USER MOD reduce.3.24.130724 H: found=0, std=0, add=1074, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 1079 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 109 HIS : no HE2:sc= 0.661 K(o=0.53,f=-5.4!) USER MOD Set 1.2: A 147 SER OG : rot -160:sc= -0.132 USER MOD Set 2.1: A 107 ASN : amide:sc= 0.499 K(o=-2.9,f=-4.4!) USER MOD Set 2.2: A 154 SER OG : rot 100:sc= -3.41! USER MOD Set 3.1: A 15 ASN : amide:sc= -1.62! K(o=-1.7!,f=-3) USER MOD Set 3.2: A 63 THR OG1 : rot 88:sc= -0.119 USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 1.22 (180deg=1.21) USER MOD Single : A 20 SER OG : rot 180:sc= 0.00675 USER MOD Single : A 21 HIS : no HD1:sc= -4.51! C(o=-4.5!,f=-3.7!) USER MOD Single : A 25 HIS : no HD1:sc= -0.735 K(o=-0.73,f=-1.8) USER MOD Single : A 28 HIS : no HD1:sc= -1.41 K(o=-1.4,f=-4.9!) USER MOD Single : A 29 TYR OH : rot -140:sc= -0.779 USER MOD Single : A 31 LYS NZ :NH3+ 174:sc= 1.06 (180deg=0.978) USER MOD Single : A 53 SER OG : rot 148:sc= 0.879 USER MOD Single : A 54 ASN : amide:sc= -2.33 K(o=-2.3,f=-3.2!) USER MOD Single : A 58 GLN : amide:sc= 0 X(o=0,f=0.067) USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 GLN : amide:sc= -0.341 X(o=-0.34,f=0) USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 73 TYR OH : rot 19:sc= 0.144 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 TYR OH : rot 165:sc= -0.478 USER MOD Single : A 88 LYS NZ :NH3+ 142:sc= 1.09 (180deg=-1.2!) USER MOD Single : A 110 THR OG1 : rot 180:sc= 0.00128 USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 HIS : no HD1:sc= -0.192 K(o=-0.19,f=-0.86) USER MOD Single : A 124 SER OG : rot -133:sc= 0.483 USER MOD Single : A 125 THR OG1 : rot -4:sc= 1.03 USER MOD Single : A 127 HIS : no HD1:sc= -2.39! C(o=-2.4!,f=-11!) USER MOD Single : A 134 SER OG : rot 180:sc= -0.953 USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD Single : A 143 GLN : amide:sc= 0.763 K(o=0.76,f=-1) USER MOD Single : A 148 THR OG1 : rot 180:sc= 0 USER MOD Single : A 150 THR OG1 : rot 180:sc= 0 USER MOD Single : A 152 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 159 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 168 CYS SG : rot 56:sc= -1.44! USER MOD Single : A 173 MET CE :methyl -161:sc= -2.76! (180deg=-4.58!) USER MOD Single : A 174 LYS NZ :NH3+ -178:sc= 0.775 (180deg=0.648) USER MOD Single : A 176 THR OG1 : rot 180:sc= -0.0405 USER MOD ----------------------------------------------------------------- ATOM 8 N LEU A 6 -9.749 13.419 4.179 1.00 0.72 N ATOM 9 CA LEU A 6 -9.256 12.065 3.968 1.00 0.55 C ATOM 10 C LEU A 6 -9.513 11.205 5.205 1.00 0.42 C ATOM 11 O LEU A 6 -9.740 9.997 5.105 1.00 0.36 O ATOM 12 CB LEU A 6 -7.761 12.106 3.638 1.00 0.53 C ATOM 13 CG LEU A 6 -7.162 10.787 3.148 1.00 0.44 C ATOM 14 CD1 LEU A 6 -7.852 10.335 1.877 1.00 0.52 C ATOM 15 CD2 LEU A 6 -5.670 10.926 2.910 1.00 0.47 C ATOM 0 HA LEU A 6 -9.789 11.618 3.129 1.00 0.55 H new ATOM 0 HB2 LEU A 6 -7.595 12.867 2.875 1.00 0.53 H new ATOM 0 HB3 LEU A 6 -7.218 12.424 4.528 1.00 0.53 H new ATOM 0 HG LEU A 6 -7.318 10.035 3.922 1.00 0.44 H new ATOM 0 HD11 LEU A 6 -7.415 9.395 1.540 1.00 0.52 H new ATOM 0 HD12 LEU A 6 -8.915 10.192 2.071 1.00 0.52 H new ATOM 0 HD13 LEU A 6 -7.723 11.093 1.104 1.00 0.52 H new ATOM 0 HD21 LEU A 6 -5.267 9.975 2.562 1.00 0.47 H new ATOM 0 HD22 LEU A 6 -5.492 11.693 2.156 1.00 0.47 H new ATOM 0 HD23 LEU A 6 -5.178 11.210 3.840 1.00 0.47 H new ATOM 27 N ALA A 7 -9.505 11.856 6.362 1.00 0.44 N ATOM 28 CA ALA A 7 -9.751 11.190 7.638 1.00 0.41 C ATOM 29 C ALA A 7 -11.141 10.562 7.694 1.00 0.39 C ATOM 30 O ALA A 7 -11.370 9.605 8.431 1.00 0.44 O ATOM 31 CB ALA A 7 -9.593 12.178 8.783 1.00 0.53 C ATOM 0 H ALA A 7 -9.329 12.857 6.444 1.00 0.44 H new ATOM 0 HA ALA A 7 -9.016 10.391 7.735 1.00 0.41 H new ATOM 0 HB1 ALA A 7 -9.779 11.671 9.730 1.00 0.53 H new ATOM 0 HB2 ALA A 7 -8.580 12.580 8.779 1.00 0.53 H new ATOM 0 HB3 ALA A 7 -10.307 12.993 8.662 1.00 0.53 H new ATOM 37 N ASP A 8 -12.066 11.109 6.918 1.00 0.41 N ATOM 38 CA ASP A 8 -13.443 10.630 6.927 1.00 0.48 C ATOM 39 C ASP A 8 -13.616 9.423 6.016 1.00 0.44 C ATOM 40 O ASP A 8 -14.354 8.490 6.337 1.00 0.60 O ATOM 41 CB ASP A 8 -14.397 11.747 6.496 1.00 0.61 C ATOM 42 CG ASP A 8 -15.823 11.260 6.312 1.00 1.30 C ATOM 43 OD1 ASP A 8 -16.409 10.732 7.278 1.00 1.44 O ATOM 44 OD2 ASP A 8 -16.375 11.419 5.201 1.00 2.18 O ATOM 0 H ASP A 8 -11.890 11.882 6.276 1.00 0.41 H new ATOM 0 HA ASP A 8 -13.682 10.325 7.946 1.00 0.48 H new ATOM 0 HB2 ASP A 8 -14.382 12.541 7.243 1.00 0.61 H new ATOM 0 HB3 ASP A 8 -14.042 12.182 5.562 1.00 0.61 H new ATOM 49 N LYS A 9 -12.915 9.425 4.891 1.00 0.33 N ATOM 50 CA LYS A 9 -13.149 8.414 3.873 1.00 0.34 C ATOM 51 C LYS A 9 -12.264 7.192 4.083 1.00 0.29 C ATOM 52 O LYS A 9 -12.453 6.177 3.430 1.00 0.36 O ATOM 53 CB LYS A 9 -12.935 8.962 2.452 1.00 0.44 C ATOM 54 CG LYS A 9 -12.872 10.483 2.343 1.00 0.65 C ATOM 55 CD LYS A 9 -14.168 11.150 2.781 1.00 0.86 C ATOM 56 CE LYS A 9 -15.376 10.582 2.059 1.00 1.24 C ATOM 57 NZ LYS A 9 -16.634 11.218 2.519 1.00 1.79 N ATOM 0 H LYS A 9 -12.190 10.105 4.663 1.00 0.33 H new ATOM 0 HA LYS A 9 -14.193 8.118 3.975 1.00 0.34 H new ATOM 0 HB2 LYS A 9 -12.008 8.547 2.056 1.00 0.44 H new ATOM 0 HB3 LYS A 9 -13.743 8.602 1.816 1.00 0.44 H new ATOM 0 HG2 LYS A 9 -12.050 10.855 2.955 1.00 0.65 H new ATOM 0 HG3 LYS A 9 -12.653 10.762 1.312 1.00 0.65 H new ATOM 0 HD2 LYS A 9 -14.296 11.022 3.856 1.00 0.86 H new ATOM 0 HD3 LYS A 9 -14.105 12.222 2.593 1.00 0.86 H new ATOM 0 HE2 LYS A 9 -15.263 10.732 0.985 1.00 1.24 H new ATOM 0 HE3 LYS A 9 -15.429 9.506 2.227 1.00 1.24 H new ATOM 0 HZ1 LYS A 9 -17.439 10.806 2.005 1.00 1.79 H new ATOM 0 HZ2 LYS A 9 -16.753 11.053 3.539 1.00 1.79 H new ATOM 0 HZ3 LYS A 9 -16.593 12.241 2.336 1.00 1.79 H new ATOM 71 N VAL A 10 -11.284 7.281 4.966 1.00 0.26 N ATOM 72 CA VAL A 10 -10.450 6.122 5.248 1.00 0.24 C ATOM 73 C VAL A 10 -11.280 4.945 5.767 1.00 0.23 C ATOM 74 O VAL A 10 -12.136 5.099 6.640 1.00 0.30 O ATOM 75 CB VAL A 10 -9.340 6.446 6.259 1.00 0.28 C ATOM 76 CG1 VAL A 10 -9.909 6.840 7.614 1.00 0.33 C ATOM 77 CG2 VAL A 10 -8.384 5.270 6.381 1.00 0.28 C ATOM 0 H VAL A 10 -11.048 8.123 5.491 1.00 0.26 H new ATOM 0 HA VAL A 10 -9.988 5.841 4.302 1.00 0.24 H new ATOM 0 HB VAL A 10 -8.785 7.307 5.888 1.00 0.28 H new ATOM 0 HG11 VAL A 10 -9.092 7.061 8.301 1.00 0.33 H new ATOM 0 HG12 VAL A 10 -10.538 7.723 7.502 1.00 0.33 H new ATOM 0 HG13 VAL A 10 -10.505 6.018 8.011 1.00 0.33 H new ATOM 0 HG21 VAL A 10 -7.601 5.511 7.100 1.00 0.28 H new ATOM 0 HG22 VAL A 10 -8.931 4.390 6.721 1.00 0.28 H new ATOM 0 HG23 VAL A 10 -7.934 5.065 5.410 1.00 0.28 H new ATOM 87 N ILE A 11 -11.038 3.771 5.206 1.00 0.24 N ATOM 88 CA ILE A 11 -11.710 2.566 5.662 1.00 0.29 C ATOM 89 C ILE A 11 -10.741 1.668 6.424 1.00 0.26 C ATOM 90 O ILE A 11 -11.094 1.083 7.451 1.00 0.28 O ATOM 91 CB ILE A 11 -12.364 1.789 4.482 1.00 0.38 C ATOM 92 CG1 ILE A 11 -12.481 0.293 4.794 1.00 0.53 C ATOM 93 CG2 ILE A 11 -11.582 1.997 3.196 1.00 0.92 C ATOM 94 CD1 ILE A 11 -13.312 -0.479 3.793 1.00 0.62 C ATOM 0 H ILE A 11 -10.384 3.627 4.437 1.00 0.24 H new ATOM 0 HA ILE A 11 -12.510 2.871 6.337 1.00 0.29 H new ATOM 0 HB ILE A 11 -13.370 2.187 4.347 1.00 0.38 H new ATOM 0 HG12 ILE A 11 -11.481 -0.139 4.832 1.00 0.53 H new ATOM 0 HG13 ILE A 11 -12.918 0.172 5.785 1.00 0.53 H new ATOM 0 HG21 ILE A 11 -12.059 1.444 2.387 1.00 0.92 H new ATOM 0 HG22 ILE A 11 -11.564 3.058 2.949 1.00 0.92 H new ATOM 0 HG23 ILE A 11 -10.561 1.638 3.329 1.00 0.92 H new ATOM 0 HD11 ILE A 11 -13.347 -1.529 4.082 1.00 0.62 H new ATOM 0 HD12 ILE A 11 -14.324 -0.074 3.771 1.00 0.62 H new ATOM 0 HD13 ILE A 11 -12.864 -0.390 2.803 1.00 0.62 H new ATOM 106 N TRP A 12 -9.511 1.609 5.943 1.00 0.23 N ATOM 107 CA TRP A 12 -8.532 0.671 6.461 1.00 0.21 C ATOM 108 C TRP A 12 -7.141 1.077 5.982 1.00 0.21 C ATOM 109 O TRP A 12 -6.987 1.569 4.867 1.00 0.25 O ATOM 110 CB TRP A 12 -8.916 -0.729 5.961 1.00 0.23 C ATOM 111 CG TRP A 12 -8.001 -1.847 6.352 1.00 0.25 C ATOM 112 CD1 TRP A 12 -8.186 -2.743 7.362 1.00 0.31 C ATOM 113 CD2 TRP A 12 -6.776 -2.213 5.709 1.00 0.26 C ATOM 114 NE1 TRP A 12 -7.153 -3.646 7.382 1.00 0.33 N ATOM 115 CE2 TRP A 12 -6.275 -3.342 6.378 1.00 0.29 C ATOM 116 CE3 TRP A 12 -6.060 -1.697 4.631 1.00 0.30 C ATOM 117 CZ2 TRP A 12 -5.086 -3.960 6.001 1.00 0.33 C ATOM 118 CZ3 TRP A 12 -4.885 -2.309 4.261 1.00 0.36 C ATOM 119 CH2 TRP A 12 -4.409 -3.432 4.942 1.00 0.36 C ATOM 0 H TRP A 12 -9.166 2.204 5.190 1.00 0.23 H new ATOM 0 HA TRP A 12 -8.518 0.670 7.551 1.00 0.21 H new ATOM 0 HB2 TRP A 12 -9.916 -0.961 6.328 1.00 0.23 H new ATOM 0 HB3 TRP A 12 -8.975 -0.700 4.873 1.00 0.23 H new ATOM 0 HD1 TRP A 12 -9.022 -2.742 8.046 1.00 0.31 H new ATOM 0 HE1 TRP A 12 -7.055 -4.420 8.040 1.00 0.33 H new ATOM 0 HE3 TRP A 12 -6.421 -0.832 4.095 1.00 0.30 H new ATOM 0 HZ2 TRP A 12 -4.714 -4.826 6.528 1.00 0.33 H new ATOM 0 HZ3 TRP A 12 -4.320 -1.914 3.429 1.00 0.36 H new ATOM 0 HH2 TRP A 12 -3.485 -3.892 4.623 1.00 0.36 H new ATOM 130 N ALA A 13 -6.133 0.900 6.818 1.00 0.23 N ATOM 131 CA ALA A 13 -4.774 1.239 6.424 1.00 0.23 C ATOM 132 C ALA A 13 -3.755 0.472 7.242 1.00 0.25 C ATOM 133 O ALA A 13 -3.887 0.348 8.459 1.00 0.26 O ATOM 134 CB ALA A 13 -4.531 2.732 6.563 1.00 0.25 C ATOM 0 H ALA A 13 -6.226 0.528 7.763 1.00 0.23 H new ATOM 0 HA ALA A 13 -4.656 0.956 5.378 1.00 0.23 H new ATOM 0 HB1 ALA A 13 -3.509 2.964 6.263 1.00 0.25 H new ATOM 0 HB2 ALA A 13 -5.228 3.275 5.925 1.00 0.25 H new ATOM 0 HB3 ALA A 13 -4.681 3.030 7.601 1.00 0.25 H new ATOM 140 N VAL A 14 -2.747 -0.050 6.567 1.00 0.27 N ATOM 141 CA VAL A 14 -1.635 -0.701 7.226 1.00 0.27 C ATOM 142 C VAL A 14 -0.317 -0.294 6.594 1.00 0.26 C ATOM 143 O VAL A 14 0.014 -0.689 5.466 1.00 0.33 O ATOM 144 CB VAL A 14 -1.748 -2.247 7.219 1.00 0.33 C ATOM 145 CG1 VAL A 14 -0.413 -2.896 7.568 1.00 0.70 C ATOM 146 CG2 VAL A 14 -2.795 -2.705 8.210 1.00 0.79 C ATOM 0 H VAL A 14 -2.678 -0.034 5.549 1.00 0.27 H new ATOM 0 HA VAL A 14 -1.667 -0.370 8.264 1.00 0.27 H new ATOM 0 HB VAL A 14 -2.038 -2.551 6.213 1.00 0.33 H new ATOM 0 HG11 VAL A 14 -0.521 -3.981 7.556 1.00 0.70 H new ATOM 0 HG12 VAL A 14 0.339 -2.598 6.837 1.00 0.70 H new ATOM 0 HG13 VAL A 14 -0.100 -2.574 8.561 1.00 0.70 H new ATOM 0 HG21 VAL A 14 -2.862 -3.793 8.192 1.00 0.79 H new ATOM 0 HG22 VAL A 14 -2.518 -2.375 9.211 1.00 0.79 H new ATOM 0 HG23 VAL A 14 -3.761 -2.278 7.942 1.00 0.79 H new ATOM 156 N ASN A 15 0.412 0.531 7.312 1.00 0.26 N ATOM 157 CA ASN A 15 1.804 0.720 7.020 1.00 0.28 C ATOM 158 C ASN A 15 2.557 -0.433 7.653 1.00 0.28 C ATOM 159 O ASN A 15 3.003 -0.355 8.797 1.00 0.34 O ATOM 160 CB ASN A 15 2.313 2.060 7.557 1.00 0.32 C ATOM 161 CG ASN A 15 3.803 2.225 7.361 1.00 0.50 C ATOM 162 OD1 ASN A 15 4.481 2.817 8.194 1.00 1.49 O ATOM 163 ND2 ASN A 15 4.315 1.714 6.257 1.00 0.83 N ATOM 0 H ASN A 15 0.060 1.077 8.098 1.00 0.26 H new ATOM 0 HA ASN A 15 1.960 0.739 5.941 1.00 0.28 H new ATOM 0 HB2 ASN A 15 1.790 2.873 7.054 1.00 0.32 H new ATOM 0 HB3 ASN A 15 2.077 2.137 8.618 1.00 0.32 H new ATOM 0 HD21 ASN A 15 5.313 1.804 6.069 1.00 0.83 H new ATOM 0 HD22 ASN A 15 3.712 1.229 5.592 1.00 0.83 H new ATOM 170 N ALA A 16 2.652 -1.522 6.912 1.00 0.33 N ATOM 171 CA ALA A 16 3.280 -2.721 7.405 1.00 0.39 C ATOM 172 C ALA A 16 4.754 -2.478 7.612 1.00 0.37 C ATOM 173 O ALA A 16 5.542 -2.394 6.639 1.00 0.38 O ATOM 174 CB ALA A 16 3.040 -3.893 6.472 1.00 0.48 C ATOM 0 H ALA A 16 2.297 -1.594 5.959 1.00 0.33 H new ATOM 0 HA ALA A 16 2.832 -2.980 8.364 1.00 0.39 H new ATOM 0 HB1 ALA A 16 3.527 -4.782 6.872 1.00 0.48 H new ATOM 0 HB2 ALA A 16 1.969 -4.074 6.384 1.00 0.48 H new ATOM 0 HB3 ALA A 16 3.452 -3.666 5.489 1.00 0.48 H new ATOM 180 N GLY A 17 5.083 -2.323 8.895 1.00 0.40 N ATOM 181 CA GLY A 17 6.439 -2.084 9.322 1.00 0.45 C ATOM 182 C GLY A 17 6.529 -1.773 10.805 1.00 0.49 C ATOM 183 O GLY A 17 7.453 -2.213 11.477 1.00 0.76 O ATOM 0 H GLY A 17 4.408 -2.362 9.659 1.00 0.40 H new ATOM 0 HA2 GLY A 17 7.048 -2.960 9.099 1.00 0.45 H new ATOM 0 HA3 GLY A 17 6.856 -1.253 8.753 1.00 0.45 H new ATOM 187 N GLY A 18 5.566 -1.017 11.318 1.00 0.57 N ATOM 188 CA GLY A 18 5.606 -0.608 12.718 1.00 0.66 C ATOM 189 C GLY A 18 4.278 -0.817 13.420 1.00 0.57 C ATOM 190 O GLY A 18 3.588 -1.805 13.170 1.00 0.74 O ATOM 0 H GLY A 18 4.758 -0.678 10.795 1.00 0.57 H new ATOM 0 HA2 GLY A 18 6.381 -1.173 13.237 1.00 0.66 H new ATOM 0 HA3 GLY A 18 5.884 0.444 12.778 1.00 0.66 H new ATOM 194 N GLU A 19 3.902 0.119 14.289 1.00 0.53 N ATOM 195 CA GLU A 19 2.604 0.056 14.947 1.00 0.50 C ATOM 196 C GLU A 19 1.748 1.273 14.584 1.00 0.45 C ATOM 197 O GLU A 19 2.283 2.299 14.159 1.00 0.64 O ATOM 198 CB GLU A 19 2.749 -0.060 16.472 1.00 0.69 C ATOM 199 CG GLU A 19 3.214 1.215 17.165 1.00 1.27 C ATOM 200 CD GLU A 19 4.639 1.589 16.824 1.00 1.45 C ATOM 201 OE1 GLU A 19 5.564 1.120 17.519 1.00 1.77 O ATOM 202 OE2 GLU A 19 4.839 2.355 15.860 1.00 1.75 O ATOM 0 H GLU A 19 4.474 0.922 14.551 1.00 0.53 H new ATOM 0 HA GLU A 19 2.101 -0.842 14.589 1.00 0.50 H new ATOM 0 HB2 GLU A 19 1.789 -0.357 16.893 1.00 0.69 H new ATOM 0 HB3 GLU A 19 3.456 -0.858 16.697 1.00 0.69 H new ATOM 0 HG2 GLU A 19 2.553 2.035 16.886 1.00 1.27 H new ATOM 0 HG3 GLU A 19 3.126 1.088 18.244 1.00 1.27 H new ATOM 209 N SER A 20 0.427 1.113 14.728 1.00 0.42 N ATOM 210 CA SER A 20 -0.586 2.148 14.453 1.00 0.42 C ATOM 211 C SER A 20 -0.059 3.587 14.415 1.00 0.38 C ATOM 212 O SER A 20 0.523 4.083 15.380 1.00 0.44 O ATOM 213 CB SER A 20 -1.695 2.033 15.495 1.00 0.59 C ATOM 214 OG SER A 20 -2.225 0.719 15.514 1.00 1.29 O ATOM 0 H SER A 20 0.018 0.235 15.048 1.00 0.42 H new ATOM 0 HA SER A 20 -0.950 1.955 13.444 1.00 0.42 H new ATOM 0 HB2 SER A 20 -1.304 2.288 16.480 1.00 0.59 H new ATOM 0 HB3 SER A 20 -2.487 2.748 15.272 1.00 0.59 H new ATOM 0 HG SER A 20 -2.934 0.662 16.189 1.00 1.29 H new ATOM 220 N HIS A 21 -0.283 4.244 13.277 1.00 0.34 N ATOM 221 CA HIS A 21 0.120 5.632 13.090 1.00 0.33 C ATOM 222 C HIS A 21 -0.959 6.428 12.370 1.00 0.32 C ATOM 223 O HIS A 21 -1.379 6.078 11.270 1.00 0.32 O ATOM 224 CB HIS A 21 1.441 5.706 12.313 1.00 0.35 C ATOM 225 CG HIS A 21 1.791 7.068 11.785 1.00 0.35 C ATOM 226 ND1 HIS A 21 2.543 7.985 12.482 1.00 0.41 N ATOM 227 CD2 HIS A 21 1.503 7.651 10.597 1.00 0.40 C ATOM 228 CE1 HIS A 21 2.701 9.068 11.746 1.00 0.42 C ATOM 229 NE2 HIS A 21 2.081 8.890 10.598 1.00 0.41 N ATOM 0 H HIS A 21 -0.745 3.831 12.467 1.00 0.34 H new ATOM 0 HA HIS A 21 0.264 6.074 14.076 1.00 0.33 H new ATOM 0 HB2 HIS A 21 2.247 5.367 12.963 1.00 0.35 H new ATOM 0 HB3 HIS A 21 1.392 5.010 11.476 1.00 0.35 H new ATOM 0 HD2 HIS A 21 0.923 7.217 9.796 1.00 0.40 H new ATOM 0 HE1 HIS A 21 3.248 9.953 12.036 1.00 0.42 H new ATOM 0 HE2 HIS A 21 2.039 9.565 9.835 1.00 0.41 H new ATOM 238 N VAL A 22 -1.415 7.477 13.030 1.00 0.41 N ATOM 239 CA VAL A 22 -2.251 8.499 12.412 1.00 0.40 C ATOM 240 C VAL A 22 -1.359 9.526 11.736 1.00 0.40 C ATOM 241 O VAL A 22 -0.488 10.115 12.376 1.00 0.48 O ATOM 242 CB VAL A 22 -3.131 9.244 13.443 1.00 0.49 C ATOM 243 CG1 VAL A 22 -3.985 10.303 12.761 1.00 0.84 C ATOM 244 CG2 VAL A 22 -4.007 8.286 14.214 1.00 1.01 C ATOM 0 H VAL A 22 -1.217 7.648 14.016 1.00 0.41 H new ATOM 0 HA VAL A 22 -2.904 7.995 11.700 1.00 0.40 H new ATOM 0 HB VAL A 22 -2.462 9.735 