USER MOD reduce.3.24.130724 H: found=0, std=0, add=879, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 874 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 106 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 107 HIS : no HD1:sc= 0.743 K(o=0.74,f=-5.1!) USER MOD Set 2.1: A 74 THR OG1 : rot -108:sc= 1.02 USER MOD Set 2.2: A 92 THR OG1 : rot 180:sc= 0.0768 USER MOD Set 3.1: A 61 HIS : no HE2:sc= -5.79! C(o=-5.8!,f=-11!) USER MOD Set 3.2: A 82 THR OG1 : rot -31:sc= -0.0581 USER MOD Set 4.1: A 10 LYS NZ :NH3+ -152:sc= -0.0761 (180deg=-0.483) USER MOD Set 4.2: A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 1 GLY N :NH3+ -116:sc= 0.114 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= -0.216 USER MOD Single : A 5 SER OG : rot 180:sc= 0.0182 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 13 TYR OH : rot 180:sc= -0.141 USER MOD Single : A 18 SER OG : rot 180:sc= -0.128 USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 TYR OH : rot 0:sc= -2.53 USER MOD Single : A 34 GLN : amide:sc= -0.018 X(o=-0.018,f=0) USER MOD Single : A 36 SER OG : rot 95:sc= -0.122 USER MOD Single : A 38 THR OG1 : rot -82:sc= 0.225 USER MOD Single : A 42 THR OG1 : rot 180:sc=-0.00742 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 ASN : amide:sc=-0.00372 X(o=-0.0037,f=0) USER MOD Single : A 49 SER OG : rot -130:sc= 0.178 USER MOD Single : A 51 GLN : amide:sc= 0.396 K(o=0.4,f=-2.1) USER MOD Single : A 58 GLN : amide:sc= -2.15 K(o=-2.1,f=-3.1) USER MOD Single : A 60 HIS : no HE2:sc= -5.55! C(o=-5.6!,f=-12!) USER MOD Single : A 62 CYS SG : rot -122:sc= 0.277! USER MOD Single : A 65 THR OG1 : rot 180:sc= -1.73! USER MOD Single : A 66 ASN : amide:sc= -1.31! C(o=-1.3!,f=-8.7!) USER MOD Single : A 67 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 72 THR OG1 : rot 39:sc= 0.206 USER MOD Single : A 77 SER OG : rot 70:sc= 1.03 USER MOD Single : A 78 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 83 TYR OH : rot 30:sc= -0.231 USER MOD Single : A 87 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 93 THR OG1 : rot 76:sc= 0.00458 USER MOD Single : A 94 MET CE :methyl -114:sc= -0.0638 (180deg=-2.52!) USER MOD Single : A 96 GLN : amide:sc= -0.0127 X(o=-0.013,f=0) USER MOD Single : A 97 SER OG : rot -7:sc= 0.619 USER MOD Single : A 99 MET CE :methyl 180:sc= -2.24 (180deg=-2.24) USER MOD Single : A 102 GLN : amide:sc= -0.423 K(o=-0.42,f=-1.1) USER MOD Single : A 105 THR OG1 : rot -64:sc= 1.01 USER MOD Single : A 110 LYS NZ :NH3+ -110:sc= -2.54 (180deg=-4.29!) USER MOD Single : A 118 SER OG : rot 11:sc= 0.491! USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -11.455 -21.135 2.817 1.00 0.00 N ATOM 2 CA GLY A 1 -11.449 -22.070 3.929 1.00 0.00 C ATOM 3 C GLY A 1 -10.789 -21.452 5.163 1.00 0.00 C ATOM 4 O GLY A 1 -10.134 -20.415 5.066 1.00 0.00 O ATOM 0 H1 GLY A 1 -12.436 -20.895 2.570 1.00 0.00 H new ATOM 0 H2 GLY A 1 -10.945 -20.270 3.088 1.00 0.00 H new ATOM 0 H3 GLY A 1 -10.988 -21.569 1.996 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -12.471 -22.363 4.168 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -10.916 -22.977 3.643 1.00 0.00 H new ATOM 8 N SER A 2 -10.985 -22.113 6.294 1.00 0.00 N ATOM 9 CA SER A 2 -10.417 -21.641 7.545 1.00 0.00 C ATOM 10 C SER A 2 -8.945 -22.049 7.638 1.00 0.00 C ATOM 11 O SER A 2 -8.519 -23.004 6.990 1.00 0.00 O ATOM 12 CB SER A 2 -11.195 -22.186 8.744 1.00 0.00 C ATOM 13 OG SER A 2 -10.773 -21.594 9.969 1.00 0.00 O ATOM 0 H SER A 2 -11.530 -22.972 6.370 1.00 0.00 H new ATOM 0 HA SER A 2 -10.488 -20.554 7.564 1.00 0.00 H new ATOM 0 HB2 SER A 2 -12.259 -22.001 8.600 1.00 0.00 H new ATOM 0 HB3 SER A 2 -11.064 -23.267 8.800 1.00 0.00 H new ATOM 0 HG SER A 2 -11.295 -21.967 10.710 1.00 0.00 H new ATOM 19 N SER A 3 -8.208 -21.304 8.450 1.00 0.00 N ATOM 20 CA SER A 3 -6.793 -21.577 8.636 1.00 0.00 C ATOM 21 C SER A 3 -6.332 -21.045 9.994 1.00 0.00 C ATOM 22 O SER A 3 -6.726 -19.953 10.404 1.00 0.00 O ATOM 23 CB SER A 3 -5.960 -20.956 7.513 1.00 0.00 C ATOM 24 OG SER A 3 -6.467 -21.292 6.224 1.00 0.00 O ATOM 0 H SER A 3 -8.564 -20.512 8.986 1.00 0.00 H new ATOM 0 HA SER A 3 -6.646 -22.657 8.606 1.00 0.00 H new ATOM 0 HB2 SER A 3 -5.949 -19.872 7.627 1.00 0.00 H new ATOM 0 HB3 SER A 3 -4.928 -21.296 7.597 1.00 0.00 H new ATOM 0 HG SER A 3 -5.909 -20.876 5.534 1.00 0.00 H new ATOM 30 N GLY A 4 -5.505 -21.840 10.656 1.00 0.00 N ATOM 31 CA GLY A 4 -4.987 -21.463 11.960 1.00 0.00 C ATOM 32 C GLY A 4 -4.118 -20.207 11.862 1.00 0.00 C ATOM 33 O GLY A 4 -4.562 -19.180 11.351 1.00 0.00 O ATOM 0 H GLY A 4 -5.181 -22.744 10.314 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -5.815 -21.284 12.646 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -4.401 -22.284 12.374 1.00 0.00 H new ATOM 37 N SER A 5 -2.897 -20.331 12.361 1.00 0.00 N ATOM 38 CA SER A 5 -1.963 -19.218 12.336 1.00 0.00 C ATOM 39 C SER A 5 -1.413 -19.027 10.921 1.00 0.00 C ATOM 40 O SER A 5 -1.842 -19.705 9.988 1.00 0.00 O ATOM 41 CB SER A 5 -0.816 -19.440 13.325 1.00 0.00 C ATOM 42 OG SER A 5 -0.310 -20.770 13.266 1.00 0.00 O ATOM 0 H SER A 5 -2.533 -21.184 12.785 1.00 0.00 H new ATOM 0 HA SER A 5 -2.497 -18.317 12.636 1.00 0.00 H new ATOM 0 HB2 SER A 5 -0.012 -18.736 13.111 1.00 0.00 H new ATOM 0 HB3 SER A 5 -1.163 -19.229 14.336 1.00 0.00 H new ATOM 0 HG SER A 5 0.421 -20.871 13.911 1.00 0.00 H new ATOM 48 N SER A 6 -0.473 -18.101 10.806 1.00 0.00 N ATOM 49 CA SER A 6 0.139 -17.812 9.520 1.00 0.00 C ATOM 50 C SER A 6 -0.925 -17.340 8.528 1.00 0.00 C ATOM 51 O SER A 6 -1.219 -18.029 7.552 1.00 0.00 O ATOM 52 CB SER A 6 0.870 -19.039 8.970 1.00 0.00 C ATOM 53 OG SER A 6 2.249 -19.045 9.332 1.00 0.00 O ATOM 0 H SER A 6 -0.120 -17.541 11.582 1.00 0.00 H new ATOM 0 HA SER A 6 0.872 -17.018 9.661 1.00 0.00 H new ATOM 0 HB2 SER A 6 0.393 -19.944 9.345 1.00 0.00 H new ATOM 0 HB3 SER A 6 0.780 -19.058 7.884 1.00 0.00 H new ATOM 0 HG SER A 6 2.680 -19.844 8.964 1.00 0.00 H new ATOM 59 N GLY A 7 -1.474 -16.168 8.811 1.00 0.00 N ATOM 60 CA GLY A 7 -2.499 -15.595 7.956 1.00 0.00 C ATOM 61 C GLY A 7 -2.684 -14.104 8.244 1.00 0.00 C ATOM 62 O GLY A 7 -2.080 -13.261 7.583 1.00 0.00 O ATOM 0 H GLY A 7 -1.228 -15.599 9.621 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -2.225 -15.736 6.910 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -3.442 -16.119 8.112 1.00 0.00 H new ATOM 66 N PRO A 8 -3.544 -13.817 9.258 1.00 0.00 N ATOM 67 CA PRO A 8 -3.816 -12.442 9.641 1.00 0.00 C ATOM 68 C PRO A 8 -2.643 -11.849 10.423 1.00 0.00 C ATOM 69 O PRO A 8 -2.562 -10.634 10.603 1.00 0.00 O ATOM 70 CB PRO A 8 -5.099 -12.507 10.454 1.00 0.00 C ATOM 71 CG PRO A 8 -5.245 -13.957 10.887 1.00 0.00 C ATOM 72 CD PRO A 8 -4.278 -14.790 10.062 1.00 0.00 C ATOM 0 HA PRO A 8 -3.937 -11.782 8.782 1.00 0.00 H new ATOM 0 HB2 PRO A 8 -5.048 -11.845 11.318 1.00 0.00 H new ATOM 0 HB3 PRO A 8 -5.955 -12.189 9.859 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -5.028 -14.062 11.950 1.00 0.00 H new ATOM 0 HG3 PRO A 8 -6.269 -14.299 10.736 1.00 0.00 H new ATOM 0 HD2 PRO A 8 -3.606 -15.364 10.700 1.00 0.00 H new ATOM 0 HD3 PRO A 8 -4.808 -15.505 9.432 1.00 0.00 H new ATOM 80 N GLU A 9 -1.762 -12.733 10.867 1.00 0.00 N ATOM 81 CA GLU A 9 -0.596 -12.312 11.626 1.00 0.00 C ATOM 82 C GLU A 9 0.499 -11.810 10.682 1.00 0.00 C ATOM 83 O GLU A 9 1.601 -11.486 11.120 1.00 