.761 2.343 1.00 0.00 O ATOM 493 OE2 GLU A 57 -8.209 -15.363 2.657 1.00 0.00 O ATOM 0 H GLU A 57 -7.972 -9.839 4.295 1.00 0.00 H new ATOM 0 HA GLU A 57 -8.727 -12.377 4.810 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -8.488 -11.360 2.606 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -6.760 -11.165 2.823 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -7.212 -12.948 1.232 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -6.434 -13.603 2.659 1.00 0.00 H new ATOM 501 N GLN A 58 -5.456 -12.461 5.031 1.00 0.00 N ATOM 502 CA GLN A 58 -4.290 -13.152 5.585 1.00 0.00 C ATOM 503 C GLN A 58 -4.019 -12.662 7.030 1.00 0.00 C ATOM 504 O GLN A 58 -2.918 -12.829 7.538 1.00 0.00 O ATOM 505 CB GLN A 58 -3.084 -12.891 4.654 1.00 0.00 C ATOM 506 CG GLN A 58 -3.333 -13.170 3.157 1.00 0.00 C ATOM 507 CD GLN A 58 -2.613 -14.356 2.522 1.00 0.00 C ATOM 508 OE1 GLN A 58 -3.050 -15.501 2.563 1.00 0.00 O ATOM 509 NE2 GLN A 58 -1.553 -14.102 1.778 1.00 0.00 N ATOM 0 H GLN A 58 -5.190 -11.689 4.420 1.00 0.00 H new ATOM 0 HA GLN A 58 -4.468 -14.226 5.639 1.00 0.00 H new ATOM 0 HB2 GLN A 58 -2.778 -11.851 4.767 1.00 0.00 H new ATOM 0 HB3 GLN A 58 -2.249 -13.507 4.987 1.00 0.00 H new ATOM 0 HG2 GLN A 58 -4.404 -13.316 3.018 1.00 0.00 H new ATOM 0 HG3 GLN A 58 -3.058 -12.275 2.600 1.00 0.00 H new ATOM 0 HE21 GLN A 58 -1.177 -13.155 1.733 1.00 0.00 H new ATOM 0 HE22 GLN A 58 -1.110 -14.853 1.248 1.00 0.00 H new ATOM 518 N GLY A 59 -4.922 -11.904 7.656 1.00 0.00 N ATOM 519 CA GLY A 59 -4.767 -11.262 8.964 1.00 0.00 C ATOM 520 C GLY A 59 -3.872 -10.024 8.903 1.00 0.00 C ATOM 521 O GLY A 59 -4.142 -8.997 9.518 1.00 0.00 O ATOM 0 H GLY A 59 -5.833 -11.711 7.240 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -5.748 -10.979 9.345 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -4.345 -11.978 9.669 1.00 0.00 H new ATOM 525 N ILE A 60 -2.802 -10.109 8.127 1.00 0.00 N ATOM 526 CA ILE A 60 -1.758 -9.119 7.966 1.00 0.00 C ATOM 527 C ILE A 60 -2.147 -7.986 7.029 1.00 0.00 C ATOM 528 O ILE A 60 -2.984 -8.119 6.130 1.00 0.00 O ATOM 529 CB ILE A 60 -0.457 -9.804 7.501 1.00 0.00 C ATOM 530 CG1 ILE A 60 -0.678 -10.713 6.273 1.00 0.00 C ATOM 531 CG2 ILE A 60 0.163 -10.583 8.654 1.00 0.00 C ATOM 532 CD1 ILE A 60 0.409 -11.770 6.032 1.00 0.00 C ATOM 0 H ILE A 60 -2.632 -10.935 7.553 1.00 0.00 H new ATOM 0 HA ILE A 60 -1.597 -8.656 8.940 1.00 0.00 H new ATOM 0 HB ILE A 60 0.234 -9.022 7.187 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -1.636 -11.221 6.386 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -0.753 -10.084 5.386 1.00 0.00 H new ATOM 0 HG21 ILE A 60 1.081 -11.063 8.316 1.00 0.00 H new ATOM 0 HG22 ILE A 60 0.390 -9.901 9.473 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -0.538 -11.343 8.999 1.00 0.00 H new ATOM 0 HD11 ILE A 60 0.158 -12.354 5.147 1.00 0.00 H new ATOM 0 HD12 ILE A 60 1.369 -11.277 5.881 1.00 0.00 H new ATOM 0 HD13 ILE A 60 0.472 -12.431 6.897 1.00 0.00 H new ATOM 544 N VAL A 61 -1.471 -6.866 7.230 1.00 0.00 N ATOM 545 CA VAL A 61 -1.720 -5.584 6.613 1.00 0.00 C ATOM 546 C VAL A 61 -0.359 -4.984 6.247 1.00 0.00 C ATOM 547 O VAL A 61 0.534 -4.953 7.101 1.00 0.00 O ATOM 548 CB VAL A 61 -2.541 -4.704 7.581 1.00 0.00 C ATOM 549 CG1 VAL A 61 -4.029 -5.073 7.527 1.00 0.00 C ATOM 550 CG2 VAL A 61 -2.085 -4.822 9.050 1.00 0.00 C ATOM 0 H VAL A 61 -0.681 -6.832 7.874 1.00 0.00 H new ATOM 0 HA VAL A 61 -2.312 -5.667 5.702 1.00 0.00 H new ATOM 0 HB VAL A 61 -2.376 -3.680 7.246 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -4.586 -4.440 8.217 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -4.404 -4.924 6.515 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -4.155 -6.118 7.811 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -2.703 -4.178 9.676 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -2.187 -5.856 9.381 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -1.042 -4.515 9.133 1.00 0.00 H new ATOM 560 N PRO A 62 -0.137 -4.575 4.989 1.00 0.00 N ATOM 561 CA PRO A 62 1.114 -3.958 4.594 1.00 0.00 C ATOM 562 C PRO A 62 1.183 -2.523 5.114 1.00 0.00 C ATOM 563 O PRO A 62 0.171 -1.813 5.213 1.00 0.00 O ATOM 564 CB PRO A 62 1.137 -4.026 3.065 1.00 0.00 C ATOM 565 CG PRO A 62 -0.348 -3.953 2.703 1.00 0.00 C ATOM 566 CD PRO A 62 -1.035 -4.685 3.851 1.00 0.00 C ATOM 0 HA PRO A 62 1.983 -4.466 5.012 1.00 0.00 H new ATOM 0 HB2 PRO A 62 1.701 -3.200 2.631 1.00 0.00 H new ATOM 0 HB3 PRO A 62 1.596 -4.948 2.707 1.00 0.00 H new ATOM 0 HG2 PRO A 62 -0.691 -2.921 2.623 1.00 0.00 H new ATOM 0 HG3 PRO A 62 -0.551 -4.431 1.745 1.00 0.00 H new ATOM 0 HD2 PRO A 62 -2.004 -4.239 4.074 1.00 0.00 H new ATOM 0 HD3 PRO A 62 -1.216 -5.729 3.596 1.00 0.00 H new ATOM 574 N CYS A 63 2.415 -2.093 5.383 1.00 0.00 N ATOM 575 CA CYS A 63 2.786 -0.703 5.535 1.00 0.00 C ATOM 576 C CYS A 63 2.447 -0.003 4.220 1.00 0.00 C ATOM 577 O CYS A 63 3.011 -0.318 3.173 1.00 0.00 O ATOM 578 CB CYS A 63 4.279 -0.590 5.853 1.00 0.00 C ATOM 579 SG CYS A 63 4.864 1.108 6.097 1.00 0.00 S ATOM 0 H CYS A 63 3.202 -2.731 5.503 1.00 0.00 H new ATOM 0 HA CYS A 63 2.246 -0.237 6.359 1.00 0.00 H new ATOM 0 HB2 CYS A 63 4.492 -1.168 6.753 1.00 0.00 H new ATOM 0 HB3 CYS A 63 4.847 -1.044 5.041 1.00 0.00 H new ATOM 0 HG CYS A 63 5.308 1.580 4.970 1.00 0.00 H new ATOM 585 N LEU A 64 1.500 0.926 4.254 1.00 0.00 N ATOM 586 CA LEU A 64 1.019 1.675 3.106 1.00 0.00 C ATOM 587 C LEU A 64 0.858 3.105 3.579 1.00 0.00 C ATOM 588 O LEU A 64 -0.157 3.448 4.187 1.00 0.00 O ATOM 589 CB LEU A 64 -0.314 1.106 2.587 1.00 0.00 C ATOM 590 CG LEU A 64 -0.229 -0.223 1.817 1.00 0.00 C ATOM 591 CD1 LEU A 64 -1.638 -0.674 1.443 1.00 0.00 C ATOM 592 CD2 LEU A 64 0.654 -0.153 0.566 1.00 0.00 C ATOM 0 H LEU A 64 1.028 1.187 5.120 1.00 0.00 H new ATOM 0 HA LEU A 64 1.718 1.611 2.272 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -0.982 0.968 3.437 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -0.775 1.850 1.937 1.00 0.00 H new ATOM 0 HG LEU A 64 0.246 -0.948 2.479 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -1.586 -1.616 0.897 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -2.228 -0.812 2.349 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -2.108 0.084 0.816 1.00 0.00 H new ATOM 0 HD21 LEU A 64 0.667 -1.126 0.075 1.00 0.00 H new ATOM 0 HD22 LEU A 64 0.255 0.595 -0.120 1.00 0.00 H new ATOM 0 HD23 LEU A 64 1.669 0.122 0.852 1.00 0.00 H new ATOM 604 N THR A 65 1.888 3.924 3.379 1.00 0.00 N ATOM 605 CA THR A 65 1.897 5.297 3.853 1.00 0.00 C ATOM 606 C THR A 65 1.343 6.216 2.765 1.00 0.00 C ATOM 607 O THR A 65 1.184 5.778 1.626 1.00 0.00 O ATOM 608 CB THR A 65 3.312 5.641 4.347 1.00 0.00 C ATOM 609 OG1 THR A 65 4.270 5.674 3.300 1.00 0.00 O ATOM 610 CG2 THR A 65 3.769 4.546 5.319 1.00 0.00 C ATOM 0 H THR A 65 2.737 3.651 2.884 1.00 0.00 H new ATOM 0 HA THR A 65 1.238 5.441 4.710 1.00 0.00 H new ATOM 0 HB THR A 65 3.255 6.628 4.806 1.00 0.00 H new ATOM 0 HG1 THR A 65 5.150 5.898 3.669 1.00 0.00 H new ATOM 0 HG21 THR A 65 4.772 4.775 5.679 1.00 0.00 H new ATOM 0 HG22 THR A 65 3.082 4.499 6.164 1.00 0.00 H new ATOM 0 HG23 THR A 65 3.778 3.585 4.806 1.00 0.00 H new ATOM 618 N ARG A 66 1.038 7.481 3.076 1.00 0.00 N ATOM 619 CA ARG A 66 0.414 8.421 2.136 1.00 0.00 C ATOM 620 C ARG A 66 1.181 8.452 0.828 1.00 0.00 C ATOM 621 O ARG A 66 0.595 8.320 -0.244 1.00 0.00 O ATOM 622 CB ARG A 66 0.420 9.861 2.684 1.00 0.00 C ATOM 623 CG ARG A 66 -0.690 10.125 3.689 1.00 0.00 C ATOM 624 CD ARG A 66 -0.182 10.804 4.952 1.00 0.00 C ATOM 625 NE ARG A 66 0.233 12.211 4.801 1.00 0.00 N ATOM 626 CZ ARG A 66 0.122 13.110 5.787 1.00 0.00 C ATOM 627 NH1 ARG A 66 -0.786 12.941 6.735 1.00 0.00 N ATOM 628 NH2 ARG A 66 0.907 14.176 5.856 1.00 0.00 N ATOM 0 H ARG A 66 1.219 7.885 3.995 1.00 0.00 H new ATOM 0 HA ARG A 66 -0.610 8.076 1.990 1.00 0.00 H new ATOM 0 HB2 ARG A 66 1.383 10.059 3.155 1.00 0.00 H new ATOM 0 HB3 ARG A 66 0.322 10.559 1.853 1.00 0.00 H new ATOM 0 HG2 ARG A 66 -1.454 10.750 3.226 1.00 0.00 H new ATOM 0 HG3 ARG A 66 -1.168 9.182 3.954 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -0.965 10.755 5.708 1.00 0.00 H new ATOM 0 HD3 ARG A 66 0.665 10.234 5.333 1.00 0.00 H new ATOM 0 HE ARG A 66 0.621 12.512 3.907 1.00 0.00 H new ATOM 0 HH11 ARG A 66 -1.400 12.127 6.714 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -0.872 13.625 7.487 1.00 0.00 H new ATOM 0 HH21 ARG A 66 1.622 14.330 5.145 1.00 0.00 H new ATOM 0 HH22 ARG A 66 0.796 14.842 6.620 1.00 0.00 H new ATOM 642 N ALA A 67 2.490 8.641 0.947 1.00 0.00 N ATOM 643 CA ALA A 67 3.409 8.735 -0.160 1.00 0.00 C ATOM 644 C ALA A 67 3.302 7.494 -1.039 1.00 0.00 C ATOM 645 O ALA A 67 3.069 7.608 -2.244 1.00 0.00 O ATOM 646 CB ALA A 67 4.804 8.888 0.424 1.00 0.00 C ATOM 0 H