USER MOD reduce.3.24.130724 H: found=0, std=0, add=1041, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 1037 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 116 TYR OH : rot 180:sc= 0.0856 USER MOD Set 1.2: A 117 GLN : amide:sc= 0.487 X(o=0.57,f=0.87) USER MOD Set 2.1: A 109 HIS : no HD1:sc= -1.59 X(o=-3.3,f=-3.2) USER MOD Set 2.2: A 110 GLN : amide:sc= -1.59 K(o=-3.3,f=-2.4!) USER MOD Set 2.3: A 113 GLN : amide:sc= -0.125 X(o=-3.3,f=-2.9) USER MOD Set 3.1: A 46 THR OG1 : rot 180:sc= 0 USER MOD Set 3.2: A 47 HIS : no HD1:sc= -5.58! C(o=-5.6!,f=-8.3!) USER MOD Set 4.1: A 8 CYS SG : rot 146:sc= -2.7! USER MOD Set 4.2: A 34 CYS SG : rot -70:sc= -2.82 USER MOD Single : A 1 MET CE :methyl 150:sc= -0.333 (180deg=-1.72!) USER MOD Single : A 1 MET N :NH3+ -159:sc= -0.0429 (180deg=-0.629) USER MOD Single : A 3 SER OG : rot -77:sc= -0.914! USER MOD Single : A 4 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0.0504 USER MOD Single : A 18 GLN : amide:sc= -0.0431 X(o=-0.043,f=-0.23) USER MOD Single : A 20 CYS SG : rot 80:sc= -2.33 USER MOD Single : A 21 GLN : amide:sc= -5.83! C(o=-5.8!,f=-5.8!) USER MOD Single : A 25 SER OG : rot 61:sc= 1.12 USER MOD Single : A 29 TYR OH : rot 80:sc= -1.8! USER MOD Single : A 30 GLN : amide:sc= -0.0041 X(o=-0.0041,f=-0.24) USER MOD Single : A 32 GLN : amide:sc= -0.601 X(o=-0.6,f=-0.14) USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 39 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 43 TYR OH : rot 130:sc= -0.927 USER MOD Single : A 45 GLN : amide:sc= -4.17! C(o=-4.2!,f=-12!) USER MOD Single : A 50 GLN : amide:sc= -0.0753 X(o=-0.075,f=-0.48) USER MOD Single : A 53 CYS SG : rot -2:sc= -0.614 USER MOD Single : A 60 ASN : amide:sc= -0.106 K(o=-0.11,f=-1.5!) USER MOD Single : A 62 SER OG : rot 180:sc= 0.028 USER MOD Single : A 68 GLN : amide:sc= 0 X(o=0,f=-0.016) USER MOD Single : A 69 GLN : amide:sc= -1.46 K(o=-1.5,f=-5.3!) USER MOD Single : A 71 CYS SG : rot 80:sc= -2.05! USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 GLN : amide:sc= 0 K(o=0,f=-1.5!) USER MOD Single : A 99 TYR OH : rot -11:sc= 0.444 USER MOD Single : A 100 HIS : no HD1:sc= -17.9! C(o=-18!,f=-26!) USER MOD Single : A 101 SER OG : rot -48:sc= 0.0378 USER MOD Single : A 105 HIS : no HD1:sc= -0.529 K(o=-0.53,f=-0.023) USER MOD Single : A 133 THR OG1 : rot 180:sc= 0.151 USER MOD Single : A 134 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -3.396 10.226 16.995 1.00 0.00 N ATOM 2 CA MET A 1 -2.313 9.393 17.600 1.00 0.00 C ATOM 3 C MET A 1 -1.369 8.863 16.520 1.00 0.00 C ATOM 4 O MET A 1 -1.584 7.805 15.968 1.00 0.00 O ATOM 5 CB MET A 1 -3.026 8.218 18.264 1.00 0.00 C ATOM 6 CG MET A 1 -3.925 8.709 19.398 1.00 0.00 C ATOM 7 SD MET A 1 -4.658 7.279 20.233 1.00 0.00 S ATOM 8 CE MET A 1 -3.123 6.570 20.885 1.00 0.00 C ATOM 0 H1 MET A 1 -3.800 10.852 17.721 1.00 0.00 H new ATOM 0 H2 MET A 1 -3.002 10.801 16.223 1.00 0.00 H new ATOM 0 H3 MET A 1 -4.142 9.606 16.619 1.00 0.00 H new ATOM 0 HA MET A 1 -1.716 9.974 18.303 1.00 0.00 H new ATOM 0 HB2 MET A 1 -3.622 7.682 17.525 1.00 0.00 H new ATOM 0 HB3 MET A 1 -2.292 7.513 18.653 1.00 0.00 H new ATOM 0 HG2 MET A 1 -3.347 9.303 20.106 1.00 0.00 H new ATOM 0 HG3 MET A 1 -4.708 9.357 19.004 1.00 0.00 H new ATOM 0 HE1 MET A 1 -3.332 6.043 21.816 1.00 0.00 H new ATOM 0 HE2 MET A 1 -2.707 5.872 20.158 1.00 0.00 H new ATOM 0 HE3 MET A 1 -2.405 7.368 21.073 1.00 0.00 H new ATOM 20 N LEU A 2 -0.320 9.577 16.222 1.00 0.00 N ATOM 21 CA LEU A 2 0.639 9.092 15.185 1.00 0.00 C ATOM 22 C LEU A 2 1.241 7.747 15.595 1.00 0.00 C ATOM 23 O LEU A 2 1.434 6.866 14.781 1.00 0.00 O ATOM 24 CB LEU A 2 1.732 10.159 15.143 1.00 0.00 C ATOM 25 CG LEU A 2 2.809 9.769 14.126 1.00 0.00 C ATOM 26 CD1 LEU A 2 2.279 9.965 12.704 1.00 0.00 C ATOM 27 CD2 LEU A 2 4.043 10.651 14.340 1.00 0.00 C ATOM 0 H LEU A 2 -0.084 10.473 16.649 1.00 0.00 H new ATOM 0 HA LEU A 2 0.157 8.944 14.219 1.00 0.00 H new ATOM 0 HB2 LEU A 2 1.300 11.123 14.875 1.00 0.00 H new ATOM 0 HB3 LEU A 2 2.178 10.273 16.131 1.00 0.00 H new ATOM 0 HG LEU A 2 3.076 8.721 14.263 1.00 0.00 H new ATOM 0 HD11 LEU A 2 3.050 9.686 11.986 1.00 0.00 H new ATOM 0 HD12 LEU A 2 1.400 9.339 12.554 1.00 0.00 H new ATOM 0 HD13 LEU A 2 2.009 11.011 12.557 1.00 0.00 H new ATOM 0 HD21 LEU A 2 4.814 10.379 13.619 1.00 0.00 H new ATOM 0 HD22 LEU A 2 3.771 11.697 14.202 1.00 0.00 H new ATOM 0 HD23 LEU A 2 4.424 10.505 15.351 1.00 0.00 H new ATOM 39 N SER A 3 1.555 7.594 16.855 1.00 0.00 N ATOM 40 CA SER A 3 2.167 6.319 17.331 1.00 0.00 C ATOM 41 C SER A 3 3.194 5.823 16.309 1.00 0.00 C ATOM 42 O SER A 3 4.334 6.243 16.307 1.00 0.00 O ATOM 43 CB SER A 3 1.007 5.334 17.458 1.00 0.00 C ATOM 44 OG SER A 3 -0.038 5.719 16.573 1.00 0.00 O ATOM 0 H SER A 3 1.413 8.300 17.577 1.00 0.00 H new ATOM 0 HA SER A 3 2.691 6.439 18.279 1.00 0.00 H new ATOM 0 HB2 SER A 3 1.345 4.325 17.222 1.00 0.00 H new ATOM 0 HB3 SER A 3 0.641 5.316 18.485 1.00 0.00 H new ATOM 0 HG SER A 3 -0.524 6.480 16.953 1.00 0.00 H new ATOM 50 N GLN A 4 2.796 4.947 15.429 1.00 0.00 N ATOM 51 CA GLN A 4 3.742 4.441 14.401 1.00 0.00 C ATOM 52 C GLN A 4 2.991 4.199 13.090 1.00 0.00 C ATOM 53 O GLN A 4 1.777 4.180 13.058 1.00 0.00 O ATOM 54 CB GLN A 4 4.307 3.142 14.983 1.00 0.00 C ATOM 55 CG GLN A 4 5.129 3.480 16.229 1.00 0.00 C ATOM 56 CD GLN A 4 5.774 2.211 16.790 1.00 0.00 C ATOM 57 OE1 GLN A 4 5.089 1.306 17.223 1.00 0.00 O ATOM 58 NE2 GLN A 4 7.077 2.107 16.811 1.00 0.00 N ATOM 0 H GLN A 4 1.854 4.560 15.379 1.00 0.00 H new ATOM 0 HA GLN A 4 4.543 5.144 14.174 1.00 0.00 H new ATOM 0 HB2 GLN A 4 3.497 2.459 15.238 1.00 0.00 H new ATOM 0 HB3 GLN A 4 4.930 2.637 14.245 1.00 0.00 H new ATOM 0 HG2 GLN A 4 5.899 4.210 15.980 1.00 0.00 H new ATOM 0 HG3 GLN A 4 4.489 3.937 16.984 1.00 0.00 H new ATOM 0 HE21 GLN A 4 7.655 2.865 16.448 1.00 0.00 H new ATOM 0 HE22 GLN A 4 7.516 1.268 17.190 1.00 0.00 H new ATOM 67 N ILE A 5 3.695 4.031 12.008 1.00 0.00 N ATOM 68 CA ILE A 5 3.000 3.811 10.710 1.00 0.00 C ATOM 69 C ILE A 5 3.085 2.342 10.306 1.00 0.00 C ATOM 70 O ILE A 5 4.142 1.743 10.326 1.00 0.00 O ATOM 71 CB ILE A 5 3.741 4.695 9.707 1.00 0.00 C ATOM 72 CG1 ILE A 5 3.690 6.149 10.187 1.00 0.00 C ATOM 73 CG2 ILE A 5 3.062 4.584 8.340 1.00 0.00 C ATOM 74 CD1 ILE A 5 4.429 7.047 9.195 1.00 0.00 C ATOM 0 H ILE A 5 4.714 4.036 11.965 1.00 0.00 H new ATOM 0 HA ILE A 5 1.940 4.060 10.762 1.00 0.00 H new ATOM 0 HB ILE A 5 4.779 4.373 9.625 1.00 0.00 H new ATOM 0 HG12 ILE A 5 2.654 6.474 10.284 1.00 0.00 H new ATOM 0 HG13 ILE A 5 4.144 6.232 11.175 1.00 0.00 H new ATOM 0 HG21 ILE A 5 3.587 5.213 7.621 1.00 0.00 H new ATOM 0 HG22 ILE A 5 3.089 3.548 8.003 1.00 0.00 H new ATOM 0 HG23 ILE A 5 2.026 4.912 8.421 1.00 0.00 H new ATOM 0 HD11 ILE A 5 4.390 8.080 9.541 1.00 0.00 H new ATOM 0 HD12 ILE A 5 5.469 6.728 9.120 1.00 0.00 H new ATOM 0 HD13 ILE A 5 3.956 6.974 8.216 1.00 0.00 H new ATOM 86 N ALA A 6 1.978 1.756 9.937 1.00 0.00 N ATOM 87 CA ALA A 6 1.997 0.324 9.528 1.00 0.00 C ATOM 88 C ALA A 6 2.193 0.231 8.018 1.00 0.00 C ATOM 89 O ALA A 6 1.370 0.682 7.248 1.00 0.00 O ATOM 90 CB ALA A 6 0.630 -0.228 9.935 1.00 0.00 C ATOM 0 H ALA A 6 1.064 2.207 9.901 1.00 0.00 H new ATOM 0 HA ALA A 6 2.806 -0.237 9.995 1.00 0.00 H new ATOM 0 HB1 ALA A 6 0.568 -1.282 9.665 1.00 0.00 H new ATOM 0 HB2 ALA A 6 0.500 -0.121 11.012 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -0.154 0.325 9.418 1.00 0.00 H new ATOM 96 N ILE A 7 3.285 -0.334 7.588 1.00 0.00 N ATOM 97 CA ILE A 7 3.533 -0.430 6.127 1.00 0.00 C ATOM 98 C ILE A 7 3.839 -1.873 5.724 1.00 0.00 C ATOM 99 O ILE A 7 4.802 -2.464 6.171 1.00 0.00 O ATOM 100 CB ILE A 7 4.738 0.484 5.892 1.00 0.00 C ATOM 101 CG1 ILE A 7 4.336 1.923 6.222 1.00 0.00 C ATOM 102 CG2 ILE A 7 5.190 0.406 4.434 1.00 0.00 C ATOM 103 CD1 ILE A 7 5.532 2.852 6.010 1.00 0.00 C ATOM 0 H ILE A 7 4.012 -0.731 8.183 1.00 0.00 H new ATOM 0 HA ILE A 7 2.670 -0.134 5.531 1.00 0.00 H new ATOM 0 HB ILE A 7 5.562 0.165 6.531 1.00 0.00 H new ATOM 0 HG12 ILE A 7 3.505 2.233 5.589 1.00 0.00 H new ATOM 0 HG13 ILE A 7 3.991 1.987 7.254 1.00 0.00 H new ATOM 0 HG21 ILE A 7 6.048 1.062 4.283 1.00 0.00 H new ATOM 0 HG22 ILE A 7 5.471 -0.620 4.195 1.00 0.00 H new ATOM 0 HG23 ILE A 7 4.374 0.720 3.783 1.00 0.00 H new ATOM 0 HD11 ILE A 7 5.243 3.876 6.246 1.00 0.00 H new ATOM 0 HD12 ILE A 7 6.350 2.546 6.662 1.00 0.00 H new ATOM 0 HD13 ILE A 7 5.856 2.796 4.971 1.00 0.00 H new ATOM 115 N CYS A 8 3.032 -2.438 4.865 1.00 0.00 N ATOM 116 CA CYS A 8 3.286 -3.838 4.413 1.00 0.00 C ATOM 117 C CYS A 8 3.774 -3.820 2.971 1.00 0.00 C ATOM 118 O CYS A 8 3.144 -3.251 2.104 1.00 0.00 O ATOM 119 CB CYS A 8 1.942 -4.569 4.502 1.00 0.00 C ATOM 120 SG CYS A 8 2.244 -6.356 4.526 1.00 0.00 S ATOM 0 H CYS A 8 2.210 -1.992 4.458 1.00 0.00 H new ATOM 0 HA CYS A 8 4.043 -4.330 5.024 1.00 0.00 H new ATOM 0 HB2 CYS A 8 1.407 -4.265 5.402 1.00 0.00 H new ATOM 0 HB3 CYS A 8 1.312 -4.305 3.652 1.00 0.00 H new ATOM 0 HG CYS A 8 1.352 -6.937 5.273 1.00 0.00 H new ATOM 126 N ILE A 9 4.892 -4.425 2.699 1.00 0.00 N ATOM 127 CA ILE A 9 5.401 -4.416 1.305 1.00 0.00 C ATOM 128 C ILE A 9 5.346 -5.809 0.695 1.00 0.00 C ATOM 129 O ILE A 9 5.587 -6.806 1.352 1.00 0.00 O ATOM 130 CB ILE A 9 6.848 -3.972 1.414 1.00 0.00 C ATOM 131 CG1 ILE A 9 7.523 -4.126 0.047 1.00 0.00 C ATOM 132 CG2 ILE A 9 7.559 -4.845 2.446 1.00 0.00 C ATOM 133 CD1 ILE A 9 8.966 -3.634 0.137 1.00 0.00 C ATOM 0 H ILE A 9 5.471 -4.922 3.376 1.00 0.00 H new ATOM 0 HA ILE A 9 4.803 -3.762 0.670 1.00 0.00 H new ATOM 0 HB ILE A 9 6.899 -2.929 1.726 1.00 0.00 H new ATOM 0 HG12 ILE A 9 7.502 -5.170 -0.266 1.00 0.00 H new ATOM 0 HG13 ILE A 9 6.979 -3.556 -0.706 1.00 0.00 H new ATOM 0 HG21 ILE A 9 8.600 -4.533 2.531 1.00 0.00 H new ATOM 0 HG22 ILE A 9 7.068 -4.738 3.413 1.00 0.00 H new ATOM 0 HG23 ILE A 9 7.517 -5.888 2.131 1.00 0.00 H new ATOM 0 HD11 ILE A 9 9.449 -3.742 -0.834 1.00 0.00 H new ATOM 0 HD12 ILE A 9 8.975 -2.585 0.431 1.00 0.00 H new ATOM 0 HD13 ILE A 9 9.506 -4.223 0.878 1.00 0.00 H new ATOM 145 N TRP A 10 5.075 -5.876 -0.573 1.00 0.00 N ATOM 146 CA TRP A 10 5.054 -7.200 -1.252 1.00 0.00 C ATOM 147 C TRP A 10 6.201 -7.237 -2.253 1.00 0.00 C ATOM 148 O TRP A 10 6.163 -6.583 -3.277 1.00 0.00 O ATOM 149 CB TRP A 10 3.718 -7.313 -1.982 1.00 0.00 C ATOM 150 CG TRP A 10 3.748 -8.547 -2.833 1.00 0.00 C ATOM 151 CD1 TRP A 10 4.626 -9.569 -2.682 1.00 0.00 C ATOM 152 CD2 TRP A 10 2.894 -8.908 -3.956 1.00 0.00 C ATOM 153 NE1 TRP A 10 4.364 -10.533 -3.640 1.00 0.00 N ATOM 154 CE2 TRP A 10 3.304 -10.173 -4.448 1.00 0.00 C ATOM 155 CE3 TRP A 10 1.814 -8.272 -4.588 1.00 0.00 C ATOM 156 CZ2 TRP A 10 2.666 -10.780 -5.531 1.00 0.00 C ATOM 157 CZ3 TRP A 10 1.173 -8.878 -5.678 1.00 0.00 C ATOM 158 CH2 TRP A 10 1.595 -10.130 -6.148 1.00 0.00 C ATOM 0 H TRP A 10 4.867 -5.075 -1.170 1.00 0.00 H new ATOM 0 HA TRP A 10 5.166 -8.023 -0.546 1.00 0.00 H new ATOM 0 HB2 TRP A 10 2.898 -7.366 -1.266 1.00 0.00 H new ATOM 0 HB3 TRP A 10 3.547 -6.431 -2.599 1.00 0.00 H new ATOM 0 HD1 TRP A 10 5.404 -9.622 -1.935 1.00 0.00 H new ATOM 0 HE1 TRP A 10 4.889 -11.402 -3.737 1.00 0.00 H new ATOM 0 HE3 TRP A 10 1.475 -7.310 -4.233 1.00 0.00 H new ATOM 0 HZ2 TRP A 10 2.998 -11.744 -5.889 1.00 0.00 H new ATOM 0 HZ3 TRP A 10 0.347 -8.376 -6.160 1.00 0.00 H new ATOM 0 HH2 TRP A 10 1.093 -10.591 -6.986 1.00 0.00 H new ATOM 169 N VAL A 11 7.229 -7.970 -1.959 1.00 0.00 N ATOM 170 CA VAL A 11 8.386 -8.019 -2.887 1.00 0.00 C ATOM 171 C VAL A 11 9.113 -9.359 -2.752 1.00 0.00 C ATOM 172 O VAL A 11 9.540 -9.747 -1.682 1.00 0.00 O ATOM 173 CB VAL A 11 9.273 -6.858 -2.433 1.00 0.00 C ATOM 174 CG1 VAL A 11 9.413 -6.893 -0.911 1.00 0.00 C ATOM 175 CG2 VAL A 11 10.652 -6.970 -3.088 1.00 0.00 C ATOM 0 H VAL A 11 7.320 -8.538 -1.117 1.00 0.00 H new ATOM 0 HA VAL A 11 8.101 -7.932 -3.935 1.00 0.00 H new ATOM 0 HB VAL A 11 8.817 -5.914 -2.732 1.00 0.00 H new ATOM 0 HG11 VAL A 11 10.045 -6.067 -0.585 1.00 0.00 H new ATOM 0 HG12 VAL A 11 8.428 -6.800 -0.453 1.00 0.00 H new ATOM 0 HG13 VAL A 11 9.866 -7.837 -0.609 1.00 0.00 H new ATOM 0 HG21 VAL A 11 11.279 -6.140 -2.761 1.00 0.00 H new ATOM 0 HG22 VAL A 11 11.117 -7.912 -2.798 1.00 0.00 H new ATOM 0 HG23 VAL A 11 10.544 -6.937 -4.172 1.00 0.00 H new ATOM 185 N GLU A 12 9.251 -10.065 -3.836 1.00 0.00 N ATOM 186 CA GLU A 12 9.949 -11.385 -3.798 1.00 0.00 C ATOM 187 C GLU A 12 11.465 -11.181 -3.715 1.00 0.00 C ATOM 188 O GLU A 12 12.199 -12.056 -3.302 1.00 0.00 O ATOM 189 CB GLU A 12 9.553 -12.073 -5.106 1.00 0.00 C ATOM 190 CG GLU A 12 8.191 -12.750 -4.936 1.00 0.00 C ATOM 191 CD GLU A 12 7.823 -13.484 -6.225 1.00 0.00 C ATOM 192 OE1 GLU A 12 8.092 -12.947 -7.288 1.00 0.00 O ATOM 193 OE2 GLU A 12 7.276 -14.570 -6.129 1.00 0.00 O ATOM 0 H GLU A 12 8.909 -9.786 -4.755 1.00 0.00 H new ATOM 0 HA GLU A 12 9.672 -11.982 -2.929 1.00 0.00 H new ATOM 0 HB2 GLU A 12 9.510 -11.343 -5.914 1.00 0.00 H new ATOM 0 HB3 GLU A 12 10.306 -12.811 -5.383 1.00 0.00 H new ATOM 0 HG2 GLU A 12 8.223 -13.451 -4.102 1.00 0.00 H new ATOM 0 HG3 GLU A 12 7.430 -12.006 -4.698 1.00 0.00 H new ATOM 200 N SER A 13 11.934 -10.028 -4.103 1.00 0.00 N ATOM 201 CA SER A 13 13.401 -9.760 -4.046 1.00 0.00 C ATOM 202 C SER A 13 13.763 -9.089 -2.716 1.00 0.00 C ATOM 203 O SER A 13 13.390 -7.961 -2.465 1.00 0.00 O ATOM 204 CB SER A 13 13.668 -8.802 -5.207 1.00 0.00 C ATOM 205 OG SER A 13 14.990 -9.003 -5.691 1.00 0.00 O ATOM 0 H SER A 13 11.366 -9.259 -4.457 1.00 0.00 H new ATOM 0 HA SER A 13 13.992 -10.673 -4.118 1.00 0.00 H new ATOM 0 HB2 SER A 13 12.947 -8.972 -6.006 1.00 0.00 H new ATOM 0 HB3 SER A 13 13.542 -7.770 -4.878 1.00 0.00 H new ATOM 0 HG SER A 13 15.162 -8.391 -6.437 1.00 0.00 H new ATOM 211 N THR A 14 14.490 -9.762 -1.863 1.00 0.00 N ATOM 212 CA THR A 14 14.865 -9.134 -0.564 1.00 0.00 C ATOM 213 C THR A 14 15.556 -7.796 -0.828 1.00 0.00 C ATOM 214 O THR A 14 15.389 -6.842 -0.097 1.00 0.00 O ATOM 215 CB THR A 14 15.844 -10.108 0.090 1.00 0.00 C ATOM 216 OG1 THR A 14 15.394 -11.443 -0.111 1.00 0.00 O ATOM 217 CG2 THR A 14 15.939 -9.810 1.588 1.00 0.00 C ATOM 0 H THR A 14 14.837 -10.710 -2.008 1.00 0.00 H new ATOM 0 HA THR A 14 13.999 -8.945 0.070 1.00 0.00 H new ATOM 0 HB THR A 14 16.829 -9.991 -0.361 1.00 0.00 H new ATOM 0 HG1 THR A 14 16.023 -12.067 0.307 1.00 0.00 H new ATOM 0 HG21 THR A 14 16.637 -10.505 2.054 1.00 0.00 H new ATOM 0 HG22 THR A 14 16.291 -8.789 1.734 1.00 0.00 H new ATOM 0 HG23 THR A 14 14.956 -9.923 2.045 1.00 0.00 H new ATOM 225 N ALA A 15 16.338 -7.727 -1.872 1.00 0.00 N ATOM 226 CA ALA A 15 17.051 -6.456 -2.197 1.00 0.00 C ATOM 227 C ALA A 15 16.048 -5.307 -2.318 1.00 0.00 C ATOM 228 O ALA A 15 16.236 -4.244 -1.763 1.00 0.00 O ATOM 229 CB ALA A 15 17.734 -6.726 -3.537 1.00 0.00 C ATOM 0 H ALA A 15 16.515 -8.498 -2.516 1.00 0.00 H new ATOM 0 HA ALA A 15 17.766 -6.167 -1.427 1.00 0.00 H new ATOM 0 HB1 ALA A 15 18.283 -5.838 -3.851 1.00 0.00 H new ATOM 0 HB2 ALA A 15 18.425 -7.562 -3.431 1.00 0.00 H new ATOM 0 HB3 ALA A 15 16.981 -6.971 -4.286 1.00 0.00 H new ATOM 235 N ILE A 16 14.969 -5.524 -3.016 1.00 0.00 N ATOM 236 CA ILE A 16 13.939 -4.458 -3.144 1.00 0.00 C ATOM 237 C ILE A 16 13.304 -4.249 -1.777 1.00 0.00 C ATOM 238 O ILE