USER MOD reduce.3.24.130724 H: found=0, std=0, add=1300, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1298 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 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 171 HIS : no HD1:sc=-0.00989 X(o=-0.0099,f=-0.0095) USER MOD Set 2.1: A 3 MET CE :methyl 180:sc= -0.365 (180deg=-0.365) USER MOD Set 2.2: A 168 MET CE :methyl -168:sc= -3.1! (180deg=-3.28) USER MOD Set 3.1: A 105 HIS : no HD1:sc= -1.65 K(o=-1.6,f=-4!) USER MOD Set 3.2: A 118 TYR OH : rot -26:sc= 0.0107 USER MOD Set 4.1: A 90 GLN : amide:sc= -4.39! K(o=-5.8!,f=-0.1) USER MOD Set 4.2: A 148 ASN : amide:sc= -1.46! C(o=-5.8!,f=-5.1!) USER MOD Set 5.1: A 33 HIS : no HE2:sc= 0.851 K(o=1.9,f=-3.2!) USER MOD Set 5.2: A 46 TYR OH : rot -135:sc= 1.02 USER MOD Set 6.1: A 12 CYS SG : rot 180:sc= -0.0188 USER MOD Set 6.2: A 16 MET CE :methyl -168:sc= -0.995 (180deg=-0.946) USER MOD Set 7.1: A 9 SER OG : rot -120:sc= 1 USER MOD Set 7.2: A 14 THR OG1 : rot 83:sc= 0.581 USER MOD Single : A 1 MET CE :methyl 163:sc= 0 (180deg=-0.0881) USER MOD Single : A 1 MET N :NH3+ -148:sc= 0.108 (180deg=0) USER MOD Single : A 2 ASN : amide:sc= 0.346 X(o=0.35,f=-0.056) USER MOD Single : A 7 TYR OH : rot 163:sc= 1.26 USER MOD Single : A 10 SER OG : rot 176:sc= 0 USER MOD Single : A 11 THR OG1 : rot 142:sc= 2.04 USER MOD Single : A 13 TYR OH : rot 180:sc= 0 USER MOD Single : A 20 LYS NZ :NH3+ -173:sc= 1.34 (180deg=1.2) USER MOD Single : A 31 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 ASN : amide:sc= -0.239 K(o=-0.24,f=-9.7!) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 41 LYS NZ :NH3+ -156:sc= 1.25 (180deg=0.886) USER MOD Single : A 43 MET CE :methyl 149:sc= -0.482 (180deg=-1.17) USER MOD Single : A 45 GLN : amide:sc= 0.47 X(o=0.47,f=0) USER MOD Single : A 55 THR OG1 : rot 100:sc= 0.234 USER MOD Single : A 62 GLN : amide:sc= -0.935 K(o=-0.94,f=-3.1!) USER MOD Single : A 71 GLN : amide:sc= 0 X(o=0,f=-0.38) USER MOD Single : A 76 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 80 LYS NZ :NH3+ -166:sc= 2.1 (180deg=1.64) USER MOD Single : A 85 TYR OH : rot 180:sc=-0.00149 USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 103 MET CE :methyl 166:sc= -0.288 (180deg=-0.56) USER MOD Single : A 107 LYS NZ :NH3+ -167:sc= 0.273 (180deg=0.202) USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 111 LYS NZ :NH3+ 163:sc= 2.31 (180deg=1.92) USER MOD Single : A 121 THR OG1 : rot -161:sc= 0.135 USER MOD Single : A 127 THR OG1 : rot -37:sc= 0.0374 USER MOD Single : A 128 SER OG : rot 110:sc= 0.382 USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 147 THR OG1 : rot 180:sc= 0 USER MOD Single : A 149 GLN : amide:sc= 0.436 X(o=0.44,f=0) USER MOD Single : A 150 TYR OH : rot 180:sc= 0 USER MOD Single : A 153 SER OG : rot 75:sc= 0.453 USER MOD Single : A 158 GLN : amide:sc= 0.185 X(o=0.18,f=-0.18) USER MOD Single : A 159 SER OG : rot 70:sc= 0.029 USER MOD Single : A 161 CYS SG : rot 76:sc= -1.01 USER MOD Single : A 163 GLN : amide:sc= 1.4 K(o=1.4,f=-0.49) USER MOD Single : A 166 ASN : amide:sc= 0.849 K(o=0.85,f=0) USER MOD Single : A 172 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 0.553 0.704 -0.478 1.00 0.00 N ATOM 2 CA MET A 1 1.687 0.681 -1.455 1.00 0.00 C ATOM 3 C MET A 1 1.967 2.072 -2.022 1.00 0.00 C ATOM 4 O MET A 1 1.034 2.824 -2.278 1.00 0.00 O ATOM 5 CB MET A 1 1.486 -0.339 -2.614 1.00 0.00 C ATOM 6 CG MET A 1 0.507 0.066 -3.739 1.00 0.00 C ATOM 7 SD MET A 1 -1.267 -0.060 -3.370 1.00 0.00 S ATOM 8 CE MET A 1 -1.534 -1.812 -3.752 1.00 0.00 C ATOM 0 H1 MET A 1 0.710 -0.019 0.253 1.00 0.00 H new ATOM 0 H2 MET A 1 0.499 1.642 -0.031 1.00 0.00 H new ATOM 0 H3 MET A 1 -0.338 0.505 -0.976 1.00 0.00 H new ATOM 0 HA MET A 1 2.554 0.348 -0.885 1.00 0.00 H new ATOM 0 HB2 MET A 1 2.459 -0.536 -3.065 1.00 0.00 H new ATOM 0 HB3 MET A 1 1.138 -1.278 -2.183 1.00 0.00 H new ATOM 0 HG2 MET A 1 0.722 1.097 -4.021 1.00 0.00 H new ATOM 0 HG3 MET A 1 0.717 -0.554 -4.611 1.00 0.00 H new ATOM 0 HE1 MET A 1 -2.472 -2.143 -3.306 1.00 0.00 H new ATOM 0 HE2 MET A 1 -1.579 -1.946 -4.833 1.00 0.00 H new ATOM 0 HE3 MET A 1 -0.712 -2.402 -3.347 1.00 0.00 H new ATOM 20 N ASN A 2 3.230 2.396 -2.305 1.00 0.00 N ATOM 21 CA ASN A 2 3.582 3.595 -3.070 1.00 0.00 C ATOM 22 C ASN A 2 3.486 3.269 -4.564 1.00 0.00 C ATOM 23 O ASN A 2 3.839 2.163 -4.974 1.00 0.00 O ATOM 24 CB ASN A 2 4.946 4.165 -2.644 1.00 0.00 C ATOM 25 CG ASN A 2 6.152 3.219 -2.593 1.00 0.00 C ATOM 26 OD1 ASN A 2 7.029 3.389 -1.753 1.00 0.00 O ATOM 27 ND2 ASN A 2 6.243 2.208 -3.447 1.00 0.00 N ATOM 0 H ASN A 2 4.033 1.839 -2.013 1.00 0.00 H new ATOM 0 HA ASN A 2 2.874 4.396 -2.857 1.00 0.00 H new ATOM 0 HB2 ASN A 2 5.192 4.979 -3.326 1.00 0.00 H new ATOM 0 HB3 ASN A 2 4.827 4.604 -1.653 1.00 0.00 H new ATOM 0 HD21 ASN A 2 7.041 1.574 -3.404 1.00 0.00 H new ATOM 0 HD22 ASN A 2 5.515 2.064 -4.147 1.00 0.00 H new ATOM 34 N MET A 3 3.020 4.214 -5.373 1.00 0.00 N ATOM 35 CA MET A 3 2.651 4.050 -6.779 1.00 0.00 C ATOM 36 C MET A 3 3.313 5.161 -7.586 1.00 0.00 C ATOM 37 O MET A 3 3.465 6.274 -7.089 1.00 0.00 O ATOM 38 CB MET A 3 1.121 4.122 -6.934 1.00 0.00 C ATOM 39 CG MET A 3 0.410 3.180 -5.950 1.00 0.00 C ATOM 40 SD MET A 3 -1.293 2.707 -6.351 1.00 0.00 S ATOM 41 CE MET A 3 -2.099 4.312 -6.551 1.00 0.00 C ATOM 0 H MET A 3 2.881 5.171 -5.049 1.00 0.00 H new ATOM 0 HA MET A 3 2.987 3.079 -7.141 1.00 0.00 H new ATOM 0 HB2 MET A 3 0.785 5.145 -6.767 1.00 0.00 H new ATOM 0 HB3 MET A 3 0.845 3.859 -7.955 1.00 0.00 H new ATOM 0 HG2 MET A 3 1.003 2.270 -5.863 1.00 0.00 H new ATOM 0 HG3 MET A 3 0.408 3.654 -4.968 1.00 0.00 H new ATOM 0 HE1 MET A 3 -3.150 4.163 -6.799 1.00 0.00 H new ATOM 0 HE2 MET A 3 -2.022 4.876 -5.621 1.00 0.00 H new ATOM 0 HE3 MET A 3 -1.612 4.866 -7.353 1.00 0.00 H new ATOM 51 N GLY A 4 3.672 4.891 -8.835 1.00 0.00 N ATOM 52 CA GLY A 4 4.385 5.863 -9.660 1.00 0.00 C ATOM 53 C GLY A 4 3.493 6.382 -10.775 1.00 0.00 C ATOM 54 O GLY A 4 3.071 5.589 -11.614 1.00 0.00 O ATOM 0 H GLY A 4 3.481 4.004 -9.302 1.00 0.00 H new ATOM 0 HA2 GLY A 4 4.722 6.694 -9.041 1.00 0.00 H new ATOM 0 HA3 GLY A 4 5.276 5.401 -10.086 1.00 0.00 H new ATOM 58 N LEU A 5 3.191 7.683 -10.807 1.00 0.00 N ATOM 59 CA LEU A 5 2.491 8.308 -11.919 1.00 0.00 C ATOM 60 C LEU A 5 3.504 8.759 -12.973 1.00 0.00 C ATOM 61 O LEU A 5 4.071 9.846 -12.867 1.00 0.00 O ATOM 62 CB LEU A 5 1.654 9.488 -11.395 1.00 0.00 C ATOM 63 CG LEU A 5 0.548 10.014 -12.326 1.00 0.00 C ATOM 64 CD1 LEU A 5 0.701 9.757 -13.828 1.00 0.00 C ATOM 65 CD2 LEU A 5 -0.771 9.392 -11.891 1.00 0.00 C ATOM 0 H LEU A 5 3.429 8.331 -10.056 1.00 0.00 H new ATOM 0 HA LEU A 5 1.814 7.594 -12.389 1.00 0.00 H new ATOM 0 HB2 LEU A 5 1.193 9.188 -10.454 1.00 0.00 H new ATOM 0 HB3 LEU A 5 2.331 10.312 -11.170 1.00 0.00 H new ATOM 0 HG LEU A 5 0.605 11.097 -12.220 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -0.151 10.183 -14.359 1.00 0.00 H new ATOM 0 HD12 LEU A 5 1.620 10.222 -14.185 1.00 0.00 H new ATOM 0 HD13 LEU A 5 0.742 8.683 -14.011 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -1.573 9.750 -12.537 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -0.703 8.307 -11.964 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -0.983 9.673 -10.860 1.00 0.00 H new ATOM 77 N PHE A 6 3.690 7.954 -14.008 1.00 0.00 N ATOM 78 CA PHE A 6 4.513 8.276 -15.167 1.00 0.00 C ATOM 79 C PHE A 6 3.655 8.829 -16.289 1.00 0.00 C ATOM 80 O PHE A 6 2.513 8.423 -16.487 1.00 0.00 O ATOM 81 CB PHE A 6 5.265 7.032 -15.631 1.00 0.00 C ATOM 82 CG PHE A 6 6.251 6.557 -14.599 1.00 0.00 C ATOM 83 CD1 PHE A 6 5.842 5.700 -13.565 1.00 0.00 C ATOM 84 CD2 PHE A 6 7.559 7.055 -14.622 1.00 0.00 C ATOM 85 CE1 PHE A 6 6.740 5.371 -12.538 1.00 0.00 C ATOM 86 CE2 PHE A 6 8.459 6.706 -13.610 1.00 0.00 C ATOM 87 CZ PHE A 6 8.048 5.878 -12.550 1.00 0.00 C ATOM 0 H PHE A 6 3.260 7.031 -14.068 1.00 0.00 H new ATOM 0 HA PHE A 6 5.238 9.040 -14.884 1.00 0.00 H new ATOM 0 HB2 PHE A 6 4.552 6.236 -15.846 1.00 0.00 H new ATOM 0 HB3 PHE A 6 5.789 7.250 -16.561 1.00 0.00 H new ATOM 0 HD1 PHE A 6 4.841 5.296 -13.560 1.00 0.00 H new ATOM 0 HD2 PHE A 6 7.873 7.709 -15.422 1.00 0.00 H new ATOM 0 HE1 PHE A 6 6.422 4.724 -11.734 1.00 0.00 H new ATOM 0 HE2 PHE A 6 9.474 7.074 -13.643 1.00 0.00 H new ATOM 0 HZ PHE A 6 8.734 5.635 -11.752 1.00 0.00 H new ATOM 97 N TYR A 7 4.219 9.748 -17.054 1.00 0.00 N ATOM 98 CA TYR A 7 3.561 10.361 -18.196 1.00 0.00 C ATOM 99 C TYR A 7 4.601 11.080 -19.040 1.00 0.00 C ATOM 100 O TYR A 7 5.758 11.206 -18.636 1.00 0.00 O ATOM 101 CB TYR A 7 2.513 11.367 -17.704 1.00 0.00 C ATOM 102 CG TYR A 7 3.093 12.518 -16.909 1.00 0.00 C ATOM 103 CD1 TYR A 7 3.431 12.340 -15.555 1.00 0.00 C ATOM 104 CD2 TYR A 7 3.343 13.755 -17.532 1.00 0.00 C ATOM 105 CE1 TYR A 7 3.966 13.398 -14.809 1.00 0.00 C ATOM 106 CE2 TYR A 7 3.897 14.807 -16.790 1.00 0.00 C ATOM 107 CZ TYR A 7 4.188 14.648 -15.417 1.00 0.00 C ATOM 108 OH TYR A 7 4.705 15.667 -14.679 1.00 0.00 O ATOM 0 H TYR A 7 5.165 10.096 -16.896 1.00 0.00 H new ATOM 0 HA TYR A 7 3.069 9.594 -18.794 1.00 0.00 H new ATOM 0 HB2 TYR A 7 1.976 11.767 -18.564 1.00 0.00 H new ATOM 0 HB3 TYR A 7 1.783 10.844 -17.087 1.00 0.00 H new ATOM 0 HD1 TYR A 7 3.277 11.379 -15.087 1.00 0.00 H new ATOM 0 HD2 TYR A 7 3.109 13.893 -18.577 1.00 0.00 H new ATOM 0 HE1 TYR A 7 4.208 13.255 -13.766 1.00 0.00 H new ATOM 0 HE2 TYR A 7 4.104 15.750 -17.274 1.00 0.00 H new ATOM 0 HH TYR A 7 5.051 16.362 -15.278 1.00 0.00 H new ATOM 118 N GLY A 8 4.164 11.598 -20.184 1.00 0.00 N ATOM 119 CA GLY A 8 4.925 12.511 -21.008 1.00 0.00 C ATOM 120 C GLY A 8 3.948 13.574 -21.475 1.00 0.00 C ATOM 121 O GLY A 8 2.819 13.249 -21.836 1.00 0.00 O ATOM 0 H GLY A 8 3.244 11.384 -20.568 1.00 0.00 H new ATOM 0 HA2 GLY A 8 5.743 12.956 -20.442 1.00 0.00 H new ATOM 0 HA3 GLY A 8 5.370 11.991 -21.857 1.00 0.00 H new ATOM 125 N SER A 9 4.337 14.840 -21.387 1.00 0.00 N ATOM 126 CA SER A 9 3.607 15.962 -21.948 1.00 0.00 C ATOM 127 C SER A 9 4.638 17.028 -22.301 1.00 0.00 C ATOM 128 O SER A 9 5.644 17.186 -21.603 1.00 0.00 O ATOM 129 CB SER A 9 2.576 16.513 -20.954 1.00 0.00 C ATOM 130 OG SER A 9 1.307 16.575 -21.564 1.00 0.00 O ATOM 0 H SER A 9 5.194 15.119 -20.909 1.00 0.00 H new ATOM 0 HA SER A 9 3.049 15.648 -22.830 1.00 0.00 H new ATOM 0 HB2 SER A 9 2.534 15.876 -20.070 1.00 0.00 H new ATOM 0 HB3 SER A 9 2.876 17.505 -20.618 1.00 0.00 H new ATOM 0 HG SER A 9 0.989 17.502 -21.563 1.00 0.00 H new ATOM 136 N SER A 10 4.343 17.780 -23.358 1.00 0.00 N ATOM 137 CA SER A 10 5.177 18.852 -23.876 1.00 0.00 C ATOM 138 C SER A 10 4.357 20.144 -23.983 1.00 0.00 C ATOM 139 O SER A 10 4.930 21.227 -23.821 1.00 0.00 O ATOM 140 CB SER A 10 5.778 18.346 -25.193 1.00 0.00 C ATOM 141 OG SER A 10 6.537 19.315 -25.901 1.00 0.00 O ATOM 0 H SER A 10 3.485 17.652 -23.894 1.00 0.00 H new ATOM 0 HA SER A 10 6.004 19.112 -23.215 1.00 0.00 H new ATOM 0 HB2 SER A 10 6.415 17.487 -24.982 1.00 0.00 H new ATOM 0 HB3 SER A 10 4.971 17.994 -25.835 1.00 0.00 H new ATOM 0 HG SER A 10 6.943 18.900 -26.690 1.00 0.00 H new ATOM 147 N THR A 11 3.030 20.056 -24.167 1.00 0.00 N ATOM 148 CA THR A 11 2.160 21.218 -24.043 1.00 0.00 C ATOM 149 C THR A 11 1.893 21.410 -22.543 1.00 0.00 C ATOM 150 O THR A 11 2.494 22.296 -21.929 1.00 0.00 O ATOM 151 CB THR A 11 0.921 21.046 -24.933 1.00 0.00 C ATOM 152 OG1 THR A 11 0.295 19.845 -24.559 1.00 0.00 O ATOM 153 CG2 THR A 11 1.302 20.924 -26.410 1.00 0.00 C ATOM 0 H THR A 11 2.545 19.190 -24.402 1.00 0.00 H new ATOM 0 HA THR A 11 2.611 22.140 -24.410 1.00 0.00 H new ATOM 0 HB THR A 11 0.276 21.915 -24.807 1.00 0.00 H new ATOM 0 HG1 THR A 11 -0.678 19.960 -24.589 1.00 0.00 H new ATOM 0 HG21 THR A 11 0.400 20.804 -27.010 1.00 0.00 H new ATOM 0 HG22 THR A 11 1.830 21.824 -26.725 1.00 0.00 H new ATOM 0 HG23 THR A 11 1.948 20.057 -26.549 1.00 0.00 H new ATOM 161 N CYS A 12 1.047 20.546 -21.951 1.00 0.00 N ATOM 162 CA CYS A 12 0.752 20.468 -20.511 1.00 0.00 C ATOM 163 C CYS A 12 -0.339 19.442 -20.154 1.00 0.00 C ATOM 164 O CYS A 12 -0.513 19.125 -18.983 1.00 0.00 O ATOM 165 CB CYS A 12 0.249 21.834 -19.985 1.00 0.00 C ATOM 166 SG CYS A 12 -1.051 22.562 -21.038 1.00 0.00 S ATOM 0 H CYS A 12 0.528 19.853 -22.490 1.00 0.00 H new ATOM 0 HA CYS A 12 1.693 20.164 -20.052 1.00 0.00 H new ATOM 0 HB2 CYS A 12 -0.137 21.709 -18.973 1.00 0.00 H new ATOM 0 HB3 CYS A 12 1.089 22.526 -19.922 1.00 0.00 H new ATOM 0 HG CYS A 12 -1.427 23.702 -20.538 1.00 0.00 H new ATOM 172 N TYR A 13 -1.110 18.937 -21.116 1.00 0.00 N ATOM 173 CA TYR A 13 -2.359 18.217 -20.821 1.00 0.00 C ATOM 174 C TYR A 13 -2.169 16.923 -20.028 1.00 0.00 C ATOM 175 O TYR A 13 -2.842 16.713 -19.020 1.00 0.00 O ATOM 176 CB TYR A 13 -3.120 17.955 -22.118 1.00 0.00 C ATOM 177 CG TYR A 13 -3.359 19.179 -22.972 1.00 0.00 C ATOM 178 CD1 TYR A 13 -4.247 20.188 -22.550 1.00 0.00 C ATOM 179 CD2 TYR A 13 -2.663 19.309 -24.187 1.00 0.00 C ATOM 180 CE1 TYR A 13 -4.427 21.339 -23.337 1.00 0.00 C ATOM 181 CE2 TYR A 13 -2.829 20.467 -24.969 1.00 0.00 C ATOM 182 CZ TYR A 13 -3.710 21.488 -24.548 1.00 0.00 C ATOM 183 OH TYR A 13 -3.865 22.604 -25.321 1.00 0.00 O ATOM 0 H TYR A 13 -0.895 19.011 -22.110 1.00 0.00 H new ATOM 0 HA TYR A 13 -2.942 18.866 -20.168 1.00 0.00 H new ATOM 0 HB2 TYR A 13 -2.567 17.222 -22.705 1.00 0.00 H new ATOM 0 HB3 TYR A 13 -4.083 17.506 -21.873 1.00 0.00 H new ATOM 0 HD1 TYR A 13 -4.789 20.077 -21.623 1.00 0.00 H new ATOM 0 HD2 TYR A 13 -2.002 18.522 -24.519 1.00 0.00 H new ATOM 0 HE1 TYR A 13 -5.113 22.110 -23.017 1.00 0.00 H new ATOM 0 HE2 TYR A 13 -2.281 20.576 -25.894 1.00 0.00 H new ATOM 0 HH TYR A 13 -3.294 22.534 -26.114 1.00 0.00 H new ATOM 193 N THR A 14 -1.233 16.072 -20.449 1.00 0.00 N ATOM 194 CA THR A 14 -0.963 14.806 -19.774 1.00 0.00 C ATOM 195 C THR A 14 -0.351 15.109 -18.409 1.00 0.00 C ATOM 196 O THR A 14 -0.630 14.424 -17.429 1.00 0.00 O ATOM 197 CB THR A 14 -0.048 13.893 -20.610 1.00 0.00 C ATOM 198 OG1 THR A 14 -0.171 14.178 -21.984 1.00 0.00 O ATOM 199 CG2 THR A 14 -0.385 12.414 -20.466 1.00 0.00 C ATOM 0 H THR A 14 -0.644 16.241 -21.264 1.00 0.00 H new ATOM 0 HA THR A 14 -1.898 14.261 -19.646 1.00 0.00 H new ATOM 0 HB THR A 14 0.956 14.088 -20.234 1.00 0.00 H new ATOM 0 HG1 THR A 14 0.394 14.946 -22.211 1.00 0.00 H new ATOM 0 HG21 THR A 14 0.296 11.824 -21.080 1.00 0.00 H new ATOM 0 HG22 THR A 14 -0.282 12.117 -19.422 1.00 0.00 H new ATOM 0 HG23 THR A 14 -1.410 12.241 -20.793 1.00 0.00 H new ATOM 207 N GLU A 15 0.433 16.188 -18.335 1.00 0.00 N ATOM 208 CA GLU A 15 1.055 16.633 -17.105 1.00 0.00 C ATOM 209 C GLU A 15 -0.010 17.021 -16.086 1.00 0.00 C ATOM 210 O GLU A 15 0.020 16.534 -14.960 1.00 0.00 O ATOM 211 CB GLU A 15 2.061 17.756 -17.419 1.00 0.00 C ATOM 212 CG GLU A 15 2.787 18.241 -16.155 1.00 0.00 C ATOM 213 CD GLU A 15 4.248 18.631 -16.446 1.00 0.00 C ATOM 214 OE1 GLU A 15 4.503 19.793 -16.839 1.00 0.00 O ATOM 215 OE2 GLU A 15 5.140 17.761 -16.271 1.00 0.00 O1- ATOM 0 H GLU A 15 0.650 16.776 -19.140 1.00 0.00 H new ATOM 0 HA GLU A 15 1.623 15.824 -16.645 1.00 0.00 H new ATOM 0 HB2 GLU A 15 2.792 17.397 -18.143 1.00 0.00 H new ATOM 0 HB3 GLU A 15 1.539 18.593 -17.882 1.00 0.00 H new ATOM 0 HG2 GLU A 15 2.258 19.099 -15.739 1.00 0.00 H new ATOM 0 HG3 GLU A 15 2.764 17.456 -15.399 1.00 0.00 H new ATOM 222 N MET A 16 -1.002 17.813 -16.489 1.00 0.00 N ATOM 223 CA MET A 16 -2.079 18.228 -15.596 1.00 0.00 C ATOM 224 C MET A 16 -2.918 17.038 -15.144 1.00 0.00 C ATOM 225 O MET A 16 -3.267 16.937 -13.968 1.00 0.00 O ATOM 226 CB MET A 16 -2.959 19.298 -16.254 1.00 0.00 C ATOM 227 CG MET A 16 -2.213 20.617 -16.490 1.00 0.00 C ATOM 228 SD MET A 16 -3.206 21.908 -17.294 1.00 0.00 S ATOM 229 CE MET A 16 -3.512 21.137 -18.909 1.00 0.00 C ATOM 0 H MET A 16 -1.081 18.182 -17.437 1.00 0.00 H new ATOM 0 HA MET A 16 -1.619 18.665 -14.710 1.00 0.00 H new ATOM 0 HB2 MET A 16 -3.331 18.921 -17.207 1.00 0.00 H new ATOM 0 HB3 MET A 16 -3.828 19.485 -15.624 1.00 0.00 H new ATOM 0 HG2 MET A 16 -1.856 20.995 -15.532 1.00 0.00 H new ATOM 0 HG3 MET A 16 -1.333 20.418 -17.102 1.00 0.00 H new ATOM 0 HE1 MET A 16 -3.922 21.879 -19.594 1.00 0.00 H new ATOM 0 HE2 MET A 16 -2.575 20.750 -19.311 1.00 0.00 H new ATOM 0 HE3 MET A 16 -4.222 20.318 -18.793 1.00 0.00 H new ATOM 239 N ALA A 17 -3.213 16.108 -16.053 1.00 0.00 N ATOM 240 CA ALA A 17 -3.919 14.880 -15.720 1.00 0.00 C ATOM 241 C ALA A 17 -3.141 14.075 -14.679 1.00 0.00 C ATOM 242 O ALA A 17 -3.748 13.609 -13.720 1.00 0.00 O ATOM 243 CB ALA A 17 -4.221 14.071 -16.984 1.00 0.00 C ATOM 0 H ALA A 17 -2.967 16.189 -17.040 1.00 0.00 H new ATOM 0 HA ALA A 17 -4.879 15.134 -15.270 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -4.749 13.157 -16.713 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -4.842 14.664 -17.656 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -3.287 13.816 -17.484 1.00 0.00 H new ATOM 249 N ALA A 18 -1.818 13.982 -14.802 1.00 0.00 N ATOM 250 CA ALA A 18 -0.956 13.309 -13.840 1.00 0.00 C ATOM 251 C ALA A 18 -1.127 13.908 -12.451 1.00 0.00 C ATOM 252 O ALA A 18 -1.316 13.167 -11.486 1.00 0.00 O ATOM 253 CB ALA A 18 0.507 13.411 -14.296 1.00 0.00 C ATOM 0 H ALA A 18 -1.308 14.381 -15.590 1.00 0.00 H new ATOM 0 HA ALA A 18 -1.239 12.258 -13.789 1.00 0.00 H new ATOM 0 HB1 ALA A 18 1.149 12.907 -13.574 1.00 0.00 H new ATOM 0 HB2 ALA A 18 0.618 12.939 -15.272 1.00 0.00 H new ATOM 0 HB3 ALA A 18 0.794 14.460 -14.366 1.00 0.00 H new ATOM 259 N GLU A 19 -1.115 15.240 -12.351 1.00 0.00 N ATOM 260 CA GLU A 19 -1.283 15.934 -11.075 1.00 0.00 C ATOM 261 C GLU A 19 -2.609 15.553 -10.454 1.00 0.00 C ATOM 262 O GLU A 19 -2.656 15.251 -9.260 1.00 0.00 O ATOM 263 CB GLU A 19 -1.241 17.471 -11.171 1.00 0.00 C ATOM 264 CG GLU A 19 -0.118 18.026 -12.032 1.00 0.00 C ATOM 265 CD GLU A 19 0.106 19.527 -11.783 1.00 0.00 C ATOM 266 OE1 GLU A 19 -0.526 20.366 -12.470 1.00 0.00 O ATOM 267 OE2 GLU A 19 0.918 19.879 -10.895 1.00 0.00 O1- ATOM 0 H GLU A 19 -0.989 15.863 -13.149 1.00 0.00 H new ATOM 0 HA GLU A 19 -0.434 15.620 -10.468 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -2.193 17.822 -11.570 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -1.146 17.881 -10.166 1.00 0.00 H new ATOM 0 HG2 GLU A 19 0.803 17.482 -11.823 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -0.353 17.863 -13.084 1.00 0.00 H new ATOM 274 N LYS A 20 -3.659 15.548 -11.280 1.00 0.00 N ATOM 275 CA LYS A 20 -5.015 15.265 -10.880 1.00 0.00 C ATOM 276 C LYS A 20 -5.071 13.861 -10.353 1.00 0.00 C ATOM 277 O LYS A 20 -5.433 13.689 -9.200 1.00 0.00 O ATOM 278 CB LYS A 20 -5.979 15.531 -12.050 1.00 0.00 C ATOM 279 CG LYS A 20 -6.125 17.038 -12.313 1.00 0.00 C ATOM 280 CD LYS A 20 -6.827 17.263 -13.660 1.00 0.00 C ATOM 281 CE LYS A 20 -6.835 18.728 -14.120 1.00 0.00 C ATOM 282 NZ LYS A 20 -7.595 19.626 -13.205 1.00 0.00 N1+ ATOM 0 H LYS A 20 -3.572 15.749 -12.276 1.00 0.00 H new ATOM 0 HA LYS A 20 -5.339 15.927 -10.077 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -5.611 15.036 -12.949 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -6.955 15.101 -11.826 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -6.698 17.503 -11.511 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -5.144 17.512 -12.320 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -6.336 16.656 -14.421 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -7.856 16.910 -13.586 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -5.808 19.084 -14.197 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -7.268 18.786 -15.119 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -7.665 20.574 -13.628 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -8.550 19.242 -13.056 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -7.101 19.690 -12.292 1.00 0.00 H new ATOM 296 N ILE A 21 -4.663 12.865 -11.136 1.00 0.00 N ATOM 297 CA ILE A 21 -4.745 11.466 -10.717 1.00 0.00 C ATOM 298 C ILE A 21 -4.098 11.294 -9.346 1.00 0.00 C ATOM 299 O ILE A 21 -4.731 10.819 -8.410 1.00 0.00 O ATOM 300 CB ILE A 21 -4.060 10.567 -11.765 1.00 0.00 C ATOM 301 CG1 ILE A 21 -4.879 10.435 -13.057 1.00 0.00 C ATOM 302 CG2 ILE A 21 -3.857 9.160 -11.189 1.00 0.00 C ATOM 303 CD1 ILE A 21 -3.976 10.403 -14.290 1.00 0.00 C ATOM 0 H ILE A 21 -4.271 13.001 -12.068 1.00 0.00 H new ATOM 0 HA ILE A 21 -5.792 11.171 -10.640 1.00 0.00 H new ATOM 0 HB ILE A 21 -3.108 11.040 -12.006 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -5.477 9.525 -13.019 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -5.575 11.270 -13.135 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -3.373 8.528 -11.934 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -3.230 9.218 -10.299 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -4.824 8.732 -10.924 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -4.588 10.309 -15.187 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -3.397 11.325 -14.341 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -3.298 9.552 -14.223 1.00 0.00 H new ATOM 315 N ARG A 22 -2.827 11.684 -9.233 1.00 0.00 N ATOM 316 CA ARG A 22 -2.057 11.565 -8.001 1.00 0.00 C ATOM 317 C ARG A 22 -2.766 12.282 -6.856 1.00 0.00 C ATOM 318 O ARG A 22 -2.776 11.766 -5.750 1.00 0.00 O ATOM 319 CB ARG A 22 -0.638 12.090 -8.307 1.00 0.00 C ATOM 320 CG ARG A 22 0.278 12.326 -7.085 1.00 0.00 C ATOM 321 CD ARG A 22 0.869 13.737 -6.937 1.00 0.00 C ATOM 322 NE ARG A 22 -0.112 14.782 -7.270 1.00 0.00 N ATOM 323 CZ ARG A 22 -0.079 16.082 -6.930 1.00 0.00 C ATOM 324 NH1 ARG A 22 0.914 16.571 -6.193 1.00 0.00 N1+ ATOM 325 NH2 ARG A 22 -1.048 16.888 -7.349 1.00 0.00 N ATOM 0 H ARG A 22 -2.301 12.095 -10.004 1.00 0.00 H new ATOM 0 HA ARG A 22 -1.972 10.533 -7.662 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -0.146 11.381 -8.973 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -0.730 13.029 -8.853 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -0.290 12.097 -6.183 1.00 0.00 H new ATOM 0 HG3 ARG A 22 1.102 11.614 -7.133 1.00 0.00 H new ATOM 0 HD2 ARG A 22 1.217 13.879 -5.914 1.00 0.00 H new ATOM 0 HD3 ARG A 22 1.739 13.836 -7.586 1.00 0.00 H new ATOM 0 HE ARG A 22 -0.914 14.484 -7.826 1.00 0.00 H new ATOM 0 HH11 ARG A 22 1.665 15.957 -5.877 1.00 0.00 H new ATOM 0 HH12 ARG A 22 0.925 17.560 -5.943 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -1.806 16.519 -7.922 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -1.034 17.876 -7.097 1.00 0.00 H new ATOM 339 N ASP A 23 -3.364 13.432 -7.125 1.00 0.00 N ATOM 340 CA ASP A 23 -4.084 14.208 -6.112 1.00 0.00 C ATOM 341 C ASP A 23 -5.337 13.476 -5.634 1.00 0.00 C ATOM 342 O ASP A 23 -5.567 13.355 -4.431 1.00 0.00 O ATOM 343 CB ASP A 23 -4.469 15.600 -6.623 1.00 0.00 C ATOM 344 CG ASP A 23 -5.260 16.363 -5.548 1.00 0.00 C ATOM 345 OD1 ASP A 23 -4.635 16.832 -4.567 1.00 0.00 O ATOM 346 OD2 ASP A 23 -6.496 16.514 -5.689 1.00 0.00 O1- ATOM 0 H ASP A 23 -3.367 13.859 -8.051 1.00 0.00 H new ATOM 0 HA ASP A 23 -3.400 14.326 -5.272 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -3.571 16.158 -6.889 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -5.068 15.509 -7.529 1.00 0.00 H new ATOM 351 N ILE A 24 -6.121 12.961 -6.584 1.00 0.00 N ATOM 352 CA ILE A 24 -7.398 12.306 -6.335 1.00 0.00 C ATOM 353 C ILE A 24 -7.144 11.016 -5.544 1.00 0.00 C ATOM 354 O ILE A 24 -7.808 10.754 -4.539 1.00 0.00 O ATOM 355 CB ILE A 24 -8.143 12.062 -7.674 1.00 0.00 C ATOM 356 CG1 ILE A 24 -8.497 13.377 -8.428 1.00 0.00 C ATOM 357 CG2 ILE A 24 -9.443 11.274 -7.430 1.00 0.00 C ATOM 358 CD1 ILE A 24 -8.377 13.256 -9.947 1.00 0.00 C ATOM 0 H ILE A 24 -5.874 12.991 -7.573 1.00 0.00 H new ATOM 0 HA ILE A 24 -8.049 12.941 -5.734 1.00 0.00 H new ATOM 0 HB ILE A 24 -7.455 11.492 -8.298 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -9.515 13.670 -8.174 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -7.840 14.174 -8.081 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -9.953 11.111 -8.379 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -9.206 10.312 -6.976 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -10.092 11.840 -6.762 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -8.638 14.208 -10.410 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -7.353 12.993 -10.211 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -9.055 12.481 -10.305 1.00 0.00 H new ATOM 370 N ILE A 25 -6.176 10.219 -6.001 1.00 0.00 N ATOM 371 CA ILE A 25 -5.855 8.919 -5.426 1.00 0.00 C ATOM 372 C ILE A 25 -5.164 9.093 -4.074 1.00 0.00 C ATOM 373 O ILE A 25 -5.587 8.503 -3.079 1.00 0.00 O ATOM 374 CB ILE A 25 -5.039 8.117 -6.456 1.00 0.00 C ATOM 375 CG1 ILE A 25 -5.940 7.845 -7.675 1.00 0.00 C ATOM 376 CG2 ILE A 25 -4.484 6.793 -5.905 1.00 0.00 C ATOM 377 CD1 ILE A 25 -5.230 7.077 -8.775 1.00 0.00 C ATOM 0 H ILE A 25 -5.585 10.467 -6.795 1.00 0.00 H new ATOM 0 HA ILE A 25 -6.757 8.345 -5.214 1.00 0.00 H new ATOM 0 HB ILE A 25 -4.168 8.714 -6.728 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -6.817 7.283 -7.354 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -6.298 8.794 -8.074 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -3.920 6.282 -6.685 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -3.828 6.998 -5.059 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -5.309 6.160 -5.580 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -5.916 6.916 -9.607 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -4.369 7.649 -9.120 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -4.895 6.114 -8.389 1.00 0.00 H new ATOM 389 N GLY A 26 -4.124 9.921 -4.040 1.00 0.00 N ATOM 390 CA GLY A 26 -3.469 10.359 -2.815 1.00 0.00 C ATOM 391 C GLY A 26 -1.993 10.649 -3.065 1.00 0.00 C ATOM 392 O GLY A 26 -1.223 9.716 -3.300 1.00 0.00 O ATOM 0 H GLY A 26 -3.705 10.314 -4.883 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -3.961 11.254 -2.434 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -3.569 9.590 -2.049 1.00 0.00 H new ATOM 396 N PRO A 27 -1.533 11.904 -2.933 1.00 0.00 N ATOM 397 CA PRO A 27 -0.126 12.269 -3.110 1.00 0.00 C ATOM 398 C PRO A 27 0.769 11.776 -1.956 1.00 0.00 C ATOM 399 O PRO A 27 1.971 12.036 -1.938 1.00 0.00 O ATOM 400 CB PRO A 27 -0.147 13.794 -3.257 1.00 0.00 C ATOM 401 CG PRO A 27 -1.324 14.206 -2.382 1.00 0.00 C ATOM 402 CD PRO A 27 -2.325 13.083 -2.606 1.00 0.00 C ATOM 0 HA PRO A 27 0.318 11.789 -3.982 1.00 0.00 H new ATOM 0 HB2 PRO A 27 0.786 14.245 -2.918 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -0.289 14.098 -4.294 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -1.038 14.289 -1.333 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -1.729 15.173 -2.679 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -2.928 12.914 -1.714 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -3.013 13.328 -3.415 1.00 0.00 H new ATOM 410 N GLU A 28 0.188 11.049 -0.996 1.00 0.00 N ATOM 411 CA GLU A 28 0.886 10.410 0.109 1.00 0.00 C ATOM 412 C GLU A 28 1.660 9.201 -0.423 1.00 0.00 C ATOM 413 O GLU A 28 2.727 8.854 0.086 1.00 0.00 O ATOM 414 CB GLU A 28 -0.097 9.922 1.194 1.00 0.00 C ATOM 415 CG GLU A 28 -1.415 10.702 1.290 1.00 0.00 C ATOM 416 CD GLU A 28 -2.224 10.301 2.541 1.00 0.00 C ATOM 417 OE1 GLU A 28 -2.025 10.912 3.620 1.00 0.00 O ATOM 418 OE2 GLU A 28 -3.074 9.382 2.446 1.00 0.00 O1- ATOM 0 H GLU A 28 -0.819 10.887 -0.972 1.00 0.00 H new ATOM 0 HA GLU A 28 1.559 11.144 0.554 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -0.328 8.874 1.005 1.00 0.00 H new ATOM 0 HB3 GLU A 28 0.404 9.969 2.161 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -1.204 11.771 1.320 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -2.012 10.520 0.396 1.00 0.00 H new ATOM 425 N LEU A 29 1.077 8.547 -1.436 1.00 0.00 N ATOM 426 CA LEU A 29 1.498 7.270 -1.969 1.00 0.00 C ATOM 427 C LEU A 29 1.736 7.342 -3.470 1.00 0.00 C ATOM 428 O LEU A 29 2.514 6.538 -3.965 1.00 0.00 O ATOM 429 CB LEU A 29 0.487 6.185 -1.557 1.00 0.00 C ATOM 430 CG LEU A 29 -0.958 6.371 -2.078 1.00 0.00 C ATOM 431 CD1 LEU A 29 -1.423 5.100 -2.794 1.00 0.00 C ATOM 432 CD2 LEU A 29 -1.934 6.715 -0.949 1.00 0.00 C ATOM 0 H LEU A 29 0.262 8.922 -1.921 1.00 0.00 H new ATOM 0 HA LEU A 29 2.463 6.995 -1.542 1.00 0.00 H new ATOM 0 HB2 LEU A 29 0.857 5.221 -1.906 1.00 0.00 H new ATOM 0 HB3 LEU A 29 0.456 6.140 -0.468 1.00 0.00 H new ATOM 0 HG LEU A 29 -0.950 7.207 -2.777 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -2.441 5.239 -3.158 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -0.762 4.894 -3.636 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -1.398 4.261 -2.099 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -2.936 6.837 -1.359 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -1.938 5.910 -0.214 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -1.623 7.643 -0.469 1.00 0.00 H new ATOM 444 N VAL A 30 1.132 8.278 -4.207 1.00 0.00 N ATOM 445 CA VAL A 30 1.431 8.449 -5.630 1.00 0.00 C ATOM 446 C VAL A 30 2.518 9.518 -5.794 1.00 0.00 C ATOM 447 O VAL A 30 2.452 10.552 -5.133 1.00 0.00 O ATOM 448 CB VAL A 30 0.145 8.757 -6.418 1.00 0.00 C ATOM 449 CG1 VAL A 30 0.405 8.727 -7.937 1.00 0.00 C ATOM 450 CG2 VAL A 30 -0.994 7.785 -6.097 1.00 0.00 C ATOM 0 H VAL A 30 0.435 8.927 -3.842 1.00 0.00 H new ATOM 0 HA VAL A 30 1.824 7.523 -6.049 1.00 0.00 H new ATOM 0 HB VAL A 30 -0.160 9.757 -6.109 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -0.520 8.948 -8.469 1.00 0.00 H new ATOM 0 HG12 VAL A 30 1.157 9.473 -8.192 1.00 0.00 H new ATOM 0 HG13 VAL A 30 0.762 7.738 -8.226 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -1.875 8.051 -6.682 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -0.686 6.769 -6.346 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -1.233 7.842 -5.035 1.00 0.00 H new ATOM 460 N THR A 31 3.459 9.314 -6.727 1.00 0.00 N ATOM 461 CA THR A 31 4.519 10.257 -7.055 1.00 0.00 C ATOM 462 C THR A 31 4.573 10.498 -8.567 1.00 0.00 C ATOM 463 O THR A 31 4.591 9.532 -9.322 1.00 0.00 O ATOM 464 CB THR A 31 5.852 9.730 -6.483 1.00 0.00 C ATOM 465 OG1 THR A 31 5.737 9.466 -5.092 1.00 0.00 O ATOM 466 CG2 THR A 31 6.988 10.740 -6.678 1.00 0.00 C ATOM 0 H THR A 31 3.498 8.462 -7.286 1.00 0.00 H new ATOM 0 HA THR A 31 4.320 11.227 -6.599 1.00 0.00 H new ATOM 0 HB THR A 31 6.081 8.813 -7.025 1.00 0.00 H new ATOM 0 HG1 THR A 31 6.593 9.131 -4.751 1.00 0.00 H new ATOM 0 HG21 THR A 31 7.911 10.334 -6.263 1.00 0.00 H new ATOM 0 HG22 THR A 31 7.123 10.934 -7.742 1.00 0.00 H new ATOM 0 HG23 THR A 31 6.739 11.671 -6.168 1.00 0.00 H new ATOM 474 N LEU A 32 4.565 11.761 -9.015 1.00 0.00 N ATOM 475 CA LEU A 32 4.711 12.138 -10.429 1.00 0.00 C ATOM 476 C LEU A 32 6.126 11.883 -10.949 1.00 0.00 C ATOM 477 O LEU A 32 7.091 12.104 -10.216 1.00 0.00 O ATOM 478 CB LEU A 32 4.408 13.631 -10.677 1.00 0.00 C ATOM 479 CG LEU A 32 3.047 14.160 -10.224 1.00 0.00 C ATOM 480 CD1 LEU A 32 2.780 15.532 -10.844 1.00 0.00 C ATOM 481 CD2 LEU A 32 1.918 13.198 -10.591 1.00 0.00 C ATOM 0 H LEU A 32 4.455 12.563 -8.395 1.00 0.00 H new ATOM 0 HA LEU A 32 3.989 11.515 -10.957 1.00 0.00 H new ATOM 0 HB2 LEU A 32 5.180 14.218 -10.179 1.00 0.00 H new ATOM 0 HB3 LEU A 32 4.504 13.820 -11.746 1.00 0.00 H new ATOM 0 HG LEU A 32 3.074 14.250 -9.138 1.00 0.00 H new ATOM 0 HD11 LEU A 32 1.808 15.898 -10.514 1.00 0.00 H new ATOM 0 HD12 LEU A 32 3.556 16.230 -10.530 1.00 0.00 H new ATOM 0 HD13 LEU A 32 2.786 15.448 -11.931 1.00 0.00 H new ATOM 0 HD21 LEU A 32 0.966 13.608 -10.253 1.00 0.00 H new ATOM 0 HD22 LEU A 32 1.892 13.064 -11.672 1.00 0.00 H new ATOM 0 HD23 LEU A 32 2.090 12.235 -10.110 1.00 0.00 H new ATOM 493 N HIS A 33 6.241 11.548 -12.239 1.00 0.00 N ATOM 494 CA HIS A 33 7.485 11.429 -12.972 1.00 0.00 C ATOM 495 C HIS A 33 7.204 11.806 -14.422 1.00 0.00 C ATOM 496 O HIS A 33 6.514 11.058 -15.121 1.00 0.00 O ATOM 497 CB HIS A 33 7.995 9.986 -12.905 1.00 0.00 C ATOM 498 CG HIS A 33 8.545 9.601 -11.555 1.00 0.00 C ATOM 499 ND1 HIS A 33 9.746 10.069 -11.014 1.00 0.00 N ATOM 500 CD2 HIS A 33 7.927 8.787 -10.647 1.00 0.00 C ATOM 501 CE1 HIS A 33 9.818 9.531 -9.785 1.00 0.00 C ATOM 502 NE2 HIS A 33 8.750 8.752 -9.542 1.00 0.00 N ATOM 0 H HIS A 33 5.426 11.345 -12.818 1.00 0.00 H new ATOM 0 HA HIS A 33 8.244 12.083 -12.543 1.00 0.00 H new ATOM 0 HB2 HIS A 33 7.180 9.309 -13.162 1.00 0.00 H new ATOM 0 HB3 HIS A 33 8.772 9.849 -13.657 1.00 0.00 H new ATOM 0 HD1 HIS A 33 10.424 10.688 -11.458 1.00 0.00 H new ATOM 0 HD2 HIS A 33 6.984 8.275 -10.771 1.00 0.00 H new ATOM 0 HE1 HIS A 33 10.624 9.701 -9.087 1.00 0.00 H new ATOM 510 N ASN A 34 7.710 12.947 -14.895 1.00 0.00 N ATOM 511 CA ASN A 34 7.599 13.288 -16.297 1.00 0.00 C ATOM 512 C ASN A 34 8.769 12.677 -17.040 1.00 0.00 C ATOM 513 O ASN A 34 9.915 13.106 -16.903 1.00 0.00 O ATOM 514 CB ASN A 34 7.586 14.784 -16.551 1.00 0.00 C ATOM 515 CG ASN A 34 7.129 15.022 -17.981 1.00 0.00 C ATOM 516 OD1 ASN A 34 7.362 14.250 -18.904 1.00 0.00 O ATOM 517 ND2 ASN A 34 6.458 16.117 -18.195 1.00 0.00 N ATOM 0 H ASN A 34 8.195 13.640 -14.325 1.00 0.00 H new ATOM 0 HA ASN A 34 6.646 12.895 -16.650 1.00 0.00 H new ATOM 0 HB2 ASN A 34 6.916 15.282 -15.850 1.00 0.00 H new ATOM 0 HB3 ASN A 34 8.580 15.204 -16.395 1.00 0.00 H new ATOM 0 HD21 ASN A 34 6.124 16.335 -19.134 1.00 0.00 H new ATOM 0 HD22 ASN A 34 6.266 16.757 -17.424 1.00 0.00 H new ATOM 524 N LEU A 35 8.456 11.721 -17.892 1.00 0.00 N ATOM 525 CA LEU A 35 9.433 10.926 -18.619 1.00 0.00 C ATOM 526 C LEU A 35 10.251 11.730 -19.632 1.00 0.00 C ATOM 527 O LEU A 35 11.261 11.224 -20.127 1.00 0.00 O ATOM 528 CB LEU A 35 8.737 9.753 -19.310 1.00 0.00 C ATOM 529 CG LEU A 35 8.298 8.675 -18.311 1.00 0.00 C ATOM 530 CD1 LEU A 35 7.306 7.750 -19.007 1.00 0.00 C ATOM 531 CD2 LEU A 35 9.494 7.870 -17.780 1.00 0.00 C ATOM 0 H LEU A 35 7.491 11.467 -18.105 1.00 0.00 H new ATOM 0 HA LEU A 35 10.146 10.559 -17.880 1.00 0.00 H new ATOM 0 HB2 LEU A 35 7.866 10.118 -19.855 1.00 0.00 H new ATOM 0 HB3 LEU A 35 9.411 9.313 -20.045 1.00 0.00 H new ATOM 0 HG LEU A 35 7.831 9.157 -17.452 1.00 0.00 H new ATOM 0 HD11 LEU A 35 6.982 6.975 -18.312 1.00 0.00 H new ATOM 0 HD12 LEU A 35 6.442 8.326 -19.338 1.00 0.00 H new ATOM 0 HD13 LEU A 35 7.784 7.286 -19.870 1.00 0.00 H new ATOM 0 HD21 LEU A 35 9.142 7.117 -17.075 1.00 0.00 H new ATOM 0 HD22 LEU A 35 10.001 7.380 -18.611 1.00 0.00 H new ATOM 0 HD23 LEU A 35 10.189 8.541 -17.276 1.00 0.00 H new ATOM 543 N LYS A 36 9.878 12.985 -19.918 1.00 0.00 N ATOM 544 CA LYS A 36 10.725 13.883 -20.693 1.00 0.00 C ATOM 545 C LYS A 36 12.090 14.092 -20.032 1.00 0.00 C ATOM 546 O LYS A 36 13.054 14.424 -20.724 1.00 0.00 O ATOM 547 CB LYS A 36 10.011 15.227 -20.921 1.00 0.00 C ATOM 548 CG LYS A 36 9.968 16.107 -19.661 1.00 0.00 C ATOM 549 CD LYS A 36 9.278 17.448 -19.887 1.00 0.00 C ATOM 550 CE LYS A 36 10.248 18.337 -20.674 1.00 0.00 C ATOM 551 NZ LYS A 36 9.920 19.787 -20.562 1.00 0.00 N1+ ATOM 0 H LYS A 36 8.993 13.396 -19.621 1.00 0.00 H new ATOM 0 HA LYS A 36 10.907 13.416 -21.661 1.00 0.00 H new ATOM 0 HB2 LYS A 36 10.517 15.770 -21.719 1.00 0.00 H new ATOM 0 HB3 LYS A 36 8.992 15.038 -21.260 1.00 0.00 H new ATOM 0 HG2 LYS A 36 9.450 15.569 -18.867 1.00 0.00 H new ATOM 0 HG3 LYS A 36 10.986 16.284 -19.314 1.00 0.00 H new ATOM 0 HD2 LYS A 36 8.348 17.313 -20.439 1.00 0.00 H new ATOM 0 HD3 LYS A 36 9.019 17.912 -18.935 1.00 0.00 H new ATOM 0 HE2 LYS A 36 11.263 18.169 -20.313 1.00 0.00 H new ATOM 0 HE3 LYS A 36 10.231 18.045 -21.724 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 10.606 20.342 -21.112 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 8.963 19.956 -20.931 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 9.962 20.076 -19.564 1.00 0.00 H new ATOM 565 N ASP A 37 12.157 13.951 -18.707 1.00 0.00 N ATOM 566 CA ASP A 37 13.302 14.360 -17.903 1.00 0.00 C ATOM 567 C ASP A 37 13.605 13.356 -16.780 1.00 0.00 C ATOM 568 O ASP A 37 14.765 13.194 -16.395 1.00 0.00 O ATOM 569 CB ASP A 37 12.977 15.740 -17.321 1.00 0.00 C ATOM 570 CG ASP A 37 14.138 16.251 -16.452 1.00 0.00 C ATOM 571 OD1 ASP A 37 15.197 16.619 -17.015 1.00 0.00 O ATOM 572 OD2 ASP A 37 13.983 16.331 -15.209 1.00 0.00 O1- ATOM 0 H ASP A 37 11.402 13.542 -18.156 1.00 0.00 H new ATOM 0 HA ASP A 37 14.195 14.397 -18.527 1.00 0.00 H new ATOM 0 HB2 ASP A 37 12.784 16.445 -18.130 1.00 0.00 H new ATOM 0 HB3 ASP A 37 12.067 15.683 -16.724 1.00 0.00 H new ATOM 577 N ASP A 38 12.587 12.644 -16.284 1.00 0.00 N ATOM 578 CA ASP A 38 12.705 11.577 -15.305 1.00 0.00 C ATOM 579 C ASP A 38 12.957 10.264 -16.043 1.00 0.00 C ATOM 580 O ASP A 38 12.419 10.037 -17.131 1.00 0.00 O ATOM 581 CB ASP A 38 11.454 11.450 -14.417 1.00 0.00 C ATOM 582 CG ASP A 38 11.302 12.624 -13.430 1.00 0.00 C ATOM 583 OD1 ASP A 38 12.212 12.824 -12.586 1.00 0.00 O1- ATOM 584 OD2 ASP A 38 10.270 13.339 -13.488 1.00 0.00 O ATOM 0 H ASP A 38 11.622 12.808 -16.571 1.00 0.00 H new ATOM 0 HA ASP A 38 13.537 11.814 -14.642 1.00 0.00 H new ATOM 0 HB2 ASP A 38 10.568 11.396 -15.050 1.00 0.00 H new ATOM 0 HB3 ASP A 38 11.504 10.515 -13.858 1.00 0.00 H new ATOM 589 N SER A 39 13.751 9.378 -15.445 1.00 0.00 N ATOM 590 CA SER A 39 14.067 8.070 -16.005 1.00 0.00 C ATOM 591 C SER A 39 12.943 7.090 -15.648 1.00 0.00 C ATOM 592 O SER A 39 12.389 7.192 -14.561 1.00 0.00 O ATOM 593 CB SER A 39 15.438 7.593 -15.496 1.00 0.00 C ATOM 594 OG SER A 39 16.423 8.602 -15.680 1.00 0.00 O ATOM 0 H SER A 39 14.198 9.553 -14.545 1.00 0.00 H new ATOM 0 HA SER A 39 14.134 8.129 -17.091 1.00 0.00 H new ATOM 0 HB2 SER A 39 15.369 7.334 -14.439 1.00 0.00 H new ATOM 0 HB3 SER A 39 15.734 6.688 -16.027 1.00 0.00 H new ATOM 0 HG SER A 39 17.287 8.280 -15.349 1.00 0.00 H new ATOM 600 N PRO A 40 12.622 6.081 -16.476 1.00 0.00 N ATOM 601 CA PRO A 40 11.616 5.078 -16.146 1.00 0.00 C ATOM 602 C PRO A 40 12.183 4.015 -15.195 1.00 0.00 C ATOM 603 O PRO A 40 11.412 3.245 -14.648 1.00 0.00 O ATOM 604 CB PRO A 40 11.214 4.521 -17.517 1.00 0.00 C ATOM 605 CG PRO A 40 12.554 4.485 -18.246 1.00 0.00 C ATOM 606 CD PRO A 40 13.149 5.823 -17.809 1.00 0.00 C ATOM 0 HA PRO A 40 10.756 5.475 -15.606 1.00 0.00 H new ATOM 0 HB2 PRO A 40 10.764 3.531 -17.440 1.00 0.00 H new ATOM 0 HB3 PRO A 40 10.491 5.161 -18.022 1.00 0.00 H new ATOM 0 HG2 PRO A 40 13.169 3.639 -17.940 1.00 0.00 H new ATOM 0 HG3 PRO A 40 12.435 4.418 -19.327 1.00 0.00 H new ATOM 0 HD2 PRO A 40 14.238 5.780 -17.796 1.00 0.00 H new ATOM 0 HD3 PRO A 40 12.869 6.618 -18.500 1.00 0.00 H new ATOM 614 N LYS A 41 13.501 3.953 -14.953 1.00 0.00 N ATOM 615 CA LYS A 41 14.143 2.898 -14.152 1.00 0.00 C ATOM 616 C LYS A 41 13.542 2.816 -12.750 1.00 0.00 C ATOM 617 O LYS A 41 13.303 1.741 -12.221 1.00 0.00 O ATOM 618 CB LYS A 41 15.657 3.186 -14.067 1.00 0.00 C ATOM 619 CG LYS A 41 16.426 2.960 -15.385 1.00 0.00 C ATOM 620 CD LYS A 41 16.914 1.514 -15.572 1.00 0.00 C ATOM 621 CE LYS A 41 17.766 1.406 -16.849 1.00 0.00 C ATOM 622 NZ LYS A 41 18.387 0.063 -17.016 1.00 0.00 N1+ ATOM 0 H LYS A 41 14.160 4.643 -15.313 1.00 0.00 H new ATOM 0 HA LYS A 41 13.972 1.937 -14.637 1.00 0.00 H new ATOM 0 HB2 LYS A 41 15.800 4.219 -13.750 1.00 0.00 H new ATOM 0 HB3 LYS A 41 16.092 2.552 -13.294 1.00 0.00 H new ATOM 0 HG2 LYS A 41 15.782 3.229 -16.222 1.00 0.00 H new ATOM 0 HG3 LYS A 41 17.284 3.631 -15.415 1.00 0.00 H new ATOM 0 HD2 LYS A 41 17.500 1.205 -14.707 1.00 0.00 H new ATOM 0 HD3 LYS A 41 16.061 0.839 -15.636 1.00 0.00 H new ATOM 0 HE2 LYS A 41 17.142 1.623 -17.716 1.00 0.00 H new ATOM 0 HE3 LYS A 41 18.550 2.163 -16.823 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 19.233 0.144 -17.615 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 18.657 -0.313 -16.085 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 17.705 -0.581 -17.465 1.00 0.00 H new ATOM 636 N LEU A 42 13.188 3.964 -12.176 1.00 0.00 N ATOM 637 CA LEU A 42 12.554 4.049 -10.864 1.00 0.00 C ATOM 638 C LEU A 42 11.157 3.430 -10.834 1.00 0.00 C ATOM 639 O LEU A 42 10.700 3.013 -9.773 1.00 0.00 O ATOM 640 CB LEU A 42 12.599 5.474 -10.297 1.00 0.00 C ATOM 641 CG LEU A 42 12.645 6.681 -11.243 1.00 0.00 C ATOM 642 CD1 LEU A 42 11.265 6.899 -11.835 1.00 0.00 C ATOM 643 CD2 LEU A 42 13.099 7.941 -10.507 1.00 0.00 C ATOM 0 H LEU A 42 13.336 4.873 -12.616 1.00 0.00 H new ATOM 0 HA LEU A 42 13.150 3.433 -10.190 1.00 0.00 H new ATOM 0 HB2 LEU A 42 11.723 5.596 -9.660 1.00 0.00 H new ATOM 0 HB3 LEU A 42 13.474 5.537 -9.650 1.00 0.00 H new ATOM 0 HG LEU A 42 13.365 6.478 -12.036 1.00 0.00 H new ATOM 0 HD11 LEU A 42 11.289 7.755 -12.509 1.00 0.00 H new ATOM 0 HD12 LEU A 42 10.962 6.010 -12.389 1.00 0.00 H new ATOM 0 HD13 LEU A 42 10.551 7.088 -11.033 1.00 0.00 H new ATOM 0 HD21 LEU A 42 13.122 8.780 -11.202 1.00 0.00 H new ATOM 0 HD22 LEU A 42 12.403 8.160 -9.697 1.00 0.00 H new ATOM 0 HD23 LEU A 42 14.096 7.783 -10.096 1.00 0.00 H new ATOM 655 N MET A 43 10.513 3.274 -11.984 1.00 0.00 N ATOM 656 CA MET A 43 9.271 2.511 -12.141 1.00 0.00 C ATOM 657 C MET A 43 9.451 1.026 -11.773 1.00 0.00 C ATOM 658 O MET A 43 8.465 0.327 -11.568 1.00 0.00 O ATOM 659 CB MET A 43 8.603 2.786 -13.512 1.00 0.00 C ATOM 660 CG MET A 43 8.680 1.687 -14.579 1.00 0.00 C ATOM 661 SD MET A 43 7.575 1.909 -16.013 1.00 0.00 S ATOM 662 CE MET A 43 7.772 3.672 -16.393 1.00 0.00 C ATOM 0 H MET A 43 10.844 3.683 -12.858 1.00 0.00 H new ATOM 0 HA MET A 43 8.548 2.872 -11.410 1.00 0.00 H new ATOM 0 HB2 MET A 43 7.550 3.006 -13.333 1.00 0.00 H new ATOM 0 HB3 MET A 43 9.051 3.688 -13.928 1.00 0.00 H new ATOM 0 HG2 MET A 43 9.707 1.626 -14.939 1.00 0.00 H new ATOM 0 HG3 MET A 43 8.449 0.731 -14.109 1.00 0.00 H new ATOM 0 HE1 MET A 43 7.644 3.830 -17.464 1.00 0.00 H new ATOM 0 HE2 MET A 43 7.023 4.247 -15.849 1.00 0.00 H new ATOM 0 HE3 MET A 43 8.768 3.999 -16.094 1.00 0.00 H new ATOM 672 N GLU A 44 10.688 0.532 -11.640 1.00 0.00 N ATOM 673 CA GLU A 44 10.962 -0.830 -11.191 1.00 0.00 C ATOM 674 C GLU A 44 10.709 -0.971 -9.681 1.00 0.00 C ATOM 675 O GLU A 44 10.371 -2.065 -9.232 1.00 0.00 O ATOM 676 CB GLU A 44 12.400 -1.239 -11.556 1.00 0.00 C ATOM 677 CG GLU A 44 12.613 -1.274 -13.073 1.00 0.00 C ATOM 678 CD GLU A 44 14.039 -1.723 -13.439 1.00 0.00 C ATOM 679 OE1 GLU A 44 14.997 -0.923 -13.334 1.00 0.00 O1- ATOM 680 OE2 GLU A 44 14.192 -2.888 -13.862 1.00 0.00 O ATOM 0 H GLU A 44 11.529 1.073 -11.843 1.00 0.00 H new ATOM 0 HA GLU A 44 10.278 -1.506 -11.705 1.00 0.00 H new ATOM 0 HB2 GLU A 44 13.103 -0.538 -11.106 1.00 0.00 H new ATOM 0 HB3 GLU A 44 12.617 -2.221 -11.136 1.00 0.00 H new ATOM 0 HG2 GLU A 44 11.891 -1.953 -13.526 1.00 0.00 H new ATOM 0 HG3 GLU A 44 12.425 -0.284 -13.489 1.00 0.00 H new ATOM 687 N GLN A 45 10.827 0.112 -8.900 1.00 0.00 N ATOM 688 CA GLN A 45 10.736 0.055 -7.437 1.00 0.00 C ATOM 689 C GLN A 45 9.278 -0.094 -7.007 1.00 0.00 C ATOM 690 O GLN A 45 8.928 -0.940 -6.186 1.00 0.00 O ATOM 691 CB GLN A 45 11.296 1.318 -6.756 1.00 0.00 C ATOM 692 CG GLN A 45 12.583 1.904 -7.350 1.00 0.00 C ATOM 693 CD GLN A 45 12.718 3.372 -6.947 1.00 0.00 C ATOM 694 OE1 GLN A 45 13.609 3.764 -6.197 1.00 0.00 O ATOM 695 NE2 GLN A 45 11.807 4.207 -7.438 1.00 0.00 N ATOM 0 H GLN A 45 10.988 1.050 -9.266 1.00 0.00 H new ATOM 0 HA GLN A 45 11.333 -0.803 -7.128 1.00 0.00 H new ATOM 0 HB2 GLN A 45 10.526 2.089 -6.783 1.00 0.00 H new ATOM 0 HB3 GLN A 45 11.479 1.087 -5.707 1.00 0.00 H new ATOM 0 HG2 GLN A 45 13.447 1.340 -6.998 1.00 0.00 H new ATOM 0 HG3 GLN A 45 12.566 1.816 -8.436 1.00 0.00 H new ATOM 0 HE21 GLN A 45 11.077 3.858 -8.059 1.00 0.00 H new ATOM 0 HE22 GLN A 45 11.838 5.197 -7.194 1.00 0.00 H new ATOM 704 N TYR A 46 8.445 0.794 -7.561 1.00 0.00 N ATOM 705 CA TYR A 46 7.065 1.001 -7.167 1.00 0.00 C ATOM 706 C TYR A 46 6.282 -0.266 -7.488 1.00 0.00 C ATOM 707 O TYR A 46 6.531 -0.927 -8.493 1.00 0.00 O ATOM 708 CB TYR A 46 6.479 2.221 -7.895 1.00 0.00 C ATOM 709 CG TYR A 46 7.148 3.553 -7.617 1.00 0.00 C ATOM 710 CD1 TYR A 46 6.863 4.275 -6.446 1.00 0.00 C ATOM 711 CD2 TYR A 46 8.034 4.095 -8.566 1.00 0.00 C ATOM 712 CE1 TYR A 46 7.472 5.522 -6.216 1.00 0.00 C ATOM 713 CE2 TYR A 46 8.651 5.337 -8.347 1.00 0.00 C ATOM 714 CZ TYR A 46 8.371 6.058 -7.165 1.00 0.00 C ATOM 715 OH TYR A 46 8.969 7.267 -6.964 1.00 0.00 O ATOM 0 H TYR A 46 8.734 1.406 -8.324 1.00 0.00 H new ATOM 0 HA TYR A 46 7.002 1.203 -6.098 1.00 0.00 H new ATOM 0 HB2 TYR A 46 6.523 2.033 -8.968 1.00 0.00 H new ATOM 0 HB3 TYR A 46 5.425 2.305 -7.629 1.00 0.00 H new ATOM 0 HD1 TYR A 46 6.174 3.871 -5.719 1.00 0.00 H new ATOM 0 HD2 TYR A 46 8.242 3.549 -9.474 1.00 0.00 H new ATOM 0 HE1 TYR A 46 7.252 6.071 -5.312 1.00 0.00 H new ATOM 0 HE2 TYR A 46 9.336 5.739 -9.079 1.00 0.00 H new ATOM 0 HH TYR A 46 8.924 7.795 -7.788 1.00 0.00 H new ATOM 725 N ASP A 47 5.323 -0.605 -6.643 1.00 0.00 N ATOM 726 CA ASP A 47 4.547 -1.847 -6.786 1.00 0.00 C ATOM 727 C ASP A 47 3.522 -1.719 -7.915 1.00 0.00 C ATOM 728 O ASP A 47 3.087 -2.713 -8.496 1.00 0.00 O ATOM 729 CB ASP A 47 3.828 -2.174 -5.469 1.00 0.00 C ATOM 730 CG ASP A 47 4.801 -2.550 -4.343 1.00 0.00 C ATOM 731 OD1 ASP A 47 5.421 -3.638 -4.406 1.00 0.00 O ATOM 732 OD2 ASP A 47 4.955 -1.740 -3.397 1.00 0.00 O1- ATOM 0 H ASP A 47 5.054 -0.037 -5.839 1.00 0.00 H new ATOM 0 HA ASP A 47 5.237 -2.655 -7.031 1.00 0.00 H new ATOM 0 HB2 ASP A 47 3.235 -1.313 -5.160 1.00 0.00 H new ATOM 0 HB3 ASP A 47 3.133 -2.997 -5.634 1.00 0.00 H new ATOM 737 N VAL A 48 3.111 -0.487 -8.220 1.00 0.00 N ATOM 738 CA VAL A 48 1.990 -0.163 -9.082 1.00 0.00 C ATOM 739 C VAL A 48 2.395 1.090 -9.837 1.00 0.00 C ATOM 740 O VAL A 48 2.978 1.989 -9.229 1.00 0.00 O ATOM 741 CB VAL A 48 0.783 0.087 -8.165 1.00 0.00 C ATOM 742 CG1 VAL A 48 -0.361 0.736 -8.926 1.00 0.00 C ATOM 743 CG2 VAL A 48 0.312 -1.211 -7.499 1.00 0.00 C ATOM 0 H VAL A 48 3.576 0.344 -7.853 1.00 0.00 H new ATOM 0 HA VAL A 48 1.730 -0.947 -9.793 1.00 0.00 H new ATOM 0 HB VAL A 48 1.107 0.774 -7.383 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -1.200 0.900 -8.250 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -0.031 1.691 -9.334 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -0.673 0.082 -9.740 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -0.543 -1.001 -6.857 1.00 0.00 H new ATOM 0 HG22 VAL A 48 0.022 -1.929 -8.266 1.00 0.00 H new ATOM 0 HG23 VAL A 48 1.122 -1.627 -6.900 1.00 0.00 H new ATOM 753 N LEU A 49 2.070 1.193 -11.126 1.00 0.00 N ATOM 754 CA LEU A 49 2.296 2.402 -11.887 1.00 0.00 C ATOM 755 C LEU A 49 1.015 2.856 -12.571 1.00 0.00 C ATOM 756 O LEU A 49 0.128 2.052 -12.843 1.00 0.00 O ATOM 757 CB LEU A 49 3.394 2.243 -12.950 1.00 0.00 C ATOM 758 CG LEU A 49 4.759 1.606 -12.660 1.00 0.00 C ATOM 759 CD1 LEU A 49 5.361 1.998 -11.315 1.00 0.00 C ATOM 760 CD2 LEU A 49 4.758 0.085 -12.796 1.00 0.00 C ATOM 0 H LEU A 49 1.644 0.437 -11.663 1.00 0.00 H new ATOM 0 HA LEU A 49 2.627 3.151 -11.168 1.00 0.00 H new ATOM 0 HB2 LEU A 49 2.953 1.669 -13.765 1.00 0.00 H new ATOM 0 HB3 LEU A 49 3.596 3.242 -13.336 1.00 0.00 H new ATOM 0 HG LEU A 49 5.398 2.023 -13.438 1.00 0.00 H new ATOM 0 HD11 LEU A 49 6.325 1.504 -11.190 1.00 0.00 H new ATOM 0 HD12 LEU A 49 5.500 3.079 -11.279 1.00 0.00 H new ATOM 0 HD13 LEU A 49 4.690 1.692 -10.513 1.00 0.00 H new ATOM 0 HD21 LEU A 49 5.754 -0.300 -12.577 1.00 0.00 H new ATOM 0 HD22 LEU A 49 4.041 -0.343 -12.095 1.00 0.00 H new ATOM 0 HD23 LEU A 49 4.478 -0.189 -13.813 1.00 0.00 H new ATOM 772 N ILE A 50 0.952 4.135 -12.925 1.00 0.00 N ATOM 773 CA ILE A 50 -0.075 4.692 -13.798 1.00 0.00 C ATOM 774 C ILE A 50 0.700 5.394 -14.897 1.00 0.00 C ATOM 775 O ILE A 50 1.560 6.207 -14.569 1.00 0.00 O ATOM 776 CB ILE A 50 -0.994 5.618 -12.996 1.00 0.00 C ATOM 777 CG1 ILE A 50 -1.790 4.791 -11.966 1.00 0.00 C ATOM 778 CG2 ILE A 50 -1.961 6.406 -13.892 1.00 0.00 C ATOM 779 CD1 ILE A 50 -1.362 5.176 -10.559 1.00 0.00 C ATOM 0 H ILE A 50 1.628 4.829 -12.606 1.00 0.00 H new ATOM 0 HA ILE A 50 -0.743 3.947 -14.230 1.00 0.00 H new ATOM 0 HB ILE A 50 -0.362 6.346 -12.487 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -2.858 4.966 -12.092 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -1.620 3.727 -12.130 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -2.590 7.047 -13.274 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -1.392 7.020 -14.590 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -2.589 5.711 -14.449 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -1.926 4.590 -9.834 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -0.297 4.978 -10.436 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -1.555 6.237 -10.397 1.00 0.00 H new ATOM 791 N LEU A 51 0.471 5.039 -16.159 1.00 0.00 N ATOM 792 CA LEU A 51 1.262 5.512 -17.294 1.00 0.00 C ATOM 793 C LEU A 51 0.343 6.235 -18.267 1.00 0.00 C ATOM 794 O LEU A 51 -0.732 5.725 -18.575 1.00 0.00 O ATOM 795 CB LEU A 51 1.987 4.342 -17.987 1.00 0.00 C ATOM 796 CG LEU A 51 3.348 3.965 -17.388 1.00 0.00 C ATOM 797 CD1 LEU A 51 3.258 3.586 -15.918 1.00 0.00 C ATOM 798 CD2 LEU A 51 3.912 2.758 -18.135 1.00 0.00 C ATOM 0 H LEU A 51 -0.281 4.404 -16.427 1.00 0.00 H new ATOM 0 HA LEU A 51 2.028 6.201 -16.939 1.00 0.00 H new ATOM 0 HB2 LEU A 51 1.340 3.466 -17.955 1.00 0.00 H new ATOM 0 HB3 LEU A 51 2.129 4.596 -19.038 1.00 0.00 H new ATOM 0 HG LEU A 51 3.987 4.843 -17.484 1.00 0.00 H new ATOM 0 HD11 LEU A 51 4.250 3.329 -15.547 1.00 0.00 H new ATOM 0 HD12 LEU A 51 2.865 4.428 -15.349 1.00 0.00 H new ATOM 0 HD13 LEU A 51 2.594 2.729 -15.803 1.00 0.00 H new ATOM 0 HD21 LEU A 51 4.879 2.488 -17.712 1.00 0.00 H new ATOM 0 HD22 LEU A 51 3.226 1.917 -18.038 1.00 0.00 H new ATOM 0 HD23 LEU A 51 4.034 3.007 -19.189 1.00 0.00 H new ATOM 810 N GLY A 52 0.776 7.391 -18.771 1.00 0.00 N ATOM 811 CA GLY A 52 -0.061 8.244 -19.605 1.00 0.00 C ATOM 812 C GLY A 52 0.643 8.688 -20.868 1.00 0.00 C ATOM 813 O GLY A 52 1.695 9.312 -20.751 1.00 0.00 O ATOM 0 H GLY A 52 1.714 7.759 -18.611 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -0.972 7.707 -19.870 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -0.363 9.122 -19.034 1.00 0.00 H new ATOM 817 N ILE A 53 0.080 8.415 -22.050 1.00 0.00 N ATOM 818 CA ILE A 53 0.640 8.834 -23.343 1.00 0.00 C ATOM 819 C ILE A 53 -0.370 9.697 -24.114 1.00 0.00 C ATOM 820 O ILE A 53 -1.521 9.290 -24.280 1.00 0.00 O ATOM 821 CB ILE A 53 1.145 7.668 -24.233 1.00 0.00 C ATOM 822 CG1 ILE A 53 0.119 6.589 -24.608 1.00 0.00 C ATOM 823 CG2 ILE A 53 2.390 6.969 -23.670 1.00 0.00 C ATOM 824 CD1 ILE A 53 -0.408 5.776 -23.431 1.00 0.00 C ATOM 0 H ILE A 53 -0.790 7.889 -22.138 1.00 0.00 H new ATOM 0 HA ILE A 53 1.524 9.423 -23.100 1.00 0.00 H new ATOM 0 HB ILE A 53 1.386 8.204 -25.151 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -0.723 7.066 -25.109 1.00 0.00 H new ATOM 0 HG13 ILE A 53 0.574 5.908 -25.328 1.00 0.00 H new ATOM 0 HG21 ILE A 53 2.690 6.164 -24.341 1.00 0.00 H new ATOM 0 HG22 ILE A 53 3.203 7.690 -23.581 1.00 0.00 H new ATOM 0 HG23 ILE A 53 2.162 6.556 -22.687 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -1.126 5.039 -23.790 1.00 0.00 H new ATOM 0 HD12 ILE A 53 0.421 5.266 -22.941 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -0.896 6.441 -22.719 1.00 0.00 H new ATOM 836 N PRO A 54 0.031 10.868 -24.622 1.00 0.00 N ATOM 837 CA PRO A 54 -0.759 11.640 -25.574 1.00 0.00 C ATOM 838 C PRO A 54 -0.474 11.087 -26.984 1.00 0.00 C ATOM 839 O PRO A 54 0.681 10.799 -27.304 1.00 0.00 O ATOM 840 CB PRO A 54 -0.297 13.085 -25.356 1.00 0.00 C ATOM 841 CG PRO A 54 1.174 12.929 -24.943 1.00 0.00 C ATOM 842 CD PRO A 54 1.251 11.573 -24.264 1.00 0.00 C ATOM 0 HA PRO A 54 -1.840 11.583 -25.448 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -0.399 13.681 -26.263 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -0.882 13.581 -24.581 1.00 0.00 H new ATOM 0 HG2 PRO A 54 1.834 12.974 -25.809 1.00 0.00 H new ATOM 0 HG3 PRO A 54 1.481 13.727 -24.267 1.00 0.00 H new ATOM 0 HD2 PRO A 54 2.131 11.021 -24.596 1.00 0.00 H new ATOM 0 HD3 PRO A 54 1.333 11.684 -23.183 1.00 0.00 H new ATOM 850 N THR A 55 -1.491 10.937 -27.841 1.00 0.00 N ATOM 851 CA THR A 55 -1.259 10.519 -29.223 1.00 0.00 C ATOM 852 C THR A 55 -0.983 11.782 -30.051 1.00 0.00 C ATOM 853 O THR A 55 -1.798 12.706 -30.040 1.00 0.00 O ATOM 854 CB THR A 55 -2.436 9.704 -29.767 1.00 0.00 C ATOM 855 OG1 THR A 55 -2.698 8.596 -28.915 1.00 0.00 O ATOM 856 CG2 THR A 55 -2.077 9.117 -31.128 1.00 0.00 C ATOM 0 H THR A 55 -2.470 11.097 -27.603 1.00 0.00 H new ATOM 0 HA THR A 55 -0.397 9.854 -29.281 1.00 0.00 H new ATOM 0 HB THR A 55 -3.298 10.368 -29.832 1.00 0.00 H new ATOM 0 HG1 THR A 55 -3.455 8.806 -28.329 1.00 0.00 H new ATOM 0 HG21 THR A 55 -2.919 8.539 -31.508 1.00 0.00 H new ATOM 0 HG22 THR A 55 -1.848 9.924 -31.823 1.00 0.00 H new ATOM 0 HG23 THR A 55 -1.207 8.468 -31.026 1.00 0.00 H new ATOM 864 N TRP A 56 0.129 11.820 -30.776 1.00 0.00 N ATOM 865 CA TRP A 56 0.519 12.873 -31.693 1.00 0.00 C ATOM 866 C TRP A 56 0.515 12.339 -33.135 1.00 0.00 C ATOM 867 O TRP A 56 0.327 11.143 -33.350 1.00 0.00 O ATOM 868 CB TRP A 56 1.899 13.427 -31.297 1.00 0.00 C ATOM 869 CG TRP A 56 1.931 14.488 -30.235 1.00 0.00 C ATOM 870 CD1 TRP A 56 2.112 14.272 -28.914 1.00 0.00 C ATOM 871 CD2 TRP A 56 1.859 15.942 -30.388 1.00 0.00 C ATOM 872 NE1 TRP A 56 2.279 15.483 -28.262 1.00 0.00 N ATOM 873 CE2 TRP A 56 2.056 16.541 -29.109 1.00 0.00 C ATOM 874 CE3 TRP A 56 1.665 16.826 -31.474 1.00 0.00 C ATOM 875 CZ2 TRP A 56 2.031 17.926 -28.904 1.00 0.00 C ATOM 876 CZ3 TRP A 56 1.640 18.224 -31.284 1.00 0.00 C ATOM 877 CH2 TRP A 56 1.806 18.776 -29.998 1.00 0.00 C ATOM 0 H TRP A 56 0.820 11.071 -30.734 1.00 0.00 H new ATOM 0 HA TRP A 56 -0.198 13.692 -31.638 1.00 0.00 H new ATOM 0 HB2 TRP A 56 2.515 12.593 -30.960 1.00 0.00 H new ATOM 0 HB3 TRP A 56 2.371 13.831 -32.193 1.00 0.00 H new ATOM 0 HD1 TRP A 56 2.125 13.303 -28.438 1.00 0.00 H new ATOM 0 HE1 TRP A 56 2.535 15.577 -27.279 1.00 0.00 H new ATOM 0 HE3 TRP A 56 1.533 16.424 -32.468 1.00 0.00 H new ATOM 0 HZ2 TRP A 56 2.183 18.335 -27.916 1.00 0.00 H new ATOM 0 HZ3 TRP A 56 1.492 18.877 -32.132 1.00 0.00 H new ATOM 0 HH2 TRP A 56 1.760 19.846 -29.855 1.00 0.00 H new ATOM 888 N ASP A 57 0.711 13.248 -34.098 1.00 0.00 N ATOM 889 CA ASP A 57 0.974 13.044 -35.529 1.00 0.00 C ATOM 890 C ASP A 57 0.527 11.685 -36.097 1.00 0.00 C ATOM 891 O ASP A 57 1.346 10.886 -36.559 1.00 0.00 O ATOM 892 CB ASP A 57 2.445 13.363 -35.835 1.00 0.00 C ATOM 893 CG ASP A 57 2.737 13.346 -37.351 1.00 0.00 C ATOM 894 OD1 ASP A 57 1.891 13.826 -38.146 1.00 0.00 O1- ATOM 895 OD2 ASP A 57 3.854 12.937 -37.750 1.00 0.00 O ATOM 0 H ASP A 57 0.687 14.243 -33.873 1.00 0.00 H new ATOM 0 HA ASP A 57 0.334 13.747 -36.061 1.00 0.00 H new ATOM 0 HB2 ASP A 57 2.696 14.343 -35.428 1.00 0.00 H new ATOM 0 HB3 ASP A 57 3.085 12.637 -35.334 1.00 0.00 H new ATOM 900 N PHE A 58 -0.789 11.439 -36.071 1.00 0.00 N ATOM 901 CA PHE A 58 -1.420 10.222 -36.585 1.00 0.00 C ATOM 902 C PHE A 58 -0.827 8.954 -35.958 1.00 0.00 C ATOM 903 O PHE A 58 -0.142 8.163 -36.620 1.00 0.00 O ATOM 904 CB PHE A 58 -1.411 10.203 -38.122 1.00 0.00 C ATOM 905 CG PHE A 58 -2.141 11.370 -38.748 1.00 0.00 C ATOM 906 CD1 PHE A 58 -3.525 11.497 -38.552 1.00 0.00 C ATOM 907 CD2 PHE A 58 -1.447 12.331 -39.507 1.00 0.00 C ATOM 908 CE1 PHE A 58 -4.228 12.565 -39.140 1.00 0.00 C ATOM 909 CE2 PHE A 58 -2.146 13.408 -40.085 1.00 0.00 C ATOM 910 CZ PHE A 58 -3.538 13.521 -39.907 1.00 0.00 C ATOM 0 H PHE A 58 -1.460 12.100 -35.681 1.00 0.00 H new ATOM 0 HA PHE A 58 -2.466 10.232 -36.280 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -0.378 10.203 -38.471 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -1.865 9.274 -38.468 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -4.052 10.773 -37.948 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -0.380 12.242 -39.646 1.00 0.00 H new ATOM 0 HE1 PHE A 58 -5.296 12.650 -39.002 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -1.614 14.148 -40.665 1.00 0.00 H new ATOM 0 HZ PHE A 58 -4.076 14.341 -40.359 1.00 0.00 H new ATOM 920 N GLY A 59 -1.133 8.728 -34.674 1.00 0.00 N ATOM 921 CA GLY A 59 -0.714 7.522 -33.976 1.00 0.00 C ATOM 922 C GLY A 59 0.769 7.459 -33.606 1.00 0.00 C ATOM 923 O GLY A 59 1.273 6.400 -33.226 1.00 0.00 O ATOM 0 H GLY A 59 -1.674 9.375 -34.100 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -1.303 7.428 -33.064 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -0.952 6.660 -34.600 1.00 0.00 H new ATOM 927 N GLU A 60 1.469 8.578 -33.696 1.00 0.00 N ATOM 928 CA GLU A 60 2.800 8.735 -33.166 1.00 0.00 C ATOM 929 C GLU A 60 2.722 8.918 -31.650 1.00 0.00 C ATOM 930 O GLU A 60 1.748 9.436 -31.089 1.00 0.00 O ATOM 931 CB GLU A 60 3.558 9.888 -33.844 1.00 0.00 C ATOM 932 CG GLU A 60 3.978 9.551 -35.282 1.00 0.00 C ATOM 933 CD GLU A 60 5.207 8.625 -35.340 1.00 0.00 C ATOM 934 OE1 GLU A 60 5.062 7.390 -35.165 1.00 0.00 O ATOM 935 OE2 GLU A 60 6.333 9.126 -35.585 1.00 0.00 O1- ATOM 0 H GLU A 60 1.113 9.418 -34.152 1.00 0.00 H new ATOM 0 HA GLU A 60 3.371 7.832 -33.383 1.00 0.00 H new ATOM 0 HB2 GLU A 60 2.928 10.777 -33.852 1.00 0.00 H new ATOM 0 HB3 GLU A 60 4.444 10.130 -33.258 1.00 0.00 H new ATOM 0 HG2 GLU A 60 3.144 9.074 -35.798 1.00 0.00 H new ATOM 0 HG3 GLU A 60 4.198 10.474 -35.818 1.00 0.00 H new ATOM 942 N ILE A 61 3.785 8.486 -30.983 1.00 0.00 N ATOM 943 CA ILE A 61 4.018 8.692 -29.567 1.00 0.00 C ATOM 944 C ILE A 61 4.759 10.037 -29.449 1.00 0.00 C ATOM 945 O ILE A 61 5.524 10.399 -30.354 1.00 0.00 O ATOM 946 CB ILE A 61 4.848 7.509 -29.022 1.00 0.00 C ATOM 947 CG1 ILE A 61 4.260 6.110 -29.314 1.00 0.00 C ATOM 948 CG2 ILE A 61 5.044 7.630 -27.508 1.00 0.00 C ATOM 949 CD1 ILE A 61 5.365 5.046 -29.344 1.00 0.00 C ATOM 0 H ILE A 61 4.535 7.963 -31.435 1.00 0.00 H new ATOM 0 HA ILE A 61 3.100 8.729 -28.981 1.00 0.00 H new ATOM 0 HB ILE A 61 5.795 7.581 -29.557 1.00 0.00 H new ATOM 0 HG12 ILE A 61 3.524 5.854 -28.552 1.00 0.00 H new ATOM 0 HG13 ILE A 61 3.737 6.124 -30.270 1.00 0.00 H new ATOM 0 HG21 ILE A 61 5.631 6.785 -27.148 1.00 0.00 H new ATOM 0 HG22 ILE A 61 5.568 8.559 -27.282 1.00 0.00 H new ATOM 0 HG23 ILE A 61 4.072 7.632 -27.014 1.00 0.00 H new ATOM 0 HD11 ILE A 61 4.925 4.070 -29.551 1.00 0.00 H new ATOM 0 HD12 ILE A 61 6.086 5.292 -30.124 1.00 0.00 H new ATOM 0 HD13 ILE A 61 5.870 5.019 -28.378 1.00 0.00 H new ATOM 961 N GLN A 62 4.559 10.778 -28.351 1.00 0.00 N ATOM 962 CA GLN A 62 5.365 11.955 -28.085 1.00 0.00 C ATOM 963 C GLN A 62 6.815 11.527 -27.872 1.00 0.00 C ATOM 964 O GLN A 62 7.098 10.479 -27.288 1.00 0.00 O ATOM 965 CB GLN A 62 4.810 12.774 -26.905 1.00 0.00 C ATOM 966 CG GLN A 62 5.577 14.068 -26.556 1.00 0.00 C ATOM 967 CD GLN A 62 5.836 15.066 -27.696 1.00 0.00 C ATOM 968 OE1 GLN A 62 5.416 14.902 -28.835 1.00 0.00 O ATOM 969 NE2 GLN A 62 6.602 16.108 -27.417 1.00 0.00 N ATOM 0 H GLN A 62 3.851 10.578 -27.645 1.00 0.00 H new ATOM 0 HA GLN A 62 5.325 12.622 -28.946 1.00 0.00 H new ATOM 0 HB2 GLN A 62 3.776 13.037 -27.127 1.00 0.00 H new ATOM 0 HB3 GLN A 62 4.794 12.136 -26.022 1.00 0.00 H new ATOM 0 HG2 GLN A 62 5.024 14.587 -25.773 1.00 0.00 H new ATOM 0 HG3 GLN A 62 6.540 13.785 -26.131 1.00 0.00 H new ATOM 0 HE21 GLN A 62 6.952 16.245 -26.469 1.00 0.00 H new ATOM 0 HE22 GLN A 62 6.843 16.775 -28.150 1.00 0.00 H new ATOM 978 N GLU A 63 7.737 12.366 -28.324 1.00 0.00 N ATOM 979 CA GLU A 63 9.165 12.050 -28.339 1.00 0.00 C ATOM 980 C GLU A 63 9.719 11.801 -26.926 1.00 0.00 C ATOM 981 O GLU A 63 10.663 11.030 -26.757 1.00 0.00 O ATOM 982 CB GLU A 63 9.949 