0.00 O ATOM 84 CB GLU A 9 -0.078 -13.447 12.511 1.00 0.00 C ATOM 85 CG GLU A 9 0.273 -14.679 11.674 1.00 0.00 C ATOM 86 CD GLU A 9 1.656 -15.217 12.043 1.00 0.00 C ATOM 87 OE1 GLU A 9 2.641 -14.516 11.726 1.00 0.00 O ATOM 88 OE2 GLU A 9 1.698 -16.318 12.634 1.00 0.00 O ATOM 0 H GLU A 9 -1.832 -13.739 10.716 1.00 0.00 H new ATOM 0 HA GLU A 9 -0.890 -11.491 12.280 1.00 0.00 H new ATOM 0 HB2 GLU A 9 0.803 -13.112 13.059 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -0.834 -13.709 13.251 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -0.476 -15.455 11.831 1.00 0.00 H new ATOM 0 HG3 GLU A 9 0.250 -14.422 10.615 1.00 0.00 H new ATOM 95 N LYS A 10 0.156 -11.761 9.403 1.00 0.00 N ATOM 96 CA LYS A 10 1.096 -11.304 8.393 1.00 0.00 C ATOM 97 C LYS A 10 0.333 -10.569 7.289 1.00 0.00 C ATOM 98 O LYS A 10 0.366 -10.978 6.129 1.00 0.00 O ATOM 99 CB LYS A 10 1.944 -12.471 7.883 1.00 0.00 C ATOM 100 CG LYS A 10 1.060 -13.634 7.428 1.00 0.00 C ATOM 101 CD LYS A 10 1.689 -14.978 7.798 1.00 0.00 C ATOM 102 CE LYS A 10 2.405 -15.597 6.596 1.00 0.00 C ATOM 103 NZ LYS A 10 1.430 -15.970 5.547 1.00 0.00 N ATOM 0 H LYS A 10 -0.760 -12.030 9.043 1.00 0.00 H new ATOM 0 HA LYS A 10 1.801 -10.592 8.822 1.00 0.00 H new ATOM 0 HB2 LYS A 10 2.567 -12.137 7.053 1.00 0.00 H new ATOM 0 HB3 LYS A 10 2.617 -12.808 8.671 1.00 0.00 H new ATOM 0 HG2 LYS A 10 0.076 -13.550 7.889 1.00 0.00 H new ATOM 0 HG3 LYS A 10 0.912 -13.582 6.349 1.00 0.00 H new ATOM 0 HD2 LYS A 10 2.396 -14.840 8.616 1.00 0.00 H new ATOM 0 HD3 LYS A 10 0.917 -15.659 8.156 1.00 0.00 H new ATOM 0 HE2 LYS A 10 3.129 -14.889 6.193 1.00 0.00 H new ATOM 0 HE3 LYS A 10 2.963 -16.478 6.912 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 1.804 -16.767 4.993 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 0.532 -16.248 5.991 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 1.269 -15.157 4.918 1.00 0.00 H new ATOM 117 N LEU A 11 -0.335 -9.497 7.688 1.00 0.00 N ATOM 118 CA LEU A 11 -1.104 -8.701 6.746 1.00 0.00 C ATOM 119 C LEU A 11 -0.354 -7.400 6.452 1.00 0.00 C ATOM 120 O LEU A 11 0.390 -6.904 7.297 1.00 0.00 O ATOM 121 CB LEU A 11 -2.528 -8.487 7.264 1.00 0.00 C ATOM 122 CG LEU A 11 -3.323 -9.754 7.585 1.00 0.00 C ATOM 123 CD1 LEU A 11 -4.602 -9.418 8.354 1.00 0.00 C ATOM 124 CD2 LEU A 11 -3.611 -10.557 6.315 1.00 0.00 C ATOM 0 H LEU A 11 -0.360 -9.161 8.651 1.00 0.00 H new ATOM 0 HA LEU A 11 -1.210 -9.229 5.798 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -2.477 -7.876 8.165 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -3.081 -7.913 6.520 1.00 0.00 H new ATOM 0 HG LEU A 11 -2.714 -10.385 8.233 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -5.149 -10.336 8.570 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -4.344 -8.921 9.289 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -5.226 -8.757 7.752 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -4.177 -11.452 6.571 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -4.191 -9.947 5.622 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -2.670 -10.845 5.845 1.00 0.00 H new ATOM 136 N PRO A 12 -0.581 -6.871 5.220 1.00 0.00 N ATOM 137 CA PRO A 12 0.064 -5.638 4.805 1.00 0.00 C ATOM 138 C PRO A 12 -0.580 -4.426 5.482 1.00 0.00 C ATOM 139 O PRO A 12 -1.798 -4.380 5.650 1.00 0.00 O ATOM 140 CB PRO A 12 -0.071 -5.614 3.291 1.00 0.00 C ATOM 141 CG PRO A 12 -1.186 -6.592 2.956 1.00 0.00 C ATOM 142 CD PRO A 12 -1.456 -7.431 4.194 1.00 0.00 C ATOM 0 HA PRO A 12 1.113 -5.593 5.099 1.00 0.00 H new ATOM 0 HB2 PRO A 12 -0.311 -4.612 2.936 1.00 0.00 H new ATOM 0 HB3 PRO A 12 0.863 -5.907 2.811 1.00 0.00 H new ATOM 0 HG2 PRO A 12 -2.086 -6.056 2.654 1.00 0.00 H new ATOM 0 HG3 PRO A 12 -0.898 -7.228 2.119 1.00 0.00 H new ATOM 0 HD2 PRO A 12 -2.503 -7.372 4.491 1.00 0.00 H new ATOM 0 HD3 PRO A 12 -1.234 -8.483 4.015 1.00 0.00 H new ATOM 150 N TYR A 13 0.266 -3.476 5.852 1.00 0.00 N ATOM 151 CA TYR A 13 -0.206 -2.268 6.507 1.00 0.00 C ATOM 152 C TYR A 13 0.539 -1.037 5.988 1.00 0.00 C ATOM 153 O TYR A 13 1.547 -1.163 5.294 1.00 0.00 O ATOM 154 CB TYR A 13 0.102 -2.447 7.995 1.00 0.00 C ATOM 155 CG TYR A 13 1.580 -2.703 8.297 1.00 0.00 C ATOM 156 CD1 TYR A 13 2.067 -3.994 8.314 1.00 0.00 C ATOM 157 CD2 TYR A 13 2.426 -1.643 8.555 1.00 0.00 C ATOM 158 CE1 TYR A 13 3.458 -4.235 8.599 1.00 0.00 C ATOM 159 CE2 TYR A 13 3.816 -1.884 8.840 1.00 0.00 C ATOM 160 CZ TYR A 13 4.264 -3.168 8.848 1.00 0.00 C ATOM 161 OH TYR A 13 5.577 -3.396 9.117 1.00 0.00 O ATOM 0 H TYR A 13 1.275 -3.518 5.711 1.00 0.00 H new ATOM 0 HA TYR A 13 -1.268 -2.117 6.316 1.00 0.00 H new ATOM 0 HB2 TYR A 13 -0.219 -1.554 8.532 1.00 0.00 H new ATOM 0 HB3 TYR A 13 -0.487 -3.280 8.380 1.00 0.00 H new ATOM 0 HD1 TYR A 13 1.405 -4.824 8.114 1.00 0.00 H new ATOM 0 HD2 TYR A 13 2.045 -0.633 8.543 1.00 0.00 H new ATOM 0 HE1 TYR A 13 3.852 -5.240 8.615 1.00 0.00 H new ATOM 0 HE2 TYR A 13 4.488 -1.063 9.043 1.00 0.00 H new ATOM 0 HH TYR A 13 6.032 -2.542 9.274 1.00 0.00 H new ATOM 171 N LEU A 14 0.015 0.127 6.345 1.00 0.00 N ATOM 172 CA LEU A 14 0.618 1.380 5.925 1.00 0.00 C ATOM 173 C LEU A 14 1.052 2.172 7.160 1.00 0.00 C ATOM 174 O LEU A 14 0.230 2.491 8.018 1.00 0.00 O ATOM 175 CB LEU A 14 -0.331 2.149 5.003 1.00 0.00 C ATOM 176 CG LEU A 14 -0.977 1.337 3.879 1.00 0.00 C ATOM 177 CD1 LEU A 14 -2.265 2.005 3.391 1.00 0.00 C ATOM 178 CD2 LEU A 14 0.012 1.098 2.737 1.00 0.00 C ATOM 0 H LEU A 14 -0.821 0.228 6.921 1.00 0.00 H new ATOM 0 HA LEU A 14 1.515 1.192 5.335 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -1.123 2.585 5.612 1.00 0.00 H new ATOM 0 HB3 LEU A 14 0.220 2.977 4.556 1.00 0.00 H new ATOM 0 HG LEU A 14 -1.251 0.360 4.277 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -2.704 1.408 2.592 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -2.971 2.081 4.218 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -2.038 3.003 3.015 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -0.473 0.519 1.951 1.00 0.00 H new ATOM 0 HD22 LEU A 14 0.339 2.056 2.332 1.00 0.00 H new ATOM 0 HD23 LEU A 14 0.876 0.549 3.112 1.00 0.00 H new ATOM 190 N VAL A 15 2.343 2.467 7.211 1.00 0.00 N ATOM 191 CA VAL A 15 2.895 3.216 8.327 1.00 0.00 C ATOM 192 C VAL A 15 3.213 4.641 7.872 1.00 0.00 C ATOM 193 O VAL A 15 4.192 4.866 7.161 1.00 0.00 O ATOM 194 CB VAL A 15 4.113 2.485 8.896 1.00 0.00 C ATOM 195 CG1 VAL A 15 5.302 2.573 7.938 1.00 0.00 C ATOM 196 CG2 VAL A 15 4.481 3.026 10.279 1.00 0.00 C ATOM 0 H VAL A 15 3.022 2.201 6.498 1.00 0.00 H new ATOM 0 HA VAL A 15 2.168 3.288 9.136 1.00 0.00 H new ATOM 0 HB VAL A 15 3.850 1.433 9.008 1.00 0.00 H new ATOM 0 HG11 VAL A 15 6.154 2.046 8.366 1.00 0.00 H new ATOM 0 HG12 VAL A 15 5.035 2.117 6.984 1.00 0.00 H new ATOM 0 HG13 VAL A 15 5.565 3.619 7.780 1.00 0.00 H new ATOM 0 HG21 VAL A 15 5.350 2.489 10.660 1.00 0.00 H new ATOM 0 HG22 VAL A 15 4.715 4.088 10.204 1.00 0.00 H new ATOM 0 HG23 VAL A 15 3.641 2.887 10.959 1.00 0.00 H new ATOM 206 N GLU A 16 2.367 5.567 8.300 1.00 0.00 N ATOM 207 CA GLU A 16 2.546 6.965 7.944 1.00 0.00 C ATOM 208 C GLU A 16 4.024 7.351 8.034 1.00 0.00 C ATOM 209 O GLU A 16 4.690 7.044 9.022 1.00 0.00 O ATOM 210 CB GLU A 16 1.688 7.870 8.831 1.00 0.00 C ATOM 211 CG GLU A 16 1.914 9.345 8.491 1.00 0.00 C ATOM 212 CD GLU A 16 1.744 10.225 9.731 1.00 0.00 C ATOM 213 OE1 GLU A 16 2.695 10.253 10.542 