USER MOD reduce.3.24.130724 H: found=0, std=0, add=1081, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1083 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 33 ASN : amide:sc= -0.313 K(o=-0.31,f=-1.2) USER MOD Set 1.2: A 99 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 34 SER OG : rot -11:sc= 0.601 USER MOD Set 2.2: A 35 HIS : no HD1:sc= -1.51 K(o=-0.91,f=-0.23) USER MOD Single : A 3 THR OG1 : rot 180:sc= -0.0856 USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 8 ASN : amide:sc= -4.55! C(o=-4.6!,f=-6.8!) USER MOD Single : A 10 GLN : amide:sc= -1.04 K(o=-1,f=-2.8!) USER MOD Single : A 11 LYS NZ :NH3+ 164:sc= 0.0943 (180deg=0.0308) USER MOD Single : A 12 ASN : amide:sc= -0.46 X(o=-0.46,f=0) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 THR OG1 : rot 180:sc= -0.391 USER MOD Single : A 16 ASN : amide:sc=-0.00688 X(o=-0.0069,f=-0.1) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 TYR OH : rot 180:sc= -0.229 USER MOD Single : A 20 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 TYR OH : rot 165:sc= -0.592 USER MOD Single : A 26 ASN : amide:sc= -0.0017 X(o=-0.0017,f=-0.013) USER MOD Single : A 27 GLN : amide:sc= -0.391 K(o=-0.39,f=-2.2) USER MOD Single : A 28 ASN : amide:sc= -0.222 K(o=-0.22,f=-0.88!) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 36 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 THR OG1 : rot 145:sc= 0.795 USER MOD Single : A 46 SER OG : rot -59:sc= -1.96! USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 48 TYR OH : rot 0:sc= 0 USER MOD Single : A 50 HIS : no HE2:sc= -3.7 X(o=-3.7,f=-3.7!) USER MOD Single : A 53 THR OG1 : rot 180:sc= -0.0228 USER MOD Single : A 54 ASN : amide:sc= -1.68 K(o=-1.7,f=-7!) USER MOD Single : A 56 TYR OH : rot 70:sc= 0.135 USER MOD Single : A 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 HIS : no HD1:sc= -0.314 K(o=-0.31,f=-4.2!) USER MOD Single : A 83 SER OG : rot 180:sc= 0.248 USER MOD Single : A 84 LYS NZ :NH3+ 152:sc= -0.0449 (180deg=-0.426) USER MOD Single : A 87 ASN : amide:sc= -1.74 K(o=-1.7,f=-0.92) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 HIS : no HD1:sc= -1.1 K(o=-1.1,f=-1.8) USER MOD Single : A 93 TYR OH : rot -43:sc= 0.696 USER MOD Single : A 104 HIS : no HD1:sc= -1.76 K(o=-1.8,f=-4.7) USER MOD Single : A 106 TYR OH : rot 52:sc= -2.34 USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 ASN : amide:sc= -1.42 X(o=-1.4,f=-1.3) USER MOD Single : A 124 TYR OH : rot 180:sc= 0 USER MOD Single : A 125 THR OG1 : rot 180:sc= 0.171 USER MOD Single : A 126 TYR OH : rot 180:sc= 0 USER MOD Single : A 128 ASN : amide:sc= -1.03 K(o=-1,f=-4.1!) USER MOD Single : A 129 LYS NZ :NH3+ -147:sc= -1.18 (180deg=-3.16!) USER MOD Single : A 137 HIS : no HE2:sc= -0.208 K(o=-0.21,f=-5.5!) USER MOD Single : A 138 THR OG1 : rot 180:sc= 0.0853 USER MOD Single : A 139 LYS NZ :NH3+ 138:sc= 0.0771 (180deg=0) USER MOD Single : A 141 ASN : amide:sc= -1.54 K(o=-1.5,f=-2.8!) USER MOD Single : A 142 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 146 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 149 SER OG : rot 180:sc= 0 USER MOD Single : A 150 HIS : no HD1:sc= -3.27 X(o=-3.3,f=-2.8!) USER MOD ----------------------------------------------------------------- ATOM 11 N VAL A 2 3.514 -9.057 -15.643 1.00 0.00 N ATOM 12 CA VAL A 2 3.617 -9.700 -14.324 1.00 0.00 C ATOM 13 C VAL A 2 2.250 -9.571 -13.614 1.00 0.00 C ATOM 14 O VAL A 2 1.889 -8.523 -13.095 1.00 0.00 O ATOM 15 CB VAL A 2 4.761 -9.025 -13.540 1.00 0.00 C ATOM 16 CG1 VAL A 2 5.103 -9.837 -12.325 1.00 0.00 C ATOM 17 CG2 VAL A 2 6.122 -8.892 -14.227 1.00 0.00 C ATOM 0 HA VAL A 2 3.853 -10.761 -14.403 1.00 0.00 H new ATOM 0 HB VAL A 2 4.343 -8.032 -13.376 1.00 0.00 H new ATOM 0 HG11 VAL A 2 5.912 -9.352 -11.779 1.00 0.00 H new ATOM 0 HG12 VAL A 2 4.227 -9.916 -11.682 1.00 0.00 H new ATOM 0 HG13 VAL A 2 5.419 -10.834 -12.631 1.00 0.00 H new ATOM 0 HG21 VAL A 2 6.823 -8.399 -13.554 1.00 0.00 H new ATOM 0 HG22 VAL A 2 6.499 -9.882 -14.481 1.00 0.00 H new ATOM 0 HG23 VAL A 2 6.014 -8.300 -15.136 1.00 0.00 H new ATOM 27 N THR A 3 1.429 -10.595 -13.779 1.00 0.00 N ATOM 28 CA THR A 3 0.091 -10.658 -13.175 1.00 0.00 C ATOM 29 C THR A 3 0.169 -11.137 -11.719 1.00 0.00 C ATOM 30 O THR A 3 0.313 -12.332 -11.444 1.00 0.00 O ATOM 31 CB THR A 3 -0.844 -11.485 -14.086 1.00 0.00 C ATOM 32 OG1 THR A 3 -1.610 -10.527 -14.810 1.00 0.00 O ATOM 33 CG2 THR A 3 -1.770 -12.525 -13.458 1.00 0.00 C ATOM 0 H THR A 3 1.665 -11.415 -14.338 1.00 0.00 H new ATOM 0 HA THR A 3 -0.350 -9.663 -13.111 1.00 0.00 H new ATOM 0 HB THR A 3 -0.191 -12.123 -14.682 1.00 0.00 H new ATOM 0 HG1 THR A 3 -2.228 -10.991 -15.413 1.00 0.00 H new ATOM 0 HG21 THR A 3 -2.354 -13.011 -14.239 1.00 0.00 H new ATOM 0 HG22 THR A 3 -1.175 -13.272 -12.932 1.00 0.00 H new ATOM 0 HG23 THR A 3 -2.443 -12.035 -12.754 1.00 0.00 H new ATOM 41 N TRP A 4 0.178 -10.181 -10.811 1.00 0.00 N ATOM 42 CA TRP A 4 0.232 -10.485 -9.372 1.00 0.00 C ATOM 43 C TRP A 4 -1.161 -10.832 -8.853 1.00 0.00 C ATOM 44 O TRP A 4 -2.033 -9.977 -8.727 1.00 0.00 O ATOM 45 CB TRP A 4 0.799 -9.300 -8.600 1.00 0.00 C ATOM 46 CG TRP A 4 2.256 -9.025 -8.984 1.00 0.00 C ATOM 47 CD1 TRP A 4 2.658 -8.371 -10.074 1.00 0.00 C ATOM 48 CD2 TRP A 4 3.394 -9.336 -8.243 1.00 0.00 C ATOM 49 NE1 TRP A 4 3.986 -8.241 -10.055 1.00 0.00 N ATOM 50 CE2 TRP A 4 4.484 -8.834 -8.978 1.00 0.00 C ATOM 51 CE3 TRP A 4 3.598 -10.047 -7.049 1.00 0.00 C ATOM 52 CZ2 TRP A 4 5.801 -9.053 -8.532 1.00 0.00 C ATOM 53 CZ3 TRP A 4 4.910 -10.274 -6.607 1.00 0.00 C ATOM 54 CH2 TRP A 4 6.013 -9.791 -7.349 1.00 0.00 C ATOM 0 H TRP A 4 0.149 -9.185 -11.031 1.00 0.00 H new ATOM 0 HA TRP A 4 0.887 -11.344 -9.223 1.00 0.00 H new ATOM 0 HB2 TRP A 4 0.196 -8.414 -8.798 1.00 0.00 H new ATOM 0 HB3 TRP A 4 0.735 -9.497 -7.530 1.00 0.00 H new ATOM 0 HD1 TRP A 4 2.008 -8.003 -10.854 1.00 0.00 H new ATOM 0 HE1 TRP A 4 4.537 -7.757 -10.764 1.00 0.00 H new ATOM 0 HE3 TRP A 4 2.757 -10.414 -6.479 1.00 0.00 H new ATOM 0 HZ2 TRP A 4 6.639 -8.661 -9.089 1.00 0.00 H new ATOM 0 HZ3 TRP A 4 5.079 -10.822 -5.692 1.00 0.00 H new ATOM 0 HH2 TRP A 4 7.019 -9.988 -7.009 1.00 0.00 H new ATOM 65 N THR A 5 -1.363 -12.113 -8.607 1.00 0.00 N ATOM 66 CA THR A 5 -2.696 -12.612 -8.219 1.00 0.00 C ATOM 67 C THR A 5 -2.661 -13.020 -6.744 1.00 0.00 C ATOM 68 O THR A 5 -1.837 -13.833 -6.311 1.00 0.00 O ATOM 69 CB THR A 5 -3.123 -13.773 -9.123 1.00 0.00 C ATOM 70 OG1 THR A 5 -2.747 -13.430 -10.466 1.00 0.00 O ATOM 71 CG2 THR A 5 -4.648 -13.954 -9.128 1.00 0.00 C ATOM 0 H THR A 5 -0.640 -12.830 -8.664 1.00 0.00 H new ATOM 0 HA THR A 5 -3.439 -11.825 -8.346 1.00 0.00 H new ATOM 0 HB THR A 5 -2.652 -14.687 -8.761 1.00 0.00 H new ATOM 0 HG1 THR A 5 -3.005 -14.155 -11.073 1.00 0.00 H new ATOM 0 HG21 THR A 5 -4.913 -14.786 -9.780 1.00 0.00 H new ATOM 0 HG22 THR A 5 -4.993 -14.162 -8.115 1.00 0.00 H new ATOM 0 HG23 THR A 5 -5.121 -13.042 -9.493 1.00 0.00 H new ATOM 79 N CYS A 6 -3.487 -12.326 -5.968 1.00 0.00 N ATOM 80 CA CYS A 6 -3.551 -12.504 -4.516 1.00 0.00 C ATOM 81 C CYS A 6 -4.867 -13.200 -4.173 1.00 0.00 C ATOM 82 O CYS A 6 -5.943 -12.831 -4.635 1.00 0.00 O ATOM 83 CB CYS A 6 -3.549 -11.129 -3.838 1.00 0.00 C ATOM 84 SG CYS A 6 -2.467 -9.869 -4.603 1.00 0.00 S ATOM 0 H CYS A 6 -4.133 -11.622 -6.326 1.00 0.00 H new ATOM 0 HA CYS A 6 -2.698 -13.092 -4.177 1.00 0.00 H new ATOM 0 HB2 CYS A 6 -4.570 -10.747 -3.829 1.00 0.00 H new ATOM 0 HB3 CYS A 6 -3.247 -11.257 -2.798 1.00 0.00 H new ATOM 89 N LEU A 7 -4.767 -14.252 -3.373 1.00 0.00 N ATOM 90 CA LEU A 7 -5.956 -15.031 -2.978 1.00 0.00 C ATOM 91 C LEU A 7 -6.456 -14.592 -1.595 1.00 0.00 C ATOM 92 O LEU A 7 -6.011 -15.070 -0.554 1.00 0.00 O ATOM 93 CB LEU A 7 -5.633 -16.527 -3.004 1.00 0.00 C ATOM 94 CG LEU A 7 -5.726 -17.102 -4.414 1.00 0.00 C ATOM 95 CD1 LEU A 7 -4.887 -18.377 -4.519 1.00 0.00 C ATOM 96 CD2 LEU A 7 -7.178 -17.406 -4.763 1.00 0.00 C ATOM 0 H LEU A 7 -3.888 -14.592 -2.982 1.00 0.00 H new ATOM 0 HA LEU A 7 -6.757 -14.842 -3.692 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -4.629 -16.689 -2.611 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -6.322 -17.059 -2.348 1.00 0.00 H new ATOM 0 HG LEU A 7 -5.340 -16.365 -5.118 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -4.961 -18.779 -5.530 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -3.845 -18.147 -4.295 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -5.256 -19.115 -3.807 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -7.232 -17.816 -5.772 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -7.578 -18.131 -4.055 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -7.764 -16.488 -4.713 1.00 0.00 H new ATOM 108 N ASN A 8 -7.289 -13.555 -1.633 1.00 0.00 N ATOM 109 CA ASN A 8 -7.849 -12.963 -0.397 1.00 0.00 C ATOM 110 C ASN A 8 -9.220 -13.580 -0.127 1.00 0.00 C ATOM 111 O ASN A 8 -9.917 -14.022 -1.033 1.00 0.00 O ATOM 112 CB ASN A 8 -8.029 -11.442 -0.512 1.00 0.00 C ATOM 113 CG ASN A 8 -6.863 -10.793 -1.263 1.00 0.00 C ATOM 114 OD1 ASN A 8 -6.987 -10.457 -2.422 1.00 0.00 O ATOM 115 ND2 ASN A 8 -5.684 -10.799 -0.707 1.00 0.00 N ATOM 0 H ASN A 8 -7.596 -13.102 -2.494 1.00 0.00 H new ATOM 0 HA ASN A 8 -7.147 -13.169 0.411 1.00 0.00 H new ATOM 0 HB2 ASN A 8 -8.963 -11.223 -1.030 1.00 0.00 H new ATOM 0 HB3 ASN A 8 -8.108 -11.008 0.485 1.00 0.00 H new ATOM 0 HD21 ASN A 8 -4.864 -10.521 -1.247 1.00 0.00 H new ATOM 0 HD22 ASN A 8 -5.581 -11.082 0.268 1.00 0.00 H new ATOM 122 N ASP A 9 -9.595 -13.548 1.142 1.00 0.00 N ATOM 123 CA ASP A 9 -10.895 -14.101 1.540 1.00 0.00 C ATOM 124 C ASP A 9 -11.951 -12.984 1.582 1.00 0.00 C ATOM 125 O ASP A 9 -11.738 -11.940 2.161 1.00 0.00 O ATOM 126 CB ASP A 9 -10.694 -14.809 2.887 1.00 0.00 C ATOM 127 CG ASP A 9 -11.641 -15.991 3.124 1.00 0.00 C ATOM 128 OD1 ASP A 9 -12.366 -16.372 2.178 1.00 0.00 O ATOM 129 OD2 ASP A 9 -11.753 -16.384 4.310 1.00 0.00 O ATOM 0 H ASP A 9 -9.039 -13.157 1.903 1.00 0.00 H new ATOM 0 HA ASP A 9 -11.269 -14.829 0.821 1.00 0.00 H new ATOM 0 HB2 ASP A 9 -9.665 -15.164 2.948 1.00 0.00 H new ATOM 0 HB3 ASP A 9 -10.829 -14.084 3.689 1.00 0.00 H new ATOM 134 N GLN A 10 -13.091 -13.185 0.968 1.00 0.00 N ATOM 135 CA GLN A 10 -14.178 -12.193 0.928 1.00 0.00 C ATOM 136 C GLN A 10 -15.451 -12.733 1.562 1.00 0.00 C ATOM 137 O GLN A 10 -15.886 -13.832 1.227 1.00 0.00 O ATOM 138 CB GLN A 10 -14.465 -11.738 -0.496 1.00 0.00 C ATOM 139 CG GLN A 10 -13.622 -10.504 -0.811 1.00 0.00 C ATOM 140 CD GLN A 10 -13.664 -10.176 -2.298 1.00 0.00 C ATOM 141 OE1 GLN A 10 -13.143 -10.891 -3.142 1.00 0.00 O ATOM 142 NE2 GLN A 10 -14.268 -9.068 -2.664 1.00 0.00 N ATOM 0 H GLN A 10 -13.309 -14.048 0.470 1.00 0.00 H new ATOM 0 HA GLN A 10 -13.840 -11.333 1.507 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -14.235 -12.539 -1.199 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -15.524 -11.508 -0.610 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -13.989 -9.653 -0.237 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -12.591 -10.676 -0.502 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -14.704 -8.469 -1.963 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -14.301 -8.807 -3.649 1.00 0.00 H new ATOM 151 N LYS A 11 -15.936 -11.996 2.570 1.00 0.00 N ATOM 152 CA LYS A 11 -17.160 -12.374 3.287 1.00 0.00 C ATOM 153 C LYS A 11 -18.364 -11.759 2.566 1.00 0.00 C ATOM 154 O LYS A 11 -18.775 -10.633 2.826 1.00 0.00 O ATOM 155 CB LYS A 11 -17.102 -11.956 4.765 1.00 0.00 C ATOM 156 CG LYS A 11 -18.366 -12.384 5.514 1.00 0.00 C ATOM 157 CD LYS A 11 -18.107 -13.531 6.502 1.00 0.00 C ATOM 158 CE LYS A 11 -18.267 -13.022 7.930 1.00 0.00 C ATOM 159 NZ LYS A 11 -17.312 -13.708 8.826 1.00 0.00 N ATOM 0 H LYS A 11 -15.501 -11.137 2.906 1.00 0.00 H new ATOM 0 HA LYS A 11 -17.260 -13.459 3.284 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -16.228 -12.403 5.238 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -16.984 -10.875 4.835 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -18.771 -11.528 6.054 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -19.123 -12.694 4.794 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -18.804 -14.349 6.316 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -17.103 -13.929 6.357 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -18.098 -11.946 7.961 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -19.287 -13.194 8.273 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -17.233 -13.181 9.719 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -17.650 -14.672 9.022 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -16.379 -13.755 8.369 1.00 0.00 H new ATOM 173 N ASN A 12 -18.843 -12.510 1.590 1.00 0.00 N ATOM 174 CA ASN A 12 -20.022 -12.111 0.794 1.00 0.00 C ATOM 175 C ASN A 12 -21.200 -11.903 1.745 1.00 0.00 C ATOM 176 O ASN A 12 -21.503 -12.833 2.477 1.00 0.00 O ATOM 177 CB ASN A 12 -20.380 -13.194 -0.225 1.00 0.00 C ATOM 178 CG ASN A 12 -20.674 -12.528 -1.564 1.00 0.00 C ATOM 179 OD1 ASN A 12 -19.799 -12.305 -2.384 1.00 0.00 O ATOM 180 ND2 ASN A 12 -21.905 -12.095 -1.772 1.00 0.00 N ATOM 0 H ASN A 12 -18.441 -13.407 1.318 1.00 0.00 H new ATOM 0 HA ASN A 12 -19.796 -11.192 0.254 1.00 0.00 H new ATOM 0 HB2 ASN A 12 -19.558 -13.902 -0.328 1.00 0.00 H new ATOM 0 HB3 ASN A 12 -21.248 -13.760 0.114 1.00 0.00 H new ATOM 0 HD21 ASN A 12 -22.125 -11.573 -2.620 1.00 0.00 H new ATOM 0 HD22 ASN A 12 -22.635 -12.283 -1.085 1.00 0.00 H new ATOM 187 N PRO A 13 -21.870 -10.743 1.730 1.00 0.00 N ATOM 188 CA PRO A 13 -23.031 -10.472 2.595 1.00 0.00 C ATOM 189 C PRO A 13 -24.302 -11.197 2.135 1.00 0.00 C ATOM 190 O PRO A 13 -25.124 -11.619 2.949 1.00 0.00 O ATOM 191 CB PRO A 13 -23.198 -8.951 2.553 1.00 0.00 C ATOM 192 CG PRO A 13 -22.559 -8.514 1.231 1.00 0.00 C ATOM 193 CD PRO A 13 -21.533 -9.583 0.880 1.00 0.00 C ATOM 0 HA PRO A 13 -22.866 -10.845 3.606 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -24.250 -8.669 2.594 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -22.707 -8.477 3.403 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -23.311 -8.424 0.447 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -22.085 -7.538 1.332 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -21.582 -9.843 -0.177 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -20.519 -9.234 1.075 1.00 0.00 H new ATOM 201 N LYS A 14 -24.383 -11.466 0.827 1.00 0.00 N ATOM 202 CA LYS A 14 -25.507 -12.200 0.213 1.00 0.00 C ATOM 203 C LYS A 14 -25.601 -13.610 0.809 1.00 0.00 C ATOM 204 O LYS A 14 -26.665 -14.050 1.230 1.00 0.00 O ATOM 205 CB LYS A 14 -25.327 -12.289 -1.309 1.00 0.00 C ATOM 206 CG LYS A 14 -26.526 -12.946 -2.017 1.00 0.00 C ATOM 207 CD LYS A 14 -27.480 -11.891 -2.577 1.00 0.00 C ATOM 208 CE LYS A 14 -28.951 -12.243 -2.319 1.00 0.00 C ATOM 209 NZ LYS A 14 -29.605 -12.785 -3.513 1.00 0.00 N ATOM 0 H LYS A 14 -23.669 -11.181 0.157 1.00 0.00 H new ATOM 0 HA LYS A 14 -26.429 -11.658 0.424 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -25.178 -11.287 -1.711 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -24.424 -12.858 -1.530 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -26.170 -13.584 -2.825 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -27.060 -13.588 -1.316 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -27.255 -10.925 -2.126 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -27.316 -11.788 -3.650 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -29.013 -12.971 -1.510 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -29.484 -11.352 -1.987 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -30.597 -13.009 -3.294 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -29.570 -12.081 -4.278 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -29.113 -13.650 -3.816 1.00 0.00 H new ATOM 223 N THR A 15 -24.460 -14.267 0.874 1.00 0.00 N ATOM 224 CA THR A 15 -24.371 -15.641 1.394 1.00 0.00 C ATOM 225 C THR A 15 -23.838 -15.666 2.831 1.00 0.00 C ATOM 226 O THR A 15 -23.689 -16.747 3.407 1.00 0.00 O ATOM 227 CB THR A 15 -23.491 -16.472 0.463 1.00 0.00 C ATOM 228 OG1 THR A 15 -22.177 -15.907 0.439 1.00 0.00 O ATOM 229 CG2 THR A 15 -24.056 -16.530 -0.965 1.00 0.00 C ATOM 0 H THR A 15 -23.567 -13.877 0.573 1.00 0.00 H new ATOM 0 HA THR A 15 -25.371 -16.073 1.424 1.00 0.00 H new ATOM 0 HB THR A 15 -23.462 -17.493 0.844 1.00 0.00 H new ATOM 0 HG1 THR A 15 -21.604 -16.436 -0.155 1.00 0.00 H new ATOM 0 HG21 THR A 15 -23.398 -17.131 -1.592 1.00 0.00 H new ATOM 0 HG22 THR A 15 -25.049 -16.979 -0.945 1.00 0.00 H new ATOM 0 HG23 THR A 15 -24.122 -15.521 -1.371 1.00 0.00 H new ATOM 237 N ASN A 16 -23.518 -14.483 3.363 1.00 0.00 N ATOM 238 CA ASN A 16 -22.881 -14.276 4.684 1.00 0.00 C ATOM 239 C ASN A 16 -21.716 -15.241 4.930 1.00 0.00 C ATOM 240 O ASN A 16 -21.433 -15.645 6.057 1.00 0.00 O ATOM 241 CB ASN A 16 -23.978 -14.323 5.749 1.00 0.00 C ATOM 242 CG ASN A 16 -23.726 -13.265 6.814 1.00 0.00 C ATOM 243 OD1 ASN A 16 -23.648 -12.067 6.568 1.00 0.00 O ATOM 244 ND2 ASN A 16 -23.637 -13.722 8.045 1.00 0.00 N ATOM 0 H ASN A 16 -23.698 -13.606 2.875 1.00 0.00 H new ATOM 0 HA ASN A 16 -22.407 -13.296 4.727 1.00 0.00 H new ATOM 0 HB2 ASN A 16 -24.951 -14.158 5.286 1.00 0.00 H new ATOM 0 HB3 ASN A 16 -24.007 -15.311 6.208 1.00 0.00 H new ATOM 0 HD21 ASN A 16 -23.500 -13.074 8.821 1.00 0.00 H new ATOM 0 HD22 ASN A 16 -23.705 -14.724 8.223 1.00 0.00 H new ATOM 251 N LYS A 17 -21.103 -15.671 3.835 1.00 0.00 N ATOM 252 CA LYS A 17 -20.048 -16.689 3.835 1.00 0.00 C ATOM 253 C LYS A 17 -18.762 -16.112 3.244 1.00 0.00 C ATOM 254 O LYS A 17 -18.769 -15.106 2.528 1.00 0.00 O ATOM 255 CB LYS A 17 -20.462 -17.951 3.061 1.00 0.00 C ATOM 256 CG LYS A 17 -20.653 -19.128 4.023 1.00 0.00 C ATOM 257 CD LYS A 17 -20.595 -20.464 3.276 1.00 0.00 C ATOM 258 CE LYS A 17 -19.195 -21.098 3.388 1.00 0.00 C ATOM 259 NZ LYS A 17 -18.907 -21.888 2.182 1.00 0.00 N ATOM 0 H LYS A 17 -21.325 -15.319 2.904 1.00 0.00 H new ATOM 0 HA LYS A 17 -19.876 -16.981 4.871 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -21.388 -17.764 2.516 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -19.701 -18.198 2.321 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -19.880 -19.103 4.791 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -21.612 -19.034 4.532 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -21.341 -21.146 3.684 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -20.845 -20.309 2.226 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -18.442 -20.319 3.512 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -19.144 -21.734 4.271 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -17.961 -22.313 2.263 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -19.618 -22.641 2.082 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -18.938 -21.270 1.346 1.00 0.00 H new ATOM 273 N TYR A 18 -17.689 -16.786 3.586 1.00 0.00 N ATOM 274 CA TYR A 18 -16.332 -16.396 3.177 1.00 0.00 C ATOM 275 C TYR A 18 -15.847 -17.221 1.983 1.00 0.00 C ATOM 276 O TYR A 18 -16.155 -18.407 1.866 1.00 0.00 O ATOM 277 CB TYR A 18 -15.368 -16.601 4.346 1.00 0.00 C ATOM 278 CG TYR A 18 -14.828 -15.271 4.874 1.00 0.00 C ATOM 279 CD1 TYR A 18 -14.109 -14.427 4.008 1.00 0.00 C ATOM 280 CD2 TYR A 18 -14.961 -14.971 6.240 1.00 0.00 C ATOM 281 CE1 TYR A 18 -13.493 -13.277 4.511 1.00 0.00 C ATOM 282 CE2 TYR A 18 -14.366 -13.796 6.746 1.00 0.00 C ATOM 283 CZ TYR A 18 -13.626 -12.977 5.876 1.00 0.00 C ATOM 284 OH TYR A 18 -13.037 -11.845 6.342 1.00 0.00 O ATOM 0 H TYR A 18 -17.718 -17.629 4.160 1.00 0.00 H new ATOM 0 HA TYR A 18 -16.359 -15.347 2.884 1.00 0.00 H new ATOM 0 HB2 TYR A 18 -15.878 -17.131 5.150 1.00 0.00 H new ATOM 0 HB3 TYR A 18 -14.537 -17.230 4.026 1.00 0.00 H new ATOM 0 HD1 TYR A 18 -14.033 -14.667 2.958 1.00 0.00 H new ATOM 0 HD2 TYR A 18 -15.511 -15.631 6.894 1.00 0.00 H new ATOM 0 HE1 TYR A 18 -12.924 -12.630 3.860 1.00 0.00 H new ATOM 0 HE2 TYR A 18 -14.478 -13.530 7.787 1.00 0.00 H new ATOM 0 HH TYR A 18 -13.209 -11.759 7.303 1.00 0.00 H new ATOM 294 N GLU A 19 -15.211 -16.523 1.052 1.00 0.00 N ATOM 295 CA GLU A 19 -14.740 -17.134 -0.206 1.00 0.00 C ATOM 296 C GLU A 19 -13.345 -16.605 -0.550 1.00 0.00 C ATOM 297 O GLU A 19 -13.064 -15.432 -0.359 1.00 0.00 O ATOM 298 CB GLU A 19 -15.676 -16.817 -1.384 1.00 0.00 C ATOM 299 CG GLU A 19 -17.144 -16.701 -0.967 1.00 0.00 C ATOM 300 CD GLU A 19 -18.094 -16.680 -2.147 1.00 0.00 C ATOM 301 OE1 GLU A 19 -18.275 -17.762 -2.748 1.00 0.00 O ATOM 302 OE2 GLU A 19 -18.716 -15.615 -2.349 1.00 0.00 O ATOM 0 H GLU A 19 -15.004 -15.528 1.135 1.00 0.00 H new ATOM 0 HA GLU A 19 -14.721 -18.213 -0.051 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -15.361 -15.883 -1.850 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -15.579 -17.598 -2.138 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -17.399 -17.538 -0.317 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -17.279 -15.791 -0.382 1.00 0.00 H new ATOM 309 N THR A 20 -12.555 -17.451 -1.180 1.00 0.00 N ATOM 310 CA THR A 20 -11.171 -17.081 -1.523 1.00 0.00 C ATOM 311 C THR A 20 -11.081 -16.727 -3.011 1.00 0.00 C ATOM 312 O THR A 20 -10.795 -17.554 -3.878 1.00 0.00 O ATOM 313 CB THR A 20 -10.221 -18.218 -1.128 1.00 0.00 C ATOM 314 OG1 THR A 20 -10.481 -18.523 0.240 1.00 0.00 O ATOM 315 CG2 THR A 20 -8.745 -17.840 -1.271 1.00 0.00 C ATOM 0 H THR A 20 -12.830 -18.390 -1.467 1.00 0.00 H new ATOM 0 HA THR A 20 -10.867 -16.196 -0.964 1.00 0.00 H new ATOM 0 HB THR A 20 -10.398 -19.064 -1.792 1.00 0.00 H new ATOM 0 HG1 THR A 20 -9.892 -19.250 0.531 1.00 0.00 H new ATOM 0 HG21 THR A 20 -8.123 -18.685 -0.977 1.00 0.00 H new ATOM 0 HG22 THR A 20 -8.535 -17.579 -2.308 1.00 0.00 H new ATOM 0 HG23 THR A 20 -8.524 -16.987 -0.630 1.00 0.00 H new ATOM 323 N LYS A 21 -11.466 -15.482 -3.261 1.00 0.00 N ATOM 324 CA LYS A 21 -11.463 -14.929 -4.627 1.00 0.00 C ATOM 325 C LYS A 21 -10.008 -14.668 -5.069 1.00 0.00 C ATOM 326 O LYS A 21 -9.074 -14.660 -4.272 1.00 0.00 O ATOM 327 CB LYS A 21 -12.291 -13.642 -4.661 1.00 0.00 C ATOM 328 CG LYS A 21 -13.685 -13.799 -4.047 1.00 0.00 C ATOM 329 CD LYS A 21 -14.799 -13.798 -5.095 1.00 0.00 C ATOM 330 CE LYS A 21 -16.041 -13.132 -4.497 1.00 0.00 C ATOM 331 NZ LYS A 21 -17.103 -13.081 -5.504 1.00 0.00 N ATOM 0 H LYS A 21 -11.785 -14.830 -2.544 1.00 0.00 H new ATOM 0 HA LYS A 21 -11.912 -15.641 -5.320 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -11.753 -12.859 -4.127 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -12.393 -13.311 -5.695 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -13.725 -14.730 -3.482 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -13.858 -12.989 -3.339 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -14.477 -13.262 -5.988 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -15.029 -14.818 -5.402 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -16.380 -13.689 -3.624 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -15.799 -12.125 -4.158 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -17.946 -12.628 -5.097 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -16.777 -12.531 -6.325 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -17.341 -14.047 -5.807 1.00 0.00 H new ATOM 345 N ARG A 22 -9.845 -14.515 -6.376 1.00 0.00 N ATOM 346 CA ARG A 22 -8.516 -14.288 -6.992 1.00 0.00 C ATOM 347 C ARG A 22 -8.355 -12.816 -7.384 1.00 0.00 C ATOM 348 O ARG A 22 -8.893 -12.353 -8.392 1.00 0.00 O ATOM 349 CB ARG A 22 -8.325 -15.177 -8.231 1.00 0.00 C ATOM 350 CG ARG A 22 -8.355 -16.656 -7.878 1.00 0.00 C ATOM 351 CD ARG A 22 -9.371 -17.390 -8.730 1.00 0.00 C ATOM 352 NE ARG A 22 -9.899 -18.560 -8.005 1.00 0.00 N ATOM 353 CZ ARG A 22 -10.713 -19.480 -8.523 1.00 0.00 C ATOM 354 NH1 ARG A 22 -11.054 -19.445 -9.802 1.00 0.00 N ATOM 355 NH2 ARG A 22 -11.169 -20.469 -7.768 1.00 0.00 N ATOM 0 H ARG A 22 -10.614 -14.542 -7.046 1.00 0.00 H new ATOM 0 HA ARG A 22 -7.756 -14.549 -6.256 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -9.109 -14.961 -8.957 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -7.374 -14.937 -8.707 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -7.367 -17.091 -8.027 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -8.601 -16.778 -6.823 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -10.188 -16.718 -8.993 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -8.909 -17.711 -9.664 1.00 0.00 H new ATOM 0 HE ARG A 22 -9.620 -18.675 -7.031 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -10.693 -18.707 -10.406 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -11.678 -20.156 -10.183 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -10.897 -20.528 -6.787 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -11.792 -21.171 -8.168 1.00 0.00 H new ATOM 369 N LEU A 23 -7.655 -12.101 -6.528 1.00 0.00 N ATOM 370 CA LEU A 23 -7.369 -10.673 -6.743 1.00 0.00 C ATOM 371 C LEU A 23 -6.153 -10.512 -7.662 1.00 0.00 C ATOM 372 O LEU A 23 -5.006 -10.491 -7.240 1.00 0.00 O ATOM 373 CB LEU A 23 -7.134 -9.975 -5.398 1.00 0.00 C ATOM 374 CG LEU A 23 -8.138 -8.842 -5.174 1.00 0.00 C ATOM 375 CD1 LEU A 23 -9.544 -9.363 -4.923 1.00 0.00 C ATOM 376 CD2 LEU A 23 -7.695 -7.995 -3.972 1.00 0.00 C ATOM 0 H LEU A 23 -7.264 -12.478 -5.665 1.00 0.00 H new ATOM 0 HA LEU A 23 -8.227 -10.206 -7.226 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -7.217 -10.702 -4.590 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -6.120 -9.576 -5.365 1.00 0.00 H new ATOM 0 HG LEU A 23 -8.160 -8.240 -6.082 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -10.221 -8.523 -4.770 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -9.876 -9.944 -5.783 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -9.544 -9.996 -4.036 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -8.410 -7.188 -3.812 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -7.651 -8.622 -3.082 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -6.709 -7.573 -4.168 1.00 0.00 H new ATOM 388 N LEU A 24 -6.469 -10.530 -8.946 1.00 0.00 N ATOM 389 CA LEU A 24 -5.470 -10.304 -10.006 1.00 0.00 C ATOM 390 C LEU A 24 -5.134 -8.815 -10.080 1.00 0.00 C ATOM 391 O LEU A 24 -6.009 -7.956 -10.144 1.00 0.00 O ATOM 392 CB LEU A 24 -5.959 -10.962 -11.312 1.00 0.00 C ATOM 393 CG LEU A 24 -5.484 -10.376 -12.663 1.00 0.00 C ATOM 394 CD1 LEU A 24 -6.185 -9.060 -13.033 1.00 0.00 C ATOM 395 CD2 LEU A 24 -3.974 -10.209 -12.721 1.00 0.00 C ATOM 0 H LEU A 24 -7.413 -10.699 -9.293 1.00 0.00 H new ATOM 0 HA LEU A 24 -4.518 -10.788 -9.789 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -5.663 -12.011 -11.284 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -7.049 -10.938 -11.306 1.00 0.00 H new ATOM 0 HG LEU A 24 -5.773 -11.115 -13.410 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -5.806 -8.703 -13.991 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -7.259 -9.228 -13.108 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -5.987 -8.314 -12.264 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -3.691 -9.795 -13.689 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -3.652 -9.533 -11.929 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -3.495 -11.179 -12.587 1.00 0.00 H new ATOM 407 N TYR A 25 -3.837 -8.560 -10.098 1.00 0.00 N ATOM 408 CA TYR A 25 -3.258 -7.214 -10.193 1.00 0.00 C ATOM 409 C TYR A 25 -2.239 -7.162 -11.327 1.00 0.00 C ATOM 410 O TYR A 25 -1.303 -7.951 -11.406 1.00 0.00 O ATOM 411 CB TYR A 25 -2.581 -6.850 -8.883 1.00 0.00 C ATOM 412 CG TYR A 25 -3.596 -6.428 -7.823 1.00 0.00 C ATOM 413 CD1 TYR A 25 -4.375 -7.398 -7.141 1.00 0.00 C ATOM 414 CD2 TYR A 25 -3.689 -5.056 -7.534 1.00 0.00 C ATOM 415 CE1 TYR A 25 -5.296 -6.959 -6.180 1.00 0.00 C ATOM 416 CE2 TYR A 25 -4.582 -4.643 -6.528 1.00 0.00 C ATOM 417 CZ TYR A 25 -5.399 -5.589 -5.873 1.00 0.00 C ATOM 418 OH TYR A 25 -6.278 -5.143 -4.935 1.00 0.00 O ATOM 0 H TYR A 25 -3.133 -9.296 -10.046 1.00 0.00 H new ATOM 0 HA TYR A 25 -4.056 -6.500 -10.397 1.00 0.00 H new ATOM 0 HB2 TYR A 25 -2.008 -7.703 -8.520 1.00 0.00 H new ATOM 0 HB3 TYR A 25 -1.872 -6.039 -9.052 1.00 0.00 H new ATOM 0 HD1 TYR A 25 -4.261 -8.450 -7.357 1.00 0.00 H new ATOM 0 HD2 TYR A 25 -3.090 -4.336 -8.071 1.00 0.00 H new ATOM 0 HE1 TYR A 25 -5.928 -7.673 -5.674 1.00 0.00 H new ATOM 0 HE2 TYR A 25 -4.642 -3.599 -6.256 1.00 0.00 H new ATOM 0 HH TYR A 25 -6.050 -4.224 -4.684 1.00 0.00 H new ATOM 428 N ASN A 26 -2.422 -6.171 -12.184 1.00 0.00 N ATOM 429 CA ASN A 26 -1.487 -5.960 -13.287 1.00 0.00 C ATOM 430 C ASN A 26 -0.285 -5.169 -12.753 1.00 0.00 C ATOM 431 O ASN A 26 -0.418 -4.035 -12.317 1.00 0.00 O ATOM 432 CB ASN A 26 -2.157 -5.163 -14.393 1.00 0.00 C ATOM 433 CG ASN A 26 -2.114 -5.928 -15.723 1.00 0.00 C ATOM 434 OD1 ASN A 26 -2.561 -7.056 -15.844 1.00 0.00 O ATOM 435 ND2 ASN A 26 -1.538 -5.301 -16.722 1.00 0.00 N ATOM 0 H ASN A 26 -3.195 -5.507 -12.143 1.00 0.00 H new ATOM 0 HA ASN A 26 -1.167 -6.921 -13.689 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -3.192 -4.956 -14.121 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -1.658 -4.200 -14.506 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -1.455 -5.757 -17.630 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -1.174 -4.358 -16.590 1.00 0.00 H new ATOM 442 N GLN A 27 0.885 -5.797 -12.805 1.00 0.00 N ATOM 443 CA GLN A 27 2.127 -5.133 -12.365 1.00 0.00 C ATOM 444 C GLN A 27 2.347 -3.815 -13.099 1.00 0.00 C ATOM 445 O GLN A 27 2.817 -2.869 -12.485 1.00 0.00 O ATOM 446 CB GLN A 27 3.355 -5.982 -12.622 1.00 0.00 C ATOM 447 CG GLN A 27 4.670 -5.321 -12.235 1.00 0.00 C ATOM 448 CD GLN A 27 5.559 -5.142 -13.463 1.00 0.00 C ATOM 449 OE1 GLN A 27 5.197 -4.552 -14.477 1.00 0.00 O ATOM 450 NE2 GLN A 27 6.754 -5.684 -13.362 1.00 0.00 N ATOM 0 H GLN A 27 1.009 -6.752 -13.141 1.00 0.00 H new ATOM 0 HA GLN A 27 1.999 -4.969 -11.295 1.00 0.00 H new ATOM 0 HB2 GLN A 27 3.257 -6.917 -12.071 1.00 0.00 H new ATOM 0 HB3 GLN A 27 3.389 -6.238 -13.681 1.00 0.00 H new ATOM 0 HG2 GLN A 27 4.475 -4.352 -11.775 1.00 0.00 H new ATOM 0 HG3 GLN A 27 5.185 -5.929 -11.491 1.00 0.00 H new ATOM 0 HE21 GLN A 27 7.024 -6.167 -12.505 1.00 0.00 H new ATOM 0 HE22 GLN A 27 7.410 -5.621 -14.140 1.00 0.00 H new ATOM 459 N ASN A 28 1.956 -3.752 -14.365 1.00 0.00 N ATOM 460 CA ASN A 28 2.014 -2.499 -15.138 1.00 0.00 C ATOM 461 C ASN A 28 1.303 -1.337 -14.418 1.00 0.00 C ATOM 462 O ASN A 28 1.756 -0.196 -14.459 1.00 0.00 O ATOM 463 CB ASN A 28 1.378 -2.698 -16.513 1.00 0.00 C ATOM 464 CG ASN A 28 1.761 -1.557 -17.453 1.00 0.00 C ATOM 465 OD1 ASN A 28 1.639 -0.374 -17.185 1.00 0.00 O ATOM 466 ND2 ASN A 28 2.235 -1.927 -18.620 1.00 0.00 N ATOM 0 H ASN A 28 1.594 -4.550 -14.887 1.00 0.00 H new ATOM 0 HA ASN A 28 3.067 -2.239 -15.244 1.00 0.00 H new ATOM 0 HB2 ASN A 28 1.703 -3.649 -16.936 1.00 0.00 H new ATOM 0 HB3 ASN A 28 0.294 -2.747 -16.414 1.00 0.00 H new ATOM 0 HD21 ASN A 28 2.503 -1.223 -19.308 1.00 0.00 H new ATOM 0 HD22 ASN A 28 2.335 -2.918 -18.839 1.00 0.00 H new ATOM 473 N LYS A 29 0.345 -1.701 -13.584 1.00 0.00 N ATOM 474 CA LYS A 29 -0.366 -0.757 -12.707 1.00 0.00 C ATOM 475 C LYS A 29 0.324 -0.586 -11.354 1.00 0.00 C ATOM 476 O LYS A 29 0.402 0.528 -10.876 1.00 0.00 O ATOM 477 CB LYS A 29 -1.829 -1.162 -12.550 1.00 0.00 C ATOM 478 CG LYS A 29 -2.552 -0.613 -13.771 1.00 0.00 C ATOM 479 CD LYS A 29 -3.330 -1.685 -14.532 1.00 0.00 C ATOM 480 CE LYS A 29 -3.592 -1.199 -15.952 1.00 0.00 C ATOM 481 NZ LYS A 29 -5.024 -1.143 -16.246 1.00 0.00 N ATOM 0 H LYS A 29 0.028 -2.666 -13.488 1.00 0.00 H new ATOM 0 HA LYS A 29 -0.336 0.220 -13.189 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -1.929 -2.246 -12.492 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -2.250 -0.754 -11.631 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -3.238 0.173 -13.458 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -1.826 -0.154 -14.441 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -2.765 -2.617 -14.552 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -4.273 -1.895 -14.027 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -3.154 -0.210 -16.085 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -3.100 -1.864 -16.662 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -5.166 -0.808 -17.220 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -5.437 -2.092 -16.142 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -5.489 -0.489 -15.584 1.00 0.00 H new