14.149 1.00 0.49 H new ATOM 0 HG11 VAL A 22 -4.595 10.814 13.506 1.00 0.84 H new ATOM 0 HG12 VAL A 22 -3.339 11.026 12.263 1.00 0.84 H new ATOM 0 HG13 VAL A 22 -4.633 9.829 12.024 1.00 0.84 H new ATOM 0 HG21 VAL A 22 -4.612 8.842 14.930 1.00 1.01 H new ATOM 0 HG22 VAL A 22 -4.660 7.754 13.523 1.00 1.01 H new ATOM 0 HG23 VAL A 22 -3.382 7.570 14.747 1.00 1.01 H new ATOM 254 N ASP A 23 -1.555 9.735 10.451 1.00 0.37 N ATOM 255 CA ASP A 23 -0.751 10.709 9.730 1.00 0.42 C ATOM 256 C ASP A 23 -1.527 12.000 9.524 1.00 0.36 C ATOM 257 O ASP A 23 -2.739 12.041 9.754 1.00 0.33 O ATOM 258 CB ASP A 23 -0.305 10.159 8.384 1.00 0.51 C ATOM 259 CG ASP A 23 -1.164 10.663 7.243 1.00 0.55 C ATOM 260 OD1 ASP A 23 -2.243 10.100 7.003 1.00 0.77 O ATOM 261 OD2 ASP A 23 -0.768 11.660 6.614 1.00 0.75 O ATOM 0 H ASP A 23 -2.254 9.252 9.887 1.00 0.37 H new ATOM 0 HA ASP A 23 0.133 10.918 10.332 1.00 0.42 H new ATOM 0 HB2 ASP A 23 0.733 10.440 8.206 1.00 0.51 H new ATOM 0 HB3 ASP A 23 -0.341 9.070 8.409 1.00 0.51 H new ATOM 266 N VAL A 24 -0.808 13.020 9.032 1.00 0.38 N ATOM 267 CA VAL A 24 -1.318 14.385 8.869 1.00 0.37 C ATOM 268 C VAL A 24 -2.578 14.448 8.003 1.00 0.38 C ATOM 269 O VAL A 24 -3.352 15.402 8.095 1.00 0.49 O ATOM 270 CB VAL A 24 -0.241 15.312 8.249 1.00 0.42 C ATOM 271 CG1 VAL A 24 1.005 15.358 9.119 1.00 0.59 C ATOM 272 CG2 VAL A 24 0.120 14.871 6.836 1.00 0.62 C ATOM 0 H VAL A 24 0.161 12.915 8.732 1.00 0.38 H new ATOM 0 HA VAL A 24 -1.575 14.727 9.871 1.00 0.37 H new ATOM 0 HB VAL A 24 -0.664 16.315 8.197 1.00 0.42 H new ATOM 0 HG11 VAL A 24 1.744 16.015 8.661 1.00 0.59 H new ATOM 0 HG12 VAL A 24 0.745 15.737 10.107 1.00 0.59 H new ATOM 0 HG13 VAL A 24 1.420 14.355 9.213 1.00 0.59 H new ATOM 0 HG21 VAL A 24 0.877 15.541 6.428 1.00 0.62 H new ATOM 0 HG22 VAL A 24 0.511 13.854 6.861 1.00 0.62 H new ATOM 0 HG23 VAL A 24 -0.769 14.903 6.207 1.00 0.62 H new ATOM 282 N HIS A 25 -2.781 13.444 7.156 1.00 0.37 N ATOM 283 CA HIS A 25 -3.977 13.390 6.318 1.00 0.43 C ATOM 284 C HIS A 25 -5.167 12.937 7.152 1.00 0.40 C ATOM 285 O HIS A 25 -6.317 13.000 6.715 1.00 0.51 O ATOM 286 CB HIS A 25 -3.796 12.425 5.138 1.00 0.53 C ATOM 287 CG HIS A 25 -2.538 12.616 4.343 1.00 0.61 C ATOM 288 ND1 HIS A 25 -2.106 13.834 3.878 1.00 0.73 N ATOM 289 CD2 HIS A 25 -1.611 11.715 3.941 1.00 0.72 C ATOM 290 CE1 HIS A 25 -0.968 13.673 3.226 1.00 0.86 C ATOM 291 NE2 HIS A 25 -0.637 12.393 3.252 1.00 0.86 N ATOM 0 H HIS A 25 -2.139 12.661 7.031 1.00 0.37 H new ATOM 0 HA HIS A 25 -4.151 14.390 5.921 1.00 0.43 H new ATOM 0 HB2 HIS A 25 -3.815 11.404 5.519 1.00 0.53 H new ATOM 0 HB3 HIS A 25 -4.649 12.531 4.468 1.00 0.53 H new ATOM 0 HD2 HIS A 25 -1.634 10.652 4.129 1.00 0.72 H new ATOM 0 HE1 HIS A 25 -0.401 14.459 2.750 1.00 0.86 H new ATOM 0 HE2 HIS A 25 0.197 11.981 2.833 1.00 0.86 H new ATOM 300 N GLY A 26 -4.867 12.480 8.359 1.00 0.32 N ATOM 301 CA GLY A 26 -5.873 11.936 9.237 1.00 0.33 C ATOM 302 C GLY A 26 -6.062 10.469 8.985 1.00 0.30 C ATOM 303 O GLY A 26 -7.140 9.922 9.213 1.00 0.33 O ATOM 0 H GLY A 26 -3.924 12.479 8.748 1.00 0.32 H new ATOM 0 HA2 GLY A 26 -5.582 12.097 10.275 1.00 0.33 H new ATOM 0 HA3 GLY A 26 -6.817 12.460 9.086 1.00 0.33 H new ATOM 307 N ILE A 27 -5.003 9.821 8.519 1.00 0.26 N ATOM 308 CA ILE A 27 -5.084 8.401 8.202 1.00 0.24 C ATOM 309 C ILE A 27 -4.439 7.577 9.315 1.00 0.26 C ATOM 310 O ILE A 27 -3.231 7.650 9.543 1.00 0.28 O ATOM 311 CB ILE A 27 -4.435 8.044 6.831 1.00 0.24 C ATOM 312 CG1 ILE A 27 -5.259 8.577 5.650 1.00 0.26 C ATOM 313 CG2 ILE A 27 -4.282 6.542 6.680 1.00 0.27 C ATOM 314 CD1 ILE A 27 -6.726 8.251 5.735 1.00 0.31 C ATOM 0 H ILE A 27 -4.091 10.247 8.354 1.00 0.26 H new ATOM 0 HA ILE A 27 -6.143 8.157 8.123 1.00 0.24 H new ATOM 0 HB ILE A 27 -3.454 8.520 6.818 1.00 0.24 H new ATOM 0 HG12 ILE A 27 -5.140 9.659 5.595 1.00 0.26 H new ATOM 0 HG13 ILE A 27 -4.858 8.165 4.724 1.00 0.26 H new ATOM 0 HG21 ILE A 27 -3.827 6.318 5.715 1.00 0.27 H new ATOM 0 HG22 ILE A 27 -3.647 6.159 7.479 1.00 0.27 H new ATOM 0 HG23 ILE A 27 -5.262 6.069 6.737 1.00 0.27 H new ATOM 0 HD11 ILE A 27 -7.241 8.661 4.866 1.00 0.31 H new ATOM 0 HD12 ILE A 27 -6.858 7.169 5.758 1.00 0.31 H new ATOM 0 HD13 ILE A 27 -7.144 8.687 6.643 1.00 0.31 H new ATOM 326 N HIS A 28 -5.262 6.820 10.029 1.00 0.31 N ATOM 327 CA HIS A 28 -4.776 5.950 11.089 1.00 0.33 C ATOM 328 C HIS A 28 -4.529 4.553 10.545 1.00 0.33 C ATOM 329 O HIS A 28 -5.469 3.855 10.168 1.00 0.39 O ATOM 330 CB HIS A 28 -5.788 5.885 12.240 1.00 0.40 C ATOM 331 CG HIS A 28 -5.403 4.938 13.345 1.00 0.49 C ATOM 332 ND1 HIS A 28 -4.827 5.347 14.528 1.00 0.60 N ATOM 333 CD2 HIS A 28 -5.512 3.592 13.434 1.00 0.80 C ATOM 334 CE1 HIS A 28 -4.596 4.299 15.291 1.00 0.66 C ATOM 335 NE2 HIS A 28 -5.004 3.220 14.653 1.00 0.78 N ATOM 0 H HIS A 28 -6.272 6.792 9.892 1.00 0.31 H new ATOM 0 HA HIS A 28 -3.840 6.360 11.468 1.00 0.33 H new ATOM 0 HB2 HIS A 28 -5.910 6.884 12.659 1.00 0.40 H new ATOM 0 HB3 HIS A 28 -6.757 5.586 11.841 1.00 0.40 H new ATOM 0 HD2 HIS A 28 -5.923 2.932 12.684 1.00 0.80 H new ATOM 0 HE1 HIS A 28 -4.148 4.320 16.273 1.00 0.66 H new ATOM 0 HE2 HIS A 28 -4.951 2.265 15.007 1.00 0.78 H new ATOM 344 N TYR A 29 -3.273 4.147 10.511 1.00 0.32 N ATOM 345 CA TYR A 29 -2.938 2.799 10.095 1.00 0.35 C ATOM 346 C TYR A 29 -2.915 1.877 11.312 1.00 0.40 C ATOM 347 O TYR A 29 -2.502 2.290 12.389 1.00 0.44 O ATOM 348 CB TYR A 29 -1.622 2.809 9.304 1.00 0.42 C ATOM 349 CG TYR A 29 -0.368 2.350 10.018 1.00 0.65 C ATOM 350 CD1 TYR A 29 -0.133 1.012 10.309 1.00 0.80 C ATOM 351 CD2 TYR A 29 0.614 3.267 10.334 1.00 0.98 C ATOM 352 CE1 TYR A 29 1.051 0.615 10.898 1.00 1.17 C ATOM 353 CE2 TYR A 29 1.791 2.879 10.927 1.00 1.30 C ATOM 354 CZ TYR A 29 2.005 1.558 11.203 1.00 1.39 C ATOM 355 OH TYR A 29 3.186 1.182 11.777 1.00 1.75 O ATOM 0 H TYR A 29 -2.473 4.727 10.765 1.00 0.32 H new ATOM 0 HA TYR A 29 -3.698 2.405 9.421 1.00 0.35 H new ATOM 0 HB2 TYR A 29 -1.755 2.181 8.423 1.00 0.42 H new ATOM 0 HB3 TYR A 29 -1.452 3.825 8.948 1.00 0.42 H new ATOM 0 HD1 TYR A 29 -0.885 0.274 10.072 1.00 0.80 H new ATOM 0 HD2 TYR A 29 0.454 4.311 10.110 1.00 0.98 H new ATOM 0 HE1 TYR A 29 1.227 -0.428 11.118 1.00 1.17 H new ATOM 0 HE2 TYR A 29 2.543 3.614 11.174 1.00 1.30 H new ATOM 0 HH TYR A 29 3.440 1.836 12.461 1.00 1.75 H new ATOM 365 N ARG A 30 -3.385 0.643 11.137 1.00 0.50 N ATOM 366 CA ARG A 30 -3.632 -0.265 12.261 1.00 0.64 C ATOM 367 C ARG A 30 -2.518 -1.302 12.450 1.00 0.76 C ATOM 368 O ARG A 30 -2.714 -2.496 12.217 1.00 1.46 O ATOM 369 CB ARG A 30 -4.995 -0.960 12.087 1.00 0.83 C ATOM 370 CG ARG A 30 -5.271 -1.447 10.670 1.00 0.73 C ATOM 371 CD ARG A 30 -5.317 -2.965 10.577 1.00 0.93 C ATOM 372 NE ARG A 30 -6.496 -3.530 11.231 1.00 1.52 N ATOM 373 CZ ARG A 30 -7.005 -4.729 10.942 1.00 2.17 C ATOM 374 NH1 ARG A 30 -6.449 -5.483 9.999 1.00 2.48 N ATOM 375 NH2 ARG A 30 -8.068 -5.177 11.598 1.00 2.94 N ATOM 0 H ARG A 30 -3.604 0.246 10.224 1.00 0.50 H new ATOM 0 HA ARG A 30 -3.644 0.343 13.166 1.00 0.64 H new ATOM 0 HB2 ARG A 30 -5.047 -1.810 12.768 1.00 0.83 H new ATOM 0 HB3 ARG A 30 -5.784 -0.267 12.381 1.00 0.83 H new ATOM 0 HG2 ARG A 30 -6.220 -1.036 10.326 1.00 0.73 H new ATOM 0 HG3 ARG A 30 -4.498 -1.068 10.001 1.00 0.73 H new ATOM 0 HD2 ARG A 30 -5.310 -3.262 9.528 1.00 0.93 H new ATOM 0 HD3 ARG A 30 -4.418 -3.381 11.032 1.00 0.93 H new ATOM 0 HE ARG A 30 -6.957 -2.974 11.951 1.00 1.52 H new ATOM 0 HH11 ARG A 30 -5.630 -5.146 9.493 1.00 2.48 H new ATOM 0 HH12 ARG A 30 -6.841 -6.399 9.781 1.00 2.48 H new ATOM 0 HH21 ARG A 30 -8.498 -4.604 12.325 1.00 2.94 H new ATOM 0 HH22 ARG A 30 -8.456 -6.094 11.375 1.00 2.94 H new ATOM 389 N LYS A 31 -1.354 -0.820 12.877 1.00 0.59 N ATOM 390 CA LYS A 31 -0.228 -1.668 13.287 1.00 0.67 C ATOM 391 C LYS A 31 0.257 -2.557 12.142 1.00 0.86 C ATOM 392 O LYS A 31 -0.111 -2.353 10.985 1.00 1.37 O ATOM 393 CB LYS A 31 -0.633 -2.531 14.488 1.00 0.99 C ATOM 394 CG LYS A 31 0.532 -2.916 15.388 1.00 1.25 C ATOM 395 CD LYS A 31 0.112 -3.913 16.454 1.00 1.61 C ATOM 396 CE LYS A 31 -0.037 -5.319 15.889 1.00 2.18 C ATOM 397 NZ LYS A 31 1.279 -5.918 15.525 1.00 2.78 N ATOM 0 H LYS A 31 -1.160 0.179 12.950 1.00 0.59 H new ATOM 0 HA LYS A 31 0.596 -1.013 13.570 1.00 0.67 H new ATOM 0 HB2 LYS A 31 -1.373 -1.991 15.078 1.00 0.99 H new ATOM 0 HB3 LYS A 31 -1.115 -3.439 14.125 1.00 0.99 H new ATOM 0 HG2 LYS A 31 1.332 -3.344 14.784 1.00 1.25 H new ATOM 0 HG3 LYS A 31 0.935 -2.022 15.864 1.00 1.25 H new ATOM 0 HD2 LYS A 31 0.851 -3.920 17.256 1.00 1.61 H new ATOM 0 HD3 LYS A 31 -0.833 -3.597 16.895 1.00 1.61 H new ATOM 0 HE2 LYS A 31 -0.533 -5.954 16.623 1.00 2.18 H new ATOM 0 HE3 LYS A 31 -0.678 -5.289 15.008 1.00 2.18 H new ATOM 0 HZ1 LYS A 31 1.143 -6.909 15.241 1.00 2.78 H new ATOM 0 HZ2 LYS A 31 1.696 -5.386 14.735 1.00 2.78 H new ATOM 0 HZ3 LYS A 31 1.917 -5.878 16.345 1.00 2.78 H new ATOM 411 N ASP A 32 1.120 -3.510 12.472 1.00 0.75 N ATOM 412 CA ASP A 32 1.554 -4.519 11.525 1.00 1.00 C ATOM 413 C ASP A 32 0.837 -5.848 11.804 1.00 0.93 C ATOM 414 O ASP A 32 1.284 -6.676 12.598 1.00 1.29 O ATOM 415 CB ASP A 32 3.083 -4.683 11.580 1.00 1.58 C ATOM 416 CG ASP A 32 3.584 -5.349 12.852 1.00 1.92 C ATOM 417 OD1 ASP A 32 3.244 -4.868 13.959 1.00 2.41 O ATOM 418 OD2 ASP A 32 4.288 -6.379 12.743 1.00 2.36 O ATOM 0 H ASP A 32 1.534 -3.602 13.399 1.00 0.75 H new ATOM 0 HA ASP A 32 1.291 -4.199 10.517 1.00 1.00 H new ATOM 0 HB2 ASP A 32 3.407 -5.271 10.721 1.00 1.58 H new ATOM 0 HB3 ASP A 32 3.548 -3.701 11.488 1.00 1.58 H new ATOM 423 N PRO A 33 -0.330 -6.049 11.195 1.00 0.72 N ATOM 424 CA PRO A 33 -1.068 -7.285 11.334 1.00 0.89 C ATOM 425 C PRO A 33 -0.629 -8.338 10.323 1.00 1.04 C ATOM 426 O PRO A 33 0.450 -8.919 10.473 1.00 1.87 O ATOM 427 CB PRO A 33 -2.519 -6.860 11.117 1.00 0.99 C ATOM 428 CG PRO A 33 -2.467 -5.568 10.359 1.00 0.86 C ATOM 429 CD PRO A 33 -1.038 -5.083 10.357 1.00 0.69 C ATOM 0 HA PRO A 33 -0.905 -7.760 12.302 1.00 0.89 H new ATOM 0 HB2 PRO A 33 -3.067 -7.618 10.557 1.00 0.99 H new ATOM 0 HB3 PRO A 33 -3.034 -6.732 12.069 1.00 0.99 H new ATOM 0 HG2 PRO A 33 -2.822 -5.711 9.338 1.00 0.86 H new ATOM 0 HG3 PRO A 33 -3.119 -4.828 10.823 1.00 0.86 H new ATOM 0 HD2 PRO A 33 -0.628 -5.056 9.347 1.00 0.69 H new ATOM 0 HD3 PRO A 33 -0.960 -4.073 10.760 1.00 0.69 H new ATOM 682 N ILE A 50 11.837 8.728 2.870 1.00 0.66 N ATOM 683 CA ILE A 50 11.061 8.721 1.642 1.00 0.48 C ATOM 684 C ILE A 50 10.839 10.155 1.139 1.00 0.70 C ATOM 685 O ILE A 50 10.141 10.961 1.757 1.00 1.59 O ATOM 686 CB ILE A 50 9.721 7.932 1.818 1.00 0.38 C ATOM 687 CG1 ILE A 50 9.877 6.500 1.303 1.00 0.42 C ATOM 688 CG2 ILE A 50 8.567 8.593 1.087 1.00 0.42 C ATOM 689 CD1 ILE A 50 10.997 5.726 1.957 1.00 0.51 C ATOM 0 HA ILE A 50 11.628 8.193 0.876 1.00 0.48 H new ATOM 0 HB ILE A 50 9.494 7.928 2.884 1.00 0.38 H new ATOM 0 HG12 ILE A 50 8.940 5.965 1.460 1.00 0.42 H new ATOM 0 HG13 ILE A 50 10.050 6.529 0.227 1.00 0.42 H new ATOM 0 HG21 ILE A 50 7.659 8.010 1.238 1.00 0.42 H new ATOM 0 HG22 ILE A 50 8.420 9.601 1.475 1.00 0.42 H new ATOM 0 HG23 ILE A 50 8.792 8.644 0.022 1.00 0.42 H new ATOM 0 HD11 ILE A 50 11.040 4.722 1.536 1.00 0.51 H new ATOM 0 HD12 ILE A 50 11.944 6.235 1.778 1.00 0.51 H new ATOM 0 HD13 ILE A 50 10.817 5.662 3.030 1.00 0.51 H new ATOM 701 N LEU A 51 11.472 10.454 0.008 1.00 0.60 N ATOM 702 CA LEU A 51 11.515 11.807 -0.550 1.00 0.60 C ATOM 703 C LEU A 51 10.149 12.252 -1.056 1.00 0.62 C ATOM 704 O LEU A 51 9.922 13.432 -1.307 1.00 0.90 O ATOM 705 CB LEU A 51 12.523 11.882 -1.709 1.00 0.66 C ATOM 706 CG LEU A 51 13.982 11.541 -1.372 1.00 0.92 C ATOM 707 CD1 LEU A 51 14.178 10.040 -1.206 1.00 1.51 C ATOM 708 CD2 LEU A 51 14.903 12.075 -2.453 1.00 1.91 C ATOM 0 H LEU A 51 11.972 9.763 -0.551 1.00 0.60 H new ATOM 0 HA LEU A 51 11.824 12.473 0.255 1.00 0.60 H new ATOM 0 HB2 LEU A 51 12.188 11.207 -2.496 1.00 0.66 H new ATOM 0 HB3 LEU A 51 12.495 12.891 -2.121 1.00 0.66 H new ATOM 0 HG LEU A 51 14.229 12.016 -0.423 1.00 0.92 H new ATOM 0 HD11 LEU A 51 15.221 9.833 -0.968 1.00 1.51 H new ATOM 0 HD12 LEU A 51 13.543 9.677 -0.398 1.00 1.51 H new ATOM 0 HD13 LEU A 51 13.910 9.533 -2.133 1.00 1.51 H new ATOM 0 HD21 LEU A 51 15.936 11.829 -2.206 1.00 1.91 H new ATOM 0 HD22 LEU A 51 14.641 11.623 -3.410 1.00 1.91 H new ATOM 0 HD23 LEU A 51 14.795 13.157 -2.521 1.00 1.91 H new ATOM 720 N ARG A 52 9.242 11.304 -1.196 1.00 0.56 N ATOM 721 CA ARG A 52 7.932 11.577 -1.770 1.00 0.60 C ATOM 722 C ARG A 52 6.877 11.758 -0.687 1.00 0.59 C ATOM 723 O ARG A 52 5.687 11.569 -0.943 1.00 0.83 O ATOM 724 CB ARG A 52 7.526 10.427 -2.691 1.00 0.70 C ATOM 725 CG ARG A 52 8.373 10.306 -3.944 1.00 0.93 C ATOM 726 CD ARG A 52 8.072 11.421 -4.925 1.00 1.14 C ATOM 727 NE ARG A 52 6.669 11.418 -5.338 1.00 1.80 N ATOM 728 CZ ARG A 52 6.040 12.482 -5.837 1.00 2.47 C ATOM 729 NH1 ARG A 52 6.680 13.643 -5.948 1.00 2.72 N ATOM 730 NH2 ARG A 52 4.769 12.388 -6.213 1.00 3.17 N ATOM 0 H ARG A 52 9.386 10.333 -0.920 1.00 0.56 H new ATOM 0 HA ARG A 52 7.998 12.505 -2.338 1.00 0.60 H new ATOM 0 HB2 ARG A 52 7.585 9.492 -2.134 1.00 0.70 H new ATOM 0 HB3 ARG A 52 6.484 10.559 -2.982 1.00 0.70 H new ATOM 0 HG2 ARG A 52 9.429 10.331 -3.675 1.00 0.93 H new ATOM 0 HG3 ARG A 52 8.188 9.342 -4.418 1.00 0.93 H new ATOM 0 HD2 ARG A 52 8.315 12.381 -4.469 1.00 1.14 H new ATOM 0 HD3 ARG A 52 8.709 11.315 -5.803 1.00 1.14 H new ATOM 0 HE ARG A 52 6.141 10.551 -5.238 1.00 1.80 H new ATOM 0 HH11 ARG A 52 7.653 13.719 -5.651 1.00 2.72 H new ATOM 0 HH12 ARG A 52 6.198 14.457 -6.330 1.00 2.72 H new ATOM 0 HH21 ARG A 52 4.274 11.501 -6.120 1.00 3.17 H new ATOM 0 HH22 ARG A 52 4.288 13.203 -6.595 1.00 3.17 H new ATOM 744 N SER A 53 7.303 12.114 0.516 1.00 0.49 N ATOM 745 CA SER A 53 6.369 12.230 1.625 1.00 0.47 C ATOM 746 C SER A 53 6.816 13.280 2.652 1.00 0.46 C ATOM 747 O SER A 53 7.951 13.764 2.619 1.00 0.54 O ATOM 748 CB SER A 53 6.220 10.863 2.293 1.00 0.47 C ATOM 749 OG SER A 53 4.898 10.654 2.743 1.00 0.97 O ATOM 0 H SER A 53 8.274 12.325 0.747 1.00 0.49 H new ATOM 0 HA SER A 53 5.409 12.563 1.231 1.00 0.47 H new ATOM 0 HB2 SER A 53 6.495 10.079 1.587 1.00 0.47 H new ATOM 0 HB3 SER A 53 6.909 10.790 3.135 1.00 0.47 H new ATOM 0 HG SER A 53 4.678 9.701 2.681 1.00 0.97 H new ATOM 755 N ASN A 54 5.892 13.618 3.551 1.00 0.46 N ATOM 756 CA ASN A 54 6.123 14.556 4.652 1.00 0.48 C ATOM 757 C ASN A 54 6.490 13.762 5.909 1.00 0.44 C ATOM 758 O ASN A 54 5.853 12.767 6.192 1.00 0.42 O ATOM 759 CB ASN A 54 4.851 15.401 4.865 1.00 0.60 C ATOM 760 CG ASN A 54 4.788 16.092 6.215 1.00 0.92 C ATOM 761 OD1 ASN A 54 5.313 17.194 6.394 1.00 1.92 O ATOM 762 ND2 ASN A 54 4.110 15.463 7.160 1.00 0.75 N ATOM 0 H ASN A 54 4.944 13.241 3.535 1.00 0.46 H new ATOM 0 HA ASN A 54 6.946 15.233 4.422 1.00 0.48 H new ATOM 0 HB2 ASN A 54 4.792 16.154 4.080 1.00 0.60 H new ATOM 0 HB3 ASN A 54 3.978 14.758 4.756 1.00 0.60 H new ATOM 0 HD21 ASN A 54 4.005 15.888 8.081 1.00 0.75 H new ATOM 0 HD22 ASN A 54 3.692 14.553 6.968 1.00 0.75 H new ATOM 769 N PRO A 55 7.469 14.228 6.712 1.00 0.47 N ATOM 770 CA PRO A 55 8.175 13.419 7.728 1.00 0.49 C ATOM 771 C PRO A 55 7.323 12.378 8.484 1.00 0.45 C ATOM 772 O PRO A 55 7.675 11.197 8.495 1.00 0.46 O ATOM 773 CB PRO A 55 8.708 14.474 8.713 1.00 0.57 C ATOM 774 CG PRO A 55 8.370 15.813 8.128 1.00 0.70 