A 16 13.084 -3.139 -1.333 1.00 0.00 O ATOM 239 CB ILE A 16 12.922 -5.022 -4.140 1.00 0.00 C ATOM 240 CG1 ILE A 16 13.491 -4.936 -5.558 1.00 0.00 C ATOM 241 CG2 ILE A 16 11.608 -4.236 -4.072 1.00 0.00 C ATOM 242 CD1 ILE A 16 12.740 -5.919 -6.456 1.00 0.00 C ATOM 0 H ILE A 16 14.756 -6.394 -3.504 1.00 0.00 H new ATOM 0 HA ILE A 16 14.333 -3.499 -3.482 1.00 0.00 H new ATOM 0 HB ILE A 16 12.724 -6.062 -3.883 1.00 0.00 H new ATOM 0 HG12 ILE A 16 13.390 -3.921 -5.943 1.00 0.00 H new ATOM 0 HG13 ILE A 16 14.556 -5.170 -5.551 1.00 0.00 H new ATOM 0 HG21 ILE A 16 10.898 -4.652 -4.787 1.00 0.00 H new ATOM 0 HG22 ILE A 16 11.194 -4.306 -3.066 1.00 0.00 H new ATOM 0 HG23 ILE A 16 11.797 -3.190 -4.314 1.00 0.00 H new ATOM 0 HD11 ILE A 16 13.139 -5.864 -7.469 1.00 0.00 H new ATOM 0 HD12 ILE A 16 12.864 -6.931 -6.071 1.00 0.00 H new ATOM 0 HD13 ILE A 16 11.681 -5.663 -6.469 1.00 0.00 H new ATOM 254 N LEU A 17 13.029 -5.327 -1.105 1.00 0.00 N ATOM 255 CA LEU A 17 12.427 -5.242 0.245 1.00 0.00 C ATOM 256 C LEU A 17 13.361 -4.467 1.171 1.00 0.00 C ATOM 257 O LEU A 17 12.949 -3.581 1.894 1.00 0.00 O ATOM 258 CB LEU A 17 12.306 -6.709 0.675 1.00 0.00 C ATOM 259 CG LEU A 17 12.081 -6.823 2.185 1.00 0.00 C ATOM 260 CD1 LEU A 17 13.429 -6.734 2.899 1.00 0.00 C ATOM 261 CD2 LEU A 17 11.166 -5.699 2.672 1.00 0.00 C ATOM 0 H LEU A 17 13.199 -6.275 -1.440 1.00 0.00 H new ATOM 0 HA LEU A 17 11.468 -4.725 0.270 1.00 0.00 H new ATOM 0 HB2 LEU A 17 11.479 -7.180 0.144 1.00 0.00 H new ATOM 0 HB3 LEU A 17 13.211 -7.249 0.397 1.00 0.00 H new ATOM 0 HG LEU A 17 11.606 -7.779 2.406 1.00 0.00 H new ATOM 0 HD11 LEU A 17 13.277 -6.814 3.975 1.00 0.00 H new ATOM 0 HD12 LEU A 17 14.074 -7.546 2.562 1.00 0.00 H new ATOM 0 HD13 LEU A 17 13.900 -5.778 2.670 1.00 0.00 H new ATOM 0 HD21 LEU A 17 11.015 -5.793 3.747 1.00 0.00 H new ATOM 0 HD22 LEU A 17 11.625 -4.735 2.453 1.00 0.00 H new ATOM 0 HD23 LEU A 17 10.204 -5.767 2.163 1.00 0.00 H new ATOM 273 N GLN A 18 14.625 -4.791 1.147 1.00 0.00 N ATOM 274 CA GLN A 18 15.593 -4.073 2.020 1.00 0.00 C ATOM 275 C GLN A 18 15.681 -2.600 1.611 1.00 0.00 C ATOM 276 O GLN A 18 15.850 -1.726 2.438 1.00 0.00 O ATOM 277 CB GLN A 18 16.920 -4.798 1.803 1.00 0.00 C ATOM 278 CG GLN A 18 16.818 -6.192 2.426 1.00 0.00 C ATOM 279 CD GLN A 18 18.191 -6.861 2.452 1.00 0.00 C ATOM 280 OE1 GLN A 18 18.943 -6.774 1.504 1.00 0.00 O ATOM 281 NE2 GLN A 18 18.551 -7.528 3.515 1.00 0.00 N ATOM 0 H GLN A 18 15.028 -5.522 0.560 1.00 0.00 H new ATOM 0 HA GLN A 18 15.302 -4.078 3.070 1.00 0.00 H new ATOM 0 HB2 GLN A 18 17.141 -4.874 0.738 1.00 0.00 H new ATOM 0 HB3 GLN A 18 17.737 -4.238 2.259 1.00 0.00 H new ATOM 0 HG2 GLN A 18 16.423 -6.117 3.439 1.00 0.00 H new ATOM 0 HG3 GLN A 18 16.119 -6.803 1.855 1.00 0.00 H new ATOM 0 HE21 GLN A 18 17.917 -7.600 4.311 1.00 0.00 H new ATOM 0 HE22 GLN A 18 19.466 -7.977 3.550 1.00 0.00 H new ATOM 290 N ASP A 19 15.551 -2.316 0.342 1.00 0.00 N ATOM 291 CA ASP A 19 15.610 -0.894 -0.105 1.00 0.00 C ATOM 292 C ASP A 19 14.368 -0.147 0.392 1.00 0.00 C ATOM 293 O ASP A 19 14.446 0.985 0.826 1.00 0.00 O ATOM 294 CB ASP A 19 15.629 -0.956 -1.634 1.00 0.00 C ATOM 295 CG ASP A 19 16.884 -1.705 -2.087 1.00 0.00 C ATOM 296 OD1 ASP A 19 17.647 -2.113 -1.228 1.00 0.00 O ATOM 297 OD2 ASP A 19 17.064 -1.849 -3.284 1.00 0.00 O ATOM 0 H ASP A 19 15.408 -3.002 -0.399 1.00 0.00 H new ATOM 0 HA ASP A 19 16.481 -0.368 0.285 1.00 0.00 H new ATOM 0 HB2 ASP A 19 14.736 -1.461 -2.001 1.00 0.00 H new ATOM 0 HB3 ASP A 19 15.620 0.051 -2.052 1.00 0.00 H new ATOM 302 N CYS A 20 13.226 -0.781 0.347 1.00 0.00 N ATOM 303 CA CYS A 20 11.979 -0.115 0.826 1.00 0.00 C ATOM 304 C CYS A 20 12.053 0.101 2.339 1.00 0.00 C ATOM 305 O CYS A 20 11.696 1.147 2.844 1.00 0.00 O ATOM 306 CB CYS A 20 10.850 -1.088 0.484 1.00 0.00 C ATOM 307 SG CYS A 20 10.650 -1.180 -1.313 1.00 0.00 S ATOM 0 H CYS A 20 13.103 -1.732 -0.001 1.00 0.00 H new ATOM 0 HA CYS A 20 11.828 0.861 0.365 1.00 0.00 H new ATOM 0 HB2 CYS A 20 11.074 -2.076 0.886 1.00 0.00 H new ATOM 0 HB3 CYS A 20 9.920 -0.759 0.947 1.00 0.00 H new ATOM 0 HG CYS A 20 11.553 -1.972 -1.810 1.00 0.00 H new ATOM 313 N GLN A 21 12.527 -0.876 3.060 1.00 0.00 N ATOM 314 CA GLN A 21 12.643 -0.731 4.537 1.00 0.00 C ATOM 315 C GLN A 21 13.700 0.316 4.856 1.00 0.00 C ATOM 316 O GLN A 21 13.594 1.062 5.811 1.00 0.00 O ATOM 317 CB GLN A 21 13.075 -2.104 5.026 1.00 0.00 C ATOM 318 CG GLN A 21 11.967 -3.095 4.705 1.00 0.00 C ATOM 319 CD GLN A 21 12.331 -4.460 5.266 1.00 0.00 C ATOM 320 OE1 GLN A 21 13.478 -4.857 5.249 1.00 0.00 O ATOM 321 NE2 GLN A 21 11.393 -5.195 5.773 1.00 0.00 N ATOM 0 H GLN A 21 12.840 -1.773 2.688 1.00 0.00 H new ATOM 0 HA GLN A 21 11.716 -0.409 5.011 1.00 0.00 H new ATOM 0 HB2 GLN A 21 14.005 -2.404 4.543 1.00 0.00 H new ATOM 0 HB3 GLN A 21 13.266 -2.082 6.099 1.00 0.00 H new ATOM 0 HG2 GLN A 21 11.024 -2.754 5.132 1.00 0.00 H new ATOM 0 HG3 GLN A 21 11.823 -3.160 3.626 1.00 0.00 H new ATOM 0 HE21 GLN A 21 10.431 -4.857 5.785 1.00 0.00 H new ATOM 0 HE22 GLN A 21 11.617 -6.112 6.160 1.00 0.00 H new ATOM 330 N ARG A 22 14.713 0.377 4.044 1.00 0.00 N ATOM 331 CA ARG A 22 15.788 1.374 4.262 1.00 0.00 C ATOM 332 C ARG A 22 15.189 2.775 4.280 1.00 0.00 C ATOM 333 O ARG A 22 15.425 3.553 5.183 1.00 0.00 O ATOM 334 CB ARG A 22 16.712 1.198 3.065 1.00 0.00 C ATOM 335 CG ARG A 22 17.750 0.119 3.384 1.00 0.00 C ATOM 336 CD ARG A 22 18.590 -0.172 2.137 1.00 0.00 C ATOM 337 NE ARG A 22 19.713 -1.029 2.617 1.00 0.00 N ATOM 338 CZ ARG A 22 20.559 -1.544 1.764 1.00 0.00 C ATOM 339 NH1 ARG A 22 20.441 -1.289 0.488 1.00 0.00 N ATOM 340 NH2 ARG A 22 21.531 -2.303 2.190 1.00 0.00 N ATOM 0 H ARG A 22 14.842 -0.227 3.232 1.00 0.00 H new ATOM 0 HA ARG A 22 16.313 1.239 5.208 1.00 0.00 H new ATOM 0 HB2 ARG A 22 16.136 0.916 2.184 1.00 0.00 H new ATOM 0 HB3 ARG A 22 17.209 2.140 2.832 1.00 0.00 H new ATOM 0 HG2 ARG A 22 18.394 0.449 4.199 1.00 0.00 H new ATOM 0 HG3 ARG A 22 17.252 -0.791 3.720 1.00 0.00 H new ATOM 0 HD2 ARG A 22 18.001 -0.683 1.375 1.00 0.00 H new ATOM 0 HD3 ARG A 22 18.961 0.749 1.688 1.00 0.00 H new ATOM 0 HE ARG A 22 19.821 -1.214 3.614 1.00 0.00 H new ATOM 0 HH11 ARG A 22 19.688 -0.687 0.156 1.00 0.00 H new ATOM 0 HH12 ARG A 22 21.102 -1.692 -0.176 1.00 0.00 H new ATOM 0 HH21 ARG A 22 21.630 -2.494 3.187 1.00 0.00 H new ATOM 0 HH22 ARG A 22 22.192 -2.706 1.526 1.00 0.00 H new ATOM 354 N ALA A 23 14.398 3.099 3.298 1.00 0.00 N ATOM 355 CA ALA A 23 13.769 4.445 3.282 1.00 0.00 C ATOM 356 C ALA A 23 12.693 4.493 4.375 1.00 0.00 C ATOM 357 O ALA A 23 12.652 5.402 5.181 1.00 0.00 O ATOM 358 CB ALA A 23 13.165 4.589 1.884 1.00 0.00 C ATOM 0 H ALA A 23 14.161 2.495 2.511 1.00 0.00 H new ATOM 0 HA ALA A 23 14.469 5.257 3.481 1.00 0.00 H new ATOM 0 HB1 ALA A 23 12.681 5.562 1.795 1.00 0.00 H new ATOM 0 HB2 ALA A 23 13.954 4.507 1.137 1.00 0.00 H new ATOM 0 HB3 ALA A 23 12.429 3.801 1.723 1.00 0.00 H new ATOM 364 N LEU A 24 11.836 3.502 4.423 1.00 0.00 N ATOM 365 CA LEU A 24 10.786 3.473 5.479 1.00 0.00 C ATOM 366 C LEU A 24 11.328 2.754 6.715 1.00 0.00 C ATOM 367 O LEU A 24 10.719 1.849 7.250 1.00 0.00 O ATOM 368 CB LEU A 24 9.644 2.696 4.845 1.00 0.00 C ATOM 369 CG LEU A 24 9.277 3.382 3.535 1.00 0.00 C ATOM 370 CD1 LEU A 24 8.023 2.751 2.957 1.00 0.00 C ATOM 371 CD2 LEU A 24 9.027 4.861 3.806 1.00 0.00 C ATOM 0 H LEU A 24 11.821 2.714 3.775 1.00 0.00 H new ATOM 0 HA LEU A 24 10.469 4.463 5.806 1.00 0.00 H new ATOM 0 HB2 LEU A 24 9.940 1.663 4.664 1.00 0.00 H new ATOM 0 HB3 LEU A 24 8.784 2.668 5.514 1.00 0.00 H new ATOM 0 HG LEU A 24 10.092 3.268 2.820 1.00 0.00 H new ATOM 0 HD11 LEU A 24 7.765 3.246 2.020 1.00 0.00 H new ATOM 0 HD12 LEU A 24 8.201 1.692 2.771 1.00 0.00 H new ATOM 0 HD13 LEU A 24 7.201 2.862 3.664 1.00 0.00 H new ATOM 0 HD21 LEU A 24 8.763 5.362 2.875 1.00 0.00 H new ATOM 0 HD22 LEU A 24 8.210 4.967 4.519 1.00 0.00 H new ATOM 0 HD23 LEU A 24 9.929 5.313 4.218 1.00 0.00 H new ATOM 383 N SER A 25 12.475 3.167 7.165 1.00 0.00 N ATOM 384 CA SER A 25 13.097 2.540 8.364 1.00 0.00 C ATOM 385 C SER A 25 12.970 3.492 9.548 1.00 0.00 C ATOM 386 O SER A 25 13.706 3.410 10.511 1.00 0.00 O ATOM 387 CB SER A 25 14.570 2.333 7.990 1.00 0.00 C ATOM 388 OG SER A 25 15.381 3.214 8.759 1.00 0.00 O ATOM 0 H SER A 25 13.018 3.923 6.748 1.00 0.00 H new ATOM 0 HA SER A 25 12.623 1.600 8.645 1.00 0.00 H new ATOM 0 HB2 SER A 25 14.862 1.299 8.174 1.00 0.00 H new ATOM 0 HB3 SER A 25 14.717 2.521 6.926 1.00 0.00 H new ATOM 0 HG SER A 25 15.262 3.020 9.712 1.00 0.00 H new ATOM 394 N ALA A 26 12.044 4.403 9.474 1.00 0.00 N ATOM 395 CA ALA A 26 11.865 5.372 10.583 1.00 0.00 C ATOM 396 C ALA A 26 11.519 4.630 11.872 1.00 0.00 C ATOM 397 O ALA A 26 10.789 3.658 11.868 1.00 0.00 O ATOM 398 CB ALA A 26 10.708 6.264 10.142 1.00 0.00 C ATOM 0 H ALA A 26 11.402 4.517 8.690 1.00 0.00 H new ATOM 0 HA ALA A 26 12.767 5.951 10.784 1.00 0.00 H new ATOM 0 HB1 ALA A 26 10.511 7.011 10.911 1.00 0.00 H new ATOM 0 HB2 ALA A 26 10.969 6.763 9.209 1.00 0.00 H new ATOM 0 HB3 ALA A 26 9.816 5.655 9.991 1.00 0.00 H new ATOM 404 N ASP A 27 12.040 5.082 12.973 1.00 0.00 N ATOM 405 CA ASP A 27 11.750 4.409 14.266 1.00 0.00 C ATOM 406 C ASP A 27 10.241 4.245 14.458 1.00 0.00 C ATOM 407 O ASP A 27 9.793 3.446 15.253 1.00 0.00 O ATOM 408 CB ASP A 27 12.323 5.351 15.325 1.00 0.00 C ATOM 409 CG ASP A 27 13.809 5.585 15.057 1.00 0.00 C ATOM 410 OD1 ASP A 27 14.361 4.877 14.230 1.00 0.00 O ATOM 411 OD2 ASP A 27 14.371 6.471 15.680 1.00 0.00 O ATOM 0 H ASP A 27 12.657 5.892 13.035 1.00 0.00 H new ATOM 0 HA ASP A 27 12.182 3.410 14.320 1.00 0.00 H new ATOM 0 HB2 ASP A 27 11.787 6.300 15.310 1.00 0.00 H new ATOM 0 HB3 ASP A 27 12.186 4.924 16.318 1.00 0.00 H new ATOM 416 N ARG A 28 9.454 5.000 13.741 1.00 0.00 N ATOM 417 CA ARG A 28 7.975 4.886 13.896 1.00 0.00 C ATOM 418 C ARG A 28 7.358 4.131 12.713 1.00 0.00 C ATOM 419 O ARG A 28 6.209 4.337 12.374 1.00 0.00 O ATOM 420 CB ARG A 28 7.478 6.332 13.933 1.00 0.00 C ATOM 421 CG ARG A 28 7.648 6.970 12.552 1.00 0.00 C ATOM 422 CD ARG A 28 7.490 8.487 12.676 1.00 0.00 C ATOM 423 NE ARG A 28 7.911 9.040 11.357 1.00 0.00 N ATOM 424 CZ ARG A 28 8.298 10.287 11.265 1.00 0.00 C ATOM 425 NH1 ARG A 28 8.294 11.060 12.320 1.00 0.00 N ATOM 426 NH2 ARG A 28 8.692 10.764 10.116 1.00 0.00 N ATOM 0 H ARG A 28 9.769 5.688 13.057 1.00 0.00 H new ATOM 0 HA ARG A 28 7.697 4.329 14.791 1.00 0.00 H new ATOM 0 HB2 ARG A 28 6.430 6.359 14.231 1.00 0.00 H new ATOM 0 HB3 ARG A 28 8.036 6.900 14.678 1.00 0.00 H new ATOM 0 HG2 ARG A 28 8.629 6.727 12.144 1.00 0.00 H new ATOM 0 HG3 ARG A 28 6.907 6.570 11.860 1.00 0.00 H new ATOM 0 HD2 ARG A 28 6.459 8.757 12.904 1.00 0.00 H new ATOM 0 HD3 ARG A 28 8.108 8.881 13.482 1.00 0.00 H new ATOM 0 HE ARG A 28 7.897 8.447 10.527 1.00 0.00 H new ATOM 0 HH11 ARG A 28 7.988 10.692 13.221 1.00 0.00 H new ATOM 0 HH12 ARG A 28 8.597 12.031 12.242 1.00 0.00 H new ATOM 0 HH21 ARG A 28 8.698 10.165 9.290 1.00 0.00 H new ATOM 0 HH22 ARG A 28 8.994 11.736 10.044 1.00 0.00 H new ATOM 440 N TYR A 29 8.104 3.264 12.079 1.00 0.00 N ATOM 441 CA TYR A 29 7.545 2.514 10.921 1.00 0.00 C ATOM 442 C TYR A 29 7.374 1.031 11.249 1.00 0.00 C ATOM 443 O TYR A 29 8.216 0.424 11.883 1.00 0.00 O ATOM 444 CB TYR A 29 8.593 2.670 9.827 1.00 0.00 C ATOM 445 CG TYR A 29 8.234 3.834 8.954 1.00 0.00 C ATOM 446 CD1 TYR A 29 8.200 5.116 9.495 1.00 0.00 C ATOM 447 CD2 TYR A 29 7.942 3.630 7.604 1.00 0.00 C ATOM 448 CE1 TYR A 29 7.869 6.209 8.690 1.00 0.00 C ATOM 449 CE2 TYR A 29 7.608 4.717 6.794 1.00 0.00 C ATOM 450 CZ TYR A 29 7.572 6.009 7.334 1.00 0.00 C ATOM 451 OH TYR A 29 7.250 7.082 6.528 1.00 0.00 O ATOM 0 H TYR A 29 9.072 3.045 12.314 1.00 0.00 H new ATOM 0 HA TYR A 29 6.562 2.890 10.638 1.00 0.00 H new ATOM 0 HB2 TYR A 29 9.577 2.824 10.270 1.00 0.00 H new ATOM 0 HB3 TYR A 29 8.651 1.759 9.231 1.00 0.00 H new ATOM 0 HD1 TYR A 29 8.430 5.266 10.539 1.00 0.00 H new ATOM 0 HD2 TYR A 29 7.974 2.634 7.187 1.00 0.00 H new ATOM 0 HE1 TYR A 29 7.842 7.204 9.110 1.00 0.00 H new ATOM 0 HE2 TYR A 29 7.377 4.562 5.750 1.00 0.00 H new ATOM 0 HH TYR A 29 8.070 7.543 6.254 1.00 0.00 H new ATOM 461 N GLN A 30 6.312 0.432 10.784 1.00 0.00 N ATOM 462 CA GLN A 30 6.113 -1.024 11.027 1.00 0.00 C ATOM 463 C GLN A 30 6.225 -1.743 9.682 1.00 0.00 C ATOM 464 O GLN A 30 5.258 -1.882 8.960 1.00 0.00 O ATOM 465 CB GLN A 30 4.703 -1.157 11.608 1.00 0.00 C ATOM 466 CG GLN A 30 4.673 -2.343 12.574 1.00 0.00 C ATOM 467 CD GLN A 30 3.410 -2.287 13.433 1.00 0.00 C ATOM 468 OE1 GLN A 30 3.107 -1.270 14.026 1.00 0.00 O ATOM 469 NE2 GLN A 30 2.654 -3.346 13.524 1.00 0.00 N ATOM 0 H GLN A 30 5.574 0.888 10.247 1.00 0.00 H new ATOM 0 HA GLN A 30 6.846 -1.456 11.708 1.00 0.00 H new ATOM 0 HB2 GLN A 30 4.422 -0.241 12.127 1.00 0.00 H new ATOM 0 HB3 GLN A 30 3.978 -1.305 10.807 1.00 0.00 H new ATOM 0 HG2 GLN A 30 4.701 -3.278 12.015 1.00 0.00 H new ATOM 0 HG3 GLN A 30 5.557 -2.326 13.211 1.00 0.00 H new ATOM 0 HE21 GLN A 30 2.909 -4.199 13.026 1.00 0.00 H new ATOM 0 HE22 GLN A 30 1.808 -3.321 14.093 1.00 0.00 H new ATOM 478 N LEU A 31 7.410 -2.152 9.312 1.00 0.00 N ATOM 479 CA LEU A 31 7.587 -2.802 7.986 1.00 0.00 C ATOM 480 C LEU A 31 7.244 -4.291 8.024 1.00 0.00 C ATOM 481 O LEU A 31 7.869 -5.067 8.720 1.00 0.00 O ATOM 482 CB LEU A 31 9.071 -2.636 7.662 1.00 0.00 C ATOM 483 CG LEU A 31 9.350 -1.220 7.166 1.00 0.00 C ATOM 484 CD1 LEU A 31 8.827 -1.065 5.739 1.00 0.00 C ATOM 485 CD2 LEU A 31 8.662 -0.203 8.073 1.00 0.00 C ATOM 0 H LEU A 31 8.259 -2.063 9.871 1.00 0.00 H new ATOM 0 HA LEU A 31 6.927 -2.351 7.245 1.00 0.00 H new ATOM 0 HB2 LEU A 31 9.669 -2.842 8.550 1.00 0.00 H new ATOM 0 HB3 LEU A 31 9.368 -3.360 6.903 1.00 0.00 H new ATOM 0 HG LEU A 31 10.425 -1.043 7.182 1.00 0.00 H new ATOM 0 HD11 LEU A 31 9.027 -0.053 5.386 1.00 0.00 H new ATOM 0 HD12 LEU A 31 9.328 -1.782 5.088 1.00 0.00 H new ATOM 0 HD13 LEU A 31 7.753 -1.249 5.723 1.00 0.00 H new ATOM 0 HD21 LEU A 31 8.867 0.805 7.711 1.00 0.00 H new ATOM 0 HD22 LEU A 31 7.586 -0.379 8.067 1.00 0.00 H new ATOM 0 HD23 LEU A 31 9.041 -0.307 9.090 1.00 0.00 H new ATOM 497 N GLN A 32 6.287 -4.697 7.241 1.00 0.00 N ATOM 498 CA GLN A 32 5.926 -6.137 7.179 1.00 0.00 C ATOM 499 C GLN A 32 6.333 -6.676 5.805 1.00 0.00 C ATOM 500 O GLN A 32 6.044 -6.075 4.789 1.00 0.00 O ATOM 501 CB GLN A 32 4.409 -6.182 7.358 1.00 0.00 C ATOM 502 CG GLN A 32 4.071 -6.969 8.624 1.00 0.00 C ATOM 503 CD GLN A 32 4.492 -8.427 8.439 1.00 0.00 C ATOM 504 OE1 GLN A 32 5.099 -9.015 9.314 1.00 0.00 O ATOM 505 NE2 GLN A 32 4.204 -9.036 7.321 1.00 0.00 N ATOM 0 H GLN A 32 5.735 -4.088 6.637 1.00 0.00 H new ATOM 0 HA GLN A 32 6.423 -6.741 7.938 1.00 0.00 H new ATOM 0 HB2 GLN A 32 4.010 -5.170 7.428 1.00 0.00 H new ATOM 0 HB3 GLN A 32 3.943 -6.649 6.491 1.00 0.00 H new ATOM 0 HG2 GLN A 32 4.584 -6.536 9.483 1.00 0.00 H new ATOM 0 HG3 GLN A 32 3.002 -6.910 8.828 1.00 0.00 H new ATOM 0 HE21 GLN A 32 3.695 -8.542 6.588 1.00 0.00 H new ATOM 0 HE22 GLN A 32 4.488 -10.006 7.181 1.00 0.00 H new ATOM 514 N VAL A 33 7.018 -7.784 5.753 1.00 0.00 N ATOM 515 CA VAL A 33 7.451 -8.315 4.428 1.00 0.00 C ATOM 516 C VAL A 33 6.646 -9.551 4.038 1.00 0.00 C ATOM 517 O VAL A 33 6.466 -10.465 