ALA A 67 2.948 8.735 1.853 1.00 0.00 H new ATOM 0 HA ALA A 67 3.178 9.592 -0.793 1.00 0.00 H new ATOM 0 HB1 ALA A 67 5.531 8.963 -0.385 1.00 0.00 H new ATOM 0 HB2 ALA A 67 4.846 9.790 1.034 1.00 0.00 H new ATOM 0 HB3 ALA A 67 5.037 8.021 1.042 1.00 0.00 H new ATOM 652 N GLN A 68 3.436 6.308 -0.438 1.00 0.00 N ATOM 653 CA GLN A 68 3.385 5.061 -1.187 1.00 0.00 C ATOM 654 C GLN A 68 2.001 4.884 -1.819 1.00 0.00 C ATOM 655 O GLN A 68 1.914 4.642 -3.020 1.00 0.00 O ATOM 656 CB GLN A 68 3.853 3.879 -0.308 1.00 0.00 C ATOM 657 CG GLN A 68 5.320 3.532 -0.603 1.00 0.00 C ATOM 658 CD GLN A 68 6.279 4.721 -0.495 1.00 0.00 C ATOM 659 OE1 GLN A 68 6.938 5.068 -1.469 1.00 0.00 O ATOM 660 NE2 GLN A 68 6.359 5.389 0.644 1.00 0.00 N ATOM 0 H GLN A 68 3.580 6.191 0.565 1.00 0.00 H new ATOM 0 HA GLN A 68 4.088 5.090 -2.020 1.00 0.00 H new ATOM 0 HB2 GLN A 68 3.739 4.135 0.745 1.00 0.00 H new ATOM 0 HB3 GLN A 68 3.224 3.009 -0.494 1.00 0.00 H new ATOM 0 HG2 GLN A 68 5.644 2.754 0.088 1.00 0.00 H new ATOM 0 HG3 GLN A 68 5.388 3.114 -1.608 1.00 0.00 H new ATOM 0 HE21 GLN A 68 5.807 5.093 1.449 1.00 0.00 H new ATOM 0 HE22 GLN A 68 6.973 6.200 0.717 1.00 0.00 H new ATOM 669 N LEU A 69 0.927 5.095 -1.057 1.00 0.00 N ATOM 670 CA LEU A 69 -0.463 4.986 -1.493 1.00 0.00 C ATOM 671 C LEU A 69 -0.756 5.854 -2.711 1.00 0.00 C ATOM 672 O LEU A 69 -1.401 5.394 -3.658 1.00 0.00 O ATOM 673 CB LEU A 69 -1.403 5.378 -0.339 1.00 0.00 C ATOM 674 CG LEU A 69 -1.615 4.270 0.705 1.00 0.00 C ATOM 675 CD1 LEU A 69 -2.528 4.725 1.845 1.00 0.00 C ATOM 676 CD2 LEU A 69 -2.288 3.058 0.059 1.00 0.00 C ATOM 0 H LEU A 69 1.008 5.358 -0.075 1.00 0.00 H new ATOM 0 HA LEU A 69 -0.634 3.949 -1.780 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -1.000 6.259 0.160 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -2.371 5.661 -0.754 1.00 0.00 H new ATOM 0 HG LEU A 69 -0.628 4.022 1.096 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -2.651 3.911 2.560 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -2.083 5.585 2.346 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -3.502 5.004 1.442 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -2.433 2.280 0.808 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -3.255 3.353 -0.349 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -1.657 2.676 -0.743 1.00 0.00 H new ATOM 688 N ALA A 70 -0.289 7.099 -2.697 1.00 0.00 N ATOM 689 CA ALA A 70 -0.411 8.030 -3.805 1.00 0.00 C ATOM 690 C ALA A 70 0.415 7.589 -5.016 1.00 0.00 C ATOM 691 O ALA A 70 0.031 7.863 -6.157 1.00 0.00 O ATOM 692 CB ALA A 70 0.084 9.389 -3.331 1.00 0.00 C ATOM 0 H ALA A 70 0.197 7.495 -1.892 1.00 0.00 H new ATOM 0 HA ALA A 70 -1.455 8.070 -4.117 1.00 0.00 H new ATOM 0 HB1 ALA A 70 0.004 10.110 -4.145 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -0.522 9.724 -2.489 1.00 0.00 H new ATOM 0 HB3 ALA A 70 1.125 9.308 -3.019 1.00 0.00 H new ATOM 698 N SER A 71 1.525 6.888 -4.781 1.00 0.00 N ATOM 699 CA SER A 71 2.383 6.381 -5.839 1.00 0.00 C ATOM 700 C SER A 71 1.627 5.311 -6.634 1.00 0.00 C ATOM 701 O SER A 71 1.821 5.220 -7.845 1.00 0.00 O ATOM 702 CB SER A 71 3.701 5.865 -5.247 1.00 0.00 C ATOM 703 OG SER A 71 4.762 5.960 -6.177 1.00 0.00 O ATOM 0 H SER A 71 1.851 6.657 -3.843 1.00 0.00 H new ATOM 0 HA SER A 71 2.645 7.180 -6.532 1.00 0.00 H new ATOM 0 HB2 SER A 71 3.948 6.438 -4.353 1.00 0.00 H new ATOM 0 HB3 SER A 71 3.580 4.827 -4.937 1.00 0.00 H new ATOM 0 HG SER A 71 5.587 5.625 -5.768 1.00 0.00 H new ATOM 709 N MET A 72 0.706 4.568 -6.008 1.00 0.00 N ATOM 710 CA MET A 72 -0.315 3.835 -6.738 1.00 0.00 C ATOM 711 C MET A 72 -1.337 4.824 -7.309 1.00 0.00 C ATOM 712 O MET A 72 -1.479 4.937 -8.526 1.00 0.00 O ATOM 713 CB MET A 72 -0.955 2.740 -5.885 1.00 0.00 C ATOM 714 CG MET A 72 0.041 1.818 -5.164 1.00 0.00 C ATOM 715 SD MET A 72 0.227 2.156 -3.405 1.00 0.00 S ATOM 716 CE MET A 72 1.713 1.207 -2.996 1.00 0.00 C ATOM 0 H MET A 72 0.654 4.464 -4.995 1.00 0.00 H new ATOM 0 HA MET A 72 0.150 3.309 -7.572 1.00 0.00 H new ATOM 0 HB2 MET A 72 -1.599 3.209 -5.141 1.00 0.00 H new ATOM 0 HB3 MET A 72 -1.596 2.131 -6.522 1.00 0.00 H new ATOM 0 HG2 MET A 72 -0.282 0.785 -5.291 1.00 0.00 H new ATOM 0 HG3 MET A 72 1.015 1.909 -5.644 1.00 0.00 H new ATOM 0 HE1 MET A 72 1.962 1.356 -1.945 1.00 0.00 H new ATOM 0 HE2 MET A 72 1.530 0.148 -3.179 1.00 0.00 H new ATOM 0 HE3 MET A 72 2.543 1.545 -3.617 1.00 0.00 H new ATOM 726 N GLY A 73 -1.999 5.609 -6.454 1.00 0.00 N ATOM 727 CA GLY A 73 -2.876 6.700 -6.883 1.00 0.00 C ATOM 728 C GLY A 73 -3.927 7.109 -5.860 1.00 0.00 C ATOM 729 O GLY A 73 -4.770 7.941 -6.169 1.00 0.00 O ATOM 0 H GLY A 73 -1.941 5.504 -5.441 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -2.263 7.569 -7.121 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -3.380 6.403 -7.803 1.00 0.00 H new ATOM 733 N LEU A 74 -3.933 6.534 -4.658 1.00 0.00 N ATOM 734 CA LEU A 74 -4.960 6.800 -3.654 1.00 0.00 C ATOM 735 C LEU A 74 -4.995 8.283 -3.308 1.00 0.00 C ATOM 736 O LEU A 74 -3.952 8.884 -3.042 1.00 0.00 O ATOM 737 CB LEU A 74 -4.604 6.011 -2.407 1.00 0.00 C ATOM 738 CG LEU A 74 -5.647 5.890 -1.278 1.00 0.00 C ATOM 739 CD1 LEU A 74 -5.254 6.730 -0.068 1.00 0.00 C ATOM 740 CD2 LEU A 74 -7.125 6.145 -1.510 1.00 0.00 C ATOM 0 H LEU A 74 -3.223 5.868 -4.353 1.00 0.00 H new ATOM 0 HA LEU A 74 -5.937 6.510 -4.040 1.00 0.00 H new ATOM 0 HB2 LEU A 74 -4.339 5.001 -2.721 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -3.706 6.458 -1.980 1.00 0.00 H new ATOM 0 HG LEU A 74 -5.593 4.808 -1.154 1.00 0.00 H new ATOM 0 HD11 LEU A 74 -6.010 6.623 0.710 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -4.291 6.391 0.313 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -5.180 7.777 -0.361 1.00 0.00 H new ATOM 0 HD21 LEU A 74 -7.670 6.002 -0.577 1.00 0.00 H new ATOM 0 HD22 LEU A 74 -7.267 7.167 -1.860 1.00 0.00 H new ATOM 0 HD23 LEU A 74 -7.501 5.449 -2.260 1.00 0.00 H new ATOM 752 N ASN A 75 -6.190 8.863 -3.270 1.00 0.00 N ATOM 753 CA ASN A 75 -6.385 10.228 -2.830 1.00 0.00 C ATOM 754 C ASN A 75 -6.408 10.281 -1.302 1.00 0.00 C ATOM 755 O ASN A 75 -7.453 10.163 -0.660 1.00 0.00 O ATOM 756 CB ASN A 75 -7.642 10.849 -3.443 1.00 0.00 C ATOM 757 CG ASN A 75 -7.545 12.368 -3.366 1.00 0.00 C ATOM 758 OD1 ASN A 75 -6.783 12.936 -2.587 1.00 0.00 O ATOM 759 ND2 ASN A 75 -8.251 13.041 -4.247 1.00 0.00 N ATOM 0 H ASN A 75 -7.051 8.392 -3.546 1.00 0.00 H new ATOM 0 HA ASN A 75 -5.546 10.829 -3.182 1.00 0.00 H new ATOM 0 HB2 ASN A 75 -7.748 10.532 -4.481 1.00 0.00 H new ATOM 0 HB3 ASN A 75 -8.528 10.503 -2.912 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -8.173 14.057 -4.294 1.00 0.00 H new ATOM 0 HD22 ASN A 75 -8.877 12.547 -4.883 1.00 0.00 H new ATOM 766 N THR A 76 -5.233 10.437 -0.705 1.00 0.00 N ATOM 767 CA THR A 76 -5.021 10.553 0.733 1.00 0.00 C ATOM 768 C THR A 76 -5.735 11.773 1.342 1.00 0.00 C ATOM 769 O THR A 76 -5.984 11.804 2.548 1.00 0.00 O ATOM 770 CB THR A 76 -3.507 10.581 1.020 1.00 0.00 C ATOM 771 OG1 THR A 76 -2.931 11.814 0.658 1.00 0.00 O ATOM 772 CG2 THR A 76 -2.698 9.534 0.253 1.00 0.00 C ATOM 0 H THR A 76 -4.362 10.488 -1.234 1.00 0.00 H new ATOM 0 HA THR A 76 -5.465 9.682 1.215 1.00 0.00 H new ATOM 0 HB THR A 76 -3.457 10.385 2.091 1.00 0.00 H new ATOM 0 HG1 THR A 76 -1.971 11.797 0.855 1.00 0.00 H new ATOM 0 HG21 THR A 76 -1.644 9.625 0.515 1.00 0.00 H new ATOM 0 HG22 THR A 76 -3.052 8.537 0.515 1.00 0.00 H new ATOM 0 HG23 THR A 76 -2.821 9.693 -0.818 1.00 0.00 H new ATOM 780 N ALA A 77 -6.088 12.776 0.529 1.00 0.00 N ATOM 781 CA ALA A 77 -6.867 13.931 0.954 1.00 0.00 C ATOM 782 C ALA A 77 -8.377 13.706 0.744 1.00 0.00 C ATOM 783 O ALA A 77 -9.158 14.659 0.738 1.00 0.00 O ATOM 784 CB ALA A 77 -6.342 15.190 0.268 1.00 0.00 C ATOM 0 H ALA A 77 -5.833 12.802 -0.458 1.00 0.00 H new ATOM 0 HA ALA A 77 -6.743 14.071 2.028 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -6.928 16.051 0.589 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -5.297 15.342 0.537 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -6.426 15.077 -0.813 1.00 0.00 H new ATOM 790 N SER A 78 -8.804 12.456 0.565 1.00 0.00 N ATOM 791 CA SER A 78 -10.195 12.071 0.361 1.00 0.00 C ATOM 792 C SER A 78 -10.660 11.024 1.385 1.00 0.00 C ATOM 793 O SER A 78 -11.865 10.802 1.496 1.00 0.00 O ATOM 794 CB SER A 78 -10.343 11.595 -1.094 1.00 0.00 C ATOM 795 OG SER A 78 -11.338 12.297 -1.809 1.00 0.00 O ATOM 0 H SER A 78 -8.167 11.659 0.558 1.00 0.00 H new ATOM 0 HA SER A 78 -10.849 12.927 0.526 1.00 0.00 H new ATOM 0 HB2 SER A 78 -9.388 11.709 -1.606 1.00 0.00 H new ATOM 0 HB3 SER A 78 -10.582 10.532 -1.099 1.00 0.00 H new ATOM 0 HG SER A 78 -11.386 11.954 -2.726 1.00 0.00 H new ATOM 801 N VAL A 79 -9.762 10.389 2.155 1.00 0.00 N ATOM 