C ATOM 775 CD PRO A 55 8.010 15.585 6.688 1.00 0.53 C ATOM 0 HA PRO A 55 8.929 12.803 7.239 1.00 0.49 H new ATOM 0 HB2 PRO A 55 8.251 14.353 9.695 1.00 0.57 H new ATOM 0 HB3 PRO A 55 9.785 14.370 8.847 1.00 0.57 H new ATOM 0 HG2 PRO A 55 7.539 16.270 8.665 1.00 0.70 H new ATOM 0 HG3 PRO A 55 9.217 16.495 8.211 1.00 0.70 H new ATOM 0 HD2 PRO A 55 7.276 16.309 6.333 1.00 0.53 H new ATOM 0 HD3 PRO A 55 8.879 15.665 6.034 1.00 0.53 H new ATOM 783 N GLU A 56 6.219 12.775 9.109 1.00 0.47 N ATOM 784 CA GLU A 56 5.436 11.811 9.886 1.00 0.49 C ATOM 785 C GLU A 56 4.590 10.903 8.989 1.00 0.40 C ATOM 786 O GLU A 56 4.314 9.752 9.323 1.00 0.39 O ATOM 787 CB GLU A 56 4.558 12.487 10.951 1.00 0.62 C ATOM 788 CG GLU A 56 3.828 13.735 10.488 1.00 0.78 C ATOM 789 CD GLU A 56 4.687 14.976 10.588 1.00 1.73 C ATOM 790 OE1 GLU A 56 4.705 15.601 11.662 1.00 2.02 O ATOM 791 OE2 GLU A 56 5.349 15.330 9.591 1.00 2.71 O ATOM 0 H GLU A 56 5.852 13.726 9.097 1.00 0.47 H new ATOM 0 HA GLU A 56 6.163 11.188 10.408 1.00 0.49 H new ATOM 0 HB2 GLU A 56 3.822 11.765 11.304 1.00 0.62 H new ATOM 0 HB3 GLU A 56 5.185 12.747 11.804 1.00 0.62 H new ATOM 0 HG2 GLU A 56 3.506 13.602 9.455 1.00 0.78 H new ATOM 0 HG3 GLU A 56 2.928 13.870 11.088 1.00 0.78 H new ATOM 798 N ASP A 57 4.192 11.383 7.838 1.00 0.40 N ATOM 799 CA ASP A 57 3.439 10.536 6.932 1.00 0.38 C ATOM 800 C ASP A 57 4.414 9.796 6.015 1.00 0.35 C ATOM 801 O ASP A 57 4.058 8.836 5.344 1.00 0.38 O ATOM 802 CB ASP A 57 2.371 11.349 6.183 1.00 0.47 C ATOM 803 CG ASP A 57 2.684 11.657 4.725 1.00 0.92 C ATOM 804 OD1 ASP A 57 3.769 12.216 4.448 1.00 1.36 O ATOM 805 OD2 ASP A 57 1.875 11.297 3.847 1.00 1.63 O ATOM 0 H ASP A 57 4.368 12.331 7.506 1.00 0.40 H new ATOM 0 HA ASP A 57 2.884 9.780 7.488 1.00 0.38 H new ATOM 0 HB2 ASP A 57 1.428 10.804 6.227 1.00 0.47 H new ATOM 0 HB3 ASP A 57 2.220 12.291 6.711 1.00 0.47 H new ATOM 810 N GLN A 58 5.669 10.234 6.068 1.00 0.34 N ATOM 811 CA GLN A 58 6.785 9.557 5.428 1.00 0.36 C ATOM 812 C GLN A 58 7.037 8.220 6.102 1.00 0.34 C ATOM 813 O GLN A 58 7.224 7.211 5.432 1.00 0.35 O ATOM 814 CB GLN A 58 8.038 10.428 5.518 1.00 0.42 C ATOM 815 CG GLN A 58 9.283 9.803 4.918 1.00 0.51 C ATOM 816 CD GLN A 58 10.539 10.555 5.309 1.00 0.89 C ATOM 817 OE1 GLN A 58 10.938 11.509 4.646 1.00 1.52 O ATOM 818 NE2 GLN A 58 11.183 10.116 6.378 1.00 1.58 N ATOM 0 H GLN A 58 5.940 11.082 6.565 1.00 0.34 H new ATOM 0 HA GLN A 58 6.543 9.385 4.379 1.00 0.36 H new ATOM 0 HB2 GLN A 58 7.844 11.375 5.015 1.00 0.42 H new ATOM 0 HB3 GLN A 58 8.231 10.658 6.566 1.00 0.42 H new ATOM 0 HG2 GLN A 58 9.363 8.767 5.247 1.00 0.51 H new ATOM 0 HG3 GLN A 58 9.193 9.787 3.832 1.00 0.51 H new ATOM 0 HE21 GLN A 58 10.819 9.320 6.902 1.00 1.58 H new ATOM 0 HE22 GLN A 58 12.044 10.573 6.678 1.00 1.58 H new ATOM 827 N VAL A 59 7.060 8.217 7.434 1.00 0.35 N ATOM 828 CA VAL A 59 7.145 6.964 8.168 1.00 0.37 C ATOM 829 C VAL A 59 5.911 6.116 7.881 1.00 0.32 C ATOM 830 O VAL A 59 6.031 4.918 7.669 1.00 0.37 O ATOM 831 CB VAL A 59 7.355 7.148 9.703 1.00 0.45 C ATOM 832 CG1 VAL A 59 6.434 8.185 10.289 1.00 1.08 C ATOM 833 CG2 VAL A 59 7.162 5.836 10.441 1.00 1.27 C ATOM 0 H VAL A 59 7.022 9.054 8.015 1.00 0.35 H new ATOM 0 HA VAL A 59 8.038 6.449 7.814 1.00 0.37 H new ATOM 0 HB VAL A 59 8.381 7.493 9.830 1.00 0.45 H new ATOM 0 HG11 VAL A 59 6.621 8.274 11.359 1.00 1.08 H new ATOM 0 HG12 VAL A 59 6.615 9.146 9.808 1.00 1.08 H new ATOM 0 HG13 VAL A 59 5.399 7.886 10.125 1.00 1.08 H new ATOM 0 HG21 VAL A 59 7.314 5.993 11.509 1.00 1.27 H new ATOM 0 HG22 VAL A 59 6.151 5.467 10.269 1.00 1.27 H new ATOM 0 HG23 VAL A 59 7.882 5.104 10.076 1.00 1.27 H new ATOM 843 N LEU A 60 4.730 6.747 7.807 1.00 0.30 N ATOM 844 CA LEU A 60 3.519 6.019 7.405 1.00 0.31 C ATOM 845 C LEU A 60 3.664 5.442 5.995 1.00 0.33 C ATOM 846 O LEU A 60 2.963 4.509 5.615 1.00 0.41 O ATOM 847 CB LEU A 60 2.278 6.920 7.442 1.00 0.34 C ATOM 848 CG LEU A 60 1.014 6.261 6.877 1.00 0.56 C ATOM 849 CD1 LEU A 60 0.553 5.137 7.777 1.00 1.12 C ATOM 850 CD2 LEU A 60 -0.107 7.259 6.694 1.00 1.18 C ATOM 0 H LEU A 60 4.589 7.736 8.015 1.00 0.30 H new ATOM 0 HA LEU A 60 3.392 5.208 8.122 1.00 0.31 H new ATOM 0 HB2 LEU A 60 2.090 7.220 8.473 1.00 0.34 H new ATOM 0 HB3 LEU A 60 2.485 7.830 6.878 1.00 0.34 H new ATOM 0 HG LEU A 60 1.272 5.858 5.898 1.00 0.56 H new ATOM 0 HD11 LEU A 60 -0.345 4.682 7.360 1.00 1.12 H new ATOM 0 HD12 LEU A 60 1.339 4.386 7.853 1.00 1.12 H new ATOM 0 HD13 LEU A 60 0.332 5.532 8.769 1.00 1.12 H new ATOM 0 HD21 LEU A 60 -0.984 6.752 6.292 1.00 1.18 H new ATOM 0 HD22 LEU A 60 -0.356 7.707 7.656 1.00 1.18 H new ATOM 0 HD23 LEU A 60 0.210 8.039 6.002 1.00 1.18 H new ATOM 862 N TYR A 61 4.567 6.016 5.228 1.00 0.35 N ATOM 863 CA TYR A 61 4.791 5.595 3.851 1.00 0.40 C ATOM 864 C TYR A 61 6.043 4.739 3.725 1.00 0.45 C ATOM 865 O TYR A 61 6.370 4.269 2.636 1.00 0.56 O ATOM 866 CB TYR A 61 4.893 6.804 2.919 1.00 0.42 C ATOM 867 CG TYR A 61 3.559 7.442 2.585 1.00 0.47 C ATOM 868 CD1 TYR A 61 2.412 7.062 3.262 1.00 0.59 C ATOM 869 CD2 TYR A 61 3.447 8.421 1.605 1.00 0.82 C ATOM 870 CE1 TYR A 61 1.189 7.636 2.973 1.00 0.64 C ATOM 871 CE2 TYR A 61 2.228 9.001 1.311 1.00 0.99 C ATOM 872 CZ TYR A 61 1.122 8.618 1.949 1.00 0.78 C ATOM 873 OH TYR A 61 -0.114 9.181 1.710 1.00 0.96 O ATOM 0 H TYR A 61 5.166 6.783 5.534 1.00 0.35 H new ATOM 0 HA TYR A 61 3.932 4.992 3.556 1.00 0.40 H new ATOM 0 HB2 TYR A 61 5.536 7.553 3.382 1.00 0.42 H new ATOM 0 HB3 TYR A 61 5.378 6.496 1.993 1.00 0.42 H new ATOM 0 HD1 TYR A 61 2.475 6.304 4.029 1.00 0.59 H new ATOM 0 HD2 TYR A 61 4.328 8.734 1.064 1.00 0.82 H new ATOM 0 HE1 TYR A 61 0.302 7.344 3.515 1.00 0.64 H new ATOM 0 HE2 TYR A 61 2.171 9.772 0.557 1.00 0.99 H new ATOM 0 HH TYR A 61 -0.039 9.841 0.989 1.00 0.96 H new ATOM 883 N GLN A 62 6.749 4.544 4.829 1.00 0.43 N ATOM 884 CA GLN A 62 7.893 3.652 4.827 1.00 0.58 C ATOM 885 C GLN A 62 7.696 2.544 5.853 1.00 0.73 C ATOM 886 O GLN A 62 6.822 1.715 5.679 1.00 1.49 O ATOM 887 CB GLN A 62 9.216 4.382 5.082 1.00 0.63 C ATOM 888 CG GLN A 62 10.410 3.575 4.594 1.00 0.99 C ATOM 889 CD GLN A 62 11.724 3.957 5.240 1.00 1.18 C ATOM 890 OE1 GLN A 62 12.616 3.120 5.377 1.00 1.97 O ATOM 891 NE2 GLN A 62 11.854 5.207 5.645 1.00 1.13 N ATOM 0 H GLN A 62 6.551 4.987 5.726 1.00 0.43 H new ATOM 0 HA GLN A 62 7.958 3.220 3.828 1.00 0.58 H new ATOM 0 HB2 GLN A 62 9.201 5.349 4.579 1.00 0.63 H new ATOM 0 HB3 GLN A 62 9.322 4.580 6.149 1.00 0.63 H new ATOM 0 HG2 GLN A 62 10.220 2.518 4.781 1.00 0.99 H new ATOM 0 HG3 GLN A 62 10.500 3.697 3.515 1.00 0.99 H new ATOM 0 HE21 GLN A 62 11.089 5.868 5.512 1.00 1.13 H new ATOM 0 HE22 GLN A 62 12.719 5.511 6.091 1.00 1.13 H new ATOM 900 N THR A 63 8.483 2.584 6.927 1.00 0.44 N ATOM 901 CA THR A 63 8.521 1.524 7.960 1.00 0.48 C ATOM 902 C THR A 63 8.317 0.105 7.391 1.00 0.61 C ATOM 903 O THR A 63 7.201 -0.309 7.105 1.00 1.27 O ATOM 904 CB THR A 63 7.480 1.785 9.059 1.00 0.50 C ATOM 905 OG1 THR A 63 7.298 3.187 9.208 1.00 0.89 O ATOM 906 CG2 THR A 63 7.946 1.206 10.383 1.00 0.89 C ATOM 0 H THR A 63 9.122 3.356 7.116 1.00 0.44 H new ATOM 0 HA THR A 63 9.525 1.565 8.382 1.00 0.48 H new ATOM 0 HB THR A 63 6.542 1.309 8.773 1.00 0.50 H new ATOM 0 HG1 THR A 63 6.602 3.494 8.590 1.00 0.89 H new ATOM 0 HG21 THR A 63 7.196 1.401 11.149 1.00 0.89 H new ATOM 0 HG22 THR A 63 8.089 0.130 10.280 1.00 0.89 H new ATOM 0 HG23 THR A 63 8.889 1.671 10.672 1.00 0.89 H new ATOM 914 N GLU A 64 9.403 -0.642 7.265 1.00 0.53 N ATOM 915 CA GLU A 64 9.372 -1.975 6.652 1.00 0.53 C ATOM 916 C GLU A 64 9.081 -3.068 7.682 1.00 0.58 C ATOM 917 O GLU A 64 9.628 -3.056 8.782 1.00 0.99 O ATOM 918 CB GLU A 64 10.733 -2.248 6.016 1.00 0.67 C ATOM 919 CG GLU A 64 11.895 -2.008 6.976 1.00 1.00 C ATOM 920 CD GLU A 64 13.219 -2.505 6.447 1.00 1.42 C ATOM 921 OE1 GLU A 64 13.557 -3.683 6.689 1.00 1.78 O ATOM 922 OE2 GLU A 64 13.926 -1.720 5.782 1.00 1.96 O ATOM 0 H GLU A 64 10.328 -0.350 7.580 1.00 0.53 H new ATOM 0 HA GLU A 64 8.575 -1.992 5.908 1.00 0.53 H new ATOM 0 HB2 GLU A 64 10.765 -3.280 5.666 1.00 0.67 H new ATOM 0 HB3 GLU A 64 10.854 -1.610 5.140 1.00 0.67 H new ATOM 0 HG2 GLU A 64 11.972 -0.941 7.183 1.00 1.00 H new ATOM 0 HG3 GLU A 64 11.682 -2.502 7.924 1.00 1.00 H new ATOM 929 N ARG A 65 8.219 -4.011 7.316 1.00 0.85 N ATOM 930 CA ARG A 65 7.970 -5.185 8.149 1.00 0.96 C ATOM 931 C ARG A 65 8.886 -6.339 7.735 1.00 1.17 C ATOM 932 O ARG A 65 9.680 -6.213 6.800 1.00 2.02 O ATOM 933 CB ARG A 65 6.508 -5.633 8.046 1.00 0.96 C ATOM 934 CG ARG A 65 5.797 -5.654 9.389 1.00 1.17 C ATOM 935 CD ARG A 65 4.620 -6.621 9.402 1.00 1.09 C ATOM 936 NE ARG A 65 5.040 -7.982 9.099 1.00 1.70 N ATOM 937 CZ ARG A 65 5.107 -8.948 10.007 1.00 2.50 C ATOM 938 NH1 ARG A 65 4.835 -8.691 11.284 1.00 2.93 N ATOM 939 NH2 ARG A 65 5.476 -10.168 9.647 1.00 3.35 N ATOM 0 H ARG A 65 7.681 -3.987 6.450 1.00 0.85 H new ATOM 0 HA ARG A 65 8.181 -4.909 9.182 1.00 0.96 H new ATOM 0 HB2 ARG A 65 5.976 -4.964 7.370 1.00 0.96 H new ATOM 0 HB3 ARG A 65 6.469 -6.629 7.605 1.00 0.96 H new ATOM 0 HG2 ARG A 65 6.505 -5.936 10.169 1.00 1.17 H new ATOM 0 HG3 ARG A 65 5.443 -4.651 9.627 1.00 1.17 H new ATOM 0 HD2 ARG A 65 4.140 -6.597 10.380 1.00 1.09 H new ATOM 0 HD3 ARG A 65 3.876 -6.299 8.674 1.00 1.09 H new ATOM 0 HE ARG A 65 5.297 -8.205 8.137 1.00 1.70 H new ATOM 0 HH11 ARG A 65 4.573 -7.747 11.570 1.00 2.93 H new ATOM 0 HH12 ARG A 65 4.888 -9.438 11.977 1.00 2.93 H new ATOM 0 HH21 ARG A 65 5.708 -10.364 8.673 1.00 3.35 H new ATOM 0 HH22 ARG A 65 5.528 -10.911 10.343 1.00 3.35 H new ATOM 1015 N SER A 70 3.764 -14.126 0.648 1.00 0.78 N ATOM 1016 CA SER A 70 2.438 -13.621 0.349 1.00 0.76 C ATOM 1017 C SER A 70 1.969 -12.696 1.471 1.00 0.82 C ATOM 1018 O SER A 70 1.413 -13.145 2.474 1.00 1.01 O ATOM 1019 CB SER A 70 1.459 -14.787 0.163 1.00 0.96 C ATOM 1020 OG SER A 70 0.240 -14.359 -0.423 1.00 1.41 O ATOM 0 HA SER A 70 2.473 -13.051 -0.579 1.00 0.76 H new ATOM 0 HB2 SER A 70 1.917 -15.550 -0.466 1.00 0.96 H new ATOM 0 HB3 SER A 70 1.256 -15.250 1.129 1.00 0.96 H new ATOM 0 HG SER A 70 -0.360 -15.127 -0.528 1.00 1.41 H new ATOM 1026 N PHE A 71 2.247 -11.409 1.310 1.00 0.78 N ATOM 1027 CA PHE A 71 1.779 -10.398 2.235 1.00 0.94 C ATOM 1028 C PHE A 71 0.280 -10.247 2.044 1.00 0.58 C ATOM 1029 O PHE A 71 -0.163 -9.522 1.151 1.00 0.79 O ATOM 1030 CB PHE A 71 2.441 -9.043 1.964 1.00 1.57 C ATOM 1031 CG PHE A 71 3.856 -8.832 2.447 1.00 1.10 C ATOM 1032 CD1 PHE A 71 4.937 -9.392 1.793 1.00 1.38 C ATOM 1033 CD2 PHE A 71 4.096 -7.984 3.518 1.00 1.10 C ATOM 1034 CE1 PHE A 71 6.230 -9.109 2.196 1.00 1.18 C ATOM 1035 CE2 PHE A 71 5.383 -7.709 3.934 1.00 1.29 C ATOM 1036 CZ PHE A 71 6.453 -8.268 3.268 1.00 1.02 C ATOM 0 H PHE A 71 2.801 -11.042 0.536 1.00 0.78 H new ATOM 0 HA PHE A 71 2.029 -10.706 3.250 1.00 0.94 H new ATOM 0 HB2 PHE A 71 2.428 -8.875 0.887 1.00 1.57 H new ATOM 0 HB3 PHE A 71 1.817 -8.271 2.414 1.00 1.57 H new ATOM 0 HD1 PHE A 71 4.771 -10.057 0.959 1.00 1.38 H new ATOM 0 HD2 PHE A 71 3.262 -7.532 4.035 1.00 1.10 H new ATOM 0 HE1 PHE A 71 7.066 -9.547 1.671 1.00 1.18 H new ATOM 0 HE2 PHE A 71 5.551 -7.058 4.779 1.00 1.29 H new ATOM 0 HZ PHE A 71 7.462 -8.049 3.584 1.00 1.02 H new ATOM 1046 N GLY A 72 -0.489 -10.948 2.852 1.00 0.46 N ATOM 1047 CA GLY A 72 -1.919 -10.958 2.680 1.00 0.78 C ATOM 1048 C GLY A 72 -2.634 -10.133 3.728 1.00 0.58 C ATOM 1049 O GLY A 72 -2.634 -10.480 4.910 1.00 0.74 O ATOM 0 H GLY A 72 -0.146 -11.514 3.629 1.00 0.46 H new ATOM 0 HA2 GLY A 72 -2.165 -10.575 1.690 1.00 0.78 H new ATOM 0 HA3 GLY A 72 -2.280 -11.986 2.723 1.00 0.78 H new ATOM 1053 N TYR A 73 -3.219 -9.032 3.289 1.00 0.39 N ATOM 1054 CA TYR A 73 -3.945 -8.125 4.169 1.00 0.36 C ATOM 1055 C TYR A 73 -5.445 -8.321 4.021 1.00 0.34 C ATOM 1056 O TYR A 73 -5.928 -8.695 2.948 1.00 0.43 O ATOM 1057 CB TYR A 73 -3.606 -6.671 3.842 1.00 0.51 C ATOM 1058 CG TYR A 73 -2.132 -6.353 3.892 1.00 0.58 C ATOM 1059 CD1 TYR A 73 -1.280 -6.738 2.867 1.00 0.78 C ATOM 1060 CD2 TYR A 73 -1.592 -5.675 4.972 1.00 0.72 C ATOM 1061 CE1 TYR A 73 0.068 -6.454 2.923 1.00 0.97 C ATOM 1062 CE2 TYR A 73 -0.249 -5.389 5.033 1.00 0.89 C ATOM 1063 CZ TYR A 73 0.575 -5.761 3.961 1.00 0.99 C ATOM 1064 OH TYR A 73 1.916 -5.492 4.069 1.00 1.21 O ATOM 0 H TYR A 73 -3.206 -8.739 2.312 1.00 0.39 H new ATOM 0 HA TYR A 73 -3.646 -8.349 5.193 1.00 0.36 H new ATOM 0 HB2 TYR A 73 -3.983 -6.437 2.846 1.00 0.51 H new ATOM 0 HB3 TYR A 73 -4.130 -6.021 4.543 1.00 0.51 H new ATOM 0 HD1 TYR A 73 -1.678 -7.267 2.014 1.00 0.78 H new ATOM 0 HD2 TYR A 73 -2.238 -5.365 5.781 1.00 0.72 H new ATOM 0 HE1 TYR A 73 0.721 -6.789 2.131 1.00 0.97 H new ATOM 0 HE2 TYR A 73 0.166 -4.885 5.894 1.00 0.89 H new ATOM 0 HH TYR A 73 2.341 -5.588 3.191 1.00 1.21 H new ATOM 1074 N ASP A 74 -6.176 -8.046 5.087 1.00 0.35 N ATOM 1075 CA ASP A 74 -7.624 -8.161 5.075 1.00 0.39 C ATOM 1076 C ASP A 74 -8.273 -6.794 5.271 1.00 0.34 C ATOM 1077 O ASP A 74 -8.141 -6.168 6.321 1.00 0.44 O ATOM 1078 CB ASP A 74 -8.092 -9.153 6.150 1.00 0.57 C ATOM 1079 CG ASP A 74 -7.774 -8.714 7.568 1.00 1.58 C ATOM 1080 OD1 ASP A 74 -6.584 -8.473 7.865 1.00 1.92 O ATOM 1081 OD2 ASP A 74 -8.713 -8.570 8.377 1.00 2.47 O ATOM 0 H ASP A 74 -5.787 -7.739 5.978 1.00 0.35 H new ATOM 0 HA ASP A 74 -7.934 -8.544 4.103 1.00 0.39 H new ATOM 0 HB2 ASP A 74 -9.169 -9.295 6.056 1.00 0.57 H new ATOM 0 HB3 ASP A 74 -7.626 -10.121 5.966 1.00 0.57 H new ATOM 1086 N ILE A 75 -8.943 -6.322 4.227 1.00 0.28 N ATOM 1087 CA ILE A 75 -9.654 -5.051 4.265 1.00 0.27 C ATOM 1088 C ILE A 75 -11.147 -5.293 4.400 1.00 0.27 C ATOM 1089 O ILE A 75 -11.845 -5.469 3.407 1.00 0.26 O ATOM 1090 CB ILE A 75 -9.431 -4.211 2.988 1.00 0.25 C ATOM 1091 CG1 ILE A 75 -7.975 -3.823 2.809 1.00 0.28 C ATOM 1092 CG2 ILE A 75 -10.286 -2.956 3.016 1.00 0.29 C ATOM 1093 CD1 ILE A 75 -7.106 -4.890 2.213 1.00 0.38 C ATOM 0 H ILE A 75 -9.009 -6.808 3.333 1.00 0.28 H new ATOM 0 HA ILE A 75 -9.261 -4.504 5.122 1.00 0.27 H new ATOM 0 HB ILE A 75 -9.724 -4.836 2.144 1.00 0.25 H new ATOM 0 HG12 ILE A 75 -7.925 -2.938 2.175 1.00 0.28 H new ATOM 0 HG13 ILE A 75 -7.567 -3.543 3.780 1.00 0.28 H new ATOM 0 HG21 ILE A 75 -10.114 -2.378 2.108 1.00 0.29 H new ATOM 0 HG22 ILE A 75 -11.338 -3.234 3.076 1.00 0.29 H new ATOM 0 HG23 ILE A 75 -10.020 -2.354 3.885 1.00 0.29 H new ATOM 0 HD11 ILE A 75 -6.085 -4.520 2.124 1.00 0.38 H new ATOM 0 HD12 ILE A 75 -7.118 -5.770 2.856 1.00 0.38 H new ATOM 0 HD13 ILE A 75 -7.482 -5.156 1.225 1.00 0.38 H new ATOM 1105 N PRO A 76 -11.662 -5.300 5.619 1.00 0.32 N ATOM 1106 CA PRO A 76 -13.062 -5.608 5.854 1.00 0.35 C ATOM 1107 C PRO A 76 -13.990 -4.552 5.260 1.00 0.34 C ATOM 1108 O PRO A 76 -13.941 -3.378 5.627 1.00 0.41 O ATOM 1109 CB PRO A 76 -13.187 -5.652 7.368 1.00 0.45 C ATOM 1110 CG PRO A 76 -12.011 -4.894 7.895 1.00 0.59 C ATOM 1111 CD PRO A 76 -10.933 -4.989 6.850 1.00 0.41 C ATOM 0 HA PRO A 76 -13.354 -6.544 5.378 1.00 0.35 H new ATOM 0 HB2 PRO A 76 -14.123 -5.200 7.697 1.00 0.45 H new ATOM 0 HB3 PRO A 76 -13.185 -6.680 7.731 1.00 0.45 H new ATOM 0 HG2 PRO A 76 -12.275 -3.854 8.086 1.00 0.59 H new ATOM 0 HG3 PRO A 76 -11.671 -5.315 8.841 1.00 0.59 H new ATOM 0 HD2 PRO A 76 -10.379 -4.054 6.761 1.00 0.41 H new ATOM 0 HD3 PRO A 76 -10.209 -5.767 7.093 1.00 0.41 H new ATOM 1119 N ILE A 77 -14.835 -4.985 