1.00 0.00 O ATOM 214 OE2 GLU A 16 0.667 10.850 9.840 1.00 0.00 O ATOM 0 H GLU A 16 1.557 5.377 8.889 1.00 0.00 H new ATOM 0 HA GLU A 16 2.217 7.103 6.914 1.00 0.00 H new ATOM 0 HB2 GLU A 16 0.635 7.620 8.701 1.00 0.00 H new ATOM 0 HB3 GLU A 16 1.930 7.693 9.879 1.00 0.00 H new ATOM 0 HG2 GLU A 16 2.915 9.478 8.080 1.00 0.00 H new ATOM 0 HG3 GLU A 16 1.209 9.656 7.720 1.00 0.00 H new ATOM 221 N LEU A 17 4.493 8.018 6.990 1.00 0.00 N ATOM 222 CA LEU A 17 5.879 8.449 6.939 1.00 0.00 C ATOM 223 C LEU A 17 5.937 9.977 7.000 1.00 0.00 C ATOM 224 O LEU A 17 4.939 10.650 6.745 1.00 0.00 O ATOM 225 CB LEU A 17 6.580 7.856 5.715 1.00 0.00 C ATOM 226 CG LEU A 17 6.802 6.343 5.737 1.00 0.00 C ATOM 227 CD1 LEU A 17 7.941 5.942 4.797 1.00 0.00 C ATOM 228 CD2 LEU A 17 7.035 5.844 7.164 1.00 0.00 C ATOM 0 H LEU A 17 3.937 8.270 6.173 1.00 0.00 H new ATOM 0 HA LEU A 17 6.426 8.074 7.804 1.00 0.00 H new ATOM 0 HB2 LEU A 17 5.994 8.104 4.830 1.00 0.00 H new ATOM 0 HB3 LEU A 17 7.548 8.344 5.604 1.00 0.00 H new ATOM 0 HG LEU A 17 5.896 5.860 5.370 1.00 0.00 H new ATOM 0 HD11 LEU A 17 8.078 4.861 4.832 1.00 0.00 H new ATOM 0 HD12 LEU A 17 7.696 6.244 3.779 1.00 0.00 H new ATOM 0 HD13 LEU A 17 8.862 6.435 5.110 1.00 0.00 H new ATOM 0 HD21 LEU A 17 7.190 4.765 7.151 1.00 0.00 H new ATOM 0 HD22 LEU A 17 7.916 6.332 7.581 1.00 0.00 H new ATOM 0 HD23 LEU A 17 6.165 6.078 7.778 1.00 0.00 H new ATOM 240 N SER A 18 7.115 10.480 7.340 1.00 0.00 N ATOM 241 CA SER A 18 7.315 11.916 7.438 1.00 0.00 C ATOM 242 C SER A 18 6.969 12.584 6.106 1.00 0.00 C ATOM 243 O SER A 18 6.696 11.904 5.118 1.00 0.00 O ATOM 244 CB SER A 18 8.754 12.245 7.839 1.00 0.00 C ATOM 245 OG SER A 18 8.820 12.896 9.105 1.00 0.00 O ATOM 0 H SER A 18 7.940 9.919 7.551 1.00 0.00 H new ATOM 0 HA SER A 18 6.653 12.302 8.213 1.00 0.00 H new ATOM 0 HB2 SER A 18 9.340 11.326 7.873 1.00 0.00 H new ATOM 0 HB3 SER A 18 9.205 12.883 7.079 1.00 0.00 H new ATOM 0 HG SER A 18 9.755 13.088 9.326 1.00 0.00 H new ATOM 251 N PRO A 19 6.993 13.944 6.122 1.00 0.00 N ATOM 252 CA PRO A 19 6.686 14.712 4.928 1.00 0.00 C ATOM 253 C PRO A 19 7.848 14.669 3.934 1.00 0.00 C ATOM 254 O PRO A 19 7.777 15.270 2.863 1.00 0.00 O ATOM 255 CB PRO A 19 6.385 16.115 5.429 1.00 0.00 C ATOM 256 CG PRO A 19 6.984 16.197 6.824 1.00 0.00 C ATOM 257 CD PRO A 19 7.313 14.783 7.273 1.00 0.00 C ATOM 0 HA PRO A 19 5.836 14.309 4.376 1.00 0.00 H new ATOM 0 HB2 PRO A 19 6.822 16.867 4.772 1.00 0.00 H new ATOM 0 HB3 PRO A 19 5.311 16.299 5.454 1.00 0.00 H new ATOM 0 HG2 PRO A 19 7.882 16.814 6.818 1.00 0.00 H new ATOM 0 HG3 PRO A 19 6.281 16.663 7.515 1.00 0.00 H new ATOM 0 HD2 PRO A 19 8.363 14.690 7.551 1.00 0.00 H new ATOM 0 HD3 PRO A 19 6.726 14.498 8.146 1.00 0.00 H new ATOM 265 N ASP A 20 8.892 13.953 4.324 1.00 0.00 N ATOM 266 CA ASP A 20 10.068 13.823 3.480 1.00 0.00 C ATOM 267 C ASP A 20 10.160 12.389 2.957 1.00 0.00 C ATOM 268 O ASP A 20 11.027 12.076 2.142 1.00 0.00 O ATOM 269 CB ASP A 20 11.346 14.122 4.267 1.00 0.00 C ATOM 270 CG ASP A 20 12.227 15.224 3.675 1.00 0.00 C ATOM 271 OD1 ASP A 20 11.707 16.351 3.531 1.00 0.00 O ATOM 272 OD2 ASP A 20 13.402 14.914 3.381 1.00 0.00 O ATOM 0 H ASP A 20 8.948 13.457 5.213 1.00 0.00 H new ATOM 0 HA ASP A 20 9.974 14.534 2.660 1.00 0.00 H new ATOM 0 HB2 ASP A 20 11.071 14.404 5.283 1.00 0.00 H new ATOM 0 HB3 ASP A 20 11.934 13.207 4.338 1.00 0.00 H new ATOM 277 N GLY A 21 9.255 11.555 3.447 1.00 0.00 N ATOM 278 CA GLY A 21 9.222 10.161 3.039 1.00 0.00 C ATOM 279 C GLY A 21 10.255 9.339 3.813 1.00 0.00 C ATOM 280 O GLY A 21 10.870 8.428 3.260 1.00 0.00 O ATOM 0 H GLY A 21 8.538 11.818 4.123 1.00 0.00 H new ATOM 0 HA2 GLY A 21 8.226 9.752 3.208 1.00 0.00 H new ATOM 0 HA3 GLY A 21 9.420 10.086 1.970 1.00 0.00 H new ATOM 284 N SER A 22 10.414 9.690 5.081 1.00 0.00 N ATOM 285 CA SER A 22 11.361 8.996 5.937 1.00 0.00 C ATOM 286 C SER A 22 10.639 8.413 7.152 1.00 0.00 C ATOM 287 O SER A 22 9.611 8.938 7.579 1.00 0.00 O ATOM 288 CB SER A 22 12.485 9.932 6.386 1.00 0.00 C ATOM 289 OG SER A 22 11.981 11.150 6.928 1.00 0.00 O ATOM 0 H SER A 22 9.903 10.446 5.536 1.00 0.00 H new ATOM 0 HA SER A 22 11.808 8.183 5.364 1.00 0.00 H new ATOM 0 HB2 SER A 22 13.099 9.429 7.133 1.00 0.00 H new ATOM 0 HB3 SER A 22 13.133 10.153 5.538 1.00 0.00 H new ATOM 0 HG SER A 22 12.729 11.719 7.204 1.00 0.00 H new ATOM 295 N ASP A 23 11.204 7.335 7.676 1.00 0.00 N ATOM 296 CA ASP A 23 10.626 6.674 8.834 1.00 0.00 C ATOM 297 C ASP A 23 11.253 7.246 10.107 1.00 0.00 C ATOM 298 O ASP A 23 12.439 7.042 10.365 1.00 0.00 O ATOM 299 CB ASP A 23 10.903 5.170 8.805 1.00 0.00 C ATOM 300 CG ASP A 23 12.326 4.782 8.400 1.00 0.00 C ATOM 301 OD1 ASP A 23 13.179 4.723 9.312 1.00 0.00 O ATOM 302 OD2 ASP A 23 12.530 4.553 7.188 1.00 0.00 O ATOM 0 H ASP A 23 12.056 6.903 7.320 1.00 0.00 H new ATOM 0 HA ASP A 23 9.549 6.842 8.816 1.00 0.00 H new ATOM 0 HB2 ASP A 23 10.698 4.759 9.794 1.00 0.00 H new ATOM 0 HB3 ASP A 23 10.204 4.700 8.113 1.00 0.00 H new ATOM 307 N SER A 24 10.430 7.950 10.869 1.00 0.00 N ATOM 308 CA SER A 24 10.889 8.552 12.110 1.00 0.00 C ATOM 309 C SER A 24 9.728 9.265 12.806 1.00 0.00 C ATOM 310 O SER A 24 8.564 8.958 12.553 1.00 0.00 O ATOM 311 CB SER A 24 12.037 9.531 11.854 1.00 0.00 C ATOM 312 OG SER A 24 13.159 9.268 12.693 1.00 0.00 O ATOM 0 H SER A 24 9.448 8.117 10.652 1.00 0.00 H new ATOM 0 HA SER A 24 11.261 7.759 12.759 1.00 0.00 H new ATOM 0 HB2 SER A 24 12.342 9.467 10.810 1.00 0.00 H new ATOM 0 HB3 SER A 24 11.689 10.550 12.023 1.00 0.00 H new ATOM 0 HG SER A 24 13.871 9.913 12.498 1.00 0.00 H new ATOM 318 N ARG A 25 10.085 10.204 13.670 1.00 0.00 N ATOM 319 CA ARG A 25 9.088 10.963 14.405 1.00 0.00 C ATOM 320 C ARG A 25 8.228 10.026 15.256 1.00 0.00 C ATOM 321 O ARG A 25 7.065 9.786 14.938 1.00 0.00 O ATOM 322 CB ARG A 25 8.184 11.750 13.454 1.00 0.00 C ATOM 323 CG ARG A 25 8.968 12.851 12.737 1.00 0.00 C ATOM 324 CD ARG A 25 8.850 14.183 13.480 1.00 0.00 C ATOM 325 NE ARG A 25 10.196 14.701 13.809 1.00 0.00 N ATOM 326 CZ ARG A 25 10.420 15.815 14.519 1.00 0.00 C ATOM 327 NH1 ARG A 25 9.388 16.535 14.979 1.00 0.00 N ATOM 328 NH2 ARG A 25 11.676 16.209 14.770 1.00 0.00 N ATOM 0 H ARG A 25 11.051 10.456 13.877 1.00 0.00 H new ATOM 0 HA ARG A 25 9.616 11.665 15.051 1.00 0.00 H new ATOM 0 HB2 ARG A 25 7.746 11.074 12.720 1.00 0.00 H new ATOM 0 HB3 ARG A 25 7.359 12.191 14.013 1.00 0.00 H new ATOM 0 HG2 ARG A 25 10.017 12.565 12.661 1.00 0.00 H new ATOM 0 HG3 ARG A 25 8.594 12.964 11.719 1.00 0.00 H new ATOM 0 HD2 ARG A 25 8.314 14.906 12.865 1.00 0.00 H new ATOM 0 HD3 ARG A 25 8.270 14.049 14.393 1.00 0.00 H new ATOM 0 HE ARG A 25 11.005 14.177 13.474 1.00 0.00 H new ATOM 0 HH11 ARG A 25 8.432 16.235 14.789 1.00 0.00 H new ATOM 0 HH12 ARG A 25 9.558 17.383 15.520 1.00 0.00 H new ATOM 0 HH21 ARG A 25 12.462 15.661 14.420 1.00 0.00 H new ATOM 0 HH22 ARG A 25 11.846 17.057 15.311 1.00 0.00 H new ATOM 342 N ASP A 26 8.835 9.523 16.321 1.00 0.00 N ATOM 343 CA ASP A 26 8.139 8.618 17.220 1.00 0.00 C ATOM 344 C ASP A 26 7.434 7.535 16.401 1.00 0.00 C ATOM 345 O ASP A 26 7.633 7.438 15.191 1.00 0.00 O ATOM 346 CB ASP A 26 7.079 9.359 18.036 1.00 0.00 C ATOM 347 CG ASP A 26 6.761 8.739 19.398 1.00 0.00 C ATOM 348 OD1 ASP A 26 7.659 8.052 19.932 1.00 0.00 O ATOM 349 OD2 ASP A 26 5.628 8.967 19.875 1.00 0.00 O ATOM 0 H ASP A 26 