802 CA VAL A 79 -10.114 9.326 3.073 1.00 0.00 C ATOM 803 C VAL A 79 -9.851 9.834 4.488 1.00 0.00 C ATOM 804 O VAL A 79 -8.698 10.086 4.851 1.00 0.00 O ATOM 805 CB VAL A 79 -9.404 8.019 2.691 1.00 0.00 C ATOM 806 CG1 VAL A 79 -9.718 7.599 1.255 1.00 0.00 C ATOM 807 CG2 VAL A 79 -7.895 7.977 2.900 1.00 0.00 C ATOM 0 H VAL A 79 -8.766 10.611 2.148 1.00 0.00 H new ATOM 0 HA VAL A 79 -11.171 9.066 3.020 1.00 0.00 H new ATOM 0 HB VAL A 79 -9.821 7.310 3.406 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -9.196 6.670 1.025 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -10.792 7.448 1.147 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -9.390 8.379 0.568 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -7.512 7.003 2.594 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -7.423 8.757 2.302 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -7.669 8.141 3.954 1.00 0.00 H new ATOM 817 N ALA A 80 -10.943 10.079 5.226 1.00 0.00 N ATOM 818 CA ALA A 80 -11.016 10.670 6.555 1.00 0.00 C ATOM 819 C ALA A 80 -9.807 11.550 6.863 1.00 0.00 C ATOM 820 O ALA A 80 -9.642 12.599 6.228 1.00 0.00 O ATOM 821 CB ALA A 80 -11.259 9.589 7.614 1.00 0.00 C ATOM 0 H ALA A 80 -11.871 9.847 4.872 1.00 0.00 H new ATOM 0 HA ALA A 80 -11.874 11.341 6.580 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -11.310 10.051 8.600 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -12.198 9.078 7.403 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -10.441 8.869 7.593 1.00 0.00 H new ATOM 827 N GLY A 81 -8.942 11.100 7.775 1.00 0.00 N ATOM 828 CA GLY A 81 -7.807 11.847 8.258 1.00 0.00 C ATOM 829 C GLY A 81 -6.469 11.258 7.861 1.00 0.00 C ATOM 830 O GLY A 81 -5.484 11.469 8.571 1.00 0.00 O ATOM 0 H GLY A 81 -9.026 10.178 8.202 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -7.870 12.868 7.881 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -7.859 11.905 9.345 1.00 0.00 H new ATOM 834 N MET A 82 -6.394 10.559 6.724 1.00 0.00 N ATOM 835 CA MET A 82 -5.100 10.104 6.216 1.00 0.00 C ATOM 836 C MET A 82 -4.144 11.284 6.084 1.00 0.00 C ATOM 837 O MET A 82 -3.047 11.257 6.636 1.00 0.00 O ATOM 838 CB MET A 82 -5.257 9.376 4.889 1.00 0.00 C ATOM 839 CG MET A 82 -3.926 8.803 4.432 1.00 0.00 C ATOM 840 SD MET A 82 -4.047 7.804 2.933 1.00 0.00 S ATOM 841 CE MET A 82 -4.853 6.314 3.568 1.00 0.00 C ATOM 0 H MET A 82 -7.197 10.301 6.150 1.00 0.00 H new ATOM 0 HA MET A 82 -4.679 9.396 6.930 1.00 0.00 H new ATOM 0 HB2 MET A 82 -5.988 8.574 4.992 1.00 0.00 H new ATOM 0 HB3 MET A 82 -5.642 10.063 4.135 1.00 0.00 H new ATOM 0 HG2 MET A 82 -3.228 9.622 4.258 1.00 0.00 H new ATOM 0 HG3 MET A 82 -3.508 8.193 5.233 1.00 0.00 H new ATOM 0 HE1 MET A 82 -5.385 5.815 2.758 1.00 0.00 H new ATOM 0 HE2 MET A 82 -4.101 5.640 3.977 1.00 0.00 H new ATOM 0 HE3 MET A 82 -5.559 6.588 4.352 1.00 0.00 H new ATOM 851 N ASN A 83 -4.578 12.351 5.416 1.00 0.00 N ATOM 852 CA ASN A 83 -3.858 13.615 5.301 1.00 0.00 C ATOM 853 C ASN A 83 -3.553 14.337 6.637 1.00 0.00 C ATOM 854 O ASN A 83 -3.019 15.438 6.561 1.00 0.00 O ATOM 855 CB ASN A 83 -4.553 14.563 4.313 1.00 0.00 C ATOM 856 CG ASN A 83 -5.796 15.259 4.839 1.00 0.00 C ATOM 857 OD1 ASN A 83 -5.834 16.482 4.949 1.00 0.00 O ATOM 858 ND2 ASN A 83 -6.856 14.516 5.109 1.00 0.00 N ATOM 0 H ASN A 83 -5.471 12.358 4.924 1.00 0.00 H new ATOM 0 HA ASN A 83 -2.880 13.331 4.912 1.00 0.00 H new ATOM 0 HB2 ASN A 83 -3.837 15.323 4.001 1.00 0.00 H new ATOM 0 HB3 ASN A 83 -4.825 13.996 3.422 1.00 0.00 H new ATOM 0 HD21 ASN A 83 -7.724 14.957 5.414 1.00 0.00 H new ATOM 0 HD22 ASN A 83 -6.806 13.502 5.012 1.00 0.00 H new ATOM 865 N LEU A 84 -3.827 13.766 7.827 1.00 0.00 N ATOM 866 CA LEU A 84 -3.573 14.407 9.131 1.00 0.00 C ATOM 867 C LEU A 84 -2.805 13.472 10.069 1.00 0.00 C ATOM 868 O LEU A 84 -2.372 13.888 11.144 1.00 0.00 O ATOM 869 CB LEU A 84 -4.851 14.871 9.868 1.00 0.00 C ATOM 870 CG LEU A 84 -6.203 14.772 9.150 1.00 0.00 C ATOM 871 CD1 LEU A 84 -7.295 14.580 10.197 1.00 0.00 C ATOM 872 CD2 LEU A 84 -6.536 15.972 8.274 1.00 0.00 C ATOM 0 H LEU A 84 -4.236 12.835 7.910 1.00 0.00 H new ATOM 0 HA LEU A 84 -2.984 15.291 8.888 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -4.926 14.295 10.790 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -4.706 15.913 10.153 1.00 0.00 H new ATOM 0 HG LEU A 84 -6.140 13.921 8.472 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -8.264 14.508 9.703 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -7.104 13.665 10.758 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -7.298 15.430 10.879 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -7.508 15.821 7.804 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -6.566 16.873 8.887 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -5.773 16.083 7.503 1.00 0.00 H new ATOM 884 N LEU A 85 -2.654 12.201 9.692 1.00 0.00 N ATOM 885 CA LEU A 85 -1.680 11.275 10.257 1.00 0.00 C ATOM 886 C LEU A 85 -0.259 11.799 9.981 1.00 0.00 C ATOM 887 O LEU A 85 -0.098 12.858 9.363 1.00 0.00 O ATOM 888 CB LEU A 85 -1.936 9.901 9.626 1.00 0.00 C ATOM 889 CG LEU A 85 -3.051 9.103 10.321 1.00 0.00 C ATOM 890 CD1 LEU A 85 -3.933 8.346 9.332 1.00 0.00 C ATOM 891 CD2 LEU A 85 -2.420 8.075 11.238 1.00 0.00 C ATOM 0 H LEU A 85 -3.226 11.778 8.961 1.00 0.00 H new ATOM 0 HA LEU A 85 -1.777 11.187 11.339 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -2.197 10.035 8.576 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -1.014 9.320 9.653 1.00 0.00 H new ATOM 0 HG LEU A 85 -3.668 9.820 10.863 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -4.704 7.800 9.876 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -4.403 9.053 8.649 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -3.323 7.644 8.764 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -3.203 7.503 11.736 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -1.794 7.401 10.653 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -1.808 8.581 11.985 1.00 0.00 H new ATOM 903 N ALA A 86 0.787 11.078 10.388 1.00 0.00 N ATOM 904 CA ALA A 86 2.139 11.399 9.928 1.00 0.00 C ATOM 905 C ALA A 86 2.241 11.189 8.404 1.00 0.00 C ATOM 906 O ALA A 86 1.363 10.555 7.802 1.00 0.00 O ATOM 907 CB ALA A 86 3.164 10.558 10.694 1.00 0.00 C ATOM 0 H ALA A 86 0.727 10.282 11.023 1.00 0.00 H new ATOM 0 HA ALA A 86 2.357 12.448 10.130 1.00 0.00 H new ATOM 0 HB1 ALA A 86 4.168 10.802 10.346 1.00 0.00 H new ATOM 0 HB2 ALA A 86 3.087 10.772 11.760 1.00 0.00 H new ATOM 0 HB3 ALA A 86 2.968 9.500 10.522 1.00 0.00 H new ATOM 913 N ASP A 87 3.306 11.702 7.781 1.00 0.00 N ATOM 914 CA ASP A 87 3.574 11.559 6.340 1.00 0.00 C ATOM 915 C ASP A 87 3.955 10.121 5.982 1.00 0.00 C ATOM 916 O ASP A 87 3.768 9.679 4.849 1.00 0.00 O ATOM 917 CB ASP A 87 4.713 12.497 5.899 1.00 0.00 C ATOM 918 CG ASP A 87 4.304 13.969 5.886 1.00 0.00 C ATOM 919 OD1 ASP A 87 3.471 14.352 5.031 1.00 0.00 O ATOM 920 OD2 ASP A 87 4.861 14.797 6.647 1.00 0.00 O ATOM 0 H ASP A 87 4.022 12.239 8.270 1.00 0.00 H new ATOM 0 HA ASP A 87 2.655 11.825 5.818 1.00 0.00 H new ATOM 0 HB2 ASP A 87 5.563 12.368 6.569 1.00 0.00 H new ATOM 0 HB3 ASP A 87 5.047 12.210 4.902 1.00 0.00 H new ATOM 926 N ASP A 88 4.478 9.391 6.963 1.00 0.00 N ATOM 927 CA ASP A 88 5.195 8.125 6.846 1.00 0.00 C ATOM 928 C ASP A 88 4.583 7.096 7.780 1.00 0.00 C ATOM 929 O ASP A 88 5.262 6.221 8.311 1.00 0.00 O ATOM 930 CB ASP A 88 6.611 8.413 7.367 1.00 0.00 C ATOM 931 CG ASP A 88 6.640 8.691 8.879 1.00 0.00 C ATOM 932 OD1 ASP A 88 5.960 9.635 9.344 1.00 0.00 O ATOM 933 OD2 ASP A 88 7.354 8.003 9.637 1.00 0.00 O ATOM 0 H ASP A 88 4.406 9.692 7.935 1.00 0.00 H new ATOM 0 HA ASP A 88 5.168 7.752 5.822 1.00 0.00 H new ATOM 0 HB2 ASP A 88 7.256 7.562 7.145 1.00 0.00 H new ATOM 0 HB3 ASP A 88 7.022 9.271 6.836 1.00 0.00 H new ATOM 939 N ALA A 89 3.268 7.149 7.914 1.00 0.00 N ATOM 940 CA ALA A 89 2.580 6.400 8.935 1.00 0.00 C ATOM 941 C ALA A 89 1.957 5.178 8.288 1.00 0.00 C ATOM 942 O ALA A 89 1.334 5.350 7.242 1.00 0.00 O ATOM 943 CB ALA A 89 1.459 7.271 9.491 1.00 0.00 C ATOM 0 H ALA A 89 2.657 7.710 7.320 1.00 0.00 H new ATOM 0 HA ALA A 89 3.268 6.106 9.728 1.00 0.00 H new ATOM 0 HB1 ALA A 89 0.924 6.724 10.267 1.00 0.00 H new ATOM 0 HB2 ALA A 89 1.882 8.181 9.916 1.00 0.00 H new ATOM 0 HB3 ALA A 89 0.769 7.532 8.689 1.00 0.00 H new ATOM 949 N CYS A 90 2.016 3.997 8.902 1.00 0.00 N ATOM 950 CA CYS A 90 1.203 2.872 8.457 1.00 0.00 C ATOM 951 C CYS A 90 -0.271 3.300 8.478 1.00 0.00 C ATOM 952 O CYS A 90 -0.773 3.712 9.532 1.00 0.00 O ATOM 953 CB CYS A 90 1.443 1.658 9.358 1.00 0.00 C ATOM 954 SG CYS A 90 3.116 0.969 9.252 1.00 0.00 S ATOM 0 H CYS A 90 2.615 3.797 9.703 1.00 0.00 H new ATOM 0 HA CYS A 90 1.478 2.584 7.442 1.00 0.00 H new ATOM 0 HB2 CYS A 