4.338 1.00 0.31 N ATOM 1120 CA ILE A 77 -15.723 -4.090 3.627 1.00 0.30 C ATOM 1121 C ILE A 77 -17.169 -4.454 3.912 1.00 0.36 C ATOM 1122 O ILE A 77 -17.550 -5.623 3.850 1.00 0.40 O ATOM 1123 CB ILE A 77 -15.461 -4.144 2.107 1.00 0.26 C ATOM 1124 CG1 ILE A 77 -14.059 -3.613 1.794 1.00 0.28 C ATOM 1125 CG2 ILE A 77 -16.515 -3.354 1.344 1.00 0.30 C ATOM 1126 CD1 ILE A 77 -13.694 -3.654 0.326 1.00 0.49 C ATOM 0 H ILE A 77 -14.922 -5.964 4.065 1.00 0.31 H new ATOM 0 HA ILE A 77 -15.531 -3.075 3.975 1.00 0.30 H new ATOM 0 HB ILE A 77 -15.522 -5.183 1.785 1.00 0.26 H new ATOM 0 HG12 ILE A 77 -13.985 -2.584 2.147 1.00 0.28 H new ATOM 0 HG13 ILE A 77 -13.328 -4.196 2.355 1.00 0.28 H new ATOM 0 HG21 ILE A 77 -16.307 -3.408 0.275 1.00 0.30 H new ATOM 0 HG22 ILE A 77 -17.500 -3.775 1.544 1.00 0.30 H new ATOM 0 HG23 ILE A 77 -16.493 -2.313 1.666 1.00 0.30 H new ATOM 0 HD11 ILE A 77 -12.686 -3.261 0.190 1.00 0.49 H new ATOM 0 HD12 ILE A 77 -13.733 -4.684 -0.030 1.00 0.49 H new ATOM 0 HD13 ILE A 77 -14.400 -3.047 -0.241 1.00 0.49 H new ATOM 1138 N LYS A 78 -17.965 -3.453 4.238 1.00 0.44 N ATOM 1139 CA LYS A 78 -19.362 -3.668 4.568 1.00 0.54 C ATOM 1140 C LYS A 78 -20.263 -2.708 3.798 1.00 0.55 C ATOM 1141 O LYS A 78 -21.471 -2.661 4.027 1.00 0.71 O ATOM 1142 CB LYS A 78 -19.567 -3.496 6.074 1.00 0.71 C ATOM 1143 CG LYS A 78 -18.924 -2.234 6.626 1.00 1.23 C ATOM 1144 CD LYS A 78 -19.130 -2.112 8.124 1.00 1.82 C ATOM 1145 CE LYS A 78 -18.438 -0.878 8.686 1.00 2.66 C ATOM 1146 NZ LYS A 78 -18.627 -0.758 10.153 1.00 3.32 N ATOM 0 H LYS A 78 -17.667 -2.479 4.282 1.00 0.44 H new ATOM 0 HA LYS A 78 -19.633 -4.684 4.280 1.00 0.54 H new ATOM 0 HB2 LYS A 78 -20.635 -3.475 6.289 1.00 0.71 H new ATOM 0 HB3 LYS A 78 -19.155 -4.362 6.591 1.00 0.71 H new ATOM 0 HG2 LYS A 78 -17.857 -2.242 6.404 1.00 1.23 H new ATOM 0 HG3 LYS A 78 -19.347 -1.362 6.128 1.00 1.23 H new ATOM 0 HD2 LYS A 78 -20.197 -2.063 8.342 1.00 1.82 H new ATOM 0 HD3 LYS A 78 -18.744 -3.003 8.619 1.00 1.82 H new ATOM 0 HE2 LYS A 78 -17.373 -0.924 8.460 1.00 2.66 H new ATOM 0 HE3 LYS A 78 -18.830 0.013 8.195 1.00 2.66 H new ATOM 0 HZ1 LYS A 78 -18.141 0.095 10.497 1.00 3.32 H new ATOM 0 HZ2 LYS A 78 -19.642 -0.688 10.368 1.00 3.32 H new ATOM 0 HZ3 LYS A 78 -18.231 -1.596 10.624 1.00 3.32 H new ATOM 1160 N GLU A 79 -19.678 -1.951 2.877 1.00 0.46 N ATOM 1161 CA GLU A 79 -20.433 -0.966 2.120 1.00 0.47 C ATOM 1162 C GLU A 79 -20.081 -1.041 0.643 1.00 0.36 C ATOM 1163 O GLU A 79 -19.204 -1.807 0.241 1.00 0.39 O ATOM 1164 CB GLU A 79 -20.143 0.442 2.639 1.00 0.60 C ATOM 1165 CG GLU A 79 -20.608 0.688 4.063 1.00 1.02 C ATOM 1166 CD GLU A 79 -20.295 2.093 4.520 1.00 1.41 C ATOM 1167 OE1 GLU A 79 -21.122 2.999 4.274 1.00 1.87 O ATOM 1168 OE2 GLU A 79 -19.239 2.297 5.155 1.00 2.16 O ATOM 0 H GLU A 79 -18.687 -2.002 2.639 1.00 0.46 H new ATOM 0 HA GLU A 79 -21.493 -1.185 2.245 1.00 0.47 H new ATOM 0 HB2 GLU A 79 -19.070 0.624 2.583 1.00 0.60 H new ATOM 0 HB3 GLU A 79 -20.624 1.166 1.981 1.00 0.60 H new ATOM 0 HG2 GLU A 79 -21.682 0.515 4.130 1.00 1.02 H new ATOM 0 HG3 GLU A 79 -20.128 -0.027 4.731 1.00 1.02 H new ATOM 1175 N GLU A 80 -20.760 -0.235 -0.151 1.00 0.38 N ATOM 1176 CA GLU A 80 -20.506 -0.161 -1.575 1.00 0.34 C ATOM 1177 C GLU A 80 -20.145 1.265 -1.969 1.00 0.35 C ATOM 1178 O GLU A 80 -20.459 2.216 -1.252 1.00 0.52 O ATOM 1179 CB GLU A 80 -21.728 -0.659 -2.344 1.00 0.42 C ATOM 1180 CG GLU A 80 -21.867 -2.169 -2.322 1.00 0.71 C ATOM 1181 CD GLU A 80 -23.307 -2.627 -2.279 1.00 0.84 C ATOM 1182 OE1 GLU A 80 -24.049 -2.364 -3.247 1.00 0.90 O ATOM 1183 OE2 GLU A 80 -23.704 -3.251 -1.275 1.00 1.20 O ATOM 0 H GLU A 80 -21.502 0.385 0.173 1.00 0.38 H new ATOM 0 HA GLU A 80 -19.661 -0.801 -1.828 1.00 0.34 H new ATOM 0 HB2 GLU A 80 -22.626 -0.211 -1.918 1.00 0.42 H new ATOM 0 HB3 GLU A 80 -21.662 -0.321 -3.378 1.00 0.42 H new ATOM 0 HG2 GLU A 80 -21.385 -2.586 -3.206 1.00 0.71 H new ATOM 0 HG3 GLU A 80 -21.339 -2.565 -1.454 1.00 0.71 H new ATOM 1190 N GLY A 81 -19.487 1.408 -3.105 1.00 0.30 N ATOM 1191 CA GLY A 81 -18.958 2.694 -3.509 1.00 0.28 C ATOM 1192 C GLY A 81 -17.691 2.525 -4.305 1.00 0.24 C ATOM 1193 O GLY A 81 -17.475 1.468 -4.903 1.00 0.28 O ATOM 0 H GLY A 81 -19.307 0.649 -3.762 1.00 0.30 H new ATOM 0 HA2 GLY A 81 -19.699 3.226 -4.105 1.00 0.28 H new ATOM 0 HA3 GLY A 81 -18.760 3.304 -2.628 1.00 0.28 H new ATOM 1197 N GLU A 82 -16.841 3.539 -4.314 1.00 0.22 N ATOM 1198 CA GLU A 82 -15.582 3.440 -5.037 1.00 0.23 C ATOM 1199 C GLU A 82 -14.429 3.394 -4.055 1.00 0.22 C ATOM 1200 O GLU A 82 -14.070 4.399 -3.466 1.00 0.26 O ATOM 1201 CB GLU A 82 -15.418 4.618 -6.002 1.00 0.29 C ATOM 1202 CG GLU A 82 -16.541 4.720 -7.017 1.00 0.42 C ATOM 1203 CD GLU A 82 -16.422 5.924 -7.924 1.00 1.11 C ATOM 1204 OE1 GLU A 82 -15.372 6.065 -8.584 1.00 1.30 O ATOM 1205 OE2 GLU A 82 -17.363 6.744 -7.968 1.00 1.96 O ATOM 0 H GLU A 82 -16.995 4.427 -3.837 1.00 0.22 H new ATOM 0 HA GLU A 82 -15.585 2.521 -5.623 1.00 0.23 H new ATOM 0 HB2 GLU A 82 -15.369 5.544 -5.429 1.00 0.29 H new ATOM 0 HB3 GLU A 82 -14.469 4.518 -6.529 1.00 0.29 H new ATOM 0 HG2 GLU A 82 -16.554 3.816 -7.625 1.00 0.42 H new ATOM 0 HG3 GLU A 82 -17.494 4.764 -6.490 1.00 0.42 H new ATOM 1212 N TYR A 83 -13.824 2.237 -3.884 1.00 0.21 N ATOM 1213 CA TYR A 83 -12.766 2.118 -2.903 1.00 0.22 C ATOM 1214 C TYR A 83 -11.441 2.316 -3.579 1.00 0.22 C ATOM 1215 O TYR A 83 -11.116 1.640 -4.546 1.00 0.22 O ATOM 1216 CB TYR A 83 -12.785 0.758 -2.212 1.00 0.25 C ATOM 1217 CG TYR A 83 -13.988 0.540 -1.335 1.00 0.27 C ATOM 1218 CD1 TYR A 83 -15.184 0.091 -1.867 1.00 0.59 C ATOM 1219 CD2 TYR A 83 -13.928 0.789 0.026 1.00 0.67 C ATOM 1220 CE1 TYR A 83 -16.284 -0.105 -1.069 1.00 0.60 C ATOM 1221 CE2 TYR A 83 -15.024 0.594 0.832 1.00 0.71 C ATOM 1222 CZ TYR A 83 -16.202 0.150 0.281 1.00 0.39 C ATOM 1223 OH TYR A 83 -17.295 -0.046 1.082 1.00 0.44 O ATOM 0 H TYR A 83 -14.040 1.383 -4.399 1.00 0.21 H new ATOM 0 HA TYR A 83 -12.924 2.882 -2.142 1.00 0.22 H new ATOM 0 HB2 TYR A 83 -12.753 -0.025 -2.970 1.00 0.25 H new ATOM 0 HB3 TYR A 83 -11.883 0.655 -1.608 1.00 0.25 H new ATOM 0 HD1 TYR A 83 -15.253 -0.108 -2.926 1.00 0.59 H new ATOM 0 HD2 TYR A 83 -13.005 1.142 0.461 1.00 0.67 H new ATOM 0 HE1 TYR A 83 -17.210 -0.458 -1.499 1.00 0.60 H new ATOM 0 HE2 TYR A 83 -14.960 0.789 1.892 1.00 0.71 H new ATOM 0 HH TYR A 83 -17.015 -0.055 2.021 1.00 0.44 H new ATOM 1233 N VAL A 84 -10.680 3.243 -3.063 1.00 0.22 N ATOM 1234 CA VAL A 84 -9.422 3.584 -3.667 1.00 0.22 C ATOM 1235 C VAL A 84 -8.287 3.094 -2.807 1.00 0.23 C ATOM 1236 O VAL A 84 -8.004 3.623 -1.729 1.00 0.24 O ATOM 1237 CB VAL A 84 -9.319 5.094 -3.951 1.00 0.22 C ATOM 1238 CG1 VAL A 84 -7.901 5.498 -4.337 1.00 0.26 C ATOM 1239 CG2 VAL A 84 -10.286 5.440 -5.055 1.00 0.25 C ATOM 0 H VAL A 84 -10.910 3.776 -2.224 1.00 0.22 H new ATOM 0 HA VAL A 84 -9.356 3.084 -4.633 1.00 0.22 H new ATOM 0 HB VAL A 84 -9.571 5.644 -3.044 1.00 0.22 H new ATOM 0 HG11 VAL A 84 -7.868 6.570 -4.530 1.00 0.26 H new ATOM 0 HG12 VAL A 84 -7.219 5.255 -3.522 1.00 0.26 H new ATOM 0 HG13 VAL A 84 -7.601 4.958 -5.235 1.00 0.26 H new ATOM 0 HG21 VAL A 84 -10.227 6.507 -5.270 1.00 0.25 H new ATOM 0 HG22 VAL A 84 -10.032 4.875 -5.952 1.00 0.25 H new ATOM 0 HG23 VAL A 84 -11.300 5.189 -4.743 1.00 0.25 H new ATOM 1249 N LEU A 85 -7.671 2.042 -3.290 1.00 0.25 N ATOM 1250 CA LEU A 85 -6.592 1.408 -2.592 1.00 0.30 C ATOM 1251 C LEU A 85 -5.277 1.903 -3.156 1.00 0.29 C ATOM 1252 O LEU A 85 -4.879 1.533 -4.255 1.00 0.31 O ATOM 1253 CB LEU A 85 -6.728 -0.110 -2.731 1.00 0.40 C ATOM 1254 CG LEU A 85 -5.755 -0.944 -1.907 1.00 0.92 C ATOM 1255 CD1 LEU A 85 -6.437 -2.219 -1.452 1.00 1.56 C ATOM 1256 CD2 LEU A 85 -4.515 -1.281 -2.720 1.00 1.13 C ATOM 0 H LEU A 85 -7.908 1.605 -4.180 1.00 0.25 H new ATOM 0 HA LEU A 85 -6.622 1.656 -1.531 1.00 0.30 H new ATOM 0 HB2 LEU A 85 -7.744 -0.391 -2.452 1.00 0.40 H new ATOM 0 HB3 LEU A 85 -6.601 -0.372 -3.781 1.00 0.40 H new ATOM 0 HG LEU A 85 -5.448 -0.365 -1.036 1.00 0.92 H new ATOM 0 HD11 LEU A 85 -5.740 -2.814 -0.863 1.00 1.56 H new ATOM 0 HD12 LEU A 85 -7.306 -1.969 -0.843 1.00 1.56 H new ATOM 0 HD13 LEU A 85 -6.757 -2.791 -2.323 1.00 1.56 H new ATOM 0 HD21 LEU A 85 -3.833 -1.877 -2.113 1.00 1.13 H new ATOM 0 HD22 LEU A 85 -4.803 -1.848 -3.605 1.00 1.13 H new ATOM 0 HD23 LEU A 85 -4.019 -0.360 -3.025 1.00 1.13 H new ATOM 1268 N VAL A 86 -4.626 2.762 -2.407 1.00 0.31 N ATOM 1269 CA VAL A 86 -3.342 3.292 -2.793 1.00 0.34 C ATOM 1270 C VAL A 86 -2.292 2.819 -1.800 1.00 0.32 C ATOM 1271 O VAL A 86 -2.236 3.273 -0.657 1.00 0.32 O ATOM 1272 CB VAL A 86 -3.360 4.840 -2.892 1.00 0.41 C ATOM 1273 CG1 VAL A 86 -4.030 5.467 -1.679 1.00 1.05 C ATOM 1274 CG2 VAL A 86 -1.949 5.390 -3.069 1.00 1.14 C ATOM 0 H VAL A 86 -4.972 3.112 -1.514 1.00 0.31 H new ATOM 0 HA VAL A 86 -3.096 2.921 -3.788 1.00 0.34 H new ATOM 0 HB VAL A 86 -3.946 5.106 -3.772 1.00 0.41 H new ATOM 0 HG11 VAL A 86 -4.025 6.552 -1.781 1.00 1.05 H new ATOM 0 HG12 VAL A 86 -5.059 5.114 -1.608 1.00 1.05 H new ATOM 0 HG13 VAL A 86 -3.487 5.185 -0.777 1.00 1.05 H new ATOM 0 HG21 VAL A 86 -1.988 6.477 -3.136 1.00 1.14 H new ATOM 0 HG22 VAL A 86 -1.336 5.101 -2.215 1.00 1.14 H new ATOM 0 HG23 VAL A 86 -1.513 4.986 -3.982 1.00 1.14 H new ATOM 1284 N LEU A 87 -1.474 1.879 -2.222 1.00 0.33 N ATOM 1285 CA LEU A 87 -0.473 1.323 -1.337 1.00 0.32 C ATOM 1286 C LEU A 87 0.881 1.926 -1.639 1.00 0.28 C ATOM 1287 O LEU A 87 1.261 2.088 -2.799 1.00 0.29 O ATOM 1288 CB LEU A 87 -0.446 -0.215 -1.425 1.00 0.42 C ATOM 1289 CG LEU A 87 -0.645 -0.832 -2.819 1.00 0.57 C ATOM 1290 CD1 LEU A 87 0.576 -0.632 -3.698 1.00 1.37 C ATOM 1291 CD2 LEU A 87 -0.970 -2.314 -2.699 1.00 1.44 C ATOM 0 H LEU A 87 -1.481 1.487 -3.163 1.00 0.33 H new ATOM 0 HA LEU A 87 -0.734 1.578 -0.310 1.00 0.32 H new ATOM 0 HB2 LEU A 87 0.511 -0.561 -1.033 1.00 0.42 H new ATOM 0 HB3 LEU A 87 -1.221 -0.607 -0.766 1.00 0.42 H new ATOM 0 HG LEU A 87 -1.483 -0.320 -3.292 1.00 0.57 H new ATOM 0 HD11 LEU A 87 0.398 -1.081 -4.675 1.00 1.37 H new ATOM 0 HD12 LEU A 87 0.767 0.434 -3.818 1.00 1.37 H new ATOM 0 HD13 LEU A 87 1.441 -1.105 -3.233 1.00 1.37 H new ATOM 0 HD21 LEU A 87 -1.108 -2.738 -3.694 1.00 1.44 H new ATOM 0 HD22 LEU A 87 -0.150 -2.827 -2.197 1.00 1.44 H new ATOM 0 HD23 LEU A 87 -1.885 -2.440 -2.120 1.00 1.44 H new ATOM 1303 N LYS A 88 1.591 2.304 -0.594 1.00 0.28 N ATOM 1304 CA LYS A 88 2.889 2.911 -0.775 1.00 0.28 C ATOM 1305 C LYS A 88 3.980 1.869 -0.574 1.00 0.28 C ATOM 1306 O LYS A 88 4.148 1.323 0.511 1.00 0.39 O ATOM 1307 CB LYS A 88 3.066 4.089 0.183 1.00 0.35 C ATOM 1308 CG LYS A 88 4.193 5.037 -0.194 1.00 0.67 C ATOM 1309 CD LYS A 88 3.833 5.904 -1.396 1.00 1.91 C ATOM 1310 CE LYS A 88 2.555 6.694 -1.162 1.00 2.70 C ATOM 1311 NZ LYS A 88 2.338 7.739 -2.202 1.00 3.73 N ATOM 0 H LYS A 88 1.294 2.202 0.376 1.00 0.28 H new ATOM 0 HA LYS A 88 2.965 3.296 -1.792 1.00 0.28 H new ATOM 0 HB2 LYS A 88 2.133 4.651 0.226 1.00 0.35 H new ATOM 0 HB3 LYS A 88 3.252 3.703 1.185 1.00 0.35 H new ATOM 0 HG2 LYS A 88 4.428 5.677 0.657 1.00 0.67 H new ATOM 0 HG3 LYS A 88 5.091 4.461 -0.418 1.00 0.67 H new ATOM 0 HD2 LYS A 88 4.652 6.592 -1.606 1.00 1.91 H new ATOM 0 HD3 LYS A 88 3.714 5.273 -2.276 1.00 1.91 H new ATOM 0 HE2 LYS A 88 1.705 6.012 -1.153 1.00 2.70 H new ATOM 0 HE3 LYS A 88 2.596 7.165 -0.180 1.00 2.70 H new ATOM 0 HZ1 LYS A 88 1.325 7.797 -2.430 1.00 3.73 H new ATOM 0 HZ2 LYS A 88 2.665 8.659 -1.844 1.00 3.73 H new ATOM 0 HZ3 LYS A 88 2.872 7.492 -3.059 1.00 3.73 H new ATOM 1325 N PHE A 89 4.698 1.591 -1.638 1.00 0.27 N ATOM 1326 CA PHE A 89 5.769 0.618 -1.621 1.00 0.28 C ATOM 1327 C PHE A 89 7.113 1.327 -1.666 1.00 0.28 C ATOM 1328 O PHE A 89 7.247 2.377 -2.292 1.00 0.29 O ATOM 1329 CB PHE A 89 5.669 -0.315 -2.829 1.00 0.32 C ATOM 1330 CG PHE A 89 4.781 -1.506 -2.627 1.00 0.32 C ATOM 1331 CD1 PHE A 89 4.865 -2.238 -1.460 1.00 0.37 C ATOM 1332 CD2 PHE A 89 3.893 -1.917 -3.612 1.00 0.37 C ATOM 1333 CE1 PHE A 89 4.083 -3.355 -1.270 1.00 0.44 C ATOM 1334 CE2 PHE A 89 3.115 -3.039 -3.431 1.00 0.42 C ATOM 1335 CZ PHE A 89 3.208 -3.758 -2.265 1.00 0.45 C ATOM 0 H PHE A 89 4.556 2.035 -2.545 1.00 0.27 H new ATOM 0 HA PHE A 89 5.682 0.035 -0.704 1.00 0.28 H new ATOM 0 HB2 PHE A 89 5.301 0.255 -3.682 1.00 0.32 H new ATOM 0 HB3 PHE A 89 6.669 -0.664 -3.086 1.00 0.32 H new ATOM 0 HD1 PHE A 89 5.553 -1.931 -0.686 1.00 0.37 H new ATOM 0 HD2 PHE A 89 3.812 -1.352 -4.529 1.00 0.37 H new ATOM 0 HE1 PHE A 89 4.152 -3.915 -0.349 1.00 0.44 H new ATOM 0 HE2 PHE A 89 2.432 -3.353 -4.206 1.00 0.42 H new ATOM 0 HZ PHE A 89 2.598 -4.638 -2.124 1.00 0.45 H new ATOM 1345 N ALA A 90 8.098 0.747 -1.014 1.00 0.32 N ATOM 1346 CA ALA A 90 9.454 1.277 -1.057 1.00 0.36 C ATOM 1347 C ALA A 90 10.458 0.140 -1.224 1.00 0.42 C ATOM 1348 O ALA A 90 10.398 -0.852 -0.496 1.00 0.51 O ATOM 1349 CB ALA A 90 9.759 2.083 0.198 1.00 0.44 C ATOM 0 H ALA A 90 7.990 -0.093 -0.446 1.00 0.32 H new ATOM 0 HA ALA A 90 9.538 1.945 -1.915 1.00 0.36 H new ATOM 0 HB1 ALA A 90 10.777 2.469 0.144 1.00 0.44 H new ATOM 0 HB2 ALA A 90 9.059 2.915 0.275 1.00 0.44 H new ATOM 0 HB3 ALA A 90 9.660 1.443 1.075 1.00 0.44 H new ATOM 1521 N VAL A 101 10.463 -8.323 -9.934 1.00 0.62 N ATOM 1522 CA VAL A 101 9.061 -8.176 -10.300 1.00 0.51 C ATOM 1523 C VAL A 101 8.179 -9.009 -9.377 1.00 0.49 C ATOM 1524 O VAL A 101 8.369 -10.217 -9.224 1.00 0.64 O ATOM 1525 CB VAL A 101 8.815 -8.583 -11.775 1.00 0.60 C ATOM 1526 CG1 VAL A 101 9.456 -7.579 -12.723 1.00 1.22 C ATOM 1527 CG2 VAL A 101 9.351 -9.980 -12.058 1.00 1.20 C ATOM 0 HA VAL A 101 8.800 -7.123 -10.190 1.00 0.51 H new ATOM 0 HB VAL A 101 7.738 -8.588 -11.941 1.00 0.60 H new ATOM 0 HG11 VAL A 101 9.272 -7.883 -13.753 1.00 1.22 H new ATOM 0 HG12 VAL A 101 9.026 -6.592 -12.553 1.00 1.22 H new ATOM 0 HG13 VAL A 101 10.530 -7.542 -12.542 1.00 1.22 H new ATOM 0 HG21 VAL A 101 9.164 -10.237 -13.101 1.00 1.20 H new ATOM 0 HG22 VAL A 101 10.424 -10.004 -11.865 1.00 1.20 H new ATOM 0 HG23 VAL A 101 8.850 -10.700 -11.411 1.00 1.20 H new ATOM 1537 N PHE A 102 7.232 -8.339 -8.743 1.00 0.43 N ATOM 1538 CA PHE A 102 6.393 -8.959 -7.730 1.00 0.43 C ATOM 1539 C PHE A 102 4.942 -9.026 -8.166 1.00 0.35 C ATOM 1540 O PHE A 102 4.552 -8.408 -9.145 1.00 0.34 O ATOM 1541 CB PHE A 102 6.503 -8.155 -6.445 1.00 0.47 C ATOM 1542 CG PHE A 102 7.876 -8.208 -5.846 1.00 0.63 C ATOM 1543 CD1 PHE A 102 8.329 -9.358 -5.221 1.00 0.80 C ATOM 1544 CD2 PHE A 102 8.709 -7.105 -5.903 1.00 0.76 C ATOM 1545 CE1 PHE A 102 9.591 -9.405 -4.666 1.00 0.97 C ATOM 1546 CE2 PHE A 102 9.972 -7.146 -5.347 1.00 0.91 C ATOM 1547 CZ PHE A 102 10.419 -8.315 -4.744 1.00 0.99 C ATOM 0 H PHE A 102 7.023 -7.355 -8.914 1.00 0.43 H new ATOM 0 HA PHE A 102 6.738 -9.981 -7.574 1.00 0.43 H new ATOM 0 HB2 PHE A 102 6.239 -7.117 -6.647 1.00 0.47 H new ATOM 0 HB3 PHE A 102 5.780 -8.533 -5.722 1.00 0.47 H new ATOM 0 HD1 PHE A 102 7.688 -10.226 -5.168 1.00 0.80 H new ATOM 0 HD2 PHE A 102 8.368 -6.202 -6.388 1.00 0.76 H new ATOM 0 HE1 PHE A 102 9.928 -10.303 -4.169 1.00 0.97 H new ATOM 0 HE2 PHE A 102 10.609 -6.274 -5.381 1.00 0.91 H new ATOM 0 HZ PHE A 102 11.418 -8.365 -4.337 1.00 0.99 H new ATOM 1557 N ASP A 103 4.140 -9.771 -7.430 1.00 0.35 N ATOM 1558 CA ASP A 103 2.729 -9.910 -7.762 1.00 0.34 C ATOM 1559 C ASP A 103 1.904 -9.127 -6.759 1.00 0.33 C ATOM 1560 O ASP A 103 2.199 -9.165 -5.585 1.00 0.40 O ATOM 1561 CB ASP A 103 2.322 -11.384 -7.732 1.00 0.45 C ATOM 1562 CG ASP A 103 3.286 -12.287 -8.483 1.00 0.86 C ATOM 1563 OD1 ASP A 103 3.922 -11.815 -9.448 1.00 1.46 O ATOM 1564 OD2 ASP A 103 3.403 -13.476 -8.118 1.00 1.53 O ATOM 0 H ASP A 103 4.436 -10.288 -6.602 1.00 0.35 H new ATOM 0 HA ASP A 103 2.554 -9.522 -8.765 1.00 0.34 H new ATOM 0 HB2 ASP A 103 2.257 -11.715 -6.696 1.00 0.45 H new ATOM 0 HB3 ASP A 103 1.326 -11.488 -8.163 1.00 0.45 H new ATOM 1569 N VAL A 104 0.885 -8.418 -7.220 1.00 0.30 N ATOM 1570 CA VAL A 104 0.087 -7.547 -6.353 1.00 0.31 C ATOM 1571 C VAL A 104 -1.409 -7.695 -6.633 1.00 0.28 C ATOM 1572 O VAL A 104 -1.884 -7.320 -7.706 1.00 0.30 O ATOM 1573 CB VAL A 104 0.501 -6.068 -6.544 1.00 0.36 C ATOM 1574 CG1 VAL A 104 -0.585 -5.115 -6.075 1.00 0.45 C ATOM 1575 CG2 VAL A 104 1.799 -5.780 -5.813 1.00 0.63 C ATOM 0 H VAL A 104 0.585 -8.425 -8.195 1.00 0.30 H new ATOM 0 HA VAL A 104 0.278 -7.850 -5.323 1.00 0.31 H new ATOM 0 HB VAL A 104 0.649 -5.906 -7.612 1.00 0.36 H new ATOM 0 HG11 VAL A 104 -0.257 -4.087 -6.226 1.00 0.45 H new ATOM 0 HG12 VAL A 104 -1.496 -5.292 -6.646 1.00 0.45 H new ATOM 0 HG13 VAL A 104 -0.783 -5.281 -5.016 1.00 0.45 H new ATOM 0 HG21 VAL A 104 2.075 -4.735 -5.959 1.00 0.63 H new ATOM 0 HG22 VAL A 104 1.668 -5.976 -4.749 1.00 0.63 H new ATOM 0 HG23 VAL A 104 2.588 -6.421 -6.206 1.00 0.63 H new ATOM 1585 N ARG A 105 -2.145 -8.231 -5.662 1.00 0.28 N ATOM 1586 CA ARG A 105 -3.577 -8.479 -5.831 1.00 0.26 C ATOM 1587 C ARG A 105 -4.428 -7.558 -4.964 1.00 0.28 C ATOM 1588 O ARG A 105 -4.095 -7.295 -3.810 1.00 0.39 O ATOM 1589 CB ARG A 105 -3.931 -9.908 -5.439 1.00 0.37 C ATOM 1590 CG ARG A 105 -2.994 -10.970 -5.973 1.00 0.64 C ATOM 1591 CD ARG A 105 -3.369 -12.325 -5.409 1.00 0.57 C ATOM 1592 NE ARG A 105 -2.488 -13.387 -5.872 1.00 1.11 N ATOM 1593 CZ ARG A 105 -2.470 -14.607 -5.339 1.00 1.36 C ATOM 1594 NH1 ARG A 105 -3.219 -14.880 -4.280 1.00 1.37 N ATOM 1595 NH2 ARG A 105 -1.693 -15.550 -5.854 1.00 1.95 N ATOM 0 H ARG A 105 -1.775 -8.502 -4.751 1.00 0.28 H new ATOM 0 HA ARG A 105 -3.788 -8.295 -6.885 1.00 0.26 H new ATOM 0 HB2 ARG A 105 -3.950 -9.976 -4.351 1.00 0.37 H new ATOM 0 HB3 ARG A 105 -4.940 -10.125 -5.790 1.00 0.37 H new ATOM 0 HG2 ARG A 105 -3.042 -10.994 -7.062 1.00 0.64 H new ATOM 0 HG3 ARG A 105 -1.966 -10.727 -5.705 1.00 0.64 H new ATOM 0 HD2 ARG A 105 -3.339 -12.282 -4.320 1.00 0.57 H new ATOM 0 HD3 ARG A 105 -4.395 -12.560 -5.691 1.00 0.57 H new ATOM 0 HE ARG A 105 -1.852 -13.186 -6.644 1.00 1.11 H new ATOM 0 HH11 ARG A 105 -3.810 -14.155 -3.873 1.00 1.37 H new ATOM 0 HH12 ARG A 105 -3.205 -15.815 -3.872 1.00 1.37 H new ATOM 0 HH21 ARG A 105 -1.106 -15.342 -6.662 1.00 1.95 H new ATOM 0 HH22 ARG A 105 -1.682 -16.483 -5.442 1.00 1.95 H new ATOM 1609 N VAL A 106 -5.544 -7.115 -5.528 1.00 0.28 N ATOM 1610 CA VAL A 106 -6.584 -6.429 -4.778 1.00 0.31 C ATOM 1611 C VAL A 106 -7.825 -7.321 -4.684 1.00 0.28 C ATOM 1612 O VAL A 106 -8.632 -7.404 -5.608 1.00 0.34 O ATOM 1613 CB VAL A 106 -6.944 -5.048 -5.385 1.00 0.39 C ATOM 1614 CG1 VAL A 106 -5.820 -4.055 -5.139 1.00 1.44 C ATOM 1615 CG2 VAL A 106 -7.235 -5.147 -6.875 1.00 1.41 C ATOM 0 H VAL A 106 -5.753 -7.222 -6.521 1.00 0.28 H new ATOM 0 HA VAL A 106 -6.197 -6.235 -3.778 1.00 0.31 H new ATOM 0 HB VAL A 106 -7.850 -4.697 -4.890 1.00 0.39 H new ATOM 0 HG11 VAL A 106 -6.086 -3.090 -5.570 1.00 1.44 H new ATOM 0 HG12 VAL A 106 -5.663 -3.942 -4.066 1.00 1.44 H new ATOM 0 HG13 VAL A 106 -4.904 -4.420 -5.604 1.00 1.44 H new ATOM 0 HG21 VAL A 106 -7.483 -4.159 -7.264 1.00 1.41 H new ATOM 0 HG22 VAL A 106 -6.356 -5.530 -7.393 1.00 1.41 H new ATOM 0 HG23 VAL A 106 -8.075 -5.822 -7.038 1.00 1.41 H new ATOM 1625 N ASN A 107 -7.928 -8.023 -3.562 1.00 0.28 N ATOM 1626 CA ASN A 107 -8.949 -9.049 -3.340 1.00 0.28 C ATOM 1627 C ASN A 107 -8.891 -10.085 -4.454 1.00 0.29 C ATOM 1628 O ASN A 107 -9.851 -10.296 -5.197 1.00 0.38 O ATOM 1629 CB ASN A 107 -10.347 -8.437 -3.209 1.00 0.30 C ATOM 1630 CG ASN A 107 -11.451 -9.444 -2.892 1.00 0.96 C ATOM 1631 OD1 ASN A 107 -12.582 -9.296 -3.354 1.00 1.57 O ATOM 1632 ND2 ASN A 107 -11.154 -10.454 -2.088 1.00 1.65 N ATOM 0 H ASN A 107 -7.299 -7.897 -2.769 1.00 0.28 H new ATOM 0 HA ASN A 107 -8.739 -9.547 -2.393 1.00 0.28 H new ATOM 0 HB2 ASN A 107 -10.327 -7.680 -2.425 1.00 0.30 H new ATOM 0 HB3 ASN A 107 -10.595 -7.926 -4.139 1.00 0.30 H new ATOM 0 HD21 ASN A 107 -11.872 -11.134 -1.837 1.00 1.65 H new ATOM 0 HD22 ASN A 107 -10.208 -10.552 -1.720 1.00 1.65 H new ATOM 1639 N GLY A 108 -7.725 -10.698 -4.580 1.00 0.29 N ATOM 1640 CA GLY A 108 -7.519 -11.728 -5.575 1.00 0.35 C ATOM 1641 C GLY A 108 -7.088 -11.172 -6.920 1.00 0.32 C ATOM 1642 O GLY A 108 -6.421 -11.850 -7.700 1.00 0.42 O ATOM 0 H GLY A 108 -6.908 -10.497 -4.003 1.00 0.29 H new ATOM 0 HA2 GLY A 108 -6.762 -12.426 -5.217 1.00 0.35 H new ATOM 0 HA3 GLY A 108 -8.442 -12.295 -5.701 1.00 0.35 H new ATOM 1646 N HIS A 109 -7.457 -9.928 -7.179 1.00 0.26 N ATOM 1647 CA HIS A 109 -7.243 -9.309 -8.478 1.00 0.27 C ATOM 1648 C HIS A 109 -5.840 -8.737 -8.610 1.00 0.23 C ATOM 1649 O HIS A 109 -5.590 -7.610 -8.195 1.00 0.24 O ATOM 1650 CB HIS A 109 -8.272 -8.202 -8.676 1.00 0.33 C ATOM 1651 CG HIS A 109 -9.654 -8.715 -8.906 1.00 0.44 C ATOM 1652 ND1 HIS A 109 -10.071 -9.210 -10.118 1.00 0.57 N ATOM 1653 CD2 HIS A 109 -10.713 -8.830 -8.068 1.00 0.53 C ATOM 1654 CE1 HIS A 109 -11.323 -9.607 -10.023 1.00 0.68 C ATOM 1655 NE2 HIS A 109 -11.739 -9.391 -8.790 1.00 0.65 N ATOM 0 H HIS A 109 -7.912 -9.320 -6.498 1.00 0.26 H new ATOM 0 HA HIS A 109 -7.357 -10.076 -9.244 1.00 0.27 H new ATOM 0 HB2 HIS A 109 -8.273 -7.556 -7.798 1.00 0.33 H new ATOM 0 HB3 HIS A 109 -7.974 -7.586 -9.525 1.00 0.33 H new ATOM 0 HD1 HIS A 109 -9.499 -9.262 -10.961 1.00 0.57 H new ATOM 0 HD2 HIS A 109 -10.745 -8.536 -7.029 1.00 0.53 H new ATOM 0 HE1 HIS A 109 -11.911 -10.037 -10.821 1.00 0.68 H new ATOM 1664 N THR A 110 -4.928 -9.505 -9.185 1.00 0.27 N ATOM 1665 CA THR A 110 -3.560 -9.046 -9.362 1.00 0.30 C ATOM 1666 C THR A 110 -3.488 -7.917 -10.390 1.00 0.30 C ATOM 1667 O THR A 110 -3.382 -8.156 -11.594 1.00 0.48 O ATOM 1668 CB THR A 110 -2.639 -10.191 -9.809 1.00 0.40 C ATOM 1669 OG1 THR A 110 -3.248 -11.450 -9.499 1.00 0.77 O ATOM 1670 CG2 THR A 110 -1.292 -10.101 -9.117 1.00 0.61 C ATOM 0 H THR A 110 -5.109 -10.445 -9.536 1.00 0.27 H new ATOM 0 HA THR A 110 -3.222 -8.675 -8.394 1.00 0.30 H new ATOM 0 HB THR A 110 -2.486 -10.108 -10.885 1.00 0.40 H new ATOM 0 HG1 THR A 110 -2.659 -12.178 -9.787 1.00 0.77 H new ATOM 0 HG21 THR A 110 -0.657 -10.922 -9.449 1.00 0.61 H new ATOM 0 HG22 THR A 110 -0.818 -9.152 -9.366 1.00 0.61 H new ATOM 0 HG23 THR A 110 -1.432 -10.164 -8.038 1.00 0.61 H new ATOM 1678 N VAL A 111 -3.561 -6.686 -9.906 1.00 0.26 N ATOM 1679 CA VAL A 111 -3.475 -5.522 -10.768 1.00 0.29 C ATOM 1680 C VAL A 111 -2.044 -5.294 -11.231 1.00 0.29 C ATOM 1681 O VAL A 111 -1.807 -4.923 -12.381 1.00 0.38 O ATOM 1682 CB VAL A 111 -4.009 -4.253 -10.072 1.00 0.32 C ATOM 1683 CG1 VAL A 111 -5.523 -4.296 -9.993 1.00 0.93 C ATOM 1684 CG2 VAL A 111 -3.414 -4.102 -8.678 1.00 0.94 C ATOM 0 H VAL A 111 -3.680 -6.469 -8.916 1.00 0.26 H new ATOM 0 HA VAL A 111 -4.103 -5.722 -11.637 1.00 0.29 H new ATOM 0 HB VAL A 111 -3.709 -3.389 -10.665 1.00 0.32 H new ATOM 0 HG11 VAL A 111 -5.887 -3.395 -9.500 1.00 0.93 H new ATOM 0 HG12 VAL A 111 -5.938 -4.352 -10.999 1.00 0.93 H new ATOM 0 HG13 VAL A 111 -5.833 -5.172 -9.423 1.00 0.93 H new ATOM 0 HG21 VAL A 111 -3.807 -3.199 -8.210 1.00 0.94 H new ATOM 0 HG22 VAL A 111 -3.679 -4.969 -8.073 1.00 0.94 H new ATOM 0 HG23 VAL A 111 -2.329 -4.029 -8.751 1.00 0.94 H new ATOM 1694 N VAL A 112 -1.088 -5.540 -10.345 1.00 0.27 N ATOM 1695 CA VAL A 112 0.313 -5.385 -10.695 1.00 0.28 C ATOM 1696 C VAL A 112 1.042 -6.702 -10.509 1.00 0.28 C ATOM 1697 O VAL A 112 1.584 -6.978 -9.446 1.00 0.27 O ATOM 1698 CB VAL A 112 1.011 -4.308 -9.835 1.00 0.29 C ATOM 1699 CG1 VAL A 112 2.350 -3.925 -10.447 1.00 0.35 C ATOM 1700 CG2 VAL A 112 0.122 -3.088 -9.665 1.00 0.33 C ATOM 0 H VAL A 112 -1.257 -5.845 -9.387 1.00 0.27 H new ATOM 0 HA VAL A 112 0.349 -5.070 -11.738 1.00 0.28 H new ATOM 0 HB VAL A 112 1.194 -4.726 -8.845 1.00 0.29 H new ATOM 0 HG11 VAL A 112 2.829 -3.165 -9.829 1.00 0.35 H new ATOM 0 HG12 VAL A 112 2.990 -4.805 -10.501 1.00 0.35 H new ATOM 0 HG13 VAL A 112 2.192 -3.529 -11.450 1.00 0.35 H new ATOM 0 HG21 VAL A 112 0.637 -2.345 -9.056 1.00 0.33 H new ATOM 0 HG22 VAL A 112 -0.103 -2.663 -10.643 1.00 0.33 H new ATOM 0 HG23 VAL A 112 -0.806 -3.380 -9.174 1.00 0.33 H new ATOM 1710 N LYS A 113 1.066 -7.513 -11.546 1.00 0.33 N ATOM 1711 CA LYS A 113 1.788 -8.767 -11.494 1.00 0.37 C ATOM 1712 C LYS A 113 3.038 -8.617 -12.345 1.00 0.41 C ATOM 1713 O LYS A 113 3.148 -9.171 -13.444 1.00 0.68 O ATOM 1714 CB LYS A 113 0.871 -9.894 -11.985 1.00 0.44 C ATOM 1715 CG LYS A 113 1.239 -11.293 -11.498 1.00 1.24 C ATOM 1716 CD LYS A 113 2.449 -11.864 -12.217 1.00 2.09 C ATOM 1717 CE LYS A 113 2.756 -13.279 -11.755 1.00 3.07 C ATOM 1718 NZ LYS A 113 4.004 -13.799 -12.366 1.00 4.01 N ATOM 0 H LYS A 113 0.596 -7.327 -12.432 1.00 0.33 H new ATOM 0 HA LYS A 113 2.092 -9.022 -10.479 1.00 0.37 H new ATOM 0 HB2 LYS A 113 -0.149 -9.674 -11.669 1.00 0.44 H new ATOM 0 HB3 LYS A 113 0.874 -9.894 -13.075 1.00 0.44 H new ATOM 0 HG2 LYS A 113 1.440 -11.259 -10.427 1.00 1.24 H new ATOM 0 HG3 LYS A 113 0.388 -11.959 -11.642 1.00 1.24 H new ATOM 0 HD2 LYS A 113 2.269 -11.862 -13.292 1.00 2.09 H new ATOM 0 HD3 LYS A 113 3.314 -11.226 -12.038 1.00 2.09 H new ATOM 0 HE2 LYS A 113 2.849 -13.295 -10.669 1.00 3.07 H new ATOM 0 HE3 LYS A 113 1.924 -13.934 -12.013 1.00 3.07 H new ATOM 0 HZ1 LYS A 113 4.180 -14.766 -12.027 1.00 4.01 H new ATOM 0 HZ2 LYS A 113 3.906 -13.808 -13.401 1.00 4.01 H new ATOM 0 HZ3 LYS A 113 4.802 -13.188 -12.099 1.00 4.01 H new ATOM 1732 N ASP A 114 3.978 -7.866 -11.777 1.00 0.39 N ATOM 1733 CA ASP A 114 5.206 -7.429 -12.446 1.00 0.45 C ATOM 1734 C ASP A 114 5.786 -6.241 -11.683 1.00 0.38 C ATOM 1735 O ASP A 114 6.472 -5.397 -12.257 1.00 0.45 O ATOM 1736 CB ASP A 114 4.949 -7.000 -13.904 1.00 0.63 C ATOM 1737 CG ASP A 114 4.047 -5.776 -14.033 1.00 1.33 C ATOM 1738 OD1 ASP A 114 2.812 -5.920 -13.900 1.00 1.52 O ATOM 1739 OD2 ASP A 114 4.568 -4.658 -14.246 1.00 1.96 O ATOM 0 H ASP A 114 3.908 -7.535 -10.815 1.00 0.39 H new ATOM 0 HA ASP A 114 5.899 -8.270 -12.458 1.00 0.45 H new ATOM 0 HB2 ASP A 114 5.904 -6.789 -14.385 1.00 0.63 H new ATOM 0 HB3 ASP A 114 4.497 -7.832 -14.444 1.00 0.63 H new ATOM 1744 N LEU A 115 5.511 -6.191 -10.380 1.00 0.33 N ATOM 1745 CA LEU A 115 5.822 -5.022 -9.573 1.00 0.34 C ATOM 1746 C LEU A 115 7.322 -4.869 -9.355 1.00 0.37 C ATOM 1747 O LEU A 115 7.855 -5.256 -8.317 1.00 0.47 O ATOM 1748 CB LEU A 115 5.081 -5.060 -8.227 1.00 0.38 C ATOM 1749 CG LEU A 115 4.534 -3.710 -7.751 1.00 0.45 C ATOM 1750 CD1 LEU A 115 4.612 -3.633 -6.250 1.00 1.18 C ATOM 1751 CD2 LEU A 115 5.277 -2.540 -8.383 1.00 1.07 C ATOM 0 H LEU A 115 5.071 -6.953 -9.863 1.00 0.33 H new ATOM 0 HA LEU A 115 5.476 -4.150 -10.128 1.00 0.34 H new ATOM 0 HB2 LEU A 115 4.252 -5.764 -8.305 1.00 0.38 H new ATOM 0 HB3 LEU A 115 5.759 -5.449 -7.467 1.00 0.38 H new ATOM 0 HG LEU A 115 3.493 -3.638 -8.067 1.00 0.45 H new ATOM 0 HD11 LEU A 115 4.222 -2.672 -5.914 1.00 1.18 H new ATOM 0 HD12 LEU A 115 4.020 -4.437 -5.813 1.00 1.18 H new ATOM 0 HD13 LEU A 115 5.650 -3.734 -5.934 1.00 1.18 H new ATOM 0 HD21 LEU A 115 4.857 -1.603 -8.018 1.00 1.07 H new ATOM 0 HD22 LEU A 115 6.333 -2.593 -8.117 1.00 1.07 H new ATOM 0 HD23 LEU A 115 5.174 -2.586 -9.467 1.00 1.07 H new ATOM 1763 N ASP A 116 7.987 -4.322 -10.359 1.00 0.39 N ATOM 1764 CA ASP A 116 9.370 -3.903 -10.239 1.00 0.44 C ATOM 1765 C ASP A 116 9.385 -2.449 -9.784 1.00 0.43 C ATOM 1766 O ASP A 116 9.168 -1.533 -10.581 1.00 0.48 O ATOM 1767 CB ASP A 116 10.094 -4.057 -11.583 1.00 0.53 C ATOM 1768 CG ASP A 116 11.597 -3.895 -11.464 1.00 1.28 C ATOM 1769 OD1 ASP A 116 12.050 -2.776 -11.125 1.00 1.93 O ATOM 1770 OD2 ASP A 116 12.324 -4.888 -11.677 1.00 1.83 O ATOM 0 H ASP A 116 7.581 -4.157 -11.280 1.00 0.39 H new ATOM 0 HA ASP A 116 9.890 -4.526 -9.511 1.00 0.44 H new ATOM 0 HB2 ASP A 116 9.871 -5.039 -12.000 1.00 0.53 H new ATOM 0 HB3 ASP A 116 9.708 -3.318 -12.285 1.00 0.53 H new ATOM 1775 N ILE A 117 9.594 -2.245 -8.492 1.00 0.44 N ATOM 1776 CA ILE A 117 9.477 -0.920 -7.896 1.00 0.46 C ATOM 1777 C ILE A 117 10.518 0.044 -8.465 1.00 0.48 C ATOM 1778 O ILE A 117 10.223 1.223 -8.690 1.00 0.51 O ATOM 1779 CB ILE A 117 9.593 -0.983 -6.357 1.00 0.52 C ATOM 1780 CG1 ILE A 117 8.537 -1.942 -5.793 1.00 0.56 C ATOM 1781 CG2 ILE A 117 9.434 0.407 -5.748 1.00 0.58 C ATOM 1782 CD1 ILE A 117 8.602 -2.110 -4.290 1.00 0.82 C ATOM 0 H ILE A 117 9.846 -2.982 -7.833 1.00 0.44 H new ATOM 0 HA ILE A 117 8.487 -0.542 -8.151 1.00 0.46 H new ATOM 0 HB ILE A 117 10.583 -1.356 -6.095 1.00 0.52 H new ATOM 0 HG12 ILE A 117 7.547 -1.577 -6.066 1.00 0.56 H new ATOM 0 HG13 ILE A 117 8.658 -2.918 -6.263 1.00 0.56 H new ATOM 0 HG21 ILE A 117 9.519 0.341 -4.663 1.00 0.58 H new ATOM 0 HG22 ILE A 117 10.213 1.064 -6.134 1.00 0.58 H new ATOM 0 HG23 ILE A 117 8.456 0.810 -6.011 1.00 0.58 H new ATOM 0 HD11 ILE A 117 7.824 -2.802 -3.967 1.00 0.82 H new ATOM 0 HD12 ILE A 117 9.579 -2.505 -4.010 1.00 0.82 H new ATOM 0 HD13 ILE A 117 8.450 -1.144 -3.809 1.00 0.82 H new ATOM 1794 N PHE A 118 11.711 -0.470 -8.739 1.00 0.54 N ATOM 1795 CA PHE A 118 12.796 0.349 -9.269 1.00 0.62 C ATOM 1796 C PHE A 118 12.461 0.825 -10.680 1.00 0.65 C ATOM 1797 O PHE A 118 12.818 1.931 -11.077 1.00 0.74 O ATOM 1798 CB PHE A 118 14.107 -0.446 -9.269 1.00 0.70 C ATOM 1799 CG PHE A 118 15.312 0.366 -9.654 1.00 0.81 C ATOM 1800 CD1 PHE A 118 15.939 1.178 -8.725 1.00 0.89 C ATOM 1801 CD2 PHE A 118 15.819 0.315 -10.942 1.00 0.92 C ATOM 1802 CE1 PHE A 118 17.049 1.924 -9.074 1.00 1.02 C ATOM 1803 CE2 PHE A 118 16.928 1.058 -11.296 1.00 1.06 C ATOM 1804 CZ PHE A 118 17.544 1.864 -10.360 1.00 1.08 C ATOM 0 H PHE A 118 11.952 -1.452 -8.603 1.00 0.54 H new ATOM 0 HA PHE A 118 12.919 1.223 -8.630 1.00 0.62 H new ATOM 0 HB2 PHE A 118 14.266 -0.865 -8.276 1.00 0.70 H new ATOM 0 HB3 PHE A 118 14.011 -1.285 -9.958 1.00 0.70 H new ATOM 0 HD1 PHE A 118 15.557 1.229 -7.716 1.00 0.89 H new ATOM 0 HD2 PHE A 118 15.341 -0.314 -11.679 1.00 0.92 H new ATOM 0 HE1 PHE A 118 17.529 2.554 -8.340 1.00 1.02 H new ATOM 0 HE2 PHE A 118 17.313 1.008 -12.304 1.00 1.06 H new ATOM 0 HZ PHE A 118 18.411 2.446 -10.634 1.00 1.08 H new ATOM 1814 N ASP A 119 11.776 -0.018 -11.435 1.00 0.61 N ATOM 1815 CA ASP A 119 11.322 0.341 -12.775 1.00 0.68 C ATOM 1816 C ASP A 119 10.253 1.430 -12.728 1.00 0.69 C ATOM 1817 O ASP A 119 10.238 2.340 -13.557 1.00 0.81 O ATOM 1818 CB ASP A 119 10.760 -0.895 -13.486 1.00 0.68 C ATOM 1819 CG ASP A 119 10.104 -0.566 -14.813 1.00 0.82 C ATOM 1820 OD1 ASP A 119 10.817 -0.546 -15.839 1.00 0.96 O ATOM 1821 OD2 ASP A 119 8.873 -0.350 -14.841 1.00 0.89 O ATOM 0 H ASP A 119 11.519 -0.961 -11.144 1.00 0.61 H new ATOM 0 HA ASP A 119 12.180 0.726 -13.326 1.00 0.68 H new ATOM 0 HB2 ASP A 119 11.566 -1.610 -13.652 1.00 0.68 H new ATOM 0 HB3 ASP A 119 10.032 -1.381 -12.837 1.00 0.68 H new ATOM 1826 N ARG A 120 