9.800 9.725 16.581 1.00 0.00 H new ATOM 0 HA ASP A 26 8.875 8.183 17.896 1.00 0.00 H new ATOM 0 HB2 ASP A 26 7.412 10.385 18.190 1.00 0.00 H new ATOM 0 HB3 ASP A 26 6.160 9.407 17.452 1.00 0.00 H new ATOM 354 N LYS A 27 6.625 6.747 17.094 1.00 0.00 N ATOM 355 CA LYS A 27 5.889 5.674 16.446 1.00 0.00 C ATOM 356 C LYS A 27 4.717 6.267 15.662 1.00 0.00 C ATOM 357 O LYS A 27 3.789 6.820 16.250 1.00 0.00 O ATOM 358 CB LYS A 27 5.472 4.616 17.470 1.00 0.00 C ATOM 359 CG LYS A 27 6.683 3.815 17.954 1.00 0.00 C ATOM 360 CD LYS A 27 7.039 4.179 19.397 1.00 0.00 C ATOM 361 CE LYS A 27 7.233 2.923 20.248 1.00 0.00 C ATOM 362 NZ LYS A 27 7.462 3.286 21.664 1.00 0.00 N ATOM 0 H LYS A 27 6.463 6.830 18.098 1.00 0.00 H new ATOM 0 HA LYS A 27 6.524 5.156 15.727 1.00 0.00 H new ATOM 0 HB2 LYS A 27 4.987 5.098 18.319 1.00 0.00 H new ATOM 0 HB3 LYS A 27 4.740 3.942 17.025 1.00 0.00 H new ATOM 0 HG2 LYS A 27 6.469 2.748 17.886 1.00 0.00 H new ATOM 0 HG3 LYS A 27 7.536 4.011 17.305 1.00 0.00 H new ATOM 0 HD2 LYS A 27 7.951 4.776 19.411 1.00 0.00 H new ATOM 0 HD3 LYS A 27 6.248 4.795 19.826 1.00 0.00 H new ATOM 0 HE2 LYS A 27 6.354 2.283 20.168 1.00 0.00 H new ATOM 0 HE3 LYS A 27 8.080 2.349 19.872 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 7.592 2.421 22.227 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 8.314 3.878 21.737 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 6.642 3.814 22.024 1.00 0.00 H new ATOM 376 N PRO A 28 4.799 6.128 14.312 1.00 0.00 N ATOM 377 CA PRO A 28 3.756 6.643 13.441 1.00 0.00 C ATOM 378 C PRO A 28 2.512 5.755 13.491 1.00 0.00 C ATOM 379 O PRO A 28 2.542 4.670 14.071 1.00 0.00 O ATOM 380 CB PRO A 28 4.390 6.701 12.061 1.00 0.00 C ATOM 381 CG PRO A 28 5.602 5.786 12.119 1.00 0.00 C ATOM 382 CD PRO A 28 5.884 5.478 13.581 1.00 0.00 C ATOM 0 HA PRO A 28 3.403 7.629 13.744 1.00 0.00 H new ATOM 0 HB2 PRO A 28 3.688 6.371 11.295 1.00 0.00 H new ATOM 0 HB3 PRO A 28 4.682 7.720 11.808 1.00 0.00 H new ATOM 0 HG2 PRO A 28 5.413 4.867 11.565 1.00 0.00 H new ATOM 0 HG3 PRO A 28 6.465 6.265 11.657 1.00 0.00 H new ATOM 0 HD2 PRO A 28 5.897 4.404 13.764 1.00 0.00 H new ATOM 0 HD3 PRO A 28 6.856 5.865 13.887 1.00 0.00 H new ATOM 390 N LYS A 29 1.447 6.247 12.876 1.00 0.00 N ATOM 391 CA LYS A 29 0.194 5.512 12.843 1.00 0.00 C ATOM 392 C LYS A 29 0.366 4.259 11.982 1.00 0.00 C ATOM 393 O LYS A 29 1.223 4.219 11.101 1.00 0.00 O ATOM 394 CB LYS A 29 -0.949 6.420 12.385 1.00 0.00 C ATOM 395 CG LYS A 29 -2.059 6.476 13.436 1.00 0.00 C ATOM 396 CD LYS A 29 -3.439 6.403 12.780 1.00 0.00 C ATOM 397 CE LYS A 29 -4.308 7.592 13.194 1.00 0.00 C ATOM 398 NZ LYS A 29 -5.096 7.263 14.403 1.00 0.00 N ATOM 0 H LYS A 29 1.426 7.147 12.396 1.00 0.00 H new ATOM 0 HA LYS A 29 -0.078 5.178 13.844 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -0.568 7.424 12.199 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -1.354 6.053 11.442 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -1.942 5.650 14.138 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -1.974 7.398 14.011 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -3.330 6.388 11.696 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -3.931 5.473 13.063 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -3.678 8.460 13.389 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -4.979 7.861 12.378 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -5.680 8.081 14.670 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -5.711 6.448 14.205 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -4.451 7.028 15.184 1.00 0.00 H new ATOM 412 N LEU A 30 -0.462 3.265 12.268 1.00 0.00 N ATOM 413 CA LEU A 30 -0.413 2.014 11.532 1.00 0.00 C ATOM 414 C LEU A 30 -1.826 1.634 11.085 1.00 0.00 C ATOM 415 O LEU A 30 -2.803 1.968 11.753 1.00 0.00 O ATOM 416 CB LEU A 30 0.282 0.931 12.360 1.00 0.00 C ATOM 417 CG LEU A 30 1.261 0.032 11.603 1.00 0.00 C ATOM 418 CD1 LEU A 30 0.585 -1.271 11.169 1.00 0.00 C ATOM 419 CD2 LEU A 30 1.885 0.775 10.420 1.00 0.00 C ATOM 0 H LEU A 30 -1.171 3.301 13.000 1.00 0.00 H new ATOM 0 HA LEU A 30 0.188 2.127 10.630 1.00 0.00 H new ATOM 0 HB2 LEU A 30 0.820 1.414 13.175 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -0.483 0.301 12.813 1.00 0.00 H new ATOM 0 HG LEU A 30 2.073 -0.236 12.280 1.00 0.00 H new ATOM 0 HD11 LEU A 30 1.303 -1.892 10.633 1.00 0.00 H new ATOM 0 HD12 LEU A 30 0.228 -1.806 12.049 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -0.257 -1.044 10.516 1.00 0.00 H new ATOM 0 HD21 LEU A 30 2.577 0.113 9.899 1.00 0.00 H new ATOM 0 HD22 LEU A 30 1.099 1.092 9.734 1.00 0.00 H new ATOM 0 HD23 LEU A 30 2.424 1.650 10.783 1.00 0.00 H new ATOM 431 N TYR A 31 -1.889 0.940 9.957 1.00 0.00 N ATOM 432 CA TYR A 31 -3.166 0.512 9.413 1.00 0.00 C ATOM 433 C TYR A 31 -3.034 -0.835 8.700 1.00 0.00 C ATOM 434 O TYR A 31 -2.488 -0.908 7.600 1.00 0.00 O ATOM 435 CB TYR A 31 -3.570 1.578 8.393 1.00 0.00 C ATOM 436 CG TYR A 31 -4.042 2.892 9.020 1.00 0.00 C ATOM 437 CD1 TYR A 31 -5.137 2.901 9.859 1.00 0.00 C ATOM 438 CD2 TYR A 31 -3.372 4.067 8.745 1.00 0.00 C ATOM 439 CE1 TYR A 31 -5.581 4.138 10.449 1.00 0.00 C ATOM 440 CE2 TYR A 31 -3.816 5.303 9.335 1.00 0.00 C ATOM 441 CZ TYR A 31 -4.899 5.278 10.158 1.00 0.00 C ATOM 442 OH TYR A 31 -5.318 6.445 10.715 1.00 0.00 O ATOM 0 H TYR A 31 -1.076 0.664 9.406 1.00 0.00 H new ATOM 0 HA TYR A 31 -3.902 0.396 10.209 1.00 0.00 H new ATOM 0 HB2 TYR A 31 -2.721 1.783 7.741 1.00 0.00 H new ATOM 0 HB3 TYR A 31 -4.366 1.181 7.764 1.00 0.00 H new ATOM 0 HD1 TYR A 31 -5.661 1.981 10.073 1.00 0.00 H new ATOM 0 HD2 TYR A 31 -2.515 4.059 8.088 1.00 0.00 H new ATOM 0 HE1 TYR A 31 -6.437 4.160 11.108 1.00 0.00 H new ATOM 0 HE2 TYR A 31 -3.301 6.229 9.129 1.00 0.00 H new ATOM 0 HH TYR A 31 -6.101 6.276 11.279 1.00 0.00 H new ATOM 452 N ARG A 32 -3.543 -1.869 9.355 1.00 0.00 N ATOM 453 CA ARG A 32 -3.488 -3.209 8.797 1.00 0.00 C ATOM 454 C ARG A 32 -4.533 -3.367 7.691 1.00 0.00 C ATOM 455 O ARG A 32 -5.719 -3.129 7.914 1.00 0.00 O ATOM 456 CB ARG A 32 -3.734 -4.265 9.876 1.00 0.00 C ATOM 457 CG ARG A 32 -2.994 -3.912 11.168 1.00 0.00 C ATOM 458 CD ARG A 32 -2.278 -5.137 11.742 1.00 0.00 C ATOM 459 NE ARG A 32 -2.491 -5.208 13.205 1.00 0.00 N ATOM 460 CZ ARG A 32 -2.290 -6.310 13.940 1.00 0.00 C ATOM 461 NH1 ARG A 32 -1.869 -7.439 13.354 1.00 0.00 N ATOM 462 NH2 ARG A 32 -2.509 -6.283 15.262 1.00 0.00 N ATOM 0 H ARG A 32 -3.995 -1.805 10.267 1.00 0.00 H new ATOM 0 HA ARG A 32 -2.491 -3.355 8.382 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -4.803 -4.345 10.075 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -3.403 -5.240 9.518 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -2.270 -3.122 10.972 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -3.700 -3.522 11.901 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -2.653 -6.044 11.267 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -1.212 -5.081 11.524 1.00 0.00 H new ATOM 0 HE ARG A 32 -2.811 -4.366 13.683 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -1.701 -7.460 12.348 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -1.716 -8.278 13.914 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -2.829 -5.423 15.709 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -2.356 -7.122 15.822 1.00 0.00 H new ATOM 476 N LEU A 33 -4.055 -3.767 6.522 