4.820 1.00 0.00 O ATOM 518 CB VAL A 33 8.922 -8.681 4.604 1.00 0.00 C ATOM 519 CG1 VAL A 33 9.527 -9.019 3.237 1.00 0.00 C ATOM 520 CG2 VAL A 33 9.668 -7.498 5.221 1.00 0.00 C ATOM 0 H VAL A 33 7.295 -8.341 6.561 1.00 0.00 H new ATOM 0 HA VAL A 33 7.297 -7.581 3.637 1.00 0.00 H new ATOM 0 HB VAL A 33 9.010 -9.546 5.262 1.00 0.00 H new ATOM 0 HG11 VAL A 33 10.578 -9.281 3.359 1.00 0.00 H new ATOM 0 HG12 VAL A 33 8.991 -9.862 2.800 1.00 0.00 H new ATOM 0 HG13 VAL A 33 9.443 -8.155 2.578 1.00 0.00 H new ATOM 0 HG21 VAL A 33 10.719 -7.757 5.348 1.00 0.00 H new ATOM 0 HG22 VAL A 33 9.584 -6.632 4.564 1.00 0.00 H new ATOM 0 HG23 VAL A 33 9.233 -7.260 6.192 1.00 0.00 H new ATOM 530 N CYS A 34 6.172 -9.590 2.827 1.00 0.00 N ATOM 531 CA CYS A 34 5.389 -10.777 2.376 1.00 0.00 C ATOM 532 C CYS A 34 6.161 -11.542 1.302 1.00 0.00 C ATOM 533 O CYS A 34 6.519 -11.002 0.275 1.00 0.00 O ATOM 534 CB CYS A 34 4.089 -10.212 1.806 1.00 0.00 C ATOM 535 SG CYS A 34 2.956 -9.844 3.166 1.00 0.00 S ATOM 0 H CYS A 34 6.291 -8.855 2.130 1.00 0.00 H new ATOM 0 HA CYS A 34 5.200 -11.477 3.190 1.00 0.00 H new ATOM 0 HB2 CYS A 34 4.292 -9.308 1.231 1.00 0.00 H new ATOM 0 HB3 CYS A 34 3.635 -10.930 1.122 1.00 0.00 H new ATOM 0 HG CYS A 34 2.537 -10.955 3.695 1.00 0.00 H new ATOM 541 N GLU A 35 6.414 -12.801 1.536 1.00 0.00 N ATOM 542 CA GLU A 35 7.159 -13.613 0.534 1.00 0.00 C ATOM 543 C GLU A 35 6.310 -13.804 -0.720 1.00 0.00 C ATOM 544 O GLU A 35 6.816 -14.097 -1.785 1.00 0.00 O ATOM 545 CB GLU A 35 7.414 -14.953 1.222 1.00 0.00 C ATOM 546 CG GLU A 35 8.272 -14.726 2.466 1.00 0.00 C ATOM 547 CD GLU A 35 8.534 -16.064 3.157 1.00 0.00 C ATOM 548 OE1 GLU A 35 8.652 -17.056 2.457 1.00 0.00 O ATOM 549 OE2 GLU A 35 8.612 -16.071 4.374 1.00 0.00 O ATOM 0 H GLU A 35 6.136 -13.302 2.380 1.00 0.00 H new ATOM 0 HA GLU A 35 8.087 -13.136 0.219 1.00 0.00 H new ATOM 0 HB2 GLU A 35 6.468 -15.419 1.498 1.00 0.00 H new ATOM 0 HB3 GLU A 35 7.918 -15.636 0.538 1.00 0.00 H new ATOM 0 HG2 GLU A 35 9.216 -14.257 2.189 1.00 0.00 H new ATOM 0 HG3 GLU A 35 7.766 -14.044 3.150 1.00 0.00 H new ATOM 556 N SER A 36 5.019 -13.648 -0.603 1.00 0.00 N ATOM 557 CA SER A 36 4.144 -13.830 -1.794 1.00 0.00 C ATOM 558 C SER A 36 3.180 -12.642 -1.921 1.00 0.00 C ATOM 559 O SER A 36 3.332 -11.639 -1.254 1.00 0.00 O ATOM 560 CB SER A 36 3.391 -15.133 -1.519 1.00 0.00 C ATOM 561 OG SER A 36 4.206 -16.241 -1.894 1.00 0.00 O ATOM 0 H SER A 36 4.535 -13.404 0.261 1.00 0.00 H new ATOM 0 HA SER A 36 4.700 -13.876 -2.730 1.00 0.00 H new ATOM 0 HB2 SER A 36 3.132 -15.200 -0.462 1.00 0.00 H new ATOM 0 HB3 SER A 36 2.456 -15.150 -2.078 1.00 0.00 H new ATOM 0 HG SER A 36 3.725 -17.076 -1.716 1.00 0.00 H new ATOM 567 N GLY A 37 2.181 -12.752 -2.753 1.00 0.00 N ATOM 568 CA GLY A 37 1.206 -11.638 -2.894 1.00 0.00 C ATOM 569 C GLY A 37 -0.033 -12.030 -2.113 1.00 0.00 C ATOM 570 O GLY A 37 -0.812 -11.205 -1.679 1.00 0.00 O ATOM 0 H GLY A 37 1.999 -13.566 -3.341 1.00 0.00 H new ATOM 0 HA2 GLY A 37 1.625 -10.708 -2.510 1.00 0.00 H new ATOM 0 HA3 GLY A 37 0.963 -11.469 -3.943 1.00 0.00 H new ATOM 574 N GLU A 38 -0.194 -13.305 -1.911 1.00 0.00 N ATOM 575 CA GLU A 38 -1.342 -13.806 -1.138 1.00 0.00 C ATOM 576 C GLU A 38 -1.089 -13.520 0.336 1.00 0.00 C ATOM 577 O GLU A 38 -1.980 -13.159 1.080 1.00 0.00 O ATOM 578 CB GLU A 38 -1.344 -15.300 -1.440 1.00 0.00 C ATOM 579 CG GLU A 38 -1.956 -15.525 -2.826 1.00 0.00 C ATOM 580 CD GLU A 38 -2.186 -17.018 -3.059 1.00 0.00 C ATOM 581 OE1 GLU A 38 -1.415 -17.806 -2.539 1.00 0.00 O ATOM 582 OE2 GLU A 38 -3.132 -17.348 -3.755 1.00 0.00 O ATOM 0 H GLU A 38 0.437 -14.028 -2.258 1.00 0.00 H new ATOM 0 HA GLU A 38 -2.299 -13.348 -1.386 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -0.328 -15.692 -1.409 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -1.916 -15.837 -0.683 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -2.900 -14.986 -2.908 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -1.294 -15.126 -3.594 1.00 0.00 H new ATOM 589 N MET A 39 0.140 -13.652 0.750 1.00 0.00 N ATOM 590 CA MET A 39 0.485 -13.363 2.161 1.00 0.00 C ATOM 591 C MET A 39 0.179 -11.893 2.466 1.00 0.00 C ATOM 592 O MET A 39 -0.195 -11.543 3.567 1.00 0.00 O ATOM 593 CB MET A 39 1.986 -13.661 2.266 1.00 0.00 C ATOM 594 CG MET A 39 2.199 -15.177 2.316 1.00 0.00 C ATOM 595 SD MET A 39 3.541 -15.564 3.468 1.00 0.00 S ATOM 596 CE MET A 39 2.509 -15.902 4.917 1.00 0.00 C ATOM 0 H MET A 39 0.921 -13.949 0.165 1.00 0.00 H new ATOM 0 HA MET A 39 -0.084 -13.957 2.876 1.00 0.00 H new ATOM 0 HB2 MET A 39 2.513 -13.236 1.412 1.00 0.00 H new ATOM 0 HB3 MET A 39 2.399 -13.194 3.160 1.00 0.00 H new ATOM 0 HG2 MET A 39 1.281 -15.673 2.631 1.00 0.00 H new ATOM 0 HG3 MET A 39 2.440 -15.554 1.322 1.00 0.00 H new ATOM 0 HE1 MET A 39 3.144 -16.167 5.762 1.00 0.00 H new ATOM 0 HE2 MET A 39 1.927 -15.014 5.164 1.00 0.00 H new ATOM 0 HE3 MET A 39 1.833 -16.729 4.698 1.00 0.00 H new ATOM 606 N LEU A 40 0.316 -11.035 1.488 1.00 0.00 N ATOM 607 CA LEU A 40 0.010 -9.592 1.710 1.00 0.00 C ATOM 608 C LEU A 40 -1.488 -9.435 1.940 1.00 0.00 C ATOM 609 O LEU A 40 -1.927 -8.688 2.793 1.00 0.00 O ATOM 610 CB LEU A 40 0.428 -8.888 0.415 1.00 0.00 C ATOM 611 CG LEU A 40 0.576 -7.379 0.649 1.00 0.00 C ATOM 612 CD1 LEU A 40 -0.616 -6.849 1.446 1.00 0.00 C ATOM 613 CD2 LEU A 40 1.862 -7.105 1.429 1.00 0.00 C ATOM 0 H LEU A 40 0.627 -11.272 0.546 1.00 0.00 H new ATOM 0 HA LEU A 40 0.528 -9.177 2.575 1.00 0.00 H new ATOM 0 HB2 LEU A 40 1.371 -9.301 0.057 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -0.315 -9.071 -0.362 1.00 0.00 H new ATOM 0 HG LEU A 40 0.615 -6.876 -0.317 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -0.499 -5.777 1.606 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -1.536 -7.035 0.892 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -0.664 -7.356 2.410 1.00 0.00 H new ATOM 0 HD21 LEU A 40 1.966 -6.033 1.594 1.00 0.00 H new ATOM 0 HD22 LEU A 40 1.821 -7.618 2.390 1.00 0.00 H new ATOM 0 HD23 LEU A 40 2.717 -7.469 0.860 1.00 0.00 H new ATOM 625 N LEU A 41 -2.277 -10.142 1.182 1.00 0.00 N ATOM 626 CA LEU A 41 -3.743 -10.044 1.350 1.00 0.00 C ATOM 627 C LEU A 41 -4.112 -10.460 2.764 1.00 0.00 C ATOM 628 O LEU A 41 -4.782 -9.742 3.477 1.00 0.00 O ATOM 629 CB LEU A 41 -4.326 -11.040 0.350 1.00 0.00 C ATOM 630 CG LEU A 41 -3.888 -10.676 -1.065 1.00 0.00 C ATOM 631 CD1 LEU A 41 -4.456 -11.705 -2.043 1.00 0.00 C ATOM 632 CD2 LEU A 41 -4.426 -9.291 -1.418 1.00 0.00 C ATOM 0 H LEU A 41 -1.964 -10.783 0.453 1.00 0.00 H new ATOM 0 HA LEU A 41 -4.116 -9.033 1.185 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -3.994 -12.049 0.594 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -5.414 -11.038 0.415 1.00 0.00 H new ATOM 0 HG LEU A 41 -2.800 -10.671 -1.126 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -4.147 -11.452 -3.057 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -4.082 -12.696 -1.786 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -5.544 -11.702 -1.983 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -4.115 -9.027 -2.429 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -5.515 -9.299 -1.363 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -4.033 -8.558 -0.714 1.00 0.00 H new ATOM 644 N GLU A 42 -3.677 -11.618 3.170 1.00 0.00 N ATOM 645 CA GLU A 42 -4.006 -12.101 4.534 1.00 0.00 C ATOM 646 C GLU A 42 -3.568 -11.086 5.591 1.00 0.00 C ATOM 647 O GLU A 42 -4.271 -10.842 6.554 1.00 0.00 O ATOM 648 CB GLU A 42 -3.220 -13.402 4.673 1.00 0.00 C ATOM 649 CG GLU A 42 -3.656 -14.139 5.937 1.00 0.00 C ATOM 650 CD GLU A 42 -2.435 -14.782 6.595 1.00 0.00 C ATOM 651 OE1 GLU A 42 -1.405 -14.847 5.945 1.00 0.00 O ATOM 652 OE2 GLU A 42 -2.551 -15.196 7.735 1.00 0.00 O ATOM 0 H GLU A 42 -3.105 -12.252 2.612 1.00 0.00 H new ATOM 0 HA GLU A 42 -5.077 -12.244 4.677 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -3.385 -14.032 3.799 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -2.152 -13.189 4.716 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -4.133 -13.446 6.629 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -4.394 -14.902 5.690 1.00 0.00 H new ATOM 659 N TYR A 43 -2.422 -10.481 5.429 1.00 0.00 N ATOM 660 CA TYR A 43 -1.977 -9.484 6.442 1.00 0.00 C ATOM 661 C TYR A 43 -2.926 -8.282 6.446 1.00 0.00 C ATOM 662 O TYR A 43 -3.219 -7.715 7.481 1.00 0.00 O ATOM 663 CB TYR A 43 -0.570 -9.061 6.016 1.00 0.00 C ATOM 664 CG TYR A 43 -0.212 -7.760 6.697 1.00 0.00 C ATOM 665 CD1 TYR A 43 0.407 -7.769 7.954 1.00 0.00 C ATOM 666 CD2 TYR A 43 -0.509 -6.543 6.073 1.00 0.00 C ATOM 667 CE1 TYR A 43 0.729 -6.560 8.583 1.00 0.00 C ATOM 668 CE2 TYR A 43 -0.185 -5.336 6.702 1.00 0.00 C ATOM 669 CZ TYR A 43 0.434 -5.344 7.957 1.00 0.00 C ATOM 670 OH TYR A 43 0.752 -4.154 8.579 1.00 0.00 O ATOM 0 H TYR A 43 -1.782 -10.632 4.649 1.00 0.00 H new ATOM 0 HA TYR A 43 -1.978 -9.897 7.451 1.00 0.00 H new ATOM 0 HB2 TYR A 43 0.151 -9.834 6.282 1.00 0.00 H new ATOM 0 HB3 TYR A 43 -0.526 -8.942 4.933 1.00 0.00 H new ATOM 0 HD1 TYR A 43 0.636 -8.707 8.437 1.00 0.00 H new ATOM 0 HD2 TYR A 43 -0.989 -6.536 5.105 1.00 0.00 H new ATOM 0 HE1 TYR A 43 1.205 -6.566 9.552 1.00 0.00 H new ATOM 0 HE2 TYR A 43 -0.413 -4.397 6.219 1.00 0.00 H new ATOM 0 HH TYR A 43 1.240 -3.578 7.954 1.00 0.00 H new ATOM 680 N ALA A 44 -3.403 -7.883 5.299 1.00 0.00 N ATOM 681 CA ALA A 44 -4.327 -6.714 5.247 1.00 0.00 C ATOM 682 C ALA A 44 -5.736 -7.136 5.677 1.00 0.00 C ATOM 683 O ALA A 44 -6.552 -6.315 6.048 1.00 0.00 O ATOM 684 CB ALA A 44 -4.313 -6.266 3.784 1.00 0.00 C ATOM 0 H ALA A 44 -3.194 -8.314 4.398 1.00 0.00 H new ATOM 0 HA ALA A 44 -4.023 -5.911 5.918 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -4.971 -5.406 3.661 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -3.298 -5.990 3.498 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -4.660 -7.082 3.150 1.00 0.00 H new ATOM 690 N GLN A 45 -6.030 -8.409 5.630 1.00 0.00 N ATOM 691 CA GLN A 45 -7.388 -8.878 6.037 1.00 0.00 C ATOM 692 C GLN A 45 -7.681 -8.530 7.496 1.00 0.00 C ATOM 693 O GLN A 45 -8.816 -8.345 7.880 1.00 0.00 O ATOM 694 CB GLN A 45 -7.363 -10.405 5.902 1.00 0.00 C ATOM 695 CG GLN A 45 -7.238 -10.846 4.439 1.00 0.00 C ATOM 696 CD GLN A 45 -7.868 -9.819 3.498 1.00 0.00 C ATOM 697 OE1 GLN A 45 -9.042 -9.532 3.588 1.00 0.00 O ATOM 698 NE2 GLN A 45 -7.124 -9.254 2.592 1.00 0.00 N ATOM 0 H GLN A 45 -5.390 -9.143 5.328 1.00 0.00 H new ATOM 0 HA GLN A 45 -8.152 -8.406 5.419 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -6.527 -10.807 6.475 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -8.274 -10.823 6.331 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -6.186 -10.979 4.185 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -7.724 -11.813 4.305 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -6.136 -9.498 2.519 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -7.529 -8.568 1.955 1.00 0.00 H new ATOM 707 N THR A 46 -6.677 -8.486 8.323 1.00 0.00 N ATOM 708 CA THR A 46 -6.930 -8.207 9.764 1.00 0.00 C ATOM 709 C THR A 46 -6.420 -6.826 10.163 1.00 0.00 C ATOM 710 O THR A 46 -6.231 -6.549 11.330 1.00 0.00 O ATOM 711 CB THR A 46 -6.146 -9.293 10.499 1.00 0.00 C ATOM 712 OG1 THR A 46 -4.755 -9.033 10.368 1.00 0.00 O ATOM 713 CG2 THR A 46 -6.472 -10.660 9.888 1.00 0.00 C ATOM 0 H THR A 46 -5.700 -8.630 8.068 1.00 0.00 H new ATOM 0 HA THR A 46 -7.994 -8.215 9.999 1.00 0.00 H new ATOM 0 HB THR A 46 -6.420 -9.295 11.554 1.00 0.00 H new ATOM 0 HG1 THR A 46 -4.247 -9.726 10.839 1.00 0.00 H new ATOM 0 HG21 THR A 46 -5.913 -11.435 10.412 1.00 0.00 H new ATOM 0 HG22 THR A 46 -7.540 -10.856 9.983 1.00 0.00 H new ATOM 0 HG23 THR A 46 -6.195 -10.663 8.834 1.00 0.00 H new ATOM 721 N HIS A 47 -6.195 -5.960 9.214 1.00 0.00 N ATOM 722 CA HIS A 47 -5.688 -4.603 9.560 1.00 0.00 C ATOM 723 C HIS A 47 -5.873 -3.635 8.381 1.00 0.00 C ATOM 724 O HIS A 47 -5.133 -2.685 8.237 1.00 0.00 O ATOM 725 CB HIS A 47 -4.198 -4.817 9.847 1.00 0.00 C ATOM 726 CG HIS A 47 -4.022 -5.353 11.239 1.00 0.00 C ATOM 727 ND1 HIS A 47 -4.751 -4.869 12.312 1.00 0.00 N ATOM 728 CD2 HIS A 47 -3.211 -6.336 11.750 1.00 0.00 C ATOM 729 CE1 HIS A 47 -4.369 -5.552 13.405 1.00 0.00 C ATOM 730 NE2 HIS A 47 -3.431 -6.460 13.120 1.00 0.00 N ATOM 0 H HIS A 47 -6.339 -6.132 8.219 1.00 0.00 H new ATOM 0 HA HIS A 47 -6.220 -4.165 10.405 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -3.775 -5.513 9.123 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -3.658 -3.876 9.738 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -2.509 -6.924 11.177 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -4.771 -5.387 14.394 1.00 0.00 H new ATOM 0 HE2 HIS A 47 -2.975 -7.104 13.766 1.00 0.00 H new ATOM 738 N ARG A 48 -6.840 -3.880 7.531 1.00 0.00 N ATOM 739 CA ARG A 48 -7.041 -2.973 6.344 1.00 0.00 C ATOM 740 C ARG A 48 -6.855 -1.523 6.763 1.00 0.00 C ATOM 741 O ARG A 48 -6.049 -0.798 6.217 1.00 0.00 O ATOM 742 CB ARG A 48 -8.497 -3.131 5.872 1.00 0.00 C ATOM 743 CG ARG A 48 -9.041 -4.520 6.175 1.00 0.00 C ATOM 744 CD ARG A 48 -10.408 -4.677 5.509 1.00 0.00 C ATOM 745 NE ARG A 48 -11.390 -4.358 6.584 1.00 0.00 N ATOM 746 CZ ARG A 48 -11.812 -3.132 6.772 1.00 0.00 C ATOM 747 NH1 ARG A 48 -11.405 -2.156 6.002 1.00 0.00 N ATOM 748 NH2 ARG A 48 -12.654 -2.886 7.740 1.00 0.00 N ATOM 0 H ARG A 48 -7.495 -4.658 7.601 1.00 0.00 H new ATOM 0 HA ARG A 48 -6.327 -3.231 5.562 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -9.121 -2.382 6.360 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -8.554 -2.944 4.800 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -8.354 -5.282 5.807 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -9.129 -4.663 7.252 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -10.515 -4.001 4.661 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -10.550 -5.689 5.130 1.00 0.00 H new ATOM 0 HE ARG A 48 -11.739 -5.106 7.183 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -10.750 -2.344 5.243 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -11.742 -1.207 6.161 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -12.976 -3.645 8.341 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -12.989 -1.935 7.895 1.00 0.00 H new ATOM 762 N ASP A 49 -7.609 -1.097 7.729 1.00 0.00 N ATOM 763 CA ASP A 49 -7.496 0.315 8.193 1.00 0.00 C ATOM 764 C ASP A 49 -6.185 0.523 8.960 1.00 0.00 C ATOM 765 O ASP A 49 -5.594 1.582 8.908 1.00 0.00 O ATOM 766 CB ASP A 49 -8.710 0.545 9.100 1.00 0.00 C ATOM 767 CG ASP A 49 -8.494 -0.137 10.452 1.00 0.00 C ATOM 768 OD1 ASP A 49 -7.911 0.488 11.320 1.00 0.00 O ATOM 769 OD2 ASP A 49 -8.915 -1.273 10.594 1.00 0.00 O ATOM 0 H ASP A 49 -8.301 -1.662 8.221 1.00 0.00 H new ATOM 0 HA ASP A 49 -7.482 1.020 7.361 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -8.868 1.614 9.244 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -9.608 0.151 8.625 1.00 0.00 H new ATOM 774 N GLN A 50 -5.721 -0.475 9.666 1.00 0.00 N ATOM 775 CA GLN A 50 -4.446 -0.314 10.425 1.00 0.00 C ATOM 776 C GLN A 50 -3.266 -0.110 9.472 1.00 0.00 C ATOM 777 O GLN A 50 -2.328 0.600 9.780 1.00 0.00 O ATOM 778 CB GLN A 50 -4.283 -1.603 11.228 1.00 0.00 C ATOM 779 CG GLN A 50 -5.296 -1.606 