ATOM 495 N ALA A 30 1.002 -1.608 -10.855 1.00 0.00 N ATOM 496 CA ALA A 30 1.775 -1.543 -9.595 1.00 0.00 C ATOM 497 C ALA A 30 3.115 -0.799 -9.756 1.00 0.00 C ATOM 498 O ALA A 30 3.350 0.204 -9.081 1.00 0.00 O ATOM 499 CB ALA A 30 2.005 -2.974 -9.137 1.00 0.00 C ATOM 0 H ALA A 30 1.040 -2.521 -11.308 1.00 0.00 H new ATOM 0 HA ALA A 30 1.212 -0.975 -8.855 1.00 0.00 H new ATOM 0 HB1 ALA A 30 2.574 -2.971 -8.207 1.00 0.00 H new ATOM 0 HB2 ALA A 30 1.044 -3.462 -8.973 1.00 0.00 H new ATOM 0 HB3 ALA A 30 2.562 -3.516 -9.902 1.00 0.00 H new ATOM 505 N GLU A 31 3.878 -1.195 -10.777 1.00 0.00 N ATOM 506 CA GLU A 31 5.144 -0.533 -11.169 1.00 0.00 C ATOM 507 C GLU A 31 4.894 0.928 -11.545 1.00 0.00 C ATOM 508 O GLU A 31 5.601 1.798 -11.071 1.00 0.00 O ATOM 509 CB GLU A 31 5.841 -1.293 -12.313 1.00 0.00 C ATOM 510 CG GLU A 31 5.143 -1.236 -13.681 1.00 0.00 C ATOM 511 CD GLU A 31 5.737 -0.179 -14.607 1.00 0.00 C ATOM 512 OE1 GLU A 31 6.946 -0.295 -14.880 1.00 0.00 O ATOM 513 OE2 GLU A 31 4.956 0.677 -15.093 1.00 0.00 O ATOM 0 H GLU A 31 3.640 -1.992 -11.367 1.00 0.00 H new ATOM 0 HA GLU A 31 5.815 -0.551 -10.310 1.00 0.00 H new ATOM 0 HB2 GLU A 31 6.850 -0.896 -12.425 1.00 0.00 H new ATOM 0 HB3 GLU A 31 5.940 -2.338 -12.021 1.00 0.00 H new ATOM 0 HG2 GLU A 31 5.213 -2.213 -14.160 1.00 0.00 H new ATOM 0 HG3 GLU A 31 4.083 -1.029 -13.534 1.00 0.00 H new ATOM 520 N SER A 32 3.743 1.211 -12.139 1.00 0.00 N ATOM 521 CA SER A 32 3.361 2.588 -12.497 1.00 0.00 C ATOM 522 C SER A 32 2.825 3.370 -11.298 1.00 0.00 C ATOM 523 O SER A 32 3.300 4.461 -11.012 1.00 0.00 O ATOM 524 CB SER A 32 2.328 2.603 -13.617 1.00 0.00 C ATOM 525 OG SER A 32 1.827 3.929 -13.814 1.00 0.00 O ATOM 0 H SER A 32 3.048 0.507 -12.388 1.00 0.00 H new ATOM 0 HA SER A 32 4.272 3.077 -12.843 1.00 0.00 H new ATOM 0 HB2 SER A 32 2.777 2.236 -14.540 1.00 0.00 H new ATOM 0 HB3 SER A 32 1.507 1.929 -13.372 1.00 0.00 H new ATOM 0 HG SER A 32 1.166 3.925 -14.537 1.00 0.00 H new ATOM 531 N ASN A 33 1.932 2.745 -10.526 1.00 0.00 N ATOM 532 CA ASN A 33 1.367 3.336 -9.281 1.00 0.00 C ATOM 533 C ASN A 33 2.461 3.814 -8.340 1.00 0.00 C ATOM 534 O ASN A 33 2.456 4.951 -7.877 1.00 0.00 O ATOM 535 CB ASN A 33 0.502 2.343 -8.499 1.00 0.00 C ATOM 536 CG ASN A 33 -0.986 2.442 -8.870 1.00 0.00 C ATOM 537 OD1 ASN A 33 -1.606 3.494 -8.828 1.00 0.00 O ATOM 538 ND2 ASN A 33 -1.599 1.309 -9.137 1.00 0.00 N ATOM 0 H ASN A 33 1.572 1.814 -10.735 1.00 0.00 H new ATOM 0 HA ASN A 33 0.755 4.173 -9.617 1.00 0.00 H new ATOM 0 HB2 ASN A 33 0.854 1.329 -8.690 1.00 0.00 H new ATOM 0 HB3 ASN A 33 0.620 2.525 -7.431 1.00 0.00 H new ATOM 0 HD21 ASN A 33 -2.604 1.302 -9.312 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -1.069 0.438 -9.169 1.00 0.00 H new ATOM 545 N SER A 34 3.459 2.940 -8.165 1.00 0.00 N ATOM 546 CA SER A 34 4.646 3.242 -7.352 1.00 0.00 C ATOM 547 C SER A 34 5.502 4.365 -7.971 1.00 0.00 C ATOM 548 O SER A 34 5.823 5.307 -7.261 1.00 0.00 O ATOM 549 CB SER A 34 5.502 1.996 -7.124 1.00 0.00 C ATOM 550 OG SER A 34 6.026 1.442 -8.329 1.00 0.00 O ATOM 0 H SER A 34 3.468 2.008 -8.580 1.00 0.00 H new ATOM 0 HA SER A 34 4.278 3.592 -6.388 1.00 0.00 H new ATOM 0 HB2 SER A 34 6.328 2.248 -6.459 1.00 0.00 H new ATOM 0 HB3 SER A 34 4.903 1.240 -6.616 1.00 0.00 H new ATOM 0 HG SER A 34 5.598 1.871 -9.099 1.00 0.00 H new ATOM 556 N HIS A 35 5.544 4.400 -9.291 1.00 0.00 N ATOM 557 CA HIS A 35 6.237 5.453 -10.061 1.00 0.00 C ATOM 558 C HIS A 35 5.376 6.718 -10.234 1.00 0.00 C ATOM 559 O HIS A 35 5.783 7.682 -10.880 1.00 0.00 O ATOM 560 CB HIS A 35 6.653 4.886 -11.429 1.00 0.00 C ATOM 561 CG HIS A 35 7.673 3.726 -11.370 1.00 0.00 C ATOM 562 ND1 HIS A 35 8.200 3.154 -12.443 1.00 0.00 N ATOM 563 CD2 HIS A 35 8.062 3.004 -10.324 1.00 0.00 C ATOM 564 CE1 HIS A 35 8.877 2.071 -12.072 1.00 0.00 C ATOM 565 NE2 HIS A 35 8.777 1.984 -10.751 1.00 0.00 N ATOM 0 H HIS A 35 5.097 3.696 -9.878 1.00 0.00 H new ATOM 0 HA HIS A 35 7.121 5.756 -9.500 1.00 0.00 H new ATOM 0 HB2 HIS A 35 5.760 4.539 -11.949 1.00 0.00 H new ATOM 0 HB3 HIS A 35 7.077 5.693 -12.027 1.00 0.00 H new ATOM 0 HD2 HIS A 35 7.829 3.219 -9.291 1.00 0.00 H new ATOM 0 HE1 HIS A 35 9.408 1.391 -12.722 1.00 0.00 H new ATOM 0 HE2 HIS A 35 9.184 1.253 -10.167 1.00 0.00 H new ATOM 574 N HIS A 36 4.213 6.722 -9.584 1.00 0.00 N ATOM 575 CA HIS A 36 3.257 7.848 -9.605 1.00 0.00 C ATOM 576 C HIS A 36 3.285 8.565 -8.245 1.00 0.00 C ATOM 577 O HIS A 36 3.609 9.747 -8.177 1.00 0.00 O ATOM 578 CB HIS A 36 1.860 7.329 -9.927 1.00 0.00 C ATOM 579 CG HIS A 36 1.297 7.961 -11.208 1.00 0.00 C ATOM 580 ND1 HIS A 36 0.252 8.789 -11.256 1.00 0.00 N ATOM 581 CD2 HIS A 36 1.737 7.781 -12.439 1.00 0.00 C ATOM 582 CE1 HIS A 36 0.044 9.115 -12.532 1.00 0.00 C ATOM 583 NE2 HIS A 36 0.968 8.499 -13.255 1.00 0.00 N ATOM 0 H HIS A 36 3.896 5.935 -9.017 1.00 0.00 H new ATOM 0 HA HIS A 36 3.539 8.563 -10.378 1.00 0.00 H new ATOM 0 HB2 HIS A 36 1.892 6.245 -10.040 1.00 0.00 H new ATOM 0 HB3 HIS A 36 1.192 7.542 -9.093 1.00 0.00 H new ATOM 0 HD2 HIS A 36 2.572 7.162 -12.732 1.00 0.00 H new ATOM 0 HE1 HIS A 36 -0.735 9.762 -12.907 1.00 0.00 H new ATOM 0 HE2 HIS A 36 1.073 8.564 -14.268 1.00 0.00 H new ATOM 592 N ALA A 37 3.031 7.798 -7.185 1.00 0.00 N ATOM 593 CA ALA A 37 3.127 8.310 -5.813 1.00 0.00 C ATOM 594 C ALA A 37 4.531 8.843 -5.475 1.00 0.00 C ATOM 595 O ALA A 37 5.509 8.344 -6.016 1.00 0.00 O ATOM 596 CB ALA A 37 2.752 7.198 -4.832 1.00 0.00 C ATOM 0 H ALA A 37 2.756 6.818 -7.248 1.00 0.00 H new ATOM 0 HA ALA A 37 2.436 9.148 -5.728 1.00 0.00 H new ATOM 0 HB1 ALA A 37 2.822 7.574 -3.811 1.00 0.00 H new ATOM 0 HB2 ALA A 37 1.732 6.869 -5.028 1.00 0.00 H new ATOM 0 HB3 ALA A 37 3.435 6.357 -4.956 1.00 0.00 H new ATOM 602 N PRO A 38 4.608 9.897 -4.636 1.00 0.00 N ATOM 603 CA PRO A 38 5.881 10.495 -4.243 1.00 0.00 C ATOM 604 C PRO A 38 6.609 9.553 -3.280 1.00 0.00 C ATOM 605 O PRO A 38 6.019 8.691 -2.643 1.00 0.00 O ATOM 606 CB PRO A 38 5.535 11.834 -3.588 1.00 0.00 C ATOM 607 CG PRO A 38 4.098 11.688 -3.083 1.00 0.00 C ATOM 608 CD PRO A 38 3.498 10.594 -3.961 1.00 0.00 C ATOM 0 HA PRO A 38 6.549 10.656 -5.089 1.00 0.00 H new ATOM 0 HB2 PRO A 38 6.218 12.057 -2.768 1.00 0.00 H new ATOM 0 HB3 PRO A 38 5.618 12.653 -4.303 1.00 0.00 H new ATOM 0 HG2 PRO A 38 4.073 11.410 -2.029 1.00 0.00 H new ATOM 0 HG3 PRO A 38 3.546 12.623 -3.179 1.00 0.00 H new ATOM 0 HD2 PRO A 38 2.919 9.895 -3.358 1.00 0.00 H new ATOM 0 HD3 PRO A 38 2.815 11.024 -4.694 1.00 0.00 H new ATOM 616 N LEU A 39 7.898 9.762 -3.205 1.00 0.00 N ATOM 617 CA LEU A 39 8.765 8.957 -2.341 1.00 0.00 C ATOM 618 C LEU A 39 8.974 9.615 -0.979 1.00 0.00 C ATOM 619 O LEU A 39 9.948 10.338 -0.737 1.00 0.00 O ATOM 620 CB LEU A 39 10.079 8.770 -3.070 1.00 0.00 C ATOM 621 CG LEU A 39 10.016 7.645 -4.098 1.00 0.00 C ATOM 622 CD1 LEU A 39 11.245 7.779 -5.003 1.00 0.00 C ATOM 623 CD2 LEU A 39 9.888 6.285 -3.413 1.00 0.00 C ATOM 0 H LEU A 39 8.387 10.486 -3.731 1.00 0.00 H new ATOM 0 HA LEU A 39 8.300 7.992 -2.139 1.00 0.00 H new ATOM 0 HB2 LEU A 39 10.351 9.700 -3.569 1.00 0.00 H new ATOM 0 HB3 LEU A 39 10.866 8.555 -2.347 1.00 0.00 H new ATOM 0 HG LEU A 39 9.125 7.721 -4.721 1.00 0.00 H new ATOM 0 HD11 LEU A 39 11.233 6.988 -5.753 1.00 0.00 H new ATOM 0 HD12 LEU A 39 11.227 8.749 -5.499 1.00 0.00 H new ATOM 0 HD13 LEU A 39 12.150 7.695 -4.402 1.00 0.00 H new ATOM 0 HD21 LEU A 39 9.845 5.500 -4.168 1.00 0.00 H new ATOM 0 HD22 LEU A 39 10.750 6.120 -2.767 1.00 0.00 H new ATOM 0 HD23 LEU A 39 8.977 6.263 -2.815 1.00 0.00 H new ATOM 635 N SER A 40 7.987 9.389 -0.124 1.00 0.00 N ATOM 636 CA SER A 40 7.945 9.997 1.214 1.00 0.00 C ATOM 637 C SER A 40 6.954 9.269 2.119 1.00 0.00 C ATOM 638 O SER A 40 5.777 9.126 1.793 1.00 0.00 O ATOM 639 CB SER A 40 7.605 11.493 1.143 1.00 0.00 C ATOM 640 OG SER A 40 6.647 11.767 0.106 1.00 0.00 O ATOM 0 H SER A 40 7.192 8.783 -0.329 1.00 0.00 H new ATOM 0 HA SER A 40 8.942 9.898 1.644 1.00 0.00 H new ATOM 0 HB2 SER A 40 7.208 11.823 2.103 1.00 0.00 H new ATOM 0 HB3 SER A 40 8.514 12.066 0.960 1.00 0.00 H new ATOM 0 HG SER A 40 6.450 12.727 0.088 1.00 0.00 H new ATOM 646 N ASP A 41 7.501 8.782 3.229 1.00 0.00 N ATOM 647 CA ASP A 41 6.696 8.057 4.222 1.00 0.00 C ATOM 648 C ASP A 41 5.818 9.066 4.970 1.00 0.00 C ATOM 649 O ASP A 41 6.350 10.015 5.536 1.00 0.00 O ATOM 650 CB ASP A 41 7.603 7.327 5.213 1.00 0.00 C ATOM 651 CG ASP A 41 6.808 6.755 6.403 1.00 0.00 C ATOM 652 OD1 ASP A 41 5.673 6.308 6.189 1.00 0.00 O ATOM 653 OD2 ASP A 41 7.335 6.802 7.522 1.00 0.00 O ATOM 0 H ASP A 41 8.489 8.872 3.467 1.00 0.00 H new ATOM 0 HA ASP A 41 6.074 7.318 3.717 1.00 0.00 H new ATOM 0 HB2 ASP A 41 8.123 6.518 4.701 1.00 0.00 H new ATOM 0 HB3 ASP A 41 8.365 8.013 5.582 1.00 0.00 H new ATOM 658 N GLY A 42 4.529 8.754 5.020 1.00 0.00 N ATOM 659 CA GLY A 42 3.523 9.565 5.744 1.00 0.00 C ATOM 660 C GLY A 42 3.736 11.061 5.513 1.00 0.00 C ATOM 661 O GLY A 42 4.274 11.767 6.379 1.00 0.00 O ATOM 0 H GLY A 42 4.137 7.931 4.562 1.00 0.00 H new ATOM 0 HA2 GLY A 42 2.523 9.284 5.415 1.00 0.00 H new ATOM 0 HA3 GLY A 42 3.580 9.349 6.811 1.00 0.00 H new ATOM 665 N LYS A 43 3.501 11.454 4.274 1.00 0.00 N ATOM 666 CA LYS A 43 3.685 12.859 3.853 1.00 0.00 C ATOM 667 C LYS A 43 2.711 13.254 2.732 1.00 0.00 C ATOM 668 O LYS A 43 2.943 14.147 1.928 1.00 0.00 O ATOM 669 CB LYS A 43 5.140 13.069 3.440 1.00 0.00 C ATOM 670 CG LYS A 43 5.627 14.436 3.936 1.00 0.00 C ATOM 671 CD LYS A 43 7.058 14.765 3.523 1.00 0.00 C ATOM 672 CE LYS A 43 8.084 14.393 4.594 1.00 0.00 C ATOM 673 NZ LYS A 43 9.364 15.061 4.286 1.00 0.00 N ATOM 0 H LYS A 43 3.182 10.832 3.532 1.00 0.00 H new ATOM 0 HA LYS A 43 3.456 13.513 4.694 1.00 0.00 H new ATOM 0 HB2 LYS A 43 5.764 12.278 3.856 1.00 0.00 H new ATOM 0 HB3 LYS A 43 5.232 13.011 2.355 1.00 0.00 H new ATOM 0 HG2 LYS A 43 4.961 15.210 3.553 1.00 0.00 H new ATOM 0 HG3 LYS A 43 5.557 14.464 5.023 1.00 0.00 H new ATOM 0 HD2 LYS A 43 7.295 14.237 2.600 1.00 0.00 H new ATOM 0 HD3 LYS A 43 7.134 15.831 3.309 1.00 0.00 H new ATOM 0 HE2 LYS A 43 7.728 14.697 5.578 1.00 0.00 H new ATOM 0 HE3 LYS A 43 8.221 13.312 4.625 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 10.068 14.813 5.010 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 9.702 14.750 3.353 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 9.224 16.092 4.277 1.00 0.00 H new ATOM 687 N THR A 44 1.576 12.579 2.762 1.00 0.00 N ATOM 688 CA THR A 44 0.561 12.780 1.714 1.00 0.00 C ATOM 689 C THR A 44 -0.805 12.697 2.381 1.00 0.00 C ATOM 690 O THR A 44 -0.931 12.346 3.553 1.00 0.00 O ATOM 691 CB THR A 44 0.741 11.736 0.620 1.00 0.00 C ATOM 692 OG1 THR A 44 2.109 11.302 0.581 1.00 0.00 O ATOM 693 CG2 THR A 44 0.443 12.316 -0.752 1.00 0.00 C ATOM 0 H THR A 44 1.326 11.898 3.479 1.00 0.00 H new ATOM 0 HA THR A 44 0.661 13.754 1.235 1.00 0.00 H new ATOM 0 HB THR A 44 0.058 10.917 0.847 1.00 0.00 H new ATOM 0 HG1 THR A 44 2.144 10.349 0.355 1.00 0.00 H new ATOM 0 HG21 THR A 44 0.581 11.545 -1.511 1.00 0.00 H new ATOM 0 HG22 THR A 44 -0.586 12.673 -0.780 1.00 0.00 H new ATOM 0 HG23 THR A 44 1.121 13.146 -0.951 1.00 0.00 H new ATOM 701 N GLY A 45 -1.812 13.028 1.593 1.00 0.00 N ATOM 702 CA GLY A 45 -3.196 13.077 2.065 1.00 0.00 C ATOM 703 C GLY A 45 -3.646 11.790 2.760 1.00 0.00 C ATOM 704 O GLY A 45 -3.765 11.717 3.985 1.00 0.00 O ATOM 0 H GLY A 45 -1.700 13.271 0.609 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -3.307 13.913 2.756 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -3.854 13.274 1.219 1.00 0.00 H new ATOM 708 N SER A 46 -3.745 10.732 1.966 1.00 0.00 N ATOM 709 CA SER A 46 -4.070 9.404 2.495 1.00 0.00 C ATOM 710 C SER A 46 -2.986 8.865 3.443 1.00 0.00 C ATOM 711 O SER A 46 -3.189 7.776 3.997 1.00 0.00 O ATOM 712 CB SER A 46 -4.243 8.373 1.391 1.00 0.00 C ATOM 713 OG SER A 46 -2.975 8.017 0.834 1.00 0.00 O ATOM 0 H SER A 46 -3.606 10.762 0.956 1.00 0.00 H new ATOM 0 HA SER A 46 -5.005 9.545 3.036 1.00 0.00 H new ATOM 0 HB2 SER A 46 -4.734 7.485 1.789 1.00 0.00 H new ATOM 0 HB3 SER A 46 -4.890 8.773 0.610 1.00 0.00 H new ATOM 0 HG SER A 46 -2.539 8.818 0.475 1.00 0.00 H new ATOM 719 N SER A 47 -1.843 9.561 3.507 1.00 0.00 N ATOM 720 CA SER A 47 -0.640 9.243 4.311 1.00 0.00 C ATOM 721 C SER A 47 0.314 8.325 3.530 1.00 0.00 C ATOM 722 O SER A 47 1.465 8.098 3.896 1.00 0.00 O ATOM 723 CB SER A 47 -1.041 8.626 5.650 1.00 0.00 C ATOM 724 OG SER A 47 -0.056 8.699 6.666 1.00 0.00 O ATOM 0 H SER A 47 -1.719 10.417 2.967 1.00 0.00 H new ATOM 0 HA SER A 47 -0.105 10.170 4.517 1.00 0.00 H new ATOM 0 HB2 SER A 47 -1.944 9.123 6.005 1.00 0.00 H new ATOM 0 HB3 SER A 47 -1.296 7.579 5.488 1.00 0.00 H new ATOM 0 HG SER A 47 -0.399 8.283 7.484 1.00 0.00 H new ATOM 730 N TYR A 48 -0.165 7.908 2.363 1.00 0.00 N ATOM 731 CA TYR A 48 0.532 7.007 1.439 1.00 0.00 C ATOM 732 C TYR A 48 1.446 7.776 0.469 1.00 0.00 C ATOM 733 O TYR A 48 1.055 8.839 -0.012 1.00 0.00 O ATOM 734 CB TYR A 48 -0.483 6.149 0.699 1.00 0.00 C ATOM 735 CG TYR A 48 -1.181 5.169 1.639 1.00 0.00 C ATOM 736 CD1 TYR A 48 -2.372 5.570 2.270 1.00 0.00 C ATOM 737 CD2 TYR A 48 -0.682 3.858 1.804 1.00 0.00 C ATOM 738 CE1 TYR A 48 -3.096 4.670 3.062 1.00 0.00 C ATOM 739 CE2 TYR A 48 -1.425 2.935 2.562 1.00 0.00 C ATOM 740 CZ TYR A 48 -2.613 3.357 3.196 1.00 0.00 C ATOM 741 OH TYR A 48 -3.282 2.466 3.970 1.00 0.00 O ATOM 0 H TYR A 48 -1.081 8.195 2.018 1.00 0.00 H new ATOM 0 HA TYR A 48 1.184 6.353 2.018 1.00 0.00 H new ATOM 0 HB2 TYR A 48 -1.225 6.790 0.224 1.00 0.00 H new ATOM 0 HB3 TYR A 48 0.017 5.597 -0.097 1.00 0.00 H new ATOM 0 HD1 TYR A 48 -2.731 6.580 2.143 1.00 0.00 H new ATOM 0 HD2 TYR A 48 0.256 3.568 1.355 1.00 0.00 H new ATOM 0 HE1 TYR A 48 -4.004 4.978 3.558 1.00 0.00 H new ATOM 0 HE2 TYR A 48 -1.089 1.913 2.658 1.00 0.00 H new ATOM 0 HH TYR A 48 -4.071 2.898 4.359 1.00 0.00 H new ATOM 751 N PRO A 49 2.569 7.166 0.053 1.00 0.00 N ATOM 752 CA PRO A 49 2.992 5.815 0.466 1.00 0.00 C ATOM 753 C PRO A 49 3.605 5.831 1.856 1.00 0.00 C ATOM 754 O PRO A 49 4.301 6.766 2.254 1.00 0.00 O ATOM 755 CB PRO A 49 3.940 5.334 -0.621 1.00 0.00 C ATOM 756 CG PRO A 49 4.489 6.611 -1.237 1.00 0.00 C ATOM 757 CD PRO A 49 3.460 7.718 -0.972 1.00 0.00 C ATOM 0 HA PRO A 49 2.154 5.124 0.557 1.00 0.00 H new ATOM 0 HB2 PRO A 49 4.738 4.717 -0.208 1.00 0.00 H new ATOM 0 HB3 PRO A 49 3.420 4.727 -1.362 1.00 0.00 H new ATOM 0 HG2 PRO A 49 5.453 6.868 -0.797 1.00 0.00 H new ATOM 0 HG3 PRO A 49 4.651 6.484 -2.307 1.00 0.00 H new ATOM 0 HD2 PRO A 49 3.943 8.632 -0.625 1.00 0.00 H new ATOM 0 HD3 PRO A 49 2.910 7.972 -1.878 1.00 0.00 H new ATOM 765 N HIS A 50 3.048 4.940 2.661 1.00 0.00 N ATOM 766 CA HIS A 50 3.511 4.806 4.044 1.00 0.00 C ATOM 767 C HIS A 50 4.574 3.709 4.096 1.00 0.00 C ATOM 768 O HIS A 50 4.510 2.719 3.359 1.00 0.00 O ATOM 769 CB HIS A 50 2.340 4.536 4.997 1.00 0.00 C ATOM 770 CG HIS A 50 1.829 3.089 4.981 1.00 0.00 C ATOM 771 ND1 HIS A 50 1.684 2.309 6.047 1.00 0.00 N ATOM 772 CD2 HIS A 50 1.351 2.425 3.947 1.00 0.00 C ATOM 773 CE1 HIS A 50 1.092 1.181 5.669 1.00 0.00 C ATOM 774 NE2 HIS A 50 0.876 1.257 4.364 1.00 0.00 N ATOM 0 H HIS A 50 2.292 4.310 2.395 1.00 0.00 H new ATOM 0 HA HIS A 50 3.959 5.741 4.381 1.00 0.00 H new ATOM 0 HB2 HIS A 50 2.648 4.788 6.012 1.00 0.00 H new ATOM 0 HB3 HIS A 50 1.517 5.202 4.739 1.00 0.00 H new ATOM 0 HD1 HIS A 50 1.978 2.538 6.997 1.00 0.00 H new ATOM 0 HD2 HIS A 50 1.346 2.775 2.925 1.00 0.00 H new ATOM 0 HE1 HIS A 50 0.833 0.351 6.310 1.00 0.00 H new ATOM 783 N TRP A 51 5.611 3.991 4.869 1.00 0.00 N ATOM 784 CA TRP A 51 6.714 3.052 5.121 1.00 0.00 C ATOM 785 C TRP A 51 6.108 1.721 5.561 1.00 0.00 C ATOM 786 O TRP A 51 5.179 1.634 6.357 1.00 0.00 O ATOM 787 CB TRP A 51 7.677 3.564 6.193 1.00 0.00 C ATOM 788 CG TRP A 51 8.618 2.507 6.779 1.00 0.00 C ATOM 789 CD1 TRP A 51 9.520 1.770 6.135 1.00 0.00 C ATOM 790 CD2 TRP A 51 8.648 2.124 8.111 1.00 0.00 C ATOM 791 NE1 TRP A 51 10.133 0.950 6.989 1.00 0.00 N ATOM 792 CE2 TRP A 51 9.649 1.139 8.211 1.00 0.00 C ATOM 793 CE3 TRP A 51 7.986 2.588 9.264 1.00 0.00 C ATOM 794 CZ2 TRP A 51 10.020 0.608 9.467 1.00 0.00 C ATOM 795 CZ3 TRP A 51 8.360 2.079 10.524 1.00 0.00 C ATOM 796 CH2 TRP A 51 9.361 1.087 10.612 1.00 0.00 C ATOM 0 H TRP A 51 5.720 