1.00 0.00 N ATOM 477 CA LEU A 33 -4.934 -3.959 5.381 1.00 0.00 C ATOM 478 C LEU A 33 -5.483 -5.387 5.400 1.00 0.00 C ATOM 479 O LEU A 33 -5.042 -6.236 4.627 1.00 0.00 O ATOM 480 CB LEU A 33 -4.212 -3.595 4.082 1.00 0.00 C ATOM 481 CG LEU A 33 -3.488 -2.247 4.071 1.00 0.00 C ATOM 482 CD1 LEU A 33 -2.873 -1.966 2.699 1.00 0.00 C ATOM 483 CD2 LEU A 33 -4.420 -1.121 4.524 1.00 0.00 C ATOM 0 H LEU A 33 -3.071 -3.963 6.340 1.00 0.00 H new ATOM 0 HA LEU A 33 -5.790 -3.287 5.442 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -3.485 -4.377 3.862 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -4.940 -3.600 3.271 1.00 0.00 H new ATOM 0 HG LEU A 33 -2.668 -2.294 4.787 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -2.365 -1.002 2.719 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -2.156 -2.750 2.454 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -3.660 -1.946 1.945 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -3.881 -0.174 4.507 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -5.275 -1.064 3.851 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -4.768 -1.322 5.537 1.00 0.00 H new ATOM 495 N GLN A 34 -6.438 -5.608 6.292 1.00 0.00 N ATOM 496 CA GLN A 34 -7.052 -6.918 6.422 1.00 0.00 C ATOM 497 C GLN A 34 -7.780 -7.294 5.129 1.00 0.00 C ATOM 498 O GLN A 34 -8.049 -6.434 4.292 1.00 0.00 O ATOM 499 CB GLN A 34 -8.003 -6.962 7.619 1.00 0.00 C ATOM 500 CG GLN A 34 -7.245 -6.736 8.929 1.00 0.00 C ATOM 501 CD GLN A 34 -8.091 -7.159 10.132 1.00 0.00 C ATOM 502 OE1 GLN A 34 -9.217 -6.726 10.315 1.00 0.00 O ATOM 503 NE2 GLN A 34 -7.488 -8.027 10.939 1.00 0.00 N ATOM 0 H GLN A 34 -6.801 -4.901 6.932 1.00 0.00 H new ATOM 0 HA GLN A 34 -6.264 -7.650 6.599 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -8.774 -6.200 7.504 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -8.510 -7.926 7.650 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -6.314 -7.303 8.917 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -6.976 -5.684 9.021 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -6.544 -8.349 10.727 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -7.970 -8.371 11.770 1.00 0.00 H new ATOM 512 N LEU A 35 -8.078 -8.579 5.008 1.00 0.00 N ATOM 513 CA LEU A 35 -8.770 -9.079 3.832 1.00 0.00 C ATOM 514 C LEU A 35 -9.914 -8.128 3.476 1.00 0.00 C ATOM 515 O LEU A 35 -10.291 -7.277 4.280 1.00 0.00 O ATOM 516 CB LEU A 35 -9.218 -10.526 4.049 1.00 0.00 C ATOM 517 CG LEU A 35 -8.272 -11.607 3.521 1.00 0.00 C ATOM 518 CD1 LEU A 35 -8.667 -12.987 4.051 1.00 0.00 C ATOM 519 CD2 LEU A 35 -8.203 -11.577 1.993 1.00 0.00 C ATOM 0 H LEU A 35 -7.853 -9.289 5.705 1.00 0.00 H new ATOM 0 HA LEU A 35 -8.097 -9.103 2.975 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -9.359 -10.685 5.118 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -10.191 -10.659 3.575 1.00 0.00 H new ATOM 0 HG LEU A 35 -7.269 -11.395 3.892 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -7.979 -13.737 3.661 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -8.622 -12.985 5.140 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -9.682 -13.223 3.730 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -7.524 -12.355 1.644 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -9.197 -11.751 1.580 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -7.839 -10.604 1.664 1.00 0.00 H new ATOM 531 N SER A 36 -10.434 -8.304 2.270 1.00 0.00 N ATOM 532 CA SER A 36 -11.527 -7.472 1.797 1.00 0.00 C ATOM 533 C SER A 36 -10.975 -6.205 1.142 1.00 0.00 C ATOM 534 O SER A 36 -9.837 -6.188 0.675 1.00 0.00 O ATOM 535 CB SER A 36 -12.476 -7.108 2.941 1.00 0.00 C ATOM 536 OG SER A 36 -12.658 -8.191 3.849 1.00 0.00 O ATOM 0 H SER A 36 -10.118 -9.011 1.606 1.00 0.00 H new ATOM 0 HA SER A 36 -12.093 -8.038 1.057 1.00 0.00 H new ATOM 0 HB2 SER A 36 -12.081 -6.246 3.479 1.00 0.00 H new ATOM 0 HB3 SER A 36 -13.442 -6.813 2.531 1.00 0.00 H new ATOM 0 HG SER A 36 -12.037 -8.095 4.601 1.00 0.00 H new ATOM 542 N VAL A 37 -11.806 -5.173 1.129 1.00 0.00 N ATOM 543 CA VAL A 37 -11.415 -3.904 0.539 1.00 0.00 C ATOM 544 C VAL A 37 -11.418 -2.822 1.620 1.00 0.00 C ATOM 545 O VAL A 37 -12.265 -2.832 2.512 1.00 0.00 O ATOM 546 CB VAL A 37 -12.330 -3.573 -0.642 1.00 0.00 C ATOM 547 CG1 VAL A 37 -13.794 -3.509 -0.201 1.00 0.00 C ATOM 548 CG2 VAL A 37 -11.903 -2.267 -1.317 1.00 0.00 C ATOM 0 H VAL A 37 -12.749 -5.190 1.518 1.00 0.00 H new ATOM 0 HA VAL A 37 -10.402 -3.963 0.141 1.00 0.00 H new ATOM 0 HB VAL A 37 -12.236 -4.375 -1.374 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -14.423 -3.272 -1.059 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -14.092 -4.473 0.212 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -13.912 -2.736 0.559 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -12.569 -2.055 -2.153 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -11.954 -1.451 -0.596 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -10.881 -2.364 -1.683 1.00 0.00 H new ATOM 558 N THR A 38 -10.462 -1.912 1.504 1.00 0.00 N ATOM 559 CA THR A 38 -10.343 -0.825 2.460 1.00 0.00 C ATOM 560 C THR A 38 -10.398 0.525 1.742 1.00 0.00 C ATOM 561 O THR A 38 -9.420 0.944 1.125 1.00 0.00 O ATOM 562 CB THR A 38 -9.056 -1.036 3.259 1.00 0.00 C ATOM 563 OG1 THR A 38 -9.381 -2.081 4.172 1.00 0.00 O ATOM 564 CG2 THR A 38 -8.724 0.155 4.160 1.00 0.00 C ATOM 0 H THR A 38 -9.762 -1.905 0.762 1.00 0.00 H new ATOM 0 HA THR A 38 -11.179 -0.820 3.159 1.00 0.00 H new ATOM 0 HB THR A 38 -8.228 -1.214 2.572 1.00 0.00 H new ATOM 0 HG1 THR A 38 -9.847 -1.705 4.948 1.00 0.00 H new ATOM 0 HG21 THR A 38 -7.802 -0.047 4.705 1.00 0.00 H new ATOM 0 HG22 THR A 38 -8.597 1.049 3.549 1.00 0.00 H new ATOM 0 HG23 THR A 38 -9.537 0.313 4.869 1.00 0.00 H new ATOM 572 N GLU A 39 -11.552 1.168 1.847 1.00 0.00 N ATOM 573 CA GLU A 39 -11.747 2.462 1.215 1.00 0.00 C ATOM 574 C GLU A 39 -11.018 3.553 2.003 1.00 0.00 C ATOM 575 O GLU A 39 -11.315 3.781 3.174 1.00 0.00 O ATOM 576 CB GLU A 39 -13.236 2.787 1.079 1.00 0.00 C ATOM 577 CG GLU A 39 -13.967 1.691 0.301 1.00 0.00 C ATOM 578 CD GLU A 39 -14.523 0.625 1.248 1.00 0.00 C ATOM 579 OE1 GLU A 39 -13.907 0.440 2.319 1.00 0.00 O ATOM 580 OE2 GLU A 39 -15.551 0.018 0.878 1.00 0.00 O ATOM 0 H GLU A 39 -12.361 0.817 2.360 1.00 0.00 H new ATOM 0 HA GLU A 39 -11.324 2.421 0.211 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -13.681 2.894 2.068 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -13.358 3.743 0.570 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -14.781 2.130 -0.276 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -13.284 1.229 -0.412 1.00 0.00 H new ATOM 587 N VAL A 40 -10.078 4.197 1.327 1.00 0.00 N ATOM 588 CA VAL A 40 -9.304 5.258 1.949 1.00 0.00 C ATOM 589 C VAL A 40 -9.942 6.609 1.620 1.00 0.00 C ATOM 590 O VAL A 40 -10.815 6.694 0.757 1.00 0.00 O ATOM 591 CB VAL A 40 -7.841 5.166 1.510 1.00 0.00 C ATOM 592 CG1 VAL A 40 -7.011 6.293 2.128 1.00 0.00 C ATOM 593 CG2 VAL A 40 -7.251 3.797 1.856 1.00 0.00 C ATOM 0 H VAL A 40 -9.835 4.005 0.355 1.00 0.00 H new ATOM 0 HA VAL A 40 -9.311 5.150 3.034 1.00 0.00 H new ATOM 0 HB VAL A 40 -7.808 5.282 0.427 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -5.975 6.204 1.800 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -7.411 7.256 1.810 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -7.054 