12.372 1.00 0.00 C ATOM 780 CD GLN A 50 -5.105 -0.347 13.222 1.00 0.00 C ATOM 781 OE1 GLN A 50 -4.004 -0.040 13.635 1.00 0.00 O ATOM 782 NE2 GLN A 50 -6.137 0.404 13.493 1.00 0.00 N ATOM 0 H GLN A 50 -6.166 -1.389 9.750 1.00 0.00 H new ATOM 0 HA GLN A 50 -4.471 0.562 11.073 1.00 0.00 H new ATOM 0 HB2 GLN A 50 -4.438 -2.470 10.585 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -3.269 -1.676 11.622 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -6.310 -1.640 11.974 1.00 0.00 H new ATOM 0 HG3 GLN A 50 -5.165 -2.497 12.987 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -7.061 0.146 13.146 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -6.020 1.249 14.052 1.00 0.00 H new ATOM 791 N ILE A 51 -3.298 -0.711 8.314 1.00 0.00 N ATOM 792 CA ILE A 51 -2.164 -0.515 7.368 1.00 0.00 C ATOM 793 C ILE A 51 -2.076 0.966 6.994 1.00 0.00 C ATOM 794 O ILE A 51 -3.001 1.536 6.443 1.00 0.00 O ATOM 795 CB ILE A 51 -2.488 -1.373 6.137 1.00 0.00 C ATOM 796 CG1 ILE A 51 -2.800 -2.825 6.539 1.00 0.00 C ATOM 797 CG2 ILE A 51 -1.285 -1.376 5.197 1.00 0.00 C ATOM 798 CD1 ILE A 51 -2.094 -3.194 7.851 1.00 0.00 C ATOM 0 H ILE A 51 -4.048 -1.320 7.986 1.00 0.00 H new ATOM 0 HA ILE A 51 -1.206 -0.806 7.799 1.00 0.00 H new ATOM 0 HB ILE A 51 -3.363 -0.948 5.645 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -3.877 -2.952 6.653 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -2.481 -3.502 5.747 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -1.510 -1.984 4.321 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -1.065 -0.355 4.884 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -0.420 -1.791 5.714 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -2.330 -4.225 8.114 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -1.016 -3.089 7.726 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -2.433 -2.530 8.646 1.00 0.00 H new ATOM 810 N ASP A 52 -0.977 1.594 7.303 1.00 0.00 N ATOM 811 CA ASP A 52 -0.831 3.041 6.982 1.00 0.00 C ATOM 812 C ASP A 52 -0.325 3.230 5.553 1.00 0.00 C ATOM 813 O ASP A 52 -0.564 4.246 4.945 1.00 0.00 O ATOM 814 CB ASP A 52 0.188 3.579 7.989 1.00 0.00 C ATOM 815 CG ASP A 52 -0.503 3.819 9.334 1.00 0.00 C ATOM 816 OD1 ASP A 52 -0.535 2.900 10.134 1.00 0.00 O ATOM 817 OD2 ASP A 52 -0.989 4.920 9.541 1.00 0.00 O ATOM 0 H ASP A 52 -0.173 1.168 7.764 1.00 0.00 H new ATOM 0 HA ASP A 52 -1.784 3.567 7.048 1.00 0.00 H new ATOM 0 HB2 ASP A 52 1.006 2.869 8.110 1.00 0.00 H new ATOM 0 HB3 ASP A 52 0.624 4.508 7.621 1.00 0.00 H new ATOM 822 N CYS A 53 0.374 2.268 5.012 1.00 0.00 N ATOM 823 CA CYS A 53 0.884 2.426 3.619 1.00 0.00 C ATOM 824 C CYS A 53 1.316 1.075 3.046 1.00 0.00 C ATOM 825 O CYS A 53 1.998 0.303 3.690 1.00 0.00 O ATOM 826 CB CYS A 53 2.081 3.373 3.749 1.00 0.00 C ATOM 827 SG CYS A 53 2.201 4.415 2.272 1.00 0.00 S ATOM 0 H CYS A 53 0.612 1.388 5.469 1.00 0.00 H new ATOM 0 HA CYS A 53 0.125 2.816 2.941 1.00 0.00 H new ATOM 0 HB2 CYS A 53 1.969 3.996 4.637 1.00 0.00 H new ATOM 0 HB3 CYS A 53 2.999 2.799 3.876 1.00 0.00 H new ATOM 0 HG CYS A 53 1.264 4.088 1.433 1.00 0.00 H new ATOM 833 N LEU A 54 0.921 0.772 1.842 1.00 0.00 N ATOM 834 CA LEU A 54 1.321 -0.536 1.260 1.00 0.00 C ATOM 835 C LEU A 54 2.366 -0.352 0.161 1.00 0.00 C ATOM 836 O LEU A 54 2.234 0.493 -0.702 1.00 0.00 O ATOM 837 CB LEU A 54 0.045 -1.118 0.661 1.00 0.00 C ATOM 838 CG LEU A 54 0.367 -2.463 0.012 1.00 0.00 C ATOM 839 CD1 LEU A 54 0.457 -3.538 1.094 1.00 0.00 C ATOM 840 CD2 LEU A 54 -0.731 -2.825 -0.986 1.00 0.00 C ATOM 0 H LEU A 54 0.346 1.365 1.243 1.00 0.00 H new ATOM 0 HA LEU A 54 1.763 -1.185 2.016 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -0.710 -1.246 1.436 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -0.370 -0.433 -0.079 1.00 0.00 H new ATOM 0 HG LEU A 54 1.320 -2.397 -0.513 1.00 0.00 H new ATOM 0 HD11 LEU A 54 0.687 -4.499 0.634 1.00 0.00 H new ATOM 0 HD12 LEU A 54 1.244 -3.277 1.802 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -0.495 -3.606 1.620 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -0.500 -3.785 -1.448 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -1.687 -2.893 -0.467 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -0.791 -2.056 -1.756 1.00 0.00 H new ATOM 852 N ILE A 55 3.389 -1.163 0.152 1.00 0.00 N ATOM 853 CA ILE A 55 4.396 -1.038 -0.935 1.00 0.00 C ATOM 854 C ILE A 55 4.140 -2.136 -1.946 1.00 0.00 C ATOM 855 O ILE A 55 4.151 -3.308 -1.620 1.00 0.00 O ATOM 856 CB ILE A 55 5.762 -1.251 -0.300 1.00 0.00 C ATOM 857 CG1 ILE A 55 5.977 -0.253 0.827 1.00 0.00 C ATOM 858 CG2 ILE A 55 6.847 -1.050 -1.361 1.00 0.00 C ATOM 859 CD1 ILE A 55 7.209 -0.687 1.605 1.00 0.00 C ATOM 0 H ILE A 55 3.568 -1.895 0.839 1.00 0.00 H new ATOM 0 HA ILE A 55 4.343 -0.067 -1.427 1.00 0.00 H new ATOM 0 HB ILE A 55 5.814 -2.263 0.103 1.00 0.00 H new ATOM 0 HG12 ILE A 55 6.113 0.752 0.427 1.00 0.00 H new ATOM 0 HG13 ILE A 55 5.105 -0.221 1.480 1.00 0.00 H new ATOM 0 HG21 ILE A 55 7.828 -1.201 -0.911 1.00 0.00 H new ATOM 0 HG22 ILE A 55 6.703 -1.768 -2.169 1.00 0.00 H new ATOM 0 HG23 ILE A 55 6.783 -0.038 -1.760 1.00 0.00 H new ATOM 0 HD11 ILE A 55 7.388 0.012 2.422 1.00 0.00 H new ATOM 0 HD12 ILE A 55 7.050 -1.686 2.011 1.00 0.00 H new ATOM 0 HD13 ILE A 55 8.073 -0.699 0.941 1.00 0.00 H new ATOM 871 N LEU A 56 3.903 -1.784 -3.164 1.00 0.00 N ATOM 872 CA LEU A 56 3.645 -2.828 -4.181 1.00 0.00 C ATOM 873 C LEU A 56 4.641 -2.710 -5.327 1.00 0.00 C ATOM 874 O LEU A 56 5.038 -1.629 -5.713 1.00 0.00 O ATOM 875 CB LEU A 56 2.225 -2.560 -4.667 1.00 0.00 C ATOM 876 CG LEU A 56 1.228 -3.093 -3.639 1.00 0.00 C ATOM 877 CD1 LEU A 56 -0.188 -2.956 -4.190 1.00 0.00 C ATOM 878 CD2 LEU A 56 1.520 -4.569 -3.359 1.00 0.00 C ATOM 0 H LEU A 56 3.876 -0.823 -3.503 1.00 0.00 H new ATOM 0 HA LEU A 56 3.753 -3.835 -3.778 1.00 0.00 H new ATOM 0 HB2 LEU A 56 2.075 -1.491 -4.815 1.00 0.00 H new ATOM 0 HB3 LEU A 56 2.062 -3.041 -5.631 1.00 0.00 H new ATOM 0 HG LEU A 56 1.320 -2.522 -2.715 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -0.901 -3.336 -3.458 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -0.400 -1.906 -4.392 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -0.276 -3.528 -5.113 1.00 0.00 H new ATOM 0 HD21 LEU A 56 0.808 -4.948 -2.626 1.00 0.00 H new ATOM 0 HD22 LEU A 56 1.428 -5.140 -4.283 1.00 0.00 H new ATOM 0 HD23 LEU A 56 2.533 -4.672 -2.969 1.00 0.00 H new ATOM 890 N VAL A 57 5.033 -3.818 -5.886 1.00 0.00 N ATOM 891 CA VAL A 57 5.988 -3.771 -7.025 1.00 0.00 C ATOM 892 C VAL A 57 5.230 -4.121 -8.302 1.00 0.00 C ATOM 893 O VAL A 57 4.851 -5.254 -8.524 1.00 0.00 O ATOM 894 CB VAL A 57 7.060 -4.818 -6.718 1.00 0.00 C ATOM 895 CG1 VAL A 57 7.978 -4.972 -7.932 1.00 0.00 C ATOM 896 CG2 VAL A 57 7.890 -4.359 -5.517 1.00 0.00 C ATOM 0 H VAL A 57 4.735 -4.752 -5.605 1.00 0.00 H new ATOM 0 HA VAL A 57 6.443 -2.790 -7.160 1.00 0.00 H new ATOM 0 HB VAL A 57 6.583 -5.772 -6.492 1.00 0.00 H new ATOM 0 HG11 VAL A 57 8.744 -5.718 -7.717 1.00 0.00 H new ATOM 0 HG12 VAL A 57 7.392 -5.292 -8.793 1.00 0.00 H new ATOM 0 HG13 VAL A 57 8.454 -4.016 -8.152 1.00 0.00 H new ATOM 0 HG21 VAL A 57 8.654 -5.104 -5.297 1.00 0.00 H new ATOM 0 HG22 VAL A 57 8.367 -3.407 -5.747 1.00 0.00 H new ATOM 0 HG23 VAL A 57 7.240 -4.239 -4.650 1.00 0.00 H new ATOM 906 N ALA A 58 4.982 -3.151 -9.126 1.00 0.00 N ATOM 907 CA ALA A 58 4.217 -3.411 -10.378 1.00 0.00 C ATOM 908 C ALA A 58 5.011 -4.300 -11.336 1.00 0.00 C ATOM 909 O ALA A 58 4.494 -4.767 -12.330 1.00 0.00 O ATOM 910 CB ALA A 58 3.999 -2.030 -10.983 1.00 0.00 C ATOM 0 H ALA A 58 5.275 -2.184 -8.990 1.00 0.00 H new ATOM 0 HA ALA A 58 3.282 -3.936 -10.185 1.00 0.00 H new ATOM 0 HB1 ALA A 58 3.440 -2.125 -11.914 1.00 0.00 H new ATOM 0 HB2 ALA A 58 3.437 -1.411 -10.284 1.00 0.00 H new ATOM 0 HB3 ALA A 58 4.964 -1.565 -11.185 1.00 0.00 H new ATOM 916 N ALA A 59 6.259 -4.535 -11.050 1.00 0.00 N ATOM 917 CA ALA A 59 7.078 -5.391 -11.955 1.00 0.00 C ATOM 918 C ALA A 59 6.589 -6.846 -11.919 1.00 0.00 C ATOM 919 O ALA A 59 7.030 -7.674 -12.691 1.00 0.00 O ATOM 920 CB ALA A 59 8.502 -5.283 -11.409 1.00 0.00 C ATOM 0 H ALA A 59 6.748 -4.173 -10.231 1.00 0.00 H new ATOM 0 HA ALA A 59 7.011 -5.072 -12.995 1.00 0.00 H new ATOM 0 HB1 ALA A 59 9.173 -5.886 -12.020 1.00 0.00 H new ATOM 0 HB2 ALA A 59 8.824 -4.242 -11.436 1.00 0.00 H new ATOM 0 HB3 ALA A 59 8.526 -5.643 -10.381 1.00 0.00 H new ATOM 926 N ASN A 60 5.681 -7.166 -11.035 1.00 0.00 N ATOM 927 CA ASN A 60 5.170 -8.568 -10.965 1.00 0.00 C ATOM 928 C ASN A 60 4.033 -8.768 -11.974 1.00 0.00 C ATOM 929 O ASN A 60 3.420 -7.817 -12.418 1.00 0.00 O ATOM 930 CB ASN A 60 4.653 -8.736 -9.537 1.00 0.00 C ATOM 931 CG ASN A 60 5.774 -9.263 -8.638 1.00 0.00 C ATOM 932 OD1 ASN A 60 6.593 -10.053 -9.068 1.00 0.00 O ATOM 933 ND2 ASN A 60 5.848 -8.860 -7.399 1.00 0.00 N ATOM 0 H ASN A 60 5.272 -6.520 -10.360 1.00 0.00 H new ATOM 0 HA ASN A 60 5.942 -9.299 -11.205 1.00 0.00 H new ATOM 0 HB2 ASN A 60 4.289 -7.781 -9.158 1.00 0.00 H new ATOM 0 HB3 ASN A 60 3.810 -9.426 -9.525 1.00 0.00 H new ATOM 0 HD21 ASN A 60 6.592 -9.207 -6.793 1.00 0.00 H new ATOM 0 HD22 ASN A 60 5.162 -8.198 -7.036 1.00 0.00 H new ATOM 940 N PRO A 61 3.800 -10.007 -12.309 1.00 0.00 N ATOM 941 CA PRO A 61 2.733 -10.347 -13.281 1.00 0.00 C ATOM 942 C PRO A 61 1.339 -10.218 -12.653 1.00 0.00 C ATOM 943 O PRO A 61 0.669 -9.219 -12.817 1.00 0.00 O ATOM 944 CB PRO A 61 3.035 -11.793 -13.655 1.00 0.00 C ATOM 945 CG PRO A 61 3.807 -12.350 -12.500 1.00 0.00 C ATOM 946 CD PRO A 61 4.504 -11.197 -11.821 1.00 0.00 C ATOM 0 HA PRO A 61 2.723 -9.679 -14.142 1.00 0.00 H new ATOM 0 HB2 PRO A 61 2.116 -12.356 -13.821 1.00 0.00 H new ATOM 0 HB3 PRO A 61 3.614 -11.848 -14.577 1.00 0.00 H new ATOM 0 HG2 PRO A 61 3.141 -12.859 -11.803 1.00 0.00 H new ATOM 0 HG3 PRO A 61 4.532 -13.087 -12.844 1.00 0.00 H new ATOM 0 HD2 PRO A 61 4.442 -11.278 -10.736 1.00 0.00 H new ATOM 0 HD3 PRO A 61 5.563 -11.166 -12.078 1.00 0.00 H new ATOM 954 N SER A 62 0.893 -11.219 -11.948 1.00 0.00 N ATOM 955 CA SER A 62 -0.466 -11.153 -11.331 1.00 0.00 C ATOM 956 C SER A 62 -0.531 -10.105 -10.217 1.00 0.00 C ATOM 957 O SER A 62 -1.543 -9.964 -9.559 1.00 0.00 O ATOM 958 CB SER A 62 -0.706 -12.541 -10.748 1.00 0.00 C ATOM 959 OG SER A 62 0.440 -12.943 -10.008 1.00 0.00 O ATOM 0 H SER A 62 1.409 -12.081 -11.771 1.00 0.00 H new ATOM 0 HA SER A 62 -1.216 -10.867 -12.068 1.00 0.00 H new ATOM 0 HB2 SER A 62 -1.585 -12.530 -10.103 1.00 0.00 H new ATOM 0 HB3 SER A 62 -0.906 -13.255 -11.547 1.00 0.00 H new ATOM 0 HG SER A 62 0.289 -13.834 -9.630 1.00 0.00 H new ATOM 965 N PHE A 63 0.526 -9.371 -9.982 1.00 0.00 N ATOM 966 CA PHE A 63 0.478 -8.357 -8.898 1.00 0.00 C ATOM 967 C PHE A 63 -0.843 -7.585 -8.982 1.00 0.00 C ATOM 968 O PHE A 63 -1.545 -7.434 -8.002 1.00 0.00 O ATOM 969 CB PHE A 63 1.683 -7.437 -9.145 1.00 0.00 C ATOM 970 CG PHE A 63 1.380 -6.064 -8.602 1.00 0.00 C ATOM 971 CD1 PHE A 63 1.152 -5.896 -7.235 1.00 0.00 C ATOM 972 CD2 PHE A 63 1.292 -4.968 -9.468 1.00 0.00 C ATOM 973 CE1 PHE A 63 0.835 -4.638 -6.731 1.00 0.00 C ATOM 974 CE2 PHE A 63 0.980 -3.704 -8.962 1.00 0.00 C ATOM 975 CZ PHE A 63 0.748 -3.536 -7.592 1.00 0.00 C ATOM 0 H PHE A 63 1.409 -9.431 -10.490 1.00 0.00 H new ATOM 0 HA PHE A 63 0.526 -8.799 -7.903 1.00 0.00 H new ATOM 0 HB2 PHE A 63 2.571 -7.844 -8.662 1.00 0.00 H new ATOM 0 HB3 PHE A 63 1.899 -7.379 -10.212 1.00 0.00 H new ATOM 0 HD1 PHE A 63 1.222 -6.743 -6.568 1.00 0.00 H new ATOM 0 HD2 PHE A 63 1.465 -5.099 -10.526 1.00 0.00 H new ATOM 0 HE1 PHE A 63 0.656 -4.511 -5.674 1.00 0.00 H new ATOM 0 HE2 PHE A 63 0.918 -2.856 -9.628 1.00 0.00 H new ATOM 0 HZ PHE A 63 0.503 -2.560 -7.200 1.00 0.00 H new ATOM 985 N ARG A 64 -1.197 -7.111 -10.144 1.00 0.00 N ATOM 986 CA ARG A 64 -2.483 -6.370 -10.269 1.00 0.00 C ATOM 987 C ARG A 64 -3.609 -7.231 -9.695 1.00 0.00 C ATOM 988 O ARG A 64 -4.490 -6.749 -9.010 1.00 0.00 O ATOM 989 CB ARG A 64 -2.691 -6.156 -11.771 1.00 0.00 C ATOM 990 CG ARG A 64 -2.000 -4.866 -12.218 1.00 0.00 C ATOM 991 CD ARG A 64 -0.485 -5.070 -12.218 1.00 0.00 C ATOM 992 NE ARG A 64 -0.211 -5.986 -13.363 1.00 0.00 N ATOM 993 CZ ARG A 64 1.017 -6.174 -13.776 1.00 0.00 C ATOM 994 NH1 ARG A 64 2.007 -5.543 -13.203 1.00 0.00 N ATOM 995 NH2 ARG A 64 1.251 -6.994 -14.767 1.00 0.00 N ATOM 0 H ARG A 64 -0.658 -7.203 -11.005 1.00 0.00 H new ATOM 0 HA ARG A 64 -2.474 -5.422 -9.732 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -2.290 -7.004 -12.326 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -3.756 -6.104 -11.995 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -2.340 -4.586 -13.215 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -2.267 -4.048 -11.549 1.00 0.00 H new ATOM 0 HD2 ARG A 64 0.039 -4.122 -12.338 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -0.147 -5.504 -11.277 1.00 0.00 H new ATOM 0 HE ARG A 64 -0.982 -6.467 -13.825 1.00 0.00 H new ATOM 0 HH11 ARG A 64 1.824 -4.902 -12.431 1.00 0.00 H new ATOM 0 HH12 ARG A 64 2.963 -5.692 -13.527 1.00 0.00 H new ATOM 0 HH21 ARG A 64 0.478 -7.485 -15.216 1.00 0.00 H new ATOM 0 HH22 ARG A 64 2.207 -7.143 -15.091 1.00 0.00 H new ATOM 1009 N ALA A 65 -3.577 -8.508 -9.967 1.00 0.00 N ATOM 1010 CA ALA A 65 -4.636 -9.417 -9.436 1.00 0.00 C ATOM 1011 C ALA A 65 -4.615 -9.416 -7.902 1.00 0.00 C ATOM 1012 O ALA A 65 -5.643 -9.341 -7.254 1.00 0.00 O ATOM 1013 CB ALA A 65 -4.271 -10.801 -9.976 1.00 0.00 C ATOM 0 H ALA A 65 -2.862 -8.963 -10.535 1.00 0.00 H new ATOM 0 HA ALA A 65 -5.637 -9.110 -9.739 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -5.003 -11.531 -9.630 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -4.269 -10.777 -11.066 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -3.281 -11.082 -9.617 1.00 0.00 H new ATOM 1019 N VAL A 66 -3.453 -9.487 -7.319 1.00 0.00 N ATOM 1020 CA VAL A 66 -3.361 -9.475 -5.831 1.00 0.00 C ATOM 1021 C VAL A 66 -3.897 -8.145 -5.306 1.00 0.00 C ATOM 1022 O VAL A 66 -4.558 -8.083 -4.285 1.00 0.00 O ATOM 1023 CB VAL A 66 -1.873 -9.622 -5.529 1.00 0.00 C ATOM 1024 CG1 VAL A 66 -1.600 -9.354 -4.044 1.00 0.00 C ATOM 1025 CG2 VAL A 66 -1.432 -11.044 -5.870 1.00 0.00 C ATOM 0 H VAL A 66 -2.560 -9.553 -7.808 1.00 0.00 H new ATOM 0 HA VAL A 66 -3.943 -10.267 -5.359 1.00 0.00 H new ATOM 0 HB VAL A 66 -1.317 -8.900 -6.127 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -0.534 -9.463 -3.845 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -1.914 -8.341 -3.793 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -2.157 -10.068 -3.437 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -0.369 -11.156 -5.657 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -2.000 -11.755 -5.270 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -1.612 -11.237 -6.928 1.00 0.00 H new ATOM 1035 N VAL A 67 -3.625 -7.076 -6.006 1.00 0.00 N ATOM 1036 CA VAL A 67 -4.131 -5.752 -5.554 1.00 0.00 C ATOM 1037 C VAL A 67 -5.653 -5.743 -5.616 1.00 0.00 C ATOM 1038 O VAL A 67 -6.321 -5.370 -4.672 1.00 0.00 O ATOM 1039 CB VAL A 67 -3.563 -4.735 -6.536 1.00 0.00 C ATOM 1040 CG1 VAL A 67 -3.987 -3.332 -6.096 1.00 0.00 C ATOM 1041 CG2 VAL A 67 -2.036 -4.830 -6.561 1.00 0.00 C ATOM 0 H VAL A 67 -3.077 -7.064 -6.866 1.00 0.00 H new ATOM 0 