90 1.245 1.942 10.391 1.00 0.00 H new ATOM 0 HB3 CYS A 90 0.725 0.880 9.098 1.00 0.00 H new ATOM 0 HG CYS A 90 3.569 1.113 8.042 1.00 0.00 H new ATOM 960 N VAL A 91 -0.957 3.280 7.336 1.00 0.00 N ATOM 961 CA VAL A 91 -2.388 3.543 7.235 1.00 0.00 C ATOM 962 C VAL A 91 -3.062 2.238 6.763 1.00 0.00 C ATOM 963 O VAL A 91 -2.482 1.536 5.921 1.00 0.00 O ATOM 964 CB VAL A 91 -2.649 4.737 6.283 1.00 0.00 C ATOM 965 CG1 VAL A 91 -3.931 5.440 6.733 1.00 0.00 C ATOM 966 CG2 VAL A 91 -1.561 5.817 6.278 1.00 0.00 C ATOM 0 H VAL A 91 -0.522 3.076 6.436 1.00 0.00 H new ATOM 0 HA VAL A 91 -2.813 3.832 8.197 1.00 0.00 H new ATOM 0 HB VAL A 91 -2.693 4.303 5.284 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -4.133 6.285 6.075 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -4.765 4.739 6.690 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -3.810 5.798 7.756 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -1.837 6.608 5.581 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -1.459 6.235 7.279 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -0.613 5.377 5.970 1.00 0.00 H new ATOM 976 N PRO A 92 -4.251 1.853 7.264 1.00 0.00 N ATOM 977 CA PRO A 92 -4.923 0.669 6.746 1.00 0.00 C ATOM 978 C PRO A 92 -5.593 0.966 5.428 1.00 0.00 C ATOM 979 O PRO A 92 -6.336 1.951 5.330 1.00 0.00 O ATOM 980 CB PRO A 92 -6.012 0.321 7.721 1.00 0.00 C ATOM 981 CG PRO A 92 -6.353 1.653 8.382 1.00 0.00 C ATOM 982 CD PRO A 92 -5.036 2.445 8.341 1.00 0.00 C ATOM 0 HA PRO A 92 -4.195 -0.131 6.612 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -6.878 -0.108 7.216 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -5.674 -0.413 8.452 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -7.146 2.172 7.845 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -6.701 1.512 9.405 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -5.221 3.503 8.154 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -4.509 2.377 9.293 1.00 0.00 H new ATOM 990 N LEU A 93 -5.424 0.066 4.462 1.00 0.00 N ATOM 991 CA LEU A 93 -6.108 0.282 3.210 1.00 0.00 C ATOM 992 C LEU A 93 -7.595 -0.032 3.319 1.00 0.00 C ATOM 993 O LEU A 93 -8.426 0.843 3.099 1.00 0.00 O ATOM 994 CB LEU A 93 -5.424 -0.448 2.046 1.00 0.00 C ATOM 995 CG LEU A 93 -5.954 -0.033 0.657 1.00 0.00 C ATOM 996 CD1 LEU A 93 -6.052 1.486 0.455 1.00 0.00 C ATOM 997 CD2 LEU A 93 -4.989 -0.587 -0.391 1.00 0.00 C ATOM 0 H LEU A 93 -4.849 -0.774 4.522 1.00 0.00 H new ATOM 0 HA LEU A 93 -6.036 1.345 2.979 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -4.352 -0.256 2.088 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -5.561 -1.522 2.171 1.00 0.00 H new ATOM 0 HG LEU A 93 -6.965 -0.430 0.565 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -6.432 1.696 -0.545 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -6.729 1.909 1.197 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -5.064 1.933 0.569 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -5.336 -0.311 -1.387 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -3.995 -0.173 -0.225 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -4.948 -1.673 -0.310 1.00 0.00 H new ATOM 1009 N THR A 94 -7.935 -1.262 3.697 1.00 0.00 N ATOM 1010 CA THR A 94 -9.302 -1.773 3.607 1.00 0.00 C ATOM 1011 C THR A 94 -10.238 -1.200 4.684 1.00 0.00 C ATOM 1012 O THR A 94 -11.406 -1.584 4.739 1.00 0.00 O ATOM 1013 CB THR A 94 -9.235 -3.316 3.562 1.00 0.00 C ATOM 1014 OG1 THR A 94 -10.436 -3.904 3.119 1.00 0.00 O ATOM 1015 CG2 THR A 94 -8.841 -3.960 4.891 1.00 0.00 C ATOM 0 H THR A 94 -7.269 -1.935 4.076 1.00 0.00 H new ATOM 0 HA THR A 94 -9.767 -1.425 2.685 1.00 0.00 H new ATOM 0 HB THR A 94 -8.444 -3.514 2.838 1.00 0.00 H new ATOM 0 HG1 THR A 94 -11.198 -3.403 3.478 1.00 0.00 H new ATOM 0 HG21 THR A 94 -8.816 -5.044 4.777 1.00 0.00 H new ATOM 0 HG22 THR A 94 -7.855 -3.604 5.190 1.00 0.00 H new ATOM 0 HG23 THR A 94 -9.570 -3.692 5.655 1.00 0.00 H new ATOM 1023 N THR A 95 -9.742 -0.308 5.543 1.00 0.00 N ATOM 1024 CA THR A 95 -10.382 0.058 6.796 1.00 0.00 C ATOM 1025 C THR A 95 -10.617 1.568 6.853 1.00 0.00 C ATOM 1026 O THR A 95 -11.711 1.997 7.208 1.00 0.00 O ATOM 1027 CB THR A 95 -9.482 -0.402 7.945 1.00 0.00 C ATOM 1028 OG1 THR A 95 -8.896 -1.675 7.701 1.00 0.00 O ATOM 1029 CG2 THR A 95 -10.155 -0.463 9.310 1.00 0.00 C ATOM 0 H THR A 95 -8.866 0.187 5.379 1.00 0.00 H new ATOM 0 HA THR A 95 -11.355 -0.426 6.878 1.00 0.00 H new ATOM 0 HB THR A 95 -8.722 0.378 7.977 1.00 0.00 H new ATOM 0 HG1 THR A 95 -8.329 -1.925 8.460 1.00 0.00 H new ATOM 0 HG21 THR A 95 -9.435 -0.799 10.056 1.00 0.00 H new ATOM 0 HG22 THR A 95 -10.521 0.528 9.580 1.00 0.00 H new ATOM 0 HG23 THR A 95 -10.991 -1.161 9.272 1.00 0.00 H new ATOM 1037 N MET A 96 -9.607 2.400 6.552 1.00 0.00 N ATOM 1038 CA MET A 96 -9.842 3.840 6.482 1.00 0.00 C ATOM 1039 C MET A 96 -10.741 4.143 5.286 1.00 0.00 C ATOM 1040 O MET A 96 -11.618 5.003 5.349 1.00 0.00 O ATOM 1041 CB MET A 96 -8.528 4.619 6.397 1.00 0.00 C ATOM 1042 CG MET A 96 -8.865 6.113 6.364 1.00 0.00 C ATOM 1043 SD MET A 96 -7.454 7.205 6.550 1.00 0.00 S ATOM 1044 CE MET A 96 -7.253 7.190 8.326 1.00 0.00 C ATOM 0 H MET A 96 -8.649 2.107 6.359 1.00 0.00 H new ATOM 0 HA MET A 96 -10.340 4.162 7.397 1.00 0.00 H new ATOM 0 HB2 MET A 96 -7.893 4.390 7.253 1.00 0.00 H new ATOM 0 HB3 MET A 96 -7.973 4.334 5.503 1.00 0.00 H new ATOM 0 HG2 MET A 96 -9.360 6.339 5.419 1.00 0.00 H new ATOM 0 HG3 MET A 96 -9.580 6.328 7.158 1.00 0.00 H new ATOM 0 HE1 MET A 96 -6.692 8.071 8.636 1.00 0.00 H new ATOM 0 HE2 MET A 96 -8.233 7.197 8.803 1.00 0.00 H new ATOM 0 HE3 MET A 96 -6.712 6.292 8.623 1.00 0.00 H new ATOM 1054 N VAL A 97 -10.465 3.463 4.181 1.00 0.00 N ATOM 1055 CA VAL A 97 -11.184 3.584 2.932 1.00 0.00 C ATOM 1056 C VAL A 97 -12.425 2.687 2.985 1.00 0.00 C ATOM 1057 O VAL A 97 -12.665 1.941 3.938 1.00 0.00 O ATOM 1058 CB VAL A 97 -10.228 3.268 1.756 1.00 0.00 C ATOM 1059 CG1 VAL A 97 -10.751 3.802 0.406 1.00 0.00 C ATOM 1060 CG2 VAL A 97 -8.833 3.883 1.998 1.00 0.00 C ATOM 0 H VAL A 97 -9.703 2.787 4.135 1.00 0.00 H new ATOM 0 HA VAL A 97 -11.539 4.602 2.770 1.00 0.00 H new ATOM 0 HB VAL A 97 -10.168 2.181 1.708 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -10.042 3.553 -0.383 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -11.716 3.347 0.184 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -10.865 4.885 0.462 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -8.180 3.647 1.158 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -8.924 4.965 2.094 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -8.408 3.472 2.914 1.00 0.00 H new ATOM 1070 N GLN A 98 -13.211 2.783 1.926 1.00 0.00 N ATOM 1071 CA GLN A 98 -14.365 1.982 1.617 1.00 0.00 C ATOM 1072 C GLN A 98 -14.063 1.283 0.312 1.00 0.00 C ATOM 1073 O GLN A 98 -13.635 1.945 -0.637 1.00 0.00 O ATOM 1074 CB GLN A 98 -15.542 2.947 1.490 1.00 0.00 C ATOM 1075 CG GLN A 98 -16.749 2.447 0.691 1.00 0.00 C ATOM 1076 CD GLN A 98 -16.976 3.175 -0.635 1.00 0.00 C ATOM 1077 OE1 GLN A 98 -18.010 3.798 -0.830 1.00 0.00 O ATOM 1078 NE2 GLN A 98 -16.044 3.140 -1.578 1.00 0.00 N ATOM 0 H GLN A 98 -13.037 3.484 1.206 1.00 0.00 H new ATOM 0 HA GLN A 98 -14.604 1.233 2.372 1.00 0.00 H new ATOM 0 HB2 GLN A 98 -15.880 3.207 2.493 1.00 0.00 H new ATOM 0 HB3 GLN A 98 -15.182 3.866 1.027 1.00 0.00 H new ATOM 0 HG2 GLN A 98 -16.621 1.383 0.490 1.00 0.00 H new ATOM 0 HG3 GLN A 98 -17.644 2.550 1.305 1.00 0.00 H new ATOM 0 HE21 GLN A 98 -15.179 2.622 -1.421 1.00 0.00 H new ATOM 0 HE22 GLN A 98 -16.192 3.631 -2.460 1.00 0.00 H new ATOM 1087 N ASP A 99 -14.361 -0.011 0.245 1.00 0.00 N ATOM 1088 CA ASP A 99 -14.378 -0.809 -0.984 1.00 0.00 C ATOM 1089 C ASP A 99 -13.015 -0.885 -1.695 1.00 0.00 C ATOM 1090 O ASP A 99 -12.912 -1.419 -2.798 1.00 0.00 O ATOM 1091 CB ASP A 99 -15.524 -0.292 -1.869 1.00 0.00 C ATOM 1092 CG ASP A 99 -15.933 -1.225 -3.003 1.00 0.00 C ATOM 1093 OD1 ASP A 99 -15.914 -2.461 -2.813 1.00 0.00 O ATOM 1094 OD2 ASP A 99 -16.422 -0.692 -4.027 1.00 0.00 O ATOM 0 H ASP A 99 -14.606 -0.555 1.072 1.00 0.00 H new ATOM 0 HA ASP A 99 -14.569 -1.853 -0.734 1.00 0.00 H new ATOM 0 HB2 ASP A 99 -16.394 -0.107 -1.239 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -15.229 0.667 -2.296 1.00 0.00 H new ATOM 1100 N ALA A 100 -11.955 -0.385 -1.053 1.00 0.00 N ATOM 1101 CA ALA A 100 -10.568 -0.625 -1.423 1.00 0.00 C ATOM 1102 C ALA A 100 -10.013 -1.758 -0.584 1.00 0.00 C ATOM 1103 O ALA A 100 -10.458 -1.954 0.544 1.00 0.00 O ATOM 1104 CB ALA A 100 -9.733 0.621 -1.120 1.00 0.00 C ATOM 0 H ALA A 100 -12.048 0.217 -0.235 1.00 0.00 H new ATOM 0 HA ALA A 100 -10.525 -0.869 -2.484 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -8.695 0.440 -1.398 1.00 0.00 H new ATOM 0 HB2 