6.223 3.215 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -6.211 3.757 1.534 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -7.303 3.640 2.933 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -7.818 3.017 1.348 1.00 0.00 H new ATOM 603 N GLY A 41 -9.482 7.633 2.325 1.00 0.00 N ATOM 604 CA GLY A 41 -9.997 8.975 2.119 1.00 0.00 C ATOM 605 C GLY A 41 -10.384 9.625 3.449 1.00 0.00 C ATOM 606 O GLY A 41 -9.743 9.384 4.471 1.00 0.00 O ATOM 0 H GLY A 41 -8.758 7.559 3.040 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -9.244 9.584 1.618 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -10.866 8.938 1.462 1.00 0.00 H new ATOM 610 N THR A 42 -11.430 10.436 3.393 1.00 0.00 N ATOM 611 CA THR A 42 -11.910 11.122 4.581 1.00 0.00 C ATOM 612 C THR A 42 -13.286 10.590 4.985 1.00 0.00 C ATOM 613 O THR A 42 -13.779 10.893 6.071 1.00 0.00 O ATOM 614 CB THR A 42 -11.899 12.625 4.296 1.00 0.00 C ATOM 615 OG1 THR A 42 -12.616 12.751 3.071 1.00 0.00 O ATOM 616 CG2 THR A 42 -10.500 13.148 3.964 1.00 0.00 C ATOM 0 H THR A 42 -11.959 10.634 2.543 1.00 0.00 H new ATOM 0 HA THR A 42 -11.260 10.934 5.436 1.00 0.00 H new ATOM 0 HB THR A 42 -12.291 13.161 5.160 1.00 0.00 H new ATOM 0 HG1 THR A 42 -12.658 13.695 2.812 1.00 0.00 H new ATOM 0 HG21 THR A 42 -10.549 14.220 3.770 1.00 0.00 H new ATOM 0 HG22 THR A 42 -9.833 12.961 4.805 1.00 0.00 H new ATOM 0 HG23 THR A 42 -10.121 12.636 3.080 1.00 0.00 H new ATOM 624 N GLU A 43 -13.868 9.806 4.089 1.00 0.00 N ATOM 625 CA GLU A 43 -15.178 9.229 4.339 1.00 0.00 C ATOM 626 C GLU A 43 -15.048 7.965 5.191 1.00 0.00 C ATOM 627 O GLU A 43 -14.033 7.273 5.130 1.00 0.00 O ATOM 628 CB GLU A 43 -15.906 8.932 3.026 1.00 0.00 C ATOM 629 CG GLU A 43 -17.219 9.712 2.939 1.00 0.00 C ATOM 630 CD GLU A 43 -18.417 8.800 3.214 1.00 0.00 C ATOM 631 OE1 GLU A 43 -18.531 8.346 4.373 1.00 0.00 O ATOM 632 OE2 GLU A 43 -19.192 8.578 2.259 1.00 0.00 O ATOM 0 H GLU A 43 -13.457 9.557 3.189 1.00 0.00 H new ATOM 0 HA GLU A 43 -15.774 9.956 4.891 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -15.266 9.195 2.184 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -16.108 7.863 2.952 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -17.208 10.531 3.658 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -17.316 10.158 1.949 1.00 0.00 H new ATOM 639 N LYS A 44 -16.090 7.703 5.967 1.00 0.00 N ATOM 640 CA LYS A 44 -16.105 6.535 6.830 1.00 0.00 C ATOM 641 C LYS A 44 -16.977 5.448 6.197 1.00 0.00 C ATOM 642 O LYS A 44 -18.190 5.613 6.077 1.00 0.00 O ATOM 643 CB LYS A 44 -16.536 6.921 8.247 1.00 0.00 C ATOM 644 CG LYS A 44 -16.631 5.687 9.147 1.00 0.00 C ATOM 645 CD LYS A 44 -15.446 5.619 10.112 1.00 0.00 C ATOM 646 CE LYS A 44 -15.751 4.693 11.290 1.00 0.00 C ATOM 647 NZ LYS A 44 -15.770 5.456 12.558 1.00 0.00 N ATOM 0 H LYS A 44 -16.930 8.280 6.016 1.00 0.00 H new ATOM 0 HA LYS A 44 -15.101 6.122 6.928 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -15.822 7.628 8.668 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -17.502 7.425 8.212 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -17.563 5.715 9.712 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -16.657 4.786 8.534 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -14.562 5.262 9.584 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -15.215 6.618 10.481 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -16.714 4.206 11.137 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -15.000 3.905 11.344 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -15.979 4.812 13.348 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -14.842 5.901 12.710 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -16.503 6.192 12.509 1.00 0.00 H new ATOM 661 N PHE A 45 -16.325 4.362 5.809 1.00 0.00 N ATOM 662 CA PHE A 45 -17.025 3.250 5.191 1.00 0.00 C ATOM 663 C PHE A 45 -17.184 2.088 6.174 1.00 0.00 C ATOM 664 O PHE A 45 -18.295 1.614 6.406 1.00 0.00 O ATOM 665 CB PHE A 45 -16.174 2.787 4.006 1.00 0.00 C ATOM 666 CG PHE A 45 -16.463 3.534 2.703 1.00 0.00 C ATOM 667 CD1 PHE A 45 -16.184 4.862 2.603 1.00 0.00 C ATOM 668 CD2 PHE A 45 -17.000 2.871 1.644 1.00 0.00 C ATOM 669 CE1 PHE A 45 -16.453 5.555 1.393 1.00 0.00 C ATOM 670 CE2 PHE A 45 -17.268 3.564 0.434 1.00 0.00 C ATOM 671 CZ PHE A 45 -16.989 4.891 0.334 1.00 0.00 C ATOM 0 H PHE A 45 -15.319 4.229 5.911 1.00 0.00 H new ATOM 0 HA PHE A 45 -18.020 3.565 4.878 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -15.121 2.911 4.258 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -16.340 1.722 3.847 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -15.758 5.389 3.444 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -17.223 1.817 1.723 1.00 0.00 H new ATOM 0 HE1 PHE A 45 -16.232 6.609 1.314 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -17.694 3.037 -0.407 1.00 0.00 H new ATOM 0 HZ PHE A 45 -17.193 5.418 -0.586 1.00 0.00 H new ATOM 681 N ASP A 46 -16.057 1.663 6.725 1.00 0.00 N ATOM 682 CA ASP A 46 -16.057 0.565 7.677 1.00 0.00 C ATOM 683 C ASP A 46 -15.114 0.900 8.834 1.00 0.00 C ATOM 684 O ASP A 46 -14.412 1.909 8.796 1.00 0.00 O ATOM 685 CB ASP A 46 -15.565 -0.729 7.026 1.00 0.00 C ATOM 686 CG ASP A 46 -16.165 -1.030 5.652 1.00 0.00 C ATOM 687 OD1 ASP A 46 -17.318 -0.601 5.429 1.00 0.00 O ATOM 688 OD2 ASP A 46 -15.457 -1.682 4.854 1.00 0.00 O ATOM 0 H ASP A 46 -15.137 2.059 6.531 1.00 0.00 H new ATOM 0 HA ASP A 46 -17.079 0.425 8.030 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -14.480 -0.680 6.929 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -15.788 -1.561 7.693 1.00 0.00 H new ATOM 693 N ASP A 47 -15.128 0.034 9.837 1.00 0.00 N ATOM 694 CA ASP A 47 -14.283 0.226 11.004 1.00 0.00 C ATOM 695 C ASP A 47 -12.828 -0.059 10.626 1.00 0.00 C ATOM 696 O ASP A 47 -11.907 0.392 11.306 1.00 0.00 O ATOM 697 CB ASP A 47 -14.675 -0.732 12.131 1.00 0.00 C ATOM 698 CG ASP A 47 -13.931 -0.516 13.450 1.00 0.00 C ATOM 699 OD1 ASP A 47 -12.686 -0.631 13.425 1.00 0.00 O ATOM 700 OD2 ASP A 47 -14.623 -0.242 14.454 1.00 0.00 O ATOM 0 H ASP A 47 -15.711 -0.802 9.866 1.00 0.00 H new ATOM 0 HA ASP A 47 -14.406 1.254 11.345 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -15.745 -0.635 12.315 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -14.501 -1.754 11.796 1.00 0.00 H new ATOM 705 N ASN A 48 -12.666 -0.805 9.543 1.00 0.00 N ATOM 706 CA ASN A 48 -11.339 -1.154 9.067 1.00 0.00 C ATOM 707 C ASN A 48 -11.037 -0.370 7.788 1.00 0.00 C ATOM 708 O ASN A 48 -10.691 -0.956 6.763 1.00 0.00 O ATOM 709 CB ASN A 48 -11.247 -2.646 8.739 1.00 0.00 C ATOM 710 CG ASN A 48 -11.127 -3.481 10.015 1.00 0.00 C ATOM 711 OD1 ASN A 48 -10.104 -3.504 10.679 1.00 0.00 O ATOM 712 ND2 ASN A 48 -12.226 -4.165 10.320 1.00 0.00 N ATOM 0 H ASN A 48 -13.432 -1.177 8.982 1.00 0.00 H new ATOM 0 HA ASN A 48 -10.624 -0.912 9.854 1.00 0.00 H new ATOM 0 HB2 ASN A 48 -12.131 -2.954 8.180 1.00 0.00 H new ATOM 0 HB3 ASN A 48 -10.384 -2.829 8.098 1.00 0.00 H new ATOM 0 HD21 ASN A 48 -12.246 -4.753 11.153 1.00 0.00 H new ATOM 0 HD22 ASN A 48 -13.049 -4.101 9.721 1.00 0.00 H new ATOM 719 N SER A 49 -11.179 0.943 7.891 1.00 0.00 N ATOM 720 CA SER A 49 -10.926 1.814 6.755 1.00 0.00 C ATOM 721 C SER A 49 -9.942 2.917 7.150 1.00 0.00 C ATOM 722 O SER A 49 -9.877 3.308 8.315 1.00 0.00 O ATOM 723 CB SER A 49 -12.226 2.426 