4.885 5.348 1.00 0.00 H new ATOM 0 HA TRP A 51 7.294 2.938 4.205 1.00 0.00 H new ATOM 0 HB2 TRP A 51 8.278 4.367 5.766 1.00 0.00 H new ATOM 0 HB3 TRP A 51 7.094 4.000 7.005 1.00 0.00 H new ATOM 0 HD1 TRP A 51 9.725 1.828 5.076 1.00 0.00 H new ATOM 0 HE1 TRP A 51 10.862 0.280 6.742 1.00 0.00 H new ATOM 0 HE3 TRP A 51 7.201 3.325 9.184 1.00 0.00 H new ATOM 0 HZ2 TRP A 51 10.789 -0.146 9.545 1.00 0.00 H new ATOM 0 HZ3 TRP A 51 7.882 2.447 11.420 1.00 0.00 H new ATOM 0 HH2 TRP A 51 9.626 0.688 11.580 1.00 0.00 H new ATOM 807 N PHE A 52 6.650 0.725 4.899 1.00 0.00 N ATOM 808 CA PHE A 52 6.284 -0.657 5.102 1.00 0.00 C ATOM 809 C PHE A 52 7.340 -1.298 5.973 1.00 0.00 C ATOM 810 O PHE A 52 8.294 -1.910 5.498 1.00 0.00 O ATOM 811 CB PHE A 52 6.209 -1.360 3.755 1.00 0.00 C ATOM 812 CG PHE A 52 5.750 -2.812 3.908 1.00 0.00 C ATOM 813 CD1 PHE A 52 4.925 -3.227 4.988 1.00 0.00 C ATOM 814 CD2 PHE A 52 6.109 -3.703 2.892 1.00 0.00 C ATOM 815 CE1 PHE A 52 4.434 -4.538 5.039 1.00 0.00 C ATOM 816 CE2 PHE A 52 5.624 -5.027 2.934 1.00 0.00 C ATOM 817 CZ PHE A 52 4.803 -5.421 4.017 1.00 0.00 C ATOM 0 H PHE A 52 7.372 0.856 4.190 1.00 0.00 H new ATOM 0 HA PHE A 52 5.311 -0.733 5.587 1.00 0.00 H new ATOM 0 HB2 PHE A 52 5.519 -0.826 3.102 1.00 0.00 H new ATOM 0 HB3 PHE A 52 7.187 -1.335 3.275 1.00 0.00 H new ATOM 0 HD1 PHE A 52 4.675 -2.529 5.773 1.00 0.00 H new ATOM 0 HD2 PHE A 52 6.750 -3.381 2.085 1.00 0.00 H new ATOM 0 HE1 PHE A 52 3.789 -4.859 5.844 1.00 0.00 H new ATOM 0 HE2 PHE A 52 5.875 -5.729 2.152 1.00 0.00 H new ATOM 0 HZ PHE A 52 4.448 -6.440 4.057 1.00 0.00 H new ATOM 827 N THR A 53 7.039 -1.214 7.271 1.00 0.00 N ATOM 828 CA THR A 53 7.828 -1.878 8.323 1.00 0.00 C ATOM 829 C THR A 53 8.261 -3.275 7.881 1.00 0.00 C ATOM 830 O THR A 53 9.433 -3.634 7.979 1.00 0.00 O ATOM 831 CB THR A 53 7.032 -1.988 9.635 1.00 0.00 C ATOM 832 OG1 THR A 53 5.871 -2.775 9.421 1.00 0.00 O ATOM 833 CG2 THR A 53 6.508 -0.649 10.150 1.00 0.00 C ATOM 0 H THR A 53 6.243 -0.685 7.627 1.00 0.00 H new ATOM 0 HA THR A 53 8.712 -1.264 8.496 1.00 0.00 H new ATOM 0 HB THR A 53 7.729 -2.414 10.356 1.00 0.00 H new ATOM 0 HG1 THR A 53 5.365 -2.846 10.257 1.00 0.00 H new ATOM 0 HG21 THR A 53 5.957 -0.806 11.077 1.00 0.00 H new ATOM 0 HG22 THR A 53 7.346 0.023 10.335 1.00 0.00 H new ATOM 0 HG23 THR A 53 5.846 -0.207 9.406 1.00 0.00 H new ATOM 841 N ASN A 54 7.323 -3.981 7.236 1.00 0.00 N ATOM 842 CA ASN A 54 7.520 -5.353 6.719 1.00 0.00 C ATOM 843 C ASN A 54 8.044 -6.272 7.832 1.00 0.00 C ATOM 844 O ASN A 54 8.779 -7.216 7.588 1.00 0.00 O ATOM 845 CB ASN A 54 8.458 -5.289 5.503 1.00 0.00 C ATOM 846 CG ASN A 54 8.135 -6.381 4.478 1.00 0.00 C ATOM 847 OD1 ASN A 54 7.123 -7.059 4.500 1.00 0.00 O ATOM 848 ND2 ASN A 54 9.056 -6.628 3.579 1.00 0.00 N ATOM 0 H ASN A 54 6.389 -3.614 7.053 1.00 0.00 H new ATOM 0 HA ASN A 54 6.573 -5.782 6.391 1.00 0.00 H new ATOM 0 HB2 ASN A 54 8.374 -4.310 5.030 1.00 0.00 H new ATOM 0 HB3 ASN A 54 9.491 -5.396 5.835 1.00 0.00 H new ATOM 0 HD21 ASN A 54 8.922 -7.382 2.906 1.00 0.00 H new ATOM 0 HD22 ASN A 54 9.907 -6.066 3.553 1.00 0.00 H new ATOM 855 N GLY A 55 7.758 -5.862 9.058 1.00 0.00 N ATOM 856 CA GLY A 55 8.263 -6.514 10.266 1.00 0.00 C ATOM 857 C GLY A 55 9.261 -5.601 10.993 1.00 0.00 C ATOM 858 O GLY A 55 9.206 -5.557 12.204 1.00 0.00 O ATOM 0 H GLY A 55 7.161 -5.057 9.249 1.00 0.00 H new ATOM 0 HA2 GLY A 55 7.433 -6.756 10.930 1.00 0.00 H new ATOM 0 HA3 GLY A 55 8.747 -7.455 10.003 1.00 0.00 H new ATOM 862 N TYR A 56 10.180 -4.947 10.292 1.00 0.00 N ATOM 863 CA TYR A 56 11.168 -4.010 10.883 1.00 0.00 C ATOM 864 C TYR A 56 10.536 -3.066 11.909 1.00 0.00 C ATOM 865 O TYR A 56 9.353 -2.752 11.846 1.00 0.00 O ATOM 866 CB TYR A 56 11.839 -3.187 9.781 1.00 0.00 C ATOM 867 CG TYR A 56 12.760 -4.051 8.922 1.00 0.00 C ATOM 868 CD1 TYR A 56 12.307 -4.714 7.755 1.00 0.00 C ATOM 869 CD2 TYR A 56 14.102 -4.100 9.319 1.00 0.00 C ATOM 870 CE1 TYR A 56 13.238 -5.421 6.961 1.00 0.00 C ATOM 871 CE2 TYR A 56 15.029 -4.808 8.534 1.00 0.00 C ATOM 872 CZ TYR A 56 14.591 -5.455 7.364 1.00 0.00 C ATOM 873 OH TYR A 56 15.549 -6.036 6.595 1.00 0.00 O ATOM 0 H TYR A 56 10.273 -5.044 9.281 1.00 0.00 H new ATOM 0 HA TYR A 56 11.910 -4.617 11.402 1.00 0.00 H new ATOM 0 HB2 TYR A 56 11.076 -2.729 9.152 1.00 0.00 H new ATOM 0 HB3 TYR A 56 12.412 -2.375 10.229 1.00 0.00 H new ATOM 0 HD1 TYR A 56 11.264 -4.680 7.476 1.00 0.00 H new ATOM 0 HD2 TYR A 56 14.422 -3.598 10.220 1.00 0.00 H new ATOM 0 HE1 TYR A 56 12.920 -5.927 6.061 1.00 0.00 H new ATOM 0 HE2 TYR A 56 16.068 -4.855 8.826 1.00 0.00 H new ATOM 0 HH TYR A 56 15.704 -5.489 5.796 1.00 0.00 H new ATOM 883 N ASP A 57 11.356 -2.686 12.888 1.00 0.00 N ATOM 884 CA ASP A 57 10.901 -1.745 13.941 1.00 0.00 C ATOM 885 C ASP A 57 10.918 -0.293 13.457 1.00 0.00 C ATOM 886 O ASP A 57 9.951 0.447 13.616 1.00 0.00 O ATOM 887 CB ASP A 57 11.735 -1.937 15.227 1.00 0.00 C ATOM 888 CG ASP A 57 13.168 -1.375 15.171 1.00 0.00 C ATOM 889 OD1 ASP A 57 13.910 -1.718 14.211 1.00 0.00 O ATOM 890 OD2 ASP A 57 13.422 -0.414 15.917 1.00 0.00 O ATOM 0 H ASP A 57 12.321 -3.001 12.984 1.00 0.00 H new ATOM 0 HA ASP A 57 9.862 -1.975 14.175 1.00 0.00 H new ATOM 0 HB2 ASP A 57 11.209 -1.464 16.056 1.00 0.00 H new ATOM 0 HB3 ASP A 57 11.789 -3.003 15.450 1.00 0.00 H new ATOM 895 N GLY A 58 12.058 0.048 12.875 1.00 0.00 N ATOM 896 CA GLY A 58 12.363 1.408 12.362 1.00 0.00 C ATOM 897 C GLY A 58 13.862 1.722 12.369 1.00 0.00 C ATOM 898 O GLY A 58 14.269 2.854 12.638 1.00 0.00 O ATOM 0 H GLY A 58 12.822 -0.613 12.735 1.00 0.00 H new ATOM 0 HA2 GLY A 58 11.981 1.502 11.345 1.00 0.00 H new ATOM 0 HA3 GLY A 58 11.839 2.146 12.969 1.00 0.00 H new ATOM 1029 N THR A 67 9.262 -11.561 10.626 1.00 0.00 N ATOM 1030 CA THR A 67 8.648 -12.220 9.461 1.00 0.00 C ATOM 1031 C THR A 67 8.548 -11.307 8.226 1.00 0.00 C ATOM 1032 O THR A 67 7.453 -11.011 7.726 1.00 0.00 O ATOM 1033 CB THR A 67 7.316 -12.885 9.877 1.00 0.00 C ATOM 1034 OG1 THR A 67 6.965 -13.801 8.846 1.00 0.00 O ATOM 1035 CG2 THR A 67 6.168 -11.911 10.196 1.00 0.00 C ATOM 0 HA THR A 67 9.313 -13.016 9.125 1.00 0.00 H new ATOM 0 HB THR A 67 7.474 -13.393 10.829 1.00 0.00 H new ATOM 0 HG1 THR A 67 6.122 -14.245 9.076 1.00 0.00 H new ATOM 0 HG21 THR A 67 5.279 -12.476 10.477 1.00 0.00 H new ATOM 0 HG22 THR A 67 6.461 -11.261 11.021 1.00 0.00 H new ATOM 0 HG23 THR A 67 5.950 -11.305 9.317 1.00 0.00 H new ATOM 1043 N PRO A 68 9.694 -10.790 7.763 1.00 0.00 N ATOM 1044 CA PRO A 68 9.698 -9.871 6.621 1.00 0.00 C ATOM 1045 C PRO A 68 9.424 -10.634 5.341 1.00 0.00 C ATOM 1046 O PRO A 68 10.075 -11.646 5.062 1.00 0.00 O ATOM 1047 CB PRO A 68 11.071 -9.183 6.638 1.00 0.00 C ATOM 1048 CG PRO A 68 11.985 -10.115 7.424 1.00 0.00 C ATOM 1049 CD PRO A 68 11.067 -11.051 8.220 1.00 0.00 C ATOM 0 HA PRO A 68 8.913 -9.117 6.681 1.00 0.00 H new ATOM 0 HB2 PRO A 68 11.445 -9.029 5.626 1.00 0.00 H new ATOM 0 HB3 PRO A 68 11.012 -8.202 7.109 1.00 0.00 H new ATOM 0 HG2 PRO A 68 12.631 -10.682 6.754 1.00 0.00 H new ATOM 0 HG3 PRO A 68 12.636 -9.549 8.091 1.00 0.00 H new ATOM 0 HD2 PRO A 68 11.339 -12.093 8.052 1.00 0.00 H new ATOM 0 HD3 PRO A 68 11.160 -10.866 9.290 1.00 0.00 H new ATOM 1057 N ILE A 69 8.394 -10.179 4.631 1.00 0.00 N ATOM 1058 CA ILE A 69 8.035 -10.790 3.337 1.00 0.00 C ATOM 1059 C ILE A 69 9.290 -10.845 2.448 1.00 0.00 C ATOM 1060 O ILE A 69 9.871 -9.821 2.111 1.00 0.00 O ATOM 1061 CB ILE A 69 6.832 -10.083 2.670 1.00 0.00 C ATOM 1062 CG1 ILE A 69 5.550 -10.492 3.401 1.00 0.00 C ATOM 1063 CG2 ILE A 69 6.771 -10.358 1.160 1.00 0.00 C ATOM 1064 CD1 ILE A 69 4.232 -10.024 2.757 1.00 0.00 C ATOM 0 H ILE A 69 7.797 -9.403 4.917 1.00 0.00 H new ATOM 0 HA ILE A 69 7.691 -11.812 3.498 1.00 0.00 H new ATOM 0 HB ILE A 69 6.950 -9.003 2.759 1.00 0.00 H new ATOM 0 HG12 ILE A 69 5.529 -11.579 3.477 1.00 0.00 H new ATOM 0 HG13 ILE A 69 5.594 -10.102 4.418 1.00 0.00 H new ATOM 0 HG21 ILE A 69 5.912 -9.843 0.731 1.00 0.00 H new ATOM 0 HG22 ILE A 69 7.684 -9.996 0.687 1.00 0.00 H new ATOM 0 HG23 ILE A 69 6.674 -11.430 0.989 1.00 0.00 H new ATOM 0 HD11 ILE A 69 3.391 -10.370 3.358 1.00 0.00 H new ATOM 0 HD12 ILE A 69 4.219 -8.935 2.706 1.00 0.00 H new ATOM 0 HD13 ILE A 69 4.152 -10.435 1.751 1.00 0.00 H new ATOM 1076 N LYS A 70 9.694 -12.072 2.165 1.00 0.00 N ATOM 1077 CA LYS A 70 10.848 -12.307 1.288 1.00 0.00 C ATOM 1078 C LYS A 70 10.384 -12.292 -0.173 1.00 0.00 C ATOM 1079 O LYS A 70 9.469 -13.010 -0.553 1.00 0.00 O ATOM 1080 CB LYS A 70 11.549 -13.623 1.658 1.00 0.00 C ATOM 1081 CG LYS A 70 12.772 -13.804 0.753 1.00 0.00 C ATOM 1082 CD LYS A 70 13.953 -14.473 1.457 1.00 0.00 C ATOM 1083 CE LYS A 70 15.218 -13.870 0.870 1.00 0.00 C ATOM 1084 NZ LYS A 70 16.282 -14.879 0.865 1.00 0.00 N ATOM 0 H LYS A 70 9.251 -12.919 2.522 1.00 0.00 H new ATOM 0 HA LYS A 70 11.581 -11.511 1.421 1.00 0.00 H new ATOM 0 HB2 LYS A 70 11.853 -13.607 2.705 1.00 0.00 H new ATOM 0 HB3 LYS A 70 10.864 -14.462 1.538 1.00 0.00 H new ATOM 0 HG2 LYS A 70 12.489 -14.402 -0.113 1.00 0.00 H new ATOM 0 HG3 LYS A 70 13.086 -12.829 0.379 1.00 0.00 H new ATOM 0 HD2 LYS A 70 13.908 -14.303 2.533 1.00 0.00 H new ATOM 0 HD3 LYS A 70 13.933 -15.552 1.304 1.00 0.00 H new ATOM 0 HE2 LYS A 70 15.030 -13.519 -0.145 1.00 0.00 H new ATOM 0 HE3 LYS A 70 15.526 -13.003 1.455 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 17.149 -14.468 0.463 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 16.467 -15.193 1.839 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 15.986 -15.693 0.289 1.00 0.00 H new ATOM 1098 N PHE A 71 11.069 -11.456 -0.934 1.00 0.00 N ATOM 1099 CA PHE A 71 10.778 -11.252 -2.362 1.00 0.00 C ATOM 1100 C PHE A 71 11.828 -11.938 -3.243 1.00 0.00 C ATOM 1101 O PHE A 71 11.528 -12.482 -4.303 1.00 0.00 O ATOM 1102 CB PHE A 71 10.745 -9.747 -2.676 1.00 0.00 C ATOM 1103 CG PHE A 71 9.815 -8.972 -1.741 1.00 0.00 C ATOM 1104 CD1 PHE A 71 8.451 -8.820 -2.071 1.00 0.00 C ATOM 1105 CD2 PHE A 71 10.349 -8.375 -0.576 1.00 0.00 C ATOM 1106 CE1 PHE A 71 7.617 -8.044 -1.236 1.00 0.00 C ATOM 1107 CE2 PHE A 71 9.515 -7.599 0.260 1.00 0.00 C ATOM 1108 CZ PHE A 71 8.150 -7.454 -0.083 1.00 0.00 C ATOM 0 H PHE A 71 11.846 -10.893 -0.588 1.00 0.00 H new ATOM 0 HA PHE A 71 9.806 -11.695 -2.578 1.00 0.00 H new ATOM 0 HB2 PHE A 71 11.754 -9.341 -2.598 1.00 0.00 H new ATOM 0 HB3 PHE A 71 10.422 -9.602 -3.707 1.00 0.00 H new ATOM 0 HD1 PHE A 71 8.048 -9.293 -2.955 1.00 0.00 H new ATOM 0 HD2 PHE A 71 11.391 -8.512 -0.326 1.00 0.00 H new ATOM 0 HE1 PHE A 71 6.575 -7.906 -1.485 1.00 0.00 H new ATOM 0 HE2 PHE A 71 9.912 -7.125 1.145 1.00 0.00 H new ATOM 0 HZ PHE A 71 7.504 -6.875 0.560 1.00 0.00 H new ATOM 1118 N GLY A 72 13.074 -11.883 -2.760 1.00 0.00 N ATOM 1119 CA GLY A 72 14.255 -12.434 -3.443 1.00 0.00 C ATOM 1120 C GLY A 72 15.206 -11.337 -3.942 1.00 0.00 C ATOM 1121 O GLY A 72 16.116 -11.575 -4.723 1.00 0.00 O ATOM 0 H GLY A 72 13.297 -11.446 -1.866 1.00 0.00 H new ATOM 0 HA2 GLY A 72 14.791 -13.094 -2.761 1.00 0.00 H new ATOM 0 HA3 GLY A 72 13.932 -13.043 -4.287 1.00 0.00 H new ATOM 1125 N LYS A 73 15.004 -10.138 -3.399 1.00 0.00 N ATOM 1126 CA LYS A 73 15.878 -9.000 -3.686 1.00 0.00 C ATOM 1127 C LYS A 73 16.814 -8.731 -2.507 1.00 0.00 C ATOM 1128 O LYS A 73 16.506 -9.051 -1.362 1.00 0.00 O ATOM 1129 CB LYS A 73 15.051 -7.761 -4.034 1.00 0.00 C ATOM 1130 CG LYS A 73 14.729 -7.674 -5.532 1.00 0.00 C ATOM 1131 CD LYS A 73 16.015 -7.491 -6.339 1.00 0.00 C ATOM 1132 CE LYS A 73 15.703 -6.955 -7.734 1.00 0.00 C ATOM 1133 NZ LYS A 73 16.268 -7.794 -8.781 1.00 0.00 N ATOM 0 H LYS A 73 14.241 -9.928 -2.756 1.00 0.00 H new ATOM 0 HA LYS A 73 16.494 -9.244 -4.552 1.00 0.00 H new ATOM 0 HB2 LYS A 73 14.121 -7.777 -3.466 1.00 0.00 H new ATOM 0 HB3 LYS A 73 15.595 -6.867 -3.730 1.00 0.00 H new ATOM 0 HG2 LYS A 73 14.215 -8.580 -5.854 1.00 0.00 H new ATOM 0 HG3 LYS A 73 14.052 -6.840 -5.718 1.00 0.00 H new ATOM 0 HD2 LYS A 73 16.682 -6.802 -5.820 1.00 0.00 H new ATOM 0 HD3 LYS A 73 16.539 -8.443 -6.418 1.00 0.00 H new ATOM 0 HE2 LYS A 73 14.623 -6.891 -7.864 1.00 0.00 H new ATOM 0 HE3 LYS A 73 16.096 -5.943 -7.829 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 16.032 -7.394 -9.712 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 17.302 -7.835 -8.673 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 15.874 -8.754 -8.707 1.00 0.00 H new ATOM 1147 N SER A 74 17.918 -8.073 -2.842 1.00 0.00 N ATOM 1148 CA SER A 74 18.940 -7.722 -1.848 1.00 0.00 C ATOM 1149 C SER A 74 18.673 -6.348 -1.219 1.00 0.00 C ATOM 1150 O SER A 74 18.932 -6.157 -0.045 1.00 0.00 O ATOM 1151 CB SER A 74 20.330 -7.728 -2.491 1.00 0.00 C ATOM 1152 OG SER A 74 21.254 -8.283 -1.552 1.00 0.00 O ATOM 0 H SER A 74 18.133 -7.770 -3.792 1.00 0.00 H new ATOM 0 HA SER A 74 18.897 -8.472 -1.058 1.00 0.00 H new ATOM 0 HB2 SER A 74 20.322 -8.316 -3.409 1.00 0.00 H new ATOM 0 HB3 SER A 74 20.627 -6.715 -2.764 1.00 0.00 H new ATOM 0 HG SER A 74 22.151 -8.297 -1.946 1.00 0.00 H new ATOM 1158 N ASP A 75 17.951 -5.511 -1.968 1.00 0.00 N ATOM 1159 CA ASP A 75 17.518 -4.172 -1.509 1.00 0.00 C ATOM 1160 C ASP A 75 16.183 -4.239 -0.748 1.00 0.00 C ATOM 1161 O ASP A 75 15.990 -3.537 0.239 1.00 0.00 O ATOM 1162 CB ASP A 75 17.337 -3.194 -2.677 1.00 0.00 C ATOM 1163 CG ASP A 75 18.631 -2.954 -3.452 1.00 0.00 C ATOM 1164 OD1 ASP A 75 19.523 -2.280 -2.898 1.00 0.00 O ATOM 1165 OD2 ASP A 75 18.660 -3.425 -4.605 1.00 0.00 O ATOM 0 H ASP A 75 17.645 -5.736 -2.915 1.00 0.00 H new ATOM 0 HA ASP A 75 18.310 -3.817 -0.850 1.00 0.00 H new ATOM 0 HB2 ASP A 75 16.578 -3.583 -3.356 1.00 0.00 H new ATOM 0 HB3 ASP A 75 16.966 -2.243 -2.295 1.00 0.00 H new ATOM 1170 N CYS A 76 15.301 -5.121 -1.217 1.00 0.00 N ATOM 1171 CA CYS A 76 13.990 -5.360 -0.572 1.00 0.00 C ATOM 1172 C CYS A 76 14.158 -6.094 0.769 1.00 0.00 C ATOM 1173 O CYS A 76 13.392 -5.889 1.703 1.00 0.00 O ATOM 1174 CB CYS A 76 13.063 -6.135 -1.496 1.00 0.00 C ATOM 1175 SG CYS A 76 12.708 -5.300 -3.082 1.00 0.00 S ATOM 0 H CYS A 76 15.463 -5.691 -2.047 1.00 0.00 H new ATOM 0 HA CYS A 76 13.537 -4.389 -0.371 1.00 0.00 H new ATOM 0 HB2 CYS A 76 13.507 -7.109 -1.703 1.00 0.00 H new ATOM 0 HB3 CYS A 76 12.122 -6.318 -0.977 1.00 0.00 H new ATOM 1180 N ASP A 77 15.199 -6.922 0.825 1.00 0.00 N ATOM 1181 CA ASP A 77 15.598 -7.627 2.056 1.00 0.00 C ATOM 1182 C ASP A 77 16.516 -6.751 2.941 1.00 0.00 C ATOM 1183 O ASP A 77 16.758 -7.098 4.087 1.00 0.00 O ATOM 1184 CB ASP A 77 16.300 -8.937 1.705 1.00 0.00 C ATOM 1185 CG ASP A 77 16.771 -9.738 2.927 1.00 0.00 C ATOM 1186 OD1 ASP A 77 16.013 -9.784 3.930 1.00 0.00 O ATOM 1187 OD2 ASP A 77 17.861 -10.346 2.806 1.00 0.00 O ATOM 0 H ASP A 77 15.794 -7.128 0.022 1.00 0.00 H new ATOM 0 HA ASP A 77 14.694 -7.843 2.626 1.00 0.00 H new ATOM 0 HB2 ASP A 77 15.621 -9.555 1.117 1.00 0.00 H new ATOM 0 HB3 ASP A 77 17.160 -8.718 1.073 1.00 0.00 H new ATOM 1192 N ARG A 78 17.098 -5.720 2.339 1.00 0.00 N ATOM 1193 CA ARG A 78 17.997 -4.777 3.033 1.00 0.00 C ATOM 1194 C ARG A 78 17.279 -4.079 4.205 1.00 0.00 C ATOM 1195 O ARG A 78 16.045 -4.024 4.204 1.00 0.00 O ATOM 1196 CB ARG A 78 18.563 -3.745 2.057 1.00 0.00 C ATOM 1197 CG ARG A 78 20.026 -4.065 1.741 1.00 0.00 C ATOM 1198 CD ARG A 78 20.954 -2.924 2.124 1.00 0.00 C ATOM 1199 NE ARG A 78 21.905 -2.689 1.030 1.00 0.00 N ATOM 1200 CZ ARG A 78 21.657 -1.945 -0.048 1.00 0.00 C ATOM 1201 NH1 ARG A 78 20.488 -1.340 -0.219 1.00 0.00 N ATOM 1202 NH2 ARG A 78 22.588 -1.790 -0.980 1.00 0.00 N ATOM 0 H ARG A 78 16.965 -5.505 1.351 1.00 0.00 H new ATOM 0 HA ARG A 78 18.827 -5.353 3.443 1.00 0.00 H new ATOM 0 HB2 ARG A 78 17.977 -3.743 1.138 1.00 0.00 H new ATOM 0 HB3 ARG A 78 18.486 -2.746 2.487 1.00 0.00 H new ATOM 0 HG2 ARG A 78 20.323 -4.968 2.274 1.00 0.00 H new ATOM 0 HG3 ARG A 78 20.129 -4.275 0.676 1.00 0.00 H new ATOM 0 HD2 ARG A 78 20.377 -2.020 2.321 1.00 0.00 H new ATOM 0 HD3 ARG A 78 21.489 -3.167 3.042 1.00 0.00 H new ATOM 0 HE ARG A 78 22.823 -3.127 1.100 1.00 0.00 H new ATOM 0 HH11 ARG A 78 19.755 -1.439 0.483 1.00 0.00 H new ATOM 0 HH12 ARG A 78 20.323 -0.776 -1.053 1.00 0.00 H new ATOM 0 HH21 ARG A 78 23.497 -2.241 -0.873 1.00 0.00 H new ATOM 0 HH22 ARG A 78 22.395 -1.220 -1.804 1.00 0.00 H new ATOM 1216 N PRO A 79 