HA VAL A 67 -3.834 -5.528 -4.529 1.00 0.00 H new ATOM 0 HB VAL A 67 -3.943 -4.940 -7.537 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -3.586 -2.596 -6.792 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -5.075 -3.267 -6.086 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -3.603 -3.133 -5.096 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -1.638 -4.100 -7.265 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -1.642 -4.626 -5.565 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -1.739 -5.832 -6.870 1.00 0.00 H new ATOM 1051 N GLN A 68 -6.218 -6.161 -6.719 1.00 0.00 N ATOM 1052 CA GLN A 68 -7.696 -6.174 -6.810 1.00 0.00 C ATOM 1053 C GLN A 68 -8.250 -6.960 -5.626 1.00 0.00 C ATOM 1054 O GLN A 68 -9.329 -6.690 -5.138 1.00 0.00 O ATOM 1055 CB GLN A 68 -8.030 -6.821 -8.169 1.00 0.00 C ATOM 1056 CG GLN A 68 -7.985 -8.353 -8.100 1.00 0.00 C ATOM 1057 CD GLN A 68 -9.230 -8.920 -8.786 1.00 0.00 C ATOM 1058 OE1 GLN A 68 -9.489 -8.631 -9.937 1.00 0.00 O ATOM 1059 NE2 GLN A 68 -10.018 -9.722 -8.121 1.00 0.00 N ATOM 0 H GLN A 68 -5.722 -6.489 -7.548 1.00 0.00 H new ATOM 0 HA GLN A 68 -8.144 -5.182 -6.763 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -9.021 -6.501 -8.489 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -7.323 -6.471 -8.921 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -7.084 -8.725 -8.588 1.00 0.00 H new ATOM 0 HG3 GLN A 68 -7.945 -8.682 -7.062 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -9.801 -9.965 -7.154 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -10.851 -10.105 -8.568 1.00 0.00 H new ATOM 1068 N GLN A 69 -7.499 -7.913 -5.132 1.00 0.00 N ATOM 1069 CA GLN A 69 -7.979 -8.685 -3.954 1.00 0.00 C ATOM 1070 C GLN A 69 -8.089 -7.736 -2.760 1.00 0.00 C ATOM 1071 O GLN A 69 -9.116 -7.651 -2.116 1.00 0.00 O ATOM 1072 CB GLN A 69 -6.920 -9.758 -3.697 1.00 0.00 C ATOM 1073 CG GLN A 69 -7.455 -10.756 -2.664 1.00 0.00 C ATOM 1074 CD GLN A 69 -7.592 -12.138 -3.307 1.00 0.00 C ATOM 1075 OE1 GLN A 69 -6.607 -12.763 -3.644 1.00 0.00 O ATOM 1076 NE2 GLN A 69 -8.780 -12.644 -3.494 1.00 0.00 N ATOM 0 H GLN A 69 -6.584 -8.185 -5.492 1.00 0.00 H new ATOM 0 HA GLN A 69 -8.957 -9.139 -4.117 1.00 0.00 H new ATOM 0 HB2 GLN A 69 -6.675 -10.274 -4.625 1.00 0.00 H new ATOM 0 HB3 GLN A 69 -6.000 -9.299 -3.335 1.00 0.00 H new ATOM 0 HG2 GLN A 69 -6.780 -10.807 -1.809 1.00 0.00 H new ATOM 0 HG3 GLN A 69 -8.422 -10.422 -2.287 1.00 0.00 H new ATOM 0 HE21 GLN A 69 -9.608 -12.120 -3.211 1.00 0.00 H new ATOM 0 HE22 GLN A 69 -8.881 -13.564 -3.923 1.00 0.00 H new ATOM 1085 N LEU A 70 -7.049 -6.988 -2.478 1.00 0.00 N ATOM 1086 CA LEU A 70 -7.130 -6.020 -1.347 1.00 0.00 C ATOM 1087 C LEU A 70 -8.382 -5.171 -1.546 1.00 0.00 C ATOM 1088 O LEU A 70 -9.202 -5.023 -0.661 1.00 0.00 O ATOM 1089 CB LEU A 70 -5.870 -5.160 -1.454 1.00 0.00 C ATOM 1090 CG LEU A 70 -4.745 -5.783 -0.627 1.00 0.00 C ATOM 1091 CD1 LEU A 70 -3.503 -5.945 -1.499 1.00 0.00 C ATOM 1092 CD2 LEU A 70 -4.414 -4.862 0.549 1.00 0.00 C ATOM 0 H LEU A 70 -6.160 -7.007 -2.977 1.00 0.00 H new ATOM 0 HA LEU A 70 -7.189 -6.499 -0.369 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -5.564 -5.076 -2.497 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -6.077 -4.150 -1.100 1.00 0.00 H new ATOM 0 HG LEU A 70 -5.063 -6.758 -0.256 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -2.700 -6.389 -0.910 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -3.734 -6.593 -2.344 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -3.186 -4.969 -1.866 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -3.612 -5.302 1.142 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -4.095 -3.890 0.172 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -5.299 -4.736 1.173 1.00 0.00 H new ATOM 1104 N CYS A 71 -8.540 -4.641 -2.727 1.00 0.00 N ATOM 1105 CA CYS A 71 -9.747 -3.830 -3.033 1.00 0.00 C ATOM 1106 C CYS A 71 -10.987 -4.692 -2.817 1.00 0.00 C ATOM 1107 O CYS A 71 -12.003 -4.239 -2.331 1.00 0.00 O ATOM 1108 CB CYS A 71 -9.606 -3.478 -4.514 1.00 0.00 C ATOM 1109 SG CYS A 71 -8.086 -2.535 -4.773 1.00 0.00 S ATOM 0 H CYS A 71 -7.879 -4.737 -3.498 1.00 0.00 H new ATOM 0 HA CYS A 71 -9.839 -2.943 -2.407 1.00 0.00 H new ATOM 0 HB2 CYS A 71 -9.588 -4.388 -5.114 1.00 0.00 H new ATOM 0 HB3 CYS A 71 -10.467 -2.896 -4.843 1.00 0.00 H new ATOM 0 HG CYS A 71 -7.073 -3.348 -4.818 1.00 0.00 H new ATOM 1115 N PHE A 72 -10.899 -5.939 -3.184 1.00 0.00 N ATOM 1116 CA PHE A 72 -12.054 -6.857 -3.014 1.00 0.00 C ATOM 1117 C PHE A 72 -12.385 -7.030 -1.527 1.00 0.00 C ATOM 1118 O PHE A 72 -13.532 -7.179 -1.153 1.00 0.00 O ATOM 1119 CB PHE A 72 -11.590 -8.172 -3.638 1.00 0.00 C ATOM 1120 CG PHE A 72 -12.730 -9.152 -3.634 1.00 0.00 C ATOM 1121 CD1 PHE A 72 -14.014 -8.729 -3.991 1.00 0.00 C ATOM 1122 CD2 PHE A 72 -12.504 -10.482 -3.269 1.00 0.00 C ATOM 1123 CE1 PHE A 72 -15.076 -9.641 -3.985 1.00 0.00 C ATOM 1124 CE2 PHE A 72 -13.561 -11.394 -3.262 1.00 0.00 C ATOM 1125 CZ PHE A 72 -14.849 -10.975 -3.619 1.00 0.00 C ATOM 0 H PHE A 72 -10.069 -6.363 -3.598 1.00 0.00 H new ATOM 0 HA PHE A 72 -12.964 -6.483 -3.484 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -11.245 -8.002 -4.658 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -10.746 -8.576 -3.079 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -14.186 -7.700 -4.271 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -11.511 -10.804 -2.992 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -16.068 -9.317 -4.262 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -13.386 -12.422 -2.981 1.00 0.00 H new ATOM 0 HZ PHE A 72 -15.667 -11.680 -3.612 1.00 0.00 H new ATOM 1135 N GLU A 73 -11.397 -6.996 -0.675 1.00 0.00 N ATOM 1136 CA GLU A 73 -11.673 -7.141 0.784 1.00 0.00 C ATOM 1137 C GLU A 73 -12.027 -5.773 1.372 1.00 0.00 C ATOM 1138 O GLU A 73 -12.356 -5.648 2.536 1.00 0.00 O ATOM 1139 CB GLU A 73 -10.370 -7.668 1.389 1.00 0.00 C ATOM 1140 CG GLU A 73 -10.057 -9.046 0.807 1.00 0.00 C ATOM 1141 CD GLU A 73 -10.679 -10.127 1.695 1.00 0.00 C ATOM 1142 OE1 GLU A 73 -11.773 -9.905 2.187 1.00 0.00 O ATOM 1143 OE2 GLU A 73 -10.049 -11.157 1.873 1.00 0.00 O ATOM 0 H GLU A 73 -10.415 -6.875 -0.923 1.00 0.00 H new ATOM 0 HA GLU A 73 -12.508 -7.811 0.990 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -9.553 -6.978 1.177 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -10.460 -7.732 2.473 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -10.450 -9.122 -0.207 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -8.978 -9.189 0.743 1.00 0.00 H new ATOM 1150 N GLY A 74 -11.960 -4.744 0.570 1.00 0.00 N ATOM 1151 CA GLY A 74 -12.289 -3.387 1.073 1.00 0.00 C ATOM 1152 C GLY A 74 -11.050 -2.775 1.727 1.00 0.00 C ATOM 1153 O GLY A 74 -11.134 -1.802 2.449 1.00 0.00 O ATOM 0 H GLY A 74 -11.691 -4.789 -0.413 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -12.630 -2.756 0.253 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -13.105 -3.442 1.794 1.00 0.00 H new ATOM 1157 N VAL A 75 -9.895 -3.340 1.486 1.00 0.00 N ATOM 1158 CA VAL A 75 -8.659 -2.786 2.104 1.00 0.00 C ATOM 1159 C VAL A 75 -8.028 -1.730 1.194 1.00 0.00 C ATOM 1160 O VAL A 75 -7.327 -2.050 0.257 1.00 0.00 O ATOM 1161 CB VAL A 75 -7.715 -3.981 2.246 1.00 0.00 C ATOM 1162 CG1 VAL A 75 -6.392 -3.520 2.863 1.00 0.00 C ATOM 1163 CG2 VAL A 75 -8.350 -5.042 3.146 1.00 0.00 C ATOM 0 H VAL A 75 -9.757 -4.157 0.891 1.00 0.00 H new ATOM 0 HA VAL A 75 -8.867 -2.303 3.059 1.00 0.00 H new ATOM 0 HB VAL A 75 -7.530 -4.407 1.260 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -5.721 -4.373 2.963 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -5.932 -2.770 2.219 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -6.580 -3.088 3.846 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -7.672 -5.890 3.243 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -8.541 -4.616 4.131 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -9.290 -5.377 2.707 1.00 0.00 H new ATOM 1173 N VAL A 76 -8.247 -0.475 1.475 1.00 0.00 N ATOM 1174 CA VAL A 76 -7.629 0.587 0.632 1.00 0.00 C ATOM 1175 C VAL A 76 -6.602 1.352 1.466 1.00 0.00 C ATOM 1176 O VAL A 76 -6.846 1.707 2.602 1.00 0.00 O ATOM 1177 CB VAL A 76 -8.772 1.513 0.195 1.00 0.00 C ATOM 1178 CG1 VAL A 76 -8.295 2.395 -0.969 1.00 0.00 C ATOM 1179 CG2 VAL A 76 -9.968 0.676 -0.264 1.00 0.00 C ATOM 0 H VAL A 76 -8.824 -0.140 2.247 1.00 0.00 H new ATOM 0 HA VAL A 76 -7.116 0.175 -0.237 1.00 0.00 H new ATOM 0 HB VAL A 76 -9.070 2.140 1.036 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -9.105 3.054 -1.282 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -7.444 2.994 -0.646 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -7.998 1.763 -1.806 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -10.777 1.337 -0.573 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -9.671 0.048 -1.104 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -10.308 0.046 0.558 1.00 0.00 H new ATOM 1189 N VAL A 77 -5.449 1.590 0.919 1.00 0.00 N ATOM 1190 CA VAL A 77 -4.400 2.317 1.685 1.00 0.00 C ATOM 1191 C VAL A 77 -3.511 3.086 0.723 1.00 0.00 C ATOM 1192 O VAL A 77 -3.542 2.842 -0.460 1.00 0.00 O ATOM 1193 CB VAL A 77 -3.589 1.220 2.370 1.00 0.00 C ATOM 1194 CG1 VAL A 77 -4.383 0.656 3.544 1.00 0.00 C ATOM 1195 CG2 VAL A 77 -3.309 0.100 1.364 1.00 0.00 C ATOM 0 H VAL A 77 -5.184 1.313 -0.026 1.00 0.00 H new ATOM 0 HA VAL A 77 -4.819 3.029 2.396 1.00 0.00 H new ATOM 0 HB VAL A 77 -2.649 1.634 2.734 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -3.803 -0.127 4.033 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -4.591 1.452 4.258 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -5.322 0.239 3.181 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -2.730 -0.687 1.847 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -4.253 -0.312 1.006 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -2.745 0.500 0.522 1.00 0.00 H new ATOM 1205 N PRO A 78 -2.715 3.961 1.256 1.00 0.00 N ATOM 1206 CA PRO A 78 -1.785 4.724 0.405 1.00 0.00 C ATOM 1207 C PRO A 78 -0.721 3.753 -0.082 1.00 0.00 C ATOM 1208 O PRO A 78 0.267 3.514 0.582 1.00 0.00 O ATOM 1209 CB PRO A 78 -1.197 5.766 1.343 1.00 0.00 C ATOM 1210 CG PRO A 78 -1.348 5.175 2.704 1.00 0.00 C ATOM 1211 CD PRO A 78 -2.586 4.314 2.673 1.00 0.00 C ATOM 0 HA PRO A 78 -2.239 5.194 -0.467 1.00 0.00 H new ATOM 0 HB2 PRO A 78 -0.151 5.963 1.110 1.00 0.00 H new ATOM 0 HB3 PRO A 78 -1.726 6.716 1.262 1.00 0.00 H new ATOM 0 HG2 PRO A 78 -0.472 4.582 2.967 1.00 0.00 H new ATOM 0 HG3 PRO A 78 -1.441 5.958 3.457 1.00 0.00 H new ATOM 0 HD2 PRO A 78 -2.476 3.429 3.300 1.00 0.00 H new ATOM 0 HD3 PRO A 78 -3.461 4.854 3.034 1.00 0.00 H new ATOM 1219 N ALA A 79 -0.940 3.148 -1.203 1.00 0.00 N ATOM 1220 CA ALA A 79 0.034 2.146 -1.695 1.00 0.00 C ATOM 1221 C ALA A 79 1.013 2.757 -2.698 1.00 0.00 C ATOM 1222 O ALA A 79 0.625 3.302 -3.712 1.00 0.00 O ATOM 1223 CB ALA A 79 -0.839 1.091 -2.364 1.00 0.00 C ATOM 0 H ALA A 79 -1.751 3.302 -1.803 1.00 0.00 H new ATOM 0 HA ALA A 79 0.654 1.743 -0.894 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -0.208 0.298 -2.765 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -1.528 0.671 -1.631 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -1.406 1.549 -3.175 1.00 0.00 H new ATOM 1229 N ILE A 80 2.284 2.646 -2.427 1.00 0.00 N ATOM 1230 CA ILE A 80 3.297 3.193 -3.365 1.00 0.00 C ATOM 1231 C ILE A 80 3.731 2.065 -4.302 1.00 0.00 C ATOM 1232 O ILE A 80 4.235 1.046 -3.869 1.00 0.00 O ATOM 1233 CB ILE A 80 4.446 3.660 -2.466 1.00 0.00 C ATOM 1234 CG1 ILE A 80 3.871 4.513 -1.327 1.00 0.00 C ATOM 1235 CG2 ILE A 80 5.432 4.496 -3.285 1.00 0.00 C ATOM 1236 CD1 ILE A 80 4.947 4.776 -0.271 1.00 0.00 C ATOM 0 H ILE A 80 2.663 2.198 -1.593 1.00 0.00 H new ATOM 0 HA ILE A 80 2.937 4.014 -3.986 1.00 0.00 H new ATOM 0 HB ILE A 80 4.967 2.796 -2.054 1.00 0.00 H new ATOM 0 HG12 ILE A 80 3.500 5.459 -1.722 1.00 0.00 H new ATOM 0 HG13 ILE A 80 3.022 4.002 -0.873 1.00 0.00 H new ATOM 0 HG21 ILE A 80 6.249 4.827 -2.644 1.00 0.00 H new ATOM 0 HG22 ILE A 80 5.832 3.892 -4.099 1.00 0.00 H new ATOM 0 HG23 ILE A 80 4.918 5.365 -3.696 1.00 0.00 H new ATOM 0 HD11 ILE A 80 4.528 5.382 0.532 1.00 0.00 H new ATOM 0 HD12 ILE A 80 5.298 3.827 0.135 1.00 0.00 H new ATOM 0 HD13 ILE A 80 5.783 5.306 -0.727 1.00 0.00 H new ATOM 1248 N VAL A 81 3.512 2.217 -5.579 1.00 0.00 N ATOM 1249 CA VAL A 81 3.882 1.125 -6.522 1.00 0.00 C ATOM 1250 C VAL A 81 5.273 1.355 -7.113 1.00 0.00 C ATOM 1251 O VAL A 81 5.729 2.473 -7.252 1.00 0.00 O ATOM 1252 CB VAL A 81 2.810 1.170 -7.611 1.00 0.00 C ATOM 1253 CG1 VAL A 81 3.071 0.055 -8.627 1.00 0.00 C ATOM 1254 CG2 VAL A 81 1.427 0.971 -6.979 1.00 0.00 C ATOM 0 H VAL A 81 3.096 3.044 -6.008 1.00 0.00 H new ATOM 0 HA VAL A 81 3.924 0.155 -6.027 1.00 0.00 H new ATOM 0 HB VAL A 81 2.843 2.137 -8.113 1.00 0.00 H new ATOM 0 HG11 VAL A 81 2.308 0.085 -9.404 1.00 0.00 H new ATOM 0 HG12 VAL A 81 4.054 0.196 -9.077 1.00 0.00 H new ATOM 0 HG13 VAL A 81 3.038 -0.911 -8.123 1.00 0.00 H new ATOM 0 HG21 VAL A 81 0.664 1.003 -7.756 1.00 0.00 H new ATOM 0 HG22 VAL A 81 1.392 0.004 -6.476 1.00 0.00 H new ATOM 0 HG23 VAL A 81 1.241 1.764 -6.254 1.00 0.00 H new ATOM 1264 N VAL A 82 5.951 0.294 -7.456 1.00 0.00 N ATOM 1265 CA VAL A 82 7.316 0.428 -8.035 1.00 0.00 C ATOM 1266 C VAL A 82 7.397 -0.323 -9.368 1.00 0.00 C ATOM 1267 O VAL A 82 6.757 -1.340 -9.551 1.00 0.00 O ATOM 1268 CB VAL A 82 8.244 -0.227 -7.013 1.00 0.00 C ATOM 1269 CG1 VAL A 82 9.693 0.155 -7.313 1.00 0.00 C ATOM 1270 CG2 VAL A 82 7.870 0.237 -5.602 1.00 0.00 C ATOM 0 H VAL A 82 5.616 -0.664 -7.359 1.00 0.00 H new ATOM 0 HA VAL A 82 7.580 1.468 -8.228 1.00 0.00 H new ATOM 0 HB VAL A 82 8.137 -1.310 -7.075 1.00 0.00 H new ATOM 0 HG11 VAL A 82 10.352 -0.314 -6.582 1.00 0.00 H new ATOM 0 HG12 VAL A 82 9.960 -0.186 -8.313 1.00 0.00 H new ATOM 0 HG13 VAL A 82 9.803 1.238 -7.258 1.00 0.00 H new ATOM 0 HG21 VAL A 82 8.534 -0.233 -4.877 1.00 0.00 H new ATOM 0 HG22 VAL A 82 7.969 1.321 -5.537 1.00 0.00 H new ATOM 0 HG23 VAL A 82 6.840 -0.046 -5.387 1.00 0.00 H new ATOM 1280 N GLY A 83 8.193 0.146 -10.293 1.00 0.00 N ATOM 1281 CA GLY A 83 8.325 -0.578 -11.593 1.00 0.00 C ATOM 1282 C GLY A 83 7.947 0.323 -12.776 1.00 0.00 C ATOM 1283 O GLY A 83 8.304 1.483 -12.829 1.00 0.00 O ATOM 0 H GLY A 83 8.754 0.993 -10.206 1.00 0.00 H new ATOM 0 HA2 GLY A 83 9.350 -0.929 -11.714 1.00 0.00 H new ATOM 0 HA3 GLY A 83 7.685 -1.460 -11.587 1.00 0.00 H new ATOM 1287 N ASP A 84 7.246 -0.222 -13.740 1.00 0.00 N ATOM 1288 CA ASP A 84 6.860 0.580 -14.942 1.00 0.00 C ATOM 1289 C ASP A 84 8.120 1.104 -15.641 1.00 0.00 C ATOM 1290 O ASP A 84 8.323 2.297 -15.763 1.00 0.00 O ATOM 1291 CB ASP A 84 6.010 1.737 -14.418 1.00 0.00 C ATOM 1292 CG ASP A 84 5.064 2.203 -15.527 1.00 0.00 C ATOM 1293 OD1 ASP A 84 5.498 2.242 -16.667 1.00 0.00 O ATOM 1294 OD2 ASP A 84 3.923 2.507 -15.220 1.00 0.00 O ATOM 0 H ASP A 84 6.924 -1.190 -13.746 1.00 0.00 H new ATOM 0 HA ASP A 84 6.308 -0.013 -15.671 1.00 0.00 H new ATOM 0 HB2 ASP A 84 5.439 1.420 -13.545 1.00 0.00 H new ATOM 0 HB3 ASP A 84 6.650 2.560 -14.099 1.00 0.00 H new ATOM 1299 N ARG A 85 8.972 0.217 -16.089 1.00 0.00 