13.157 -29.067 1.00 0.00 C ATOM 983 CG GLU A 63 9.996 14.479 -28.286 1.00 0.00 C ATOM 984 CD GLU A 63 10.657 15.597 -29.112 1.00 0.00 C ATOM 985 OE1 GLU A 63 11.905 15.728 -29.072 1.00 0.00 O1- ATOM 986 OE2 GLU A 63 9.936 16.362 -29.800 1.00 0.00 O ATOM 0 H GLU A 63 7.517 13.291 -28.693 1.00 0.00 H new ATOM 0 HA GLU A 63 9.294 11.118 -28.889 1.00 0.00 H new ATOM 0 HB2 GLU A 63 10.967 12.813 -29.248 1.00 0.00 H new ATOM 0 HB3 GLU A 63 9.494 13.334 -30.042 1.00 0.00 H new ATOM 0 HG2 GLU A 63 8.984 14.777 -28.012 1.00 0.00 H new ATOM 0 HG3 GLU A 63 10.549 14.335 -27.358 1.00 0.00 H new ATOM 993 N ASP A 64 9.107 12.412 -25.907 1.00 0.00 N ATOM 994 CA ASP A 64 9.465 12.210 -24.504 1.00 0.00 C ATOM 995 C ASP A 64 9.200 10.778 -24.035 1.00 0.00 C ATOM 996 O ASP A 64 9.917 10.271 -23.169 1.00 0.00 O ATOM 997 CB ASP A 64 8.756 13.220 -23.587 1.00 0.00 C ATOM 998 CG ASP A 64 7.224 13.304 -23.659 1.00 0.00 C ATOM 999 OD1 ASP A 64 6.557 12.303 -23.997 1.00 0.00 O1- ATOM 1000 OD2 ASP A 64 6.701 14.411 -23.394 1.00 0.00 O ATOM 0 H ASP A 64 8.338 13.070 -26.038 1.00 0.00 H new ATOM 0 HA ASP A 64 10.539 12.382 -24.435 1.00 0.00 H new ATOM 0 HB2 ASP A 64 9.030 12.987 -22.558 1.00 0.00 H new ATOM 0 HB3 ASP A 64 9.156 14.210 -23.807 1.00 0.00 H new ATOM 1005 N TRP A 65 8.235 10.107 -24.651 1.00 0.00 N ATOM 1006 CA TRP A 65 7.922 8.719 -24.422 1.00 0.00 C ATOM 1007 C TRP A 65 8.746 7.828 -25.335 1.00 0.00 C ATOM 1008 O TRP A 65 9.263 6.818 -24.867 1.00 0.00 O ATOM 1009 CB TRP A 65 6.422 8.479 -24.562 1.00 0.00 C ATOM 1010 CG TRP A 65 5.692 8.389 -23.271 1.00 0.00 C ATOM 1011 CD1 TRP A 65 4.809 9.291 -22.797 1.00 0.00 C ATOM 1012 CD2 TRP A 65 5.720 7.299 -22.307 1.00 0.00 C ATOM 1013 NE1 TRP A 65 4.237 8.792 -21.647 1.00 0.00 N ATOM 1014 CE2 TRP A 65 4.755 7.569 -21.298 1.00 0.00 C ATOM 1015 CE3 TRP A 65 6.448 6.098 -22.203 1.00 0.00 C ATOM 1016 CZ2 TRP A 65 4.495 6.678 -20.250 1.00 0.00 C ATOM 1017 CZ3 TRP A 65 6.231 5.219 -21.129 1.00 0.00 C ATOM 1018 CH2 TRP A 65 5.259 5.505 -20.160 1.00 0.00 C ATOM 0 H TRP A 65 7.631 10.540 -25.349 1.00 0.00 H new ATOM 0 HA TRP A 65 8.190 8.456 -23.399 1.00 0.00 H new ATOM 0 HB2 TRP A 65 5.991 9.286 -25.154 1.00 0.00 H new ATOM 0 HB3 TRP A 65 6.265 7.556 -25.120 1.00 0.00 H new ATOM 0 HD1 TRP A 65 4.586 10.248 -23.245 1.00 0.00 H new ATOM 0 HE1 TRP A 65 3.512 9.275 -21.116 1.00 0.00 H new ATOM 0 HE3 TRP A 65 7.181 5.850 -22.957 1.00 0.00 H new ATOM 0 HZ2 TRP A 65 3.722 6.889 -19.526 1.00 0.00 H new ATOM 0 HZ3 TRP A 65 6.818 4.316 -21.049 1.00 0.00 H new ATOM 0 HH2 TRP A 65 5.098 4.820 -19.341 1.00 0.00 H new ATOM 1029 N GLU A 66 8.936 8.207 -26.600 1.00 0.00 N ATOM 1030 CA GLU A 66 9.798 7.467 -27.525 1.00 0.00 C ATOM 1031 C GLU A 66 11.209 7.301 -26.948 1.00 0.00 C ATOM 1032 O GLU A 66 11.829 6.248 -27.109 1.00 0.00 O ATOM 1033 CB GLU A 66 9.894 8.157 -28.892 1.00 0.00 C ATOM 1034 CG GLU A 66 8.568 8.199 -29.654 1.00 0.00 C ATOM 1035 CD GLU A 66 8.775 8.688 -31.098 1.00 0.00 C ATOM 1036 OE1 GLU A 66 9.202 9.851 -31.306 1.00 0.00 O1- ATOM 1037 OE2 GLU A 66 8.527 7.899 -32.042 1.00 0.00 O ATOM 0 H GLU A 66 8.499 9.032 -27.011 1.00 0.00 H new ATOM 0 HA GLU A 66 9.341 6.487 -27.660 1.00 0.00 H new ATOM 0 HB2 GLU A 66 10.254 9.176 -28.750 1.00 0.00 H new ATOM 0 HB3 GLU A 66 10.636 7.639 -29.500 1.00 0.00 H new ATOM 0 HG2 GLU A 66 8.119 7.206 -29.664 1.00 0.00 H new ATOM 0 HG3 GLU A 66 7.870 8.859 -29.140 1.00 0.00 H new ATOM 1044 N ALA A 67 11.694 8.317 -26.226 1.00 0.00 N ATOM 1045 CA ALA A 67 13.013 8.325 -25.608 1.00 0.00 C ATOM 1046 C ALA A 67 13.171 7.210 -24.571 1.00 0.00 C ATOM 1047 O ALA A 67 14.277 6.700 -24.388 1.00 0.00 O ATOM 1048 CB ALA A 67 13.267 9.695 -24.968 1.00 0.00 C ATOM 0 H ALA A 67 11.165 9.172 -26.055 1.00 0.00 H new ATOM 0 HA ALA A 67 13.753 8.140 -26.387 1.00 0.00 H new ATOM 0 HB1 ALA A 67 14.254 9.703 -24.505 1.00 0.00 H new ATOM 0 HB2 ALA A 67 13.219 10.469 -25.734 1.00 0.00 H new ATOM 0 HB3 ALA A 67 12.509 9.888 -24.209 1.00 0.00 H new ATOM 1054 N VAL A 68 12.084 6.821 -23.894 1.00 0.00 N ATOM 1055 CA VAL A 68 12.104 5.790 -22.866 1.00 0.00 C ATOM 1056 C VAL A 68 11.483 4.478 -23.335 1.00 0.00 C ATOM 1057 O VAL A 68 11.703 3.464 -22.680 1.00 0.00 O ATOM 1058 CB VAL A 68 11.485 6.332 -21.567 1.00 0.00 C ATOM 1059 CG1 VAL A 68 12.295 7.516 -21.018 1.00 0.00 C ATOM 1060 CG2 VAL A 68 10.023 6.746 -21.720 1.00 0.00 C ATOM 0 H VAL A 68 11.159 7.221 -24.051 1.00 0.00 H new ATOM 0 HA VAL A 68 13.143 5.537 -22.653 1.00 0.00 H new ATOM 0 HB VAL A 68 11.518 5.503 -20.860 1.00 0.00 H new ATOM 0 HG11 VAL A 68 11.833 7.878 -20.099 1.00 0.00 H new ATOM 0 HG12 VAL A 68 13.315 7.193 -20.809 1.00 0.00 H new ATOM 0 HG13 VAL A 68 12.312 8.318 -21.756 1.00 0.00 H new ATOM 0 HG21 VAL A 68 9.649 7.119 -20.767 1.00 0.00 H new ATOM 0 HG22 VAL A 68 9.944 7.530 -22.473 1.00 0.00 H new ATOM 0 HG23 VAL A 68 9.431 5.885 -22.030 1.00 0.00 H new ATOM 1070 N TRP A 69 10.783 4.462 -24.473 1.00 0.00 N ATOM 1071 CA TRP A 69 10.109 3.289 -25.030 1.00 0.00 C ATOM 1072 C TRP A 69 11.067 2.113 -25.202 1.00 0.00 C ATOM 1073 O TRP A 69 10.665 0.955 -25.108 1.00 0.00 O ATOM 1074 CB TRP A 69 9.485 3.676 -26.378 1.00 0.00 C ATOM 1075 CG TRP A 69 8.189 3.000 -26.700 1.00 0.00 C ATOM 1076 CD1 TRP A 69 8.015 1.892 -27.458 1.00 0.00 C ATOM 1077 CD2 TRP A 69 6.845 3.442 -26.348 1.00 0.00 C ATOM 1078 NE1 TRP A 69 6.664 1.601 -27.544 1.00 0.00 N ATOM 1079 CE2 TRP A 69 5.908 2.571 -26.963 1.00 0.00 C ATOM 1080 CE3 TRP A 69 6.315 4.517 -25.612 1.00 0.00 C ATOM 1081 CZ2 TRP A 69 4.532 2.774 -26.927 1.00 0.00 C ATOM 1082 CZ3 TRP A 69 4.926 4.734 -25.551 1.00 0.00 C ATOM 1083 CH2 TRP A 69 4.041 3.895 -26.256 1.00 0.00 C ATOM 0 H TRP A 69 10.667 5.295 -25.050 1.00 0.00 H new ATOM 0 HA TRP A 69 9.333 2.966 -24.336 1.00 0.00 H new ATOM 0 HB2 TRP A 69 9.326 4.754 -26.390 1.00 0.00 H new ATOM 0 HB3 TRP A 69 10.200 3.450 -27.169 1.00 0.00 H new ATOM 0 HD1 TRP A 69 8.807 1.323 -27.923 1.00 0.00 H new ATOM 0 HE1 TRP A 69 6.284 0.765 -27.987 1.00 0.00 H new ATOM 0 HE3 TRP A 69 6.982 5.184 -25.087 1.00 0.00 H new ATOM 0 HZ2 TRP A 69 3.859 2.080 -27.408 1.00 0.00 H new ATOM 0 HZ3 TRP A 69 4.536 5.549 -24.960 1.00 0.00 H new ATOM 0 HH2 TRP A 69 2.985 4.119 -26.277 1.00 0.00 H new ATOM 1094 N ASP A 70 12.343 2.425 -25.417 1.00 0.00 N ATOM 1095 CA ASP A 70 13.418 1.455 -25.576 1.00 0.00 C ATOM 1096 C ASP A 70 13.759 0.797 -24.241 1.00 0.00 C ATOM 1097 O ASP A 70 13.854 -0.426 -24.142 1.00 0.00 O ATOM 1098 CB ASP A 70 14.650 2.139 -26.173 1.00 0.00 C ATOM 1099 CG ASP A 70 15.831 1.157 -26.258 1.00 0.00 C ATOM 1100 OD1 ASP A 70 15.847 0.307 -27.181 1.00 0.00 O ATOM 1101 OD2 ASP A 70 16.754 1.247 -25.414 1.00 0.00 O1- ATOM 0 H ASP A 70 12.665 3.390 -25.487 1.00 0.00 H new ATOM 0 HA ASP A 70 13.085 0.672 -26.257 1.00 0.00 H new ATOM 0 HB2 ASP A 70 14.415 2.519 -27.167 1.00 0.00 H new ATOM 0 HB3 ASP A 70 14.928 2.997 -25.561 1.00 0.00 H new ATOM 1106 N GLN A 71 13.862 1.613 -23.188 1.00 0.00 N ATOM 1107 CA GLN A 71 14.160 1.171 -21.836 1.00 0.00 C ATOM 1108 C GLN A 71 13.028 0.386 -21.221 1.00 0.00 C ATOM 1109 O GLN A 71 13.324 -0.487 -20.421 1.00 0.00 O ATOM 1110 CB GLN A 71 14.502 2.367 -20.930 1.00 0.00 C ATOM 1111 CG GLN A 71 15.978 2.758 -21.041 1.00 0.00 C ATOM 1112 CD GLN A 71 16.242 4.090 -20.344 1.00 0.00 C ATOM 1113 OE1 GLN A 71 16.550 4.139 -19.156 1.00 0.00 O ATOM 1114 NE2 GLN A 71 16.067 5.197 -21.051 1.00 0.00 N ATOM 0 H GLN A 71 13.736 2.623 -23.261 1.00 0.00 H new ATOM 0 HA GLN A 71 15.023 0.510 -21.914 1.00 0.00 H new ATOM 0 HB2 GLN A 71 13.879 3.219 -21.201 1.00 0.00 H new ATOM 0 HB3 GLN A 71 14.268 2.118 -19.895 1.00 0.00 H new ATOM 0 HG2 GLN A 71 16.599 1.981 -20.596 1.00 0.00 H new ATOM 0 HG3 GLN A 71 16.261 2.830 -22.091 1.00 0.00 H new ATOM 0 HE21 GLN A 71 15.811 5.138 -22.037 1.00 0.00 H new ATOM 0 HE22 GLN A 71 16.188 6.109 -20.610 1.00 0.00 H new ATOM 1123 N LEU A 72 11.766 0.632 -21.581 1.00 0.00 N ATOM 1124 CA LEU A 72 10.634 -0.073 -20.958 1.00 0.00 C ATOM 1125 C LEU A 72 10.798 -1.585 -21.085 1.00 0.00 C ATOM 1126 O LEU A 72 10.397 -2.325 -20.195 1.00 0.00 O ATOM 1127 CB LEU A 72 9.294 0.303 -21.609 1.00 0.00 C ATOM 1128 CG LEU A 72 9.002 1.801 -21.752 1.00 0.00 C ATOM 1129 CD1 LEU A 72 7.621 2.020 -22.361 1.00 0.00 C ATOM 1130 CD2 LEU A 72 9.175 2.593 -20.456 1.00 0.00 C ATOM 0 H LEU A 72 11.499 1.309 -22.296 1.00 0.00 H new ATOM 0 HA LEU A 72 10.629 0.228 -19.910 1.00 0.00 H new ATOM 0 HB2 LEU A 72 9.257 -0.148 -22.601 1.00 0.00 H new ATOM 0 HB3 LEU A 72 8.492 -0.147 -21.024 1.00 0.00 H new ATOM 0 HG LEU A 72 9.757 2.197 -22.431 1.00 0.00 H new ATOM 0 HD11 LEU A 72 7.430 3.089 -22.455 1.00 0.00 H new ATOM 0 HD12 LEU A 72 7.580 1.556 -23.346 1.00 0.00 H new ATOM 0 HD13 LEU A 72 6.864 1.572 -21.717 1.00 0.00 H new ATOM 0 HD21 LEU A 72 8.950 3.644 -20.639 1.00 0.00 H new ATOM 0 HD22 LEU A 72 8.495 2.203 -19.698 1.00 0.00 H new ATOM 0 HD23 LEU A 72 10.203 2.497 -20.106 1.00 0.00 H new ATOM 1142 N ASP A 73 11.409 -2.031 -22.182 1.00 0.00 N ATOM 1143 CA ASP A 73 11.689 -3.443 -22.437 1.00 0.00 C ATOM 1144 C ASP A 73 12.682 -4.015 -21.430 1.00 0.00 C ATOM 1145 O ASP A 73 12.554 -5.174 -21.029 1.00 0.00 O ATOM 1146 CB ASP A 73 12.227 -3.636 -23.858 1.00 0.00 C ATOM 1147 CG ASP A 73 12.511 -5.121 -24.135 1.00 0.00 C ATOM 1148 OD1 ASP A 73 11.540 -5.910 -24.232 1.00 0.00 O1- ATOM 1149 OD2 ASP A 73 13.698 -5.497 -24.284 1.00 0.00 O ATOM 0 H ASP A 73 11.728 -1.413 -22.928 1.00 0.00 H new ATOM 0 HA ASP A 73 10.748 -3.983 -22.329 1.00 0.00 H new ATOM 0 HB2 ASP A 73 11.503 -3.258 -24.580 1.00 0.00 H new ATOM 0 HB3 ASP A 73 13.140 -3.056 -23.988 1.00 0.00 H new ATOM 1154 N ASP A 74 13.632 -3.191 -20.976 1.00 0.00 N ATOM 1155 CA ASP A 74 14.678 -3.609 -20.056 1.00 0.00 C ATOM 1156 C ASP A 74 14.140 -3.697 -18.627 1.00 0.00 C ATOM 1157 O ASP A 74 14.643 -4.473 -17.813 1.00 0.00 O ATOM 1158 CB ASP A 74 15.856 -2.626 -20.126 1.00 0.00 C ATOM 1159 CG ASP A 74 16.917 -2.924 -19.057 1.00 0.00 C ATOM 1160 OD1 ASP A 74 17.644 -3.939 -19.186 1.00 0.00 O ATOM 1161 OD2 ASP A 74 17.053 -2.106 -18.112 1.00 0.00 O1- ATOM 0 H ASP A 74 13.691 -2.208 -21.243 1.00 0.00 H new ATOM 0 HA ASP A 74 15.024 -4.600 -20.348 1.00 0.00 H new ATOM 0 HB2 ASP A 74 16.313 -2.677 -21.114 1.00 0.00 H new ATOM 0 HB3 ASP A 74 15.487 -1.608 -19.997 1.00 0.00 H new ATOM 1166 N LEU A 75 13.098 -2.916 -18.325 1.00 0.00 N ATOM 1167 CA LEU A 75 12.635 -2.732 -16.962 1.00 0.00 C ATOM 1168 C LEU A 75 11.913 -3.963 -16.479 1.00 0.00 C ATOM 1169 O LEU A 75 11.261 -4.691 -17.226 1.00 0.00 O ATOM 1170 CB LEU A 75 11.720 -1.514 -16.768 1.00 0.00 C ATOM 1171 CG LEU A 75 12.269 -0.261 -17.425 1.00 0.00 C ATOM 1172 CD1 LEU A 75 11.397 0.965 -17.229 1.00 0.00 C ATOM 1173 CD2 LEU A 75 13.728 0.095 -17.143 1.00 0.00 C ATOM 0 H LEU A 75 12.560 -2.400 -19.021 1.00 0.00 H new ATOM 0 HA LEU A 75 13.536 -2.552 -16.375 1.00 0.00 H new ATOM 0 HB2 LEU A 75 10.735 -1.734 -17.181 1.00 0.00 H new ATOM 0 HB3 LEU A 75 11.585 -1.332 -15.702 1.00 0.00 H new ATOM 0 HG LEU A 75 12.243 -0.563 -18.472 1.00 0.00 H new ATOM 0 HD11 LEU A 75 11.854 1.820 -17.727 1.00 0.00 H new ATOM 0 HD12 LEU A 75 10.411 0.782 -17.655 1.00 0.00 H new ATOM 0 HD13 LEU A 75 11.299 1.175 -16.164 1.00 0.00 H new ATOM 0 HD21 LEU A 75 13.988 1.011 -17.674 1.00 0.00 H new ATOM 0 HD22 LEU A 75 13.866 0.245 -16.072 1.00 0.00 H new ATOM 0 HD23 LEU A 75 14.372 -0.716 -17.482 1.00 0.00 H new ATOM 1185 N ASN A 76 11.975 -4.105 -15.176 1.00 0.00 N ATOM 1186 CA ASN A 76 11.256 -5.103 -14.417 1.00 0.00 C ATOM 1187 C ASN A 76 9.863 -4.571 -14.115 1.00 0.00 C ATOM 1188 O ASN A 76 9.722 -3.726 -13.229 1.00 0.00 O ATOM 1189 CB ASN A 76 12.004 -5.464 -13.129 1.00 0.00 C ATOM 1190 CG ASN A 76 11.157 -6.401 -12.270 1.00 0.00 C ATOM 1191 OD1 ASN A 76 10.957 -7.562 -12.613 1.00 0.00 O ATOM 1192 ND2 ASN A 76 10.606 -5.914 -11.166 1.00 0.00 N ATOM 0 H ASN A 76 12.553 -3.502 -14.590 1.00 0.00 H new ATOM 0 HA ASN A 76 11.176 -6.019 -15.002 1.00 0.00 H new ATOM 0 HB2 ASN A 76 12.953 -5.941 -13.373 1.00 0.00 H new ATOM 0 HB3 ASN A 76 12.237 -4.558 -12.570 1.00 0.00 H new ATOM 0 HD21 ASN A 76 10.008 -6.507 -10.590 1.00 0.00 H new ATOM 0 HD22 ASN A 76 10.781 -4.947 -10.893 1.00 0.00 H new ATOM 1199 N LEU A 77 8.842 -5.049 -14.831 1.00 0.00 N ATOM 1200 CA LEU A 77 7.432 -4.739 -14.585 1.00 0.00 C ATOM 1201 C LEU A 77 6.576 -5.979 -14.390 1.00 0.00 C ATOM 1202 O LEU A 77 5.358 -5.910 -14.267 1.00 0.00 O ATOM 1203 CB LEU A 77 6.804 -3.893 -15.711 1.00 0.00 C ATOM 1204 CG LEU A 77 7.632 -2.763 -16.325 1.00 0.00 C ATOM 1205 CD1 LEU A 77 6.881 -2.170 -17.524 1.00 0.00 C ATOM 1206 CD2 LEU A 77 7.929 -1.636 -15.338 1.00 0.00 C ATOM 0 H LEU A 77 8.978 -5.680 -15.620 1.00 0.00 H new ATOM 0 HA LEU A 77 7.441 -4.163 -13.660 1.00 0.00 H new ATOM 0 HB2 LEU A 77 6.521 -4.571 -16.516 1.00 0.00 H new ATOM 0 HB3 LEU A 77 5.884 -3.456 -15.323 1.00 0.00 H new ATOM 0 HG LEU A 77 8.583 -3.202 -16.628 1.00 0.00 H new ATOM 0 HD11 LEU A 77 7.471 -1.365 -17.961 1.00 0.00 H new ATOM 0 HD12 LEU A 77 6.717 -2.947 -18.271 1.00 0.00 H new ATOM 0 HD13 LEU A 77 5.920 -1.777 -17.193 1.00 0.00 H new ATOM 0 HD21 LEU A 77 8.519 -0.865 -15.833 1.00 0.00 H new ATOM 0 HD22 LEU A 77 6.992 -1.205 -14.985 1.00 0.00 H new ATOM 0 HD23 LEU A 77 8.488 -2.033 -14.490 1.00 0.00 H new ATOM 1218 N GLU A 78 7.230 -7.112 -14.380 1.00 0.00 N ATOM 1219 CA GLU A 78 6.616 -8.414 -14.435 1.00 0.00 C ATOM 1220 C GLU A 78 5.870 -8.623 -13.111 1.00 0.00 C ATOM 1221 O GLU A 78 6.474 -8.671 -12.037 1.00 0.00 O ATOM 1222 CB GLU A 78 7.683 -9.479 -14.755 1.00 0.00 C ATOM 1223 CG GLU A 78 8.106 -9.554 -16.243 1.00 0.00 C ATOM 1224 CD GLU A 78 8.891 -8.351 -16.829 1.00 0.00 C ATOM 1225 OE1 GLU A 78 9.409 -7.494 -16.074 1.00 0.00 O ATOM 1226 OE2 GLU A 78 9.042 -8.282 -18.077 1.00 0.00 O1- ATOM 0 H GLU A 78 8.248 -7.154 -14.331 1.00 0.00 H new ATOM 0 HA GLU A 78 5.884 -8.503 -15.238 1.00 0.00 H new ATOM 0 HB2 GLU A 78 8.568 -9.278 -14.151 1.00 0.00 H new ATOM 0 HB3 GLU A 78 7.304 -10.455 -14.451 1.00 0.00 H new ATOM 0 HG2 GLU A 78 8.715 -10.448 -16.374 1.00 0.00 H new ATOM 0 HG3 GLU A 78 7.205 -9.691 -16.842 1.00 0.00 H new ATOM 1233 N GLY A 79 4.540 -8.681 -13.203 1.00 0.00 N ATOM 1234 CA GLY A 79 3.621 -8.792 -12.077 1.00 0.00 C ATOM 1235 C GLY A 79 3.240 -7.469 -11.420 1.00 0.00 C ATOM 1236 O GLY A 79 2.576 -7.472 -10.384 1.00 0.00 O ATOM 0 H GLY A 79 4.058 -8.650 -14.101 1.00 0.00 H new ATOM 0 HA2 GLY A 79 2.711 -9.286 -12.418 1.00 0.00 H new ATOM 0 HA3 GLY A 79 4.071 -9.438 -11.323 1.00 0.00 H new ATOM 1240 N LYS A 80 3.598 -6.336 -12.025 1.00 0.00 N ATOM 1241 CA LYS A 80 3.190 -5.013 -11.570 1.00 0.00 C ATOM 1242 C LYS A 80 1.819 -4.696 -12.086 1.00 0.00 C ATOM 1243 O LYS A 80 1.431 -5.167 -13.155 1.00 0.00 O ATOM 1244 CB LYS A 80 4.155 -3.899 -12.010 1.00 0.00 C ATOM 1245 CG LYS A 80 5.460 -4.045 -11.255 1.00 0.00 C ATOM 1246 CD LYS A 80 6.303 -2.775 -11.394 1.00 0.00 C ATOM 1247 CE LYS A 80 7.738 -2.968 -10.889 1.00 0.00 C ATOM 1248 NZ LYS A 80 7.825 -3.214 -9.418 1.00 0.00 N1+ ATOM 0 H LYS A 80 4.188 -6.315 -12.857 1.00 0.00 H new ATOM 0 HA LYS A 80 3.199 -5.045 -10.481 1.00 0.00 H new ATOM 0 HB2 LYS A 80 4.333 -3.959 -13.084 1.00 0.00 H new ATOM 0 HB3 LYS A 80 3.715 -2.921 -11.814 1.00 0.00 H new ATOM 0 HG2 LYS A 80 5.258 -4.241 -10.202 1.00 0.00 H new ATOM 0 HG3 LYS A 80 6.015 -4.901 -11.638 1.00 0.00 H new ATOM 0 HD2 LYS A 80 6.327 -2.471 -12.440 1.00 0.00 H new ATOM 0 HD3 LYS A 80 5.831 -1.966 -10.837 1.00 0.00 H new ATOM 0 HE2 LYS A 80 8.191 -3.807 -11.417 1.00 0.00 H new ATOM 0 HE3 LYS A 80 8.324 -2.083 -11.136 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 8.810 -3.100 -9.105 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 7.221 -2.533 -8.916 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 7.505 -4.181 -9.208 1.00 0.00 H new ATOM 1262 N ILE A 81 1.110 -3.849 -11.354 1.00 0.00 N ATOM 1263 CA ILE A 81 -0.125 -3.284 -11.876 1.00 0.00 C ATOM 1264 C ILE A 81 0.217 -2.023 -12.648 1.00 0.00 C ATOM 1265 O ILE A 81 1.074 -1.250 -12.224 1.00 0.00 O ATOM 1266 CB ILE A 81 -1.186 -3.060 -10.793 1.00 0.00 C ATOM 1267 CG1 ILE A 81 -1.482 -4.373 -10.044 1.00 0.00 C ATOM 1268 CG2 ILE A 81 -2.490 -2.599 -11.463 1.00 0.00 C ATOM 1269 CD1 ILE A 81 -1.526 -4.215 -8.540 1.00 0.00 C ATOM 0 H ILE A 81 1.362 -3.542 -10.414 1.00 0.00 H new ATOM 0 HA ILE A 81 -0.590 -4.000 -12.553 1.00 0.00 H new ATOM 0 HB ILE A 81 -0.814 -2.313 -10.092 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -2.437 -4.770 -10.387 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -0.720 -5.108 -10.302 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -3.253 -2.436 -10.701 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -2.313 -1.669 -12.003 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -2.831 -3.364 -12.160 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -1.739 -5.179 -8.079 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -0.563 -3.847 -8.184 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -2.307 -3.504 -8.272 1.00 0.00 H new ATOM 1281 N VAL A 82 -0.480 -1.818 -13.757 1.00 0.00 N ATOM 1282 CA VAL A 82 -0.371 -0.658 -14.602 1.00 0.00 C ATOM 1283 C VAL A 82 -1.776 -0.165 -14.937 1.00 0.00 C ATOM 1284 O VAL A 82 -2.606 -0.941 -15.403 1.00 0.00 O ATOM 1285 CB VAL A 82 0.431 -1.017 -15.867 1.00 0.00 C ATOM 1286 CG1 VAL A 82 0.530 0.181 -16.820 1.00 0.00 C ATOM 1287 CG2 VAL A 82 1.844 -1.498 -15.503 1.00 0.00 C ATOM 0 H VAL A 82 -1.165 -2.492 -14.099 1.00 0.00 H new ATOM 0 HA VAL A 82 0.162 0.145 -14.093 1.00 0.00 H new ATOM 0 HB VAL A 82 -0.102 -1.824 -16.370 1.00 0.00 H new ATOM 0 HG11 VAL A 82 1.102 -0.103 -17.703 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -0.471 0.491 -17.120 1.00 0.00 H new ATOM 0 HG13 VAL A 82 1.030 1.007 -16.315 1.00 0.00 H new ATOM 0 HG21 VAL A 82 2.390 -1.745 -16.413 1.00 0.00 H new ATOM 0 HG22 VAL A 82 2.371 -0.708 -14.967 1.00 0.00 H new ATOM 0 HG23 VAL A 82 1.775 -2.382 -14.870 1.00 0.00 H new ATOM 1297 N ALA A 83 -2.060 1.119 -14.745 1.00 0.00 N ATOM 1298 CA ALA A 83 -3.247 1.754 -15.266 1.00 0.00 C ATOM 1299 C ALA A 83 -2.823 2.646 -16.428 1.00 0.00 C ATOM 1300 O ALA A 83 -2.040 3.570 -16.205 1.00 0.00 O ATOM 1301 CB ALA A 83 -3.944 2.525 -14.147 1.00 0.00 C ATOM 0 H ALA A 83 -1.458 1.749 -14.215 1.00 0.00 H new ATOM 0 HA ALA A 83 -3.968 1.026 -15.638 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -4.841 3.005 -14.540 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -4.221 1.837 -13.349 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -3.269 3.285 -13.753 1.00 0.00 H new ATOM 1307 N LEU A 84 -3.295 2.388 -17.650 1.00 0.00 N ATOM 1308 CA LEU A 84 -3.017 3.263 -18.787 1.00 0.00 C ATOM 1309 C LEU A 84 -4.072 4.345 -18.928 1.00 0.00 C ATOM 1310 O LEU A 84 -5.265 4.088 -18.784 1.00 0.00 O ATOM 1311 CB LEU A 84 -2.914 2.485 -20.111 1.00 0.00 C ATOM 1312 CG LEU A 84 -1.686 1.579 -20.261 1.00 0.00 C ATOM 1313 CD1 LEU A 84 -1.628 0.985 -21.671 1.00 0.00 C ATOM 1314 CD2 LEU A 84 -0.394 2.364 -20.001 1.00 0.00 C ATOM 0 H LEU A 84 -3.872 1.578 -17.876 1.00 0.00 H new ATOM 0 HA LEU A 84 -2.051 3.725 -18.580 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -3.809 1.873 -20.221 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -2.915 3.202 -20.932 1.00 0.00 H new ATOM 0 HG LEU A 84 -1.775 0.777 -19.528 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -0.750 0.345 -21.760 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -2.527 0.397 -21.855 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -1.565 1.790 -22.403 1.00 0.00 H new ATOM 0 HD21 LEU A 84 0.464 1.701 -20.113 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -0.315 3.183 -20.716 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -0.411 2.767 -18.988 1.00 0.00 H new ATOM 1326 