6.230 1.00 0.00 C ATOM 724 OG SER A 49 -13.177 1.429 5.865 1.00 0.00 O ATOM 0 H SER A 49 -11.466 1.425 8.743 1.00 0.00 H new ATOM 0 HA SER A 49 -10.489 1.215 5.956 1.00 0.00 H new ATOM 0 HB2 SER A 49 -12.656 3.074 6.994 1.00 0.00 H new ATOM 0 HB3 SER A 49 -12.008 3.053 5.365 1.00 0.00 H new ATOM 0 HG SER A 49 -13.519 1.617 4.966 1.00 0.00 H new ATOM 730 N ILE A 50 -9.200 3.387 6.158 1.00 0.00 N ATOM 731 CA ILE A 50 -8.222 4.437 6.388 1.00 0.00 C ATOM 732 C ILE A 50 -8.904 5.800 6.256 1.00 0.00 C ATOM 733 O ILE A 50 -9.433 6.134 5.197 1.00 0.00 O ATOM 734 CB ILE A 50 -7.018 4.260 5.461 1.00 0.00 C ATOM 735 CG1 ILE A 50 -6.448 2.844 5.568 1.00 0.00 C ATOM 736 CG2 ILE A 50 -5.956 5.327 5.732 1.00 0.00 C ATOM 737 CD1 ILE A 50 -5.290 2.644 4.589 1.00 0.00 C ATOM 0 H ILE A 50 -9.256 3.060 5.193 1.00 0.00 H new ATOM 0 HA ILE A 50 -7.827 4.374 7.402 1.00 0.00 H new ATOM 0 HB ILE A 50 -7.355 4.395 4.433 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -6.104 2.663 6.586 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -7.233 2.116 5.363 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -5.111 5.178 5.060 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -6.383 6.316 5.565 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -5.616 5.248 6.765 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -4.903 1.630 4.685 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -5.643 2.802 3.570 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -4.497 3.358 4.813 1.00 0.00 H new ATOM 749 N GLN A 51 -8.869 6.552 7.347 1.00 0.00 N ATOM 750 CA GLN A 51 -9.477 7.871 7.367 1.00 0.00 C ATOM 751 C GLN A 51 -8.404 8.948 7.543 1.00 0.00 C ATOM 752 O GLN A 51 -7.960 9.211 8.660 1.00 0.00 O ATOM 753 CB GLN A 51 -10.538 7.970 8.465 1.00 0.00 C ATOM 754 CG GLN A 51 -11.737 8.796 7.996 1.00 0.00 C ATOM 755 CD GLN A 51 -12.921 8.636 8.952 1.00 0.00 C ATOM 756 OE1 GLN A 51 -12.910 7.826 9.864 1.00 0.00 O ATOM 757 NE2 GLN A 51 -13.939 9.452 8.694 1.00 0.00 N ATOM 0 H GLN A 51 -8.429 6.272 8.223 1.00 0.00 H new ATOM 0 HA GLN A 51 -9.975 8.034 6.411 1.00 0.00 H new ATOM 0 HB2 GLN A 51 -10.869 6.970 8.747 1.00 0.00 H new ATOM 0 HB3 GLN A 51 -10.104 8.425 9.355 1.00 0.00 H new ATOM 0 HG2 GLN A 51 -11.456 9.847 7.932 1.00 0.00 H new ATOM 0 HG3 GLN A 51 -12.029 8.483 6.994 1.00 0.00 H new ATOM 0 HE21 GLN A 51 -13.883 10.107 7.914 1.00 0.00 H new ATOM 0 HE22 GLN A 51 -14.776 9.423 9.276 1.00 0.00 H new ATOM 766 N LEU A 52 -8.017 9.541 6.423 1.00 0.00 N ATOM 767 CA LEU A 52 -7.004 10.583 6.440 1.00 0.00 C ATOM 768 C LEU A 52 -7.686 11.952 6.420 1.00 0.00 C ATOM 769 O LEU A 52 -8.886 12.048 6.166 1.00 0.00 O ATOM 770 CB LEU A 52 -6.005 10.377 5.299 1.00 0.00 C ATOM 771 CG LEU A 52 -5.286 9.027 5.272 1.00 0.00 C ATOM 772 CD1 LEU A 52 -5.223 8.411 6.671 1.00 0.00 C ATOM 773 CD2 LEU A 52 -5.932 8.081 4.258 1.00 0.00 C ATOM 0 H LEU A 52 -8.386 9.320 5.498 1.00 0.00 H new ATOM 0 HA LEU A 52 -6.420 10.531 7.359 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -6.532 10.504 4.354 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -5.254 11.165 5.354 1.00 0.00 H new ATOM 0 HG LEU A 52 -4.259 9.194 4.947 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -4.707 7.452 6.623 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -4.683 9.081 7.340 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -6.235 8.260 7.048 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -5.401 7.129 4.259 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -6.975 7.916 4.528 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -5.881 8.524 3.263 1.00 0.00 H new ATOM 785 N PHE A 53 -6.892 12.977 6.693 1.00 0.00 N ATOM 786 CA PHE A 53 -7.405 14.336 6.710 1.00 0.00 C ATOM 787 C PHE A 53 -6.341 15.330 6.238 1.00 0.00 C ATOM 788 O PHE A 53 -5.335 15.536 6.915 1.00 0.00 O ATOM 789 CB PHE A 53 -7.776 14.656 8.160 1.00 0.00 C ATOM 790 CG PHE A 53 -8.535 13.533 8.870 1.00 0.00 C ATOM 791 CD1 PHE A 53 -9.838 13.293 8.563 1.00 0.00 C ATOM 792 CD2 PHE A 53 -7.906 12.775 9.808 1.00 0.00 C ATOM 793 CE1 PHE A 53 -10.542 12.251 9.223 1.00 0.00 C ATOM 794 CE2 PHE A 53 -8.610 11.733 10.467 1.00 0.00 C ATOM 795 CZ PHE A 53 -9.913 11.493 10.160 1.00 0.00 C ATOM 0 H PHE A 53 -5.898 12.894 6.904 1.00 0.00 H new ATOM 0 HA PHE A 53 -8.263 14.418 6.042 1.00 0.00 H new ATOM 0 HB2 PHE A 53 -6.865 14.874 8.718 1.00 0.00 H new ATOM 0 HB3 PHE A 53 -8.385 15.560 8.178 1.00 0.00 H new ATOM 0 HD1 PHE A 53 -10.337 13.895 7.818 1.00 0.00 H new ATOM 0 HD2 PHE A 53 -6.871 12.966 10.051 1.00 0.00 H new ATOM 0 HE1 PHE A 53 -11.577 12.061 8.981 1.00 0.00 H new ATOM 0 HE2 PHE A 53 -8.111 11.131 11.212 1.00 0.00 H new ATOM 0 HZ PHE A 53 -10.448 10.700 10.661 1.00 0.00 H new ATOM 805 N GLY A 54 -6.599 15.917 5.079 1.00 0.00 N ATOM 806 CA GLY A 54 -5.676 16.884 4.508 1.00 0.00 C ATOM 807 C GLY A 54 -6.395 17.820 3.535 1.00 0.00 C ATOM 808 O GLY A 54 -7.481 17.504 3.051 1.00 0.00 O ATOM 0 H GLY A 54 -7.434 15.742 4.519 1.00 0.00 H new ATOM 0 HA2 GLY A 54 -5.215 17.467 5.305 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -4.872 16.362 3.989 1.00 0.00 H new ATOM 812 N PRO A 55 -5.744 18.984 3.270 1.00 0.00 N ATOM 813 CA PRO A 55 -6.310 19.969 2.363 1.00 0.00 C ATOM 814 C PRO A 55 -6.169 19.519 0.908 1.00 0.00 C ATOM 815 O PRO A 55 -5.113 19.690 0.301 1.00 0.00 O ATOM 816 CB PRO A 55 -5.559 21.256 2.662 1.00 0.00 C ATOM 817 CG PRO A 55 -4.291 20.840 3.390 1.00 0.00 C ATOM 818 CD PRO A 55 -4.457 19.392 3.825 1.00 0.00 C ATOM 0 HA PRO A 55 -7.382 20.106 2.506 1.00 0.00 H new ATOM 0 HB2 PRO A 55 -5.323 21.793 1.743 1.00 0.00 H new ATOM 0 HB3 PRO A 55 -6.161 21.925 3.277 1.00 0.00 H new ATOM 0 HG2 PRO A 55 -3.424 20.946 2.738 1.00 0.00 H new ATOM 0 HG3 PRO A 55 -4.119 21.481 4.255 1.00 0.00 H new ATOM 0 HD2 PRO A 55 -3.647 18.769 3.446 1.00 0.00 H new ATOM 0 HD3 PRO A 55 -4.447 19.301 4.911 1.00 0.00 H new ATOM 826 N GLY A 56 -7.249 18.952 0.390 1.00 0.00 N ATOM 827 CA GLY A 56 -7.259 18.476 -0.983 1.00 0.00 C ATOM 828 C GLY A 56 -7.617 16.989 -1.045 1.00 0.00 C ATOM 829 O GLY A 56 -7.614 16.391 -2.119 1.00 0.00 O ATOM 0 H GLY A 56 -8.123 18.812 0.896 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -7.978 19.052 -1.566 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -6.280 18.637 -1.435 1.00 0.00 H new ATOM 833 N ILE A 57 -7.916 16.436 0.121 1.00 0.00 N ATOM 834 CA ILE A 57 -8.276 15.031 0.213 1.00 0.00 C ATOM 835 C ILE A 57 -9.766 14.870 -0.093 1.00 0.00 C ATOM 836 O ILE A 57 -10.551 15.791 0.123 1.00 0.00 O ATOM 837 CB ILE A 57 -7.861 14.460 1.570 1.00 0.00 C ATOM 838 CG1 ILE A 57 -6.442 14.897 1.939 1.00 0.00 C ATOM 839 CG2 ILE A 57 -8.016 12.938 1.595 1.00 0.00 C ATOM 840 CD1 ILE A 57 -5.399 14.054 1.202 1.00 0.00 C ATOM 0 H ILE A 57 -7.916 16.935 1.010 1.00 0.00 H new ATOM 0 HA ILE A 57 -7.733 14.448 -0.531 1.00 0.00 H new ATOM 0 HB ILE A 57 -8.530 14.865 2.329 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -6.306 15.949 1.690 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -6.297 14.802 3.015 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -7.714 12.558 2.571 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -9.057 12.675 1.409 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -7.387 12.495 0.823 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -4.399 14.385 1.482 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -5.522 