ALA A 100 -10.119 1.465 -1.691 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -9.790 0.847 -0.055 1.00 0.00 H new ATOM 1110 N THR A 101 -9.030 -2.479 -1.111 1.00 0.00 N ATOM 1111 CA THR A 101 -8.590 -3.755 -0.568 1.00 0.00 C ATOM 1112 C THR A 101 -7.116 -3.992 -0.892 1.00 0.00 C ATOM 1113 O THR A 101 -6.553 -3.345 -1.786 1.00 0.00 O ATOM 1114 CB THR A 101 -9.491 -4.873 -1.138 1.00 0.00 C ATOM 1115 OG1 THR A 101 -9.438 -4.939 -2.551 1.00 0.00 O ATOM 1116 CG2 THR A 101 -10.967 -4.674 -0.774 1.00 0.00 C ATOM 0 H THR A 101 -8.510 -2.188 -1.939 1.00 0.00 H new ATOM 0 HA THR A 101 -8.680 -3.753 0.518 1.00 0.00 H new ATOM 0 HB THR A 101 -9.103 -5.789 -0.693 1.00 0.00 H new ATOM 0 HG1 THR A 101 -10.021 -5.660 -2.867 1.00 0.00 H new ATOM 0 HG21 THR A 101 -11.559 -5.485 -1.198 1.00 0.00 H new ATOM 0 HG22 THR A 101 -11.077 -4.672 0.310 1.00 0.00 H new ATOM 0 HG23 THR A 101 -11.316 -3.723 -1.176 1.00 0.00 H new ATOM 1124 N ALA A 102 -6.496 -4.954 -0.206 1.00 0.00 N ATOM 1125 CA ALA A 102 -5.128 -5.387 -0.450 1.00 0.00 C ATOM 1126 C ALA A 102 -5.025 -6.909 -0.317 1.00 0.00 C ATOM 1127 O ALA A 102 -5.640 -7.507 0.574 1.00 0.00 O ATOM 1128 CB ALA A 102 -4.195 -4.664 0.527 1.00 0.00 C ATOM 0 H ALA A 102 -6.947 -5.464 0.553 1.00 0.00 H new ATOM 0 HA ALA A 102 -4.828 -5.131 -1.466 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -3.167 -4.982 0.352 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -4.272 -3.587 0.375 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -4.481 -4.907 1.550 1.00 0.00 H new ATOM 1134 N HIS A 103 -4.233 -7.519 -1.199 1.00 0.00 N ATOM 1135 CA HIS A 103 -4.034 -8.953 -1.342 1.00 0.00 C ATOM 1136 C HIS A 103 -2.592 -9.281 -1.760 1.00 0.00 C ATOM 1137 O HIS A 103 -2.144 -8.972 -2.866 1.00 0.00 O ATOM 1138 CB HIS A 103 -5.064 -9.499 -2.344 1.00 0.00 C ATOM 1139 CG HIS A 103 -4.717 -10.892 -2.781 1.00 0.00 C ATOM 1140 ND1 HIS A 103 -4.590 -11.985 -1.956 1.00 0.00 N ATOM 1141 CD2 HIS A 103 -4.215 -11.231 -4.007 1.00 0.00 C ATOM 1142 CE1 HIS A 103 -4.000 -12.952 -2.673 1.00 0.00 C ATOM 1143 NE2 HIS A 103 -3.772 -12.548 -3.930 1.00 0.00 N ATOM 0 H HIS A 103 -3.681 -6.988 -1.872 1.00 0.00 H new ATOM 0 HA HIS A 103 -4.187 -9.440 -0.379 1.00 0.00 H new ATOM 0 HB2 HIS A 103 -6.054 -9.495 -1.889 1.00 0.00 H new ATOM 0 HB3 HIS A 103 -5.110 -8.844 -3.214 1.00 0.00 H new ATOM 0 HD1 HIS A 103 -4.888 -12.048 -0.983 1.00 0.00 H new ATOM 0 HD2 HIS A 103 -4.170 -10.593 -4.877 1.00 0.00 H new ATOM 0 HE1 HIS A 103 -3.743 -13.928 -2.288 1.00 0.00 H new ATOM 1152 N LEU A 104 -1.860 -9.946 -0.873 1.00 0.00 N ATOM 1153 CA LEU A 104 -0.560 -10.557 -1.121 1.00 0.00 C ATOM 1154 C LEU A 104 -0.763 -11.896 -1.826 1.00 0.00 C ATOM 1155 O LEU A 104 -1.327 -12.815 -1.226 1.00 0.00 O ATOM 1156 CB LEU A 104 0.104 -10.741 0.250 1.00 0.00 C ATOM 1157 CG LEU A 104 1.454 -11.474 0.392 1.00 0.00 C ATOM 1158 CD1 LEU A 104 1.312 -12.856 1.004 1.00 0.00 C ATOM 1159 CD2 LEU A 104 2.189 -11.719 -0.903 1.00 0.00 C ATOM 0 H LEU A 104 -2.174 -10.080 0.088 1.00 0.00 H new ATOM 0 HA LEU A 104 0.071 -9.941 -1.762 1.00 0.00 H new ATOM 0 HB2 LEU A 104 0.236 -9.746 0.676 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -0.612 -11.267 0.882 1.00 0.00 H new ATOM 0 HG LEU A 104 2.011 -10.783 1.025 1.00 0.00 H new ATOM 0 HD11 LEU A 104 2.294 -13.323 1.079 1.00 0.00 H new ATOM 0 HD12 LEU A 104 0.874 -12.770 1.998 1.00 0.00 H new ATOM 0 HD13 LEU A 104 0.666 -13.468 0.375 1.00 0.00 H new ATOM 0 HD21 LEU A 104 3.125 -12.239 -0.698 1.00 0.00 H new ATOM 0 HD22 LEU A 104 1.572 -12.330 -1.562 1.00 0.00 H new ATOM 0 HD23 LEU A 104 2.402 -10.766 -1.386 1.00 0.00 H new ATOM 1171 N ASP A 105 -0.269 -12.030 -3.056 1.00 0.00 N ATOM 1172 CA ASP A 105 -0.389 -13.245 -3.863 1.00 0.00 C ATOM 1173 C ASP A 105 0.924 -14.030 -3.882 1.00 0.00 C ATOM 1174 O ASP A 105 1.686 -13.973 -4.844 1.00 0.00 O ATOM 1175 CB ASP A 105 -0.860 -12.907 -5.285 1.00 0.00 C ATOM 1176 CG ASP A 105 -1.750 -14.019 -5.849 1.00 0.00 C ATOM 1177 OD1 ASP A 105 -2.402 -13.743 -6.881 1.00 0.00 O ATOM 1178 OD2 ASP A 105 -1.796 -15.133 -5.267 1.00 0.00 O ATOM 0 H ASP A 105 0.237 -11.282 -3.530 1.00 0.00 H new ATOM 0 HA ASP A 105 -1.143 -13.884 -3.403 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -1.410 -11.966 -5.275 1.00 0.00 H new ATOM 0 HB3 ASP A 105 0.004 -12.764 -5.934 1.00 0.00 H new ATOM 1184 N VAL A 106 1.243 -14.721 -2.788 1.00 0.00 N ATOM 1185 CA VAL A 106 2.589 -15.225 -2.495 1.00 0.00 C ATOM 1186 C VAL A 106 3.135 -16.135 -3.599 1.00 0.00 C ATOM 1187 O VAL A 106 4.351 -16.192 -3.806 1.00 0.00 O ATOM 1188 CB VAL A 106 2.538 -15.928 -1.123 1.00 0.00 C ATOM 1189 CG1 VAL A 106 1.955 -17.339 -1.199 1.00 0.00 C ATOM 1190 CG2 VAL A 106 3.892 -15.951 -0.410 1.00 0.00 C ATOM 0 H VAL A 106 0.561 -14.952 -2.065 1.00 0.00 H new ATOM 0 HA VAL A 106 3.290 -14.391 -2.458 1.00 0.00 H new ATOM 0 HB VAL A 106 1.860 -15.319 -0.525 1.00 0.00 H new ATOM 0 HG11 VAL A 106 1.945 -17.783 -0.203 1.00 0.00 H new ATOM 0 HG12 VAL A 106 0.937 -17.292 -1.586 1.00 0.00 H new ATOM 0 HG13 VAL A 106 2.567 -17.950 -1.862 1.00 0.00 H new ATOM 0 HG21 VAL A 106 3.790 -16.459 0.549 1.00 0.00 H new ATOM 0 HG22 VAL A 106 4.618 -16.481 -1.026 1.00 0.00 H new ATOM 0 HG23 VAL A 106 4.234 -14.929 -0.245 1.00 0.00 H new ATOM 1200 N GLY A 107 2.252 -16.850 -4.299 1.00 0.00 N ATOM 1201 CA GLY A 107 2.620 -17.861 -5.267 1.00 0.00 C ATOM 1202 C GLY A 107 2.788 -17.274 -6.667 1.00 0.00 C ATOM 1203 O GLY A 107 3.283 -17.961 -7.555 1.00 0.00 O ATOM 0 H GLY A 107 1.244 -16.733 -4.200 1.00 0.00 H new ATOM 0 HA2 GLY A 107 3.551 -18.337 -4.959 1.00 0.00 H new ATOM 0 HA3 GLY A 107 1.856 -18.638 -5.288 1.00 0.00 H new ATOM 1207 N GLN A 108 2.399 -16.014 -6.862 1.00 0.00 N ATOM 1208 CA GLN A 108 2.602 -15.215 -8.067 1.00 0.00 C ATOM 1209 C GLN A 108 3.547 -14.041 -7.776 1.00 0.00 C ATOM 1210 O GLN A 108 3.782 -13.218 -8.653 1.00 0.00 O ATOM 1211 CB GLN A 108 1.227 -14.750 -8.579 1.00 0.00 C ATOM 1212 CG GLN A 108 0.543 -15.842 -9.421 1.00 0.00 C ATOM 1213 CD GLN A 108 0.910 -15.805 -10.913 1.00 0.00 C ATOM 1214 OE1 GLN A 108 1.675 -14.975 -11.390 1.00 0.00 O ATOM 1215 NE2 GLN A 108 0.362 -16.703 -11.717 1.00 0.00 N ATOM 0 H GLN A 108 1.904 -15.494 -6.138 1.00 0.00 H new ATOM 0 HA GLN A 108 3.078 -15.809 -8.847 1.00 0.00 H new ATOM 0 HB2 GLN A 108 0.591 -14.489 -7.733 1.00 0.00 H new ATOM 0 HB3 GLN A 108 1.346 -13.847 -9.178 1.00 0.00 H new ATOM 0 HG2 GLN A 108 0.810 -16.818 -9.016 1.00 0.00 H new ATOM 0 HG3 GLN A 108 -0.538 -15.740 -9.321 1.00 0.00 H new ATOM 0 HE21 GLN A 108 -0.277 -17.402 -11.340 1.00 0.00 H new ATOM 0 HE22 GLN A 108 0.579 -16.695 -12.714 1.00 0.00 H new ATOM 1224 N GLN A 109 4.089 -13.964 -6.553 1.00 0.00 N ATOM 1225 CA GLN A 109 4.943 -12.904 -6.038 1.00 0.00 C ATOM 1226 C GLN A 109 4.440 -11.516 -6.457 1.00 0.00 C ATOM 1227 O GLN A 109 5.149 -10.734 -7.094 1.00 0.00 O ATOM 1228 CB GLN A 109 6.416 -13.196 -6.366 1.00 0.00 C ATOM 1229 CG GLN A 109 6.882 -14.387 -5.517 1.00 0.00 C ATOM 1230 CD GLN A 109 8.383 -14.622 -5.637 1.00 0.00 C ATOM 1231 OE1 GLN A 109 8.891 -14.977 -6.696 1.00 0.00 O ATOM 1232 NE2 GLN A 109 9.114 -14.446 -4.552 1.00 0.00 N ATOM 0 H GLN A 109 3.927 -14.692 -5.857 1.00 0.00 H new ATOM 0 HA GLN A 109 4.886 -12.886 -4.950 1.00 0.00 H new ATOM 0 HB2 GLN A 109 6.530 -13.420 -7.427 1.00 0.00 H new ATOM 0 HB3 GLN A 109 7.030 -12.320 -6.158 1.00 0.00 H new ATOM 0 HG2 GLN A 109 6.625 -14.210 -4.473 1.00 0.00 H new ATOM 0 HG3 GLN A 109 6.349 -15.285 -5.829 1.00 0.00 H new ATOM 0 HE21 GLN A 109 8.672 -14.151 -3.682 1.00 0.00 H new ATOM 0 HE22 GLN A 109 10.121 -14.605 -4.584 1.00 0.00 H new ATOM 1241 N ARG A 110 3.197 -11.204 -6.068 1.00 0.00 N ATOM 1242 CA ARG A 110 2.539 -9.941 -6.390 1.00 0.00 C ATOM 1243 C ARG A 110 1.889 -9.353 -5.159 1.00 0.00 C ATOM 1244 O ARG A 110 1.460 -10.092 -4.266 1.00 0.00 O ATOM 1245 CB ARG A 110 1.609 -10.154 -7.598 1.00 0.00 C ATOM 1246 CG ARG A 110 1.287 -8.878 -8.389 1.00 0.00 C ATOM 1247 CD ARG A 110 0.804 -9.179 -9.815 1.00 0.00 C ATOM 1248 NE ARG A 110 -0.545 -9.756 -9.893 1.00 0.00 N ATOM 1249 CZ ARG A 110 -1.424 -9.627 -10.899 1.00 0.00 C ATOM 1250 NH1 ARG A 110 -1.139 -8.887 -11.965 1.00 0.00 N ATOM 1251 NH2 ARG A 110 -2.611 -10.221 -10.823 1.00 0.00 N ATOM 0 H ARG A 110 2.616 -11.833 -5.514 1.00 0.00 H new ATOM 0 HA ARG A 110 3.259 -9.183 -6.699 1.00 0.00 H new ATOM 0 HB2 ARG A 110 2.069 -10.877 -8.271 1.00 0.00 H new ATOM 0 HB3 ARG A 110 0.675 -10.594 -7.248 1.00 0.00 H new ATOM 0 HG2 ARG A 110 0.521 -8.310 -7.861 1.00 0.00 H new ATOM 0 HG3 ARG A 110 2.176 -8.248 -8.435 1.00 0.00 H new ATOM 0 HD2 ARG A 110 0.825 -8.256 -10.394 1.00 0.00 H new ATOM 0 HD3 ARG A 110 1.507 -9.866 -10.286 1.00 0.00 H new ATOM 0 HE ARG A 110 -0.846 -10.316 -9.095 