N TYR A 85 -3.631 5.541 -19.304 1.00 0.00 N ATOM 1327 CA TYR A 85 -4.497 6.637 -19.708 1.00 0.00 C ATOM 1328 C TYR A 85 -3.861 7.361 -20.887 1.00 0.00 C ATOM 1329 O TYR A 85 -2.672 7.196 -21.152 1.00 0.00 O ATOM 1330 CB TYR A 85 -4.778 7.565 -18.521 1.00 0.00 C ATOM 1331 CG TYR A 85 -3.670 8.494 -18.078 1.00 0.00 C ATOM 1332 CD1 TYR A 85 -2.615 8.021 -17.274 1.00 0.00 C ATOM 1333 CD2 TYR A 85 -3.722 9.854 -18.441 1.00 0.00 C ATOM 1334 CE1 TYR A 85 -1.615 8.905 -16.826 1.00 0.00 C ATOM 1335 CE2 TYR A 85 -2.734 10.739 -17.985 1.00 0.00 C ATOM 1336 CZ TYR A 85 -1.687 10.276 -17.168 1.00 0.00 C ATOM 1337 OH TYR A 85 -0.736 11.153 -16.759 1.00 0.00 O ATOM 0 H TYR A 85 -2.639 5.778 -19.336 1.00 0.00 H new ATOM 0 HA TYR A 85 -5.465 6.255 -20.032 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -5.647 8.174 -18.770 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -5.057 6.945 -17.669 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -2.573 6.977 -17.000 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -4.522 10.215 -19.070 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -0.797 8.538 -16.224 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -2.777 11.782 -18.263 1.00 0.00 H new ATOM 0 HH TYR A 85 -0.953 12.049 -17.091 1.00 0.00 H new ATOM 1347 N GLY A 86 -4.625 8.134 -21.645 1.00 0.00 N ATOM 1348 CA GLY A 86 -4.052 8.909 -22.728 1.00 0.00 C ATOM 1349 C GLY A 86 -4.993 9.978 -23.229 1.00 0.00 C ATOM 1350 O GLY A 86 -6.115 10.118 -22.738 1.00 0.00 O ATOM 0 H GLY A 86 -5.633 8.239 -21.530 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -3.126 9.373 -22.389 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -3.792 8.243 -23.550 1.00 0.00 H new ATOM 1354 N LEU A 87 -4.517 10.729 -24.218 1.00 0.00 N ATOM 1355 CA LEU A 87 -5.222 11.869 -24.787 1.00 0.00 C ATOM 1356 C LEU A 87 -5.343 11.683 -26.293 1.00 0.00 C ATOM 1357 O LEU A 87 -4.471 11.062 -26.908 1.00 0.00 O ATOM 1358 CB LEU A 87 -4.480 13.193 -24.536 1.00 0.00 C ATOM 1359 CG LEU A 87 -3.809 13.400 -23.170 1.00 0.00 C ATOM 1360 CD1 LEU A 87 -3.210 14.796 -23.198 1.00 0.00 C ATOM 1361 CD2 LEU A 87 -4.742 13.327 -21.960 1.00 0.00 C ATOM 0 H LEU A 87 -3.611 10.557 -24.654 1.00 0.00 H new ATOM 0 HA LEU A 87 -6.199 11.918 -24.307 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -3.712 13.295 -25.303 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -5.190 14.006 -24.685 1.00 0.00 H new ATOM 0 HG LEU A 87 -3.091 12.590 -23.042 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -2.717 15.000 -22.247 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -2.482 14.863 -24.006 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -4.001 15.528 -23.361 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -4.168 13.486 -21.047 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -5.509 14.097 -22.045 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -5.215 12.346 -21.924 1.00 0.00 H new ATOM 1373 N GLY A 88 -6.360 12.291 -26.893 1.00 0.00 N ATOM 1374 CA GLY A 88 -6.504 12.398 -28.331 1.00 0.00 C ATOM 1375 C GLY A 88 -7.646 13.352 -28.676 1.00 0.00 C ATOM 1376 O GLY A 88 -8.030 14.180 -27.849 1.00 0.00 O ATOM 0 H GLY A 88 -7.122 12.731 -26.377 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -5.574 12.758 -28.771 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -6.700 11.415 -28.759 1.00 0.00 H new ATOM 1380 N ASP A 89 -8.209 13.231 -29.879 1.00 0.00 N ATOM 1381 CA ASP A 89 -9.447 13.877 -30.304 1.00 0.00 C ATOM 1382 C ASP A 89 -10.159 12.983 -31.323 1.00 0.00 C ATOM 1383 O ASP A 89 -9.510 12.342 -32.150 1.00 0.00 O ATOM 1384 CB ASP A 89 -9.198 15.266 -30.890 1.00 0.00 C ATOM 1385 CG ASP A 89 -10.403 15.694 -31.736 1.00 0.00 C ATOM 1386 OD1 ASP A 89 -11.556 15.685 -31.229 1.00 0.00 O ATOM 1387 OD2 ASP A 89 -10.195 15.927 -32.943 1.00 0.00 O ATOM 0 H ASP A 89 -7.796 12.656 -30.613 1.00 0.00 H new ATOM 0 HA ASP A 89 -10.079 14.013 -29.427 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -9.031 15.985 -30.088 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -8.296 15.257 -31.503 1.00 0.00 H new ATOM 1392 N GLN A 90 -11.489 12.918 -31.263 1.00 0.00 N ATOM 1393 CA GLN A 90 -12.299 12.166 -32.197 1.00 0.00 C ATOM 1394 C GLN A 90 -12.723 12.958 -33.443 1.00 0.00 C ATOM 1395 O GLN A 90 -13.049 12.333 -34.451 1.00 0.00 O ATOM 1396 CB GLN A 90 -13.503 11.544 -31.471 1.00 0.00 C ATOM 1397 CG GLN A 90 -14.453 12.532 -30.767 1.00 0.00 C ATOM 1398 CD GLN A 90 -14.123 12.700 -29.281 1.00 0.00 C ATOM 1399 OE1 GLN A 90 -14.462 11.857 -28.456 1.00 0.00 O ATOM 1400 NE2 GLN A 90 -13.467 13.780 -28.890 1.00 0.00 N ATOM 0 H GLN A 90 -12.035 13.398 -30.548 1.00 0.00 H new ATOM 0 HA GLN A 90 -11.667 11.367 -32.585 1.00 0.00 H new ATOM 0 HB2 GLN A 90 -14.081 10.969 -32.195 1.00 0.00 H new ATOM 0 HB3 GLN A 90 -13.129 10.839 -30.729 1.00 0.00 H new ATOM 0 HG2 GLN A 90 -14.396 13.502 -31.261 1.00 0.00 H new ATOM 0 HG3 GLN A 90 -15.480 12.181 -30.871 1.00 0.00 H new ATOM 0 HE21 GLN A 90 -13.185 14.481 -29.575 1.00 0.00 H new ATOM 0 HE22 GLN A 90 -13.243 13.912 -27.904 1.00 0.00 H new ATOM 1409 N LEU A 91 -12.721 14.296 -33.415 1.00 0.00 N ATOM 1410 CA LEU A 91 -13.232 15.104 -34.518 1.00 0.00 C ATOM 1411 C LEU A 91 -12.306 15.059 -35.730 1.00 0.00 C ATOM 1412 O LEU A 91 -12.770 15.002 -36.872 1.00 0.00 O ATOM 1413 CB LEU A 91 -13.406 16.570 -34.090 1.00 0.00 C ATOM 1414 CG LEU A 91 -14.409 16.794 -32.951 1.00 0.00 C ATOM 1415 CD1 LEU A 91 -14.426 18.284 -32.586 1.00 0.00 C ATOM 1416 CD2 LEU A 91 -15.826 16.327 -33.319 1.00 0.00 C ATOM 0 H LEU A 91 -12.366 14.842 -32.630 1.00 0.00 H new ATOM 0 HA LEU A 91 -14.198 14.680 -34.793 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -12.436 16.962 -33.783 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -13.725 17.151 -34.955 1.00 0.00 H new ATOM 0 HG LEU A 91 -14.089 16.196 -32.098 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -15.137 18.452 -31.777 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -13.431 18.591 -32.265 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -14.723 18.869 -33.457 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -16.498 16.507 -32.480 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -16.177 16.880 -34.190 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -15.810 15.262 -33.549 1.00 0.00 H new ATOM 1428 N GLY A 92 -11.001 15.114 -35.476 1.00 0.00 N ATOM 1429 CA GLY A 92 -9.969 15.272 -36.488 1.00 0.00 C ATOM 1430 C GLY A 92 -9.387 13.932 -36.904 1.00 0.00 C ATOM 1431 O GLY A 92 -8.841 13.803 -38.003 1.00 0.00 O ATOM 0 H GLY A 92 -10.625 15.047 -34.530 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -10.387 15.775 -37.360 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -9.175 15.911 -36.102 1.00 0.00 H new ATOM 1435 N TYR A 93 -9.515 12.938 -36.022 1.00 0.00 N ATOM 1436 CA TYR A 93 -8.876 11.650 -36.136 1.00 0.00 C ATOM 1437 C TYR A 93 -9.969 10.577 -36.151 1.00 0.00 C ATOM 1438 O TYR A 93 -10.372 10.118 -37.213 1.00 0.00 O ATOM 1439 CB TYR A 93 -7.790 11.498 -35.041 1.00 0.00 C ATOM 1440 CG TYR A 93 -6.828 12.670 -34.979 1.00 0.00 C ATOM 1441 CD1 TYR A 93 -5.742 12.751 -35.871 1.00 0.00 C ATOM 1442 CD2 TYR A 93 -7.082 13.737 -34.097 1.00 0.00 C ATOM 1443 CE1 TYR A 93 -4.957 13.917 -35.931 1.00 0.00 C ATOM 1444 CE2 TYR A 93 -6.310 14.907 -34.156 1.00 0.00 C ATOM 1445 CZ TYR A 93 -5.261 15.018 -35.096 1.00 0.00 C ATOM 1446 OH TYR A 93 -4.574 16.192 -35.198 1.00 0.00 O ATOM 0 H TYR A 93 -10.089 13.023 -35.184 1.00 0.00 H new ATOM 0 HA TYR A 93 -8.327 11.536 -37.071 1.00 0.00 H new ATOM 0 HB2 TYR A 93 -8.275 11.384 -34.072 1.00 0.00 H new ATOM 0 HB3 TYR A 93 -7.226 10.584 -35.224 1.00 0.00 H new ATOM 0 HD1 TYR A 93 -5.510 11.914 -36.513 1.00 0.00 H new ATOM 0 HD2 TYR A 93 -7.876 13.655 -33.370 1.00 0.00 H new ATOM 0 HE1 TYR A 93 -4.122 13.972 -36.614 1.00 0.00 H new ATOM 0 HE2 TYR A 93 -6.518 15.724 -33.482 1.00 0.00 H new ATOM 0 HH TYR A 93 -4.923 16.833 -34.544 1.00 0.00 H new ATOM 1456 N GLY A 94 -10.409 10.163 -34.961 1.00 0.00 N ATOM 1457 CA GLY A 94 -11.269 9.014 -34.661 1.00 0.00 C ATOM 1458 C GLY A 94 -10.439 7.748 -34.765 1.00 0.00 C ATOM 1459 O GLY A 94 -10.296 6.978 -33.822 1.00 0.00 O ATOM 0 H GLY A 94 -10.152 10.664 -34.111 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -11.691 9.108 -33.661 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -12.106 8.976 -35.358 1.00 0.00 H new ATOM 1463 N GLU A 95 -9.752 7.663 -35.887 1.00 0.00 N ATOM 1464 CA GLU A 95 -8.955 6.535 -36.330 1.00 0.00 C ATOM 1465 C GLU A 95 -7.683 6.425 -35.488 1.00 0.00 C ATOM 1466 O GLU A 95 -7.243 5.322 -35.167 1.00 0.00 O ATOM 1467 CB GLU A 95 -8.596 6.695 -37.818 1.00 0.00 C ATOM 1468 CG GLU A 95 -9.659 6.183 -38.796 1.00 0.00 C ATOM 1469 CD GLU A 95 -10.835 7.156 -38.999 1.00 0.00 C ATOM 1470 OE1 GLU A 95 -11.853 7.054 -38.275 1.00 0.00 O ATOM 1471 OE2 GLU A 95 -10.777 7.983 -39.944 1.00 0.00 O ATOM 0 H GLU A 95 -9.734 8.431 -36.558 1.00 0.00 H new ATOM 0 HA GLU A 95 -9.536 5.622 -36.205 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -8.414 7.750 -38.022 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -7.662 6.167 -38.010 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -9.189 5.989 -39.760 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -10.046 5.231 -38.433 1.00 0.00 H new ATOM 1478 N TRP A 96 -7.122 7.579 -35.110 1.00 0.00 N ATOM 1479 CA TRP A 96 -5.890 7.680 -34.339 1.00 0.00 C ATOM 1480 C TRP A 96 -6.151 8.098 -32.888 1.00 0.00 C ATOM 1481 O TRP A 96 -5.205 8.299 -32.132 1.00 0.00 O ATOM 1482 CB TRP A 96 -4.849 8.530 -35.079 1.00 0.00 C ATOM 1483 CG TRP A 96 -4.564 8.070 -36.477 1.00 0.00 C ATOM 1484 CD1 TRP A 96 -3.634 7.154 -36.833 1.00 0.00 C ATOM 1485 CD2 TRP A 96 -5.246 8.434 -37.718 1.00 0.00 C ATOM 1486 NE1 TRP A 96 -3.692 6.938 -38.195 1.00 0.00 N ATOM 1487 CE2 TRP A 96 -4.690 7.676 -38.786 1.00 0.00 C ATOM 1488 CE3 TRP A 96 -6.289 9.324 -38.051 1.00 0.00 C ATOM 1489 CZ2 TRP A 96 -5.165 7.761 -40.101 1.00 0.00 C ATOM 1490 CZ3 TRP A 96 -6.754 9.449 -39.374 1.00 0.00 C ATOM 1491 CH2 TRP A 96 -6.202 8.660 -40.399 1.00 0.00 C ATOM 0 H TRP A 96 -7.526 8.487 -35.340 1.00 0.00 H new ATOM 0 HA TRP A 96 -5.448 6.687 -34.254 1.00 0.00 H new ATOM 0 HB2 TRP A 96 -5.196 9.563 -35.112 1.00 0.00 H new ATOM 0 HB3 TRP A 96 -3.920 8.524 -34.510 1.00 0.00 H new ATOM 0 HD1 TRP A 96 -2.950 6.666 -36.154 1.00 0.00 H new ATOM 0 HE1 TRP A 96 -3.070 6.308 -38.701 1.00 0.00 H new ATOM 0 HE3 TRP A 96 -6.741 9.923 -37.274 1.00 0.00 H new ATOM 0 HZ2 TRP A 96 -4.739 7.142 -40.877 1.00 0.00 H new ATOM 0 HZ3 TRP A 96 -7.539 10.155 -39.603 1.00 0.00 H new ATOM 0 HH2 TRP A 96 -6.573 8.745 -41.410 1.00 0.00 H new ATOM 1502 N PHE A 97 -7.414 8.290 -32.493 1.00 0.00 N ATOM 1503 CA PHE A 97 -7.855 8.444 -31.119 1.00 0.00 C ATOM 1504 C PHE A 97 -7.182 7.384 -30.261 1.00 0.00 C ATOM 1505 O PHE A 97 -7.349 6.195 -30.518 1.00 0.00 O ATOM 1506 CB PHE A 97 -9.388 8.287 -31.065 1.00 0.00 C ATOM 1507 CG PHE A 97 -10.066 8.930 -29.878 1.00 0.00 C ATOM 1508 CD1 PHE A 97 -9.798 10.274 -29.600 1.00 0.00 C ATOM 1509 CD2 PHE A 97 -11.017 8.235 -29.112 1.00 0.00 C ATOM 1510 CE1 PHE A 97 -10.468 10.933 -28.553 1.00 0.00 C ATOM 1511 CE2 PHE A 97 -11.709 8.898 -28.083 1.00 0.00 C ATOM 1512 CZ PHE A 97 -11.437 10.249 -27.804 1.00 0.00 C ATOM 0 H PHE A 97 -8.185 8.343 -33.159 1.00 0.00 H new ATOM 0 HA PHE A 97 -7.585 9.430 -30.740 1.00 0.00 H new ATOM 0 HB2 PHE A 97 -9.811 8.710 -31.976 1.00 0.00 H new ATOM 0 HB3 PHE A 97 -9.627 7.224 -31.066 1.00 0.00 H new ATOM 0 HD1 PHE A 97 -9.072 10.810 -30.193 1.00 0.00 H new ATOM 0 HD2 PHE A 97 -11.216 7.193 -29.313 1.00 0.00 H new ATOM 0 HE1 PHE A 97 -10.237 11.963 -28.326 1.00 0.00 H new ATOM 0 HE2 PHE A 97 -12.452 8.368 -27.505 1.00 0.00 H new ATOM 0 HZ PHE A 97 -11.972 10.758 -27.016 1.00 0.00 H new ATOM 1522 N LEU A 98 -6.425 7.818 -29.249 1.00 0.00 N ATOM 1523 CA LEU A 98 -5.792 6.942 -28.263 1.00 0.00 C ATOM 1524 C LEU A 98 -4.902 5.868 -28.886 1.00 0.00 C ATOM 1525 O LEU A 98 -4.655 4.828 -28.288 1.00 0.00 O ATOM 1526 CB LEU A 98 -6.836 6.368 -27.293 1.00 0.00 C ATOM 1527 CG LEU A 98 -7.401 7.335 -26.248 1.00 0.00 C ATOM 1528 CD1 LEU A 98 -6.334 8.113 -25.482 1.00 0.00 C ATOM 1529 CD2 LEU A 98 -8.417 8.338 -26.794 1.00 0.00 C ATOM 0 H LEU A 98 -6.232 8.807 -29.091 1.00 0.00 H new ATOM 0 HA LEU A 98 -5.108 7.559 -27.681 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -7.667 5.975 -27.879 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -6.388 5.524 -26.770 1.00 0.00 H new ATOM 0 HG LEU A 98 -7.913 6.656 -25.565 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -6.814 8.776 -24.762 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -5.683 7.415 -24.956 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -5.743 8.704 -26.181 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -8.763 8.982 -25.985 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -7.948 8.947 -27.567 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -9.265 7.802 -27.219 1.00 0.00 H new ATOM 1541 N ASP A 99 -4.374 6.109 -30.072 1.00 0.00 N ATOM 1542 CA ASP A 99 -3.617 5.083 -30.784 1.00 0.00 C ATOM 1543 C ASP A 99 -2.341 4.725 -30.022 1.00 0.00 C ATOM 1544 O ASP A 99 -2.041 3.543 -29.835 1.00 0.00 O ATOM 1545 CB ASP A 99 -3.359 5.492 -32.228 1.00 0.00 C ATOM 1546 CG ASP A 99 -2.610 4.380 -32.980 1.00 0.00 C ATOM 1547 OD1 ASP A 99 -1.360 4.378 -32.971 1.00 0.00 O ATOM 1548 OD2 ASP A 99 -3.282 3.535 -33.615 1.00 0.00 O1- ATOM 0 H ASP A 99 -4.452 6.999 -30.564 1.00 0.00 H new ATOM 0 HA ASP A 99 -4.216 4.174 -30.831 1.00 0.00 H new ATOM 0 HB2 ASP A 99 -4.305 5.702 -32.727 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -2.775 6.412 -32.252 1.00 0.00 H new ATOM 1553 N ALA A 100 -1.684 5.729 -29.425 1.00 0.00 N ATOM 1554 CA ALA A 100 -0.546 5.505 -28.546 1.00 0.00 C ATOM 1555 C ALA A 100 -0.931 4.672 -27.317 1.00 0.00 C ATOM 1556 O ALA A 100 -0.120 3.879 -26.841 1.00 0.00 O ATOM 1557 CB ALA A 100 0.056 6.857 -28.142 1.00 0.00 C ATOM 0 H ALA A 100 -1.931 6.712 -29.542 1.00 0.00 H new ATOM 0 HA ALA A 100 0.205 4.928 -29.086 1.00 0.00 H new ATOM 0 HB1 ALA A 100 0.909 6.693 -27.483 1.00 0.00 H new ATOM 0 HB2 ALA A 100 0.384 7.391 -29.034 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -0.696 7.449 -27.621 1.00 0.00 H new ATOM 1563 N LEU A 101 -2.164 4.814 -26.814 1.00 0.00 N ATOM 1564 CA LEU A 101 -2.688 4.032 -25.701 1.00 0.00 C ATOM 1565 C LEU A 101 -2.702 2.553 -26.041 1.00 0.00 C ATOM 1566 O LEU A 101 -2.237 1.738 -25.251 1.00 0.00 O ATOM 1567 CB LEU A 101 -4.112 4.508 -25.357 1.00 0.00 C ATOM 1568 CG LEU A 101 -4.595 4.144 -23.957 1.00 0.00 C ATOM 1569 CD1 LEU A 101 -3.818 4.900 -22.904 1.00 0.00 C ATOM 1570 CD2 LEU A 101 -6.080 4.511 -23.817 1.00 0.00 C ATOM 0 H LEU A 101 -2.834 5.490 -27.181 1.00 0.00 H new ATOM 0 HA LEU A 101 -2.039 4.178 -24.837 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -4.153 5.592 -25.468 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -4.805 4.086 -26.085 1.00 0.00 H new ATOM 0 HG LEU A 101 -4.446 3.074 -23.815 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -4.182 4.623 -21.915 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -2.760 4.652 -22.984 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -3.952 5.972 -23.053 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -6.426 4.251 -22.817 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -6.207 5.581 -23.978 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -6.662 3.961 -24.557 1.00 0.00 H new ATOM 1582 N GLY A 102 -3.190 2.222 -27.235 1.00 0.00 N ATOM 1583 CA GLY A 102 -3.177 0.855 -27.730 1.00 0.00 C ATOM 1584 C GLY A 102 -1.744 0.338 -27.804 1.00 0.00 C ATOM 1585 O GLY A 102 -1.483 -0.794 -27.396 1.00 0.00 O ATOM 0 H GLY A 102 -3.603 2.894 -27.881 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -3.769 0.217 -27.074 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -3.638 0.813 -28.717 1.00 0.00 H new ATOM 1589 N MET A 103 -0.797 1.178 -28.242 1.00 0.00 N ATOM 1590 CA MET A 103 0.584 0.740 -28.396 1.00 0.00 C ATOM 1591 C MET A 103 1.254 0.455 -27.064 1.00 0.00 C ATOM 1592 O MET A 103 1.899 -0.584 -26.933 1.00 0.00 O ATOM 1593 CB MET A 103 1.409 1.689 -29.279 1.00 0.00 C ATOM 1594 CG MET A 103 0.835 1.813 -30.696 1.00 0.00 C ATOM 1595 SD MET A 103 2.060 2.155 -31.992 1.00 0.00 S ATOM 1596 CE MET A 103 2.657 3.762 -31.422 1.00 0.00 C ATOM 0 H MET A 103 -0.965 2.153 -28.492 1.00 0.00 H new ATOM 0 HA MET A 103 0.544 -0.211 -28.928 1.00 0.00 H new ATOM 0 HB2 MET A 103 1.443 2.675 -28.816 1.00 0.00 H new ATOM 0 HB3 MET A 103 2.436 1.328 -29.336 1.00 0.00 H new ATOM 0 HG2 MET A 103 0.315 0.888 -30.944 1.00 0.00 H new ATOM 0 HG3 MET A 103 0.090 2.609 -30.702 1.00 0.00 H new ATOM 0 HE1 MET A 103 3.579 4.014 -31.946 1.00 0.00 H new ATOM 0 HE2 MET A 103 1.904 4.523 -31.626 1.00 0.00 H new ATOM 0 HE3 MET A 103 2.849 3.719 -30.350 1.00 0.00 H new ATOM 1606 N LEU A 104 1.067 1.302 -26.048 1.00 0.00 N ATOM 1607 CA LEU A 104 1.582 0.954 -24.732 1.00 0.00 C ATOM 1608 C LEU A 104 0.913 -0.285 -24.192 1.00 0.00 C ATOM 1609 O LEU A 104 1.548 -1.038 -23.465 1.00 0.00 O ATOM 1610 CB LEU A 104 1.412 2.056 -23.681 1.00 0.00 C ATOM 1611 CG LEU A 104 2.690 2.862 -23.410 1.00 0.00 C ATOM 1612 CD1 LEU A 104 2.541 3.658 -22.122 1.00 0.00 C ATOM 1613 CD2 LEU A 104 3.974 2.035 -23.345 1.00 0.00 C ATOM 0 H LEU A 104 0.582 2.197 -26.109 1.00 0.00 H new ATOM 0 HA LEU A 104 2.648 0.794 -24.896 1.00 0.00 H new ATOM 0 HB2 LEU A 104 0.627 2.738 -24.008 1.00 0.00 H new ATOM 0 HB3 LEU A 104 1.074 1.605 -22.748 1.00 0.00 H new ATOM 0 HG LEU A 104 2.800 3.519 -24.273 1.00 0.00 H new ATOM 0 HD11 LEU A 104 3.453 4.227 -21.938 1.00 0.00 H new ATOM 0 HD12 LEU A 104 1.698 4.343 -22.213 1.00 0.00 H new ATOM 0 HD13 LEU A 104 2.365 2.975 -21.291 1.00 0.00 H new ATOM 0 HD21 LEU A 104 4.821 2.693 -23.150 1.00 0.00 H new ATOM 0 HD22 LEU A 104 3.893 1.300 -22.544 1.00 0.00 H new ATOM 0 HD23 LEU A 104 4.125 1.522 -24.295 1.00 0.00 H new ATOM 1625 N HIS A 105 -0.356 -0.499 -24.506 1.00 0.00 N ATOM 1626 CA HIS A 105 -1.051 -1.632 -23.927 1.00 0.00 C ATOM 1627 C HIS A 105 -0.432 -2.932 -24.425 1.00 0.00 C ATOM 1628 O HIS A 105 -0.129 -3.817 -23.633 1.00 0.00 O ATOM 1629 CB HIS A 105 -2.555 -1.526 -24.184 1.00 0.00 C ATOM 1630 CG HIS A 105 -3.318 -2.265 -23.127 1.00 0.00 C ATOM 1631 ND1 HIS A 105 -3.769 -1.718 -21.931 1.00 0.00 N ATOM 1632 CD2 HIS A 105 -3.551 -3.601 -23.115 1.00 0.00 C ATOM 1633 CE1 HIS A 105 -4.279 -2.738 -21.234 1.00 0.00 C ATOM 1634 NE2 HIS A 105 -4.185 -3.884 -21.928 1.00 0.00 N ATOM 0 H HIS A 105 -0.909 0.079 -25.139 1.00 0.00 H new ATOM 0 HA HIS A 105 -0.933 -1.629 -22.843 1.00 0.00 H new ATOM 0 HB2 HIS A 105 -2.856 -0.478 -24.194 1.00 0.00 H new ATOM 0 HB3 HIS A 105 -2.792 -1.935 -25.166 1.00 0.00 H new ATOM 0 HD2 HIS A 105 -3.289 -4.307 -23.889 1.00 0.00 H new ATOM 0 HE1 HIS A 105 -4.708 -2.652 -20.247 1.00 0.00 H new ATOM 0 HE2 HIS A 105 -4.523 -4.799 -21.629 1.00 0.00 H new ATOM 1642 N ASP A 106 -0.117 -3.003 -25.714 1.00 0.00 N ATOM 1643 CA ASP A 106 0.570 -4.128 -26.340 1.00 0.00 C ATOM 1644 C ASP A 106 1.995 -4.285 -25.813 1.00 0.00 C ATOM 1645 O ASP A 106 2.421 -5.393 -25.482 1.00 0.00 O ATOM 1646 CB ASP A 106 0.597 -3.956 -27.860 1.00 0.00 C ATOM 1647 CG ASP A 106 1.382 -5.101 -28.519 1.00 0.00 C ATOM 1648 OD1 ASP A 106 0.842 -6.229 -28.615 1.00 0.00 O ATOM 1649 OD2 ASP A 106 2.534 -4.869 -28.956 1.00 0.00 O1- ATOM 0 H ASP A 106 -0.339 -2.256 -26.372 1.00 0.00 H new ATOM 0 HA ASP A 106 0.015 -5.031 -26.086 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -0.422 -3.936 -28.247 1.00 0.00 H new ATOM 0 HB3 ASP A 106 1.054 -3.000 -28.115 1.00 0.00 H new ATOM 1654 N LYS A 107 2.706 -3.160 -25.660 1.00 0.00 N ATOM 1655 CA LYS A 107 4.045 -3.098 -25.087 1.00 0.00 C ATOM 1656 C LYS A 107 4.009 -3.742 -23.717 1.00 0.00 C ATOM 1657 O LYS A 107 4.709 -4.715 -23.455 1.00 0.00 O ATOM 1658 CB LYS A 107 4.511 -1.632 -25.057 1.00 0.00 C ATOM 1659 CG LYS A 107 5.894 -1.456 -24.433 1.00 0.00 C ATOM 1660 CD LYS A 107 7.050 -1.985 -25.287 1.00 0.00 C ATOM 1661 CE LYS A 107 8.158 -0.924 -25.429 1.00 0.00 C ATOM 1662 NZ LYS A 107 9.244 -1.348 -26.363 1.00 0.00 N1+ ATOM 0 H LYS A 107 2.350 -2.246 -25.941 1.00 0.00 H new ATOM 0 HA LYS A 107 4.769 -3.647 -25.689 1.00 0.00 H new ATOM 0 HB2 LYS A 107 4.525 -1.241 -26.074 1.00 0.00 H new ATOM 0 HB3 LYS A 107 3.788 -1.038 -24.497 1.00 0.00 H new ATOM 0 HG2 LYS A 107 6.058 -0.396 -24.239 1.00 0.00 H new ATOM 0 HG3 LYS A 107 5.910 -1.963 -23.468 1.00 0.00 H new ATOM 0 HD2 LYS A 107 7.460 -2.887 -24.832 1.00 0.00 H new ATOM 0 HD3 LYS A 107 6.680 -2.265 -26.273 1.00 0.00 H new ATOM 0 HE2 LYS A 107 7.720 0.008 -25.787 1.00 0.00 H new ATOM 0 HE3 LYS A 107 8.587 -0.719 -24.448 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 10.060 -0.712 -26.258 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 9.533 -2.322 -26.140 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 8.896 -1.306 -27.342 1.00 0.00 H new ATOM 1676 N LEU A 108 3.188 -3.211 -22.826 1.00 0.00 N ATOM 1677 CA LEU A 108 3.232 -3.609 -21.429 1.00 0.00 C ATOM 1678 C LEU A 108 2.560 -4.964 -21.240 1.00 0.00 C ATOM 1679 O LEU A 108 2.921 -5.676 -20.307 1.00 0.00 O ATOM 1680 CB LEU A 108 2.713 -2.482 -20.529 1.00 0.00 C ATOM 1681 CG LEU A 108 3.439 -1.145 -20.764 1.00 0.00 C ATOM 1682 CD1 LEU A 108 2.860 -0.104 -19.814 1.00 0.00 C ATOM 1683 CD2 LEU A 108 4.969 -1.219 -20.637 1.00 0.00 C ATOM 0 H LEU A 108 2.485 -2.505 -23.044 1.00 0.00 H new ATOM 0 HA LEU A 108 4.263 -3.762 -21.110 1.00 0.00 H new ATOM 0 HB2 LEU A 108 1.646 -2.346 -20.705 1.00 0.00 H new ATOM 0 HB3 LEU A 108 2.830 -2.774 -19.485 1.00 0.00 H new ATOM 0 HG LEU A 108 3.265 -0.863 -21.802 1.00 0.00 H new ATOM 0 HD11 LEU A 108 3.364 0.850 -19.968 1.00 0.00 H new ATOM 0 HD12 LEU A 108 1.794 0.014 -20.009 1.00 0.00 H new ATOM 0 HD13 LEU A 108 3.007 -0.430 -18.784 1.00 0.00 H new ATOM 0 HD21 LEU A 108 5.397 -0.233 -20.818 1.00 0.00 H new ATOM 0 HD22 LEU A 108 5.235 -1.552 -19.634 1.00 0.00 H new ATOM 0 HD23 LEU A 108 5.361 -1.925 -21.369 1.00 0.00 H new ATOM 1695 N SER A 109 1.706 -5.403 -22.167 1.00 0.00 N ATOM 1696 CA SER A 109 1.220 -6.774 -22.165 1.00 0.00 C ATOM 1697 C SER A 109 2.390 -7.760 -22.357 1.00 0.00 C ATOM 1698 O SER A 109 2.349 -8.859 -21.798 1.00 0.00 O ATOM 1699 CB SER A 109 0.127 -6.920 -23.239 1.00 0.00 C ATOM 1700 OG SER A 109 -0.538 -8.168 -23.145 1.00 0.00 O ATOM 0 H SER A 109 1.341 -4.826 -22.925 1.00 0.00 H new ATOM 0 HA SER A 109 0.772 -7.018 -21.202 1.00 0.00 H new ATOM 0 HB2 SER A 109 -0.598 -6.113 -23.133 1.00 0.00 H new ATOM 0 HB3 SER A 109 0.573 -6.819 -24.228 1.00 0.00 H new ATOM 0 HG SER A 109 -1.226 -8.225 -23.841 1.00 0.00 H new ATOM 1706 N THR A 110 3.483 -7.381 -23.047 1.00 0.00 N ATOM 1707 CA THR A 110 4.628 -8.275 -23.225 1.00 0.00 C ATOM 1708 C THR A 110 5.471 -8.298 -21.934 1.00 0.00 C ATOM 1709 O THR A 110 6.157 -9.277 -21.640 1.00 0.00 O ATOM 1710 CB THR A 110 5.378 -7.867 -24.519 1.00 0.00 C ATOM 1711 OG1 THR A 110 5.638 -9.000 -25.333 1.00 0.00 O ATOM 1712 CG2 THR A 110 6.702 -7.131 -24.287 1.00 0.00 C ATOM 0 H THR A 110 3.591 -6.466 -23.485 1.00 0.00 H new ATOM 0 HA THR A 110 4.328 -9.312 -23.375 1.00 0.00 H new ATOM 0 HB THR A 110 4.702 -7.170 -25.014 1.00 0.00 H new ATOM 0 HG1 THR A 110 6.110 -8.718 -26.144 1.00 0.00 H new ATOM 0 HG21 THR A 110 7.155 -6.886 -25.248 1.00 0.00 H new ATOM 0 HG22 THR A 110 6.515 -6.213 -23.729 1.00 0.00 H new ATOM 0 HG23 THR A 110 7.379 -7.770 -23.719 1.00 0.00 H new ATOM 1720 N LYS A 111 5.378 -7.234 -21.123 1.00 0.00 N ATOM 1721 CA LYS A 111 6.061 -7.059 -19.849 1.00 0.00 C ATOM 1722 C LYS A 111 5.369 -7.780 -18.695 1.00 0.00 C ATOM 1723 O LYS A 111 5.789 -7.624 -17.554 1.00 0.00 O ATOM 1724 CB LYS A 111 6.201 -5.550 -19.573 1.00 0.00 C ATOM 1725 CG LYS A 111 6.984 -4.788 -20.649 1.00 0.00 C ATOM 1726 CD LYS A 111 8.435 -5.269 -20.765 1.00 0.00 C ATOM 1727 CE LYS A 111 9.226 -5.188 -19.445 1.00 0.00 C ATOM 1728 NZ LYS A 111 10.335 -6.171 -19.355 1.00 0.00 N1+ ATOM 0 H LYS A 111 4.791 -6.434 -21.358 1.00 0.00 H new ATOM 0 HA LYS A 111 7.047 -7.518 -19.920 1.00 0.00 H new ATOM 0 HB2 LYS A 111 5.206 -5.114 -19.485 1.00 0.00 H new ATOM 0 HB3 LYS A 111 6.696 -5.411 -18.612 1.00 0.00 H new ATOM 0 HG2 LYS A 111 6.486 -4.909 -21.611 1.00 0.00 H new ATOM 0 HG3 LYS A 111 6.974 -3.723 -20.416 1.00 0.00 H new ATOM 0 HD2 LYS A 111 8.439 -6.301 -21.117 1.00 0.00 H new ATOM 0 HD3 LYS A 111 8.946 -4.673 -21.521 1.00 0.00 H new ATOM 0 HE2 LYS A 111 9.633 -4.183 -19.336 1.00 0.00 H new ATOM 0 HE3 LYS A 111 8.542 -5.347 -18.611 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 10.992 -5.885 -18.601 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 9.948 -7.112 -19.139 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 10.843 -6.205 -20.262 1.00 0.00 H new ATOM 1742 N GLY A 112 4.299 -8.530 -18.961 1.00 0.00 N ATOM 1743 CA GLY A 112 3.689 -9.414 -17.972 1.00 0.00 C ATOM 1744 C GLY A 112 3.060 -8.628 -16.828 1.00 0.00 C ATOM 1745 O GLY A 112 3.095 -9.072 -15.680 1.00 0.00 O ATOM 0 H GLY A 112 3.832 -8.541 -19.868 1.00 0.00 H new ATOM 0 HA2 GLY A 112 2.928 -10.029 -18.453 1.00 0.00 H new ATOM 0 HA3 GLY A 112 4.444 -10.093 -17.576 1.00 0.00 H new ATOM 1749 N VAL A 113 2.547 -7.429 -17.114 1.00 0.00 N ATOM 1750 CA VAL A 113 1.874 -6.588 -16.140 1.00 0.00 C ATOM 1751 C VAL A 113 0.415 -7.042 -16.010 1.00 0.00 C ATOM 1752 O VAL A 113 -0.071 -7.859 -16.800 1.00 0.00 O ATOM 1753 CB VAL A 113 2.057 -5.090 -16.479 1.00 0.00 C ATOM 1754 CG1 VAL A 113 3.481 -4.784 -16.967 1.00 0.00 C ATOM 1755 CG2 VAL A 113 1.059 -4.542 -17.510 1.00 0.00 C ATOM 0 H VAL A 113 2.592 -7.015 -18.045 1.00 0.00 H new ATOM 0 HA VAL A 113 2.326 -6.702 -15.155 1.00 0.00 H new ATOM 0 HB VAL A 113 1.862 -4.583 -15.534 1.00 0.00 H new ATOM 0 HG11 VAL A 113 3.567 -3.721 -17.194 1.00 0.00 H new ATOM 0 HG12 VAL A 113 4.197 -5.048 -16.189 1.00 0.00 H new ATOM 0 HG13 VAL A 113 3.691 -5.365 -17.865 1.00 0.00 H new ATOM 0 HG21 VAL A 113 1.261 -3.486 -17.687 1.00 0.00 H new ATOM 0 HG22 VAL A 113 1.163 -5.093 -18.445 1.00 0.00 H new ATOM 0 HG23 VAL A 113 0.044 -4.658 -17.131 1.00 0.00 H new ATOM 1765 N LYS A 114 -0.297 -6.485 -15.032 1.00 0.00 N ATOM 1766 CA LYS A 114 -1.748 -6.631 -14.909 1.00 0.00 C ATOM 1767 C LYS A 114 -2.342 -5.235 -15.030 1.00 0.00 C ATOM 1768 O LYS A 114 -1.715 -4.290 -14.556 1.00 0.00 O ATOM 1769 CB LYS A 114 -2.101 -7.429 -13.656 1.00 0.00 C ATOM 1770 CG LYS A 114 -1.839 -6.670 -12.360 1.00 0.00 C ATOM 1771 CD LYS A 114 -1.893 -7.631 -11.170 1.00 0.00 C ATOM 1772 CE LYS A 114 -0.483 -8.039 -10.704 1.00 0.00 C ATOM 1773 NZ LYS A 114 -0.507 -9.105 -9.659 1.00 0.00 N1+ ATOM 0 H LYS A 114 0.120 -5.915 -14.296 1.00 0.00 H new ATOM 0 HA LYS A 114 -2.195 -7.229 -15.703 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -3.153 -7.709 -13.698 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -1.525 -8.354 -13.649 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -0.863 -6.186 -12.403 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -2.581 -5.881 -12.235 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -2.427 -7.159 -10.345 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -2.457 -8.522 -11.447 1.00 0.00 H new ATOM 0 HE2 LYS A 114 0.091 -8.390 -11.562 1.00 0.00 H new ATOM 0 HE3 LYS A 114 0.033 -7.163 -10.311 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 0.467 -9.341 -9.382 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -1.031 -8.764 -8.828 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -0.974 -9.953 -10.039 1.00 0.00 H new ATOM 1787 N PHE A 115 -3.484 -5.065 -15.687 1.00 0.00 N ATOM 1788 CA PHE A 115 -4.004 -3.759 -16.039 1.00 0.00 C ATOM 1789 C PHE A 115 -5.239 -3.410 -15.219 1.00 0.00 C ATOM 1790 O PHE A 115 -6.029 -4.298 -14.892 1.00 0.00 O ATOM 1791 CB PHE A 115 -4.252 -3.658 -17.545 1.00 0.00 C ATOM 1792 CG PHE A 115 -2.996 -3.676 -18.400 1.00 0.00 C ATOM 1793 CD1 PHE A 115 -2.227 -2.503 -18.545 1.00 0.00 C ATOM 1794 CD2 PHE A 115 -2.655 -4.831 -19.130 1.00 0.00 C ATOM 1795 CE1 PHE A 115 -1.167 -2.467 -19.471 1.00 0.00 C ATOM 1796 CE2 PHE A 115 -1.592 -4.795 -20.048 1.00 0.00 C ATOM 1797 CZ PHE A 115 -0.872 -3.604 -20.241 1.00 0.00 C ATOM 0 H PHE A 115 -4.076 -5.839 -15.990 1.00 0.00 H new ATOM 0 HA PHE A 115 -3.249 -3.014 -15.789 1.00 0.00 H new ATOM 0 HB2 PHE A 115 -4.894 -4.485 -17.850 1.00 0.00 H new ATOM 0 HB3 PHE A 115 -4.800 -2.738 -17.748 1.00 0.00 H new ATOM 0 HD1 PHE A 115 -2.451 -1.633 -17.946 1.00 0.00 H new ATOM 0 HD2 PHE A 115 -3.211 -5.745 -18.984 1.00 0.00 H new ATOM 0 HE1 PHE A 115 -0.582 -1.567 -19.589 1.00 0.00 H new ATOM 0 HE2 PHE A 115 -1.329 -5.682 -20.605 1.00 0.00 H new ATOM 0 HZ PHE A 115 -0.089 -3.563 -20.984 1.00 0.00 H new ATOM 1807 N VAL A 116 -5.424 -2.119 -14.927 1.00 0.00 N ATOM 1808 CA VAL A 116 -6.649 -1.573 -14.353 1.00 0.00 C ATOM 1809 C VAL A 116 -7.110 -0.391 -15.208 1.00 0.00 C ATOM 1810 O VAL A 116 -6.412 0.003 -16.148 1.00 0.00 O ATOM 1811 CB VAL A 116 -6.459 -1.216 -12.867 1.00 0.00 C ATOM 1812 CG1 VAL A 116 -5.961 -2.420 -12.061 1.00 0.00 C ATOM 1813 CG2 VAL A 116 -5.544 -0.007 -12.634 1.00 0.00 C ATOM 0 H VAL A 116 -4.707 -1.412 -15.088 1.00 0.00 H new ATOM 0 HA VAL A 116 -7.438 -2.325 -14.368 1.00 0.00 H new ATOM 0 HB VAL A 116 -7.449 -0.931 -12.511 1.00 0.00 H new ATOM 0 HG11 VAL A 116 -5.838 -2.133 -11.017 1.00 0.00 H new ATOM 0 HG12 VAL A 116 -6.687 -3.230 -12.131 1.00 0.00 H new ATOM 0 HG13 VAL A 116 -5.004 -2.755 -12.461 1.00 0.00 H new ATOM 0 HG21 VAL A 116 -5.458 0.184 -11.564 1.00 0.00 H new ATOM 0 HG22 VAL A 116 -4.556 -0.213 -13.046 1.00 0.00 H new ATOM 0 HG23 VAL A 116 -5.966 0.869 -13.126 1.00 0.00 H new ATOM 1823 N GLY A 117 -8.239 0.227 -14.863 1.00 0.00 N ATOM 1824 CA GLY A 117 -8.656 1.444 -15.508 1.00 0.00 C ATOM 1825 C GLY A 117 -9.260 1.244 -16.896 1.00 0.00 C ATOM 1826 O GLY A 117 -9.063 2.103 -17.753 1.00 0.00 O ATOM 0 H GLY A 117 -8.874 -0.106 -14.137 1.00 0.00 H new ATOM 0 HA2 GLY A 117 -9.388 1.945 -14.875 1.00 0.00 H new ATOM 0 HA3 GLY A 117 -7.797 2.110 -15.591 1.00 0.00 H new ATOM 1830 N TYR A 118 -10.006 0.170 -17.141 1.00 0.00 N ATOM 1831 CA TYR A 118 -10.777 0.051 -18.377 1.00 0.00 C ATOM 1832 C TYR A 118 -12.041 0.903 -18.265 1.00 0.00 C ATOM 1833 O TYR A 118 -12.556 1.123 -17.171 1.00 0.00 O ATOM 1834 CB TYR A 118 -11.095 -1.422 -18.687 1.00 0.00 C ATOM 1835 CG TYR A 118 -9.904 -2.334 -18.965 1.00 0.00 C ATOM 1836 CD1 TYR A 118 -8.731 -1.841 -19.572 1.00 0.00 C ATOM 1837 CD2 TYR A 118 -9.994 -3.708 -18.663 1.00 0.00 C ATOM 1838 CE1 TYR A 118 -7.671 -2.706 -19.884 1.00 0.00 C ATOM 1839 CE2 TYR A 118 -8.934 -4.582 -18.977 1.00 0.00 C ATOM 1840 CZ TYR A 118 -7.763 -4.082 -19.593 1.00 0.00 C ATOM 1841 OH TYR A 118 -6.724 -4.904 -19.925 1.00 0.00 O ATOM 0 H TYR A 118 -10.093 -0.624 -16.507 1.00 0.00 H new ATOM 0 HA TYR A 118 -10.186 0.423 -19.214 1.00 0.00 H new ATOM 0 HB2 TYR A 118 -11.651 -1.835 -17.845 1.00 0.00 H new ATOM 0 HB3 TYR A 118 -11.757 -1.453 -19.552 1.00 0.00 H new ATOM 0 HD1 TYR A 118 -8.647 -0.788 -19.799 1.00 0.00 H new ATOM 0 HD2 TYR A 118 -10.883 -4.094 -18.187 1.00 0.00 H new ATOM 0 HE1 TYR A 118 -6.779 -2.315 -20.350 1.00 0.00 H new ATOM 0 HE2 TYR A 118 -9.016 -5.634 -18.747 1.00 0.00 H new ATOM 0 HH TYR A 118 -6.229 -4.518 -20.677 1.00 0.00 H new ATOM 1851 N TRP A 119 -12.554 1.364 -19.402 1.00 0.00 N ATOM 1852 CA TRP A 119 -13.856 2.026 -19.514 1.00 0.00 C ATOM 1853 C TRP A 119 -14.652 1.339 -20.611 1.00 0.00 C ATOM 1854 O TRP A 119 -14.035 0.953 -21.600 1.00 0.00 O ATOM 1855 CB TRP A 119 -13.715 3.488 -19.920 1.00 0.00 C ATOM 1856 CG TRP A 119 -13.424 4.475 -18.849 1.00 0.00 C ATOM 1857 CD1 TRP A 119 -12.656 5.553 -19.074 1.00 0.00 C ATOM 1858 CD2 TRP A 119 -13.942 4.610 -17.480 1.00 0.00 C ATOM 1859 NE1 TRP A 119 -12.645 6.339 -17.947 1.00 0.00 N ATOM 1860 CE2 TRP A 119 -13.421 5.820 -16.938 1.00 0.00 C ATOM 1861 CE3 TRP A 119 -14.809 3.874 -16.638 1.00 0.00 C ATOM 1862 CZ2 TRP A 119 -13.722 6.268 -15.644 1.00 0.00 C ATOM 1863 CZ3 TRP A 119 -15.112 4.304 -15.333 1.00 0.00 C ATOM 1864 CH2 TRP A 119 -14.569 5.496 -14.832 1.00 0.00 C ATOM 0 H TRP A 119 -12.066 1.287 -20.295 1.00 0.00 H new ATOM 0 HA TRP A 119 -14.344 1.967 -18.541 1.00 0.00 H new ATOM 0 HB2 TRP A 119 -12.920 3.555 -20.663 1.00 0.00 H new ATOM 0 HB3 TRP A 119 -14.639 3.790 -20.413 1.00 0.00 H new ATOM 0 HD1 TRP A 119 -12.131 5.768 -19.993 1.00 0.00 H new ATOM 0 HE1 TRP A 119 -12.120 7.210 -17.868 1.00 0.00 H new ATOM 0 HE3 TRP A 119 -15.249 2.959 -17.006 1.00 0.00 H new ATOM 0 HZ2 TRP A 119 -13.308 7.195 -15.276 1.00 0.00 H new ATOM 0 HZ3 TRP A 119 -15.768 3.711 -14.712 1.00 0.00 H new ATOM 0 HH2 TRP A 119 -14.801 5.818 -13.828 1.00 0.00 H new ATOM 1875 N PRO A 120 -15.985 1.249 -20.526 1.00 0.00 N ATOM 1876 CA PRO A 120 -16.781 0.809 -21.657 1.00 0.00 C ATOM 1877 C PRO A 120 -16.777 1.896 -22.747 1.00 0.00 C ATOM 1878 O PRO A 120 -16.853 3.090 -22.457 1.00 0.00 O ATOM 1879 CB PRO A 120 -18.165 0.510 -21.084 1.00 0.00 C ATOM 1880 CG PRO A 120 -18.278 1.498 -19.918 1.00 0.00 C ATOM 1881 CD PRO A 120 -16.840 1.623 -19.409 1.00 0.00 C ATOM 0 HA PRO A 120 -16.392 -0.084 -22.147 1.00 0.00 H new ATOM 0 HB2 PRO A 120 -18.950 0.667 -21.823 1.00 0.00 H new ATOM 0 HB3 PRO A 120 -18.247 -0.523 -20.747 1.00 0.00 H new ATOM 0 HG2 PRO A 120 -18.672 2.460 -20.245 1.00 0.00 H new ATOM 0 HG3 PRO A 120 -18.947 1.127 -19.142 1.00 0.00 H new ATOM 0 HD2 PRO A 120 -16.630 2.641 -19.080 1.00 0.00 H new ATOM 0 HD3 PRO A 120 -16.671 0.970 -18.553 1.00 0.00 H new ATOM 1889 N THR A 121 -16.697 1.475 -24.005 1.00 0.00 N ATOM 1890 CA THR A 121 -16.662 2.323 -25.188 1.00 0.00 C ATOM 1891 C THR A 121 -18.021 2.949 -25.544 1.00 0.00 C ATOM 1892 O THR A 121 -18.093 3.796 -26.437 1.00 0.00 O ATOM 1893 CB THR A 121 -16.067 1.518 -26.357 1.00 0.00 C ATOM 1894 OG1 THR A 121 -16.882 0.394 -26.643 1.00 0.00 O ATOM 1895 CG2 THR A 121 -14.651 1.002 -26.078 1.00 0.00 C ATOM 0 H THR A 121 -16.653 0.483 -24.237 1.00 0.00 H new ATOM 0 HA THR A 121 -16.024 3.179 -24.969 1.00 0.00 H new ATOM 0 HB THR A 121 -16.024 2.209 -27.199 1.00 0.00 H new ATOM 0 HG1 THR A 121 -16.366 -0.263 -27.155 1.00 0.00 H new ATOM 0 HG21 THR A 121 -14.291 0.443 -26.942 1.00 0.00 H new ATOM 0 HG22 THR A 121 -13.987 1.846 -25.889 1.00 0.00 H new ATOM 0 HG23 THR A 121 -14.667 0.350 -25.205 1.00 0.00 H new ATOM 1946 N GLU A 125 -17.556 8.033 -29.654 1.00 0.00 N ATOM 1947 CA GLU A 125 -17.433 7.870 -31.095 1.00 0.00 C ATOM 1948 C GLU A 125 -15.939 7.943 -31.417 1.00 0.00 C ATOM 1949 O GLU A 125 -15.267 8.871 -30.964 1.00 0.00 O ATOM 1950 CB GLU A 125 -18.236 8.955 -31.836 1.00 0.00 C ATOM 1951 CG GLU A 125 -19.709 8.988 -31.402 1.00 0.00 C ATOM 1952 CD GLU A 125 -20.520 9.998 -32.235 1.00 0.00 C ATOM 1953 OE1 GLU A 125 -21.079 9.614 -33.291 1.00 0.00 O ATOM 1954 OE2 GLU A 125 -20.619 11.185 -31.835 1.00 0.00 O ATOM 0 HA GLU A 125 -17.842 6.915 -31.425 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -17.783 9.929 -31.651 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -18.180 8.776 -32.910 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -20.143 7.994 -31.509 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -19.773 9.251 -30.346 1.00 0.00 H new ATOM 1961 N PHE A 126 -15.399 6.944 -32.127 1.00 0.00 N ATOM 1962 CA PHE A 126 -13.957 6.799 -32.340 1.00 0.00 C ATOM 1963 C PHE A 126 -13.701 5.832 -33.498 1.00 0.00 C ATOM 1964 O PHE A 126 -13.001 6.185 -34.436 1.00 0.00 O ATOM 1965 CB PHE A 126 -13.255 6.321 -31.046 1.00 0.00 C ATOM 1966 CG PHE A 126 -13.698 4.971 -30.502 1.00 0.00 C ATOM 1967 CD1 PHE A 126 -14.955 4.835 -29.880 1.00 0.00 C ATOM 1968 CD2 PHE A 126 -12.887 3.831 -30.676 1.00 0.00 C ATOM 1969 CE1 PHE A 126 -15.430 3.568 -29.501 1.00 0.00 C ATOM 1970 CE2 PHE A 126 -13.360 2.563 -30.287 1.00 0.00 C ATOM 1971 CZ PHE A 126 -14.635 2.429 -29.712 1.00 0.00 C ATOM 0 H PHE A 126 -15.954 6.212 -32.571 1.00 0.00 H new ATOM 0 HA PHE A 126 -13.537 7.771 -32.599 1.00 0.00 H new ATOM 0 HB2 PHE A 126 -12.182 6.280 -31.233 1.00 0.00 H new ATOM 0 HB3 PHE A 126 -13.415 7.072 -30.272 1.00 0.00 H new ATOM 0 HD1 PHE A 126 -15.558 5.711 -29.693 1.00 0.00 H new ATOM 0 HD2 PHE A 126 -11.902 3.930 -31.108 1.00 0.00 H new ATOM 0 HE1 PHE A 126 -16.405 3.470 -29.048 1.00 0.00 H new ATOM 0 HE2 PHE A 126 -12.740 1.690 -30.431 1.00 0.00 H new ATOM 0 HZ PHE A 126 -15.003 1.453 -29.433 1.00 0.00 H new ATOM 1981 N THR A 127 -14.288 4.628 -33.434 1.00 0.00 N ATOM 1982 CA THR A 127 -14.243 3.549 -34.425 1.00 0.00 C ATOM 1983 C THR A 127 -12.818 3.038 -34.759 1.00 0.00 C ATOM 1984 O THR A 127 -12.637 2.198 -35.646 1.00 0.00 O ATOM 1985 CB THR A 127 -15.206 3.874 -35.597 1.00 0.00 C ATOM 1986 OG1 THR A 127 -15.574 2.714 -36.329 1.00 0.00 O ATOM 1987 CG2 THR A 127 -14.701 4.966 -36.544 1.00 0.00 C ATOM 0 H THR A 127 -14.850 4.366 -32.624 1.00 0.00 H new ATOM 0 HA THR A 127 -14.641 2.634 -33.987 1.00 0.00 H new ATOM 0 HB THR A 127 -16.095 4.276 -35.111 1.00 0.00 H new ATOM 0 HG1 THR A 127 -14.808 2.105 -36.384 1.00 0.00 H new ATOM 0 HG21 THR A 127 -15.434 5.130 -37.334 1.00 0.00 H new ATOM 0 HG22 THR A 127 -14.554 5.891 -35.987 1.00 0.00 H new ATOM 0 HG23 THR A 127 -13.755 4.655 -36.987 1.00 0.00 H new ATOM 1995 N SER A 128 -11.798 3.476 -34.010 1.00 0.00 N ATOM 1996 CA SER A 128 -10.457 2.890 -34.071 1.00 0.00 C ATOM 1997 C SER A 128 -10.510 1.469 -33.488 1.00 0.00 C ATOM 1998 O SER A 128 -11.141 1.276 -32.446 1.00 0.00 O ATOM 1999 CB SER A 128 -9.440 3.737 -33.296 1.00 0.00 C ATOM 2000 OG SER A 128 -8.152 3.146 -33.365 1.00 0.00 O ATOM 0 H SER A 128 -11.881 4.246 -33.346 1.00 0.00 H new ATOM 0 HA SER A 128 -10.135 2.859 -35.112 1.00 0.00 H new ATOM 0 HB2 SER A 128 -9.407 4.746 -33.708 1.00 0.00 H new ATOM 0 HB3 SER A 128 -9.750 3.828 -32.255 1.00 0.00 H new ATOM 0 HG SER A 128 -7.570 3.696 -33.930 1.00 0.00 H new ATOM 2006 N PRO A 129 -9.810 0.485 -34.080 1.00 0.00 N ATOM 2007 CA PRO A 129 -9.691 -0.853 -33.514 1.00 0.00 C ATOM 2008 C PRO A 129 -8.555 -0.973 -32.482 1.00 0.00 C ATOM 2009 O PRO A 129 -8.469 -1.995 -31.797 1.00 0.00 O ATOM 2010 CB PRO A 129 -9.437 -1.747 -34.733 1.00 0.00 C ATOM 2011 CG PRO A 129 -8.592 -0.855 -35.642 1.00 0.00 C ATOM 2012 CD PRO A 129 -9.184 0.536 -35.397 1.00 0.00 C ATOM 0 HA PRO A 129 -10.585 -1.132 -32.956 1.00 0.00 H new ATOM 0 HB2 PRO A 129 -8.909 -2.661 -34.460 1.00 0.00 H new ATOM 0 HB3 PRO A 129 -10.368 -2.048 -35.214 1.00 0.00 H new ATOM 0 HG2 PRO A 129 -7.535 -0.897 -35.380 1.00 0.00 H new ATOM 0 HG3 PRO A 129 -8.673 -1.151 -36.688 1.00 0.00 H new ATOM 0 HD2 PRO A 129 -8.408 1.301 -35.430 1.00 0.00 H new ATOM 0 HD3 PRO A 129 -9.914 0.789 -36.166 1.00 0.00 H new ATOM 2020 N LYS A 130 -7.663 0.026 -32.364 1.00 0.00 N ATOM 2021 CA LYS A 130 -6.424 -0.119 -31.599 1.00 0.00 C ATOM 2022 C LYS A 130 -6.611 -0.017 -30.077 1.00 0.00 C ATOM 2023 O LYS A 130 -6.113 -0.895 -29.374 1.00 0.00 O ATOM 2024 CB LYS A 130 -5.330 0.831 -32.139 1.00 0.00 C ATOM 2025 CG LYS A 130 -3.898 0.314 -31.913 1.00 0.00 C ATOM 2026 CD LYS A 130 -3.537 -0.831 -32.877 1.00 0.00 C ATOM 2027 CE LYS A 130 -2.026 -1.099 -32.822 1.00 0.00 C ATOM 2028 NZ LYS A 130 -1.606 -2.182 -33.755 1.00 0.00 N1+ ATOM 0 H LYS A 130 -7.783 0.944 -32.793 1.00 0.00 H new ATOM 0 HA LYS A 130 -6.082 -1.142 -31.754 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -5.488 0.984 -33.207 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -5.436 1.804 -31.659 1.00 0.00 H new ATOM 0 HG2 LYS A 130 -3.192 1.134 -32.044 1.00 0.00 H new ATOM 0 HG3 LYS