18.049 -3.564 5.185 1.00 0.00 N ATOM 1217 CA PRO A 79 17.483 -2.842 6.331 1.00 0.00 C ATOM 1218 C PRO A 79 16.926 -1.475 5.912 1.00 0.00 C ATOM 1219 O PRO A 79 17.676 -0.623 5.438 1.00 0.00 O ATOM 1220 CB PRO A 79 18.614 -2.754 7.352 1.00 0.00 C ATOM 1221 CG PRO A 79 19.897 -2.843 6.528 1.00 0.00 C ATOM 1222 CD PRO A 79 19.507 -3.718 5.338 1.00 0.00 C ATOM 0 HA PRO A 79 16.624 -3.356 6.764 1.00 0.00 H new ATOM 0 HB2 PRO A 79 18.568 -1.820 7.912 1.00 0.00 H new ATOM 0 HB3 PRO A 79 18.554 -3.565 8.078 1.00 0.00 H new ATOM 0 HG2 PRO A 79 20.235 -1.858 6.206 1.00 0.00 H new ATOM 0 HG3 PRO A 79 20.711 -3.287 7.101 1.00 0.00 H new ATOM 0 HD2 PRO A 79 20.030 -3.405 4.434 1.00 0.00 H new ATOM 0 HD3 PRO A 79 19.773 -4.760 5.515 1.00 0.00 H new ATOM 1230 N PRO A 80 15.608 -1.293 6.017 1.00 0.00 N ATOM 1231 CA PRO A 80 14.919 -0.062 5.678 1.00 0.00 C ATOM 1232 C PRO A 80 15.205 1.002 6.738 1.00 0.00 C ATOM 1233 O PRO A 80 14.587 1.010 7.812 1.00 0.00 O ATOM 1234 CB PRO A 80 13.439 -0.441 5.585 1.00 0.00 C ATOM 1235 CG PRO A 80 13.252 -1.651 6.467 1.00 0.00 C ATOM 1236 CD PRO A 80 14.633 -2.298 6.425 1.00 0.00 C ATOM 0 HA PRO A 80 15.251 0.373 4.735 1.00 0.00 H new ATOM 0 HB2 PRO A 80 12.806 0.382 5.916 1.00 0.00 H new ATOM 0 HB3 PRO A 80 13.159 -0.664 4.555 1.00 0.00 H new ATOM 0 HG2 PRO A 80 12.963 -1.375 7.481 1.00 0.00 H new ATOM 0 HG3 PRO A 80 12.479 -2.317 6.085 1.00 0.00 H new ATOM 0 HD2 PRO A 80 14.892 -2.700 7.405 1.00 0.00 H new ATOM 0 HD3 PRO A 80 14.637 -3.134 5.726 1.00 0.00 H new ATOM 1244 N LYS A 81 16.215 1.802 6.427 1.00 0.00 N ATOM 1245 CA LYS A 81 16.647 2.885 7.325 1.00 0.00 C ATOM 1246 C LYS A 81 15.624 4.029 7.307 1.00 0.00 C ATOM 1247 O LYS A 81 15.735 5.030 6.591 1.00 0.00 O ATOM 1248 CB LYS A 81 18.049 3.345 6.921 1.00 0.00 C ATOM 1249 CG LYS A 81 18.937 3.578 8.141 1.00 0.00 C ATOM 1250 CD LYS A 81 20.090 2.558 8.232 1.00 0.00 C ATOM 1251 CE LYS A 81 19.813 1.467 9.250 1.00 0.00 C ATOM 1252 NZ LYS A 81 21.045 1.036 9.913 1.00 0.00 N ATOM 0 H LYS A 81 16.755 1.729 5.565 1.00 0.00 H new ATOM 0 HA LYS A 81 16.698 2.525 8.353 1.00 0.00 H new ATOM 0 HB2 LYS A 81 18.506 2.596 6.275 1.00 0.00 H new ATOM 0 HB3 LYS A 81 17.978 4.265 6.341 1.00 0.00 H new ATOM 0 HG2 LYS A 81 19.350 4.586 8.099 1.00 0.00 H new ATOM 0 HG3 LYS A 81 18.331 3.519 9.045 1.00 0.00 H new ATOM 0 HD2 LYS A 81 20.251 2.106 7.253 1.00 0.00 H new ATOM 0 HD3 LYS A 81 21.011 3.076 8.499 1.00 0.00 H new ATOM 0 HE2 LYS A 81 19.105 1.832 9.994 1.00 0.00 H new ATOM 0 HE3 LYS A 81 19.346 0.615 8.756 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 20.825 0.290 10.603 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 21.710 0.666 9.204 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 21.477 1.845 10.404 1.00 0.00 H new ATOM 1266 N HIS A 82 14.508 3.739 7.973 1.00 0.00 N ATOM 1267 CA HIS A 82 13.370 4.663 8.091 1.00 0.00 C ATOM 1268 C HIS A 82 13.665 5.655 9.215 1.00 0.00 C ATOM 1269 O HIS A 82 14.006 5.281 10.328 1.00 0.00 O ATOM 1270 CB HIS A 82 12.077 3.880 8.326 1.00 0.00 C ATOM 1271 CG HIS A 82 10.940 4.727 8.903 1.00 0.00 C ATOM 1272 ND1 HIS A 82 10.716 4.887 10.200 1.00 0.00 N ATOM 1273 CD2 HIS A 82 10.054 5.458 8.244 1.00 0.00 C ATOM 1274 CE1 HIS A 82 9.662 5.686 10.357 1.00 0.00 C ATOM 1275 NE2 HIS A 82 9.278 6.042 9.144 1.00 0.00 N ATOM 0 H HIS A 82 14.362 2.850 8.452 1.00 0.00 H new ATOM 0 HA HIS A 82 13.231 5.224 7.167 1.00 0.00 H new ATOM 0 HB2 HIS A 82 11.750 3.444 7.382 1.00 0.00 H new ATOM 0 HB3 HIS A 82 12.282 3.052 9.005 1.00 0.00 H new ATOM 0 HD2 HIS A 82 9.978 5.559 7.171 1.00 0.00 H new ATOM 0 HE1 HIS A 82 9.210 5.984 11.292 1.00 0.00 H new ATOM 0 HE2 HIS A 82 8.503 6.670 8.933 1.00 0.00 H new ATOM 1284 N SER A 83 13.563 6.916 8.834 1.00 0.00 N ATOM 1285 CA SER A 83 13.827 8.030 9.777 1.00 0.00 C ATOM 1286 C SER A 83 12.530 8.441 10.492 1.00 0.00 C ATOM 1287 O SER A 83 11.647 7.634 10.674 1.00 0.00 O ATOM 1288 CB SER A 83 14.507 9.166 9.010 1.00 0.00 C ATOM 1289 OG SER A 83 15.016 10.093 9.973 1.00 0.00 O ATOM 0 H SER A 83 13.303 7.210 7.892 1.00 0.00 H new ATOM 0 HA SER A 83 14.509 7.724 10.570 1.00 0.00 H new ATOM 0 HB2 SER A 83 15.314 8.779 8.387 1.00 0.00 H new ATOM 0 HB3 SER A 83 13.798 9.657 8.344 1.00 0.00 H new ATOM 0 HG SER A 83 15.460 10.834 9.511 1.00 0.00 H new ATOM 1295 N LYS A 84 12.371 9.709 10.862 1.00 0.00 N ATOM 1296 CA LYS A 84 11.139 10.197 11.504 1.00 0.00 C ATOM 1297 C LYS A 84 9.928 10.180 10.563 1.00 0.00 C ATOM 1298 O LYS A 84 8.983 9.429 10.743 1.00 0.00 O ATOM 1299 CB LYS A 84 11.359 11.600 12.100 1.00 0.00 C ATOM 1300 CG LYS A 84 11.858 11.483 13.534 1.00 0.00 C ATOM 1301 CD LYS A 84 13.300 11.970 13.675 1.00 0.00 C ATOM 1302 CE LYS A 84 14.085 11.086 14.649 1.00 0.00 C ATOM 1303 NZ LYS A 84 14.285 9.759 14.048 1.00 0.00 N ATOM 0 H LYS A 84 13.083 10.428 10.730 1.00 0.00 H new ATOM 0 HA LYS A 84 10.907 9.503 12.312 1.00 0.00 H new ATOM 0 HB2 LYS A 84 12.082 12.151 11.498 1.00 0.00 H new ATOM 0 HB3 LYS A 84 10.427 12.165 12.075 1.00 0.00 H new ATOM 0 HG2 LYS A 84 11.212 12.064 14.192 1.00 0.00 H new ATOM 0 HG3 LYS A 84 11.792 10.444 13.858 1.00 0.00 H new ATOM 0 HD2 LYS A 84 13.787 11.964 12.700 1.00 0.00 H new ATOM 0 HD3 LYS A 84 13.307 13.001 14.028 1.00 0.00 H new ATOM 0 HE2 LYS A 84 15.048 11.543 14.878 1.00 0.00 H new ATOM 0 HE3 LYS A 84 13.544 10.994 15.591 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 15.156 9.334 14.426 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 13.475 9.149 14.277 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 14.366 9.854 13.016 1.00 0.00 H new ATOM 1317 N ASP A 85 10.125 10.869 9.447 1.00 0.00 N ATOM 1318 CA ASP A 85 9.105 10.977 8.387 1.00 0.00 C ATOM 1319 C ASP A 85 9.453 10.097 7.178 1.00 0.00 C ATOM 1320 O ASP A 85 9.073 10.401 6.051 1.00 0.00 O ATOM 1321 CB ASP A 85 8.832 12.450 7.990 1.00 0.00 C ATOM 1322 CG ASP A 85 9.832 13.542 8.435 1.00 0.00 C ATOM 1323 OD1 ASP A 85 10.211 13.544 9.625 1.00 0.00 O ATOM 1324 OD2 ASP A 85 10.328 14.276 7.553 1.00 0.00 O ATOM 0 H ASP A 85 10.989 11.370 9.242 1.00 0.00 H new ATOM 0 HA ASP A 85 8.170 10.594 8.796 1.00 0.00 H new ATOM 0 HB2 ASP A 85 8.762 12.491 6.903 1.00 0.00 H new ATOM 0 HB3 ASP A 85 7.852 12.721 8.383 1.00 0.00 H new ATOM 1329 N GLY A 86 10.375 9.161 7.412 1.00 0.00 N ATOM 1330 CA GLY A 86 10.930 8.255 6.387 1.00 0.00 C ATOM 1331 C GLY A 86 11.242 8.995 5.085 1.00 0.00 C ATOM 1332 O GLY A 86 10.490 8.961 4.116 1.00 0.00 O ATOM 0 H GLY A 86 10.770 9.003 8.339 1.00 0.00 H new ATOM 0 HA2 GLY A 86 11.839 7.789 6.767 1.00 0.00 H new ATOM 0 HA3 GLY A 86 10.220 7.452 6.188 1.00 0.00 H new ATOM 1336 N ASN A 87 12.258 9.834 5.192 1.00 0.00 N ATOM 1337 CA ASN A 87 12.755 10.653 4.074 1.00 0.00 C ATOM 1338 C ASN A 87 14.275 10.832 4.155 1.00 0.00 C ATOM 1339 O ASN A 87 14.979 10.511 3.201 1.00 0.00 O ATOM 1340 CB ASN A 87 12.063 12.025 4.046 1.00 0.00 C ATOM 1341 CG ASN A 87 12.455 12.893 5.249 1.00 0.00 C ATOM 1342 OD1 ASN A 87 13.308 13.771 5.193 1.00 0.00 O ATOM 1343 ND2 ASN A 87 12.083 12.442 6.417 1.00 0.00 N ATOM 0 H ASN A 87 12.773 9.975 6.061 1.00 0.00 H new ATOM 0 HA ASN A 87 12.518 10.126 3.150 1.00 0.00 H new ATOM 0 HB2 ASN A 87 12.325 12.544 3.124 1.00 0.00 H new ATOM 0 HB3 ASN A 87 10.982 11.885 4.037 1.00 0.00 H new ATOM 0 HD21 ASN A 87 12.501 12.821 7.267 1.00 0.00 H new ATOM 0 HD22 ASN A 87 11.374 11.711 6.479 1.00 0.00 H new ATOM 1350 N GLY A 88 14.731 11.151 5.378 1.00 0.00 N ATOM 1351 CA GLY A 88 16.135 11.492 5.686 1.00 0.00 C ATOM 1352 C GLY A 88 16.787 12.270 4.538 1.00 0.00 C ATOM 1353 O GLY A 88 16.131 12.967 3.773 1.00 0.00 O ATOM 0 H GLY A 88 14.124 11.180 6.198 1.00 0.00 H new ATOM 0 HA2 GLY A 88 16.175 12.086 6.599 1.00 0.00 H new ATOM 0 HA3 GLY A 88 16.699 10.579 5.875 1.00 0.00 H new ATOM 1357 N LYS A 89 18.067 11.991 4.360 1.00 0.00 N ATOM 1358 CA LYS A 89 18.813 12.546 3.224 1.00 0.00 C ATOM 1359 C LYS A 89 18.940 11.502 2.094 1.00 0.00 C ATOM 1360 O LYS A 89 18.921 11.825 0.918 1.00 0.00 O ATOM 1361 CB LYS A 89 20.182 13.034 3.729 1.00 0.00 C ATOM 1362 CG LYS A 89 21.138 13.498 2.627 1.00 0.00 C ATOM 1363 CD LYS A 89 21.358 15.011 2.589 1.00 0.00 C ATOM 1364 CE LYS A 89 22.525 15.316 1.650 1.00 0.00 C ATOM 1365 NZ LYS A 89 22.540 16.749 1.340 1.00 0.00 N ATOM 0 H LYS A 89 18.614 11.390 4.976 1.00 0.00 H new ATOM 0 HA LYS A 89 18.279 13.395 2.798 1.00 0.00 H new ATOM 0 HB2 LYS A 89 20.025 13.857 4.426 1.00 0.00 H new ATOM 0 HB3 LYS A 89 20.657 12.228 4.288 1.00 0.00 H new ATOM 0 HG2 LYS A 89 22.100 13.005 2.764 1.00 0.00 H new ATOM 0 HG3 LYS A 89 20.748 13.174 1.662 1.00 0.00 H new ATOM 0 HD2 LYS A 89 20.455 15.515 2.245 1.00 0.00 H new ATOM 0 HD3 LYS A 89 21.571 15.387 3.590 1.00 0.00 H new ATOM 0 HE2 LYS A 89 23.466 15.024 2.115 1.00 0.00 H new ATOM 0 HE3 LYS A 89 22.429 14.735 0.733 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 23.334 16.958 0.701 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 21.646 17.014 0.879 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 22.651 17.293 2.219 1.00 0.00 H new ATOM 1379 N THR A 90 19.130 10.253 2.518 1.00 0.00 N ATOM 1380 CA THR A 90 19.377 9.136 1.583 1.00 0.00 C ATOM 1381 C THR A 90 18.596 7.900 2.048 1.00 0.00 C ATOM 1382 O THR A 90 18.998 6.772 1.774 1.00 0.00 O ATOM 1383 CB THR A 90 20.880 8.807 1.528 1.00 0.00 C ATOM 1384 OG1 THR A 90 21.271 8.188 2.752 1.00 0.00 O ATOM 1385 CG2 THR A 90 21.795 10.019 1.334 1.00 0.00 C ATOM 0 H THR A 90 19.119 9.981 3.501 1.00 0.00 H new ATOM 0 HA THR A 90 19.045 9.427 0.587 1.00 0.00 H new ATOM 0 HB THR A 90 20.998 8.160 0.659 1.00 0.00 H new ATOM 0 HG1 THR A 90 22.227 7.975 2.720 1.00 0.00 H new ATOM 0 HG21 THR A 90 22.834 9.690 1.308 1.00 0.00 H new ATOM 0 HG22 THR A 90 21.547 10.515 0.396 1.00 0.00 H new ATOM 0 HG23 THR A 90 21.656 10.716 2.161 1.00 0.00 H new ATOM 1393 N ASP A 91 17.487 8.132 2.768 1.00 0.00 N ATOM 1394 CA ASP A 91 16.616 7.046 3.261 1.00 0.00 C ATOM 1395 C ASP A 91 16.427 5.961 2.189 1.00 0.00 C ATOM 1396 O ASP A 91 16.515 6.222 0.990 1.00 0.00 O ATOM 1397 CB ASP A 91 15.226 7.553 3.653 1.00 0.00 C ATOM 1398 CG ASP A 91 15.063 7.846 5.147 1.00 0.00 C ATOM 1399 OD1 ASP A 91 16.011 8.368 5.757 1.00 0.00 O ATOM 1400 OD2 ASP A 91 13.936 7.624 5.637 1.00 0.00 O ATOM 0 H ASP A 91 17.169 9.067 3.024 1.00 0.00 H new ATOM 0 HA ASP A 91 17.116 6.637 4.139 1.00 0.00 H new ATOM 0 HB2 ASP A 91 15.011 8.462 3.090 1.00 0.00 H new ATOM 0 HB3 ASP A 91 14.484 6.811 3.357 1.00 0.00 H new ATOM 1405 N HIS A 92 16.357 4.736 2.670 1.00 0.00 N ATOM 1406 CA HIS A 92 16.228 3.592 1.766 1.00 0.00 C ATOM 1407 C HIS A 92 15.352 2.495 2.389 1.00 0.00 C ATOM 1408 O HIS A 92 15.722 1.341 2.629 1.00 0.00 O ATOM 1409 CB HIS A 92 17.603 3.120 1.282 1.00 0.00 C ATOM 1410 CG HIS A 92 18.441 2.428 2.355 1.00 0.00 C ATOM 1411 ND1 HIS A 92 18.462 1.117 2.559 1.00 0.00 N ATOM 1412 CD2 HIS A 92 19.236 2.999 3.252 1.00 0.00 C ATOM 1413 CE1 HIS A 92 19.270 0.864 3.572 1.00 0.00 C ATOM 1414 NE2 HIS A 92 19.743 2.023 4.008 1.00 0.00 N ATOM 0 H HIS A 92 16.386 4.501 3.662 1.00 0.00 H new ATOM 0 HA HIS A 92 15.699 3.899 0.864 1.00 0.00 H new ATOM 0 HB2 HIS A 92 17.466 2.434 0.446 1.00 0.00 H new ATOM 0 HB3 HIS A 92 18.157 3.979 0.902 1.00 0.00 H new ATOM 0 HD2 HIS A 92 19.435 4.056 3.351 1.00 0.00 H new ATOM 0 HE1 HIS A 92 19.503 -0.111 3.973 1.00 0.00 H new ATOM 0 HE2 HIS A 92 20.386 2.148 4.790 1.00 0.00 H new ATOM 1423 N TYR A 93 14.146 2.938 2.695 1.00 0.00 N ATOM 1424 CA TYR A 93 13.151 2.067 3.305 1.00 0.00 C ATOM 1425 C TYR A 93 12.243 1.375 2.298 1.00 0.00 C ATOM 1426 O TYR A 93 12.221 1.726 1.123 1.00 0.00 O ATOM 1427 CB TYR A 93 12.402 2.835 4.391 1.00 0.00 C ATOM 1428 CG TYR A 93 11.668 4.037 3.828 1.00 0.00 C ATOM 1429 CD1 TYR A 93 12.352 5.256 3.714 1.00 0.00 C ATOM 1430 CD2 TYR A 93 10.327 3.873 3.422 1.00 0.00 C ATOM 1431 CE1 TYR A 93 11.681 6.353 3.148 1.00 0.00 C ATOM 1432 CE2 TYR A 93 9.658 4.982 2.914 1.00 0.00 C ATOM 1433 CZ TYR A 93 10.338 6.202 2.743 1.00 0.00 C ATOM 1434 OH TYR A 93 9.728 7.211 2.075 1.00 0.00 O ATOM 0 H TYR A 93 13.830 3.894 2.532 1.00 0.00 H new ATOM 0 HA TYR A 93 13.671 1.235 3.780 1.00 0.00 H new ATOM 0 HB2 TYR A 93 11.690 2.171 4.880 1.00 0.00 H new ATOM 0 HB3 TYR A 93 13.107 3.165 5.155 1.00 0.00 H new ATOM 0 HD1 TYR A 93 13.373 5.350 4.054 1.00 0.00 H new ATOM 0 HD2 TYR A 93 9.834 2.915 3.503 1.00 0.00 H new ATOM 0 HE1 TYR A 93 12.187 7.299 3.025 1.00 0.00 H new ATOM 0 HE2 TYR A 93 8.613 4.906 2.650 1.00 0.00 H new ATOM 0 HH TYR A 93 9.958 8.067 2.494 1.00 0.00 H new ATOM 1444 N LEU A 94 11.525 0.370 2.783 1.00 0.00 N ATOM 1445 CA LEU A 94 10.531 -0.325 1.957 1.00 0.00 C ATOM 1446 C LEU A 94 9.154 0.303 2.155 1.00 0.00 C ATOM 1447 O LEU A 94 8.737 0.468 3.296 1.00 0.00 O ATOM 1448 CB LEU A 94 10.440 -1.827 2.279 1.00 0.00 C ATOM 1449 CG LEU A 94 11.155 -2.687 1.223 1.00 0.00 C ATOM 1450 CD1 LEU A 94 10.781 -4.149 1.415 1.00 0.00 C ATOM 1451 CD2 LEU A 94 10.637 -2.396 -0.171 1.00 0.00 C ATOM 0 H LEU A 94 11.607 0.016 3.736 1.00 0.00 H new ATOM 0 HA LEU A 94 10.857 -0.221 0.922 1.00 0.00 H new ATOM 0 HB2 LEU A 94 10.880 -2.015 3.258 1.00 0.00 H new ATOM 0 HB3 LEU A 94 9.392 -2.122 2.338 1.00 0.00 H new ATOM 0 HG LEU A 94 12.219 -2.475 1.331 1.00 0.00 H new ATOM 0 HD11 LEU A 94 11.289 -4.756 0.666 1.00 0.00 H new ATOM 0 HD12 LEU A 94 11.083 -4.474 2.411 1.00 0.00 H new ATOM 0 HD13 LEU A 94 9.703 -4.266 1.307 1.00 0.00 H new ATOM 0 HD21 LEU A 94 11.164 -3.021 -0.893 1.00 0.00 H new ATOM 0 HD22 LEU A 94 9.569 -2.612 -0.215 1.00 0.00 H new ATOM 0 HD23 LEU A 94 10.805 -1.346 -0.410 1.00 0.00 H new ATOM 1463 N LEU A 95 8.627 0.863 1.083 1.00 0.00 N ATOM 1464 CA LEU A 95 7.307 1.541 1.103 1.00 0.00 C ATOM 1465 C LEU A 95 6.244 0.600 0.520 1.00 0.00 C ATOM 1466 O LEU A 95 6.561 -0.378 -0.158 1.00 0.00 O ATOM 1467 CB LEU A 95 7.286 2.875 0.323 1.00 0.00 C ATOM 1468 CG LEU A 95 8.654 3.525 0.100 1.00 0.00 C ATOM 1469 CD1 LEU A 95 9.427 2.891 -1.040 1.00 0.00 C ATOM 1470 CD2 LEU A 95 8.518 5.002 -0.254 1.00 0.00 C ATOM 0 H LEU A 95 9.083 0.871 0.171 1.00 0.00 H new ATOM 0 HA LEU A 95 7.094 1.781 2.145 1.00 0.00 H new ATOM 0 HB2 LEU A 95 6.822 2.702 -0.648 1.00 0.00 H new ATOM 0 HB3 LEU A 95 6.650 3.580 0.859 1.00 0.00 H new ATOM 0 HG LEU A 95 9.185 3.384 1.041 1.00 0.00 H new ATOM 0 HD11 LEU A 95 10.388 3.393 -1.151 1.00 0.00 H new ATOM 0 HD12 LEU A 95 9.591 1.835 -0.825 1.00 0.00 H new ATOM 0 HD13 LEU A 95 8.858 2.989 -1.964 1.00 0.00 H new ATOM 0 HD21 LEU A 95 9.508 5.432 -0.406 1.00 0.00 H new ATOM 0 HD22 LEU A 95 7.934 5.105 -1.168 1.00 0.00 H new ATOM 0 HD23 LEU A 95 8.015 5.526 0.559 1.00 0.00 H new ATOM 1482 N GLU A 96 4.999 0.893 0.882 1.00 0.00 N ATOM 1483 CA GLU A 96 3.834 0.106 0.432 1.00 0.00 C ATOM 1484 C GLU A 96 2.648 0.986 0.023 1.00 0.00 C ATOM 1485 O GLU A 96 1.987 1.646 0.830 1.00 0.00 O ATOM 1486 CB GLU A 96 3.415 -0.914 1.478 1.00 0.00 C ATOM 1487 CG GLU A 96 2.995 -0.298 2.794 1.00 0.00 C ATOM 1488 CD GLU A 96 2.788 -1.303 3.920 1.00 0.00 C ATOM 1489 OE1 GLU A 96 2.410 -2.458 3.629 1.00 0.00 O ATOM 1490 OE2 GLU A 96 3.106 -0.909 5.064 1.00 0.00 O ATOM 0 H GLU A 96 4.760 1.675 1.491 1.00 0.00 H new ATOM 0 HA GLU A 96 4.154 -0.431 -0.461 1.00 0.00 H new ATOM 0 HB2 GLU A 96 2.589 -1.507 1.084 1.00 0.00 H new ATOM 0 HB3 GLU A 96 4.243 -1.600 1.656 1.00 0.00 H new ATOM 0 HG2 GLU A 96 3.752 0.424 3.102 1.00 0.00 H new ATOM 0 HG3 GLU A 96 2.069 0.256 2.643 1.00 0.00 H new ATOM 1497 N PHE A 97 2.427 0.997 -1.268 1.00 0.00 N ATOM 1498 CA PHE A 97 1.328 1.794 -1.832 1.00 0.00 C ATOM 1499 C PHE A 97 0.058 0.940 -1.983 1.00 0.00 C ATOM 1500 O PHE A 97 0.184 -0.217 -2.380 1.00 0.00 O ATOM 1501 CB PHE A 97 1.795 2.358 -3.178 1.00 0.00 C ATOM 1502 CG PHE A 97 0.810 3.366 -3.757 1.00 0.00 C ATOM 1503 CD1 PHE A 97 0.910 4.714 -3.357 1.00 0.00 C ATOM 1504 CD2 PHE A 97 -0.220 2.931 -4.630 1.00 0.00 C ATOM 1505 CE1 PHE A 97 -0.030 5.640 -3.844 1.00 0.00 C ATOM 1506 CE2 PHE A 97 -1.164 3.857 -5.109 1.00 0.00 C ATOM 1507 CZ PHE A 97 -1.054 5.213 -4.714 1.00 0.00 C ATOM 0 H PHE A 97 2.976 0.477 -1.952 1.00 0.00 H new ATOM 0 HA PHE A 97 1.073 2.616 -1.164 1.00 0.00 H new ATOM 0 HB2 PHE A 97 2.767 2.835 -3.052 1.00 0.00 H new ATOM 0 HB3 PHE A 97 1.931 1.539 -3.885 1.00 0.00 