N ATOM 1300 CA ARG A 85 10.231 0.657 -16.770 1.00 0.00 C ATOM 1301 C ARG A 85 9.967 1.864 -17.671 1.00 0.00 C ATOM 1302 O ARG A 85 8.858 2.102 -18.107 1.00 0.00 O ATOM 1303 CB ARG A 85 10.685 -0.537 -17.612 1.00 0.00 C ATOM 1304 CG ARG A 85 11.016 -1.725 -16.702 1.00 0.00 C ATOM 1305 CD ARG A 85 12.260 -1.408 -15.868 1.00 0.00 C ATOM 1306 NE ARG A 85 12.644 -2.703 -15.240 1.00 0.00 N ATOM 1307 CZ ARG A 85 13.335 -3.583 -15.916 1.00 0.00 C ATOM 1308 NH1 ARG A 85 13.666 -3.349 -17.155 1.00 0.00 N ATOM 1309 NH2 ARG A 85 13.691 -4.702 -15.349 1.00 0.00 N ATOM 0 H ARG A 85 8.852 -0.793 -16.013 1.00 0.00 H new ATOM 0 HA ARG A 85 10.988 0.958 -16.046 1.00 0.00 H new ATOM 0 HB2 ARG A 85 9.901 -0.815 -18.316 1.00 0.00 H new ATOM 0 HB3 ARG A 85 11.561 -0.265 -18.201 1.00 0.00 H new ATOM 0 HG2 ARG A 85 10.172 -1.939 -16.046 1.00 0.00 H new ATOM 0 HG3 ARG A 85 11.187 -2.618 -17.303 1.00 0.00 H new ATOM 0 HD2 ARG A 85 13.064 -1.018 -16.492 1.00 0.00 H new ATOM 0 HD3 ARG A 85 12.047 -0.651 -15.113 1.00 0.00 H new ATOM 0 HE ARG A 85 12.367 -2.904 -14.279 1.00 0.00 H new ATOM 0 HH11 ARG A 85 13.386 -2.476 -17.602 1.00 0.00 H new ATOM 0 HH12 ARG A 85 14.205 -4.039 -17.678 1.00 0.00 H new ATOM 0 HH21 ARG A 85 13.430 -4.889 -14.381 1.00 0.00 H new ATOM 0 HH22 ARG A 85 14.230 -5.391 -15.874 1.00 0.00 H new ATOM 1323 N ASP A 86 10.985 2.630 -17.945 1.00 0.00 N ATOM 1324 CA ASP A 86 10.815 3.831 -18.811 1.00 0.00 C ATOM 1325 C ASP A 86 10.402 3.429 -20.232 1.00 0.00 C ATOM 1326 O ASP A 86 9.839 4.215 -20.967 1.00 0.00 O ATOM 1327 CB ASP A 86 12.187 4.499 -18.816 1.00 0.00 C ATOM 1328 CG ASP A 86 12.056 5.935 -19.329 1.00 0.00 C ATOM 1329 OD1 ASP A 86 11.507 6.110 -20.403 1.00 0.00 O ATOM 1330 OD2 ASP A 86 12.509 6.831 -18.638 1.00 0.00 O ATOM 0 H ASP A 86 11.934 2.475 -17.604 1.00 0.00 H new ATOM 0 HA ASP A 86 10.032 4.494 -18.444 1.00 0.00 H new ATOM 0 HB2 ASP A 86 12.607 4.498 -17.810 1.00 0.00 H new ATOM 0 HB3 ASP A 86 12.874 3.937 -19.449 1.00 0.00 H new ATOM 1335 N SER A 87 10.678 2.216 -20.625 1.00 0.00 N ATOM 1336 CA SER A 87 10.300 1.774 -22.000 1.00 0.00 C ATOM 1337 C SER A 87 8.876 2.225 -22.328 1.00 0.00 C ATOM 1338 O SER A 87 8.150 2.692 -21.474 1.00 0.00 O ATOM 1339 CB SER A 87 10.372 0.250 -21.950 1.00 0.00 C ATOM 1340 OG SER A 87 9.105 -0.266 -21.563 1.00 0.00 O ATOM 0 H SER A 87 11.148 1.512 -20.056 1.00 0.00 H new ATOM 0 HA SER A 87 10.952 2.195 -22.765 1.00 0.00 H new ATOM 0 HB2 SER A 87 10.656 -0.145 -22.926 1.00 0.00 H new ATOM 0 HB3 SER A 87 11.138 -0.067 -21.243 1.00 0.00 H new ATOM 0 HG SER A 87 9.146 -1.245 -21.531 1.00 0.00 H new ATOM 1346 N GLU A 88 8.462 2.088 -23.558 1.00 0.00 N ATOM 1347 CA GLU A 88 7.079 2.503 -23.919 1.00 0.00 C ATOM 1348 C GLU A 88 6.076 1.547 -23.266 1.00 0.00 C ATOM 1349 O GLU A 88 4.957 1.913 -22.968 1.00 0.00 O ATOM 1350 CB GLU A 88 7.011 2.398 -25.449 1.00 0.00 C ATOM 1351 CG GLU A 88 6.842 0.931 -25.857 1.00 0.00 C ATOM 1352 CD GLU A 88 7.348 0.736 -27.286 1.00 0.00 C ATOM 1353 OE1 GLU A 88 7.613 1.731 -27.942 1.00 0.00 O ATOM 1354 OE2 GLU A 88 7.467 -0.404 -27.701 1.00 0.00 O ATOM 0 H GLU A 88 9.019 1.709 -24.324 1.00 0.00 H new ATOM 0 HA GLU A 88 6.840 3.511 -23.579 1.00 0.00 H new ATOM 0 HB2 GLU A 88 6.177 2.989 -25.827 1.00 0.00 H new ATOM 0 HB3 GLU A 88 7.919 2.807 -25.892 1.00 0.00 H new ATOM 0 HG2 GLU A 88 7.395 0.287 -25.173 1.00 0.00 H new ATOM 0 HG3 GLU A 88 5.793 0.642 -25.789 1.00 0.00 H new ATOM 1361 N ASP A 89 6.479 0.319 -23.057 1.00 0.00 N ATOM 1362 CA ASP A 89 5.568 -0.690 -22.441 1.00 0.00 C ATOM 1363 C ASP A 89 4.140 -0.493 -22.949 1.00 0.00 C ATOM 1364 O ASP A 89 3.329 0.141 -22.308 1.00 0.00 O ATOM 1365 CB ASP A 89 5.646 -0.468 -20.928 1.00 0.00 C ATOM 1366 CG ASP A 89 5.404 1.005 -20.596 1.00 0.00 C ATOM 1367 OD1 ASP A 89 4.249 1.396 -20.536 1.00 0.00 O ATOM 1368 OD2 ASP A 89 6.374 1.712 -20.392 1.00 0.00 O ATOM 0 H ASP A 89 7.409 -0.029 -23.289 1.00 0.00 H new ATOM 0 HA ASP A 89 5.860 -1.707 -22.701 1.00 0.00 H new ATOM 0 HB2 ASP A 89 4.905 -1.088 -20.424 1.00 0.00 H new ATOM 0 HB3 ASP A 89 6.624 -0.776 -20.558 1.00 0.00 H new ATOM 1373 N PRO A 90 3.894 -1.053 -24.099 1.00 0.00 N ATOM 1374 CA PRO A 90 2.567 -0.961 -24.734 1.00 0.00 C ATOM 1375 C PRO A 90 1.662 -2.093 -24.239 1.00 0.00 C ATOM 1376 O PRO A 90 0.639 -1.865 -23.628 1.00 0.00 O ATOM 1377 CB PRO A 90 2.888 -1.119 -26.219 1.00 0.00 C ATOM 1378 CG PRO A 90 4.189 -1.873 -26.282 1.00 0.00 C ATOM 1379 CD PRO A 90 4.831 -1.822 -24.915 1.00 0.00 C ATOM 0 HA PRO A 90 2.036 -0.036 -24.511 1.00 0.00 H new ATOM 0 HB2 PRO A 90 2.096 -1.663 -26.734 1.00 0.00 H new ATOM 0 HB3 PRO A 90 2.976 -0.147 -26.705 1.00 0.00 H new ATOM 0 HG2 PRO A 90 4.015 -2.906 -26.582 1.00 0.00 H new ATOM 0 HG3 PRO A 90 4.849 -1.431 -27.029 1.00 0.00 H new ATOM 0 HD2 PRO A 90 4.982 -2.823 -24.510 1.00 0.00 H new ATOM 0 HD3 PRO A 90 5.809 -1.343 -24.954 1.00 0.00 H new ATOM 1387 N ASP A 91 2.038 -3.310 -24.501 1.00 0.00 N ATOM 1388 CA ASP A 91 1.210 -4.470 -24.057 1.00 0.00 C ATOM 1389 C ASP A 91 1.155 -4.557 -22.524 1.00 0.00 C ATOM 1390 O ASP A 91 0.410 -5.341 -21.971 1.00 0.00 O ATOM 1391 CB ASP A 91 1.914 -5.700 -24.627 1.00 0.00 C ATOM 1392 CG ASP A 91 1.926 -5.626 -26.156 1.00 0.00 C ATOM 1393 OD1 ASP A 91 0.957 -5.141 -26.716 1.00 0.00 O ATOM 1394 OD2 ASP A 91 2.906 -6.057 -26.743 1.00 0.00 O ATOM 0 H ASP A 91 2.889 -3.557 -25.007 1.00 0.00 H new ATOM 0 HA ASP A 91 0.180 -4.381 -24.401 1.00 0.00 H new ATOM 0 HB2 ASP A 91 2.935 -5.755 -24.248 1.00 0.00 H new ATOM 0 HB3 ASP A 91 1.404 -6.606 -24.301 1.00 0.00 H new ATOM 1399 N GLU A 92 1.939 -3.775 -21.829 1.00 0.00 N ATOM 1400 CA GLU A 92 1.913 -3.848 -20.337 1.00 0.00 C ATOM 1401 C GLU A 92 0.583 -3.317 -19.791 1.00 0.00 C ATOM 1402 O GLU A 92 0.146 -2.247 -20.161 1.00 0.00 O ATOM 1403 CB GLU A 92 3.066 -2.956 -19.868 1.00 0.00 C ATOM 1404 CG GLU A 92 4.400 -3.570 -20.295 1.00 0.00 C ATOM 1405 CD GLU A 92 5.433 -3.371 -19.183 1.00 0.00 C ATOM 1406 OE1 GLU A 92 5.165 -2.595 -18.282 1.00 0.00 O ATOM 1407 OE2 GLU A 92 6.474 -4.002 -19.254 1.00 0.00 O ATOM 0 H GLU A 92 2.590 -3.096 -22.224 1.00 0.00 H new ATOM 0 HA GLU A 92 2.015 -4.874 -19.984 1.00 0.00 H new ATOM 0 HB2 GLU A 92 2.962 -1.958 -20.293 1.00 0.00 H new ATOM 0 HB3 GLU A 92 3.036 -2.846 -18.784 1.00 0.00 H new ATOM 0 HG2 GLU A 92 4.274 -4.633 -20.503 1.00 0.00 H new ATOM 0 HG3 GLU A 92 4.748 -3.104 -21.217 1.00 0.00 H new ATOM 1414 N PRO A 93 -0.014 -4.085 -18.914 1.00 0.00 N ATOM 1415 CA PRO A 93 -1.301 -3.686 -18.294 1.00 0.00 C ATOM 1416 C PRO A 93 -1.064 -2.740 -17.115 1.00 0.00 C ATOM 1417 O PRO A 93 -1.852 -2.668 -16.193 1.00 0.00 O ATOM 1418 CB PRO A 93 -1.881 -5.006 -17.801 1.00 0.00 C ATOM 1419 CG PRO A 93 -0.699 -5.906 -17.586 1.00 0.00 C ATOM 1420 CD PRO A 93 0.446 -5.389 -18.428 1.00 0.00 C ATOM 0 HA PRO A 93 -1.957 -3.157 -18.985 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -2.442 -4.868 -16.877 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -2.570 -5.430 -18.532 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -0.420 -5.922 -16.533 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -0.945 -6.930 -17.866 1.00 0.00 H new ATOM 0 HD2 PRO A 93 1.359 -5.294 -17.840 1.00 0.00 H new ATOM 0 HD3 PRO A 93 0.668 -6.065 -19.254 1.00 0.00 H new ATOM 1428 N ALA A 94 0.016 -2.019 -17.134 1.00 0.00 N ATOM 1429 CA ALA A 94 0.311 -1.087 -16.018 1.00 0.00 C ATOM 1430 C ALA A 94 -0.093 0.341 -16.394 1.00 0.00 C ATOM 1431 O ALA A 94 0.533 1.297 -15.980 1.00 0.00 O ATOM 1432 CB ALA A 94 1.821 -1.188 -15.841 1.00 0.00 C ATOM 0 H ALA A 94 0.712 -2.035 -17.880 1.00 0.00 H new ATOM 0 HA ALA A 94 -0.235 -1.333 -15.107 1.00 0.00 H new ATOM 0 HB1 ALA A 94 2.137 -0.530 -15.032 1.00 0.00 H new ATOM 0 HB2 ALA A 94 2.091 -2.216 -15.599 1.00 0.00 H new ATOM 0 HB3 ALA A 94 2.316 -0.891 -16.765 1.00 0.00 H new ATOM 1438 N LYS A 95 -1.127 0.498 -17.179 1.00 0.00 N ATOM 1439 CA LYS A 95 -1.544 1.875 -17.574 1.00 0.00 C ATOM 1440 C LYS A 95 -1.878 2.699 -16.331 1.00 0.00 C ATOM 1441 O LYS A 95 -1.304 3.745 -16.097 1.00 0.00 O ATOM 1442 CB LYS A 95 -2.793 1.697 -18.442 1.00 0.00 C ATOM 1443 CG LYS A 95 -3.127 3.027 -19.118 1.00 0.00 C ATOM 1444 CD LYS A 95 -4.399 2.880 -19.955 1.00 0.00 C ATOM 1445 CE LYS A 95 -4.668 4.186 -20.709 1.00 0.00 C ATOM 1446 NZ LYS A 95 -4.155 3.953 -22.089 1.00 0.00 N ATOM 0 H LYS A 95 -1.695 -0.259 -17.560 1.00 0.00 H new ATOM 0 HA LYS A 95 -0.753 2.399 -18.110 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -2.622 0.926 -19.193 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -3.632 1.365 -17.830 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -3.264 3.803 -18.365 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -2.298 3.341 -19.752 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -4.290 2.056 -20.660 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -5.245 2.638 -19.311 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -5.732 4.423 -20.719 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -4.159 5.026 -20.236 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -4.306 4.806 -22.664 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -3.138 3.737 -22.050 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -4.663 3.153 -22.518 1.00 0.00 H new ATOM 1460 N GLU A 96 -2.798 2.238 -15.528 1.00 0.00 N ATOM 1461 CA GLU A 96 -3.156 3.008 -14.305 1.00 0.00 C ATOM 1462 C GLU A 96 -4.220 2.270 -13.483 1.00 0.00 C ATOM 1463 O GLU A 96 -5.140 2.872 -12.967 1.00 0.00 O ATOM 1464 CB GLU A 96 -3.711 4.328 -14.832 1.00 0.00 C ATOM 1465 CG GLU A 96 -4.925 4.048 -15.719 1.00 0.00 C ATOM 1466 CD GLU A 96 -5.231 5.282 -16.566 1.00 0.00 C ATOM 1467 OE1 GLU A 96 -4.733 6.345 -16.230 1.00 0.00 O ATOM 1468 OE2 GLU A 96 -5.956 5.145 -17.538 1.00 0.00 O ATOM 0 H GLU A 96 -3.313 1.368 -15.665 1.00 0.00 H new ATOM 0 HA GLU A 96 -2.300 3.148 -13.644 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -3.995 4.974 -14.001 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -2.945 4.857 -15.400 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -4.728 3.191 -16.363 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -5.788 3.793 -15.104 1.00 0.00 H new ATOM 1475 N GLN A 97 -4.095 0.979 -13.340 1.00 0.00 N ATOM 1476 CA GLN A 97 -5.092 0.222 -12.531 1.00 0.00 C ATOM 1477 C GLN A 97 -4.364 -0.714 -11.575 1.00 0.00 C ATOM 1478 O GLN A 97 -4.861 -1.761 -11.211 1.00 0.00 O ATOM 1479 CB GLN A 97 -5.918 -0.585 -13.533 1.00 0.00 C ATOM 1480 CG GLN A 97 -7.210 -1.044 -12.856 1.00 0.00 C ATOM 1481 CD GLN A 97 -7.984 -1.969 -13.797 1.00 0.00 C ATOM 1482 OE1 GLN A 97 -7.448 -2.441 -14.780 1.00 0.00 O ATOM 1483 NE2 GLN A 97 -9.233 -2.250 -13.534 1.00 0.00 N ATOM 0 H GLN A 97 -3.348 0.417 -13.747 1.00 0.00 H new ATOM 0 HA GLN A 97 -5.724 0.883 -11.937 1.00 0.00 H new ATOM 0 HB2 GLN A 97 -6.147 0.023 -14.409 1.00 0.00 H new ATOM 0 HB3 GLN A 97 -5.349 -1.447 -13.883 1.00 0.00 H new ATOM 0 HG2 GLN A 97 -6.980 -1.565 -11.926 1.00 0.00 H new ATOM 0 HG3 GLN A 97 -7.822 -0.181 -12.595 1.00 0.00 H new ATOM 0 HE21 GLN A 97 -9.682 -1.853 -12.709 1.00 0.00 H new ATOM 0 HE22 GLN A 97 -9.759 -2.866 -14.154 1.00 0.00 H new ATOM 1492 N LEU A 98 -3.190 -0.341 -11.160 1.00 0.00 N ATOM 1493 CA LEU A 98 -2.421 -1.199 -10.228 1.00 0.00 C ATOM 1494 C LEU A 98 -3.139 -1.261 -8.894 1.00 0.00 C ATOM 1495 O LEU A 98 -3.107 -2.257 -8.207 1.00 0.00 O ATOM 1496 CB LEU A 98 -1.069 -0.510 -10.085 1.00 0.00 C ATOM 1497 CG LEU A 98 -0.408 -0.427 -11.458 1.00 0.00 C ATOM 1498 CD1 LEU A 98 0.993 0.161 -11.311 1.00 0.00 C ATOM 1499 CD2 LEU A 98 -0.308 -1.829 -12.056 1.00 0.00 C ATOM 0 H LEU A 98 -2.728 0.528 -11.429 1.00 0.00 H new ATOM 0 HA LEU A 98 -2.312 -2.223 -10.585 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -1.197 0.489 -9.668 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -0.434 -1.065 -9.394 1.00 0.00 H new ATOM 0 HG LEU A 98 -1.004 0.209 -12.113 1.00 0.00 H new ATOM 0 HD11 LEU A 98 1.467 0.221 -12.291 1.00 0.00 H new ATOM 0 HD12 LEU A 98 0.925 1.159 -10.879 1.00 0.00 H new ATOM 0 HD13 LEU A 98 1.589 -0.477 -10.658 1.00 0.00 H new ATOM 0 HD21 LEU A 98 0.164 -1.773 -13.037 1.00 0.00 H new ATOM 0 HD22 LEU A 98 0.290 -2.462 -11.401 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -1.307 -2.253 -12.157 1.00 0.00 H new ATOM 1511 N TYR A 99 -3.790 -0.198 -8.527 1.00 0.00 N ATOM 1512 CA TYR A 99 -4.516 -0.183 -7.232 1.00 0.00 C ATOM 1513 C TYR A 99 -5.645 0.855 -7.283 1.00 0.00 C ATOM 1514 O TYR A 99 -6.358 0.950 -8.263 1.00 0.00 O ATOM 1515 CB TYR A 99 -3.444 0.196 -6.206 1.00 0.00 C ATOM 1516 CG TYR A 99 -3.798 -0.329 -4.832 1.00 0.00 C ATOM 1517 CD1 TYR A 99 -5.125 -0.630 -4.500 1.00 0.00 C ATOM 1518 CD2 TYR A 99 -2.785 -0.496 -3.875 1.00 0.00 C ATOM 1519 CE1 TYR A 99 -5.436 -1.098 -3.212 1.00 0.00 C ATOM 1520 CE2 TYR A 99 -3.099 -0.959 -2.591 1.00 0.00 C ATOM 1521 CZ TYR A 99 -4.424 -1.260 -2.260 1.00 0.00 C ATOM 1522 OH TYR A 99 -4.732 -1.713 -0.994 1.00 0.00 O ATOM 0 H TYR A 99 -3.851 0.664 -9.069 1.00 0.00 H new ATOM 0 HA TYR A 99 -4.988 -1.134 -6.987 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -2.480 -0.208 -6.516 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -3.339 1.280 -6.169 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -5.908 -0.503 -5.233 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -1.761 -0.267 -4.129 1.00 0.00 H new ATOM 0 HE1 TYR A 99 -6.459 -1.333 -2.957 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -2.317 -1.084 -1.856 1.00 0.00 H new ATOM 0 HH TYR A 99 -5.704 -1.710 -0.873 1.00 0.00 H new ATOM 1532 N HIS A 100 -5.815 1.636 -6.250 1.00 0.00 N ATOM 1533 CA HIS A 100 -6.901 2.661 -6.275 1.00 0.00 C ATOM 1534 C HIS A 100 -6.395 3.947 -6.939 1.00 0.00 C ATOM 1535 O HIS A 100 -5.268 4.021 -7.385 1.00 0.00 O ATOM 1536 CB HIS A 100 -7.291 2.906 -4.811 1.00 0.00 C ATOM 1537 CG HIS A 100 -6.084 3.221 -3.971 1.00 0.00 C ATOM 1538 ND1 HIS A 100 -5.708 4.532 -3.667 1.00 0.00 N ATOM 1539 CD2 HIS A 100 -5.176 2.413 -3.326 1.00 0.00 C ATOM 1540 CE1 HIS A 100 -4.619 4.471 -2.875 1.00 0.00 C ATOM 1541 NE2 HIS A 100 -4.281 3.215 -2.657 1.00 0.00 N ATOM 0 H HIS A 100 -5.256 1.611 -5.397 1.00 0.00 H new ATOM 0 HA HIS A 100 -7.763 2.326 -6.852 1.00 0.00 H new ATOM 0 HB2 HIS A 100 -8.002 3.731 -4.755 1.00 0.00 H new ATOM 0 HB3 HIS A 100 -7.794 2.024 -4.414 1.00 0.00 H new ATOM 0 HD2 HIS A 100 -5.168 1.333 -3.342 1.00 0.00 H new ATOM 0 HE1 HIS A 100 -4.098 5.328 -2.476 1.00 0.00 H new ATOM 0 HE2 HIS A 100 -3.495 2.895 -2.092 1.00 0.00 H new ATOM 1549 N SER A 101 -7.226 4.952 -7.032 1.00 0.00 N ATOM 1550 CA SER A 101 -6.797 6.221 -7.697 1.00 0.00 C ATOM 1551 C SER A 101 -5.998 7.120 -6.742 1.00 0.00 C ATOM 1552 O SER A 101 -5.820 8.298 -6.989 1.00 0.00 O ATOM 1553 CB SER A 101 -8.102 6.894 -8.121 1.00 0.00 C ATOM 1554 OG SER A 101 -7.835 7.824 -9.163 1.00 0.00 O ATOM 0 H SER A 101 -8.182 4.950 -6.677 1.00 0.00 H new ATOM 0 HA SER A 101 -6.133 6.032 -8.541 1.00 0.00 H new ATOM 0 HB2 SER A 101 -8.817 6.145 -8.461 1.00 0.00 H new ATOM 0 HB3 SER A 101 -8.555 7.404 -7.270 1.00 0.00 H new ATOM 0 HG SER A 101 -7.069 8.383 -8.914 1.00 0.00 H new ATOM 1560 N ALA A 102 -5.500 6.580 -5.667 1.00 0.00 N ATOM 1561 CA ALA A 102 -4.696 7.418 -4.726 1.00 0.00 C ATOM 1562 C ALA A 102 -3.290 6.823 -4.565 1.00 0.00 C ATOM 1563 O ALA A 102 -2.347 7.516 -4.243 1.00 0.00 O ATOM 1564 CB ALA A 102 -5.451 7.399 -3.399 1.00 0.00 C ATOM 0 H ALA A 102 -5.611 5.603 -5.397 1.00 0.00 H new ATOM 0 HA ALA A 102 -4.572 8.437 -5.091 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -4.911 7.997 -2.665 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -6.449 7.814 -3.542 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -5.533 6.373 -3.041 1.00 0.00 H new ATOM 1570 N GLU A 103 -3.141 5.544 -4.792 1.00 0.00 N ATOM 1571 CA GLU A 103 -1.800 4.909 -4.660 1.00 0.00 C ATOM 1572 C GLU A 103 -0.727 5.787 -5.311 1.00 0.00 C ATOM 1573 O GLU A 103 -0.980 6.476 -6.281 1.00 0.00 O ATOM 1574 CB GLU A 103 -1.921 3.591 -5.419 1.00 0.00 C ATOM 1575 CG GLU A 103 -2.169 3.889 -6.899 1.00 0.00 C ATOM 1576 CD GLU A 103 -1.999 2.609 -7.716 1.00 0.00 C ATOM 1577 OE1 GLU A 103 -1.525 1.632 -7.160 1.00 0.00 O ATOM 1578 OE2 GLU A 103 -2.346 2.628 -8.886 1.00 0.00 O ATOM 0 H GLU A 103 -3.894 4.912 -5.064 1.00 0.00 H new ATOM 0 HA GLU A 103 -1.512 4.769 -3.618 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -1.010 3.004 -5.301 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -2.739 2.996 -5.013 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -3.174 4.289 -7.036 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -1.472 4.651 -7.249 1.00 0.00 H new ATOM 1585 N LEU A 104 0.469 5.761 -4.791 1.00 0.00 N ATOM 1586 CA LEU A 104 1.558 6.590 -5.382 1.00 0.00 C ATOM 1587 C LEU A 104 2.495 5.715 -6.217 1.00 0.00 C ATOM 1588 O LEU A 104 2.498 4.506 -6.108 1.00 0.00 O ATOM 1589 CB LEU A 104 2.303 7.179 -4.185 1.00 0.00 C ATOM 1590 CG LEU A 104 1.838 8.616 -3.948 1.00 0.00 C ATOM 1591 CD1 LEU A 104 0.359 8.620 -3.555 1.00 0.00 C ATOM 1592 CD2 LEU A 104 2.666 9.239 -2.821 1.00 0.00 C ATOM 0 H LEU A 104 0.740 5.202 -3.982 1.00 0.00 H new ATOM 0 HA LEU A 104 1.172 7.365 -6.044 1.00 0.00 H new ATOM 0 HB2 LEU A 104 2.119 6.575 -3.296 1.00 0.00 H new ATOM 0 HB3 LEU A 104 3.378 7.159 -4.367 1.00 0.00 H new ATOM 0 HG LEU A 104 1.971 9.195 -4.862 1.00 0.00 H new ATOM 0 HD11 LEU A 104 0.030 9.645 -3.387 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -0.232 8.176 -4.357 1.00 0.00 H new ATOM 0 HD13 LEU A 104 0.224 8.041 -2.641 1.00 0.00 H new ATOM 0 HD21 LEU A 104 2.336 10.264 -2.651 1.00 0.00 H new ATOM 0 HD22 LEU A 104 2.533 8.658 -1.908 1.00 0.00 H new ATOM 0 HD23 LEU A 104 3.719 9.239 -3.101 1.00 0.00 H new ATOM 1604 N HIS A 105 3.293 6.321 -7.052 1.00 0.00 N ATOM 1605 CA HIS A 105 4.233 5.530 -7.896 1.00 0.00 C ATOM 1606 C HIS A 105 5.680 5.894 -7.560 1.00 0.00 C ATOM 1607 O HIS A 105 5.980 7.016 -7.207 1.00 0.00 O ATOM 1608 CB HIS A 105 3.910 5.935 -9.332 1.00 0.00 C ATOM 1609 CG HIS A 105 2.479 5.596 -9.648 1.00 0.00 C ATOM 1610 ND1 HIS A 105 1.768 6.252 -10.643 1.00 0.00 N ATOM 1611 CD2 HIS A 105 1.615 4.671 -9.118 1.00 0.00 C ATOM 1612 CE1 HIS A 105 0.535 5.717 -10.680 1.00 0.00 C ATOM 1613 NE2 HIS A 105 0.388 4.748 -9.771 1.00 0.00 N ATOM 0 H HIS A 105 3.335 7.331 -7.187 1.00 0.00 H new ATOM 0 HA HIS A 105 4.125 4.457 -7.735 1.00 0.00 H new ATOM 0 HB2 HIS A 105 4.078 7.004 -9.464 1.00 0.00 H new ATOM 0 HB3 HIS A 105 4.577 5.420 -10.023 1.00 0.00 H new ATOM 0 HD2 HIS A 105 1.851 3.987 -8.316 1.00 0.00 H new ATOM 0 HE1 HIS A 105 -0.242 6.032 -11.361 1.00 0.00 H new ATOM 0 HE2 HIS A 105 -0.444 4.186 -9.594 1.00 0.00 H new ATOM 1621 N LEU A 106 6.581 4.958 -7.673 1.00 0.00 N ATOM 1622 CA LEU A 106 8.008 5.263 -7.364 1.00 0.00 C ATOM 1623 C LEU A 106 8.932 4.629 -8.404 1.00 0.00 C ATOM 1624 O LEU A 106 8.581 3.673 -9.065 1.00 0.00 O ATOM 1625 CB LEU A 106 8.262 4.648 -5.992 1.00 0.00 C ATOM 1626 CG LEU A 106 9.720 4.882 -5.601 1.00 0.00 C ATOM 1627 CD1 LEU A 106 9.994 6.385 -5.523 1.00 0.00 C ATOM 1628 CD2 LEU A 106 9.993 4.245 -4.238 1.00 0.00 C ATOM 0 H LEU A 106 6.393 3.999 -7.965 1.00 0.00 H new ATOM 0 HA LEU A 106 8.203 6.335 -7.377 1.00 0.00 H new ATOM 0 HB2 LEU A 106 7.598 5.094 -5.251 1.00 0.00 H new ATOM 0 HB3 LEU A 106 8.045 3.580 -6.013 1.00 0.00 H new ATOM 0 HG LEU A 106 10.371 4.432 -6.350 1.00 0.00 H new ATOM 0 HD11 LEU A 106 11.034 6.551 -5.244 1.00 0.00 H new ATOM 0 HD12 LEU A 106 9.802 6.841 -6.494 1.00 0.00 H new ATOM 0 HD13 LEU A 106 9.341 6.835 -4.775 1.00 0.00 H new ATOM 0 HD21 LEU A 106 11.034 4.413 -3.960 1.00 0.00 H new ATOM 0 HD22 LEU A 106 9.341 4.694 -3.489 1.00 0.00 H new ATOM 0 HD23 LEU A 106 9.800 3.174 -4.292 1.00 0.00 H new ATOM 1640 N GLY A 107 10.117 5.153 -8.548 1.00 0.00 N ATOM 1641 CA GLY A 107 11.066 4.577 -9.538 1.00 0.00 C ATOM 1642 C GLY A 107 11.805 3.398 -8.903 1.00 0.00 C ATOM 1643 O GLY A 107 12.192 3.438 -7.751 1.00 0.00 O ATOM 0 H GLY A 107 10.468 5.954 -8.023 1.00 0.00 H new ATOM 0 HA2 GLY A 107 10.527 4.247 -10.426 1.00 0.00 H new ATOM 0 HA3 GLY A 107 11.778 5.336 -9.861 1.00 0.00 H new ATOM 1647 N ILE A 108 12.003 2.350 -9.651 1.00 0.00 N ATOM 1648 CA ILE A 108 12.708 1.163 -9.121 1.00 0.00 C ATOM 1649 C ILE A 108 14.075 1.557 -8.563 1.00 0.00 C ATOM 1650 O ILE A 108 14.461 1.147 -7.486 1.00 0.00 O ATOM 1651 CB ILE A 108 12.853 0.285 -10.356 1.00 0.00 C ATOM 1652 CG1 ILE A 108 11.459 -0.130 -10.845 1.00 0.00 C ATOM 1653 CG2 ILE A 108 13.669 -0.943 -10.014 1.00 0.00 C ATOM 1654 CD1 ILE A 108 10.939 -1.293 -9.999 1.00 0.00 C ATOM 0 H ILE A 108 11.700 2.269 -10.621 1.00 0.00 H new ATOM 0 HA ILE A 108 12.185 0.670 -8.301 1.00 0.00 H new ATOM 0 HB ILE A 108 13.363 0.839 -11.144 1.00 0.00 H new ATOM 0 HG12 ILE A 108 10.774 0.715 -10.779 1.00 0.00 H new ATOM 0 HG13 ILE A 108 11.504 -0.423 -11.894 1.00 0.00 H new ATOM 0 HG21 ILE A 108 13.771 -1.570 -10.900 1.00 0.00 H new ATOM 0 HG22 ILE A 108 14.657 -0.639 -9.669 1.00 0.00 H new ATOM 0 HG23 ILE A 108 13.167 -1.506 -9.227 1.00 0.00 H new ATOM 0 HD11 ILE A 108 9.949 -1.584 -10.350 1.00 0.00 H new ATOM 0 HD12 ILE A 108 11.619 -2.140 -10.088 1.00 0.00 H new ATOM 0 HD13 ILE A 108 10.878 -0.985 -8.955 1.00 0.00 H new ATOM 1666 N HIS A 109 14.806 2.358 -9.282 1.00 0.00 N ATOM 1667 CA HIS A 109 16.144 2.788 -8.786 1.00 0.00 C ATOM 1668 C HIS A 109 15.987 3.986 -7.849 1.00 0.00 C ATOM 1669 O HIS A 109 16.953 4.523 -7.339 1.00 0.00 O ATOM 1670 CB HIS A 109 16.936 3.171 -10.039 1.00 0.00 C ATOM 1671 CG HIS A 109 16.426 4.477 -10.593 1.00 0.00 C ATOM 1672 ND1 HIS A 109 17.074 5.681 -10.361 1.00 0.00 N ATOM 1673 CD2 HIS A 109 15.341 4.782 -11.378 1.00 0.00 C ATOM 1674 CE1 HIS A 109 16.378 6.644 -10.996 1.00 0.00 C ATOM 1675 NE2 HIS A 109 15.314 6.150 -11.631 1.00 0.00 N ATOM 0 H HIS A 109 14.537 2.734 -10.191 1.00 0.00 H new ATOM 0 HA HIS A 109 16.651 2.006 -8.221 1.00 0.00 H new ATOM 0 HB2 HIS A 109 17.995 3.258 -9.797 1.00 0.00 H new ATOM 0 HB3 HIS A 109 16.844 2.387 -10.791 1.00 0.00 H new ATOM 0 HD2 HIS A 109 14.618 4.068 -11.744 1.00 0.00 H new ATOM 0 HE1 HIS A 109 16.649 7.689 -10.991 1.00 0.00 H new ATOM 0 HE2 HIS A 109 14.628 6.665 -12.183 1.00 0.00 H new ATOM 1683 N GLN A 110 14.773 4.402 -7.610 1.00 0.00 N ATOM 1684 CA GLN A 110 14.545 5.556 -6.699 1.00 0.00 C ATOM 1685 C GLN A 110 14.065 5.054 -5.333 1.00 0.00 C ATOM 1686 O GLN A 110 13.373 5.750 -4.617 1.00 0.00 O ATOM 1687 CB GLN A 110 13.460 6.396 -7.380 1.00 0.00 C ATOM 1688 CG GLN A 110 13.986 6.940 -8.713 1.00 0.00 C ATOM 1689 CD GLN A 110 12.840 7.597 -9.489 1.00 0.00 C ATOM 1690 OE1 GLN A 110 12.652 7.327 -10.657 1.00 0.00 O ATOM 1691 NE2 GLN A 110 12.065 8.456 -8.885 1.00 0.00 N ATOM 0 H GLN A 110 13.929 3.991 -8.008 1.00 0.00 H new ATOM 0 HA GLN A 110 15.452 6.136 -6.526 1.00 0.00 H new ATOM 0 HB2 GLN A 110 12.570 5.789 -7.550 1.00 0.00 H new ATOM 0 HB3 GLN A 110 13.165 7.221 -6.731 1.00 0.00 H new ATOM 0 HG2 GLN A 110 14.780 7.665 -8.533 1.00 0.00 H new ATOM 0 HG3 GLN A 110 14.420 6.132 -9.301 1.00 0.00 H new ATOM 0 HE21 GLN A 110 12.223 8.683 -7.903 1.00 0.00 H new ATOM 0 HE22 GLN A 110 11.301 8.900 -9.395 1.00 0.00 H new ATOM 1700 N LEU A 111 14.419 3.852 -4.962 1.00 0.00 N ATOM 1701 CA LEU A 111 13.963 3.335 -3.639 1.00 0.00 C ATOM 1702 C LEU A 111 14.597 4.156 -2.525 1.00 0.00 C ATOM 1703 O LEU A 111 15.710 3.920 -2.102 1.00 0.00 O ATOM 1704 CB LEU A 111 14.424 1.871 -3.588 1.00 0.00 C ATOM 1705 CG LEU A 111 13.436 0.935 -4.320 1.00 0.00 C ATOM 1706 CD1 LEU A 111 12.745 0.028 -3.300 1.00 0.00 C ATOM 1707 CD2 LEU A 111 12.369 1.729 -5.089 1.00 0.00 C ATOM 0 H LEU A 111 14.996 3.213 -5.509 1.00 0.00 H new ATOM 0 HA LEU A 111 12.883 3.406 -3.510 1.00 0.00 H new ATOM 0 HB2 LEU A 111 15.411 1.784 -4.042 1.00 0.00 H new ATOM 0 HB3 LEU A 111 14.522 1.556 -2.549 1.00 0.00 H new ATOM 0 HG LEU A 111 14.004 0.342 -5.037 1.00 0.00 H new ATOM 0 HD11 LEU A 111 12.048 -0.633 -3.815 1.00 0.00 H new ATOM 0 HD12 LEU A 111 13.493 -0.569 -2.778 1.00 0.00 H new ATOM 0 HD13 LEU A 111 12.201 0.639 -2.579 1.00 0.00 H new ATOM 0 HD21 LEU A 111 11.692 1.037 -5.591 1.00 0.00 H new ATOM 0 HD22 LEU A 111 11.804 2.348 -4.392 1.00 0.00 H new ATOM 0 HD23 LEU A 111 12.853 2.365 -5.830 1.00 0.00 H new ATOM 1719 N GLU A 112 13.869 5.127 -2.064 1.00 0.00 N ATOM 1720 CA GLU A 112 14.365 6.020 -0.982 1.00 0.00 C ATOM 1721 C GLU A 112 13.315 7.101 -0.706 1.00 0.00 C ATOM 1722 O GLU A 112 13.250 7.655 0.373 1.00 0.00 O ATOM 1723 CB GLU A 112 15.641 6.653 -1.537 1.00 0.00 C ATOM 1724 CG GLU A 112 15.263 7.643 -2.637 1.00 0.00 C ATOM 1725 CD GLU A 112 16.524 8.115 -3.367 1.00 0.00 C ATOM 1726 OE1 GLU A 112 17.598 7.668 -3.002 1.00 0.00 O ATOM 1727 OE2 GLU A 112 16.394 8.916 -4.279 1.00 0.00 O ATOM 0 H GLU A 112 12.930 5.346 -2.397 1.00 0.00 H new ATOM 0 HA GLU A 112 14.553 5.488 -0.050 1.00 0.00 H new ATOM 0 HB2 GLU A 112 16.186 7.162 -0.742 1.00 0.00 H new ATOM 0 HB3 GLU A 112 16.302 5.883 -1.934 1.00 0.00 H new ATOM 0 HG2 GLU A 112 14.578 7.173 -3.342 1.00 0.00 H new ATOM 0 HG3 GLU A 112 14.740 8.497 -2.206 1.00 0.00 H new ATOM 1734 N GLN A 113 12.491 7.403 -1.683 1.00 0.00 N ATOM 1735 CA GLN A 113 11.432 8.445 -1.486 1.00 0.00 C ATOM 1736 C GLN A 113 10.220 7.830 -0.786 1.00 0.00 C ATOM 1737 O GLN A 113 9.239 8.490 -0.521 1.00 0.00 O ATOM 1738 CB GLN A 113 11.043 8.889 -2.896 1.00 0.00 C ATOM 1739 CG GLN A 113 12.144 9.762 -3.498 1.00 0.00 C ATOM 1740 CD GLN A 113 11.895 9.915 -5.000 1.00 0.00 C ATOM 1741 OE1 GLN A 113 10.763 9.960 -5.441 1.00 0.00 O ATOM 1742 NE2 GLN A 113 12.914 9.994 -5.808 1.00 0.00 N ATOM 0 H GLN A 113 12.506 6.973 -2.608 1.00 0.00 H new ATOM 0 HA GLN A 113 11.782 9.275 -0.873 1.00 0.00 H new ATOM 0 HB2 GLN A 113 10.876 8.016 -3.527 1.00 0.00 H new ATOM 0 HB3 GLN A 113 10.105 9.444 -2.865 1.00 0.00 H new ATOM 0 HG2 GLN A 113 12.154 10.740 -3.017 1.00 0.00 H new ATOM 0 HG3 GLN A 113 13.120 9.310 -3.323 1.00 0.00 H new ATOM 0 HE21 GLN A 113 13.863 9.956 -5.437 1.00 0.00 H new ATOM 0 HE22 GLN A 113 12.762 10.094 -6.812 1.00 0.00 H new ATOM 1751 N LEU A 114 10.282 6.561 -0.499 1.00 0.00 N ATOM 1752 CA LEU A 114 9.143 5.875 0.165 1.00 0.00 C ATOM 1753 C LEU A 114 8.663 6.605 1.429 1.00 0.00 C ATOM 1754 O LEU A 114 7.476 6.708 1.642 1.00 0.00 O ATOM 1755 CB LEU A 114 9.687 4.496 0.511 1.00 0.00 C ATOM 1756 CG LEU A 114 9.710 3.630 -0.750 1.00 0.00 C ATOM 1757 CD1 LEU A 114 11.147 3.215 -1.062 1.00 0.00 C ATOM 1758 CD2 LEU A 114 8.864 2.381 -0.517 1.00 0.00 C ATOM 0 H LEU A 114 11.084 5.963 -0.699 1.00 0.00 H new ATOM 0 HA LEU A 114 8.269 5.842 -0.485 1.00 0.00 H new ATOM 0 HB2 LEU A 114 10.692 4.582 0.925 1.00 0.00 H new ATOM 0 HB3 LEU A 114 9.066 4.029 1.275 1.00 0.00 H new ATOM 0 HG LEU A 114 9.307 4.198 -1.588 1.00 0.00 H new ATOM 0 HD11 LEU A 114 11.161 2.598 -1.961 1.00 0.00 H new ATOM 0 HD12 LEU A 114 11.756 4.105 -1.223 1.00 0.00 H new ATOM 0 HD13 LEU A 114 11.551 2.646 -0.225 1.00 0.00 H new ATOM 0 HD21 LEU A 114 8.877 1.760 -1.413 1.00 0.00 H new ATOM 0 HD22 LEU A 114 9.272 1.817 0.322 1.00 0.00 H new ATOM 0 HD23 LEU A 114 7.838 2.673 -0.293 1.00 0.00 H new ATOM 1770 N PRO A 115 9.574 7.074 2.245 1.00 0.00 N ATOM 1771 CA PRO A 115 9.156 7.770 3.486 1.00 0.00 C ATOM 1772 C PRO A 115 8.483 9.082 3.117 1.00 0.00 C ATOM 1773 O PRO A 115 7.339 9.318 3.447 1.00 0.00 O ATOM 1774 CB PRO A 115 10.464 7.982 4.245 1.00 0.00 C ATOM 1775 CG PRO A 115 11.520 7.960 3.191 1.00 0.00 C ATOM 1776 CD PRO A 115 11.035 7.026 2.112 1.00 0.00 C ATOM 0 HA PRO A 115 8.435 7.218 4.090 1.00 0.00 H new ATOM 0 HB2 PRO A 115 10.461 8.930 4.783 1.00 0.00 H new ATOM 0 HB3 PRO A 115 10.625 7.197 4.984 1.00 0.00 H new ATOM 0 HG2 PRO A 115 11.688 8.960 2.791 1.00 0.00 H new ATOM 0 HG3 PRO A 115 12.470 7.617 3.602 1.00 0.00 H new ATOM 0 HD2 PRO A 115 11.359 7.353 1.124 1.00 0.00 H new ATOM 0 HD3 PRO A 115 11.418 6.015 2.255 1.00 0.00 H new ATOM 1784 N TYR A 116 9.161 9.922 2.391 1.00 0.00 N ATOM 1785 CA TYR A 116 8.522 11.189 1.970 1.00 0.00 C ATOM 1786 C TYR A 116 7.287 10.824 1.137 1.00 0.00 C ATOM 1787 O TYR A 116 6.240 11.431 1.253 1.00 0.00 O ATOM 1788 CB TYR A 116 9.603 11.933 1.162 1.00 0.00 C ATOM 1789 CG TYR A 116 9.169 12.127 -0.268 1.00 0.00 C ATOM 1790 CD1 TYR A 116 8.042 12.903 -0.554 1.00 0.00 C ATOM 1791 CD2 TYR A 116 9.886 11.521 -1.302 1.00 0.00 C ATOM 1792 CE1 TYR A 116 7.632 13.078 -1.879 1.00 0.00 C ATOM 1793 CE2 TYR A 116 9.478 11.693 -2.630 1.00 0.00 C ATOM 1794 CZ TYR A 116 8.349 12.470 -2.918 1.00 0.00 C ATOM 1795 OH TYR A 116 7.944 12.639 -4.226 1.00 0.00 O ATOM 0 H TYR A 116 10.121 9.786 2.075 1.00 0.00 H new ATOM 0 HA TYR A 116 8.180 11.826 2.786 1.00 0.00 H new ATOM 0 HB2 TYR A 116 9.802 12.902 1.620 1.00 0.00 H new ATOM 0 HB3 TYR A 116 10.536 11.369 1.190 1.00 0.00 H new ATOM 0 HD1 TYR A 116 7.488 13.367 0.249 1.00 0.00 H new ATOM 0 HD2 TYR A 116 10.755 10.920 -1.077 1.00 0.00 H new ATOM 0 HE1 TYR A 116 6.764 13.681 -2.101 1.00 0.00 H new ATOM 0 HE2 TYR A 116 10.033 11.227 -3.431 1.00 0.00 H new ATOM 0 HH TYR A 116 8.551 12.152 -4.822 1.00 0.00 H new ATOM 1805 N GLN A 117 7.401 9.807 0.325 1.00 0.00 N ATOM 1806 CA GLN A 117 6.233 9.362 -0.487 1.00 0.00 C ATOM 1807 C GLN A 117 5.160 8.832 0.458 1.00 0.00 C ATOM 1808 O GLN A 117 3.981 9.053 0.270 1.00 0.00 O ATOM 1809 CB GLN A 117 6.767 8.246 -1.387 1.00 0.00 C ATOM 1810 CG GLN A 117 7.598 8.856 -2.520 1.00 0.00 C ATOM 1811 CD GLN A 117 6.740 8.963 -3.783 1.00 0.00 C ATOM 1812 OE1 GLN A 117 6.429 7.968 -4.403 1.00 0.00 O ATOM 1813 NE2 GLN A 117 6.342 10.137 -4.190 1.00 0.00 N ATOM 0 H GLN A 117 8.254 9.265 0.189 1.00 0.00 H new ATOM 0 HA GLN A 117 5.792 10.163 -1.080 1.00 0.00 H new ATOM 0 HB2 GLN A 117 7.378 7.556 -0.805 1.00 0.00 H new ATOM 0 HB3 GLN A 117 5.939 7.669 -1.799 1.00 0.00 H new ATOM 0 HG2 GLN A 117 7.960 9.842 -2.229 1.00 0.00 H new ATOM 0 HG3 GLN A 117 8.475 8.239 -2.715 1.00 0.00 H new ATOM 0 HE21 GLN A 117 6.604 10.973 -3.668 1.00 0.00 H new ATOM 0 HE22 GLN A 117 5.769 10.218 -5.030 1.00 0.00 H new ATOM 1822 N VAL A 118 5.574 8.149 1.490 1.00 0.00 N ATOM 1823 CA VAL A 118 4.596 7.616 2.478 1.00 0.00 C ATOM 1824 C VAL A 118 3.803 8.782 3.072 1.00 0.00 C ATOM 1825 O VAL A 118 2.591 8.746 3.152 1.00 0.00 O ATOM 1826 CB VAL A 118 5.458 6.919 3.545 1.00 0.00 C ATOM 1827 CG1 VAL A 118 4.790 6.995 4.926 1.00 0.00 C ATOM 1828 CG2 VAL A 118 5.631 5.446 3.165 1.00 0.00 C ATOM 0 H VAL A 118 6.551 7.937 1.691 1.00 0.00 H new ATOM 0 HA VAL A 118 