A 130 -3.796 -0.033 -30.885 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -4.086 -1.733 -32.607 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -3.833 -0.570 -33.893 1.00 0.00 H new ATOM 0 HE2 LYS A 130 -1.488 -0.183 -33.067 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -1.745 -1.371 -31.805 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -0.579 -2.325 -33.681 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -2.097 -3.064 -33.506 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -1.849 -1.914 -34.730 1.00 0.00 H new ATOM 2042 N PRO A 131 -7.285 1.010 -29.513 1.00 0.00 N ATOM 2043 CA PRO A 131 -7.287 1.241 -28.067 1.00 0.00 C ATOM 2044 C PRO A 131 -8.413 0.475 -27.360 1.00 0.00 C ATOM 2045 O PRO A 131 -9.075 1.023 -26.482 1.00 0.00 O ATOM 2046 CB PRO A 131 -7.403 2.761 -27.928 1.00 0.00 C ATOM 2047 CG PRO A 131 -8.321 3.132 -29.089 1.00 0.00 C ATOM 2048 CD PRO A 131 -7.912 2.148 -30.187 1.00 0.00 C ATOM 0 HA PRO A 131 -6.386 0.866 -27.581 1.00 0.00 H new ATOM 0 HB2 PRO A 131 -7.829 3.049 -26.967 1.00 0.00 H new ATOM 0 HB3 PRO A 131 -6.432 3.251 -28.006 1.00 0.00 H new ATOM 0 HG2 PRO A 131 -9.372 3.023 -28.822 1.00 0.00 H new ATOM 0 HG3 PRO A 131 -8.177 4.166 -29.401 1.00 0.00 H new ATOM 0 HD2 PRO A 131 -8.780 1.827 -30.763 1.00 0.00 H new ATOM 0 HD3 PRO A 131 -7.219 2.614 -30.887 1.00 0.00 H new ATOM 2056 N VAL A 132 -8.662 -0.780 -27.715 1.00 0.00 N ATOM 2057 CA VAL A 132 -9.851 -1.513 -27.315 1.00 0.00 C ATOM 2058 C VAL A 132 -9.484 -2.971 -27.007 1.00 0.00 C ATOM 2059 O VAL A 132 -8.561 -3.506 -27.623 1.00 0.00 O ATOM 2060 CB VAL A 132 -10.963 -1.386 -28.382 1.00 0.00 C ATOM 2061 CG1 VAL A 132 -12.302 -1.061 -27.717 1.00 0.00 C ATOM 2062 CG2 VAL A 132 -10.754 -0.321 -29.476 1.00 0.00 C ATOM 0 H VAL A 132 -8.029 -1.325 -28.300 1.00 0.00 H new ATOM 0 HA VAL A 132 -10.256 -1.079 -26.401 1.00 0.00 H new ATOM 0 HB VAL A 132 -10.939 -2.359 -28.873 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -13.076 -0.974 -28.480 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -12.566 -1.858 -27.022 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -12.220 -0.119 -27.175 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -11.602 -0.332 -30.161 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -10.673 0.663 -29.015 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -9.839 -0.540 -30.027 1.00 0.00 H new ATOM 2072 N ILE A 133 -10.183 -3.605 -26.056 1.00 0.00 N ATOM 2073 CA ILE A 133 -10.013 -4.993 -25.652 1.00 0.00 C ATOM 2074 C ILE A 133 -11.342 -5.721 -25.709 1.00 0.00 C ATOM 2075 O ILE A 133 -12.361 -5.145 -26.098 1.00 0.00 O ATOM 2076 CB ILE A 133 -9.329 -5.160 -24.275 1.00 0.00 C ATOM 2077 CG1 ILE A 133 -10.180 -4.666 -23.088 1.00 0.00 C ATOM 2078 CG2 ILE A 133 -7.954 -4.520 -24.359 1.00 0.00 C ATOM 2079 CD1 ILE A 133 -9.988 -3.187 -22.807 1.00 0.00 C ATOM 0 H ILE A 133 -10.916 -3.134 -25.526 1.00 0.00 H new ATOM 0 HA ILE A 133 -9.328 -5.448 -26.367 1.00 0.00 H new ATOM 0 HB ILE A 133 -9.218 -6.222 -24.055 1.00 0.00 H new ATOM 0 HG12 ILE A 133 -11.233 -4.859 -23.295 1.00 0.00 H new ATOM 0 HG13 ILE A 133 -9.921 -5.238 -22.197 1.00 0.00 H new ATOM 0 HG21 ILE A 133 -7.446 -4.622 -23.400 1.00 0.00 H new ATOM 0 HG22 ILE A 133 -7.369 -5.015 -25.134 1.00 0.00 H new ATOM 0 HG23 ILE A 133 -8.059 -3.463 -24.603 1.00 0.00 H new ATOM 0 HD11 ILE A 133 -10.611 -2.893 -21.962 1.00 0.00 H new ATOM 0 HD12 ILE A 133 -8.941 -2.994 -22.571 1.00 0.00 H new ATOM 0 HD13 ILE A 133 -10.274 -2.610 -23.686 1.00 0.00 H new ATOM 2091 N ALA A 134 -11.338 -6.955 -25.212 1.00 0.00 N ATOM 2092 CA ALA A 134 -12.479 -7.835 -25.169 1.00 0.00 C ATOM 2093 C ALA A 134 -12.958 -8.041 -26.607 1.00 0.00 C ATOM 2094 O ALA A 134 -12.198 -8.547 -27.437 1.00 0.00 O ATOM 2095 CB ALA A 134 -13.474 -7.300 -24.125 1.00 0.00 C ATOM 0 H ALA A 134 -10.499 -7.377 -24.814 1.00 0.00 H new ATOM 0 HA ALA A 134 -12.273 -8.844 -24.812 1.00 0.00 H new ATOM 0 HB1 ALA A 134 -14.343 -7.956 -24.081 1.00 0.00 H new ATOM 0 HB2 ALA A 134 -12.994 -7.268 -23.147 1.00 0.00 H new ATOM 0 HB3 ALA A 134 -13.791 -6.296 -24.406 1.00 0.00 H new ATOM 2101 N ASP A 135 -14.177 -7.603 -26.918 1.00 0.00 N ATOM 2102 CA ASP A 135 -14.759 -7.637 -28.256 1.00 0.00 C ATOM 2103 C ASP A 135 -14.787 -6.243 -28.904 1.00 0.00 C ATOM 2104 O ASP A 135 -15.420 -6.029 -29.938 1.00 0.00 O ATOM 2105 CB ASP A 135 -16.150 -8.257 -28.176 1.00 0.00 C ATOM 2106 CG ASP A 135 -16.740 -8.596 -29.559 1.00 0.00 C ATOM 2107 OD1 ASP A 135 -16.070 -9.299 -30.354 1.00 0.00 O ATOM 2108 OD2 ASP A 135 -17.907 -8.217 -29.827 1.00 0.00 O ATOM 0 H ASP A 135 -14.806 -7.202 -26.222 1.00 0.00 H new ATOM 0 HA ASP A 135 -14.133 -8.253 -28.901 1.00 0.00 H new ATOM 0 HB2 ASP A 135 -16.103 -9.165 -27.575 1.00 0.00 H new ATOM 0 HB3 ASP A 135 -16.819 -7.568 -27.661 1.00 0.00 H new ATOM 2113 N GLY A 136 -14.139 -5.266 -28.262 1.00 0.00 N ATOM 2114 CA GLY A 136 -14.160 -3.859 -28.642 1.00 0.00 C ATOM 2115 C GLY A 136 -15.179 -3.052 -27.840 1.00 0.00 C ATOM 2116 O GLY A 136 -15.609 -1.989 -28.288 1.00 0.00 O ATOM 0 H GLY A 136 -13.567 -5.444 -27.436 1.00 0.00 H new ATOM 0 HA2 GLY A 136 -13.168 -3.432 -28.497 1.00 0.00 H new ATOM 0 HA3 GLY A 136 -14.390 -3.776 -29.704 1.00 0.00 H new ATOM 2120 N GLN A 137 -15.574 -3.554 -26.662 1.00 0.00 N ATOM 2121 CA GLN A 137 -16.635 -2.993 -25.835 1.00 0.00 C ATOM 2122 C GLN A 137 -16.052 -2.152 -24.705 1.00 0.00 C ATOM 2123 O GLN A 137 -16.766 -1.371 -24.084 1.00 0.00 O ATOM 2124 CB GLN A 137 -17.517 -4.113 -25.253 1.00 0.00 C ATOM 2125 CG GLN A 137 -17.650 -5.324 -26.178 1.00 0.00 C ATOM 2126 CD GLN A 137 -18.510 -6.422 -25.557 1.00 0.00 C ATOM 2127 OE1 GLN A 137 -19.674 -6.614 -25.902 1.00 0.00 O ATOM 2128 NE2 GLN A 137 -17.939 -7.158 -24.614 1.00 0.00 N ATOM 0 H GLN A 137 -15.148 -4.385 -26.252 1.00 0.00 H new ATOM 0 HA GLN A 137 -17.250 -2.352 -26.466 1.00 0.00 H new ATOM 0 HB2 GLN A 137 -17.098 -4.437 -24.300 1.00 0.00 H new ATOM 0 HB3 GLN A 137 -18.509 -3.713 -25.045 1.00 0.00 H new ATOM 0 HG2 GLN A 137 -18.089 -5.011 -27.125 1.00 0.00 H new ATOM 0 HG3 GLN A 137 -16.660 -5.721 -26.401 1.00 0.00 H new ATOM 0 HE21 GLN A 137 -16.972 -6.980 -24.344 1.00 0.00 H new ATOM 0 HE22 GLN A 137 -18.467 -7.902 -24.158 1.00 0.00 H new ATOM 2137 N LEU A 138 -14.763 -2.348 -24.402 1.00 0.00 N ATOM 2138 CA LEU A 138 -14.033 -1.536 -23.417 1.00 0.00 C ATOM 2139 C LEU A 138 -12.700 -1.060 -23.974 1.00 0.00 C ATOM 2140 O LEU A 138 -12.049 -1.790 -24.718 1.00 0.00 O ATOM 2141 CB LEU A 138 -13.861 -2.190 -22.020 1.00 0.00 C ATOM 2142 CG LEU A 138 -13.914 -3.725 -21.909 1.00 0.00 C ATOM 2143 CD1 LEU A 138 -13.177 -4.218 -20.658 1.00 0.00 C ATOM 2144 CD2 LEU A 138 -15.367 -4.204 -21.807 1.00 0.00 C ATOM 0 H LEU A 138 -14.194 -3.076 -24.834 1.00 0.00 H new ATOM 0 HA LEU A 138 -14.674 -0.673 -23.239 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -12.902 -1.863 -21.618 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -14.635 -1.785 -21.368 1.00 0.00 H new ATOM 0 HG LEU A 138 -13.437 -4.126 -22.803 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -13.232 -5.305 -20.608 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -12.133 -3.910 -20.706 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -13.641 -3.790 -19.770 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -15.387 -5.291 -21.729 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -15.833 -3.768 -20.923 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -15.916 -3.894 -22.696 1.00 0.00 H new ATOM 2156 N PHE A 139 -12.296 0.157 -23.604 1.00 0.00 N ATOM 2157 CA PHE A 139 -11.027 0.757 -23.959 1.00 0.00 C ATOM 2158 C PHE A 139 -9.926 0.187 -23.085 1.00 0.00 C ATOM 2159 O PHE A 139 -10.157 -0.167 -21.928 1.00 0.00 O ATOM 2160 CB PHE A 139 -11.047 2.279 -23.757 1.00 0.00 C ATOM 2161 CG PHE A 139 -12.026 3.035 -24.623 1.00 0.00 C ATOM 2162 CD1 PHE A 139 -11.898 3.001 -26.025 1.00 0.00 C ATOM 2163 CD2 PHE A 139 -13.065 3.775 -24.033 1.00 0.00 C ATOM 2164 CE1 PHE A 139 -12.794 3.725 -26.827 1.00 0.00 C ATOM 2165 CE2 PHE A 139 -13.975 4.472 -24.841 1.00 0.00 C ATOM 2166 CZ PHE A 139 -13.837 4.456 -26.238 1.00 0.00 C ATOM 0 H PHE A 139 -12.873 0.768 -23.026 1.00 0.00 H new ATOM 0 HA PHE A 139 -10.846 0.535 -25.011 1.00 0.00 H new ATOM 0 HB2 PHE A 139 -11.277 2.487 -22.712 1.00 0.00 H new ATOM 0 HB3 PHE A 139 -10.046 2.667 -23.946 1.00 0.00 H new ATOM 0 HD1 PHE A 139 -11.112 2.419 -26.482 1.00 0.00 H new ATOM 0 HD2 PHE A 139 -13.163 3.807 -22.958 1.00 0.00 H new ATOM 0 HE1 PHE A 139 -12.680 3.719 -27.901 1.00 0.00 H new ATOM 0 HE2 PHE A 139 -14.785 5.023 -24.387 1.00 0.00 H new ATOM 0 HZ PHE A 139 -14.531 5.004 -26.857 1.00 0.00 H new ATOM 2176 N VAL A 140 -8.702 0.228 -23.601 1.00 0.00 N ATOM 2177 CA VAL A 140 -7.495 -0.177 -22.897 1.00 0.00 C ATOM 2178 C VAL A 140 -7.177 0.734 -21.690 1.00 0.00 C ATOM 2179 O VAL A 140 -6.310 0.387 -20.890 1.00 0.00 O ATOM 2180 CB VAL A 140 -6.317 -0.211 -23.897 1.00 0.00 C ATOM 2181 CG1 VAL A 140 -6.411 -1.339 -24.924 1.00 0.00 C ATOM 2182 CG2 VAL A 140 -6.131 1.123 -24.612 1.00 0.00 C ATOM 0 H VAL A 140 -8.519 0.554 -24.550 1.00 0.00 H new ATOM 0 HA VAL A 140 -7.658 -1.173 -22.485 1.00 0.00 H new ATOM 0 HB VAL A 140 -5.440 -0.409 -23.280 1.00 0.00 H new ATOM 0 HG11 VAL A 140 -5.549 -1.297 -25.590 1.00 0.00 H new ATOM 0 HG12 VAL A 140 -6.425 -2.300 -24.409 1.00 0.00 H new ATOM 0 HG13 VAL A 140 -7.326 -1.226 -25.506 1.00 0.00 H new ATOM 0 HG21 VAL A 140 -5.292 1.051 -25.304 1.00 0.00 H new ATOM 0 HG22 VAL A 140 -7.038 1.369 -25.165 1.00 0.00 H new ATOM 0 HG23 VAL A 140 -5.930 1.904 -23.879 1.00 0.00 H new ATOM 2192 N GLY A 141 -7.827 1.898 -21.545 1.00 0.00 N ATOM 2193 CA GLY A 141 -7.455 2.862 -20.510 1.00 0.00 C ATOM 2194 C GLY A 141 -8.393 4.063 -20.468 1.00 0.00 C ATOM 2195 O GLY A 141 -9.343 4.125 -21.249 1.00 0.00 O ATOM 0 H GLY A 141 -8.609 2.190 -22.131 1.00 0.00 H new ATOM 0 HA2 GLY A 141 -7.459 2.367 -19.539 1.00 0.00 H new ATOM 0 HA3 GLY A 141 -6.436 3.206 -20.688 1.00 0.00 H new ATOM 2199 N LEU A 142 -8.107 5.035 -19.592 1.00 0.00 N ATOM 2200 CA LEU A 142 -8.815 6.316 -19.557 1.00 0.00 C ATOM 2201 C LEU A 142 -8.514 7.066 -20.842 1.00 0.00 C ATOM 2202 O LEU A 142 -7.357 7.200 -21.235 1.00 0.00 O ATOM 2203 CB LEU A 142 -8.419 7.132 -18.315 1.00 0.00 C ATOM 2204 CG LEU A 142 -8.782 8.629 -18.243 1.00 0.00 C ATOM 2205 CD1 LEU A 142 -10.302 8.842 -18.194 1.00 0.00 C ATOM 2206 CD2 LEU A 142 -8.173 9.242 -16.983 1.00 0.00 C ATOM 0 H LEU A 142 -7.375 4.952 -18.886 1.00 0.00 H new ATOM 0 HA LEU A 142 -9.889 6.145 -19.485 1.00 0.00 H new ATOM 0 HB2 LEU A 142 -8.866 6.645 -17.448 1.00 0.00 H new ATOM 0 HB3 LEU A 142 -7.338 7.052 -18.203 1.00 0.00 H new ATOM 0 HG LEU A 142 -8.388 9.106 -19.140 1.00 0.00 H new ATOM 0 HD11 LEU A 142 -10.518 9.909 -18.144 1.00 0.00 H new ATOM 0 HD12 LEU A 142 -10.757 8.421 -19.090 1.00 0.00 H new ATOM 0 HD13 LEU A 142 -10.711 8.347 -17.313 1.00 0.00 H new ATOM 0 HD21 LEU A 142 -8.430 10.300 -16.932 1.00 0.00 H new ATOM 0 HD22 LEU A 142 -8.565 8.731 -16.104 1.00 0.00 H new ATOM 0 HD23 LEU A 142 -7.089 9.133 -17.013 1.00 0.00 H new ATOM 2218 N ALA A 143 -9.573 7.561 -21.471 1.00 0.00 N ATOM 2219 CA ALA A 143 -9.511 8.235 -22.754 1.00 0.00 C ATOM 2220 C ALA A 143 -9.996 9.668 -22.568 1.00 0.00 C ATOM 2221 O ALA A 143 -11.170 9.869 -22.249 1.00 0.00 O ATOM 2222 CB ALA A 143 -10.365 7.427 -23.745 1.00 0.00 C ATOM 0 H ALA A 143 -10.518 7.502 -21.092 1.00 0.00 H new ATOM 0 HA ALA A 143 -8.499 8.290 -23.154 1.00 0.00 H new ATOM 0 HB1 ALA A 143 -10.340 7.908 -24.723 1.00 0.00 H new ATOM 0 HB2 ALA A 143 -9.967 6.416 -23.828 1.00 0.00 H new ATOM 0 HB3 ALA A 143 -11.394 7.384 -23.388 1.00 0.00 H new ATOM 2228 N LEU A 144 -9.103 10.649 -22.724 1.00 0.00 N ATOM 2229 CA LEU A 144 -9.407 12.074 -22.568 1.00 0.00 C ATOM 2230 C LEU A 144 -9.336 12.763 -23.925 1.00 0.00 C ATOM 2231 O LEU A 144 -8.600 12.325 -24.812 1.00 0.00 O ATOM 2232 CB LEU A 144 -8.424 12.750 -21.598 1.00 0.00 C ATOM 2233 CG LEU A 144 -8.336 12.130 -20.196 1.00 0.00 C ATOM 2234 CD1 LEU A 144 -7.398 12.953 -19.307 1.00 0.00 C ATOM 2235 CD2 LEU A 144 -9.714 12.037 -19.531 1.00 0.00 C ATOM 0 H LEU A 144 -8.129 10.471 -22.967 1.00 0.00 H new ATOM 0 HA LEU A 144 -10.412 12.165 -22.156 1.00 0.00 H new ATOM 0 HB2 LEU A 144 -7.430 12.732 -22.046 1.00 0.00 H new ATOM 0 HB3 LEU A 144 -8.708 13.797 -21.494 1.00 0.00 H new ATOM 0 HG LEU A 144 -7.941 11.121 -20.312 1.00 0.00 H new ATOM 0 HD11 LEU A 144 -7.346 12.501 -18.316 1.00 0.00 H new ATOM 0 HD12 LEU A 144 -6.402 12.973 -19.749 1.00 0.00 H new ATOM 0 HD13 LEU A 144 -7.778 13.971 -19.222 1.00 0.00 H new ATOM 0 HD21 LEU A 144 -9.611 11.593 -18.541 1.00 0.00 H new ATOM 0 HD22 LEU A 144 -10.142 13.035 -19.439 1.00 0.00 H new ATOM 0 HD23 LEU A 144 -10.371 11.416 -20.140 1.00 0.00 H new ATOM 2247 N ASP A 145 -10.064 13.866 -24.071 1.00 0.00 N ATOM 2248 CA ASP A 145 -10.025 14.704 -25.262 1.00 0.00 C ATOM 2249 C ASP A 145 -10.186 16.150 -24.825 1.00 0.00 C ATOM 2250 O ASP A 145 -11.095 16.494 -24.069 1.00 0.00 O ATOM 2251 CB ASP A 145 -11.030 14.219 -26.315 1.00 0.00 C ATOM 2252 CG ASP A 145 -12.101 15.243 -26.618 1.00 0.00 C ATOM 2253 OD1 ASP A 145 -11.795 16.291 -27.227 1.00 0.00 O ATOM 2254 OD2 ASP A 145 -13.276 14.934 -26.338 1.00 0.00 O ATOM 0 H ASP A 145 -10.706 14.206 -23.355 1.00 0.00 H new ATOM 0 HA ASP A 145 -9.065 14.630 -25.773 1.00 0.00 H new ATOM 0 HB2 ASP A 145 -10.497 13.975 -27.234 1.00 0.00 H new ATOM 0 HB3 ASP A 145 -11.501 13.300 -25.965 1.00 0.00 H new ATOM 2259 N GLU A 146 -9.261 16.985 -25.288 1.00 0.00 N ATOM 2260 CA GLU A 146 -9.087 18.354 -24.830 1.00 0.00 C ATOM 2261 C GLU A 146 -9.678 19.346 -25.841 1.00 0.00 C ATOM 2262 O GLU A 146 -9.385 20.540 -25.765 1.00 0.00 O ATOM 2263 CB GLU A 146 -7.594 18.620 -24.541 1.00 0.00 C ATOM 2264 CG GLU A 146 -6.976 17.687 -23.485 1.00 0.00 C ATOM 2265 CD GLU A 146 -7.644 17.780 -22.095 1.00 0.00 C ATOM 2266 OE1 GLU A 146 -8.088 18.882 -21.684 1.00 0.00 O ATOM 2267 OE2 GLU A 146 -7.679 16.748 -21.383 1.00 0.00 O1- ATOM 0 H GLU A 146 -8.594 16.718 -26.012 1.00 0.00 H new ATOM 0 HA GLU A 146 -9.634 18.499 -23.899 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -7.033 18.520 -25.470 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -7.479 19.652 -24.209 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -7.042 16.659 -23.840 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -5.916 17.921 -23.384 1.00 0.00 H new ATOM 2274 N THR A 147 -10.487 18.871 -26.803 1.00 0.00 N ATOM 2275 CA THR A 147 -11.076 19.731 -27.834 1.00 0.00 C ATOM 2276 C THR A 147 -12.615 19.668 -27.882 1.00 0.00 C ATOM 2277 O THR A 147 -13.249 20.632 -28.315 1.00 0.00 O ATOM 2278 CB THR A 147 -10.352 19.496 -29.178 1.00 0.00 C ATOM 2279 OG1 THR A 147 -10.364 20.654 -29.997 1.00 0.00 O ATOM 2280 CG2 THR A 147 -10.951 18.343 -29.976 1.00 0.00 C ATOM 0 H THR A 147 -10.747 17.888 -26.885 1.00 0.00 H new ATOM 0 HA THR A 147 -10.904 20.774 -27.569 1.00 0.00 H new ATOM 0 HB THR A 147 -9.327 19.246 -28.906 1.00 0.00 H new ATOM 0 HG1 THR A 147 -9.895 20.466 -30.837 1.00 0.00 H new ATOM 0 HG21 THR A 147 -10.403 18.224 -30.911 1.00 0.00 H new ATOM 0 HG22 THR A 147 -10.882 17.424 -29.395 1.00 0.00 H new ATOM 0 HG23 THR A 147 -11.997 18.556 -30.194 1.00 0.00 H new ATOM 2288 N ASN A 148 -13.234 18.593 -27.380 1.00 0.00 N ATOM 2289 CA ASN A 148 -14.680 18.464 -27.219 1.00 0.00 C ATOM 2290 C ASN A 148 -14.992 18.446 -25.727 1.00 0.00 C ATOM 2291 O ASN A 148 -15.862 19.174 -25.255 1.00 0.00 O ATOM 2292 CB ASN A 148 -15.259 17.173 -27.840 1.00 0.00 C ATOM 2293 CG ASN A 148 -14.811 16.800 -29.241 1.00 0.00 C ATOM 2294 OD1 ASN A 148 -15.647 16.648 -30.119 1.00 0.00 O ATOM 2295 ND2 ASN A 148 -13.528 16.555 -29.452 1.00 0.00 N ATOM 0 H ASN A 148 -12.724 17.767 -27.067 1.00 0.00 H new ATOM 0 HA ASN A 148 -15.136 19.307 -27.737 1.00 0.00 H new ATOM 0 HB2 ASN A 148 -15.013 16.343 -27.178 1.00 0.00 H new ATOM 0 HB3 ASN A 148 -16.345 17.263 -27.848 1.00 0.00 H new ATOM 0 HD21 ASN A 148 -13.215 16.230 -30.367 1.00 0.00 H new ATOM 0 HD22 ASN A 148 -12.852 16.691 -28.700 1.00 0.00 H new ATOM 2302 N GLN A 149 -14.262 17.600 -24.992 1.00 0.00 N ATOM 2303 CA GLN A 149 -14.527 17.244 -23.606 1.00 0.00 C ATOM 2304 C GLN A 149 -13.541 17.885 -22.631 1.00 0.00 C ATOM 2305 O GLN A 149 -13.403 17.411 -21.504 1.00 0.00 O ATOM 2306 CB GLN A 149 -14.564 15.718 -23.472 1.00 0.00 C ATOM 2307 CG GLN A 149 -15.696 15.090 -24.294 1.00 0.00 C ATOM 2308 CD GLN A 149 -15.689 13.581 -24.090 1.00 0.00 C ATOM 2309 OE1 GLN A 149 -16.555 13.014 -23.429 1.00 0.00 O ATOM 2310 NE2 GLN A 149 -14.675 12.923 -24.621 1.00 0.00 N ATOM 0 H GLN A 149 -13.439 17.129 -25.368 1.00 0.00 H new ATOM 0 HA GLN A 149 -15.502 17.646 -23.331 1.00 0.00 H new ATOM 0 HB2 GLN A 149 -13.609 15.304 -23.796 1.00 0.00 H new ATOM 0 HB3 GLN A 149 -14.688 15.450 -22.423 1.00 0.00 H new ATOM 0 HG2 GLN A 149 -16.656 15.505 -23.988 1.00 0.00 H new ATOM 0 HG3 GLN A 149 -15.568 15.326 -25.350 1.00 0.00 H new ATOM 0 HE21 GLN A 149 -13.972 13.423 -25.165 1.00 0.00 H new ATOM 0 HE22 GLN A 149 -14.595 11.915 -24.487 1.00 0.00 H new ATOM 2319 N TYR A 150 -12.892 18.984 -23.015 1.00 0.00 N ATOM 2320 CA TYR A 150 -12.008 19.746 -22.125 1.00 0.00 C ATOM 2321 C TYR A 150 -12.694 20.124 -20.799 1.00 0.00 C ATOM 2322 O TYR A 150 -12.024 20.291 -19.779 1.00 0.00 O ATOM 2323 CB TYR A 150 -11.515 21.022 -22.835 1.00 0.00 C ATOM 2324 CG TYR A 150 -12.594 21.867 -23.504 1.00 0.00 C ATOM 2325 CD1 TYR A 150 -13.468 22.661 -22.735 1.00 0.00 C ATOM 2326 CD2 TYR A 150 -12.722 21.861 -24.907 1.00 0.00 C ATOM 2327 CE1 TYR A 150 -14.478 23.418 -23.356 1.00 0.00 C ATOM 2328 CE2 TYR A 150 -13.724 22.621 -25.536 1.00 0.00 C ATOM 2329 CZ TYR A 150 -14.615 23.397 -24.763 1.00 0.00 C ATOM 2330 OH TYR A 150 -15.586 24.128 -25.386 1.00 0.00 O ATOM 0 H TYR A 150 -12.963 19.374 -23.955 1.00 0.00 H new ATOM 0 HA TYR A 150 -11.162 19.102 -21.885 1.00 0.00 H new ATOM 0 HB2 TYR A 150 -10.994 21.643 -22.106 1.00 0.00 H new ATOM 0 HB3 TYR A 150 -10.784 20.735 -23.591 1.00 0.00 H new ATOM 0 HD1 TYR A 150 -13.362 22.689 -21.661 1.00 0.00 H new ATOM 0 HD2 TYR A 150 -12.045 21.268 -25.504 1.00 0.00 H new ATOM 0 HE1 TYR A 150 -15.149 24.016 -22.757 1.00 0.00 H new ATOM 0 HE2 TYR A 150 -13.812 22.611 -26.612 1.00 0.00 H new ATOM 0 HH TYR A 150 -15.528 23.991 -26.355 1.00 0.00 H new ATOM 2340 N ASP A 151 -14.027 20.246 -20.804 1.00 0.00 N ATOM 2341 CA ASP A 151 -14.799 20.708 -19.649 1.00 0.00 C ATOM 2342 C ASP A 151 -14.985 19.596 -18.611 1.00 0.00 C ATOM 2343 O ASP A 151 -15.150 19.879 -17.422 1.00 0.00 O ATOM 2344 CB ASP A 151 -16.160 21.218 -20.132 1.00 0.00 C ATOM 2345 CG ASP A 151 -17.029 21.706 -18.961 1.00 0.00 C ATOM 2346 OD1 ASP A 151 -16.715 22.773 -18.377 1.00 0.00 O ATOM 2347 OD2 ASP A 151 -18.055 21.055 -18.651 1.00 0.00 O ATOM 0 H ASP A 151 -14.602 20.025 -21.617 1.00 0.00 H new ATOM 0 HA ASP A 151 -14.250 21.514 -19.163 1.00 0.00 H new ATOM 0 HB2 ASP A 151 -16.013 22.033 -20.841 1.00 0.00 H new ATOM 0 HB3 ASP A 151 -16.680 20.421 -20.664 1.00 0.00 H new ATOM 2352 N LEU A 152 -14.929 18.331 -19.048 1.00 0.00 N ATOM 2353 CA LEU A 152 -15.301 17.170 -18.245 1.00 0.00 C ATOM 2354 C LEU A 152 -14.182 16.142 -18.170 1.00 0.00 C ATOM 2355 O LEU A 152 -14.259 15.241 -17.345 1.00 0.00 O ATOM 2356 CB LEU A 152 -16.600 16.575 -18.801 1.00 0.00 C ATOM 2357 CG LEU A 152 -16.401 15.776 -20.104 1.00 0.00 C ATOM 2358 CD1 LEU A 152 -16.172 14.277 -19.860 1.00 0.00 C ATOM 2359 CD2 LEU A 152 -17.592 15.992 -21.034 1.00 0.00 C ATOM 0 H LEU A 152 -14.617 18.087 -19.988 1.00 0.00 H new ATOM 0 HA LEU A 152 -15.471 17.490 -17.217 1.00 0.00 H new ATOM 0 HB2 LEU A 152 -17.043 15.923 -18.048 1.00 0.00 H new ATOM 0 HB3 LEU A 152 -17.311 17.381 -18.983 1.00 0.00 