H new ATOM 0 HD1 PHE A 97 1.696 5.031 -2.687 1.00 0.00 H new ATOM 0 HD2 PHE A 97 -0.279 1.894 -4.925 1.00 0.00 H new ATOM 0 HE1 PHE A 97 0.033 6.678 -3.552 1.00 0.00 H new ATOM 0 HE2 PHE A 97 -1.959 3.540 -5.767 1.00 0.00 H new ATOM 0 HZ PHE A 97 -1.768 5.933 -5.086 1.00 0.00 H new ATOM 1517 N PRO A 98 -1.133 1.509 -1.724 1.00 0.00 N ATOM 1518 CA PRO A 98 -2.413 0.810 -1.864 1.00 0.00 C ATOM 1519 C PRO A 98 -2.766 0.627 -3.337 1.00 0.00 C ATOM 1520 O PRO A 98 -3.347 1.495 -3.960 1.00 0.00 O ATOM 1521 CB PRO A 98 -3.429 1.639 -1.076 1.00 0.00 C ATOM 1522 CG PRO A 98 -2.860 3.053 -1.070 1.00 0.00 C ATOM 1523 CD PRO A 98 -1.351 2.878 -1.228 1.00 0.00 C ATOM 0 HA PRO A 98 -2.388 -0.204 -1.464 1.00 0.00 H new ATOM 0 HB2 PRO A 98 -4.412 1.611 -1.546 1.00 0.00 H new ATOM 0 HB3 PRO A 98 -3.549 1.257 -0.062 1.00 0.00 H new ATOM 0 HG2 PRO A 98 -3.275 3.648 -1.884 1.00 0.00 H new ATOM 0 HG3 PRO A 98 -3.101 3.571 -0.142 1.00 0.00 H new ATOM 0 HD2 PRO A 98 -0.947 3.611 -1.926 1.00 0.00 H new ATOM 0 HD3 PRO A 98 -0.842 3.030 -0.276 1.00 0.00 H new ATOM 1531 N THR A 99 -2.144 -0.388 -3.930 1.00 0.00 N ATOM 1532 CA THR A 99 -2.361 -0.710 -5.351 1.00 0.00 C ATOM 1533 C THR A 99 -3.735 -1.349 -5.541 1.00 0.00 C ATOM 1534 O THR A 99 -4.174 -2.193 -4.765 1.00 0.00 O ATOM 1535 CB THR A 99 -1.226 -1.549 -5.940 1.00 0.00 C ATOM 1536 OG1 THR A 99 -1.265 -1.365 -7.362 1.00 0.00 O ATOM 1537 CG2 THR A 99 -1.259 -3.051 -5.591 1.00 0.00 C ATOM 0 H THR A 99 -1.485 -1.005 -3.456 1.00 0.00 H new ATOM 0 HA THR A 99 -2.348 0.221 -5.917 1.00 0.00 H new ATOM 0 HB THR A 99 -0.295 -1.199 -5.493 1.00 0.00 H new ATOM 0 HG1 THR A 99 -0.549 -1.887 -7.779 1.00 0.00 H new ATOM 0 HG21 THR A 99 -0.411 -3.552 -6.058 1.00 0.00 H new ATOM 0 HG22 THR A 99 -1.202 -3.175 -4.510 1.00 0.00 H new ATOM 0 HG23 THR A 99 -2.187 -3.490 -5.958 1.00 0.00 H new ATOM 1545 N PHE A 100 -4.427 -0.865 -6.565 1.00 0.00 N ATOM 1546 CA PHE A 100 -5.789 -1.314 -6.897 1.00 0.00 C ATOM 1547 C PHE A 100 -5.814 -2.205 -8.150 1.00 0.00 C ATOM 1548 O PHE A 100 -4.925 -2.058 -8.993 1.00 0.00 O ATOM 1549 CB PHE A 100 -6.703 -0.099 -7.078 1.00 0.00 C ATOM 1550 CG PHE A 100 -7.018 0.561 -5.731 1.00 0.00 C ATOM 1551 CD1 PHE A 100 -5.985 1.267 -5.085 1.00 0.00 C ATOM 1552 CD2 PHE A 100 -8.312 0.513 -5.170 1.00 0.00 C ATOM 1553 CE1 PHE A 100 -6.235 1.890 -3.844 1.00 0.00 C ATOM 1554 CE2 PHE A 100 -8.589 1.212 -3.979 1.00 0.00 C ATOM 1555 CZ PHE A 100 -7.543 1.890 -3.318 1.00 0.00 C ATOM 0 H PHE A 100 -4.066 -0.148 -7.195 1.00 0.00 H new ATOM 0 HA PHE A 100 -6.154 -1.922 -6.069 1.00 0.00 H new ATOM 0 HB2 PHE A 100 -6.224 0.625 -7.738 1.00 0.00 H new ATOM 0 HB3 PHE A 100 -7.630 -0.407 -7.561 1.00 0.00 H new ATOM 0 HD1 PHE A 100 -5.006 1.331 -5.537 1.00 0.00 H new ATOM 0 HD2 PHE A 100 -9.090 -0.059 -5.654 1.00 0.00 H new ATOM 0 HE1 PHE A 100 -5.430 2.363 -3.301 1.00 0.00 H new ATOM 0 HE2 PHE A 100 -9.591 1.229 -3.576 1.00 0.00 H new ATOM 0 HZ PHE A 100 -7.747 2.416 -2.397 1.00 0.00 H new ATOM 1565 N PRO A 101 -6.795 -3.118 -8.259 1.00 0.00 N ATOM 1566 CA PRO A 101 -6.913 -4.026 -9.413 1.00 0.00 C ATOM 1567 C PRO A 101 -7.422 -3.316 -10.662 1.00 0.00 C ATOM 1568 O PRO A 101 -6.793 -3.445 -11.710 1.00 0.00 O ATOM 1569 CB PRO A 101 -7.841 -5.140 -8.972 1.00 0.00 C ATOM 1570 CG PRO A 101 -8.705 -4.532 -7.866 1.00 0.00 C ATOM 1571 CD PRO A 101 -7.864 -3.396 -7.270 1.00 0.00 C ATOM 0 HA PRO A 101 -5.937 -4.417 -9.700 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -8.454 -5.492 -9.801 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -7.278 -5.998 -8.605 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -9.647 -4.156 -8.265 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -8.954 -5.275 -7.109 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -8.474 -2.510 -7.095 1.00 0.00 H new ATOM 0 HD3 PRO A 101 -7.440 -3.687 -6.309 1.00 0.00 H new ATOM 1579 N ASP A 102 -8.423 -2.439 -10.472 1.00 0.00 N ATOM 1580 CA ASP A 102 -8.990 -1.584 -11.546 1.00 0.00 C ATOM 1581 C ASP A 102 -7.875 -0.912 -12.364 1.00 0.00 C ATOM 1582 O ASP A 102 -8.020 -0.664 -13.552 1.00 0.00 O ATOM 1583 CB ASP A 102 -9.864 -0.493 -10.909 1.00 0.00 C ATOM 1584 CG ASP A 102 -11.225 -0.374 -11.597 1.00 0.00 C ATOM 1585 OD1 ASP A 102 -11.982 -1.360 -11.495 1.00 0.00 O ATOM 1586 OD2 ASP A 102 -11.525 0.745 -12.052 1.00 0.00 O ATOM 0 H ASP A 102 -8.869 -2.298 -9.566 1.00 0.00 H new ATOM 0 HA ASP A 102 -9.581 -2.212 -12.212 1.00 0.00 H new ATOM 0 HB2 ASP A 102 -10.010 -0.717 -9.852 1.00 0.00 H new ATOM 0 HB3 ASP A 102 -9.346 0.464 -10.963 1.00 0.00 H new ATOM 1591 N GLY A 103 -6.781 -0.656 -11.655 1.00 0.00 N ATOM 1592 CA GLY A 103 -5.558 -0.089 -12.210 1.00 0.00 C ATOM 1593 C GLY A 103 -5.588 1.435 -12.176 1.00 0.00 C ATOM 1594 O GLY A 103 -4.840 2.108 -12.890 1.00 0.00 O ATOM 0 H GLY A 103 -6.719 -0.842 -10.654 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -4.698 -0.450 -11.646 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -5.431 -0.429 -13.238 1.00 0.00 H new ATOM 1598 N HIS A 104 -6.440 1.922 -11.288 1.00 0.00 N ATOM 1599 CA HIS A 104 -6.546 3.350 -11.022 1.00 0.00 C ATOM 1600 C HIS A 104 -5.523 3.736 -9.957 1.00 0.00 C ATOM 1601 O HIS A 104 -5.078 2.928 -9.136 1.00 0.00 O ATOM 1602 CB HIS A 104 -7.988 3.728 -10.634 1.00 0.00 C ATOM 1603 CG HIS A 104 -8.486 3.097 -9.321 1.00 0.00 C ATOM 1604 ND1 HIS A 104 -9.487 2.246 -9.211 1.00 0.00 N ATOM 1605 CD2 HIS A 104 -8.070 3.403 -8.095 1.00 0.00 C ATOM 1606 CE1 HIS A 104 -9.686 1.996 -7.919 1.00 0.00 C ATOM 1607 NE2 HIS A 104 -8.803 2.714 -7.243 1.00 0.00 N ATOM 0 H HIS A 104 -7.073 1.345 -10.735 1.00 0.00 H new ATOM 0 HA HIS A 104 -6.319 3.917 -11.925 1.00 0.00 H new ATOM 0 HB2 HIS A 104 -8.055 4.813 -10.548 1.00 0.00 H new ATOM 0 HB3 HIS A 104 -8.657 3.430 -11.441 1.00 0.00 H new ATOM 0 HD2 HIS A 104 -7.276 4.091 -7.843 1.00 0.00 H new ATOM 0 HE1 HIS A 104 -10.428 1.332 -7.501 1.00 0.00 H new ATOM 0 HE2 HIS A 104 -8.706 2.731 -6.228 1.00 0.00 H new ATOM 1616 N ASP A 105 -5.249 5.035 -9.968 1.00 0.00 N ATOM 1617 CA ASP A 105 -4.325 5.645 -9.005 1.00 0.00 C ATOM 1618 C ASP A 105 -5.126 6.311 -7.898 1.00 0.00 C ATOM 1619 O ASP A 105 -5.419 7.507 -7.965 1.00 0.00 O ATOM 1620 CB ASP A 105 -3.372 6.640 -9.691 1.00 0.00 C ATOM 1621 CG ASP A 105 -3.929 7.259 -10.982 1.00 0.00 C ATOM 1622 OD1 ASP A 105 -4.857 8.092 -10.896 1.00 0.00 O ATOM 1623 OD2 ASP A 105 -3.524 6.754 -12.050 1.00 0.00 O ATOM 0 H ASP A 105 -5.653 5.693 -10.634 1.00 0.00 H new ATOM 0 HA ASP A 105 -3.699 4.866 -8.570 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -3.135 7.441 -8.990 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -2.436 6.130 -9.920 1.00 0.00 H new ATOM 1628 N TYR A 106 -5.595 5.481 -6.979 1.00 0.00 N ATOM 1629 CA TYR A 106 -6.327 5.948 -5.781 1.00 0.00 C ATOM 1630 C TYR A 106 -5.775 7.282 -5.312 1.00 0.00 C ATOM 1631 O TYR A 106 -4.561 7.451 -5.233 1.00 0.00 O ATOM 1632 CB TYR A 106 -6.098 4.929 -4.683 1.00 0.00 C ATOM 1633 CG TYR A 106 -6.337 5.383 -3.242 1.00 0.00 C ATOM 1634 CD1 TYR A 106 -7.611 5.835 -2.812 1.00 0.00 C ATOM 1635 CD2 TYR A 106 -5.198 5.406 -2.413 1.00 0.00 C ATOM 1636 CE1 TYR A 106 -7.728 6.353 -1.507 1.00 0.00 C ATOM 1637 CE2 TYR A 106 -5.326 5.909 -1.114 1.00 0.00 C ATOM 1638 CZ TYR A 106 -6.582 6.378 -0.696 1.00 0.00 C ATOM 1639 OH TYR A 106 -6.650 6.805 0.567 1.00 0.00 O ATOM 0 H TYR A 106 -5.487 4.468 -7.029 1.00 0.00 H new ATOM 0 HA TYR A 106 -7.385 6.063 -6.016 1.00 0.00 H new ATOM 0 HB2 TYR A 106 -6.743 4.073 -4.878 1.00 0.00 H new ATOM 0 HB3 TYR A 106 -5.069 4.577 -4.759 1.00 0.00 H new ATOM 0 HD1 TYR A 106 -8.468 5.783 -3.467 1.00 0.00 H new ATOM 0 HD2 TYR A 106 -4.247 5.043 -2.773 1.00 0.00 H new ATOM 0 HE1 TYR A 106 -8.675 6.721 -1.140 1.00 0.00 H new ATOM 0 HE2 TYR A 106 -4.477 5.936 -0.447 1.00 0.00 H new ATOM 0 HH TYR A 106 -7.367 6.328 1.035 1.00 0.00 H new ATOM 1649 N LYS A 107 -6.707 8.172 -4.990 1.00 0.00 N ATOM 1650 CA LYS A 107 -6.374 9.501 -4.459 1.00 0.00 C ATOM 1651 C LYS A 107 -5.696 9.377 -3.084 1.00 0.00 C ATOM 1652 O LYS A 107 -6.263 9.557 -2.014 1.00 0.00 O ATOM 1653 CB LYS A 107 -7.620 10.397 -4.439 1.00 0.00 C ATOM 1654 CG LYS A 107 -8.769 9.832 -3.582 1.00 0.00 C ATOM 1655 CD LYS A 107 -9.949 9.411 -4.426 1.00 0.00 C ATOM 1656 CE LYS A 107 -11.122 10.330 -4.091 1.00 0.00 C ATOM 1657 NZ LYS A 107 -11.743 10.760 -5.342 1.00 0.00 N ATOM 0 H LYS A 107 -7.708 8.001 -5.086 1.00 0.00 H new ATOM 0 HA LYS A 107 -5.653 9.985 -5.117 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -7.344 11.381 -4.060 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -7.974 10.537 -5.460 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -8.408 8.977 -3.010 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -9.089 10.585 -2.862 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -9.703 9.479 -5.486 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -10.210 8.372 -4.225 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -11.847 9.807 -3.468 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -10.777 11.194 -3.522 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -12.545 11.388 -5.133 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -11.044 11.271 -5.919 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -12.082 9.928 -5.865 1.00 0.00 H new ATOM 1671 N PHE A 108 -4.407 9.104 -3.168 1.00 0.00 N ATOM 1672 CA PHE A 108 -3.550 8.954 -1.989 1.00 0.00 C ATOM 1673 C PHE A 108 -3.144 10.305 -1.388 1.00 0.00 C ATOM 1674 O PHE A 108 -2.449 10.430 -0.392 1.00 0.00 O ATOM 1675 CB PHE A 108 -2.354 8.059 -2.299 1.00 0.00 C ATOM 1676 CG PHE A 108 -1.405 8.726 -3.295 1.00 0.00 C ATOM 1677 CD1 PHE A 108 -1.590 8.537 -4.689 1.00 0.00 C ATOM 1678 CD2 PHE A 108 -0.440 9.612 -2.787 1.00 0.00 C ATOM 1679 CE1 PHE A 108 -0.766 9.248 -5.586 1.00 0.00 C ATOM 1680 CE2 PHE A 108 0.323 10.363 -3.685 1.00 0.00 C ATOM 1681 CZ PHE A 108 0.170 10.165 -5.076 1.00 0.00 C ATOM 0 H PHE A 108 -3.917 8.978 -4.054 1.00 0.00 H new ATOM 0 HA PHE A 108 -4.133 8.455 -1.215 1.00 0.00 H new ATOM 0 HB2 PHE A 108 -1.817 7.833 -1.377 1.00 0.00 H new ATOM 0 HB3 PHE A 108 -2.703 7.110 -2.706 1.00 0.00 H new ATOM 0 HD1 PHE A 108 -2.348 7.861 -5.056 1.00 0.00 H new ATOM 0 HD2 PHE A 108 -0.291 9.711 -1.722 1.00 0.00 H new ATOM 0 HE1 PHE A 108 -0.853 9.090 -6.651 1.00 0.00 H new ATOM 0 HE2 PHE A 108 1.028 11.093 -3.317 1.00 0.00 H new ATOM 0 HZ PHE A 108 0.785 10.730 -5.761 1.00 0.00 H new ATOM 1691 N ASP A 109 -3.388 11.328 -2.193 1.00 0.00 N ATOM 1692 CA ASP A 109 -3.145 12.718 -1.788 1.00 0.00 C ATOM 1693 C ASP A 109 -4.377 13.319 -1.079 1.00 0.00 C ATOM 1694 O ASP A 109 -4.289 14.387 -0.479 1.00 0.00 O ATOM 1695 CB ASP A 109 -2.718 13.516 -3.018 1.00 0.00 C ATOM 1696 CG ASP A 109 -2.785 15.038 -2.825 1.00 0.00 C ATOM 1697 OD1 ASP A 109 -2.231 15.520 -1.816 1.00 0.00 O ATOM 1698 OD2 ASP A 109 -3.472 15.640 -3.679 1.00 0.00 O ATOM 0 H ASP A 109 -3.757 11.228 -3.139 1.00 0.00 H new ATOM 0 HA ASP A 109 -2.339 12.759 -1.055 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -1.698 13.238 -3.284 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -3.354 13.238 -3.859 1.00 0.00 H new ATOM 1703 N SER A 110 -5.510 12.633 -1.182 1.00 0.00 N ATOM 1704 CA SER A 110 -6.763 13.148 -0.603 1.00 0.00 C ATOM 1705 C SER A 110 -6.859 12.750 0.879 1.00 0.00 C ATOM 1706 O SER A 110 -7.153 11.604 1.195 1.00 0.00 O ATOM 1707 CB SER A 110 -7.959 12.571 -1.357 1.00 0.00 C ATOM 1708 OG SER A 110 -8.858 13.634 -1.656 1.00 0.00 O ATOM 0 H SER A 110 -5.596 11.732 -1.652 1.00 0.00 H new ATOM 0 HA SER A 110 -6.768 14.235 -0.688 1.00 0.00 H new ATOM 0 HB2 SER A 110 -7.629 12.084 -2.275 1.00 0.00 H new ATOM 0 HB3 SER A 110 -8.457 11.812 -0.754 1.00 0.00 H new ATOM 0 HG SER A 110 -9.632 13.281 -2.142 1.00 0.00 H new ATOM 1714 N LYS A 111 -6.401 13.673 1.718 1.00 0.00 N ATOM 1715 CA LYS A 111 -6.411 13.467 3.181 1.00 0.00 C ATOM 1716 C LYS A 111 -7.820 13.231 3.703 1.00 0.00 C ATOM 1717 O LYS A 111 -8.172 12.138 4.141 1.00 0.00 O ATOM 1718 CB LYS A 111 -5.732 14.648 3.905 1.00 0.00 C ATOM 1719 CG LYS A 111 -4.984 14.215 5.172 1.00 0.00 C ATOM 1720 CD LYS A 111 -5.585 14.778 6.452 1.00 0.00 C ATOM 1721 CE LYS A 111 -4.760 14.386 7.682 1.00 0.00 C ATOM 1722 NZ LYS A 111 -3.777 15.422 8.014 1.00 0.00 N ATOM 0 H LYS A 111 -6.018 14.571 1.422 1.00 0.00 H new ATOM 0 HA LYS A 111 -5.835 12.566 3.394 1.00 0.00 H new ATOM 0 HB2 LYS A 111 -5.033 15.133 3.224 1.00 0.00 H new ATOM 0 HB3 LYS A 111 -6.486 15.389 4.169 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -4.981 13.126 5.229 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -3.944 14.533 5.097 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -5.641 15.864 6.381 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -6.606 14.413 6.566 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -5.423 14.225 8.532 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -4.248 13.442 7.494 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 -3.233 15.129 8.851 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 -3.130 15.557 7.211 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 -4.269 16.316 8.216 1.00 0.00 H new ATOM 1736 N LYS A 112 -8.606 14.279 3.533 1.00 0.00 N ATOM 1737 CA LYS A 112 -10.007 14.290 3.937 1.00 0.00 C ATOM 1738 C LYS A 112 -10.897 14.912 2.844 1.00 0.00 C ATOM 1739 O LYS A 112 -10.633 16.028 2.400 1.00 0.00 O ATOM 1740 CB LYS A 112 -10.201 14.903 5.326 1.00 0.00 C ATOM 1741 CG LYS A 112 -9.469 16.229 5.490 1.00 0.00 C ATOM 1742 CD LYS A 112 -10.355 17.266 6.183 1.00 0.00 C ATOM 1743 CE LYS A 112 -11.403 17.825 5.220 1.00 0.00 C ATOM 1744 NZ LYS A 112 -12.182 18.835 5.926 1.00 0.00 N ATOM 0 H LYS A 112 -8.292 15.152 3.109 1.00 0.00 H new ATOM 0 HA LYS A 112 -10.339 13.257 4.039 1.00 0.00 H new ATOM 0 HB2 LYS A 112 -11.265 15.055 5.506 1.00 0.00 H new ATOM 0 HB3 LYS A 112 -9.847 14.201 6.081 1.00 0.00 H new ATOM 0 HG2 LYS A 112 -8.560 16.076 6.071 1.00 0.00 H new ATOM 0 HG3 LYS A 112 -9.163 16.602 4.513 1.00 0.00 H new ATOM 0 HD2 LYS A 112 -10.850 16.811 7.041 1.00 0.00 H new ATOM 0 HD3 LYS A 112 -9.738 18.079 6.566 1.00 0.00 H new ATOM 0 HE2 LYS A 112 -10.920 18.261 4.345 1.00 0.00 H new ATOM 0 HE3 LYS A 112 -12.053 17.027 4.861 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 -12.902 19.228 5.286 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 -12.649 18.401 6.748 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 -11.552 19.597 6.248 1.00 0.00 H new ATOM 1758 N PRO A 113 -11.863 14.104 2.365 1.00 0.00 N ATOM 1759 CA PRO A 113 -12.090 12.715 2.789 1.00 0.00 C ATOM 1760 C PRO A 113 -11.052 11.776 2.167 1.00 0.00 C ATOM 1761 O PRO A 113 -10.109 12.213 1.489 1.00 0.00 O ATOM 1762 CB PRO A 113 -13.529 12.415 2.379 1.00 0.00 C ATOM 1763 CG PRO A 113 -13.794 13.324 1.176 1.00 0.00 C ATOM 1764 CD PRO A 113 -12.850 14.516 1.350 1.00 0.00 C ATOM 0 HA PRO A 113 -11.967 12.564 3.861 1.00 0.00 H new ATOM 0 HB2 PRO A 113 -13.654 11.365 2.116 1.00 0.00 H new ATOM 0 HB3 PRO A 113 -14.223 12.624 3.193 1.00 0.00 H new ATOM 0 HG2 PRO A 113 -13.599 12.802 0.239 1.00 0.00 H new ATOM 0 HG3 PRO A 113 -14.835 13.648 1.150 1.00 0.00 H new ATOM 0 HD2 PRO A 113 -12.361 14.768 0.409 1.00 0.00 H new ATOM 0 HD3 PRO A 113 -13.396 15.403 1.673 1.00 0.00 H new ATOM 1772 N LYS A 114 -11.204 10.502 2.471 1.00 0.00 N ATOM 1773 CA LYS A 114 -10.276 9.463 2.020 1.00 0.00 C ATOM 1774 C LYS A 114 -10.985 8.106 2.109 1.00 0.00 C ATOM 1775 O LYS A 114 -11.359 7.642 3.186 1.00 0.00 O ATOM 1776 CB LYS A 114 -9.027 9.487 2.913 1.00 0.00 C ATOM 1777 CG LYS A 114 -8.045 8.398 2.528 1.00 0.00 C ATOM 1778 CD LYS A 114 -7.347 7.844 3.770 1.00 0.00 C ATOM 1779 CE LYS A 114 -6.825 6.434 3.491 1.00 0.00 C ATOM 1780 NZ LYS A 114 -6.330 5.850 4.734 1.00 0.00 N ATOM 0 H LYS A 114 -11.974 10.149 3.039 1.00 0.00 H new ATOM 0 HA LYS A 114 -9.968 9.637 0.989 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -8.542 10.460 2.835 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -9.321 9.361 3.955 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -8.568 7.595 2.009 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -7.304 8.796 1.834 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -6.522 8.497 4.055 