3.872 6.925 2.045 1.00 0.00 H new ATOM 0 HB VAL A 118 6.424 7.422 3.592 1.00 0.00 H new ATOM 0 HG11 VAL A 118 5.419 6.495 5.662 1.00 0.00 H new ATOM 0 HG12 VAL A 118 4.659 8.039 5.210 1.00 0.00 H new ATOM 0 HG13 VAL A 118 3.817 6.505 4.887 1.00 0.00 H new ATOM 0 HG21 VAL A 118 6.241 4.945 3.917 1.00 0.00 H new ATOM 0 HG22 VAL A 118 4.654 4.966 3.113 1.00 0.00 H new ATOM 0 HG23 VAL A 118 6.122 5.376 2.194 1.00 0.00 H new ATOM 1838 N ASP A 119 4.482 9.821 3.468 1.00 0.00 N ATOM 1839 CA ASP A 119 3.772 10.998 4.037 1.00 0.00 C ATOM 1840 C ASP A 119 2.877 11.606 2.955 1.00 0.00 C ATOM 1841 O ASP A 119 1.722 11.905 3.181 1.00 0.00 O ATOM 1842 CB ASP A 119 4.883 11.969 4.444 1.00 0.00 C ATOM 1843 CG ASP A 119 5.602 11.435 5.687 1.00 0.00 C ATOM 1844 OD1 ASP A 119 5.091 10.502 6.287 1.00 0.00 O ATOM 1845 OD2 ASP A 119 6.648 11.968 6.019 1.00 0.00 O ATOM 0 H ASP A 119 5.497 9.906 3.422 1.00 0.00 H new ATOM 0 HA ASP A 119 3.135 10.750 4.886 1.00 0.00 H new ATOM 0 HB2 ASP A 119 5.592 12.090 3.625 1.00 0.00 H new ATOM 0 HB3 ASP A 119 4.462 12.953 4.649 1.00 0.00 H new ATOM 1850 N ALA A 120 3.398 11.765 1.767 1.00 0.00 N ATOM 1851 CA ALA A 120 2.571 12.322 0.668 1.00 0.00 C ATOM 1852 C ALA A 120 1.456 11.331 0.334 1.00 0.00 C ATOM 1853 O ALA A 120 0.325 11.706 0.100 1.00 0.00 O ATOM 1854 CB ALA A 120 3.520 12.479 -0.521 1.00 0.00 C ATOM 0 H ALA A 120 4.359 11.533 1.515 1.00 0.00 H new ATOM 0 HA ALA A 120 2.108 13.273 0.932 1.00 0.00 H new ATOM 0 HB1 ALA A 120 2.974 12.887 -1.371 1.00 0.00 H new ATOM 0 HB2 ALA A 120 4.331 13.156 -0.252 1.00 0.00 H new ATOM 0 HB3 ALA A 120 3.933 11.506 -0.788 1.00 0.00 H new ATOM 1860 N ALA A 121 1.774 10.063 0.321 1.00 0.00 N ATOM 1861 CA ALA A 121 0.741 9.035 0.015 1.00 0.00 C ATOM 1862 C ALA A 121 -0.379 9.100 1.055 1.00 0.00 C ATOM 1863 O ALA A 121 -1.548 9.067 0.727 1.00 0.00 O ATOM 1864 CB ALA A 121 1.481 7.696 0.101 1.00 0.00 C ATOM 0 H ALA A 121 2.707 9.696 0.510 1.00 0.00 H new ATOM 0 HA ALA A 121 0.280 9.181 -0.962 1.00 0.00 H new ATOM 0 HB1 ALA A 121 0.787 6.883 -0.112 1.00 0.00 H new ATOM 0 HB2 ALA A 121 2.292 7.681 -0.627 1.00 0.00 H new ATOM 0 HB3 ALA A 121 1.890 7.570 1.103 1.00 0.00 H new ATOM 1870 N LEU A 122 -0.026 9.194 2.309 1.00 0.00 N ATOM 1871 CA LEU A 122 -1.065 9.263 3.374 1.00 0.00 C ATOM 1872 C LEU A 122 -2.011 10.433 3.097 1.00 0.00 C ATOM 1873 O LEU A 122 -3.217 10.280 3.095 1.00 0.00 O ATOM 1874 CB LEU A 122 -0.283 9.482 4.674 1.00 0.00 C ATOM 1875 CG LEU A 122 0.578 8.251 4.958 1.00 0.00 C ATOM 1876 CD1 LEU A 122 1.789 8.648 5.804 1.00 0.00 C ATOM 1877 CD2 LEU A 122 -0.257 7.222 5.721 1.00 0.00 C ATOM 0 H LEU A 122 0.938 9.226 2.641 1.00 0.00 H new ATOM 0 HA LEU A 122 -1.680 8.364 3.424 1.00 0.00 H new ATOM 0 HB2 LEU A 122 0.346 10.368 4.589 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -0.971 9.658 5.501 1.00 0.00 H new ATOM 0 HG LEU A 122 0.923 7.825 4.016 1.00 0.00 H new ATOM 0 HD11 LEU A 122 2.399 7.767 6.003 1.00 0.00 H new ATOM 0 HD12 LEU A 122 2.383 9.386 5.265 1.00 0.00 H new ATOM 0 HD13 LEU A 122 1.449 9.075 6.748 1.00 0.00 H new ATOM 0 HD21 LEU A 122 0.351 6.341 5.927 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -0.598 7.655 6.661 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -1.120 6.935 5.119 1.00 0.00 H new ATOM 1889 N ALA A 123 -1.476 11.593 2.839 1.00 0.00 N ATOM 1890 CA ALA A 123 -2.354 12.760 2.538 1.00 0.00 C ATOM 1891 C ALA A 123 -3.072 12.513 1.217 1.00 0.00 C ATOM 1892 O ALA A 123 -4.272 12.669 1.106 1.00 0.00 O ATOM 1893 CB ALA A 123 -1.409 13.954 2.416 1.00 0.00 C ATOM 0 H ALA A 123 -0.474 11.784 2.823 1.00 0.00 H new ATOM 0 HA ALA A 123 -3.111 12.928 3.304 1.00 0.00 H new ATOM 0 HB1 ALA A 123 -1.985 14.853 2.194 1.00 0.00 H new ATOM 0 HB2 ALA A 123 -0.871 14.090 3.354 1.00 0.00 H new ATOM 0 HB3 ALA A 123 -0.696 13.773 1.612 1.00 0.00 H new ATOM 1899 N GLU A 124 -2.340 12.128 0.210 1.00 0.00 N ATOM 1900 CA GLU A 124 -2.973 11.858 -1.105 1.00 0.00 C ATOM 1901 C GLU A 124 -4.014 10.751 -0.969 1.00 0.00 C ATOM 1902 O GLU A 124 -5.041 10.767 -1.617 1.00 0.00 O ATOM 1903 CB GLU A 124 -1.824 11.416 -2.009 1.00 0.00 C ATOM 1904 CG GLU A 124 -2.337 11.244 -3.441 1.00 0.00 C ATOM 1905 CD GLU A 124 -1.264 11.714 -4.425 1.00 0.00 C ATOM 1906 OE1 GLU A 124 -0.793 12.829 -4.270 1.00 0.00 O ATOM 1907 OE2 GLU A 124 -0.927 10.950 -5.313 1.00 0.00 O ATOM 0 H GLU A 124 -1.330 11.989 0.243 1.00 0.00 H new ATOM 0 HA GLU A 124 -3.492 12.729 -1.506 1.00 0.00 H new ATOM 0 HB2 GLU A 124 -1.023 12.155 -1.985 1.00 0.00 H new ATOM 0 HB3 GLU A 124 -1.403 10.478 -1.647 1.00 0.00 H new ATOM 0 HG2 GLU A 124 -2.584 10.199 -3.627 1.00 0.00 H new ATOM 0 HG3 GLU A 124 -3.253 11.818 -3.583 1.00 0.00 H new ATOM 1914 N PHE A 125 -3.758 9.783 -0.132 1.00 0.00 N ATOM 1915 CA PHE A 125 -4.737 8.677 0.040 1.00 0.00 C ATOM 1916 C PHE A 125 -5.913 9.139 0.906 1.00 0.00 C ATOM 1917 O PHE A 125 -7.063 8.887 0.597 1.00 0.00 O ATOM 1918 CB PHE A 125 -3.953 7.571 0.743 1.00 0.00 C ATOM 1919 CG PHE A 125 -4.903 6.480 1.179 1.00 0.00 C ATOM 1920 CD1 PHE A 125 -5.298 5.497 0.265 1.00 0.00 C ATOM 1921 CD2 PHE A 125 -5.394 6.459 2.489 1.00 0.00 C ATOM 1922 CE1 PHE A 125 -6.182 4.489 0.661 1.00 0.00 C ATOM 1923 CE2 PHE A 125 -6.280 5.452 2.885 1.00 0.00 C ATOM 1924 CZ PHE A 125 -6.675 4.467 1.971 1.00 0.00 C ATOM 0 H PHE A 125 -2.915 9.712 0.438 1.00 0.00 H new ATOM 0 HA PHE A 125 -5.158 8.342 -0.908 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -3.197 7.163 0.072 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -3.427 7.976 1.607 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -4.920 5.517 -0.746 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -5.089 7.219 3.193 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -6.484 3.728 -0.043 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -6.660 5.434 3.896 1.00 0.00 H new ATOM 0 HZ PHE A 125 -7.360 3.690 2.277 1.00 0.00 H new ATOM 1934 N LEU A 126 -5.631 9.806 1.996 1.00 0.00 N ATOM 1935 CA LEU A 126 -6.724 10.274 2.894 1.00 0.00 C ATOM 1936 C LEU A 126 -7.609 11.308 2.197 1.00 0.00 C ATOM 1937 O LEU A 126 -8.817 11.207 2.208 1.00 0.00 O ATOM 1938 CB LEU A 126 -6.002 10.902 4.084 1.00 0.00 C ATOM 1939 CG LEU A 126 -5.185 9.827 4.797 1.00 0.00 C ATOM 1940 CD1 LEU A 126 -4.107 10.488 5.653 1.00 0.00 C ATOM 1941 CD2 LEU A 126 -6.113 8.998 5.686 1.00 0.00 C ATOM 0 H LEU A 126 -4.688 10.046 2.302 1.00 0.00 H new ATOM 0 HA LEU A 126 -7.385 9.459 3.188 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -5.350 11.707 3.746 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -6.724 11.343 4.771 1.00 0.00 H new ATOM 0 HG LEU A 126 -4.710 9.178 4.061 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -3.524 9.720 6.162 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -3.449 11.080 5.017 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -4.577 11.136 6.393 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -5.535 8.229 6.198 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -6.586 9.647 6.423 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -6.880 8.527 5.072 1.00 0.00 H new ATOM 1953 N ARG A 127 -7.025 12.305 1.597 1.00 0.00 N ATOM 1954 CA ARG A 127 -7.855 13.338 0.908 1.00 0.00 C ATOM 1955 C ARG A 127 -8.693 12.693 -0.198 1.00 0.00 C ATOM 1956 O ARG A 127 -9.723 13.207 -0.590 1.00 0.00 O ATOM 1957 CB ARG A 127 -6.867 14.345 0.322 1.00 0.00 C ATOM 1958 CG ARG A 127 -7.647 15.407 -0.459 1.00 0.00 C ATOM 1959 CD ARG A 127 -8.603 16.146 0.487 1.00 0.00 C ATOM 1960 NE ARG A 127 -8.289 17.595 0.308 1.00 0.00 N ATOM 1961 CZ ARG A 127 -7.335 18.161 1.002 1.00 0.00 C ATOM 1962 NH1 ARG A 127 -6.627 17.466 1.850 1.00 0.00 N ATOM 1963 NH2 ARG A 127 -7.080 19.427 0.832 1.00 0.00 N ATOM 0 H ARG A 127 -6.017 12.452 1.552 1.00 0.00 H new ATOM 0 HA ARG A 127 -8.551 13.821 1.594 1.00 0.00 H new ATOM 0 HB2 ARG A 127 -6.288 14.812 1.118 1.00 0.00 H new ATOM 0 HB3 ARG A 127 -6.158 13.840 -0.334 1.00 0.00 H new ATOM 0 HG2 ARG A 127 -6.957 16.114 -0.919 1.00 0.00 H new ATOM 0 HG3 ARG A 127 -8.209 14.939 -1.267 1.00 0.00 H new ATOM 0 HD2 ARG A 127 -9.643 15.935 0.239 1.00 0.00 H new ATOM 0 HD3 ARG A 127 -8.452 15.835 1.521 1.00 0.00 H new ATOM 0 HE ARG A 127 -8.823 18.149 -0.362 1.00 0.00 H new ATOM 0 HH11 ARG A 127 -6.815 16.472 1.977 1.00 0.00 H new ATOM 0 HH12 ARG A 127 -5.886 17.917 2.386 1.00 0.00 H new ATOM 0 HH21 ARG A 127 -7.623 19.971 0.161 1.00 0.00 H new ATOM 0 HH22 ARG A 127 -6.338 19.874 1.370 1.00 0.00 H new ATOM 1977 N LEU A 128 -8.258 11.571 -0.705 1.00 0.00 N ATOM 1978 CA LEU A 128 -9.030 10.893 -1.785 1.00 0.00 C ATOM 1979 C LEU A 128 -10.000 9.875 -1.187 1.00 0.00 C ATOM 1980 O LEU A 128 -10.603 9.093 -1.895 1.00 0.00 O ATOM 1981 CB LEU A 128 -7.982 10.176 -2.635 1.00 0.00 C ATOM 1982 CG LEU A 128 -7.825 10.896 -3.973 1.00 0.00 C ATOM 1983 CD1 LEU A 128 -6.977 12.155 -3.782 1.00 0.00 C ATOM 1984 CD2 LEU A 128 -7.139 9.960 -4.970 1.00 0.00 C ATOM 0 H LEU A 128 -7.402 11.095 -0.418 1.00 0.00 H new ATOM 0 HA LEU A 128 -9.621 11.600 -2.367 1.00 0.00 H new ATOM 0 HB2 LEU A 128 -7.027 10.152 -2.109 1.00 0.00 H new ATOM 0 HB3 LEU A 128 -8.280 9.141 -2.801 1.00 0.00 H new ATOM 0 HG LEU A 128 -8.806 11.180 -4.354 1.00 0.00 H new ATOM 0 HD11 LEU A 128 -6.866 12.667 -4.738 1.00 0.00 H new ATOM 0 HD12 LEU A 128 -7.466 12.819 -3.069 1.00 0.00 H new ATOM 0 HD13 LEU A 128 -5.994 11.877 -3.403 1.00 0.00 H new ATOM 0 HD21 LEU A 128 -7.024 10.469 -5.927 1.00 0.00 H new ATOM 0 HD22 LEU A 128 -6.157 9.679 -4.589 1.00 0.00 H new ATOM 0 HD23 LEU A 128 -7.746 9.065 -5.105 1.00 0.00 H new ATOM 1996 N ALA A 129 -10.154 9.867 0.108 1.00 0.00 N ATOM 1997 CA ALA A 129 -11.087 8.887 0.731 1.00 0.00 C ATOM 1998 C ALA A 129 -12.514 9.449 0.724 1.00 0.00 C ATOM 1999 O ALA A 129 -12.715 10.607 1.032 1.00 0.00 O ATOM 2000 CB ALA A 129 -10.592 8.715 2.164 1.00 0.00 C ATOM 0 H ALA A 129 -9.678 10.492 0.758 1.00 0.00 H new ATOM 0 HA ALA A 129 -11.108 7.939 0.194 1.00 0.00 H new ATOM 0 HB1 ALA A 129 -11.232 8.005 2.687 1.00 0.00 H new ATOM 0 HB2 ALA A 129 -9.568 8.341 2.153 1.00 0.00 H new ATOM 0 HB3 ALA A 129 -10.621 9.676 2.677 1.00 0.00 H new ATOM 2006 N PRO A 130 -13.471 8.619 0.381 1.00 0.00 N ATOM 2007 CA PRO A 130 -13.193 7.204 0.008 1.00 0.00 C ATOM 2008 C PRO A 130 -12.497 7.126 -1.356 1.00 0.00 C ATOM 2009 O PRO A 130 -12.715 7.951 -2.222 1.00 0.00 O ATOM 2010 CB PRO A 130 -14.579 6.572 -0.057 1.00 0.00 C ATOM 2011 CG PRO A 130 -15.509 7.710 -0.326 1.00 0.00 C ATOM 2012 CD PRO A 130 -14.903 8.929 0.314 1.00 0.00 C ATOM 0 HA PRO A 130 -12.530 6.703 0.713 1.00 0.00 H new ATOM 0 HB2 PRO A 130 -14.634 5.822 -0.846 1.00 0.00 H new ATOM 0 HB3 PRO A 130 -14.829 6.070 0.878 1.00 0.00 H new ATOM 0 HG2 PRO A 130 -15.636 7.860 -1.398 1.00 0.00 H new ATOM 0 HG3 PRO A 130 -16.497 7.507 0.087 1.00 0.00 H new ATOM 0 HD2 PRO A 130 -15.090 9.825 -0.277 1.00 0.00 H new ATOM 0 HD3 PRO A 130 -15.319 9.108 1.305 1.00 0.00 H new ATOM 2020 N VAL A 131 -11.662 6.140 -1.554 1.00 0.00 N ATOM 2021 CA VAL A 131 -10.960 6.017 -2.865 1.00 0.00 C ATOM 2022 C VAL A 131 -11.669 4.992 -3.744 1.00 0.00 C ATOM 2023 O VAL A 131 -12.293 4.067 -3.261 1.00 0.00 O ATOM 2024 CB VAL A 131 -9.540 5.537 -2.559 1.00 0.00 C ATOM 2025 CG1 VAL A 131 -8.619 5.948 -3.706 1.00 0.00 C ATOM 2026 CG2 VAL A 131 -9.040 6.159 -1.252 1.00 0.00 C ATOM 0 H VAL A 131 -11.437 5.419 -0.869 1.00 0.00 H new ATOM 0 HA VAL A 131 -10.952 6.970 -3.395 1.00 0.00 H new ATOM 0 HB VAL A 131 -9.541 4.452 -2.452 1.00 0.00 H new ATOM 0 HG11 VAL A 131 -7.604 5.610 -3.497 1.00 0.00 H new ATOM 0 HG12 VAL A 131 -8.968 5.495 -4.634 1.00 0.00 H new ATOM 0 HG13 VAL A 131 -8.626 7.033 -3.807 1.00 0.00 H new ATOM 0 HG21 VAL A 131 -8.028 5.809 -1.046 1.00 0.00 H new ATOM 0 HG22 VAL A 131 -9.037 7.245 -1.344 1.00 0.00 H new ATOM 0 HG23 VAL A 131 -9.699 5.866 -0.434 1.00 0.00 H new ATOM 2036 N GLU A 132 -11.577 5.151 -5.028 1.00 0.00 N ATOM 2037 CA GLU A 132 -12.244 4.190 -5.949 1.00 0.00 C ATOM 2038 C GLU A 132 -11.252 3.107 -6.379 1.00 0.00 C ATOM 2039 O GLU A 132 -10.451 3.298 -7.273 1.00 0.00 O ATOM 2040 CB GLU A 132 -12.683 5.045 -7.134 1.00 0.00 C ATOM 2041 CG GLU A 132 -13.627 6.134 -6.631 1.00 0.00 C ATOM 2042 CD GLU A 132 -13.693 7.270 -7.652 1.00 0.00 C ATOM 2043 OE1 GLU A 132 -14.270 7.060 -8.705 1.00 0.00 O ATOM 2044 OE2 GLU A 132 -13.161 8.328 -7.362 1.00 0.00 O ATOM 0 H GLU A 132 -11.067 5.907 -5.485 1.00 0.00 H new ATOM 0 HA GLU A 132 -13.086 3.671 -5.492 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -11.815 5.492 -7.619 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -13.183 4.428 -7.881 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -14.622 5.720 -6.469 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -13.280 6.515 -5.671 1.00 0.00 H new ATOM 2051 N THR A 133 -11.300 1.973 -5.736 1.00 0.00 N ATOM 2052 CA THR A 133 -10.365 0.862 -6.079 1.00 0.00 C ATOM 2053 C THR A 133 -10.893 0.067 -7.276 1.00 0.00 C ATOM 2054 O THR A 133 -10.277 -0.875 -7.733 1.00 0.00 O ATOM 2055 CB THR A 133 -10.356 -0.010 -4.822 1.00 0.00 C ATOM 2056 OG1 THR A 133 -11.664 -0.036 -4.263 1.00 0.00 O ATOM 2057 CG2 THR A 133 -9.379 0.563 -3.798 1.00 0.00 C ATOM 0 H THR A 133 -11.953 1.766 -4.980 1.00 0.00 H new ATOM 0 HA THR A 133 -9.372 1.216 -6.356 1.00 0.00 H new ATOM 0 HB THR A 133 -10.045 -1.021 -5.086 1.00 0.00 H new ATOM 0 HG1 THR A 133 -11.665 -0.595 -3.458 1.00 0.00 H new ATOM 0 HG21 THR A 133 -9.378 -0.063 -2.906 1.00 0.00 H new ATOM 0 HG22 THR A 133 -8.377 0.587 -4.225 1.00 0.00 H new ATOM 0 HG23 THR A 133 -9.684 1.575 -3.531 1.00 0.00 H new ATOM 2065 N MET A 134 -12.034 0.441 -7.782 1.00 0.00 N ATOM 2066 CA MET A 134 -12.621 -0.284 -8.945 1.00 0.00 C ATOM 2067 C MET A 134 -12.581 -1.799 -8.712 1.00 0.00 C ATOM 2068 O MET A 134 -12.611 -2.577 -9.644 1.00 0.00 O ATOM 2069 CB MET A 134 -11.753 0.094 -10.149 1.00 0.00 C ATOM 2070 CG MET A 134 -11.781 1.611 -10.350 1.00 0.00 C ATOM 2071 SD MET A 134 -12.831 2.011 -11.770 1.00 0.00 S ATOM 2072 CE MET A 134 -11.505 2.371 -12.948 1.00 0.00 C ATOM 0 H MET A 134 -12.590 1.224 -7.438 1.00 0.00 H new ATOM 0 HA MET A 134 -13.666 -0.014 -9.100 1.00 0.00 H new ATOM 0 HB2 MET A 134 -10.728 -0.243 -9.991 1.00 0.00 H new ATOM 0 HB3 MET A 134 -12.119 -0.408 -11.045 1.00 0.00 H new ATOM 0 HG2 MET A 134 -12.161 2.101 -9.453 1.00 0.00 H new ATOM 0 HG3 MET A 134 -10.771 1.986 -10.514 1.00 0.00 H new ATOM 0 HE1 MET A 134 -11.938 2.646 -13.910 1.00 0.00 H new ATOM 0 HE2 MET A 134 -10.900 3.197 -12.573 1.00 0.00 H new ATOM 0 HE3 MET A 134 -10.878 1.488 -13.071 1.00 0.00 H new ATOM 2082 N ALA A 135 -12.517 -2.228 -7.478 1.00 0.00 N ATOM 2083 CA ALA A 135 -12.484 -3.701 -7.206 1.00 0.00 C ATOM 2084 C ALA A 135 -13.116 -4.015 -5.846 1.00 0.00 C ATOM 2085 O ALA A 135 -14.318 -3.847 -5.718 1.00 0.00 O ATOM 2086 CB ALA A 135 -11.004 -4.082 -7.199 1.00 0.00 C ATOM 2087 OXT ALA A 135 -12.387 -4.423 -4.958 1.00 0.00 O ATOM 0 H ALA A 135 -12.486 -1.630 -6.652 1.00 0.00 H new ATOM 0 HA ALA A 135 -13.047 -4.258 -7.955 1.00 0.00 H new ATOM 0 HB1 ALA A 135 -10.904 -5.150 -7.005 1.00 0.00 H new ATOM 0 HB2 ALA A 135 -10.563 -3.846 -8.168 1.00 0.00 H new ATOM 0 HB3 ALA A 135 -10.488 -3.522 -6.419 1.00 0.00 H new TER 2093 ALA A 135