9.380 1.349 -11.734 1.00 0.61 N ATOM 1827 CA ARG A 120 8.187 2.181 -11.695 1.00 0.66 C ATOM 1828 C ARG A 120 8.493 3.614 -11.260 1.00 0.75 C ATOM 1829 O ARG A 120 8.021 4.569 -11.880 1.00 0.97 O ATOM 1830 CB ARG A 120 7.147 1.555 -10.764 1.00 0.63 C ATOM 1831 CG ARG A 120 6.610 0.212 -11.246 1.00 0.59 C ATOM 1832 CD ARG A 120 5.760 0.355 -12.501 1.00 0.72 C ATOM 1833 NE ARG A 120 5.215 -0.931 -12.945 1.00 1.02 N ATOM 1834 CZ ARG A 120 3.909 -1.209 -13.005 1.00 1.31 C ATOM 1835 NH1 ARG A 120 3.015 -0.305 -12.620 1.00 1.69 N ATOM 1836 NH2 ARG A 120 3.500 -2.392 -13.441 1.00 1.65 N ATOM 0 H ARG A 120 9.476 0.714 -10.942 1.00 0.61 H new ATOM 0 HA ARG A 120 7.789 2.232 -12.708 1.00 0.66 H new ATOM 0 HB2 ARG A 120 7.590 1.424 -9.777 1.00 0.63 H new ATOM 0 HB3 ARG A 120 6.313 2.248 -10.650 1.00 0.63 H new ATOM 0 HG2 ARG A 120 7.444 -0.461 -11.447 1.00 0.59 H new ATOM 0 HG3 ARG A 120 6.015 -0.246 -10.455 1.00 0.59 H new ATOM 0 HD2 ARG A 120 4.941 1.048 -12.307 1.00 0.72 H new ATOM 0 HD3 ARG A 120 6.362 0.788 -13.299 1.00 0.72 H new ATOM 0 HE ARG A 120 5.873 -1.658 -13.225 1.00 1.02 H new ATOM 0 HH11 ARG A 120 3.324 0.605 -12.277 1.00 1.69 H new ATOM 0 HH12 ARG A 120 2.019 -0.520 -12.667 1.00 1.69 H new ATOM 0 HH21 ARG A 120 4.182 -3.092 -13.732 1.00 1.65 H new ATOM 0 HH22 ARG A 120 2.503 -2.602 -13.486 1.00 1.65 H new ATOM 1850 N VAL A 121 9.270 3.773 -10.195 1.00 0.65 N ATOM 1851 CA VAL A 121 9.567 5.116 -9.681 1.00 0.75 C ATOM 1852 C VAL A 121 11.032 5.486 -9.835 1.00 0.80 C ATOM 1853 O VAL A 121 11.390 6.663 -9.755 1.00 0.95 O ATOM 1854 CB VAL A 121 9.170 5.290 -8.199 1.00 0.79 C ATOM 1855 CG1 VAL A 121 7.667 5.438 -8.060 1.00 1.42 C ATOM 1856 CG2 VAL A 121 9.677 4.132 -7.357 1.00 1.49 C ATOM 0 H VAL A 121 9.701 3.009 -9.675 1.00 0.65 H new ATOM 0 HA VAL A 121 8.961 5.786 -10.291 1.00 0.75 H new ATOM 0 HB VAL A 121 9.639 6.202 -7.831 1.00 0.79 H new ATOM 0 HG11 VAL A 121 7.409 5.559 -7.008 1.00 1.42 H new ATOM 0 HG12 VAL A 121 7.334 6.313 -8.618 1.00 1.42 H new ATOM 0 HG13 VAL A 121 7.176 4.548 -8.454 1.00 1.42 H new ATOM 0 HG21 VAL A 121 9.383 4.281 -6.318 1.00 1.49 H new ATOM 0 HG22 VAL A 121 9.249 3.200 -7.725 1.00 1.49 H new ATOM 0 HG23 VAL A 121 10.764 4.083 -7.423 1.00 1.49 H new ATOM 1866 N GLY A 122 11.873 4.498 -10.058 1.00 0.76 N ATOM 1867 CA GLY A 122 13.285 4.758 -10.169 1.00 0.89 C ATOM 1868 C GLY A 122 14.025 4.370 -8.912 1.00 1.00 C ATOM 1869 O GLY A 122 13.650 3.415 -8.234 1.00 1.40 O ATOM 0 H GLY A 122 11.604 3.520 -10.164 1.00 0.76 H new ATOM 0 HA2 GLY A 122 13.691 4.205 -11.016 1.00 0.89 H new ATOM 0 HA3 GLY A 122 13.445 5.817 -10.373 1.00 0.89 H new ATOM 1873 N HIS A 123 15.071 5.111 -8.596 1.00 1.10 N ATOM 1874 CA HIS A 123 15.888 4.824 -7.426 1.00 1.36 C ATOM 1875 C HIS A 123 15.237 5.355 -6.147 1.00 1.08 C ATOM 1876 O HIS A 123 15.049 6.563 -5.992 1.00 1.41 O ATOM 1877 CB HIS A 123 17.301 5.407 -7.598 1.00 2.01 C ATOM 1878 CG HIS A 123 17.340 6.870 -7.944 1.00 2.61 C ATOM 1879 ND1 HIS A 123 17.286 7.339 -9.239 1.00 3.35 N ATOM 1880 CD2 HIS A 123 17.433 7.969 -7.157 1.00 3.26 C ATOM 1881 CE1 HIS A 123 17.344 8.656 -9.235 1.00 4.11 C ATOM 1882 NE2 HIS A 123 17.431 9.066 -7.985 1.00 4.08 N ATOM 0 H HIS A 123 15.378 5.921 -9.135 1.00 1.10 H new ATOM 0 HA HIS A 123 15.968 3.741 -7.332 1.00 1.36 H new ATOM 0 HB2 HIS A 123 17.858 5.251 -6.674 1.00 2.01 H new ATOM 0 HB3 HIS A 123 17.817 4.849 -8.379 1.00 2.01 H new ATOM 0 HD2 HIS A 123 17.497 7.981 -6.079 1.00 3.26 H new ATOM 0 HE1 HIS A 123 17.324 9.292 -10.108 1.00 4.11 H new ATOM 0 HE2 HIS A 123 17.488 10.038 -7.682 1.00 4.08 H new ATOM 1891 N SER A 124 14.883 4.434 -5.251 1.00 1.19 N ATOM 1892 CA SER A 124 14.362 4.783 -3.931 1.00 1.00 C ATOM 1893 C SER A 124 13.019 5.511 -4.054 1.00 1.02 C ATOM 1894 O SER A 124 12.230 5.212 -4.952 1.00 1.97 O ATOM 1895 CB SER A 124 15.396 5.639 -3.179 1.00 1.06 C ATOM 1896 OG SER A 124 15.036 5.836 -1.819 1.00 1.72 O ATOM 0 H SER A 124 14.949 3.430 -5.419 1.00 1.19 H new ATOM 0 HA SER A 124 14.187 3.870 -3.361 1.00 1.00 H new ATOM 0 HB2 SER A 124 16.372 5.156 -3.229 1.00 1.06 H new ATOM 0 HB3 SER A 124 15.493 6.606 -3.672 1.00 1.06 H new ATOM 0 HG SER A 124 15.137 6.783 -1.588 1.00 1.72 H new ATOM 1902 N THR A 125 12.775 6.442 -3.127 1.00 0.66 N ATOM 1903 CA THR A 125 11.546 7.244 -3.057 1.00 0.53 C ATOM 1904 C THR A 125 10.313 6.371 -2.808 1.00 0.48 C ATOM 1905 O THR A 125 10.412 5.152 -2.677 1.00 0.60 O ATOM 1906 CB THR A 125 11.328 8.144 -4.307 1.00 0.60 C ATOM 1907 OG1 THR A 125 11.062 7.371 -5.481 1.00 0.81 O ATOM 1908 CG2 THR A 125 12.541 9.031 -4.552 1.00 0.85 C ATOM 0 H THR A 125 13.440 6.665 -2.387 1.00 0.66 H new ATOM 0 HA THR A 125 11.681 7.910 -2.204 1.00 0.53 H new ATOM 0 HB THR A 125 10.457 8.766 -4.101 1.00 0.60 H new ATOM 0 HG1 THR A 125 11.137 6.417 -5.269 1.00 0.81 H new ATOM 0 HG21 THR A 125 12.366 9.652 -5.431 1.00 0.85 H new ATOM 0 HG22 THR A 125 12.706 9.669 -3.684 1.00 0.85 H new ATOM 0 HG23 THR A 125 13.420 8.408 -4.717 1.00 0.85 H new ATOM 1916 N ALA A 126 9.151 7.007 -2.705 1.00 0.44 N ATOM 1917 CA ALA A 126 7.922 6.285 -2.413 1.00 0.45 C ATOM 1918 C ALA A 126 7.180 5.919 -3.688 1.00 0.40 C ATOM 1919 O ALA A 126 6.927 6.775 -4.538 1.00 0.50 O ATOM 1920 CB ALA A 126 7.020 7.103 -1.506 1.00 0.57 C ATOM 0 H ALA A 126 9.036 8.014 -2.819 1.00 0.44 H new ATOM 0 HA ALA A 126 8.198 5.364 -1.900 1.00 0.45 H new ATOM 0 HB1 ALA A 126 6.107 6.544 -1.301 1.00 0.57 H new ATOM 0 HB2 ALA A 126 7.537 7.310 -0.569 1.00 0.57 H new ATOM 0 HB3 ALA A 126 6.767 8.043 -1.996 1.00 0.57 H new ATOM 1926 N HIS A 127 6.833 4.652 -3.819 1.00 0.33 N ATOM 1927 CA HIS A 127 6.026 4.192 -4.935 1.00 0.32 C ATOM 1928 C HIS A 127 4.593 4.007 -4.470 1.00 0.34 C ATOM 1929 O HIS A 127 4.366 3.641 -3.332 1.00 0.55 O ATOM 1930 CB HIS A 127 6.558 2.863 -5.487 1.00 0.34 C ATOM 1931 CG HIS A 127 5.773 2.367 -6.663 1.00 0.38 C ATOM 1932 ND1 HIS A 127 5.562 3.124 -7.794 1.00 0.44 N ATOM 1933 CD2 HIS A 127 5.104 1.207 -6.861 1.00 0.48 C ATOM 1934 CE1 HIS A 127 4.795 2.457 -8.629 1.00 0.50 C ATOM 1935 NE2 HIS A 127 4.504 1.291 -8.091 1.00 0.51 N ATOM 0 H HIS A 127 7.099 3.919 -3.162 1.00 0.33 H new ATOM 0 HA HIS A 127 6.072 4.937 -5.729 1.00 0.32 H new ATOM 0 HB2 HIS A 127 7.601 2.987 -5.778 1.00 0.34 H new ATOM 0 HB3 HIS A 127 6.535 2.112 -4.698 1.00 0.34 H new ATOM 0 HD2 HIS A 127 5.053 0.372 -6.178 1.00 0.48 H new ATOM 0 HE1 HIS A 127 4.460 2.807 -9.594 1.00 0.50 H new ATOM 0 HE2 HIS A 127 3.926 0.568 -8.520 1.00 0.51 H new ATOM 1944 N ASP A 128 3.631 4.252 -5.335 1.00 0.38 N ATOM 1945 CA ASP A 128 2.242 4.042 -4.972 1.00 0.47 C ATOM 1946 C ASP A 128 1.439 3.523 -6.146 1.00 0.46 C ATOM 1947 O ASP A 128 1.627 3.946 -7.286 1.00 0.61 O ATOM 1948 CB ASP A 128 1.611 5.322 -4.407 1.00 0.66 C ATOM 1949 CG ASP A 128 1.920 6.563 -5.221 1.00 0.99 C ATOM 1950 OD1 ASP A 128 1.236 6.812 -6.231 1.00 1.36 O ATOM 1951 OD2 ASP A 128 2.847 7.306 -4.829 1.00 1.64 O ATOM 0 H ASP A 128 3.781 4.593 -6.285 1.00 0.38 H new ATOM 0 HA ASP A 128 2.223 3.284 -4.189 1.00 0.47 H new ATOM 0 HB2 ASP A 128 0.530 5.192 -4.355 1.00 0.66 H new ATOM 0 HB3 ASP A 128 1.963 5.470 -3.386 1.00 0.66 H new ATOM 1956 N GLU A 129 0.588 2.554 -5.856 1.00 0.40 N ATOM 1957 CA GLU A 129 -0.376 2.056 -6.820 1.00 0.41 C ATOM 1958 C GLU A 129 -1.759 2.489 -6.376 1.00 0.33 C ATOM 1959 O GLU A 129 -2.227 2.076 -5.315 1.00 0.39 O ATOM 1960 CB GLU A 129 -0.325 0.527 -6.923 1.00 0.53 C ATOM 1961 CG GLU A 129 0.985 -0.027 -7.462 1.00 0.97 C ATOM 1962 CD GLU A 129 1.253 0.371 -8.900 1.00 0.72 C ATOM 1963 OE1 GLU A 129 0.290 0.603 -9.656 1.00 1.12 O ATOM 1964 OE2 GLU A 129 2.438 0.439 -9.283 1.00 0.75 O ATOM 0 H GLU A 129 0.546 2.092 -4.948 1.00 0.40 H new ATOM 0 HA GLU A 129 -0.139 2.463 -7.803 1.00 0.41 H new ATOM 0 HB2 GLU A 129 -0.505 0.103 -5.935 1.00 0.53 H new ATOM 0 HB3 GLU A 129 -1.138 0.192 -7.566 1.00 0.53 H new ATOM 0 HG2 GLU A 129 1.806 0.323 -6.836 1.00 0.97 H new ATOM 0 HG3 GLU A 129 0.970 -1.114 -7.389 1.00 0.97 H new ATOM 1971 N ILE A 130 -2.388 3.337 -7.165 1.00 0.28 N ATOM 1972 CA ILE A 130 -3.706 3.850 -6.834 1.00 0.24 C ATOM 1973 C ILE A 130 -4.768 3.054 -7.580 1.00 0.25 C ATOM 1974 O ILE A 130 -4.912 3.188 -8.797 1.00 0.31 O ATOM 1975 CB ILE A 130 -3.830 5.349 -7.189 1.00 0.29 C ATOM 1976 CG1 ILE A 130 -2.717 6.146 -6.504 1.00 0.39 C ATOM 1977 CG2 ILE A 130 -5.199 5.884 -6.789 1.00 0.31 C ATOM 1978 CD1 ILE A 130 -2.702 7.615 -6.864 1.00 0.74 C ATOM 0 H ILE A 130 -2.007 3.688 -8.044 1.00 0.28 H new ATOM 0 HA ILE A 130 -3.853 3.743 -5.759 1.00 0.24 H new ATOM 0 HB ILE A 130 -3.725 5.462 -8.268 1.00 0.29 H new ATOM 0 HG12 ILE A 130 -2.826 6.048 -5.424 1.00 0.39 H new ATOM 0 HG13 ILE A 130 -1.755 5.708 -6.768 1.00 0.39 H new ATOM 0 HG21 ILE A 130 -5.266 6.941 -7.047 1.00 0.31 H new ATOM 0 HG22 ILE A 130 -5.975 5.331 -7.319 1.00 0.31 H new ATOM 0 HG23 ILE A 130 -5.337 5.764 -5.714 1.00 0.31 H new ATOM 0 HD11 ILE A 130 -1.885 8.110 -6.339 1.00 0.74 H new ATOM 0 HD12 ILE A 130 -2.561 7.725 -7.939 1.00 0.74 H new ATOM 0 HD13 ILE A 130 -3.649 8.070 -6.574 1.00 0.74 H new ATOM 1990 N ILE A 131 -5.499 2.224 -6.854 1.00 0.24 N ATOM 1991 CA ILE A 131 -6.445 1.302 -7.468 1.00 0.28 C ATOM 1992 C ILE A 131 -7.875 1.618 -7.038 1.00 0.25 C ATOM 1993 O ILE A 131 -8.282 1.289 -5.922 1.00 0.26 O ATOM 1994 CB ILE A 131 -6.125 -0.166 -7.093 1.00 0.35 C ATOM 1995 CG1 ILE A 131 -4.658 -0.504 -7.393 1.00 0.40 C ATOM 1996 CG2 ILE A 131 -7.056 -1.123 -7.831 1.00 0.40 C ATOM 1997 CD1 ILE A 131 -4.275 -0.359 -8.852 1.00 1.25 C ATOM 0 H ILE A 131 -5.456 2.169 -5.836 1.00 0.24 H new ATOM 0 HA ILE A 131 -6.353 1.425 -8.547 1.00 0.28 H new ATOM 0 HB ILE A 131 -6.286 -0.283 -6.021 1.00 0.35 H new ATOM 0 HG12 ILE A 131 -4.017 0.144 -6.794 1.00 0.40 H new ATOM 0 HG13 ILE A 131 -4.460 -1.528 -7.077 1.00 0.40 H new ATOM 0 HG21 ILE A 131 -6.816 -2.150 -7.555 1.00 0.40 H new ATOM 0 HG22 ILE A 131 -8.089 -0.907 -7.560 1.00 0.40 H new ATOM 0 HG23 ILE A 131 -6.929 -0.997 -8.906 1.00 0.40 H new ATOM 0 HD11 ILE A 131 -3.223 -0.616 -8.979 1.00 1.25 H new ATOM 0 HD12 ILE A 131 -4.888 -1.027 -9.457 1.00 1.25 H new ATOM 0 HD13 ILE A 131 -4.438 0.671 -9.170 1.00 1.25 H new ATOM 2009 N PRO A 132 -8.644 2.295 -7.900 1.00 0.24 N ATOM 2010 CA PRO A 132 -10.059 2.548 -7.665 1.00 0.23 C ATOM 2011 C PRO A 132 -10.917 1.344 -8.048 1.00 0.23 C ATOM 2012 O PRO A 132 -10.892 0.890 -9.194 1.00 0.25 O ATOM 2013 CB PRO A 132 -10.375 3.745 -8.577 1.00 0.26 C ATOM 2014 CG PRO A 132 -9.079 4.120 -9.229 1.00 0.29 C ATOM 2015 CD PRO A 132 -8.204 2.903 -9.155 1.00 0.28 C ATOM 0 HA PRO A 132 -10.273 2.740 -6.614 1.00 0.23 H new ATOM 0 HB2 PRO A 132 -11.125 3.480 -9.323 1.00 0.26 H new ATOM 0 HB3 PRO A 132 -10.778 4.578 -8.002 1.00 0.26 H new ATOM 0 HG2 PRO A 132 -9.238 4.423 -10.264 1.00 0.29 H new ATOM 0 HG3 PRO A 132 -8.616 4.964 -8.717 1.00 0.29 H new ATOM 0 HD2 PRO A 132 -8.354 2.239 -10.006 1.00 0.28 H new ATOM 0 HD3 PRO A 132 -7.145 3.161 -9.135 1.00 0.28 H new ATOM 2023 N ILE A 133 -11.664 0.831 -7.086 1.00 0.21 N ATOM 2024 CA ILE A 133 -12.540 -0.304 -7.316 1.00 0.21 C ATOM 2025 C ILE A 133 -13.989 0.154 -7.242 1.00 0.19 C ATOM 2026 O ILE A 133 -14.289 1.190 -6.648 1.00 0.26 O ATOM 2027 CB ILE A 133 -12.313 -1.438 -6.279 1.00 0.23 C ATOM 2028 CG1 ILE A 133 -13.181 -1.232 -5.035 1.00 0.25 C ATOM 2029 CG2 ILE A 133 -10.851 -1.507 -5.872 1.00 0.26 C ATOM 2030 CD1 ILE A 133 -12.976 -2.290 -3.974 1.00 0.27 C ATOM 0 H ILE A 133 -11.681 1.186 -6.130 1.00 0.21 H new ATOM 0 HA ILE A 133 -12.311 -0.702 -8.304 1.00 0.21 H new ATOM 0 HB ILE A 133 -12.599 -2.377 -6.752 1.00 0.23 H new ATOM 0 HG12 ILE A 133 -12.963 -0.253 -4.608 1.00 0.25 H new ATOM 0 HG13 ILE A 133 -14.230 -1.224 -5.331 1.00 0.25 H new ATOM 0 HG21 ILE A 133 -10.713 -2.308 -5.145 1.00 0.26 H new ATOM 0 HG22 ILE A 133 -10.238 -1.705 -6.751 1.00 0.26 H new ATOM 0 HG23 ILE A 133 -10.552 -0.558 -5.427 1.00 0.26 H new ATOM 0 HD11 ILE A 133 -13.623 -2.081 -3.122 1.00 0.27 H new ATOM 0 HD12 ILE A 133 -13.222 -3.269 -4.384 1.00 0.27 H new ATOM 0 HD13 ILE A 133 -11.935 -2.283 -3.650 1.00 0.27 H new ATOM 2042 N SER A 134 -14.882 -0.610 -7.837 1.00 0.19 N ATOM 2043 CA SER A 134 -16.293 -0.288 -7.800 1.00 0.21 C ATOM 2044 C SER A 134 -17.101 -1.458 -7.244 1.00 0.22 C ATOM 2045 O SER A 134 -17.264 -2.488 -7.903 1.00 0.25 O ATOM 2046 CB SER A 134 -16.770 0.104 -9.201 1.00 0.26 C ATOM 2047 OG SER A 134 -16.226 -0.761 -10.190 1.00 1.24 O ATOM 0 H SER A 134 -14.655 -1.460 -8.353 1.00 0.19 H new ATOM 0 HA SER A 134 -16.448 0.560 -7.133 1.00 0.21 H new ATOM 0 HB2 SER A 134 -17.859 0.067 -9.241 1.00 0.26 H new ATOM 0 HB3 SER A 134 -16.478 1.132 -9.413 1.00 0.26 H new ATOM 0 HG SER A 134 -16.548 -0.489 -11.075 1.00 1.24 H new ATOM 2053 N ILE A 135 -17.583 -1.308 -6.019 1.00 0.23 N ATOM 2054 CA ILE A 135 -18.393 -2.344 -5.390 1.00 0.25 C ATOM 2055 C ILE A 135 -19.860 -1.944 -5.407 1.00 0.29 C ATOM 2056 O ILE A 135 -20.209 -0.866 -4.927 1.00 0.34 O ATOM 2057 CB ILE A 135 -17.981 -2.610 -3.925 1.00 0.26 C ATOM 2058 CG1 ILE A 135 -16.503 -2.967 -3.835 1.00 0.28 C ATOM 2059 CG2 ILE A 135 -18.828 -3.725 -3.322 1.00 0.30 C ATOM 2060 CD1 ILE A 135 -16.060 -3.348 -2.439 1.00 0.32 C ATOM 0 H ILE A 135 -17.429 -0.482 -5.441 1.00 0.23 H new ATOM 0 HA ILE A 135 -18.231 -3.256 -5.965 1.00 0.25 H new ATOM 0 HB ILE A 135 -18.152 -1.696 -3.356 1.00 0.26 H new ATOM 0 HG12 ILE A 135 -16.295 -3.795 -4.513 1.00 0.28 H new ATOM 0 HG13 ILE A 135 -15.911 -2.118 -4.177 1.00 0.28 H new ATOM 0 HG21 ILE A 135 -18.522 -3.897 -2.290 1.00 0.30 H new ATOM 0 HG22 ILE A 135 -19.879 -3.437 -3.346 1.00 0.30 H new ATOM 0 HG23 ILE A 135 -18.689 -4.640 -3.899 1.00 0.30 H new ATOM 0 HD11 ILE A 135 -14.997 -3.590 -2.448 1.00 0.32 H new ATOM 0 HD12 ILE A 135 -16.236 -2.513 -1.761 1.00 0.32 H new ATOM 0 HD13 ILE A 135 -16.627 -4.216 -2.101 1.00 0.32 H new ATOM 2072 N LYS A 136 -20.697 -2.800 -5.976 1.00 0.31 N ATOM 2073 CA LYS A 136 -22.144 -2.609 -5.975 1.00 0.37 C ATOM 2074 C LYS A 136 -22.853 -3.950 -6.029 1.00 0.40 C ATOM 2075 O LYS A 136 -22.424 -4.851 -6.749 1.00 0.42 O ATOM 2076 CB LYS A 136 -22.588 -1.723 -7.141 1.00 0.46 C ATOM 2077 CG LYS A 136 -22.480 -0.244 -6.824 1.00 0.66 C ATOM 2078 CD LYS A 136 -23.456 0.151 -5.726 1.00 1.28 C ATOM 2079 CE LYS A 136 -23.239 1.576 -5.247 1.00 1.51 C ATOM 2080 NZ LYS A 136 -24.264 1.977 -4.248 1.00 1.95 N ATOM 0 H LYS A 136 -20.393 -3.649 -6.453 1.00 0.31 H new ATOM 0 HA LYS A 136 -22.416 -2.104 -5.048 1.00 0.37 H new ATOM 0 HB2 LYS A 136 -21.979 -1.949 -8.016 1.00 0.46 H new ATOM 0 HB3 LYS A 136 -23.620 -1.961 -7.401 1.00 0.46 H new ATOM 0 HG2 LYS A 136 -21.462 -0.009 -6.513 1.00 0.66 H new ATOM 0 HG3 LYS A 136 -22.682 0.340 -7.722 1.00 0.66 H new ATOM 0 HD2 LYS A 136 -24.476 0.045 -6.095 1.00 1.28 H new ATOM 0 HD3 LYS A 136 -23.349 -0.533 -4.884 1.00 1.28 H new ATOM 0 HE2 LYS A 136 -22.246 1.666 -4.807 1.00 1.51 H new ATOM 0 HE3 LYS A 136 -23.273 2.256 -6.098 1.00 1.51 H new ATOM 0 HZ1 LYS A 136 -24.087 2.955 -3.942 1.00 1.95 H new ATOM 0 HZ2 LYS A 136 -25.210 1.914 -4.677 1.00 1.95 H new ATOM 0 HZ3 LYS A 136 -24.214 1.342 -3.426 1.00 1.95 H new ATOM 2094 N LYS A 137 -23.921 -4.077 -5.245 1.00 0.46 N ATOM 2095 CA LYS A 137 -24.696 -5.315 -5.161 1.00 0.54 C ATOM 2096 C LYS A 137 -23.834 -6.448 -4.625 1.00 0.48 C ATOM 2097 O LYS A 137 -24.016 -7.615 -4.975 1.00 0.54 O ATOM 2098 CB LYS A 137 -25.300 -5.680 -6.520 1.00 0.65 C ATOM 2099 CG LYS A 137 -26.354 -4.702 -6.981 1.00 0.81 C ATOM 2100 CD LYS A 137 -27.518 -4.682 -6.013 1.00 1.53 C ATOM 2101 CE LYS A 137 -28.352 -3.437 -6.190 1.00 2.40 C ATOM 2102 NZ LYS A 137 -29.462 -3.364 -5.203 1.00 3.13 N ATOM 0 H LYS A 137 -24.274 -3.327 -4.651 1.00 0.46 H new ATOM 0 HA LYS A 137 -25.520 -5.154 -4.466 1.00 0.54 H new ATOM 0 HB2 LYS A 137 -24.505 -5.726 -7.264 1.00 0.65 H new ATOM 0 HB3 LYS A 137 -25.738 -6.676 -6.460 1.00 0.65 H new ATOM 0 HG2 LYS A 137 -25.923 -3.704 -7.061 1.00 0.81 H new ATOM 0 HG3 LYS A 137 -26.705 -4.978 -7.975 1.00 0.81 H new ATOM 0 HD2 LYS A 137 -28.139 -5.564 -6.168 1.00 1.53 H new ATOM 0 HD3 LYS A 137 -27.145 -4.731 -4.990 1.00 1.53 H new ATOM 0 HE2 LYS A 137 -27.717 -2.557 -6.086 1.00 2.40 H new ATOM 0 HE3 LYS A 137 -28.763 -3.416 -7.199 1.00 2.40 H new ATOM 0 HZ1 LYS A 137 -30.009 -2.494 -5.360 1.00 3.13 H new ATOM 0 HZ2 LYS A 137 -30.084 -4.190 -5.318 1.00 3.13 H new ATOM 0 HZ3 LYS A 137 -29.070 -3.357 -4.240 1.00 3.13 H new ATOM 2116 N GLY A 138 -22.893 -6.079 -3.768 1.00 0.41 N ATOM 2117 CA GLY A 138 -21.982 -7.046 -3.187 1.00 0.40 C ATOM 2118 C GLY A 138 -21.002 -7.585 -4.209 1.00 0.37 C ATOM 2119 O GLY A 138 -20.444 -8.668 -4.041 1.00 0.39 O ATOM 0 H GLY A 138 -22.743 -5.118 -3.462 1.00 0.41 H new ATOM 0 HA2 GLY A 138 -21.433 -6.581 -2.368 1.00 0.40 H new ATOM 0 HA3 GLY A 138 -22.552 -7.871 -2.761 1.00 0.40 H new ATOM 2123 N LYS A 139 -20.799 -6.831 -5.278 1.00 0.37 N ATOM 2124 CA LYS A 139 -19.889 -7.234 -6.336 1.00 0.36 C ATOM 2125 C LYS A 139 -18.764 -6.220 -6.469 1.00 0.32 C ATOM 2126 O LYS A 139 -18.997 -5.016 -6.424 1.00 0.40 O ATOM 2127 CB LYS A 139 -20.643 -7.382 -7.654 1.00 0.44 C ATOM 2128 CG LYS A 139 -21.697 -8.479 -7.628 1.00 0.87 C ATOM 2129 CD LYS A 139 -22.580 -8.444 -8.864 1.00 1.14 C ATOM 2130 CE LYS A 139 -21.766 -8.566 -10.140 1.00 1.64 C ATOM 2131 NZ LYS A 139 -22.636 -8.676 -11.337 1.00 2.23 N ATOM 0 H LYS A 139 -21.255 -5.932 -5.435 1.00 0.37 H new ATOM 0 HA LYS A 139 -19.455 -8.201 -6.082 1.00 0.36 H new ATOM 0 HB2 LYS A 139 -21.122 -6.434 -7.898 1.00 0.44 H new ATOM 0 HB3 LYS A 139 -19.929 -7.593 -8.450 1.00 0.44 H new ATOM 0 HG2 LYS A 139 -21.208 -9.451 -7.558 1.00 0.87 H new ATOM 0 HG3 LYS A 139 -22.315 -8.368 -6.737 1.00 0.87 H new ATOM 0 HD2 LYS A 139 -23.305 -9.256 -8.816 1.00 1.14 H new ATOM 0 HD3 LYS A 139 -23.145 -7.512 -8.881 1.00 1.14 H new ATOM 0 HE2 LYS A 139 -21.116 -7.697 -10.241 1.00 1.64 H new ATOM 0 HE3 LYS A 139 -21.120 -9.442 -10.078 1.00 1.64 H new ATOM 0 HZ1 LYS A 139 -22.045 -8.758 -12.189 1.00 2.23 H new ATOM 0 HZ2 LYS A 139 -23.239 -9.519 -11.252 1.00 2.23 H new ATOM 0 HZ3 LYS A 139 -23.234 -7.828 -11.410 1.00 2.23 H new ATOM 2145 N LEU A 140 -17.552 -6.714 -6.640 1.00 0.33 N ATOM 2146 CA LEU A 140 -16.369 -5.873 -6.640 1.00 0.30 C ATOM 2147 C LEU A 140 -15.730 -5.879 -8.029 1.00 0.31 C ATOM 2148 O LEU A 140 -15.286 -6.922 -8.515 1.00 0.41 O ATOM 2149 CB LEU A 140 -15.386 -6.394 -5.574 1.00 0.32 C ATOM 2150 CG LEU A 140 -14.227 -5.469 -5.194 1.00 0.32 C ATOM 2151 CD1 LEU A 140 -13.653 -5.881 -3.848 1.00 0.39 C ATOM 2152 CD2 LEU A 140 -13.136 -5.507 -6.246 1.00 0.37 C ATOM 0 H LEU A 140 -17.360 -7.706 -6.782 1.00 0.33 H new ATOM 0 HA LEU A 140 -16.638 -4.845 -6.398 1.00 0.30 H new ATOM 0 HB2 LEU A 140 -15.952 -6.618 -4.670 1.00 0.32 H new ATOM 0 HB3 LEU A 140 -14.967 -7.335 -5.929 1.00 0.32 H new ATOM 0 HG LEU A 140 -14.611 -4.451 -5.130 1.00 0.32 H new ATOM 0 HD11 LEU A 140 -12.829 -5.218 -3.585 1.00 0.39 H new ATOM 0 HD12 LEU A 140 -14.429 -5.815 -3.086 1.00 0.39 H new ATOM 0 HD13 LEU A 140 -13.289 -6.907 -3.906 1.00 0.39 H new ATOM 0 HD21 LEU A 140 -12.324 -4.841 -5.952 1.00 0.37 H new ATOM 0 HD22 LEU A 140 -12.756 -6.524 -6.339 1.00 0.37 H new ATOM 0 HD23 LEU A 140 -13.543 -5.183 -7.204 1.00 0.37 H new ATOM 2164 N SER A 141 -15.702 -4.721 -8.669 1.00 0.28 N ATOM 2165 CA SER A 141 -15.099 -4.589 -9.984 1.00 0.31 C ATOM 2166 C SER A 141 -13.825 -3.751 -9.903 1.00 0.28 C ATOM 2167 O SER A 141 -13.805 -2.697 -9.273 1.00 0.36 O ATOM 2168 CB SER A 141 -16.097 -3.952 -10.959 1.00 0.39 C ATOM 2169 OG SER A 141 -15.556 -3.858 -12.267 1.00 1.19 O ATOM 0 H SER A 141 -16.092 -3.855 -8.296 1.00 0.28 H new ATOM 0 HA SER A 141 -14.836 -5.581 -10.351 1.00 0.31 H new ATOM 0 HB2 SER A 141 -17.012 -4.544 -10.984 1.00 0.39 H new ATOM 0 HB3 SER A 141 -16.370 -2.958 -10.605 1.00 0.39 H new ATOM 0 HG SER A 141 -16.216 -3.450 -12.865 1.00 1.19 H new ATOM 2175 N VAL A 142 -12.763 -4.236 -10.528 1.00 0.33 N ATOM 2176 CA VAL A 142 -11.497 -3.517 -10.573 1.00 0.35 C ATOM 2177 C VAL A 142 -11.038 -3.346 -12.018 1.00 0.43 C ATOM 2178 O VAL A 142 -10.575 -4.304 -12.643 1.00 0.48 O ATOM 2179 CB VAL A 142 -10.392 -4.243 -9.770 1.00 0.35 C ATOM 2180 CG1 VAL A 142 -9.058 -3.535 -9.931 1.00 0.92 C ATOM 2181 CG2 VAL A 142 -10.760 -4.328 -8.301 1.00 0.83 C ATOM 0 H VAL A 142 -12.753 -5.132 -11.015 1.00 0.33 H new ATOM 0 HA VAL A 142 -11.665 -2.541 -10.118 1.00 0.35 H new ATOM 0 HB VAL A 142 -10.302 -5.255 -10.165 1.00 0.35 H new ATOM 0 HG11 VAL A 142 -8.295 -4.062 -9.358 1.00 0.92 H new ATOM 0 HG12 VAL A 142 -8.777 -3.523 -10.984 1.00 0.92 H new ATOM 0 HG13 VAL A 142 -9.143 -2.511 -9.566 1.00 0.92 H new ATOM 0 HG21 VAL A 142 -9.968 -4.842 -7.757 1.00 0.83 H new ATOM 0 HG22 VAL A 142 -10.883 -3.323 -7.898 1.00 0.83 H new ATOM 0 HG23 VAL A 142 -11.693 -4.880 -8.191 1.00 0.83 H new ATOM 2191 N GLN A 143 -11.202 -2.131 -12.542 1.00 0.56 N ATOM 2192 CA GLN A 143 -10.781 -1.782 -13.902 1.00 0.70 C ATOM 2193 C GLN A 143 -11.434 -2.682 -14.953 1.00 0.82 C ATOM 2194 O GLN A 143 -12.539 -2.401 -15.422 1.00 1.45 O ATOM 2195 CB GLN A 143 -9.250 -1.818 -14.045 1.00 0.74 C ATOM 2196 CG GLN A 143 -8.542 -0.545 -13.595 1.00 0.83 C ATOM 2197 CD GLN A 143 -8.684 -0.267 -12.110 1.00 1.15 C ATOM 2198 OE1 GLN A 143 -7.873 -0.715 -11.304 1.00 1.88 O ATOM 2199 NE2 GLN A 143 -9.702 0.494 -11.744 1.00 1.11 N ATOM 0 H GLN A 143 -11.632 -1.358 -12.035 1.00 0.56 H new ATOM 0 HA GLN A 143 -11.119 -0.761 -14.080 1.00 0.70 H new ATOM 0 HB2 GLN A 143 -8.864 -2.657 -13.467 1.00 0.74 H new ATOM 0 HB3 GLN A 143 -9.000 -2.008 -15.089 1.00 0.74 H new ATOM 0 HG2 GLN A 143 -7.483 -0.620 -13.843 1.00 0.83 H new ATOM 0 HG3 GLN A 143 -8.941 0.301 -14.155 1.00 0.83 H new ATOM 0 HE21 GLN A 143 -10.354 0.846 -12.445 1.00 1.11 H new ATOM 0 HE22 GLN A 143 -9.836 0.729 -10.760 1.00 1.11 H new ATOM 2208 N GLY A 144 -10.764 -3.777 -15.292 1.00 0.86 N ATOM 2209 CA GLY A 144 -11.244 -4.645 -16.348 1.00 0.96 C ATOM 2210 C GLY A 144 -11.666 -6.011 -15.843 1.00 0.85 C ATOM 2211 O GLY A 144 -11.831 -6.944 -16.632 1.00 1.02 O ATOM 0 H GLY A 144 -9.895 -4.079 -14.852 1.00 0.86 H new ATOM 0 HA2 GLY A 144 -12.090 -4.170 -16.846 1.00 0.96 H new ATOM 0 HA3 GLY A 144 -10.461 -4.766 -17.096 1.00 0.96 H new ATOM 2215 N GLU A 145 -11.830 -6.141 -14.536 1.00 0.66 N ATOM 2216 CA GLU A 145 -12.293 -7.392 -13.950 1.00 0.65 C ATOM 2217 C GLU A 145 -13.463 -7.158 -13.008 1.00 0.52 C ATOM 2218 O GLU A 145 -13.318 -6.493 -11.986 1.00 0.55 O ATOM 2219 CB GLU A 145 -11.177 -8.088 -13.174 1.00 0.74 C ATOM 2220 CG GLU A 145 -10.041 -8.604 -14.032 1.00 1.06 C ATOM 2221 CD GLU A 145 -9.258 -9.681 -13.319 1.00 1.35 C ATOM 2222 OE1 GLU A 145 -8.559 -9.354 -12.337 1.00 1.95 O ATOM 2223 OE2 GLU A 145 -9.295 -10.842 -13.771 1.00 1.84 O ATOM 0 H GLU A 145 -11.650 -5.398 -13.861 1.00 0.66 H new ATOM 0 HA GLU A 145 -12.611 -8.027 -14.777 1.00 0.65 H new ATOM 0 HB2 GLU A 145 -10.773 -7.391 -12.440 1.00 0.74 H new ATOM 0 HB3 GLU A 145 -11.604 -8.923 -12.619 1.00 0.74 H new ATOM 0 HG2 GLU A 145 -10.439 -9.000 -14.966 1.00 1.06 H new ATOM 0 HG3 GLU A 145 -9.376 -7.780 -14.292 1.00 1.06 H new ATOM 2230 N VAL A 146 -14.613 -7.708 -13.345 1.00 0.59 N ATOM 2231 CA VAL A 146 -15.766 -7.641 -12.464 1.00 0.54 C ATOM 2232 C VAL A 146 -15.992 -8.995 -11.798 1.00 0.53 C ATOM 2233 O VAL A 146 -15.990 -10.036 -12.457 1.00 0.67 O ATOM 2234 CB VAL A 146 -17.041 -7.186 -13.217 1.00 0.64 C ATOM 2235 CG1 VAL A 146 -17.345 -8.103 -14.395 1.00 0.92 C ATOM 2236 CG2 VAL A 146 -18.234 -7.110 -12.273 1.00 0.92 C ATOM 0 H VAL A 146 -14.775 -8.206 -14.220 1.00 0.59 H new ATOM 0 HA VAL A 146 -15.559 -6.894 -11.698 1.00 0.54 H new ATOM 0 HB VAL A 146 -16.852 -6.187 -13.610 1.00 0.64 H new ATOM 0 HG11 VAL A 146 -18.245 -7.757 -14.903 1.00 0.92 H new ATOM 0 HG12 VAL A 146 -16.507 -8.089 -15.092 1.00 0.92 H new ATOM 0 HG13 VAL A 146 -17.500 -9.120 -14.034 1.00 0.92 H new ATOM 0 HG21 VAL A 146 -19.116 -6.788 -12.827 1.00 0.92 H new ATOM 0 HG22 VAL A 146 -18.417 -8.093 -11.838 1.00 0.92 H new ATOM 0 HG23 VAL A 146 -18.024 -6.395 -11.478 1.00 0.92 H new ATOM 2246 N SER A 147 -16.139 -8.985 -10.483 1.00 0.47 N ATOM 2247 CA SER A 147 -16.349 -10.206 -9.726 1.00 0.47 C ATOM 2248 C SER A 147 -17.302 -9.933 -8.573 1.00 0.48 C ATOM 2249 O SER A 147 -17.801 -8.820 -8.428 1.00 0.79 O ATOM 2250 CB SER A 147 -15.016 -10.720 -9.182 1.00 0.54 C ATOM 2251 OG SER A 147 -14.050 -10.834 -10.211 1.00 1.27 O ATOM 0 H SER A 147 -16.116 -8.138 -9.915 1.00 0.47 H new ATOM 0 HA SER A 147 -16.780 -10.963 -10.381 1.00 0.47 H new ATOM 0 HB2 SER A 147 -14.650 -10.043 -8.410 1.00 0.54 H new ATOM 0 HB3 SER A 147 -15.164 -11.691 -8.710 1.00 0.54 H new ATOM 0 HG SER A 147 -13.337 -11.442 -9.925 1.00 1.27 H new ATOM 2257 N THR A 148 -17.557 -10.939 -7.758 1.00 0.41 N ATOM 2258 CA THR A 148 -18.374 -10.755 -6.578 1.00 0.40 C ATOM 2259 C THR A 148 -17.493 -10.566 -5.350 1.00 0.39 C ATOM 2260 O THR A 148 -16.478 -11.245 -5.193 1.00 0.46 O ATOM 2261 CB THR A 148 -19.313 -11.950 -6.360 1.00 0.46 C ATOM 2262 OG1 THR A 148 -18.560 -13.170 -6.351 1.00 1.45 O ATOM 2263 CG2 THR A 148 -20.370 -12.011 -7.449 1.00 1.28 C ATOM 0 H THR A 148 -17.210 -11.889 -7.892 1.00 0.41 H new ATOM 0 HA THR A 148 -18.981 -9.862 -6.730 1.00 0.40 H new ATOM 0 HB THR A 148 -19.810 -11.823 -5.398 1.00 0.46 H new ATOM 0 HG1 THR A 148 -19.166 -13.927 -6.210 1.00 1.45 H new ATOM 0 HG21 THR A 148 -21.024 -12.865 -7.274 1.00 1.28 H new ATOM 0 HG22 THR A 148 -20.959 -11.094 -7.436 1.00 1.28 H new ATOM 0 HG23 THR A 148 -19.886 -12.117 -8.420 1.00 1.28 H new ATOM 2271 N PHE A 149 -17.888 -9.643 -4.490 1.00 0.35 N ATOM 2272 CA PHE A 149 -17.137 -9.341 -3.283 1.00 0.32 C ATOM 2273 C PHE A 149 -17.432 -10.384 -2.212 1.00 0.35 C ATOM 2274 O PHE A 149 -18.584 -10.760 -2.005 1.00 0.43 O ATOM 2275 CB PHE A 149 -17.503 -7.937 -2.788 1.00 0.30 C ATOM 2276 CG PHE A 149 -17.010 -7.628 -1.405 1.00 0.30 C ATOM 2277 CD1 PHE A 149 -15.692 -7.266 -1.186 1.00 0.34 C ATOM 2278 CD2 PHE A 149 -17.869 -7.710 -0.320 1.00 0.38 C ATOM 2279 CE1 PHE A 149 -15.243 -6.990 0.087 1.00 0.42 C ATOM 2280 CE2 PHE A 149 -17.424 -7.438 0.952 1.00 0.46 C ATOM 2281 CZ PHE A 149 -16.111 -7.077 1.156 1.00 0.47 C ATOM 0 H PHE A 149 -18.733 -9.084 -4.607 1.00 0.35 H new ATOM 0 HA PHE A 149 -16.070 -9.367 -3.503 1.00 0.32 H new ATOM 0 HB2 PHE A 149 -17.095 -7.201 -3.481 1.00 0.30 H new ATOM 0 HB3 PHE A 149 -18.587 -7.827 -2.809 1.00 0.30 H new ATOM 0 HD1 PHE A 149 -15.010 -7.199 -2.020 1.00 0.34 H new ATOM 0 HD2 PHE A 149 -18.900 -7.991 -0.476 1.00 0.38 H new ATOM 0 HE1 PHE A 149 -14.213 -6.706 0.248 1.00 0.42 H new ATOM 0 HE2 PHE A 149 -18.103 -7.507 1.789 1.00 0.46 H new ATOM 0 HZ PHE A 149 -15.760 -6.862 2.154 1.00 0.47 H new ATOM 2291 N THR A 150 -16.393 -10.858 -1.541 1.00 0.37 N ATOM 2292 CA THR A 150 -16.566 -11.891 -0.535 1.00 0.48 C ATOM 2293 C THR A 150 -15.833 -11.551 0.767 1.00 0.43 C ATOM 2294 O THR A 150 -14.610 -11.675 0.870 1.00 0.82 O ATOM 2295 CB THR A 150 -16.119 -13.277 -1.067 1.00 0.78 C ATOM 2296 OG1 THR A 150 -16.196 -14.252 -0.024 1.00 1.79 O ATOM 2297 CG2 THR A 150 -14.708 -13.237 -1.639 1.00 1.25 C ATOM 0 H THR A 150 -15.431 -10.547 -1.674 1.00 0.37 H new ATOM 0 HA THR A 150 -17.632 -11.938 -0.311 1.00 0.48 H new ATOM 0 HB THR A 150 -16.796 -13.553 -1.875 1.00 0.78 H new ATOM 0 HG1 THR A 150 -15.913 -15.124 -0.370 1.00 1.79 H new ATOM 0 HG21 THR A 150 -14.434 -14.228 -2.001 1.00 1.25 H new ATOM 0 HG22 THR A 150 -14.670 -12.526 -2.464 1.00 1.25 H new ATOM 0 HG23 THR A 150 -14.009 -12.928 -0.862 1.00 1.25 H new ATOM 2305 N GLY A 151 -16.600 -11.097 1.751 1.00 0.42 N ATOM 2306 CA GLY A 151 -16.071 -10.863 3.082 1.00 0.37 C ATOM 2307 C GLY A 151 -15.289 -9.579 3.206 1.00 0.32 C ATOM 2308 O GLY A 151 -15.727 -8.642 3.879 1.00 0.34 O ATOM 0 H GLY A 151 -17.592 -10.884 1.648 1.00 0.42 H new ATOM 0 HA2 GLY A 151 -16.896 -10.846 3.794 1.00 0.37 H new ATOM 0 HA3 GLY A 151 -15.428 -11.698 3.360 1.00 0.37 H new ATOM 2312 N LYS A 152 -14.137 -9.524 2.565 1.00 0.29 N ATOM 2313 CA LYS A 152 -13.281 -8.358 2.656 1.00 0.28 C ATOM 2314 C LYS A 152 -12.327 -8.306 1.474 1.00 0.27 C ATOM 2315 O LYS A 152 -12.181 -9.281 0.737 1.00 0.33 O ATOM 2316 CB LYS A 152 -12.506 -8.352 3.986 1.00 0.36 C ATOM 2317 CG LYS A 152 -11.228 -9.177 4.000 1.00 0.44 C ATOM 2318 CD LYS A 152 -11.502 -10.671 4.004 1.00 0.62 C ATOM 2319 CE LYS A 152 -10.208 -11.466 3.997 1.00 0.77 C ATOM 2320 NZ LYS A 152 -10.442 -12.910 4.243 1.00 1.23 N ATOM 0 H LYS A 152 -13.773 -10.273 1.976 1.00 0.29 H new ATOM 0 HA LYS A 152 -13.909 -7.468 2.629 1.00 0.28 H new ATOM 0 HB2 LYS A 152 -12.256 -7.321 4.236 1.00 0.36 H new ATOM 0 HB3 LYS A 152 -13.165 -8.720 4.773 1.00 0.36 H new ATOM 0 HG2 LYS A 152 -10.626 -8.923 3.128 1.00 0.44 H new ATOM 0 HG3 LYS A 152 -10.640 -8.916 4.880 1.00 0.44 H new ATOM 0 HD2 LYS A 152 -12.089 -10.934 4.884 1.00 0.62 H new ATOM 0 HD3 LYS A 152 -12.100 -10.936 3.132 1.00 0.62 H new ATOM 0 HE2 LYS A 152 -9.709 -11.338 3.036 1.00 0.77 H new ATOM 0 HE3 LYS A 152 -9.536 -11.072 4.760 1.00 0.77 H new ATOM 0 HZ1 LYS A 152 -9.534 -13.416 4.230 1.00 1.23 H new ATOM 0 HZ2 LYS A 152 -10.895 -13.035 5.171 1.00 1.23 H new ATOM 0 HZ3 LYS A 152 -11.062 -13.293 3.501 1.00 1.23 H new ATOM 2334 N LEU A 153 -11.687 -7.163 1.304 1.00 0.23 N ATOM 2335 CA LEU A 153 -10.747 -6.964 0.210 1.00 0.24 C ATOM 2336 C LEU A 153 -9.414 -7.581 0.600 1.00 0.26 C ATOM 2337 O LEU A 153 -8.897 -7.305 1.675 1.00 0.44 O ATOM 2338 CB LEU A 153 -10.602 -5.468 -0.104 1.00 0.26 C ATOM 2339 CG LEU A 153 -10.006 -5.119 -1.477 1.00 0.35 C ATOM 2340 CD1 LEU A 153 -10.319 -3.674 -1.833 1.00 1.17 C ATOM 2341 CD2 LEU A 153 -8.502 -5.337 -1.497 1.00 1.16 C ATOM 0 H LEU A 153 -11.801 -6.352 1.913 1.00 0.23 H new ATOM 0 HA LEU A 153 -11.114 -7.450 -0.694 1.00 0.24 H new ATOM 0 HB2 LEU A 153 -11.586 -5.005 -0.030 1.00 0.26 H new ATOM 0 HB3 LEU A 153 -9.978 -5.015 0.666 1.00 0.26 H new ATOM 0 HG LEU A 153 -10.458 -5.781 -2.215 1.00 0.35 H new ATOM 0 HD11 LEU A 153 -9.892 -3.439 -2.808 1.00 1.17 H new ATOM 0 HD12 LEU A 153 -11.399 -3.533 -1.867 1.00 1.17 H new ATOM 0 HD13 LEU A 153 -9.891 -3.013 -1.080 1.00 1.17 H new ATOM 0 HD21 LEU A 153 -8.110 -5.081 -2.482 1.00 1.16 H new ATOM 0 HD22 LEU A 153 -8.033 -4.704 -0.744 1.00 1.16 H new ATOM 0 HD23 LEU A 153 -8.283 -6.382 -1.280 1.00 1.16 H new ATOM 2353 N SER A 154 -8.868 -8.436 -0.245 1.00 0.24 N ATOM 2354 CA SER A 154 -7.688 -9.182 0.131 1.00 0.27 C ATOM 2355 C SER A 154 -6.461 -8.771 -0.676 1.00 0.30 C ATOM 2356 O SER A 154 -6.281 -9.193 -1.816 1.00 0.50 O ATOM 2357 CB SER A 154 -7.968 -10.672 -0.044 1.00 0.38 C ATOM 2358 OG SER A 154 -8.644 -10.938 -1.259 1.00 1.35 O ATOM 0 H SER A 154 -9.219 -8.628 -1.183 1.00 0.24 H new ATOM 0 HA SER A 154 -7.463 -8.962 1.174 1.00 0.27 H new ATOM 0 HB2 SER A 154 -7.028 -11.224 -0.022 1.00 0.38 H new ATOM 0 HB3 SER A 154 -8.568 -11.030 0.792 1.00 0.38 H new ATOM 0 HG SER A 154 -8.002 -11.255 -1.928 1.00 1.35 H new ATOM 2364 N VAL A 155 -5.587 -7.991 -0.070 1.00 0.26 N ATOM 2365 CA VAL A 155 -4.401 -7.529 -0.765 1.00 0.28 C ATOM 2366 C VAL A 155 -3.261 -8.490 -0.525 1.00 0.29 C ATOM 2367 O VAL A 155 -2.744 -8.589 0.584 1.00 0.38 O ATOM 2368 CB VAL A 155 -3.969 -6.119 -0.323 1.00 0.34 C ATOM 2369 CG1 VAL A 155 -2.701 -5.684 -1.050 1.00 0.42 C ATOM 2370 CG2 VAL A 155 -5.083 -5.126 -0.573 1.00 0.39 C ATOM 0 H VAL A 155 -5.674 -7.666 0.893 1.00 0.26 H new ATOM 0 HA VAL A 155 -4.650 -7.484 -1.825 1.00 0.28 H new ATOM 0 HB VAL A 155 -3.756 -6.148 0.746 1.00 0.34 H new ATOM 0 HG11 VAL A 155 -2.417 -4.685 -0.720 1.00 0.42 H new ATOM 0 HG12 VAL A 155 -1.895 -6.383 -0.826 1.00 0.42 H new ATOM 0 HG13 VAL A 155 -2.883 -5.673 -2.125 1.00 0.42 H new ATOM 0 HG21 VAL A 155 -4.764 -4.133 -0.256 1.00 0.39 H new ATOM 0 HG22 VAL A 155 -5.322 -5.108 -1.636 1.00 0.39 H new ATOM 0 HG23 VAL A 155 -5.967 -5.421 -0.007 1.00 0.39 H new ATOM 2380 N GLU A 156 -2.900 -9.214 -1.565 1.00 0.32 N ATOM 2381 CA GLU A 156 -1.822 -10.177 -1.488 1.00 0.40 C ATOM 2382 C GLU A 156 -0.741 -9.810 -2.482 1.00 0.36 C ATOM 2383 O GLU A 156 -0.973 -9.873 -3.691 1.00 0.42 O ATOM 2384 CB GLU A 156 -2.322 -11.583 -1.831 1.00 0.61 C ATOM 2385 CG GLU A 156 -3.475 -12.080 -0.975 1.00 0.73 C ATOM 2386 CD GLU A 156 -4.028 -13.395 -1.486 1.00 1.41 C ATOM 2387 OE1 GLU A 156 -4.724 -13.393 -2.524 1.00 1.98 O ATOM 2388 OE2 GLU A 156 -3.776 -14.438 -0.840 1.00 1.92 O ATOM 0 H GLU A 156 -3.343 -9.152 -2.482 1.00 0.32 H new ATOM 0 HA GLU A 156 -1.433 -10.166 -0.470 1.00 0.40 H new ATOM 0 HB2 GLU A 156 -2.632 -11.597 -2.876 1.00 0.61 H new ATOM 0 HB3 GLU A 156 -1.491 -12.282 -1.736 1.00 0.61 H new ATOM 0 HG2 GLU A 156 -3.137 -12.203 0.054 1.00 0.73 H new ATOM 0 HG3 GLU A 156 -4.268 -11.332 -0.963 1.00 0.73 H new ATOM 2395 N PHE A 157 0.423 -9.402 -2.013 1.00 0.41 N ATOM 2396 CA PHE A 157 1.546 -9.323 -2.922 1.00 0.43 C ATOM 2397 C PHE A 157 2.436 -10.542 -2.768 1.00 0.43 C ATOM 2398 O PHE A 157 3.044 -10.779 -1.723 1.00 0.51 O ATOM 2399 CB PHE A 157 2.331 -7.993 -2.891 1.00 0.55 C ATOM 2400 CG PHE A 157 2.545 -7.318 -1.569 1.00 0.88 C ATOM 2401 CD1 PHE A 157 1.472 -6.774 -0.888 1.00 1.46 C ATOM 2402 CD2 PHE A 157 3.794 -7.302 -0.975 1.00 1.19 C ATOM 2403 CE1 PHE A 157 1.643 -6.211 0.361 1.00 2.17 C ATOM 2404 CE2 PHE A 157 3.971 -6.751 0.277 1.00 1.85 C ATOM 2405 CZ PHE A 157 2.984 -5.941 0.798 1.00 2.32 C ATOM 0 H PHE A 157 0.611 -9.131 -1.048 1.00 0.41 H new ATOM 0 HA PHE A 157 1.120 -9.327 -3.925 1.00 0.43 H new ATOM 0 HB2 PHE A 157 3.311 -8.176 -3.332 1.00 0.55 H new ATOM 0 HB3 PHE A 157 1.815 -7.288 -3.543 1.00 0.55 H new ATOM 0 HD1 PHE A 157 0.490 -6.790 -1.337 1.00 1.46 H new ATOM 0 HD2 PHE A 157 4.639 -7.725 -1.497 1.00 1.19 H new ATOM 0 HE1 PHE A 157 0.795 -5.981 0.989 1.00 2.17 H new ATOM 0 HE2 PHE A 157 4.870 -6.951 0.841 1.00 1.85 H new ATOM 0 HZ PHE A 157 3.207 -5.148 1.496 1.00 2.32 H new ATOM 2415 N VAL A 158 2.468 -11.320 -3.843 1.00 0.44 N ATOM 2416 CA VAL A 158 3.063 -12.642 -3.855 1.00 0.48 C ATOM 2417 C VAL A 158 4.567 -12.557 -4.081 1.00 0.48 C ATOM 2418 O VAL A 158 5.051 -11.684 -4.813 1.00 0.47 O ATOM 2419 CB VAL A 158 2.422 -13.521 -4.948 1.00 0.52 C ATOM 2420 CG1 VAL A 158 2.887 -14.962 -4.830 1.00 0.62 C ATOM 2421 CG2 VAL A 158 0.905 -13.442 -4.875 1.00 0.59 C ATOM 0 H VAL A 158 2.074 -11.042 -4.742 1.00 0.44 H new ATOM 0 HA VAL A 158 2.878 -13.098 -2.882 1.00 0.48 H new ATOM 0 HB VAL A 158 2.742 -13.141 -5.918 1.00 0.52 H new ATOM 0 HG11 VAL A 158 2.420 -15.560 -5.612 1.00 0.62 H new ATOM 0 HG12 VAL A 158 3.971 -15.005 -4.939 1.00 0.62 H new ATOM 0 HG13 VAL A 158 2.604 -15.357 -3.854 1.00 0.62 H new ATOM 0 HG21 VAL A 158 0.470 -14.069 -5.654 1.00 0.59 H new ATOM 0 HG22 VAL A 158 0.569 -13.791 -3.899 1.00 0.59 H new ATOM 0 HG23 VAL A 158 0.587 -12.410 -5.020 1.00 0.59 H new ATOM 2431 N LYS A 159 5.289 -13.469 -3.428 1.00 0.58 N ATOM 2432 CA LYS A 159 6.745 -13.439 -3.386 1.00 0.66 C ATOM 2433 C LYS A 159 7.361 -13.610 -4.771 1.00 0.63 C ATOM 2434 O LYS A 159 6.970 -14.486 -5.547 1.00 0.77 O ATOM 2435 CB LYS A 159 7.271 -14.503 -2.406 1.00 0.93 C ATOM 2436 CG LYS A 159 7.342 -15.918 -2.963 1.00 1.36 C ATOM 2437 CD LYS A 159 7.471 -16.963 -1.857 1.00 1.66 C ATOM 2438 CE LYS A 159 8.522 -16.594 -0.811 1.00 1.99 C ATOM 2439 NZ LYS A 159 9.895 -16.501 -1.373 1.00 2.26 N ATOM 0 H LYS A 159 4.877 -14.248 -2.914 1.00 0.58 H new ATOM 0 HA LYS A 159 7.048 -12.455 -3.028 1.00 0.66 H new ATOM 0 HB2 LYS A 159 8.267 -14.209 -2.076 1.00 0.93 H new ATOM 0 HB3 LYS A 159 6.632 -14.509 -1.523 1.00 0.93 H new ATOM 0 HG2 LYS A 159 6.447 -16.121 -3.551 1.00 1.36 H new ATOM 0 HG3 LYS A 159 8.193 -15.999 -3.639 1.00 1.36 H new ATOM 0 HD2 LYS A 159 6.505 -17.087 -1.367 1.00 1.66 H new ATOM 0 HD3 LYS A 159 7.729 -17.925 -2.301 1.00 1.66 H new ATOM 0 HE2 LYS A 159 8.256 -15.639 -0.358 1.00 1.99 H new ATOM 0 HE3 LYS A 159 8.511 -17.339 -0.015 1.00 1.99 H new ATOM 0 HZ1 LYS A 159 10.563 -16.248 -0.617 1.00 2.26 H new ATOM 0 HZ2 LYS A 159 10.166 -17.418 -1.782 1.00 2.26 H new ATOM 0 HZ3 LYS A 159 9.918 -15.771 -2.114 1.00 2.26 H new ATOM 2564 N VAL A 167 9.025 -2.167 2.013 1.00 0.49 N ATOM 2565 CA VAL A 167 8.132 -1.313 2.778 1.00 0.44 C ATOM 2566 C VAL A 167 6.713 -1.425 2.263 1.00 0.38 C ATOM 2567 O VAL A 167 6.491 -1.327 1.049 1.00 0.39 O ATOM 2568 CB VAL A 167 8.617 0.145 2.690 1.00 0.53 C ATOM 2569 CG1 VAL A 167 7.471 1.128 2.851 1.00 1.15 C ATOM 2570 CG2 VAL A 167 9.701 0.393 3.726 1.00 1.19 C ATOM 0 HA VAL A 167 8.141 -1.635 3.819 1.00 0.44 H new ATOM 0 HB VAL A 167 9.036 0.306 1.697 1.00 0.53 H new ATOM 0 HG11 VAL A 167 7.853 2.147 2.783 1.00 1.15 H new ATOM 0 HG12 VAL A 167 6.736 0.963 2.063 1.00 1.15 H new ATOM 0 HG13 VAL A 167 7.000 0.981 3.823 1.00 1.15 H new ATOM 0 HG21 VAL A 167 10.040 1.427 3.658 1.00 1.19 H new ATOM 0 HG22 VAL A 167 9.301 0.207 4.723 1.00 1.19 H new ATOM 0 HG23 VAL A 167 10.541 -0.277 3.541 1.00 1.19 H new ATOM 2580 N CYS A 168 5.743 -1.580 3.177 1.00 0.38 N ATOM 2581 CA CYS A 168 4.386 -1.858 2.743 1.00 0.40 C ATOM 2582 C CYS A 168 3.342 -0.931 3.391 1.00 0.47 C ATOM 2583 O CYS A 168 2.557 -1.346 4.232 1.00 0.94 O ATOM 2584 CB CYS A 168 4.094 -3.325 3.034 1.00 0.48 C ATOM 2585 SG CYS A 168 5.349 -4.134 4.063 1.00 1.36 S ATOM 0 H CYS A 168 5.875 -1.518 4.187 1.00 0.38 H new ATOM 0 HA CYS A 168 4.310 -1.660 1.674 1.00 0.40 H new ATOM 0 HB2 CYS A 168 3.127 -3.401 3.531 1.00 0.48 H new ATOM 0 HB3 CYS A 168 4.011 -3.863 2.090 1.00 0.48 H new ATOM 0 HG CYS A 168 5.498 -3.468 5.169 1.00 1.36 H new ATOM 2591 N ALA A 169 3.314 0.308 2.925 1.00 0.29 N ATOM 2592 CA ALA A 169 2.445 1.378 3.441 1.00 0.28 C ATOM 2593 C ALA A 169 1.001 1.308 2.911 1.00 0.27 C ATOM 2594 O ALA A 169 0.416 2.334 2.563 1.00 0.28 O ATOM 2595 CB ALA A 169 3.049 2.736 3.157 1.00 0.31 C ATOM 0 H ALA A 169 3.909 0.615 2.155 1.00 0.29 H new ATOM 0 HA ALA A 169 2.382 1.225 4.518 1.00 0.28 H new ATOM 0 HB1 ALA A 169 2.393 3.515 3.546 1.00 0.31 H new ATOM 0 HB2 ALA A 169 4.024 2.809 3.639 1.00 0.31 H new ATOM 0 HB3 ALA A 169 3.166 2.864 2.081 1.00 0.31 H new ATOM 2601 N LEU A 170 0.488 0.098 2.735 1.00 0.28 N ATOM 2602 CA LEU A 170 -0.816 -0.129 2.100 1.00 0.32 C ATOM 2603 C LEU A 170 -1.950 0.676 2.766 1.00 0.32 C ATOM 2604 O LEU A 170 -2.269 0.475 3.934 1.00 0.52 O ATOM 2605 CB LEU A 170 -1.120 -1.632 2.145 1.00 0.48 C ATOM 2606 CG LEU A 170 -2.564 -2.046 1.851 1.00 0.39 C ATOM 2607 CD1 LEU A 170 -3.020 -1.555 0.494 1.00 0.66 C ATOM 2608 CD2 LEU A 170 -2.698 -3.555 1.929 1.00 0.69 C ATOM 0 H LEU A 170 0.959 -0.758 3.026 1.00 0.28 H new ATOM 0 HA LEU A 170 -0.764 0.221 1.069 1.00 0.32 H new ATOM 0 HB2 LEU A 170 -0.469 -2.133 1.429 1.00 0.48 H new ATOM 0 HB3 LEU A 170 -0.853 -2.005 3.134 1.00 0.48 H new ATOM 0 HG LEU A 170 -3.203 -1.585 2.604 1.00 0.39 H new ATOM 0 HD11 LEU A 170 -4.050 -1.868 0.321 1.00 0.66 H new ATOM 0 HD12 LEU A 170 -2.961 -0.467 0.462 1.00 0.66 H new ATOM 0 HD13 LEU A 170 -2.378 -1.976 -0.280 1.00 0.66 H new ATOM 0 HD21 LEU A 170 -3.729 -3.840 1.718 1.00 0.69 H new ATOM 0 HD22 LEU A 170 -2.037 -4.017 1.196 1.00 0.69 H new ATOM 0 HD23 LEU A 170 -2.425 -3.893 2.929 1.00 0.69 H new ATOM 2620 N PHE A 171 -2.560 1.579 1.998 1.00 0.27 N ATOM 2621 CA PHE A 171 -3.663 2.416 2.475 1.00 0.27 C ATOM 2622 C PHE A 171 -4.897 2.245 1.577 1.00 0.27 C ATOM 2623 O PHE A 171 -4.797 2.362 0.356 1.00 0.34 O ATOM 2624 CB PHE A 171 -3.214 3.885 2.490 1.00 0.32 C ATOM 2625 CG PHE A 171 -4.343 4.874 2.562 1.00 0.29 C ATOM 2626 CD1 PHE A 171 -5.288 4.781 3.568 1.00 0.33 C ATOM 2627 CD2 PHE A 171 -4.457 5.891 1.632 1.00 0.38 C ATOM 2628 CE1 PHE A 171 -6.326 5.684 3.648 1.00 0.41 C ATOM 2629 CE2 PHE A 171 -5.491 6.800 1.708 1.00 0.48 C ATOM 2630 CZ PHE A 171 -6.424 6.702 2.673 1.00 0.47 C ATOM 0 H PHE A 171 -2.303 1.752 1.026 1.00 0.27 H new ATOM 0 HA PHE A 171 -3.934 2.109 3.485 1.00 0.27 H new ATOM 0 HB2 PHE A 171 -2.553 4.042 3.342 1.00 0.32 H new ATOM 0 HB3 PHE A 171 -2.629 4.083 1.592 1.00 0.32 H new ATOM 0 HD1 PHE A 171 -5.211 3.991 4.300 1.00 0.33 H new ATOM 0 HD2 PHE A 171 -3.729 5.974 0.838 1.00 0.38 H new ATOM 0 HE1 PHE A 171 -7.053 5.615 4.443 1.00 0.41 H new ATOM 0 HE2 PHE A 171 -5.553 7.600 0.985 1.00 0.48 H new ATOM 0 HZ PHE A 171 -7.247 7.401 2.702 1.00 0.47 H new ATOM 2640 N ILE A 172 -6.056 1.948 2.168 1.00 0.23 N ATOM 2641 CA ILE A 172 -7.295 1.929 1.399 1.00 0.23 C ATOM 2642 C ILE A 172 -8.294 2.956 1.940 1.00 0.23 C ATOM 2643 O ILE A 172 -8.543 3.050 3.149 1.00 0.24 O ATOM 2644 CB ILE A 172 -7.976 0.537 1.335 1.00 0.23 C ATOM 2645 CG1 ILE A 172 -9.139 0.594 0.333 1.00 0.26 C ATOM 2646 CG2 ILE A 172 -8.463 0.085 2.699 1.00 0.21 C ATOM 2647 CD1 ILE A 172 -9.934 -0.690 0.228 1.00 0.30 C ATOM 0 H ILE A 172 -6.160 1.722 3.157 1.00 0.23 H new ATOM 0 HA ILE A 172 -7.002 2.188 0.382 1.00 0.23 H new ATOM 0 HB ILE A 172 -7.240 -0.196 1.003 1.00 0.23 H new ATOM 0 HG12 ILE A 172 -9.812 1.402 0.621 1.00 0.26 H new ATOM 0 HG13 ILE A 172 -8.743 0.844 -0.651 1.00 0.26 H new ATOM 0 HG21 ILE A 172 -8.934 -0.894 2.611 1.00 0.21 H new ATOM 0 HG22 ILE A 172 -7.618 0.021 3.384 1.00 0.21 H new ATOM 0 HG23 ILE A 172 -9.188 0.803 3.083 1.00 0.21 H new ATOM 0 HD11 ILE A 172 -10.735 -0.563 -0.500 1.00 0.30 H new ATOM 0 HD12 ILE A 172 -9.277 -1.499 -0.092 1.00 0.30 H new ATOM 0 HD13 ILE A 172 -10.363 -0.933 1.200 1.00 0.30 H new ATOM 2659 N MET A 173 -8.856 3.737 1.043 1.00 0.24 N ATOM 2660 CA MET A 173 -9.863 4.711 1.416 1.00 0.25 C ATOM 2661 C MET A 173 -11.155 4.428 0.652 1.00 0.27 C ATOM 2662 O MET A 173 -11.134 3.750 -0.374 1.00 0.31 O ATOM 2663 CB MET A 173 -9.363 6.119 1.133 1.00 0.28 C ATOM 2664 CG MET A 173 -9.042 6.358 -0.323 1.00 0.33 C ATOM 2665 SD MET A 173 -8.853 8.103 -0.695 1.00 0.99 S ATOM 2666 CE MET A 173 -10.302 8.712 0.153 1.00 0.50 C ATOM 0 H MET A 173 -8.633 3.718 0.048 1.00 0.24 H new ATOM 0 HA MET A 173 -10.064 4.633 2.484 1.00 0.25 H new ATOM 0 HB2 MET A 173 -10.118 6.836 1.454 1.00 0.28 H new ATOM 0 HB3 MET A 173 -8.471 6.307 1.730 1.00 0.28 H new ATOM 0 HG2 MET A 173 -8.124 5.831 -0.583 1.00 0.33 H new ATOM 0 HG3 MET A 173 -9.836 5.940 -0.942 1.00 0.33 H new ATOM 0 HE1 MET A 173 -10.556 9.702 -0.226 1.00 0.50 H new ATOM 0 HE2 MET A 173 -11.137 8.032 -0.019 1.00 0.50 H new ATOM 0 HE3 MET A 173 -10.099 8.774 1.222 1.00 0.50 H new ATOM 2676 N LYS A 174 -12.275 4.934 1.145 1.00 0.30 N ATOM 2677 CA LYS A 174 -13.566 4.563 0.591 1.00 0.34 C ATOM 2678 C LYS A 174 -14.272 5.721 -0.106 1.00 0.30 C ATOM 2679 O LYS A 174 -14.098 6.894 0.223 1.00 0.33 O ATOM 2680 CB LYS A 174 -14.501 4.032 1.680 1.00 0.50 C ATOM 2681 CG LYS A 174 -15.057 5.136 2.563 1.00 0.69 C ATOM 2682 CD LYS A 174 -16.137 4.648 3.512 1.00 0.77 C ATOM 2683 CE LYS A 174 -17.497 4.634 2.836 1.00 0.74 C ATOM 2684 NZ LYS A 174 -18.601 4.523 3.822 1.00 1.22 N ATOM 0 H LYS A 174 -12.316 5.596 1.920 1.00 0.30 H new ATOM 0 HA LYS A 174 -13.351 3.789 -0.146 1.00 0.34 H new ATOM 0 HB2 LYS A 174 -15.327 3.494 1.214 1.00 0.50 H new ATOM 0 HB3 LYS A 174 -13.962 3.314 2.298 1.00 0.50 H new ATOM 0 HG2 LYS A 174 -14.244 5.575 3.141 1.00 0.69 H new ATOM 0 HG3 LYS A 174 -15.464 5.927 1.933 1.00 0.69 H new ATOM 0 HD2 LYS A 174 -15.891 3.645 3.862 1.00 0.77 H new ATOM 0 HD3 LYS A 174 -16.171 5.292 4.390 1.00 0.77 H new ATOM 0 HE2 LYS A 174 -17.622 5.546 2.251 1.00 0.74 H new ATOM 0 HE3 LYS A 174 -17.548 3.798 2.138 1.00 0.74 H new ATOM 0 HZ1 LYS A 174 -19.511 4.482 3.321 1.00 1.22 H new ATOM 0 HZ2 LYS A 174 -18.477 3.658 4.386 1.00 1.22 H new ATOM 0 HZ3 LYS A 174 -18.589 5.351 4.451 1.00 1.22 H new ATOM 2698 N GLY A 175 -15.046 5.337 -1.090 1.00 0.28 N ATOM 2699 CA GLY A 175 -16.096 6.154 -1.650 1.00 0.28 C ATOM 2700 C GLY A 175 -15.754 6.781 -2.982 1.00 0.28 C ATOM 2701 O GLY A 175 -16.630 6.839 -3.843 1.00 0.31 O ATOM 0 H GLY A 175 -14.962 4.424 -1.536 1.00 0.28 H new ATOM 0 HA2 GLY A 175 -16.991 5.543 -1.768 1.00 0.28 H new ATOM 0 HA3 GLY A 175 -16.341 6.945 -0.942 1.00 0.28 H new ATOM 2705 N THR A 176 -14.476 7.118 -3.211 1.00 0.27 N ATOM 2706 CA THR A 176 -14.041 7.656 -4.501 1.00 0.32 C ATOM 2707 C THR A 176 -12.540 7.909 -4.551 1.00 0.38 C ATOM 2708 O THR A 176 -11.872 7.990 -3.521 1.00 0.44 O ATOM 2709 CB THR A 176 -14.713 8.993 -4.845 1.00 0.43 C ATOM 2710 OG1 THR A 176 -15.203 9.648 -3.666 1.00 0.57 O ATOM 2711 CG2 THR A 176 -15.835 8.823 -5.856 1.00 0.68 C ATOM 0 H THR A 176 -13.731 7.027 -2.520 1.00 0.27 H new ATOM 0 HA THR A 176 -14.329 6.887 -5.218 1.00 0.32 H new ATOM 0 HB THR A 176 -13.947 9.621 -5.299 1.00 0.43 H new ATOM 0 HG1 THR A 176 -15.624 10.497 -3.915 1.00 0.57 H new ATOM 0 HG21 THR A 176 -16.282 9.794 -6.070 1.00 0.68 H new ATOM 0 HG22 THR A 176 -15.434 8.397 -6.776 1.00 0.68 H new ATOM 0 HG23 THR A 176 -16.594 8.156 -5.448 1.00 0.68 H new ATOM 2719 N ALA A 177 -12.026 8.039 -5.775 1.00 0.50 N ATOM 2720 CA ALA A 177 -10.672 8.523 -6.013 1.00 0.65 C ATOM 2721 C ALA A 177 -10.665 10.044 -6.050 1.00 0.68 C ATOM 2722 O ALA A 177 -9.609 10.676 -6.065 1.00 0.86 O ATOM 2723 CB ALA A 177 -10.128 7.967 -7.322 1.00 0.82 C ATOM 0 H ALA A 177 -12.539 7.811 -6.627 1.00 0.50 H new ATOM 0 HA ALA A 177 -10.032 8.182 -5.200 1.00 0.65 H new ATOM 0 HB1 ALA A 177 -9.116 8.339 -7.483 1.00 0.82 H new ATOM 0 HB2 ALA A 177 -10.111 6.878 -7.276 1.00 0.82 H new ATOM 0 HB3 ALA A 177 -10.767 8.285 -8.146 1.00 0.82 H new ATOM 2729 N ASP A 178 -11.862 10.619 -6.082 1.00 0.61 N ATOM 2730 CA ASP A 178 -12.033 12.060 -6.231 1.00 0.68 C ATOM 2731 C ASP A 178 -11.862 12.785 -4.904 1.00 0.67 C ATOM 2732 O ASP A 178 -11.813 14.013 -4.862 1.00 0.79 O ATOM 2733 CB ASP A 178 -13.408 12.370 -6.821 1.00 0.82 C ATOM 2734 CG ASP A 178 -13.568 11.806 -8.217 1.00 1.38 C ATOM 2735 OD1 ASP A 178 -13.058 12.422 -9.177 1.00 1.60 O ATOM 2736 OD2 ASP A 178 -14.215 10.749 -8.362 1.00 2.16 O ATOM 0 H ASP A 178 -12.738 10.102 -6.006 1.00 0.61 H new ATOM 0 HA ASP A 178 -11.259 12.416 -6.910 1.00 0.68 H new ATOM 0 HB2 ASP A 178 -14.182 11.958 -6.173 1.00 0.82 H new ATOM 0 HB3 ASP A 178 -13.556 13.450 -6.847 1.00 0.82 H new