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -8.042 7.824 4.609 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -7.620 5.815 3.076 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -6.027 6.469 2.749 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -5.974 4.891 4.549 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -5.560 6.438 5.112 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -7.103 5.804 5.428 1.00 0.00 H new ATOM 1794 N GLU A 115 -11.244 7.557 0.934 1.00 0.00 N ATOM 1795 CA GLU A 115 -11.849 6.227 0.818 1.00 0.00 C ATOM 1796 C GLU A 115 -10.876 5.167 1.387 1.00 0.00 C ATOM 1797 O GLU A 115 -9.657 5.313 1.300 1.00 0.00 O ATOM 1798 CB GLU A 115 -12.205 5.915 -0.646 1.00 0.00 C ATOM 1799 CG GLU A 115 -12.875 4.541 -0.796 1.00 0.00 C ATOM 1800 CD GLU A 115 -13.175 4.186 -2.249 1.00 0.00 C ATOM 1801 OE1 GLU A 115 -12.283 3.577 -2.875 1.00 0.00 O ATOM 1802 OE2 GLU A 115 -14.292 4.527 -2.667 1.00 0.00 O ATOM 0 H GLU A 115 -11.047 8.008 0.041 1.00 0.00 H new ATOM 0 HA GLU A 115 -12.774 6.205 1.394 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -12.872 6.687 -1.029 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -11.300 5.945 -1.253 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -12.227 3.777 -0.366 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -13.803 4.530 -0.225 1.00 0.00 H new ATOM 1809 N ASN A 116 -11.486 4.113 1.906 1.00 0.00 N ATOM 1810 CA ASN A 116 -10.765 2.932 2.410 1.00 0.00 C ATOM 1811 C ASN A 116 -9.751 2.423 1.375 1.00 0.00 C ATOM 1812 O ASN A 116 -10.023 2.509 0.166 1.00 0.00 O ATOM 1813 CB ASN A 116 -11.748 1.812 2.769 1.00 0.00 C ATOM 1814 CG ASN A 116 -11.265 1.119 4.052 1.00 0.00 C ATOM 1815 OD1 ASN A 116 -10.866 -0.032 4.085 1.00 0.00 O ATOM 1816 ND2 ASN A 116 -11.225 1.889 5.112 1.00 0.00 N ATOM 0 H ASN A 116 -12.500 4.043 1.994 1.00 0.00 H new ATOM 0 HA ASN A 116 -10.224 3.231 3.308 1.00 0.00 H new ATOM 0 HB2 ASN A 116 -12.748 2.220 2.915 1.00 0.00 H new ATOM 0 HB3 ASN A 116 -11.813 1.092 1.953 1.00 0.00 H new ATOM 0 HD21 ASN A 116 -10.854 1.528 5.991 1.00 0.00 H new ATOM 0 HD22 ASN A 116 -11.565 2.849 5.058 1.00 0.00 H new ATOM 1823 N PRO A 117 -8.552 2.022 1.836 1.00 0.00 N ATOM 1824 CA PRO A 117 -7.503 1.521 0.939 1.00 0.00 C ATOM 1825 C PRO A 117 -7.890 0.136 0.389 1.00 0.00 C ATOM 1826 O PRO A 117 -9.030 -0.314 0.495 1.00 0.00 O ATOM 1827 CB PRO A 117 -6.237 1.548 1.796 1.00 0.00 C ATOM 1828 CG PRO A 117 -6.706 1.418 3.238 1.00 0.00 C ATOM 1829 CD PRO A 117 -8.098 2.050 3.241 1.00 0.00 C ATOM 0 HA PRO A 117 -7.351 2.118 0.040 1.00 0.00 H new ATOM 0 HB2 PRO A 117 -5.567 0.731 1.528 1.00 0.00 H new ATOM 0 HB3 PRO A 117 -5.684 2.476 1.647 1.00 0.00 H new ATOM 0 HG2 PRO A 117 -6.742 0.375 3.552 1.00 0.00 H new ATOM 0 HG3 PRO A 117 -6.033 1.934 3.923 1.00 0.00 H new ATOM 0 HD2 PRO A 117 -8.780 1.493 3.884 1.00 0.00 H new ATOM 0 HD3 PRO A 117 -8.064 3.071 3.621 1.00 0.00 H new ATOM 1837 N GLY A 118 -6.888 -0.508 -0.210 1.00 0.00 N ATOM 1838 CA GLY A 118 -7.026 -1.835 -0.815 1.00 0.00 C ATOM 1839 C GLY A 118 -6.354 -2.925 0.041 1.00 0.00 C ATOM 1840 O GLY A 118 -5.510 -2.602 0.871 1.00 0.00 O ATOM 0 H GLY A 118 -5.948 -0.120 -0.290 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -8.083 -2.070 -0.939 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -6.582 -1.829 -1.810 1.00 0.00 H new ATOM 1844 N PRO A 119 -6.737 -4.198 -0.175 1.00 0.00 N ATOM 1845 CA PRO A 119 -6.114 -5.341 0.519 1.00 0.00 C ATOM 1846 C PRO A 119 -4.705 -5.613 -0.007 1.00 0.00 C ATOM 1847 O PRO A 119 -3.811 -5.924 0.763 1.00 0.00 O ATOM 1848 CB PRO A 119 -7.038 -6.536 0.289 1.00 0.00 C ATOM 1849 CG PRO A 119 -7.907 -6.166 -0.908 1.00 0.00 C ATOM 1850 CD PRO A 119 -7.807 -4.652 -1.091 1.00 0.00 C ATOM 0 HA PRO A 119 -5.998 -5.137 1.583 1.00 0.00 H new ATOM 0 HB2 PRO A 119 -6.464 -7.441 0.090 1.00 0.00 H new ATOM 0 HB3 PRO A 119 -7.649 -6.733 1.170 1.00 0.00 H new ATOM 0 HG2 PRO A 119 -7.567 -6.685 -1.804 1.00 0.00 H new ATOM 0 HG3 PRO A 119 -8.941 -6.465 -0.739 1.00 0.00 H new ATOM 0 HD2 PRO A 119 -7.569 -4.399 -2.124 1.00 0.00 H new ATOM 0 HD3 PRO A 119 -8.754 -4.167 -0.854 1.00 0.00 H new ATOM 1858 N ALA A 120 -4.573 -5.500 -1.321 1.00 0.00 N ATOM 1859 CA ALA A 120 -3.283 -5.649 -2.014 1.00 0.00 C ATOM 1860 C ALA A 120 -2.568 -4.310 -2.157 1.00 0.00 C ATOM 1861 O ALA A 120 -3.169 -3.269 -2.396 1.00 0.00 O ATOM 1862 CB ALA A 120 -3.471 -6.311 -3.367 1.00 0.00 C ATOM 0 H ALA A 120 -5.354 -5.302 -1.946 1.00 0.00 H new ATOM 0 HA ALA A 120 -2.652 -6.294 -1.403 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -2.504 -6.411 -3.861 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -3.912 -7.298 -3.231 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -4.131 -5.700 -3.982 1.00 0.00 H new ATOM 1868 N ARG A 121 -1.280 -4.386 -1.855 1.00 0.00 N ATOM 1869 CA ARG A 121 -0.378 -3.231 -1.861 1.00 0.00 C ATOM 1870 C ARG A 121 0.937 -3.577 -2.550 1.00 0.00 C ATOM 1871 O ARG A 121 1.492 -4.651 -2.370 1.00 0.00 O ATOM 1872 CB ARG A 121 -0.087 -2.742 -0.443 1.00 0.00 C ATOM 1873 CG ARG A 121 -1.359 -2.188 0.197 1.00 0.00 C ATOM 1874 CD ARG A 121 -1.096 -0.861 0.906 1.00 0.00 C ATOM 1875 NE ARG A 121 -2.270 -0.484 1.720 1.00 0.00 N ATOM 1876 CZ ARG A 121 -2.582 -1.083 2.869 1.00 0.00 C ATOM 1877 NH1 ARG A 121 -1.842 -2.081 3.332 1.00 0.00 N ATOM 1878 NH2 ARG A 121 -3.643 -0.693 3.560 1.00 0.00 N ATOM 0 H ARG A 121 -0.821 -5.259 -1.595 1.00 0.00 H new ATOM 0 HA ARG A 121 -0.879 -2.435 -2.411 1.00 0.00 H new ATOM 0 HB2 ARG A 121 0.304 -3.562 0.159 1.00 0.00 H new ATOM 0 HB3 ARG A 121 0.682 -1.970 -0.468 1.00 0.00 H new ATOM 0 HG2 ARG A 121 -2.122 -2.048 -0.569 1.00 0.00 H new ATOM 0 HG3 ARG A 121 -1.753 -2.911 0.911 1.00 0.00 H new ATOM 0 HD2 ARG A 121 -0.215 -0.947 1.541 1.00 0.00 H new ATOM 0 HD3 ARG A 121 -0.886 -0.082 0.173 1.00 0.00 H new ATOM 0 HE ARG A 121 -2.870 0.270 1.387 1.00 0.00 H new ATOM 0 HH11 ARG A 121 -1.026 -2.397 2.808 1.00 0.00 H new ATOM 0 HH12 ARG A 121 -2.089 -2.533 4.212 1.00 0.00 H new ATOM 0 HH21 ARG A 121 -4.226 0.069 3.213 1.00 0.00 H new ATOM 0 HH22 ARG A 121 -3.877 -1.155 4.439 1.00 0.00 H new ATOM 1892 N VAL A 122 1.410 -2.614 -3.332 1.00 0.00 N ATOM 1893 CA VAL A 122 2.688 -2.735 -4.039 1.00 0.00 C ATOM 1894 C VAL A 122 3.840 -2.341 -3.112 1.00 0.00 C ATOM 1895 O VAL A 122 3.783 -1.302 -2.449 1.00 0.00 O ATOM 1896 CB VAL A 122 2.663 -1.930 -5.349 1.00 0.00 C ATOM 1897 CG1 VAL A 122 2.570 -0.412 -5.168 1.00 0.00 C ATOM 1898 CG2 VAL A 122 3.892 -2.241 -6.198 1.00 0.00 C ATOM 0 H VAL A 122 0.926 -1.731 -3.496 1.00 0.00 H new ATOM 0 HA VAL A 122 2.851 -3.775 -4.323 1.00 0.00 H new ATOM 0 HB VAL A 122 1.747 -2.248 -5.847 1.00 0.00 H new ATOM 0 HG11 VAL A 122 2.558 0.071 -6.145 1.00 0.00 H new ATOM 0 HG12 VAL A 122 1.655 -0.165 -4.630 1.00 0.00 H new ATOM 0 HG13 VAL A 122 3.431 -0.060 -4.600 1.00 0.00 H new ATOM 0 HG21 VAL A 122 3.854 -1.661 -7.120 1.00 0.00 H new ATOM 0 HG22 VAL A 122 4.793 -1.981 -5.643 1.00 0.00 H new ATOM 0 HG23 VAL A 122 3.908 -3.304 -6.439 1.00 0.00 H new ATOM 1908 N ILE A 123 4.864 -3.170 -3.119 1.00 0.00 N ATOM 1909 CA ILE A 123 6.077 -2.979 -2.294 1.00 0.00 C ATOM 1910 C ILE A 123 7.250 -2.695 -3.222 1.00 0.00 C ATOM 1911 O ILE A 123 7.307 -3.170 -4.351 1.00 0.00 O ATOM 1912 CB ILE A 123 6.366 -4.205 -1.410 1.00 0.00 C ATOM 1913 CG1 ILE A 123 5.114 -4.744 -0.722 1.00 0.00 C ATOM 1914 CG2 ILE A 123 7.466 -3.907 -0.384 1.00 0.00 C ATOM 1915 CD1 ILE A 123 4.273 -3.678 -0.017 1.00 0.00 C ATOM 0 H ILE A 123 4.894 -4.009 -3.698 1.00 0.00 H new ATOM 0 HA ILE A 123 5.920 -2.138 -1.619 1.00 0.00 H new ATOM 0 HB ILE A 123 6.722 -4.988 -2.079 1.00 0.00 H new ATOM 0 HG12 ILE A 123 4.494 -5.247 -1.464 1.00 0.00 H new ATOM 0 HG13 ILE A 123 5.411 -5.497 0.008 1.00 0.00 H new ATOM 0 HG21 ILE A 123 7.646 -4.793 0.224 1.00 0.00 H new ATOM 0 HG22 ILE A 123 8.384 -3.631 -0.904 1.00 0.00 H new ATOM 0 HG23 ILE A 123 7.152 -3.084 0.258 1.00 0.00 H new ATOM 0 HD11 ILE A 123 3.404 -4.147 0.445 1.00 0.00 H new ATOM 0 HD12 ILE A 123 4.873 -3.190 0.751 1.00 0.00 H new ATOM 0 HD13 ILE A 123 3.942 -2.936 -0.744 1.00 0.00 H new ATOM 1927 N TYR A 124 8.132 -1.865 -2.691 1.00 0.00 N ATOM 1928 CA TYR A 124 9.277 -1.326 -3.452 1.00 0.00 C ATOM 1929 C TYR A 124 10.160 -0.462 -2.573 1.00 0.00 C ATOM 1930 O TYR A 124 9.699 0.079 -1.562 1.00 0.00 O ATOM 1931 CB TYR A 124 8.775 -0.480 -4.640 1.00 0.00 C ATOM 1932 CG TYR A 124 7.884 0.693 -4.203 1.00 0.00 C ATOM 1933 CD1 TYR A 124 6.528 0.483 -3.832 1.00 0.00 C ATOM 1934 CD2 TYR A 124 8.458 1.978 -4.207 1.00 0.00 C ATOM 1935 CE1 TYR A 124 5.749 1.580 -3.427 1.00 0.00 C ATOM 1936 CE2 TYR A 124 7.668 3.081 -3.829 1.00 0.00 C ATOM 1937 CZ TYR A 124 6.336 2.867 -3.425 1.00 0.00 C ATOM 1938 OH TYR A 124 5.646 3.918 -2.928 1.00 0.00 O ATOM 0 H TYR A 124 8.087 -1.539 -1.726 1.00 0.00 H new ATOM 0 HA TYR A 124 9.859 -2.172 -3.817 1.00 0.00 H new ATOM 0 HB2 TYR A 124 9.632 -0.093 -5.192 1.00 0.00 H new ATOM 0 HB3 TYR A 124 8.217 -1.119 -5.324 1.00 0.00 H new ATOM 0 HD1 TYR A 124 6.101 -0.509 -3.861 1.00 0.00 H new ATOM 0 HD2 TYR A 124 9.489 2.116 -4.496 1.00 0.00 H new ATOM 0 HE1 TYR A 124 4.722 1.443 -3.123 1.00 0.00 H new ATOM 0 HE2 TYR A 124 8.079 4.080 -3.849 1.00 0.00 H new ATOM 0 HH TYR A 124 6.190 4.730 -2.999 1.00 0.00 H new ATOM 1948 N THR A 125 11.457 -0.565 -2.836 1.00 0.00 N ATOM 1949 CA THR A 125 12.475 0.179 -2.072 1.00 0.00 C ATOM 1950 C THR A 125 12.438 1.657 -2.468 1.00 0.00 C ATOM 1951 O THR A 125 11.501 2.102 -3.123 1.00 0.00 O ATOM 1952 CB THR A 125 13.855 -0.455 -2.325 1.00 0.00 C ATOM 1953 OG1 THR A 125 14.180 -0.290 -3.710 1.00 0.00 O ATOM 1954 CG2 THR A 125 13.888 -1.926 -1.941 1.00 0.00 C ATOM 0 H THR A 125 11.839 -1.157 -3.574 1.00 0.00 H new ATOM 0 HA THR A 125 12.269 0.123 -1.003 1.00 0.00 H new ATOM 0 HB THR A 125 14.593 0.046 -1.698 1.00 0.00 H new ATOM 0 HG1 THR A 125 15.058 -0.687 -3.890 1.00 0.00 H new ATOM 0 HG21 THR A 125 14.881 -2.331 -2.137 1.00 0.00 H new ATOM 0 HG22 THR A 125 13.656 -2.031 -0.881 1.00 0.00 H new ATOM 0 HG23 THR A 125 13.151 -2.472 -2.529 1.00 0.00 H new ATOM 1962 N TYR A 126 13.515 2.380 -2.210 1.00 0.00 N ATOM 1963 CA TYR A 126 13.606 3.831 -2.471 1.00 0.00 C ATOM 1964 C TYR A 126 15.036 4.371 -2.253 1.00 0.00 C ATOM 1965 O TYR A 126 15.735 3.828 -1.409 1.00 0.00 O ATOM 1966 CB TYR A 126 12.569 4.548 -1.592 1.00 0.00 C ATOM 1967 CG TYR A 126 12.927 5.961 -1.153 1.00 0.00 C ATOM 1968 CD1 TYR A 126 12.708 7.074 -1.970 1.00 0.00 C ATOM 1969 CD2 TYR A 126 13.584 6.102 0.082 1.00 0.00 C ATOM 1970 CE1 TYR A 126 13.162 8.353 -1.609 1.00 0.00 C ATOM 1971 CE2 TYR A 126 14.017 7.385 0.467 1.00 0.00 C ATOM 1972 CZ TYR A 126 13.813 8.486 -0.378 1.00 0.00 C ATOM 1973 OH TYR A 126 14.225 9.708 0.035 1.00 0.00 O ATOM 0 H TYR A 126 14.366 1.985 -1.810 1.00 0.00 H new ATOM 0 HA TYR A 126 13.382 4.027 -3.520 1.00 0.00 H new ATOM 0 HB2 TYR A 126 11.625 4.586 -2.136 1.00 0.00 H new ATOM 0 HB3 TYR A 126 12.398 3.944 -0.701 1.00 0.00 H new ATOM 0 HD1 TYR A 126 12.177 6.947 -2.902 1.00 0.00 H new ATOM 0 HD2 TYR A 126 13.752 5.247 0.720 1.00 0.00 H new ATOM 0 HE1 TYR A 126 13.014 9.203 -2.258 1.00 0.00 H new ATOM 0 HE2 TYR A 126 14.509 7.522 1.418 1.00 0.00 H new ATOM 0 HH TYR A 126 14.658 9.629 0.911 1.00 0.00 H new ATOM 1983 N PRO A 127 15.465 5.343 -3.078 1.00 0.00 N ATOM 1984 CA PRO A 127 14.736 5.855 -4.261 1.00 0.00 C ATOM 1985 C PRO A 127 14.748 4.932 -5.466 1.00 0.00 C ATOM 1986 O PRO A 127 13.914 5.070 -6.347 1.00 0.00 O ATOM 1987 CB PRO A 127 15.311 7.228 -4.566 1.00 0.00 C ATOM 1988 CG PRO A 127 16.722 7.169 -3.983 1.00 0.00 C ATOM 1989 CD PRO A 127 16.697 6.112 -2.876 1.00 0.00 C ATOM 0 HA PRO A 127 13.674 5.916 -4.024 1.00 0.00 H new ATOM 0 HB2 PRO A 127 15.329 7.425 -5.638 1.00 0.00 H new ATOM 0 HB3 PRO A 127 14.721 8.020 -4.106 1.00 0.00 H new ATOM 0 HG2 PRO A 127 17.448 6.906 -4.752 1.00 0.00 H new ATOM 0 HG3 PRO A 127 17.017 8.140 -3.585 1.00 0.00 H new ATOM 0 HD2 PRO A 127 17.573 5.467 -2.933 1.00 0.00 H new ATOM 0 HD3 PRO A 127 16.708 6.579 -1.891 1.00 0.00 H new ATOM 1997 N ASN A 128 15.535 3.864 -5.309 1.00 0.00 N ATOM 1998 CA ASN A 128 15.655 2.779 -6.301 1.00 0.00 C ATOM 1999 C ASN A 128 14.284 2.355 -6.802 1.00 0.00 C ATOM 2000 O ASN A 128 14.069 2.329 -8.016 1.00 0.00 O ATOM 2001 CB ASN A 128 16.343 1.575 -5.660 1.00 0.00 C ATOM 2002 CG ASN A 128 17.537 1.167 -6.523 1.00 0.00 C ATOM 2003 OD1 ASN A 128 17.452 0.532 -7.558 1.00 0.00 O ATOM 2004 ND2 ASN A 128 18.693 1.640 -6.130 1.00 0.00 N ATOM 0 H ASN A 128 16.115 3.722 -4.482 1.00 0.00 H new ATOM 0 HA ASN A 128 16.243 3.145 -7.143 1.00 0.00 H new ATOM 0 HB2 ASN A 128 16.674 1.823 -4.652 1.00 0.00 H new ATOM 0 HB3 ASN A 128 15.642 0.745 -5.570 1.00 0.00 H new ATOM 0 HD21 ASN A 128 19.528 1.477 -6.692 1.00 0.00 H new ATOM 0 HD22 ASN A 128 18.758 2.171 -5.262 1.00 0.00 H new ATOM 2011 N LYS A 129 13.350 2.185 -5.860 1.00 0.00 N ATOM 2012 CA LYS A 129 11.968 1.768 -6.143 1.00 0.00 C ATOM 2013 C LYS A 129 11.956 0.435 -6.878 1.00 0.00 C ATOM 2014 O LYS A 129 11.112 0.192 -7.745 1.00 0.00 O ATOM 2015 CB LYS A 129 11.207 2.844 -6.943 1.00 0.00 C ATOM 2016 CG LYS A 129 10.822 4.036 -6.087 1.00 0.00 C ATOM 2017 CD LYS A 129 10.158 5.092 -6.965 1.00 0.00 C ATOM 2018 CE LYS A 129 8.723 5.356 -6.530 1.00 0.00 C ATOM 2019 NZ LYS A 129 8.359 6.767 -6.754 1.00 0.00 N ATOM 0 H LYS A 129 13.532 2.334 -4.868 1.00 0.00 H new ATOM 0 HA LYS A 129 11.453 1.644 -5.191 1.00 0.00 H new ATOM 0 HB2 LYS A 129 11.827 3.182 -7.774 1.00 0.00 H new ATOM 0 HB3 LYS A 129 10.308 2.404 -7.374 1.00 0.00 H new ATOM 0 HG2 LYS A 129 10.141 3.725 -5.294 1.00 0.00 H new ATOM 0 HG3 LYS A 129 11.706 4.452 -5.603 1.00 0.00 H new ATOM 0 HD2 LYS A 129 10.730 6.019 -6.918 1.00 0.00 H new ATOM 0 HD3 LYS A 129 10.170 4.763 -8.004 1.00 0.00 H new ATOM 0 HE2 LYS A 129 8.045 4.708 -7.086 1.00 0.00 H new ATOM 0 HE3 LYS A 129 8.607 5.109 -5.475 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 7.693 7.075 -6.017 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 9.215 7.357 -6.715 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 7.912 6.866 -7.688 1.00 0.00 H new ATOM 2033 N VAL A 130 12.927 -0.397 -6.511 1.00 0.00 N ATOM 2034 CA VAL A 130 13.111 -1.742 -7.076 1.00 0.00 C ATOM 2035 C VAL A 130 11.884 -2.562 -6.670 1.00 0.00 C ATOM 2036 O VAL A 130 11.843 -3.142 -5.580 1.00 0.00 O ATOM 2037 CB VAL A 130 14.408 -2.402 -6.549 1.00 0.00 C ATOM 2038 CG1 VAL A 130 14.535 -3.858 -6.997 1.00 0.00 C ATOM 2039 CG2 VAL A 130 15.627 -1.700 -7.116 1.00 0.00 C ATOM 0 H VAL A 130 13.621 -0.158 -5.803 1.00 0.00 H new ATOM 0 HA VAL A 130 13.208 -1.690 -8.160 1.00 0.00 H new ATOM 0 HB VAL A 130 14.355 -2.334 -5.462 1.00 0.00 H new ATOM 0 HG11 VAL A 130 15.460 -4.280 -6.604 1.00 0.00 H new ATOM 0 HG12 VAL A 130 13.686 -4.430 -6.621 1.00 0.00 H new ATOM 0 HG13 VAL A 130 14.549 -3.904 -8.086 1.00 0.00 H new ATOM 0 HG21 VAL A 130 16.531 -2.176 -6.736 1.00 0.00 H new ATOM 0 HG22 VAL A 130 15.612 -1.767 -8.204 1.00 0.00 H new ATOM 0 HG23 VAL A 130 15.616 -0.652 -6.816 1.00 0.00 H new ATOM 2049 N PHE A 131 10.886 -2.470 -7.544 1.00 0.00 N ATOM 2050 CA PHE A 131 9.607 -3.170 -7.406 1.00 0.00 C ATOM 2051 C PHE A 131 9.833 -4.595 -6.893 1.00 0.00 C ATOM 2052 O PHE A 131 10.467 -5.413 -7.550 1.00 0.00 O ATOM 2053 CB PHE A 131 8.923 -3.161 -8.772 1.00 0.00 C ATOM 2054 CG PHE A 131 7.707 -4.069 -8.791 1.00 0.00 C ATOM 2055 CD1 PHE A 131 6.611 -3.781 -7.949 1.00 0.00 C ATOM 2056 CD2 PHE A 131 7.733 -5.207 -9.622 1.00 0.00 C ATOM 2057 CE1 PHE A 131 5.497 -4.638 -7.947 1.00 0.00 C ATOM 2058 CE2 PHE A 131 6.627 -6.071 -9.618 1.00 0.00 C ATOM 2059 CZ PHE A 131 5.520 -5.770 -8.791 1.00 0.00 C ATOM 0 H PHE A 131 10.942 -1.896 -8.385 1.00 0.00 H new ATOM 0 HA PHE A 131 8.968 -2.672 -6.677 1.00 0.00 H new ATOM 0 HB2 PHE A 131 8.623 -2.144 -9.023 1.00 0.00 H new ATOM 0 HB3 PHE A 131 9.630 -3.482 -9.536 1.00 0.00 H new ATOM 0 HD1 PHE A 131 6.628 -2.909 -7.312 1.00 0.00 H new ATOM 0 HD2 PHE A 131 8.588 -5.410 -10.250 1.00 0.00 H new ATOM 0 HE1 PHE A 131 4.644 -4.436 -7.316 1.00 0.00 H new ATOM 0 HE2 PHE A 131 6.621 -6.955 -10.239 1.00 0.00 H new ATOM 0 HZ PHE A 131 4.664 -6.428 -8.805 1.00 0.00 H new ATOM 2069 N CYS A 132 9.444 -4.765 -5.639 1.00 0.00 N ATOM 2070 CA CYS A 132 9.661 -6.061 -4.963 1.00 0.00 C ATOM 2071 C CYS A 132 8.515 -6.997 -5.362 1.00 0.00 C ATOM 2072 O CYS A 132 8.725 -8.006 -6.038 1.00 0.00 O ATOM 2073 CB CYS A 132 9.699 -5.861 -3.449 1.00 0.00 C ATOM 2074 SG CYS A 132 10.827 -4.568 -2.834 1.00 0.00 S ATOM 0 H CYS A 132 8.988 -4.051 -5.071 1.00 0.00 H new ATOM 0 HA CYS A 132 10.614 -6.496 -5.263 1.00 0.00 H new ATOM 0 HB2 CYS A 132 8.690 -5.625 -3.110 1.00 0.00 H new ATOM 0 HB3 CYS A 132 9.978 -6.807 -2.986 1.00 0.00 H new ATOM 2079 N GLY A 133 7.311 -6.547 -5.044 1.00 0.00 N ATOM 2080 CA GLY A 133 6.087 -7.283 -5.338 1.00 0.00 C ATOM 2081 C GLY A 133 4.828 -6.676 -4.753 1.00 0.00 C ATOM 2082 O GLY A 133 4.874 -5.636 -4.108 1.00 0.00 O ATOM 0 H GLY A 133 7.153 -5.657 -4.572 1.00 0.00 H new ATOM 0 HA2 GLY A 133 5.972 -7.353 -6.420 1.00 0.00 H new ATOM 0 HA3 GLY A 133 6.192 -8.301 -4.962 1.00 0.00 H new ATOM 2086 N ILE A 134 3.723 -7.361 -4.997 1.00 0.00 N ATOM 2087 CA ILE A 134 2.428 -6.938 -4.436 1.00 0.00 C ATOM 2088 C ILE A 134 2.067 -7.901 -3.312 1.00 0.00 C ATOM 2089 O ILE A 134 2.126 -9.118 -3.458 1.00 0.00 O ATOM 2090 CB ILE A 134 1.341 -6.839 -5.518 1.00 0.00 C ATOM 2091 CG1 ILE A 134 1.588 -5.620 -6.393 1.00 0.00 C ATOM 2092 CG2 ILE A 134 -0.091 -6.700 -4.971 1.00 0.00 C ATOM 2093 CD1 ILE A 134 2.331 -6.012 -7.668 1.00 0.00 C ATOM 0 H ILE A 134 3.684 -8.203 -5.571 1.00 0.00 H new ATOM 0 HA ILE A 134 2.505 -5.931 -4.027 1.00 0.00 H new ATOM 0 HB ILE A 134 1.410 -7.778 -6.067 1.00 0.00 H new ATOM 0 HG12 ILE A 134 0.638 -5.152 -6.649 1.00 0.00 H new ATOM 0 HG13 ILE A 134 2.169 -4.881 -5.840 1.00 0.00 H new ATOM 0 HG21 ILE A 134 -0.793 -6.637 -5.802 1.00 0.00 H new ATOM 0 HG22 ILE A 134 -0.332 -7.568 -4.358 1.00 0.00 H new ATOM 0 HG23 ILE A 134 -0.163 -5.797 -4.365 1.00 0.00 H new ATOM 0 HD11 ILE A 134 2.497 -5.125 -8.279 1.00 0.00 H new ATOM 0 HD12 ILE A 134 3.291 -6.458 -7.407 1.00 0.00 H new ATOM 0 HD13 ILE A 134 1.736 -6.733 -8.229 1.00 0.00 H new ATOM 2105 N ILE A 135 1.784 -7.331 -2.169 1.00 0.00 N ATOM 2106 CA ILE A 135 1.380 -8.109 -0.993 1.00 0.00 C ATOM 2107 C ILE A 135 -0.062 -7.752 -0.618 1.00 0.00 C ATOM 2108 O ILE A 135 -0.472 -6.595 -0.677 1.00 0.00 O ATOM 2109 CB ILE A 135 2.333 -7.858 0.171 1.00 0.00 C ATOM 2110 CG1 ILE A 135 2.288 -6.380 0.526 1.00 0.00 C ATOM 2111 CG2 ILE A 135 3.748 -8.305 -0.192 1.00 0.00 C ATOM 2112 CD1 ILE A 135 2.580 -6.192 1.992 1.00 0.00 C ATOM 0 H ILE A 135 1.822 -6.324 -2.012 1.00 0.00 H new ATOM 0 HA ILE A 135 1.427 -9.172 -1.229 1.00 0.00 H new ATOM 0 HB ILE A 135 2.025 -8.441 1.039 1.00 0.00 H new ATOM 0 HG12 ILE A 135 3.017 -5.832 -0.071 1.00 0.00 H new ATOM 0 HG13 ILE A 135 1.307 -5.970 0.287 1.00 0.00 H new ATOM 0 HG21 ILE A 135 4.415 -8.119 0.649 1.00 0.00 H new ATOM 0 HG22 ILE A 135 3.745 -9.370 -0.424 1.00 0.00 H new ATOM 0 HG23 ILE A 135 4.095 -7.745 -1.061 1.00 0.00 H new ATOM 0 HD11 ILE A 135 2.546 -5.130 2.237 1.00 0.00 H new ATOM 0 HD12 ILE A 135 1.835 -6.725 2.583 1.00 0.00 H new ATOM 0 HD13 ILE A 135 3.571 -6.585 2.219 1.00 0.00 H new ATOM 2124 N ALA A 136 -0.799 -8.771 -0.254 1.00 0.00 N ATOM 2125 CA ALA A 136 -2.211 -8.610 0.115 1.00 0.00 C ATOM 2126 C ALA A 136 -2.550 -9.452 1.339 1.00 0.00 C ATOM 2127 O ALA A 136 -1.889 -10.448 1.588 1.00 0.00 O ATOM 2128 CB ALA A 136 -3.095 -9.037 -1.044 1.00 0.00 C ATOM 0 H ALA A 136 -0.457 -9.730 -0.200 1.00 0.00 H new ATOM 0 HA ALA A 136 -2.386 -7.560 0.350 1.00 0.00 H new ATOM 0 HB1 ALA A 136 -4.142 -8.916 -0.767 1.00 0.00 H new ATOM 0 HB2 ALA A 136 -2.877 -8.419 -1.915 1.00 0.00 H new ATOM 0 HB3 ALA A 136 -2.901 -10.083 -1.283 1.00 0.00 H new ATOM 2134 N HIS A 137 -3.677 -9.148 1.946 1.00 0.00 N ATOM 2135 CA HIS A 137 -4.112 -9.909 3.132 1.00 0.00 C ATOM 2136 C HIS A 137 -4.975 -11.082 2.688 1.00 0.00 C ATOM 2137 O HIS A 137 -5.982 -10.918 1.994 1.00 0.00 O ATOM 2138 CB HIS A 137 -4.910 -9.001 4.053 1.00 0.00 C ATOM 2139 CG HIS A 137 -4.125 -7.769 4.510 1.00 0.00 C ATOM 2140 ND1 HIS A 137 -3.529 -7.613 5.685 1.00 0.00 N ATOM 2141 CD2 HIS A 137 -4.038 -6.622 3.852 1.00 0.00 C ATOM 2142 CE1 HIS A 137 -3.111 -6.353 5.782 1.00 0.00 C ATOM 2143 NE2 HIS A 137 -3.386 -5.761 4.621 1.00 0.00 N ATOM 0 H HIS A 137 -4.307 -8.399 1.658 1.00 0.00 H new ATOM 0 HA HIS A 137 -3.240 -10.284 3.668 1.00 0.00 H new ATOM 0 HB2 HIS A 137 -5.815 -8.678 3.539 1.00 0.00 H new ATOM 0 HB3 HIS A 137 -5.226 -9.568 4.928 1.00 0.00 H new ATOM 0 HD1 HIS A 137 -3.411 -8.336 6.394 1.00 0.00 H new ATOM 0 HD2 HIS A 137 -4.429 -6.424 2.865 1.00 0.00 H new ATOM 0 HE1 HIS A 137 -2.638 -5.897 6.639 1.00 0.00 H new ATOM 2152 N THR A 138 -4.625 -12.259 3.172 1.00 0.00 N ATOM 2153 CA THR A 138 -5.334 -13.505 2.838 1.00 0.00 C ATOM 2154 C THR A 138 -6.565 -13.732 3.722 1.00 0.00 C ATOM 2155 O THR A 138 -6.888 -14.856 4.127 1.00 0.00 O ATOM 2156 CB THR A 138 -4.346 -14.665 2.982 1.00 0.00 C ATOM 2157 OG1 THR A 138 -3.520 -14.411 4.129 1.00 0.00 O ATOM 2158 CG2 THR A 138 -3.565 -14.822 1.692 1.00 0.00 C ATOM 0 H THR A 138 -3.841 -12.391 3.810 1.00 0.00 H new ATOM 0 HA THR A 138 -5.703 -13.437 1.815 1.00 0.00 H new ATOM 0 HB THR A 138 -4.854 -15.615 3.149 1.00 0.00 H new ATOM 0 HG1 THR A 138 -2.880 -15.145 4.240 1.00 0.00 H new ATOM 0 HG21 THR A 138 -2.860 -15.648 1.791 1.00 0.00 H new ATOM 0 HG22 THR A 138 -4.253 -15.029 0.873 1.00 0.00 H new ATOM 0 HG23 THR A 138 -3.019 -13.902 1.483 1.00 0.00 H new ATOM 2166 N LYS A 139 -7.294 -12.637 3.928 1.00 0.00 N ATOM 2167 CA LYS A 139 -8.496 -12.586 4.775 1.00 0.00 C ATOM 2168 C LYS A 139 -9.118 -11.189 4.727 1.00 0.00 C ATOM 2169 O LYS A 139 -9.004 -10.390 5.658 1.00 0.00 O ATOM 2170 CB LYS A 139 -8.183 -12.981 6.228 1.00 0.00 C ATOM 2171 CG LYS A 139 -9.460 -13.163 7.050 1.00 0.00 C ATOM 2172 CD LYS A 139 -9.629 -14.635 7.427 1.00 0.00 C ATOM 2173 CE LYS A 139 -11.108 -15.008 7.380 1.00 0.00 C ATOM 2174 NZ LYS A 139 -11.220 -16.463 7.441 1.00 0.00 N ATOM 0 H LYS A 139 -7.065 -11.738 3.504 1.00 0.00 H new ATOM 0 HA LYS A 139 -9.210 -13.309 4.382 1.00 0.00 H new ATOM 0 HB2 LYS A 139 -7.608 -13.907 6.238 1.00 0.00 H new ATOM 0 HB3 LYS A 139 -7.560 -12.214 6.688 1.00 0.00 H new ATOM 0 HG2 LYS A 139 -9.414 -12.551 7.951 1.00 0.00 H new ATOM 0 HG3 LYS A 139 -10.323 -12.823 6.478 1.00 0.00 H new ATOM 0 HD2 LYS A 139 -9.063 -15.264 6.740 1.00 0.00 H new ATOM 0 HD3 LYS A 139 -9.230 -14.813 8.426 1.00 0.00 H new ATOM 0 HE2 LYS A 139 -11.641 -14.552 8.214 1.00 0.00 H new ATOM 0 HE3 LYS A 139 -11.565 -14.631 6.465 1.00 0.00 H new ATOM 0 HZ1 LYS A 139 -12.001 -16.725 8.076 1.00 0.00 H new ATOM 0 HZ2 LYS A 139 -11.408 -16.837 6.489 1.00 0.00 H new ATOM 0 HZ3 LYS A 139 -10.331 -16.865 7.801 1.00 0.00 H new ATOM 2188 N GLU A 140 -9.730 -10.890 3.590 1.00 0.00 N ATOM 2189 CA GLU A 140 -10.432 -9.613 3.315 1.00 0.00 C ATOM 2190 C GLU A 140 -9.424 -8.488 3.146 1.00 0.00 C ATOM 2191 O GLU A 140 -8.889 -8.308 2.062 1.00 0.00 O ATOM 2192 CB GLU A 140 -11.498 -9.342 4.392 1.00 0.00 C ATOM 2193 CG GLU A 140 -12.926 -9.567 3.906 1.00 0.00 C ATOM 2194 CD GLU A 140 -13.656 -8.222 3.881 1.00 0.00 C ATOM 2195 OE1 GLU A 140 -13.711 -7.588 4.960 1.00 0.00 O ATOM 2196 OE2 GLU A 140 -14.195 -7.907 2.801 1.00 0.00 O ATOM 0 H GLU A 140 -9.761 -11.537 2.802 1.00 0.00 H new ATOM 0 HA GLU A 140 -10.973 -9.680 2.371 1.00 0.00 H new ATOM 0 HB2 GLU A 140 -11.309 -9.988 5.250 1.00 0.00 H new ATOM 0 HB3 GLU A 140 -11.399 -8.314 4.739 1.00 0.00 H new ATOM 0 HG2 GLU A 140 -12.920 -10.012 2.911 1.00 0.00 H new ATOM 0 HG3 GLU A 140 -13.443 -10.265 4.564 1.00 0.00 H new ATOM 2203 N ASN A 141 -9.033 -7.940 4.295 1.00 0.00 N ATOM 2204 CA ASN A 141 -8.083 -6.817 4.409 1.00 0.00 C ATOM 2205 C ASN A 141 -7.373 -6.843 5.774 1.00 0.00 C ATOM 2206 O ASN A 141 -7.075 -5.808 6.360 1.00 0.00 O ATOM 2207 CB ASN A 141 -8.863 -5.511 4.222 1.00 0.00 C ATOM 2208 CG ASN A 141 -9.398 -5.336 2.798 1.00 0.00 C ATOM 2209 OD1 ASN A 141 -10.363 -5.945 2.360 1.00 0.00 O ATOM 2210 ND2 ASN A 141 -8.781 -4.432 2.078 1.00 0.00 N ATOM 0 H ASN A 141 -9.372 -8.267 5.200 1.00 0.00 H new ATOM 0 HA ASN A 141 -7.312 -6.900 3.643 1.00 0.00 H new ATOM 0 HB2 ASN A 141 -9.697 -5.488 4.924 1.00 0.00 H new ATOM 0 HB3 ASN A 141 -8.216 -4.669 4.468 1.00 0.00 H new ATOM 0 HD21 ASN A 141 -9.104 -4.225 1.133 1.00 0.00 H new ATOM 0 HD22 ASN A 141 -7.977 -3.935 2.463 1.00 0.00 H new ATOM 2217 N GLN A 142 -7.168 -8.050 6.287 1.00 0.00 N ATOM 2218 CA GLN A 142 -6.513 -8.254 7.587 1.00 0.00 C ATOM 2219 C GLN A 142 -5.774 -9.591 7.640 1.00 0.00 C ATOM 2220 O GLN A 142 -5.988 -10.479 6.809 1.00 0.00 O ATOM 2221 CB GLN A 142 -7.557 -8.167 8.701 1.00 0.00 C ATOM 2222 CG GLN A 142 -6.986 -7.350 9.861 1.00 0.00 C ATOM 2223 CD GLN A 142 -8.033 -7.148 10.951 1.00 0.00 C ATOM 2224 OE1 GLN A 142 -8.857 -6.245 10.916 1.00 0.00 O ATOM 2225 NE2 GLN A 142 -8.008 -8.008 11.934 1.00 0.00 N ATOM 0 H GLN A 142 -7.447 -8.914 5.822 1.00 0.00 H new ATOM 0 HA GLN A 142 -5.769 -7.470 7.727 1.00 0.00 H new ATOM 0 HB2 GLN A 142 -8.469 -7.701 8.326 1.00 0.00 H new ATOM 0 HB3 GLN A 142 -7.827 -9.166 9.042 1.00 0.00 H new ATOM 0 HG2 GLN A 142 -6.116 -7.859 10.276 1.00 0.00 H new ATOM 0 HG3 GLN A 142 -6.644 -6.382 9.496 1.00 0.00 H new ATOM 0 HE21 GLN A 142 -7.311 -8.753 11.942 1.00 0.00 H new ATOM 0 HE22 GLN A 142 -8.685 -7.934 12.693 1.00 0.00 H new ATOM 2234 N GLY A 143 -4.855 -9.655 8.601 1.00 0.00 N ATOM 2235 CA GLY A 143 -3.998 -10.836 8.825 1.00 0.00 C ATOM 2236 C GLY A 143 -2.741 -10.734 7.953 1.00 0.00 C ATOM 2237 O GLY A 143 -2.658 -9.897 7.063 1.00 0.00 O ATOM 0 H GLY A 143 -4.677 -8.891 9.253 1.00 0.00 H new ATOM 0 HA2 GLY A 143 -3.719 -10.901 9.877 1.00 0.00 H new ATOM 0 HA3 GLY A 143 -4.547 -11.747 8.584 1.00 0.00 H new ATOM 2241 N GLU A 144 -1.745 -11.535 8.323 1.00 0.00 N ATOM 2242 CA GLU A 144 -0.449 -11.589 7.610 1.00 0.00 C ATOM 2243 C GLU A 144 -0.616 -11.493 6.085 1.00 0.00 C ATOM 2244 O GLU A 144 -1.429 -12.190 5.489 1.00 0.00 O ATOM 2245 CB GLU A 144 0.336 -12.863 7.924 1.00 0.00 C ATOM 2246 CG GLU A 144 1.336 -12.604 9.054 1.00 0.00 C ATOM 2247 CD GLU A 144 1.105 -13.522 10.255 1.00 0.00 C ATOM 2248 OE1 GLU A 144 -0.054 -13.548 10.726 1.00 0.00 O ATOM 2249 OE2 GLU A 144 2.084 -14.155 10.679 1.00 0.00 O ATOM 0 H GLU A 144 -1.802 -12.167 9.121 1.00 0.00 H new ATOM 0 HA GLU A 144 0.106 -10.723 7.970 1.00 0.00 H new ATOM 0 HB2 GLU A 144 -0.350 -13.660 8.211 1.00 0.00 H new ATOM 0 HB3 GLU A 144 0.864 -13.203 7.033 1.00 0.00 H new ATOM 0 HG2 GLU A 144 2.349 -12.748 8.679 1.00 0.00 H new ATOM 0 HG3 GLU A 144 1.259 -11.565 9.374 1.00 0.00 H new ATOM 2256 N LEU A 145 0.051 -10.473 5.556 1.00 0.00 N ATOM 2257 CA LEU A 145 -0.006 -10.191 4.113 1.00 0.00 C ATOM 2258 C LEU A 145 0.783 -11.270 3.371 1.00 0.00 C ATOM 2259 O LEU A 145 1.914 -11.578 3.720 1.00 0.00 O ATOM 2260 CB LEU A 145 0.569 -8.817 3.774 1.00 0.00 C ATOM 2261 CG LEU A 145 -0.182 -7.696 4.472 1.00 0.00 C ATOM 2262 CD1 LEU A 145 0.638 -7.121 5.626 1.00 0.00 C ATOM 2263 CD2 LEU A 145 -0.509 -6.593 3.458 1.00 0.00 C ATOM 0 H LEU A 145 0.634 -9.830 6.092 1.00 0.00 H new ATOM 0 HA LEU A 145 -1.052 -10.193 3.806 1.00 0.00 H new ATOM 0 HB2 LEU A 145 1.620 -8.783 4.062 1.00 0.00 H new ATOM 0 HB3 LEU A 145 0.529 -8.663 2.696 1.00 0.00 H new ATOM 0 HG LEU A 145 -1.106 -8.100 4.885 1.00 0.00 H new ATOM 0 HD11 LEU A 145 0.077 -6.321 6.108 1.00 0.00 H new ATOM 0 HD12 LEU A 145 0.845 -7.907 6.352 1.00 0.00 H new ATOM 0 HD13 LEU A 145 1.578 -6.725 5.242 1.00 0.00 H new ATOM 0 HD21 LEU A 145 -1.048 -5.788 3.957 1.00 0.00 H new ATOM 0 HD22 LEU A 145 0.416 -6.202 3.034 1.00 0.00 H new ATOM 0 HD23 LEU A 145 -1.128 -7.004 2.660 1.00 0.00 H new ATOM 2275 N LYS A 146 0.079 -11.957 2.483 1.00 0.00 N ATOM 2276 CA LYS A 146 0.705 -12.993 1.657 1.00 0.00 C ATOM 2277 C LYS A 146 1.186 -12.343 0.359 1.00 0.00 C ATOM 2278 O LYS A 146 0.421 -11.713 -0.375 1.00 0.00 O ATOM 2279 CB LYS A 146 -0.296 -14.096 1.332 1.00 0.00 C ATOM 2280 CG LYS A 146 0.396 -15.360 0.826 1.00 0.00 C ATOM 2281 CD LYS A 146 -0.436 -16.046 -0.256 1.00 0.00 C ATOM 2282 CE LYS A 146 0.402 -17.134 -0.932 1.00 0.00 C ATOM 2283 NZ LYS A 146 -0.301 -17.619 -2.122 1.00 0.00 N ATOM 0 H LYS A 146 -0.918 -11.822 2.313 1.00 0.00 H new ATOM 0 HA LYS A 146 1.541 -13.437 2.198 1.00 0.00 H new ATOM 0 HB2 LYS A 146 -0.878 -14.332 2.223 1.00 0.00 H new ATOM 0 HB3 LYS A 146 -0.998 -13.739 0.578 1.00 0.00 H new ATOM 0 HG2 LYS A 146 1.378 -15.106 0.428 1.00 0.00 H new ATOM 0 HG3 LYS A 146 0.557 -16.048 1.656 1.00 0.00 H new ATOM 0 HD2 LYS A 146 -1.333 -16.483 0.183 1.00 0.00 H new ATOM 0 HD3 LYS A 146 -0.766 -15.315 -0.994 1.00 0.00 H new ATOM 0 HE2 LYS A 146 1.378 -16.737 -1.209 1.00 0.00 H new ATOM 0 HE3 LYS A 146 0.578 -17.957 -0.239 1.00 0.00 H new ATOM 0 HZ1 LYS A 146 0.267 -18.358 -2.583 1.00 0.00 H new ATOM 0 HZ2 LYS A 146 -1.223 -18.013 -1.844 1.00 0.00 H new ATOM 0 HZ3 LYS A 146 -0.447 -16.831 -2.785 1.00 0.00 H new ATOM 2297 N LEU A 147 2.507 -12.395 0.212 1.00 0.00 N ATOM 2298 CA LEU A 147 3.225 -11.920 -0.990 1.00 0.00 C ATOM 2299 C LEU A 147 2.622 -12.597 -2.218 1.00 0.00 C ATOM 2300 O LEU A 147 2.806 -13.802 -2.414 1.00 0.00 O ATOM 2301 CB LEU A 147 4.717 -12.241 -0.860 1.00 0.00 C ATOM 2302 CG LEU A 147 5.496 -12.140 -2.181 1.00 0.00 C ATOM 2303 CD1 LEU A 147 5.688 -10.705 -2.661 1.00 0.00 C ATOM 2304 CD2 LEU A 147 6.828 -12.871 -2.033 1.00 0.00 C ATOM 0 H LEU A 147 3.127 -12.772 0.929 1.00 0.00 H new ATOM 0 HA LEU A 147 3.121 -10.840 -1.093 1.00 0.00 H new ATOM 0 HB2 LEU A 147 5.163 -11.560 -0.134 1.00 0.00 H new ATOM 0 HB3 LEU A 147 4.828 -13.249 -0.461 1.00 0.00 H new ATOM 0 HG LEU A 147 4.901 -12.620 -2.958 1.00 0.00 H new ATOM 0 HD11 LEU A 147 6.245 -10.706 -3.598 1.00 0.00 H new ATOM 0 HD12 LEU A 147 4.714 -10.241 -2.818 1.00 0.00 H new ATOM 0 HD13 LEU A 147 6.242 -10.141 -1.910 1.00 0.00 H new ATOM 0 HD21 LEU A 147 7.386 -12.803 -2.967 1.00 0.00 H new ATOM 0 HD22 LEU A 147 7.407 -12.414 -1.231 1.00 0.00 H new ATOM 0 HD23 LEU A 147 6.644 -13.919 -1.796 1.00 0.00 H new ATOM 2316 N CYS A 148 1.764 -11.839 -2.894 1.00 0.00 N ATOM 2317 CA CYS A 148 1.102 -12.296 -4.128 1.00 0.00 C ATOM 2318 C CYS A 148 2.173 -12.871 -5.066 1.00 0.00 C ATOM 2319 O CYS A 148 3.370 -12.620 -4.942 1.00 0.00 O ATOM 2320 CB CYS A 148 0.359 -11.156 -4.835 1.00 0.00 C ATOM 2321 SG CYS A 148 -0.660 -10.121 -3.706 1.00 0.00 S ATOM 0 H CYS A 148 1.504 -10.894 -2.610 1.00 0.00 H new ATOM 0 HA CYS A 148 0.363 -13.054 -3.867 1.00 0.00 H new ATOM 0 HB2 CYS A 148 1.086 -10.519 -5.340 1.00 0.00 H new ATOM 0 HB3 CYS A 148 -0.285 -11.578 -5.606 1.00 0.00 H new ATOM 2326 N SER A 149 1.687 -13.696 -5.975 1.00 0.00 N ATOM 2327 CA SER A 149 2.581 -14.405 -6.887 1.00 0.00 C ATOM 2328 C SER A 149 2.096 -14.201 -8.307 1.00 0.00 C ATOM 2329 O SER A 149 0.893 -14.156 -8.583 1.00 0.00 O ATOM 2330 CB SER A 149 2.619 -15.902 -6.570 1.00 0.00 C ATOM 2331 OG SER A 149 2.827 -16.089 -5.169 1.00 0.00 O ATOM 0 H SER A 149 0.695 -13.893 -6.105 1.00 0.00 H new ATOM 0 HA SER A 149 3.589 -14.007 -6.769 1.00 0.00 H new ATOM 0 HB2 SER A 149 1.685 -16.373 -6.875 1.00 0.00 H new ATOM 0 HB3 SER A 149 3.418 -16.384 -7.134 1.00 0.00 H new ATOM 0 HG SER A 149 2.849 -17.048 -4.967 1.00 0.00 H new ATOM 2337 N HIS A 150 3.072 -14.048 -9.186 1.00 0.00 N ATOM 2338 CA HIS A 150 2.803 -13.883 -10.618 1.00 0.00 C ATOM 2339 C HIS A 150 3.264 -15.093 -11.461 1.00 0.00 C ATOM 2340 O HIS A 150 2.656 -15.325 -12.526 1.00 0.00 O ATOM 2341 CB HIS A 150 3.441 -12.589 -11.112 1.00 0.00 C ATOM 2342 CG HIS A 150 4.942 -12.569 -10.834 1.00 0.00 C ATOM 2343 ND1 HIS A 150 5.888 -13.008 -11.651 1.00 0.00 N ATOM 2344 CD2 HIS A 150 5.541 -11.980 -9.816 1.00 0.00 C ATOM 2345 CE1 HIS A 150 7.069 -12.641 -11.168 1.00 0.00 C ATOM 2346 NE2 HIS A 150 6.856 -11.988 -10.028 1.00 0.00 N ATOM 2347 OXT HIS A 150 4.246 -15.733 -11.026 1.00 0.00 O ATOM 0 H HIS A 150 4.062 -14.034 -8.940 1.00 0.00 H new ATOM 0 HA HIS A 150 1.722 -13.826 -10.747 1.00 0.00 H new ATOM 0 HB2 HIS A 150 3.266 -12.480 -12.182 1.00 0.00 H new ATOM 0 HB3 HIS A 150 2.967 -11.738 -10.623 1.00 0.00 H new ATOM 0 HD2 HIS A 150 5.046 -11.560 -8.953 1.00 0.00 H new ATOM 0 HE1 HIS A 150 8.030 -12.837 -11.619 1.00 0.00 H new ATOM 0 HE2 HIS A 150 7.568 -11.571 -9.428 1.00 0.00 H new