1.00 0.00 H new ATOM 0 HH11 ARG A 110 -0.241 -8.407 -12.027 1.00 0.00 H new ATOM 0 HH12 ARG A 110 -1.818 -8.799 -12.721 1.00 0.00 H new ATOM 0 HH21 ARG A 110 -2.853 -10.774 -10.001 1.00 0.00 H new ATOM 0 HH22 ARG A 110 -3.280 -10.124 -11.587 1.00 0.00 H new ATOM 1265 N LEU A 111 1.854 -8.024 -5.098 1.00 0.00 N ATOM 1266 CA LEU A 111 1.160 -7.271 -4.072 1.00 0.00 C ATOM 1267 C LEU A 111 0.019 -6.562 -4.771 1.00 0.00 C ATOM 1268 O LEU A 111 0.226 -5.498 -5.341 1.00 0.00 O ATOM 1269 CB LEU A 111 2.114 -6.348 -3.298 1.00 0.00 C ATOM 1270 CG LEU A 111 1.498 -5.579 -2.119 1.00 0.00 C ATOM 1271 CD1 LEU A 111 1.268 -4.100 -2.418 1.00 0.00 C ATOM 1272 CD2 LEU A 111 0.249 -6.224 -1.526 1.00 0.00 C ATOM 0 H LEU A 111 2.322 -7.431 -5.783 1.00 0.00 H new ATOM 0 HA LEU A 111 0.754 -7.915 -3.292 1.00 0.00 H new ATOM 0 HB2 LEU A 111 2.942 -6.948 -2.922 1.00 0.00 H new ATOM 0 HB3 LEU A 111 2.535 -5.625 -3.997 1.00 0.00 H new ATOM 0 HG LEU A 111 2.263 -5.641 -1.345 1.00 0.00 H new ATOM 0 HD11 LEU A 111 0.831 -3.616 -1.545 1.00 0.00 H new ATOM 0 HD12 LEU A 111 2.219 -3.625 -2.658 1.00 0.00 H new ATOM 0 HD13 LEU A 111 0.589 -4.001 -3.265 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -0.118 -5.615 -0.700 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -0.522 -6.298 -2.293 1.00 0.00 H new ATOM 0 HD23 LEU A 111 0.493 -7.221 -1.160 1.00 0.00 H new ATOM 1284 N ASN A 112 -1.145 -7.205 -4.804 1.00 0.00 N ATOM 1285 CA ASN A 112 -2.344 -6.704 -5.461 1.00 0.00 C ATOM 1286 C ASN A 112 -3.053 -5.752 -4.504 1.00 0.00 C ATOM 1287 O ASN A 112 -3.069 -5.961 -3.288 1.00 0.00 O ATOM 1288 CB ASN A 112 -3.294 -7.857 -5.827 1.00 0.00 C ATOM 1289 CG ASN A 112 -2.784 -8.736 -6.963 1.00 0.00 C ATOM 1290 OD1 ASN A 112 -3.077 -8.476 -8.125 1.00 0.00 O ATOM 1291 ND2 ASN A 112 -2.008 -9.769 -6.677 1.00 0.00 N ATOM 0 H ASN A 112 -1.282 -8.114 -4.362 1.00 0.00 H new ATOM 0 HA ASN A 112 -2.061 -6.191 -6.380 1.00 0.00 H new ATOM 0 HB2 ASN A 112 -3.455 -8.477 -4.945 1.00 0.00 H new ATOM 0 HB3 ASN A 112 -4.262 -7.443 -6.107 1.00 0.00 H new ATOM 0 HD21 ASN A 112 -1.647 -10.359 -7.427 1.00 0.00 H new ATOM 0 HD22 ASN A 112 -1.771 -9.976 -5.707 1.00 0.00 H new ATOM 1298 N LEU A 113 -3.667 -4.711 -5.050 1.00 0.00 N ATOM 1299 CA LEU A 113 -4.339 -3.630 -4.355 1.00 0.00 C ATOM 1300 C LEU A 113 -5.488 -3.187 -5.259 1.00 0.00 C ATOM 1301 O LEU A 113 -5.358 -3.240 -6.483 1.00 0.00 O ATOM 1302 CB LEU A 113 -3.380 -2.441 -4.186 1.00 0.00 C ATOM 1303 CG LEU A 113 -2.045 -2.729 -3.475 1.00 0.00 C ATOM 1304 CD1 LEU A 113 -1.056 -1.609 -3.821 1.00 0.00 C ATOM 1305 CD2 LEU A 113 -2.265 -2.880 -1.968 1.00 0.00 C ATOM 0 H LEU A 113 -3.709 -4.595 -6.062 1.00 0.00 H new ATOM 0 HA LEU A 113 -4.682 -3.955 -3.373 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -3.160 -2.038 -5.174 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -3.900 -1.660 -3.631 1.00 0.00 H new ATOM 0 HG LEU A 113 -1.623 -3.674 -3.818 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -0.104 -1.798 -3.325 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -0.903 -1.579 -4.900 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -1.457 -0.653 -3.485 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -1.312 -3.083 -1.480 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -2.688 -1.959 -1.568 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -2.952 -3.706 -1.781 1.00 0.00 H new ATOM 1317 N THR A 114 -6.557 -2.651 -4.683 1.00 0.00 N ATOM 1318 CA THR A 114 -7.722 -2.169 -5.419 1.00 0.00 C ATOM 1319 C THR A 114 -8.234 -0.927 -4.693 1.00 0.00 C ATOM 1320 O THR A 114 -8.236 -0.930 -3.461 1.00 0.00 O ATOM 1321 CB THR A 114 -8.776 -3.279 -5.435 1.00 0.00 C ATOM 1322 OG1 THR A 114 -8.237 -4.480 -5.977 1.00 0.00 O ATOM 1323 CG2 THR A 114 -10.034 -2.894 -6.209 1.00 0.00 C ATOM 0 H THR A 114 -6.641 -2.536 -3.673 1.00 0.00 H new ATOM 0 HA THR A 114 -7.482 -1.911 -6.451 1.00 0.00 H new ATOM 0 HB THR A 114 -9.064 -3.437 -4.396 1.00 0.00 H new ATOM 0 HG1 THR A 114 -8.926 -5.177 -5.977 1.00 0.00 H new ATOM 0 HG21 THR A 114 -10.744 -3.721 -6.185 1.00 0.00 H new ATOM 0 HG22 THR A 114 -10.487 -2.014 -5.753 1.00 0.00 H new ATOM 0 HG23 THR A 114 -9.771 -2.672 -7.243 1.00 0.00 H new ATOM 1331 N ILE A 115 -8.629 0.125 -5.417 1.00 0.00 N ATOM 1332 CA ILE A 115 -9.127 1.388 -4.870 1.00 0.00 C ATOM 1333 C ILE A 115 -10.234 1.939 -5.781 1.00 0.00 C ATOM 1334 O ILE A 115 -9.995 2.093 -6.981 1.00 0.00 O ATOM 1335 CB ILE A 115 -7.964 2.400 -4.726 1.00 0.00 C ATOM 1336 CG1 ILE A 115 -6.954 1.876 -3.679 1.00 0.00 C ATOM 1337 CG2 ILE A 115 -8.470 3.804 -4.332 1.00 0.00 C ATOM 1338 CD1 ILE A 115 -5.794 2.823 -3.400 1.00 0.00 C ATOM 0 H ILE A 115 -8.609 0.119 -6.437 1.00 0.00 H new ATOM 0 HA ILE A 115 -9.547 1.218 -3.879 1.00 0.00 H new ATOM 0 HB ILE A 115 -7.473 2.496 -5.694 1.00 0.00 H new ATOM 0 HG12 ILE A 115 -7.483 1.683 -2.746 1.00 0.00 H new ATOM 0 HG13 ILE A 115 -6.554 0.922 -4.022 1.00 0.00 H new ATOM 0 HG21 ILE A 115 -7.623 4.484 -4.241 1.00 0.00 H new ATOM 0 HG22 ILE A 115 -9.151 4.174 -5.098 1.00 0.00 H new ATOM 0 HG23 ILE A 115 -8.994 3.747 -3.378 1.00 0.00 H new ATOM 0 HD11 ILE A 115 -5.133 2.380 -2.655 1.00 0.00 H new ATOM 0 HD12 ILE A 115 -5.237 2.998 -4.321 1.00 0.00 H new ATOM 0 HD13 ILE A 115 -6.180 3.771 -3.024 1.00 0.00 H new ATOM 1350 N PRO A 116 -11.405 2.307 -5.230 1.00 0.00 N ATOM 1351 CA PRO A 116 -12.456 2.940 -5.999 1.00 0.00 C ATOM 1352 C PRO A 116 -12.151 4.399 -6.326 1.00 0.00 C ATOM 1353 O PRO A 116 -11.491 5.129 -5.584 1.00 0.00 O ATOM 1354 CB PRO A 116 -13.735 2.808 -5.176 1.00 0.00 C ATOM 1355 CG PRO A 116 -13.267 2.544 -3.751 1.00 0.00 C ATOM 1356 CD PRO A 116 -11.816 2.100 -3.854 1.00 0.00 C ATOM 0 HA PRO A 116 -12.556 2.450 -6.968 1.00 0.00 H new ATOM 0 HB2 PRO A 116 -14.335 3.717 -5.232 1.00 0.00 H new ATOM 0 HB3 PRO A 116 -14.357 1.992 -5.544 1.00 0.00 H new ATOM 0 HG2 PRO A 116 -13.356 3.442 -3.140 1.00 0.00 H new ATOM 0 HG3 PRO A 116 -13.877 1.774 -3.278 1.00 0.00 H new ATOM 0 HD2 PRO A 116 -11.188 2.675 -3.173 1.00 0.00 H new ATOM 0 HD3 PRO A 116 -11.713 1.052 -3.574 1.00 0.00 H new ATOM 1364 N GLN A 117 -12.767 4.853 -7.413 1.00 0.00 N ATOM 1365 CA GLN A 117 -12.563 6.133 -8.082 1.00 0.00 C ATOM 1366 C GLN A 117 -13.036 7.297 -7.220 1.00 0.00 C ATOM 1367 O GLN A 117 -12.725 8.453 -7.502 1.00 0.00 O ATOM 1368 CB GLN A 117 -13.348 6.127 -9.407 1.00 0.00 C ATOM 1369 CG GLN A 117 -12.778 5.129 -10.419 1.00 0.00 C ATOM 1370 CD GLN A 117 -12.879 3.677 -9.955 1.00 0.00 C ATOM 1371 OE1 GLN A 117 -13.968 3.193 -9.650 1.00 0.00 O ATOM 1372 NE2 GLN A 117 -11.748 3.045 -9.687 1.00 0.00 N ATOM 0 H GLN A 117 -13.476 4.292 -7.885 1.00 0.00 H new ATOM 0 HA GLN A 117 -11.496 6.264 -8.264 1.00 0.00 H new ATOM 0 HB2 GLN A 117 -14.391 5.882 -9.207 1.00 0.00 H new ATOM 0 HB3 GLN A 117 -13.333 7.127 -9.840 1.00 0.00 H new ATOM 0 HG2 GLN A 117 -13.307 5.239 -11.365 1.00 0.00 H new ATOM 0 HG3 GLN A 117 -11.732 5.371 -10.609 1.00 0.00 H new ATOM 0 HE21 GLN A 117 -10.855 3.464 -9.948 1.00 0.00 H new ATOM 0 HE22 GLN A 117 -11.769 2.139 -9.219 1.00 0.00 H new ATOM 1381 N ALA A 118 -13.817 6.988 -6.191 1.00 0.00 N ATOM 1382 CA ALA A 118 -14.221 7.900 -5.133 1.00 0.00 C ATOM 1383 C ALA A 118 -13.013 8.461 -4.375 1.00 0.00 C ATOM 1384 O ALA A 118 -13.116 9.541 -3.799 1.00 0.00 O ATOM 1385 CB ALA A 118 -15.154 7.164 -4.164 1.00 0.00 C ATOM 0 H ALA A 118 -14.202 6.052 -6.068 1.00 0.00 H new ATOM 0 HA ALA A 118 -14.742 8.743 -5.587 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -15.461 7.843 -3.368 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -16.035 6.814 -4.702 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -14.630 6.311 -3.732 1.00 0.00 H new ATOM 1391 N PHE A 119 -11.879 7.750 -4.349 1.00 0.00 N ATOM 1392 CA PHE A 119 -10.718 8.124 -3.557 1.00 0.00 C ATOM 1393 C PHE A 119 -9.419 7.842 -4.321 1.00 0.00 C ATOM 1394 O PHE A 119 -8.489 7.296 -3.745 1.00 0.00 O ATOM 1395 CB PHE A 119 -10.715 7.398 -2.199 1.00 0.00 C ATOM 1396 CG PHE A 119 -12.029 7.298 -1.451 1.00 0.00 C ATOM 1397 CD1 PHE A 119 -12.445 8.271 -0.528 1.00 0.00 C ATOM 1398 CD2 PHE A 119 -12.800 6.145 -1.613 1.00 0.00 C ATOM 1399 CE1 PHE A 119 -13.618 8.097 0.229 1.00 0.00 C ATOM 1400 CE2 PHE A 119 -13.937 5.932 -0.820 1.00 0.00 C ATOM 1401 CZ PHE A 119 -14.365 6.917 0.085 1.00 0.00 C ATOM 0 H PHE A 119 -11.748 6.892 -4.885 1.00 0.00 H new ATOM 0 HA PHE A 119 -10.778 9.196 -3.368 1.00 0.00 H new ATOM 0 HB2 PHE A 119 -10.343 6.386 -2.360 1.00 0.00 H new ATOM 0 HB3 PHE A 119 -9.998 7.902 -1.551 1.00 0.00 H new ATOM 0 HD1 PHE A 119 -11.856 9.166 -0.397 1.00 0.00 H new ATOM 0 HD2 PHE A 119 -12.519 5.412 -2.354 1.00 0.00 H new ATOM 0 HE1 PHE A 119 -13.941 8.865 0.916 1.00 0.00 H new ATOM 0 HE2 PHE A 119 -14.486 5.006 -0.906 1.00 0.00 H new ATOM 0 HZ PHE A 119 -15.263 6.768 0.666 1.00 0.00 H new ATOM 1411 N MET A 120 -9.276 8.201 -5.592 1.00 0.00 N ATOM 1412 CA MET A 120 -8.046 7.919 -6.340 1.00 0.00 C ATOM 1413 C MET A 120 -7.660 9.165 -7.118 1.00 0.00 C ATOM 1414 O MET A 120 -8.253 9.445 -8.167 1.00 0.00 O ATOM 1415 CB MET A 120 -8.246 6.734 -7.283 1.00 0.00 C ATOM 1416 CG MET A 120 -7.008 6.418 -8.125 1.00 0.00 C ATOM 1417 SD MET A 120 -6.901 4.701 -8.674 1.00 0.00 S ATOM 1418 CE MET A 120 -5.363 4.805 -9.618 1.00 0.00 C ATOM 0 H MET A 120 -9.993 8.688 -6.130 1.00 0.00 H new ATOM 0 HA MET A 120 -7.247 7.654 -5.648 1.00 0.00 H new ATOM 0 HB2 MET A 120 -8.514 5.854 -6.698 1.00 0.00 H new ATOM 0 HB3 MET A 120 -9.085 6.944 -7.947 1.00 0.00 H new ATOM 0 HG2 MET A 120 -7.003 7.068 -9.000 1.00 0.00 H new ATOM 0 HG3 MET A 120 -6.117 6.658 -7.544 1.00 0.00 H new ATOM 0 HE1 MET A 120 -5.339 4.011 -10.364 1.00 0.00 H new ATOM 0 HE2 MET A 120 -5.307 5.773 -10.117 1.00 0.00 H new ATOM 0 HE3 MET A 120 -4.514 4.695 -8.943 1.00 0.00 H new ATOM 1428 N SER A 121 -6.688 9.908 -6.594 1.00 0.00 N ATOM 1429 CA SER A 121 -6.003 10.978 -7.297 1.00 0.00 C ATOM 1430 C SER A 121 -4.552 11.120 -6.813 1.00 0.00 C ATOM 1431 O SER A 121 -4.245 10.852 -5.649 1.00 0.00 O ATOM 1432 CB SER A 121 -6.708 12.338 -7.190 1.00 0.00 C ATOM 1433 OG SER A 121 -8.043 12.265 -7.655 1.00 0.00 O ATOM 0 H SER A 121 -6.349 9.775 -5.641 1.00 0.00 H new ATOM 0 HA SER A 121 -6.020 10.687 -8.347 1.00 0.00 H new ATOM 0 HB2 SER A 121 -6.700 12.673 -6.153 1.00 0.00 H new ATOM 0 HB3 SER A 121 -6.159 13.081 -7.769 1.00 0.00 H new ATOM 0 HG SER A 121 -8.217 11.368 -8.010 1.00 0.00 H new ATOM 1439 N ASN A 122 -3.689 11.636 -7.694 1.00 0.00 N ATOM 1440 CA ASN A 122 -2.228 11.722 -7.591 1.00 0.00 C ATOM 1441 C ASN A 122 -1.793 12.503 -6.343 1.00 0.00 C ATOM 1442 O ASN A 122 -1.192 11.934 -5.438 1.00 0.00 O ATOM 1443 CB ASN A 122 -1.628 12.361 -8.868 1.00 0.00 C ATOM 1444 CG ASN A 122 -2.179 11.822 -10.187 1.00 0.00 C ATOM 1445 OD1 ASN A 122 -3.389 11.844 -10.400 1.00 0.00 O ATOM 1446 ND2 ASN A 122 -1.334 11.374 -11.095 1.00 0.00 N ATOM 0 H ASN A 122 -4.022 12.038 -8.570 1.00 0.00 H new ATOM 0 HA ASN A 122 -1.845 10.706 -7.495 1.00 0.00 H new ATOM 0 HB2 ASN A 122 -1.802 13.436 -8.833 1.00 0.00 H new ATOM 0 HB3 ASN A 122 -0.548 12.212 -8.856 1.00 0.00 H new ATOM 0 HD21 ASN A 122 -1.681 11.038 -11.993 1.00 0.00 H new ATOM 0 HD22 ASN A 122 -0.333 11.364 -10.899 1.00 0.00 H new ATOM 1453 N ARG A 123 -2.149 13.792 -6.283 1.00 0.00 N ATOM 1454 CA ARG A 123 -1.892 14.842 -5.282 1.00 0.00 C ATOM 1455 C ARG A 123 -1.595 14.395 -3.840 1.00 0.00 C ATOM 1456 O ARG A 123 -2.485 14.554 -3.002 1.00 0.00 O ATOM 1457 CB ARG A 123 -3.098 15.826 -5.350 1.00 0.00 C ATOM 1458 CG ARG A 123 -4.521 15.209 -5.280 1.00 0.00 C ATOM 1459 CD ARG A 123 -5.571 16.048 -6.026 1.00 0.00 C ATOM 1460 NE ARG A 123 -5.906 17.293 -5.320 1.00 0.00 N ATOM 1461 CZ ARG A 123 -6.560 18.351 -5.809 1.00 0.00 C ATOM 1462 NH1 ARG A 123 -6.975 18.367 -7.072 1.00 0.00 N ATOM 1463 NH2 ARG A 123 -6.789 19.392 -5.017 1.00 0.00 N ATOM 0 H ARG A 123 -2.705 14.180 -7.046 1.00 0.00 H new ATOM 0 HA ARG A 123 -0.944 15.308 -5.551 1.00 0.00 H new ATOM 0 HB2 ARG A 123 -2.998 16.540 -4.532 1.00 0.00 H new ATOM 0 HB3 ARG A 123 -3.020 16.392 -6.278 1.00 0.00 H new ATOM 0 HG2 ARG A 123 -4.498 14.205 -5.703 1.00 0.00 H new ATOM 0 HG3 ARG A 123 -4.818 15.109 -4.236 1.00 0.00 H new ATOM 0 HD2 ARG A 123 -5.198 16.288 -7.022 1.00 0.00 H new ATOM 0 HD3 ARG A 123 -6.476 15.456 -6.159 1.00 0.00 H new ATOM 0 HE ARG A 123 -5.605 17.357 -4.347 1.00 0.00 H new ATOM 0 HH11 ARG A 123 -6.795 17.567 -7.678 1.00 0.00 H new ATOM 0 HH12 ARG A 123 -7.473 19.180 -7.435 1.00 0.00 H new ATOM 0 HH21 ARG A 123 -6.467 19.377 -4.049 1.00 0.00 H new ATOM 0 HH22 ARG A 123 -7.287 20.206 -5.376 1.00 0.00 H new ATOM 1477 N ALA A 124 -0.393 13.902 -3.487 1.00 0.00 N ATOM 1478 CA ALA A 124 -0.169 13.341 -2.148 1.00 0.00 C ATOM 1479 C ALA A 124 0.021 14.431 -1.084 1.00 0.00 C ATOM 1480 O ALA A 124 0.233 15.611 -1.377 1.00 0.00 O ATOM 1481 CB ALA A 124 1.039 12.386 -2.151 1.00 0.00 C ATOM 0 H ALA A 124 0.422 13.882 -4.100 1.00 0.00 H new ATOM 0 HA ALA A 124 -1.067 12.781 -1.886 1.00 0.00 H new ATOM 0 HB1 ALA A 124 1.186 11.982 -1.149 1.00 0.00 H new ATOM 0 HB2 ALA A 124 0.855 11.569 -2.848 1.00 0.00 H new ATOM 0 HB3 ALA A 124 1.932 12.930 -2.458 1.00 0.00 H new ATOM 1487 N ARG A 125 0.035 14.004 0.181 1.00 0.00 N ATOM 1488 CA ARG A 125 0.417 14.791 1.349 1.00 0.00 C ATOM 1489 C ARG A 125 1.620 14.084 1.936 1.00 0.00 C ATOM 1490 O ARG A 125 1.474 12.959 2.409 1.00 0.00 O ATOM 1491 CB ARG A 125 -0.753 14.875 2.347 1.00 0.00 C ATOM 1492 CG ARG A 125 -1.599 16.126 2.085 1.00 0.00 C ATOM 1493 CD ARG A 125 -0.984 17.329 2.793 1.00 0.00 C ATOM 1494 NE ARG A 125 -1.552 18.596 2.324 1.00 0.00 N ATOM 1495 CZ ARG A 125 -1.389 19.773 2.935 1.00 0.00 C ATOM 1496 NH1 ARG A 125 -0.721 19.842 4.080 1.00 0.00 N ATOM 1497 NH2 ARG A 125 -1.873 20.876 2.374 1.00 0.00 N ATOM 0 H ARG A 125 -0.234 13.051 0.427 1.00 0.00 H new ATOM 0 HA ARG A 125 0.663 15.822 1.094 1.00 0.00 H new ATOM 0 HB2 ARG A 125 -1.375 13.984 2.261 1.00 0.00 H new ATOM 0 HB3 ARG A 125 -0.367 14.897 3.366 1.00 0.00 H new ATOM 0 HG2 ARG A 125 -1.660 16.316 1.013 1.00 0.00 H new ATOM 0 HG3 ARG A 125 -2.618 15.967 2.439 1.00 0.00 H new ATOM 0 HD2 ARG A 125 -1.143 17.237 3.867 1.00 0.00 H new ATOM 0 HD3 ARG A 125 0.094 17.333 2.630 1.00 0.00 H new ATOM 0 HE ARG A 125 -2.111 18.578 1.471 1.00 0.00 H new ATOM 0 HH11 ARG A 125 -0.331 18.996 4.495 1.00 0.00 H new ATOM 0 HH12 ARG A 125 -0.598 20.741 4.545 1.00 0.00 H new ATOM 0 HH21 ARG A 125 -2.365 20.821 1.482 1.00 0.00 H new ATOM 0 HH22 ARG A 125 -1.752 21.778 2.835 1.00 0.00 H new ATOM 1511 N GLY A 126 2.789 14.707 1.848 1.00 0.00 N ATOM 1512 CA GLY A 126 4.038 14.008 2.051 1.00 0.00 C ATOM 1513 C GLY A 126 4.396 13.311 0.758 1.00 0.00 C ATOM 1514 O GLY A 126 4.143 12.120 0.605 1.00 0.00 O ATOM 0 H GLY A 126 2.891 15.700 1.636 1.00 0.00 H new ATOM 0 HA2 GLY A 126 4.824 14.707 2.338 1.00 0.00 H new ATOM 0 HA3 GLY A 126 3.943 13.285 2.861 1.00 0.00 H new ATOM 1518 N TYR A 127 4.981 14.054 -0.181 1.00 0.00 N ATOM 1519 CA TYR A 127 5.826 13.426 -1.179 1.00 0.00 C ATOM 1520 C TYR A 127 7.010 12.847 -0.418 1.00 0.00 C ATOM 1521 O TYR A 127 7.815 13.605 0.131 1.00 0.00 O ATOM 1522 CB TYR A 127 6.291 14.441 -2.250 1.00 0.00 C ATOM 1523 CG TYR A 127 7.619 14.167 -2.960 1.00 0.00 C ATOM 1524 CD1 TYR A 127 8.095 12.860 -3.184 1.00 0.00 C ATOM 1525 CD2 TYR A 127 8.410 15.254 -3.380 1.00 0.00 C ATOM 1526 CE1 TYR A 127 9.346 12.636 -3.775 1.00 0.00 C ATOM 1527 CE2 TYR A 127 9.634 15.041 -4.040 1.00 0.00 C ATOM 1528 CZ TYR A 127 10.105 13.727 -4.247 1.00 0.00 C ATOM 1529 OH TYR A 127 11.267 13.524 -4.920 1.00 0.00 O ATOM 0 H TYR A 127 4.886 15.066 -0.267 1.00 0.00 H new ATOM 0 HA TYR A 127 5.284 12.651 -1.721 1.00 0.00 H new ATOM 0 HB2 TYR A 127 5.512 14.508 -3.010 1.00 0.00 H new ATOM 0 HB3 TYR A 127 6.359 15.420 -1.777 1.00 0.00 H new ATOM 0 HD1 TYR A 127 7.486 12.016 -2.895 1.00 0.00 H new ATOM 0 HD2 TYR A 127 8.073 16.263 -3.193 1.00 0.00 H new ATOM 0 HE1 TYR A 127 9.728 11.630 -3.869 1.00 0.00 H new ATOM 0 HE2 TYR A 127 10.213 15.883 -4.388 1.00 0.00 H new ATOM 0 HH TYR A 127 11.655 14.388 -5.171 1.00 0.00 H new ATOM 1539 N ILE A 128 7.117 11.521 -0.394 1.00 0.00 N ATOM 1540 CA ILE A 128 8.254 10.810 0.165 1.00 0.00 C ATOM 1541 C ILE A 128 8.637 9.752 -0.861 1.00 0.00 C ATOM 1542 O ILE A 128 7.786 8.960 -1.264 1.00 0.00 O ATOM 1543 CB ILE A 128 7.905 10.249 1.555 1.00 0.00 C ATOM 1544 CG1 ILE A 128 7.639 11.425 2.514 1.00 0.00 C ATOM 1545 CG2 ILE A 128 8.929 9.247 2.121 1.00 0.00 C ATOM 1546 CD1 ILE A 128 8.874 12.243 2.920 1.00 0.00 C ATOM 0 H ILE A 128 6.399 10.902 -0.771 1.00 0.00 H new ATOM 0 HA ILE A 128 9.114 11.457 0.341 1.00 0.00 H new ATOM 0 HB ILE A 128 7.002 9.649 1.446 1.00 0.00 H new ATOM 0 HG12 ILE A 128 6.919 12.096 2.046 1.00 0.00 H new ATOM 0 HG13 ILE A 128 7.171 11.035 3.418 1.00 0.00 H new ATOM 0 HG21 ILE A 128 8.600 8.906 3.102 1.00 0.00 H new ATOM 0 HG22 ILE A 128 9.012 8.393 1.449 1.00 0.00 H new ATOM 0 HG23 ILE A 128 9.901 9.732 2.213 1.00 0.00 H new ATOM 0 HD11 ILE A 128 8.574 13.044 3.595 1.00 0.00 H new ATOM 0 HD12 ILE A 128 9.591 11.594 3.423 1.00 0.00 H new ATOM 0 HD13 ILE A 128 9.335 12.672 2.030 1.00 0.00 H new ATOM 1558 N PRO A 129 9.880 9.769 -1.356 1.00 0.00 N ATOM 1559 CA PRO A 129 10.311 8.805 -2.338 1.00 0.00 C ATOM 1560 C PRO A 129 10.519 7.452 -1.656 1.00 0.00 C ATOM 1561 O PRO A 129 10.760 7.383 -0.445 1.00 0.00 O ATOM 1562 CB PRO A 129 11.600 9.386 -2.916 1.00 0.00 C ATOM 1563 CG PRO A 129 12.187 10.205 -1.765 1.00 0.00 C ATOM 1564 CD PRO A 