H new ATOM 0 HG LEU A 152 -15.494 16.153 -20.575 1.00 0.00 H new ATOM 0 HD11 LEU A 152 -16.039 13.769 -20.815 1.00 0.00 H new ATOM 0 HD12 LEU A 152 -15.280 14.140 -19.249 1.00 0.00 H new ATOM 0 HD13 LEU A 152 -17.034 13.857 -19.343 1.00 0.00 H new ATOM 0 HD21 LEU A 152 -17.444 15.424 -21.953 1.00 0.00 H new ATOM 0 HD22 LEU A 152 -18.504 15.654 -20.542 1.00 0.00 H new ATOM 0 HD23 LEU A 152 -17.680 17.052 -21.273 1.00 0.00 H new ATOM 2371 N SER A 153 -13.122 16.250 -18.972 1.00 0.00 N ATOM 2372 CA SER A 153 -11.982 15.343 -18.859 1.00 0.00 C ATOM 2373 C SER A 153 -11.420 15.407 -17.430 1.00 0.00 C ATOM 2374 O SER A 153 -11.007 14.389 -16.880 1.00 0.00 O ATOM 2375 CB SER A 153 -10.934 15.683 -19.931 1.00 0.00 C ATOM 2376 OG SER A 153 -11.396 15.247 -21.201 1.00 0.00 O ATOM 0 H SER A 153 -13.030 16.954 -19.704 1.00 0.00 H new ATOM 0 HA SER A 153 -12.293 14.314 -19.040 1.00 0.00 H new ATOM 0 HB2 SER A 153 -10.751 16.757 -19.948 1.00 0.00 H new ATOM 0 HB3 SER A 153 -9.985 15.202 -19.693 1.00 0.00 H new ATOM 0 HG SER A 153 -12.093 15.856 -21.522 1.00 0.00 H new ATOM 2382 N ASP A 154 -11.556 16.563 -16.776 1.00 0.00 N ATOM 2383 CA ASP A 154 -11.236 16.776 -15.371 1.00 0.00 C ATOM 2384 C ASP A 154 -12.038 15.853 -14.459 1.00 0.00 C ATOM 2385 O ASP A 154 -11.506 15.334 -13.482 1.00 0.00 O ATOM 2386 CB ASP A 154 -11.523 18.238 -15.010 1.00 0.00 C ATOM 2387 CG ASP A 154 -11.325 18.486 -13.505 1.00 0.00 C ATOM 2388 OD1 ASP A 154 -10.154 18.593 -13.076 1.00 0.00 O ATOM 2389 OD2 ASP A 154 -12.335 18.593 -12.771 1.00 0.00 O ATOM 0 H ASP A 154 -11.906 17.406 -17.232 1.00 0.00 H new ATOM 0 HA ASP A 154 -10.181 16.547 -15.223 1.00 0.00 H new ATOM 0 HB2 ASP A 154 -10.863 18.893 -15.579 1.00 0.00 H new ATOM 0 HB3 ASP A 154 -12.545 18.492 -15.292 1.00 0.00 H new ATOM 2394 N GLU A 155 -13.302 15.599 -14.785 1.00 0.00 N ATOM 2395 CA GLU A 155 -14.205 14.776 -14.002 1.00 0.00 C ATOM 2396 C GLU A 155 -13.965 13.301 -14.307 1.00 0.00 C ATOM 2397 O GLU A 155 -13.960 12.458 -13.414 1.00 0.00 O ATOM 2398 CB GLU A 155 -15.659 15.251 -14.198 1.00 0.00 C ATOM 2399 CG GLU A 155 -16.541 14.388 -15.114 1.00 0.00 C ATOM 2400 CD GLU A 155 -18.005 14.866 -15.102 1.00 0.00 C ATOM 2401 OE1 GLU A 155 -18.292 15.999 -15.557 1.00 0.00 O ATOM 2402 OE2 GLU A 155 -18.887 14.102 -14.637 1.00 0.00 O ATOM 0 H GLU A 155 -13.735 15.974 -15.629 1.00 0.00 H new ATOM 0 HA GLU A 155 -14.004 14.889 -12.937 1.00 0.00 H new ATOM 0 HB2 GLU A 155 -16.135 15.307 -13.219 1.00 0.00 H new ATOM 0 HB3 GLU A 155 -15.637 16.264 -14.600 1.00 0.00 H new ATOM 0 HG2 GLU A 155 -16.154 14.424 -16.132 1.00 0.00 H new ATOM 0 HG3 GLU A 155 -16.494 13.348 -14.791 1.00 0.00 H new ATOM 2409 N ARG A 156 -13.682 13.000 -15.572 1.00 0.00 N ATOM 2410 CA ARG A 156 -13.504 11.628 -16.045 1.00 0.00 C ATOM 2411 C ARG A 156 -12.244 11.046 -15.440 1.00 0.00 C ATOM 2412 O ARG A 156 -12.198 9.852 -15.158 1.00 0.00 O ATOM 2413 CB ARG A 156 -13.498 11.600 -17.581 1.00 0.00 C ATOM 2414 CG ARG A 156 -13.893 10.207 -18.095 1.00 0.00 C ATOM 2415 CD ARG A 156 -13.808 10.149 -19.622 1.00 0.00 C ATOM 2416 NE ARG A 156 -14.432 8.915 -20.154 1.00 0.00 N ATOM 2417 CZ ARG A 156 -15.735 8.722 -20.427 1.00 0.00 C ATOM 2418 NH1 ARG A 156 -16.631 9.681 -20.206 1.00 0.00 N ATOM 2419 NH2 ARG A 156 -16.138 7.555 -20.920 1.00 0.00 N ATOM 0 H ARG A 156 -13.569 13.704 -16.302 1.00 0.00 H new ATOM 0 HA ARG A 156 -14.337 11.003 -15.722 1.00 0.00 H new ATOM 0 HB2 ARG A 156 -14.192 12.347 -17.967 1.00 0.00 H new ATOM 0 HB3 ARG A 156 -12.507 11.864 -17.952 1.00 0.00 H new ATOM 0 HG2 ARG A 156 -13.236 9.454 -17.660 1.00 0.00 H new ATOM 0 HG3 ARG A 156 -14.907 9.969 -17.773 1.00 0.00 H new ATOM 0 HD2 ARG A 156 -14.303 11.021 -20.048 1.00 0.00 H new ATOM 0 HD3 ARG A 156 -12.764 10.192 -19.931 1.00 0.00 H new ATOM 0 HE ARG A 156 -13.807 8.128 -20.332 1.00 0.00 H new ATOM 0 HH11 ARG A 156 -16.333 10.579 -19.824 1.00 0.00 H new ATOM 0 HH12 ARG A 156 -17.615 9.518 -20.419 1.00 0.00 H new ATOM 0 HH21 ARG A 156 -15.460 6.812 -21.089 1.00 0.00 H new ATOM 0 HH22 ARG A 156 -17.125 7.403 -21.129 1.00 0.00 H new ATOM 2433 N ILE A 157 -11.250 11.892 -15.183 1.00 0.00 N ATOM 2434 CA ILE A 157 -10.074 11.494 -14.441 1.00 0.00 C ATOM 2435 C ILE A 157 -10.506 11.009 -13.056 1.00 0.00 C ATOM 2436 O ILE A 157 -10.167 9.901 -12.674 1.00 0.00 O ATOM 2437 CB ILE A 157 -9.053 12.654 -14.384 1.00 0.00 C ATOM 2438 CG1 ILE A 157 -8.371 12.933 -15.734 1.00 0.00 C ATOM 2439 CG2 ILE A 157 -7.981 12.288 -13.354 1.00 0.00 C ATOM 2440 CD1 ILE A 157 -7.755 14.337 -15.799 1.00 0.00 C ATOM 0 H ILE A 157 -11.244 12.866 -15.485 1.00 0.00 H new ATOM 0 HA ILE A 157 -9.567 10.669 -14.941 1.00 0.00 H new ATOM 0 HB ILE A 157 -9.595 13.560 -14.113 1.00 0.00 H new ATOM 0 HG12 ILE A 157 -7.593 12.189 -15.905 1.00 0.00 H new ATOM 0 HG13 ILE A 157 -9.100 12.822 -16.536 1.00 0.00 H new ATOM 0 HG21 ILE A 157 -7.246 13.091 -13.293 1.00 0.00 H new ATOM 0 HG22 ILE A 157 -8.447 12.147 -12.379 1.00 0.00 H new ATOM 0 HG23 ILE A 157 -7.486 11.365 -13.656 1.00 0.00 H new ATOM 0 HD11 ILE A 157 -7.286 14.484 -16.772 1.00 0.00 H new ATOM 0 HD12 ILE A 157 -8.536 15.084 -15.656 1.00 0.00 H new ATOM 0 HD13 ILE A 157 -7.005 14.442 -15.015 1.00 0.00 H new ATOM 2452 N GLN A 158 -11.238 11.819 -12.300 1.00 0.00 N ATOM 2453 CA GLN A 158 -11.691 11.519 -10.931 1.00 0.00 C ATOM 2454 C GLN A 158 -12.397 10.190 -10.891 1.00 0.00 C ATOM 2455 O GLN A 158 -12.093 9.333 -10.066 1.00 0.00 O ATOM 2456 CB GLN A 158 -12.653 12.577 -10.360 1.00 0.00 C ATOM 2457 CG GLN A 158 -11.984 13.929 -10.458 1.00 0.00 C ATOM 2458 CD GLN A 158 -12.874 15.112 -10.142 1.00 0.00 C ATOM 2459 OE1 GLN A 158 -13.504 15.217 -9.093 1.00 0.00 O ATOM 2460 NE2 GLN A 158 -12.904 16.026 -11.087 1.00 0.00 N ATOM 0 H GLN A 158 -11.547 12.735 -12.626 1.00 0.00 H new ATOM 0 HA GLN A 158 -10.788 11.510 -10.320 1.00 0.00 H new ATOM 0 HB2 GLN A 158 -13.591 12.576 -10.915 1.00 0.00 H new ATOM 0 HB3 GLN A 158 -12.897 12.348 -9.322 1.00 0.00 H new ATOM 0 HG2 GLN A 158 -11.131 13.945 -9.779 1.00 0.00 H new ATOM 0 HG3 GLN A 158 -11.591 14.050 -11.467 1.00 0.00 H new ATOM 0 HE21 GLN A 158 -12.363 15.894 -11.942 1.00 0.00 H new ATOM 0 HE22 GLN A 158 -13.468 16.867 -10.965 1.00 0.00 H new ATOM 2469 N SER A 159 -13.304 10.019 -11.836 1.00 0.00 N ATOM 2470 CA SER A 159 -14.092 8.793 -11.878 1.00 0.00 C ATOM 2471 C SER A 159 -13.194 7.597 -12.199 1.00 0.00 C ATOM 2472 O SER A 159 -13.371 6.516 -11.638 1.00 0.00 O ATOM 2473 CB SER A 159 -15.216 8.903 -12.896 1.00 0.00 C ATOM 2474 OG SER A 159 -16.024 10.041 -12.630 1.00 0.00 O ATOM 0 H SER A 159 -13.513 10.695 -12.571 1.00 0.00 H new ATOM 0 HA SER A 159 -14.540 8.641 -10.896 1.00 0.00 H new ATOM 0 HB2 SER A 159 -14.798 8.974 -13.900 1.00 0.00 H new ATOM 0 HB3 SER A 159 -15.828 8.002 -12.868 1.00 0.00 H new ATOM 0 HG SER A 159 -15.516 10.856 -12.825 1.00 0.00 H new ATOM 2480 N TRP A 160 -12.189 7.789 -13.058 1.00 0.00 N ATOM 2481 CA TRP A 160 -11.245 6.736 -13.389 1.00 0.00 C ATOM 2482 C TRP A 160 -10.415 6.382 -12.169 1.00 0.00 C ATOM 2483 O TRP A 160 -10.253 5.218 -11.819 1.00 0.00 O ATOM 2484 CB TRP A 160 -10.347 7.230 -14.516 1.00 0.00 C ATOM 2485 CG TRP A 160 -9.466 6.172 -15.056 1.00 0.00 C ATOM 2486 CD1 TRP A 160 -9.896 5.113 -15.772 1.00 0.00 C ATOM 2487 CD2 TRP A 160 -8.011 6.089 -15.022 1.00 0.00 C ATOM 2488 NE1 TRP A 160 -8.806 4.384 -16.181 1.00 0.00 N ATOM 2489 CE2 TRP A 160 -7.624 4.928 -15.743 1.00 0.00 C ATOM 2490 CE3 TRP A 160 -6.981 6.917 -14.536 1.00 0.00 C ATOM 2491 CZ2 TRP A 160 -6.287 4.577 -15.943 1.00 0.00 C ATOM 2492 CZ3 TRP A 160 -5.626 6.598 -14.764 1.00 0.00 C ATOM 2493 CH2 TRP A 160 -5.281 5.428 -15.462 1.00 0.00 C ATOM 0 H TRP A 160 -12.014 8.673 -13.536 1.00 0.00 H new ATOM 0 HA TRP A 160 -11.779 5.841 -13.709 1.00 0.00 H new ATOM 0 HB2 TRP A 160 -10.967 7.625 -15.321 1.00 0.00 H new ATOM 0 HB3 TRP A 160 -9.735 8.054 -14.151 1.00 0.00 H new ATOM 0 HD1 TRP A 160 -10.927 4.877 -15.988 1.00 0.00 H new ATOM 0 HE1 TRP A 160 -8.868 3.536 -16.745 1.00 0.00 H new ATOM 0 HE3 TRP A 160 -7.232 7.809 -13.981 1.00 0.00 H new ATOM 0 HZ2 TRP A 160 -6.032 3.664 -16.460 1.00 0.00 H new ATOM 0 HZ3 TRP A 160 -4.850 7.256 -14.401 1.00 0.00 H new ATOM 0 HH2 TRP A 160 -4.242 5.184 -15.628 1.00 0.00 H new ATOM 2504 N CYS A 161 -9.952 7.411 -11.473 1.00 0.00 N ATOM 2505 CA CYS A 161 -9.176 7.278 -10.264 1.00 0.00 C ATOM 2506 C CYS A 161 -9.968 6.495 -9.231 1.00 0.00 C ATOM 2507 O CYS A 161 -9.375 5.685 -8.523 1.00 0.00 O ATOM 2508 CB CYS A 161 -8.818 8.668 -9.732 1.00 0.00 C ATOM 2509 SG CYS A 161 -7.681 9.460 -10.895 1.00 0.00 S ATOM 0 H CYS A 161 -10.113 8.381 -11.746 1.00 0.00 H new ATOM 0 HA CYS A 161 -8.254 6.737 -10.476 1.00 0.00 H new ATOM 0 HB2 CYS A 161 -9.718 9.271 -9.614 1.00 0.00 H new ATOM 0 HB3 CYS A 161 -8.357 8.588 -8.748 1.00 0.00 H new ATOM 0 HG CYS A 161 -8.340 9.863 -11.941 1.00 0.00 H new ATOM 2515 N GLU A 162 -11.287 6.687 -9.187 1.00 0.00 N ATOM 2516 CA GLU A 162 -12.123 6.104 -8.166 1.00 0.00 C ATOM 2517 C GLU A 162 -12.206 4.586 -8.365 1.00 0.00 C ATOM 2518 O GLU A 162 -12.250 3.843 -7.381 1.00 0.00 O ATOM 2519 CB GLU A 162 -13.457 6.862 -8.199 1.00 0.00 C ATOM 2520 CG GLU A 162 -14.665 6.103 -7.662 1.00 0.00 C ATOM 2521 CD GLU A 162 -14.576 5.707 -6.171 1.00 0.00 C ATOM 2522 OE1 GLU A 162 -13.858 6.372 -5.386 1.00 0.00 O ATOM 2523 OE2 GLU A 162 -15.266 4.740 -5.771 1.00 0.00 O ATOM 0 H GLU A 162 -11.796 7.254 -9.865 1.00 0.00 H new ATOM 0 HA GLU A 162 -11.720 6.212 -7.159 1.00 0.00 H new ATOM 0 HB2 GLU A 162 -13.345 7.782 -7.625 1.00 0.00 H new ATOM 0 HB3 GLU A 162 -13.663 7.152 -9.229 1.00 0.00 H new ATOM 0 HG2 GLU A 162 -15.555 6.716 -7.807 1.00 0.00 H new ATOM 0 HG3 GLU A 162 -14.800 5.199 -8.255 1.00 0.00 H new ATOM 2530 N GLN A 163 -12.130 4.109 -9.614 1.00 0.00 N ATOM 2531 CA GLN A 163 -12.005 2.684 -9.863 1.00 0.00 C ATOM 2532 C GLN A 163 -10.573 2.202 -9.667 1.00 0.00 C ATOM 2533 O GLN A 163 -10.389 1.229 -8.946 1.00 0.00 O ATOM 2534 CB GLN A 163 -12.627 2.240 -11.190 1.00 0.00 C ATOM 2535 CG GLN A 163 -12.071 2.914 -12.446 1.00 0.00 C ATOM 2536 CD GLN A 163 -12.587 2.260 -13.729 1.00 0.00 C ATOM 2537 OE1 GLN A 163 -13.540 1.483 -13.740 1.00 0.00 O ATOM 2538 NE2 GLN A 163 -11.959 2.566 -14.851 1.00 0.00 N ATOM 0 H GLN A 163 -12.153 4.688 -10.453 1.00 0.00 H new ATOM 0 HA GLN A 163 -12.605 2.181 -9.104 1.00 0.00 H new ATOM 0 HB2 GLN A 163 -12.493 1.163 -11.290 1.00 0.00 H new ATOM 0 HB3 GLN A 163 -13.700 2.425 -11.146 1.00 0.00 H new ATOM 0 HG2 GLN A 163 -12.346 3.969 -12.442 1.00 0.00 H new ATOM 0 HG3 GLN A 163 -10.982 2.868 -12.429 1.00 0.00 H new ATOM 0 HE21 GLN A 163 -11.169 3.211 -14.834 1.00 0.00 H new ATOM 0 HE22 GLN A 163 -12.264 2.157 -15.734 1.00 0.00 H new ATOM 2547 N ILE A 164 -9.544 2.860 -10.211 1.00 0.00 N ATOM 2548 CA ILE A 164 -8.215 2.262 -10.206 1.00 0.00 C ATOM 2549 C ILE A 164 -7.711 2.102 -8.776 1.00 0.00 C ATOM 2550 O ILE A 164 -7.135 1.068 -8.446 1.00 0.00 O ATOM 2551 CB ILE A 164 -7.215 2.997 -11.123 1.00 0.00 C ATOM 2552 CG1 ILE A 164 -6.602 4.310 -10.585 1.00 0.00 C ATOM 2553 CG2 ILE A 164 -7.764 3.126 -12.547 1.00 0.00 C ATOM 2554 CD1 ILE A 164 -5.679 5.026 -11.588 1.00 0.00 C ATOM 0 H ILE A 164 -9.605 3.780 -10.647 1.00 0.00 H new ATOM 0 HA ILE A 164 -8.300 1.266 -10.640 1.00 0.00 H new ATOM 0 HB ILE A 164 -6.343 2.343 -11.141 1.00 0.00 H new ATOM 0 HG12 ILE A 164 -7.408 4.986 -10.302 1.00 0.00 H new ATOM 0 HG13 ILE A 164 -6.037 4.091 -9.679 1.00 0.00 H new ATOM 0 HG21 ILE A 164 -7.038 3.648 -13.171 1.00 0.00 H new ATOM 0 HG22 ILE A 164 -7.948 2.133 -12.957 1.00 0.00 H new ATOM 0 HG23 ILE A 164 -8.697 3.689 -12.528 1.00 0.00 H new ATOM 0 HD11 ILE A 164 -5.289 5.938 -11.136 1.00 0.00 H new ATOM 0 HD12 ILE A 164 -4.851 4.369 -11.853 1.00 0.00 H new ATOM 0 HD13 ILE A 164 -6.243 5.279 -12.486 1.00 0.00 H new ATOM 2566 N LEU A 165 -7.982 3.077 -7.905 1.00 0.00 N ATOM 2567 CA LEU A 165 -7.546 3.045 -6.508 1.00 0.00 C ATOM 2568 C LEU A 165 -8.204 1.905 -5.729 1.00 0.00 C ATOM 2569 O LEU A 165 -7.742 1.571 -4.641 1.00 0.00 O ATOM 2570 CB LEU A 165 -7.769 4.422 -5.847 1.00 0.00 C ATOM 2571 CG LEU A 165 -9.227 4.833 -5.508 1.00 0.00 C ATOM 2572 CD1 LEU A 165 -9.753 4.247 -4.190 1.00 0.00 C ATOM 2573 CD2 LEU A 165 -9.311 6.361 -5.372 1.00 0.00 C ATOM 0 H LEU A 165 -8.512 3.913 -8.150 1.00 0.00 H new ATOM 0 HA LEU A 165 -6.476 2.838 -6.487 1.00 0.00 H new ATOM 0 HB2 LEU A 165 -7.190 4.448 -4.924 1.00 0.00 H new ATOM 0 HB3 LEU A 165 -7.351 5.182 -6.507 1.00 0.00 H new ATOM 0 HG LEU A 165 -9.834 4.443 -6.325 1.00 0.00 H new ATOM 0 HD11 LEU A 165 -10.777 4.582 -4.026 1.00 0.00 H new ATOM 0 HD12 LEU A 165 -9.731 3.158 -4.241 1.00 0.00 H new ATOM 0 HD13 LEU A 165 -9.125 4.584 -3.365 1.00 0.00 H new ATOM 0 HD21 LEU A 165 -10.335 6.649 -5.134 1.00 0.00 H new ATOM 0 HD22 LEU A 165 -8.646 6.692 -4.575 1.00 0.00 H new ATOM 0 HD23 LEU A 165 -9.012 6.827 -6.311 1.00 0.00 H new ATOM 2585 N ASN A 166 -9.257 1.302 -6.283 1.00 0.00 N ATOM 2586 CA ASN A 166 -9.907 0.123 -5.747 1.00 0.00 C ATOM 2587 C ASN A 166 -9.332 -1.078 -6.464 1.00 0.00 C ATOM 2588 O ASN A 166 -8.899 -2.012 -5.809 1.00 0.00 O ATOM 2589 CB ASN A 166 -11.432 0.209 -5.915 1.00 0.00 C ATOM 2590 CG ASN A 166 -12.091 0.986 -4.779 1.00 0.00 C ATOM 2591 OD1 ASN A 166 -12.212 0.481 -3.667 1.00 0.00 O ATOM 2592 ND2 ASN A 166 -12.518 2.220 -5.012 1.00 0.00 N ATOM 0 H ASN A 166 -9.688 1.638 -7.144 1.00 0.00 H new ATOM 0 HA ASN A 166 -9.723 0.038 -4.676 1.00 0.00 H new ATOM 0 HB2 ASN A 166 -11.665 0.689 -6.865 1.00 0.00 H new ATOM 0 HB3 ASN A 166 -11.849 -0.797 -5.955 1.00 0.00 H new ATOM 0 HD21 ASN A 166 -12.952 2.759 -4.263 1.00 0.00 H new ATOM 0 HD22 ASN A 166 -12.412 2.630 -5.940 1.00 0.00 H new ATOM 2599 N GLU A 167 -9.220 -1.034 -7.793 1.00 0.00 N ATOM 2600 CA GLU A 167 -8.815 -2.178 -8.600 1.00 0.00 C ATOM 2601 C GLU A 167 -7.437 -2.667 -8.161 1.00 0.00 C ATOM 2602 O GLU A 167 -7.213 -3.868 -8.068 1.00 0.00 O ATOM 2603 CB GLU A 167 -8.787 -1.813 -10.095 1.00 0.00 C ATOM 2604 CG GLU A 167 -10.158 -1.632 -10.757 1.00 0.00 C ATOM 2605 CD GLU A 167 -10.011 -1.167 -12.218 1.00 0.00 C ATOM 2606 OE1 GLU A 167 -9.848 0.052 -12.458 1.00 0.00 O1- ATOM 2607 OE2 GLU A 167 -10.000 -2.024 -13.133 1.00 0.00 O ATOM 0 H GLU A 167 -9.410 -0.195 -8.340 1.00 0.00 H new ATOM 0 HA GLU A 167 -9.545 -2.974 -8.452 1.00 0.00 H new ATOM 0 HB2 GLU A 167 -8.221 -0.890 -10.215 1.00 0.00 H new ATOM 0 HB3 GLU A 167 -8.244 -2.592 -10.631 1.00 0.00 H new ATOM 0 HG2 GLU A 167 -10.708 -2.573 -10.725 1.00 0.00 H new ATOM 0 HG3 GLU A 167 -10.742 -0.902 -10.197 1.00 0.00 H new ATOM 2614 N MET A 168 -6.527 -1.740 -7.846 1.00 0.00 N ATOM 2615 CA MET A 168 -5.142 -2.052 -7.490 1.00 0.00 C ATOM 2616 C MET A 168 -5.041 -2.542 -6.049 1.00 0.00 C ATOM 2617 O MET A 168 -4.286 -3.464 -5.747 1.00 0.00 O ATOM 2618 CB MET A 168 -4.273 -0.796 -7.713 1.00 0.00 C ATOM 2619 CG MET A 168 -4.303 -0.488 -9.208 1.00 0.00 C ATOM 2620 SD MET A 168 -3.378 0.913 -9.879 1.00 0.00 S ATOM 2621 CE MET A 168 -4.227 2.273 -9.060 1.00 0.00 C ATOM 0 H MET A 168 -6.735 -0.742 -7.831 1.00 0.00 H new ATOM 0 HA MET A 168 -4.779 -2.859 -8.127 1.00 0.00 H new ATOM 0 HB2 MET A 168 -4.659 0.046 -7.139 1.00 0.00 H new ATOM 0 HB3 MET A 168 -3.251 -0.970 -7.376 1.00 0.00 H new ATOM 0 HG2 MET A 168 -3.954 -1.381 -9.727 1.00 0.00 H new ATOM 0 HG3 MET A 168 -5.347 -0.346 -9.486 1.00 0.00 H new ATOM 0 HE1 MET A 168 -3.929 3.216 -9.518 1.00 0.00 H new ATOM 0 HE2 MET A 168 -5.304 2.144 -9.163 1.00 0.00 H new ATOM 0 HE3 MET A 168 -3.962 2.283 -8.003 1.00 0.00 H new ATOM 2631 N ALA A 169 -5.833 -1.933 -5.171 1.00 0.00 N ATOM 2632 CA ALA A 169 -5.828 -2.203 -3.746 1.00 0.00 C ATOM 2633 C ALA A 169 -6.428 -3.576 -3.475 1.00 0.00 C ATOM 2634 O ALA A 169 -5.858 -4.388 -2.751 1.00 0.00 O ATOM 2635 CB ALA A 169 -6.633 -1.114 -3.027 1.00 0.00 C ATOM 0 H ALA A 169 -6.511 -1.221 -5.443 1.00 0.00 H new ATOM 0 HA ALA A 169 -4.804 -2.197 -3.373 1.00 0.00 H new ATOM 0 HB1 ALA A 169 -6.634 -1.310 -1.955 1.00 0.00 H new ATOM 0 HB2 ALA A 169 -6.180 -0.141 -3.217 1.00 0.00 H new ATOM 0 HB3 ALA A 169 -7.658 -1.115 -3.397 1.00 0.00 H new ATOM 2641 N GLU A 170 -7.561 -3.835 -4.118 1.00 0.00 N ATOM 2642 CA GLU A 170 -8.307 -5.076 -4.032 1.00 0.00 C ATOM 2643 C GLU A 170 -7.492 -6.224 -4.648 1.00 0.00 C ATOM 2644 O GLU A 170 -7.601 -7.363 -4.193 1.00 0.00 O ATOM 2645 CB GLU A 170 -9.658 -4.881 -4.740 1.00 0.00 C ATOM 2646 CG GLU A 170 -10.562 -3.846 -4.039 1.00 0.00 C ATOM 2647 CD GLU A 170 -11.236 -4.433 -2.784 1.00 0.00 C ATOM 2648 OE1 GLU A 170 -12.324 -5.045 -2.908 1.00 0.00 O ATOM 2649 OE2 GLU A 170 -10.690 -4.283 -1.662 1.00 0.00 O ATOM 0 H GLU A 170 -8.000 -3.154 -4.738 1.00 0.00 H new ATOM 0 HA GLU A 170 -8.495 -5.342 -2.992 1.00 0.00 H new ATOM 0 HB2 GLU A 170 -9.481 -4.564 -5.768 1.00 0.00 H new ATOM 0 HB3 GLU A 170 -10.179 -5.837 -4.787 1.00 0.00 H new ATOM 0 HG2 GLU A 170 -9.969 -2.975 -3.760 1.00 0.00 H new ATOM 0 HG3 GLU A 170 -11.327 -3.501 -4.735 1.00 0.00 H new ATOM 2656 N HIS A 171 -6.636 -5.931 -5.640 1.00 0.00 N ATOM 2657 CA HIS A 171 -5.724 -6.915 -6.210 1.00 0.00 C ATOM 2658 C HIS A 171 -4.711 -7.381 -5.161 1.00 0.00 C ATOM 2659 O HIS A 171 -4.484 -8.580 -4.979 1.00 0.00 O ATOM 2660 CB HIS A 171 -4.982 -6.329 -7.420 1.00 0.00 C ATOM 2661 CG HIS A 171 -4.701 -7.394 -8.440 1.00 0.00 C ATOM 2662 ND1 HIS A 171 -3.913 -8.529 -8.237 1.00 0.00 N ATOM 2663 CD2 HIS A 171 -5.357 -7.509 -9.630 1.00 0.00 C ATOM 2664 CE1 HIS A 171 -4.143 -9.320 -9.298 1.00 0.00 C ATOM 2665 NE2 HIS A 171 -4.991 -8.728 -10.159 1.00 0.00 N ATOM 0 H HIS A 171 -6.563 -5.006 -6.063 1.00 0.00 H new ATOM 0 HA HIS A 171 -6.315 -7.771 -6.538 1.00 0.00 H new ATOM 0 HB2 HIS A 171 -5.580 -5.537 -7.870 1.00 0.00 H new ATOM 0 HB3 HIS A 171 -4.046 -5.876 -7.094 1.00 0.00 H new ATOM 0 HD2 HIS A 171 -6.030 -6.788 -10.070 1.00 0.00 H new ATOM 0 HE1 HIS A 171 -3.707 -10.298 -9.441 1.00 0.00 H new ATOM 0 HE2 HIS A 171 -5.308 -9.114 -11.048 1.00 0.00 H new ATOM 2673 N TYR A 172 -4.117 -6.410 -4.461 1.00 0.00 N ATOM 2674 CA TYR A 172 -3.036 -6.620 -3.509 1.00 0.00 C ATOM 2675 C TYR A 172 -3.515 -7.058 -2.123 1.00 0.00 C ATOM 2676 O TYR A 172 -2.681 -7.307 -1.244 1.00 0.00 O ATOM 2677 CB TYR A 172 -2.152 -5.362 -3.476 1.00 0.00 C ATOM 2678 CG TYR A 172 -0.798 -5.537 -4.130 1.00 0.00 C ATOM 2679 CD1 TYR A 172 0.142 -6.428 -3.578 1.00 0.00 C ATOM 2680 CD2 TYR A 172 -0.470 -4.785 -5.274 1.00 0.00 C ATOM 2681 CE1 TYR A 172 1.414 -6.566 -4.161 1.00 0.00 C ATOM 2682 CE2 TYR A 172 0.809 -4.906 -5.852 1.00 0.00 C ATOM 2683 CZ TYR A 172 1.754 -5.802 -5.304 1.00 0.00 C ATOM 2684 OH TYR A 172 2.982 -5.920 -5.886 1.00 0.00 O ATOM 0 H TYR A 172 -4.387 -5.430 -4.548 1.00 0.00 H new ATOM 0 HA TYR A 172 -2.436 -7.464 -3.850 1.00 0.00 H new ATOM 0 HB2 TYR A 172 -2.680 -4.548 -3.972 1.00 0.00 H new ATOM 0 HB3 TYR A 172 -2.006 -5.062 -2.438 1.00 0.00 H new ATOM 0 HD1 TYR A 172 -0.115 -7.008 -2.704 1.00 0.00 H new ATOM 0 HD2 TYR A 172 -1.198 -4.116 -5.708 1.00 0.00 H new ATOM 0 HE1 TYR A 172 2.131 -7.254 -3.738 1.00 0.00 H new ATOM 0 HE2 TYR A 172 1.068 -4.312 -6.716 1.00 0.00 H new ATOM 0 HH TYR A 172 3.037 -5.320 -6.659 1.00 0.00 H new ATOM 2694 N ALA A 173 -4.831 -7.159 -1.913 1.00 0.00 N ATOM 2695 CA ALA A 173 -5.393 -7.589 -0.652 1.00 0.00 C ATOM 2696 C ALA A 173 -5.149 -9.085 -0.439 1.00 0.00 C ATOM 2697 O ALA A 173 -4.796 -9.474 0.699 1.00 0.00 O ATOM 2698 CB ALA A 173 -6.883 -7.246 -0.580 1.00 0.00 C ATOM 2699 OXT ALA A 173 -5.339 -9.878 -1.392 1.00 0.00 O1- ATOM 0 H ALA A 173 -5.530 -6.941 -2.623 1.00 0.00 H new ATOM 0 HA ALA A 173 -4.893 -7.053 0.155 1.00 0.00 H new ATOM 0 HB1 ALA A 173 -7.287 -7.578 0.376 1.00 0.00 H new ATOM 0 HB2 ALA A 173 -7.013 -6.168 -0.675 1.00 0.00 H new ATOM 0 HB3 ALA A 173 -7.411 -7.748 -1.391 1.00 0.00 H new