129 11.001 10.541 -0.861 1.00 0.00 C ATOM 0 HA PRO A 129 9.587 8.630 -3.134 1.00 0.00 H new ATOM 0 HB2 PRO A 129 12.284 8.600 -3.235 1.00 0.00 H new ATOM 0 HB3 PRO A 129 11.401 10.009 -3.788 1.00 0.00 H new ATOM 0 HG2 PRO A 129 12.944 9.637 -1.225 1.00 0.00 H new ATOM 0 HG3 PRO A 129 12.670 11.110 -2.133 1.00 0.00 H new ATOM 0 HD2 PRO A 129 11.219 10.288 0.177 1.00 0.00 H new ATOM 0 HD3 PRO A 129 10.781 11.608 -0.889 1.00 0.00 H new ATOM 1572 N PRO A 130 10.551 6.362 -2.434 1.00 0.00 N ATOM 1573 CA PRO A 130 10.815 5.041 -1.890 1.00 0.00 C ATOM 1574 C PRO A 130 12.255 4.929 -1.356 1.00 0.00 C ATOM 1575 O PRO A 130 12.571 3.990 -0.631 1.00 0.00 O ATOM 1576 CB PRO A 130 10.510 4.089 -3.047 1.00 0.00 C ATOM 1577 CG PRO A 130 10.857 4.912 -4.286 1.00 0.00 C ATOM 1578 CD PRO A 130 10.449 6.327 -3.883 1.00 0.00 C ATOM 0 HA PRO A 130 10.201 4.804 -1.021 1.00 0.00 H new ATOM 0 HB2 PRO A 130 11.109 3.180 -2.988 1.00 0.00 H new ATOM 0 HB3 PRO A 130 9.464 3.782 -3.049 1.00 0.00 H new ATOM 0 HG2 PRO A 130 11.918 4.851 -4.527 1.00 0.00 H new ATOM 0 HG3 PRO A 130 10.311 4.569 -5.165 1.00 0.00 H new ATOM 0 HD2 PRO A 130 11.103 7.069 -4.341 1.00 0.00 H new ATOM 0 HD3 PRO A 130 9.434 6.551 -4.211 1.00 0.00 H new ATOM 1586 N GLU A 131 13.116 5.897 -1.670 1.00 0.00 N ATOM 1587 CA GLU A 131 14.483 5.992 -1.185 1.00 0.00 C ATOM 1588 C GLU A 131 14.577 6.404 0.292 1.00 0.00 C ATOM 1589 O GLU A 131 15.644 6.283 0.892 1.00 0.00 O ATOM 1590 CB GLU A 131 15.201 7.045 -2.041 1.00 0.00 C ATOM 1591 CG GLU A 131 16.657 6.648 -2.282 1.00 0.00 C ATOM 1592 CD GLU A 131 16.823 6.102 -3.701 1.00 0.00 C ATOM 1593 OE1 GLU A 131 17.306 6.853 -4.587 1.00 0.00 O ATOM 1594 OE2 GLU A 131 16.418 4.947 -3.982 1.00 0.00 O ATOM 0 H GLU A 131 12.865 6.664 -2.294 1.00 0.00 H new ATOM 0 HA GLU A 131 14.940 5.005 -1.263 1.00 0.00 H new ATOM 0 HB2 GLU A 131 14.687 7.156 -2.996 1.00 0.00 H new ATOM 0 HB3 GLU A 131 15.161 8.014 -1.543 1.00 0.00 H new ATOM 0 HG2 GLU A 131 17.306 7.511 -2.138 1.00 0.00 H new ATOM 0 HG3 GLU A 131 16.962 5.895 -1.556 1.00 0.00 H new ATOM 1602 N LEU A 132 13.487 6.934 0.867 1.00 0.00 N ATOM 1603 CA LEU A 132 13.455 7.385 2.261 1.00 0.00 C ATOM 1604 C LEU A 132 12.491 6.547 3.097 1.00 0.00 C ATOM 1605 O LEU A 132 12.534 6.593 4.323 1.00 0.00 O ATOM 1606 CB LEU A 132 13.011 8.851 2.368 1.00 0.00 C ATOM 1607 CG LEU A 132 13.902 9.891 1.671 1.00 0.00 C ATOM 1608 CD1 LEU A 132 13.308 11.285 1.905 1.00 0.00 C ATOM 1609 CD2 LEU A 132 15.362 9.846 2.120 1.00 0.00 C ATOM 0 H LEU A 132 12.603 7.061 0.375 1.00 0.00 H new ATOM 0 HA LEU A 132 14.471 7.274 2.639 1.00 0.00 H new ATOM 0 HB2 LEU A 132 12.005 8.933 1.957 1.00 0.00 H new ATOM 0 HB3 LEU A 132 12.946 9.111 3.424 1.00 0.00 H new ATOM 0 HG LEU A 132 13.916 9.651 0.608 1.00 0.00 H new ATOM 0 HD11 LEU A 132 13.931 12.033 1.415 1.00 0.00 H new ATOM 0 HD12 LEU A 132 12.300 11.325 1.491 1.00 0.00 H new ATOM 0 HD13 LEU A 132 13.269 11.489 2.975 1.00 0.00 H new ATOM 0 HD21 LEU A 132 15.930 10.608 1.586 1.00 0.00 H new ATOM 0 HD22 LEU A 132 15.419 10.035 3.192 1.00 0.00 H new ATOM 0 HD23 LEU A 132 15.779 8.863 1.903 1.00 0.00 H new ATOM 1621 N TRP A 133 11.605 5.783 2.458 1.00 0.00 N ATOM 1622 CA TRP A 133 10.743 4.819 3.135 1.00 0.00 C ATOM 1623 C TRP A 133 11.428 3.458 3.285 1.00 0.00 C ATOM 1624 O TRP A 133 10.807 2.557 3.846 1.00 0.00 O ATOM 1625 CB TRP A 133 9.369 4.774 2.429 1.00 0.00 C ATOM 1626 CG TRP A 133 8.986 3.517 1.704 1.00 0.00 C ATOM 1627 CD1 TRP A 133 9.726 2.882 0.771 1.00 0.00 C ATOM 1628 CD2 TRP A 133 7.813 2.679 1.907 1.00 0.00 C ATOM 1629 NE1 TRP A 133 9.106 1.712 0.388 1.00 0.00 N ATOM 1630 CE2 TRP A 133 7.930 1.528 1.075 1.00 0.00 C ATOM 1631 CE3 TRP A 133 6.672 2.769 2.732 1.00 0.00 C ATOM 1632 CZ2 TRP A 133 6.974 0.507 1.078 1.00 0.00 C ATOM 1633 CZ3 TRP A 133 5.696 1.754 2.716 1.00 0.00 C ATOM 1634 CH2 TRP A 133 5.848 0.622 1.900 1.00 0.00 C ATOM 0 H TRP A 133 11.466 5.817 1.448 1.00 0.00 H new ATOM 0 HA TRP A 133 10.558 5.140 4.160 1.00 0.00 H new ATOM 0 HB2 TRP A 133 8.603 4.973 3.178 1.00 0.00 H new ATOM 0 HB3 TRP A 133 9.335 5.595 1.713 1.00 0.00 H new ATOM 0 HD1 TRP A 133 10.668 3.239 0.381 1.00 0.00 H new ATOM 0 HE1 TRP A 133 9.472 1.068 -0.313 1.00 0.00 H new ATOM 0 HE3 TRP A 133 6.546 3.623 3.381 1.00 0.00 H new ATOM 0 HZ2 TRP A 133 7.104 -0.363 0.451 1.00 0.00 H new ATOM 0 HZ3 TRP A 133 4.819 1.848 3.340 1.00 0.00 H new ATOM 0 HH2 TRP A 133 5.099 -0.156 1.907 1.00 0.00 H new ATOM 1645 N ASP A 134 12.658 3.325 2.769 1.00 0.00 N ATOM 1646 CA ASP A 134 13.482 2.126 2.628 1.00 0.00 C ATOM 1647 C ASP A 134 13.234 1.115 3.754 1.00 0.00 C ATOM 1648 O ASP A 134 13.764 1.271 4.855 1.00 0.00 O ATOM 1649 CB ASP A 134 14.967 2.490 2.440 1.00 0.00 C ATOM 1650 CG ASP A 134 15.649 3.159 3.633 1.00 0.00 C ATOM 1651 OD1 ASP A 134 16.719 2.677 4.067 1.00 0.00 O ATOM 1652 OD2 ASP A 134 15.195 4.251 4.048 1.00 0.00 O ATOM 0 H ASP A 134 13.147 4.142 2.404 1.00 0.00 H new ATOM 0 HA ASP A 134 13.175 1.615 1.716 1.00 0.00 H new ATOM 0 HB2 ASP A 134 15.516 1.580 2.196 1.00 0.00 H new ATOM 0 HB3 ASP A 134 15.052 3.153 1.579 1.00 0.00 H new ATOM 1658 N PRO A 135 12.350 0.123 3.526 1.00 0.00 N ATOM 1659 CA PRO A 135 11.885 -0.742 4.594 1.00 0.00 C ATOM 1660 C PRO A 135 12.932 -1.834 4.852 1.00 0.00 C ATOM 1661 O PRO A 135 13.399 -1.999 5.980 1.00 0.00 O ATOM 1662 CB PRO A 135 10.527 -1.264 4.123 1.00 0.00 C ATOM 1663 CG PRO A 135 10.612 -1.238 2.605 1.00 0.00 C ATOM 1664 CD PRO A 135 11.578 -0.097 2.309 1.00 0.00 C ATOM 0 HA PRO A 135 11.759 -0.241 5.554 1.00 0.00 H new ATOM 0 HB2 PRO A 135 10.340 -2.272 4.492 1.00 0.00 H new ATOM 0 HB3 PRO A 135 9.713 -0.636 4.485 1.00 0.00 H new ATOM 0 HG2 PRO A 135 10.980 -2.185 2.210 1.00 0.00 H new ATOM 0 HG3 PRO A 135 9.636 -1.062 2.154 1.00 0.00 H new ATOM 0 HD2 PRO A 135 12.233 -0.351 1.475 1.00 0.00 H new ATOM 0 HD3 PRO A 135 11.036 0.805 2.026 1.00 0.00 H new ATOM 1672 N GLY A 136 13.380 -2.541 3.809 1.00 0.00 N ATOM 1673 CA GLY A 136 14.603 -3.329 3.868 1.00 0.00 C ATOM 1674 C GLY A 136 15.040 -3.646 2.454 1.00 0.00 C ATOM 1675 O GLY A 136 14.845 -4.763 1.989 1.00 0.00 O ATOM 0 H GLY A 136 12.904 -2.579 2.908 1.00 0.00 H new ATOM 0 HA2 GLY A 136 15.384 -2.777 4.391 1.00 0.00 H new ATOM 0 HA3 GLY A 136 14.434 -4.249 4.427 1.00 0.00 H new ATOM 1679 N ILE A 137 15.553 -2.660 1.716 1.00 0.00 N ATOM 1680 CA ILE A 137 15.883 -2.834 0.306 1.00 0.00 C ATOM 1681 C ILE A 137 17.138 -3.710 0.213 1.00 0.00 C ATOM 1682 O ILE A 137 18.250 -3.188 0.110 1.00 0.00 O ATOM 1683 CB ILE A 137 16.087 -1.480 -0.418 1.00 0.00 C ATOM 1684 CG1 ILE A 137 14.982 -0.432 -0.171 1.00 0.00 C ATOM 1685 CG2 ILE A 137 16.203 -1.775 -1.922 1.00 0.00 C ATOM 1686 CD1 ILE A 137 15.455 0.969 -0.581 1.00 0.00 C ATOM 0 H ILE A 137 15.749 -1.727 2.078 1.00 0.00 H new ATOM 0 HA ILE A 137 15.049 -3.320 -0.199 1.00 0.00 H new ATOM 0 HB ILE A 137 16.990 -1.028 -0.008 1.00 0.00 H new ATOM 0 HG12 ILE A 137 14.089 -0.699 -0.736 1.00 0.00 H new ATOM 0 HG13 ILE A 137 14.704 -0.432 0.883 1.00 0.00 H new ATOM 0 HG21 ILE A 137 16.348 -0.841 -2.466 1.00 0.00 H new ATOM 0 HG22 ILE A 137 17.053 -2.434 -2.099 1.00 0.00 H new ATOM 0 HG23 ILE A 137 15.290 -2.259 -2.269 1.00 0.00 H new ATOM 0 HD11 ILE A 137 14.659 1.690 -0.397 1.00 0.00 H new ATOM 0 HD12 ILE A 137 16.334 1.242 0.004 1.00 0.00 H new ATOM 0 HD13 ILE A 137 15.709 0.971 -1.641 1.00 0.00 H new ATOM 1698 N ASN A 138 16.969 -5.032 0.195 1.00 0.00 N ATOM 1699 CA ASN A 138 18.055 -6.010 0.214 1.00 0.00 C ATOM 1700 C ASN A 138 19.112 -5.597 1.250 1.00 0.00 C ATOM 1701 O ASN A 138 20.294 -5.409 0.938 1.00 0.00 O ATOM 1702 CB ASN A 138 18.599 -6.245 -1.211 1.00 0.00 C ATOM 1703 CG ASN A 138 18.179 -7.586 -1.768 1.00 0.00 C ATOM 1704 OD1 ASN A 138 17.152 -7.685 -2.442 1.00 0.00 O ATOM 1705 ND2 ASN A 138 18.927 -8.634 -1.493 1.00 0.00 N ATOM 0 H ASN A 138 16.045 -5.464 0.166 1.00 0.00 H new ATOM 0 HA ASN A 138 17.687 -6.983 0.539 1.00 0.00 H new ATOM 0 HB2 ASN A 138 18.243 -5.452 -1.869 1.00 0.00 H new ATOM 0 HB3 ASN A 138 19.687 -6.184 -1.197 1.00 0.00 H new ATOM 0 HD21 ASN A 138 18.661 -9.556 -1.840 1.00 0.00 H new ATOM 0 HD22 ASN A 138 19.772 -8.524 -0.933 1.00 0.00 H new ATOM 1712 N ALA A 139 18.669 -5.354 2.483 1.00 0.00 N ATOM 1713 CA ALA A 139 19.454 -4.711 3.525 1.00 0.00 C ATOM 1714 C ALA A 139 19.486 -5.648 4.714 1.00 0.00 C ATOM 1715 O ALA A 139 18.813 -5.386 5.734 1.00 0.00 O ATOM 1716 CB ALA A 139 18.853 -3.332 3.818 1.00 0.00 C ATOM 0 H ALA A 139 17.729 -5.607 2.788 1.00 0.00 H new ATOM 0 HA ALA A 139 20.487 -4.528 3.230 1.00 0.00 H new ATOM 0 HB1 ALA A 139 19.434 -2.840 4.598 1.00 0.00 H new ATOM 0 HB2 ALA A 139 18.875 -2.726 2.913 1.00 0.00 H new ATOM 0 HB3 ALA A 139 17.822 -3.448 4.152 1.00 0.00 H new TER 1722 ALA A 139