13.005 1.472 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -5.531 14.170 0.126 1.00 0.00 H new ATOM 852 N GLN A 58 -10.111 13.692 -0.592 1.00 0.00 N ATOM 853 CA GLN A 58 -11.493 13.397 -0.930 1.00 0.00 C ATOM 854 C GLN A 58 -12.037 12.291 -0.024 1.00 0.00 C ATOM 855 O GLN A 58 -11.310 11.754 0.811 1.00 0.00 O ATOM 856 CB GLN A 58 -11.627 13.013 -2.405 1.00 0.00 C ATOM 857 CG GLN A 58 -10.382 13.423 -3.193 1.00 0.00 C ATOM 858 CD GLN A 58 -10.268 14.946 -3.285 1.00 0.00 C ATOM 859 OE1 GLN A 58 -11.117 15.688 -2.818 1.00 0.00 O ATOM 860 NE2 GLN A 58 -9.173 15.370 -3.911 1.00 0.00 N ATOM 0 H GLN A 58 -9.457 12.930 -0.770 1.00 0.00 H new ATOM 0 HA GLN A 58 -12.086 14.297 -0.768 1.00 0.00 H new ATOM 0 HB2 GLN A 58 -11.779 11.937 -2.492 1.00 0.00 H new ATOM 0 HB3 GLN A 58 -12.507 13.495 -2.832 1.00 0.00 H new ATOM 0 HG2 GLN A 58 -9.492 13.017 -2.712 1.00 0.00 H new ATOM 0 HG3 GLN A 58 -10.425 12.997 -4.195 1.00 0.00 H new ATOM 0 HE21 GLN A 58 -8.502 14.695 -4.278 1.00 0.00 H new ATOM 0 HE22 GLN A 58 -9.005 16.370 -4.023 1.00 0.00 H new ATOM 869 N PRO A 59 -13.345 11.976 -0.223 1.00 0.00 N ATOM 870 CA PRO A 59 -13.994 10.943 0.566 1.00 0.00 C ATOM 871 C PRO A 59 -13.554 9.549 0.115 1.00 0.00 C ATOM 872 O PRO A 59 -12.989 8.789 0.900 1.00 0.00 O ATOM 873 CB PRO A 59 -15.484 11.184 0.380 1.00 0.00 C ATOM 874 CG PRO A 59 -15.614 12.044 -0.867 1.00 0.00 C ATOM 875 CD PRO A 59 -14.236 12.591 -1.202 1.00 0.00 C ATOM 0 HA PRO A 59 -13.724 10.989 1.621 1.00 0.00 H new ATOM 0 HB2 PRO A 59 -16.020 10.242 0.263 1.00 0.00 H new ATOM 0 HB3 PRO A 59 -15.910 11.688 1.248 1.00 0.00 H new ATOM 0 HG2 PRO A 59 -16.003 11.455 -1.698 1.00 0.00 H new ATOM 0 HG3 PRO A 59 -16.317 12.859 -0.697 1.00 0.00 H new ATOM 0 HD2 PRO A 59 -13.944 12.333 -2.220 1.00 0.00 H new ATOM 0 HD3 PRO A 59 -14.213 13.678 -1.130 1.00 0.00 H new ATOM 883 N HIS A 60 -13.828 9.256 -1.148 1.00 0.00 N ATOM 884 CA HIS A 60 -13.467 7.967 -1.712 1.00 0.00 C ATOM 885 C HIS A 60 -12.170 8.103 -2.514 1.00 0.00 C ATOM 886 O HIS A 60 -12.196 8.125 -3.743 1.00 0.00 O ATOM 887 CB HIS A 60 -14.619 7.395 -2.541 1.00 0.00 C ATOM 888 CG HIS A 60 -14.350 6.018 -3.097 1.00 0.00 C ATOM 889 ND1 HIS A 60 -15.301 5.291 -3.793 1.00 0.00 N ATOM 890 CD2 HIS A 60 -13.229 5.242 -3.055 1.00 0.00 C ATOM 891 CE1 HIS A 60 -14.765 4.132 -4.147 1.00 0.00 C ATOM 892 NE2 HIS A 60 -13.481 4.103 -3.688 1.00 0.00 N ATOM 0 H HIS A 60 -14.296 9.889 -1.796 1.00 0.00 H new ATOM 0 HA HIS A 60 -13.284 7.253 -0.909 1.00 0.00 H new ATOM 0 HB2 HIS A 60 -15.515 7.357 -1.921 1.00 0.00 H new ATOM 0 HB3 HIS A 60 -14.831 8.074 -3.367 1.00 0.00 H new ATOM 0 HD1 HIS A 60 -16.252 5.596 -3.998 1.00 0.00 H new ATOM 0 HD2 HIS A 60 -12.294 5.509 -2.586 1.00 0.00 H new ATOM 0 HE1 HIS A 60 -15.258 3.348 -4.702 1.00 0.00 H new ATOM 900 N HIS A 61 -11.068 8.191 -1.784 1.00 0.00 N ATOM 901 CA HIS A 61 -9.764 8.324 -2.411 1.00 0.00 C ATOM 902 C HIS A 61 -9.452 7.062 -3.219 1.00 0.00 C ATOM 903 O HIS A 61 -9.466 7.089 -4.448 1.00 0.00 O ATOM 904 CB HIS A 61 -8.690 8.642 -1.369 1.00 0.00 C ATOM 905 CG HIS A 61 -7.494 9.377 -1.925 1.00 0.00 C ATOM 906 ND1 HIS A 61 -7.196 10.686 -1.589 1.00 0.00 N ATOM 907 CD2 HIS A 61 -6.524 8.973 -2.795 1.00 0.00 C ATOM 908 CE1 HIS A 61 -6.095 11.043 -2.234 1.00 0.00 C ATOM 909 NE2 HIS A 61 -5.681 9.980 -2.982 1.00 0.00 N ATOM 0 H HIS A 61 -11.051 8.173 -0.764 1.00 0.00 H new ATOM 0 HA HIS A 61 -9.774 9.164 -3.105 1.00 0.00 H new ATOM 0 HB2 HIS A 61 -9.135 9.241 -0.575 1.00 0.00 H new ATOM 0 HB3 HIS A 61 -8.352 7.711 -0.914 1.00 0.00 H new ATOM 0 HD1 HIS A 61 -7.733 11.276 -0.953 1.00 0.00 H new ATOM 0 HD2 HIS A 61 -6.454 7.998 -3.254 1.00 0.00 H new ATOM 0 HE1 HIS A 61 -5.610 12.007 -2.177 1.00 0.00 H new ATOM 917 N CYS A 62 -9.178 5.988 -2.494 1.00 0.00 N ATOM 918 CA CYS A 62 -8.862 4.719 -3.128 1.00 0.00 C ATOM 919 C CYS A 62 -9.366 3.592 -2.223 1.00 0.00 C ATOM 920 O CYS A 62 -9.869 3.847 -1.130 1.00 0.00 O ATOM 921 CB CYS A 62 -7.366 4.589 -3.421 1.00 0.00 C ATOM 922 SG CYS A 62 -6.438 4.374 -1.859 1.00 0.00 S ATOM 0 H CYS A 62 -9.168 5.970 -1.474 1.00 0.00 H new ATOM 0 HA CYS A 62 -9.361 4.659 -4.095 1.00 0.00 H new ATOM 0 HB2 CYS A 62 -7.189 3.738 -4.079 1.00 0.00 H new ATOM 0 HB3 CYS A 62 -7.011 5.477 -3.945 1.00 0.00 H new ATOM 0 HG CYS A 62 -5.553 5.320 -1.746 1.00 0.00 H new ATOM 928 N ASP A 63 -9.213 2.370 -2.713 1.00 0.00 N ATOM 929 CA ASP A 63 -9.646 1.204 -1.962 1.00 0.00 C ATOM 930 C ASP A 63 -8.569 0.121 -2.045 1.00 0.00 C ATOM 931 O ASP A 63 -8.198 -0.309 -3.136 1.00 0.00 O ATOM 932 CB ASP A 63 -10.941 0.628 -2.538 1.00 0.00 C ATOM 933 CG ASP A 63 -11.940 1.667 -3.050 1.00 0.00 C ATOM 934 OD1 ASP A 63 -12.543 2.345 -2.190 1.00 0.00 O ATOM 935 OD2 ASP A 63 -12.078 1.761 -4.289 1.00 0.00 O ATOM 0 H ASP A 63 -8.795 2.163 -3.620 1.00 0.00 H new ATOM 0 HA ASP A 63 -9.816 1.511 -0.930 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -10.689 -0.045 -3.357 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -11.427 0.027 -1.769 1.00 0.00 H new ATOM 940 N LEU A 64 -8.096 -0.290 -0.877 1.00 0.00 N ATOM 941 CA LEU A 64 -7.069 -1.315 -0.804 1.00 0.00 C ATOM 942 C LEU A 64 -7.732 -2.688 -0.685 1.00 0.00 C ATOM 943 O LEU A 64 -8.420 -2.967 0.295 1.00 0.00 O ATOM 944 CB LEU A 64 -6.085 -1.007 0.327 1.00 0.00 C ATOM 945 CG LEU A 64 -5.289 0.292 0.189 1.00 0.00 C ATOM 946 CD1 LEU A 64 -5.414 0.864 -1.224 1.00 0.00 C ATOM 947 CD2 LEU A 64 -5.705 1.306 1.257 1.00 0.00 C ATOM 0 H LEU A 64 -8.405 0.069 0.026 1.00 0.00 H new ATOM 0 HA LEU A 64 -6.476 -1.326 -1.718 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -6.640 -0.972 1.265 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -5.380 -1.835 0.404 1.00 0.00 H new ATOM 0 HG LEU A 64 -4.235 0.066 0.353 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -4.839 1.787 -1.295 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -5.031 0.141 -1.944 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -6.462 1.072 -1.441 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -5.124 2.220 1.136 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -6.766 1.533 1.150 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -5.522 0.888 2.247 1.00 0.00 H new ATOM 959 N THR A 65 -7.502 -3.510 -1.699 1.00 0.00 N ATOM 960 CA THR A 65 -8.069 -4.848 -1.721 1.00 0.00 C ATOM 961 C THR A 65 -6.957 -5.899 -1.691 1.00 0.00 C ATOM 962 O THR A 65 -6.125 -5.953 -2.595 1.00 0.00 O ATOM 963 CB THR A 65 -8.975 -4.957 -2.949 1.00 0.00 C ATOM 964 OG1 THR A 65 -9.911 -3.895 -2.785 1.00 0.00 O ATOM 965 CG2 THR A 65 -9.838 -6.221 -2.929 1.00 0.00 C ATOM 0 H THR A 65 -6.931 -3.275 -2.511 1.00 0.00 H new ATOM 0 HA THR A 65 -8.675 -5.036 -0.834 1.00 0.00 H new ATOM 0 HB THR A 65 -8.365 -4.948 -3.852 1.00 0.00 H new ATOM 0 HG1 THR A 65 -10.536 -3.891 -3.539 1.00 0.00 H new ATOM 0 HG21 THR A 65 -10.462 -6.250 -3.822 1.00 0.00 H new ATOM 0 HG22 THR A 65 -9.195 -7.101 -2.907 1.00 0.00 H new ATOM 0 HG23 THR A 65 -10.473 -6.214 -2.043 1.00 0.00 H new ATOM 973 N ASN A 66 -6.979 -6.707 -0.641 1.00 0.00 N ATOM 974 CA ASN A 66 -5.983 -7.753 -0.482 1.00 0.00 C ATOM 975 C ASN A 66 -6.425 -8.995 -1.258 1.00 0.00 C ATOM 976 O ASN A 66 -7.346 -9.697 -0.842 1.00 0.00 O ATOM 977 CB ASN A 66 -5.828 -8.146 0.989 1.00 0.00 C ATOM 978 CG ASN A 66 -4.840 -9.304 1.146 1.00 0.00 C ATOM 979 OD1 ASN A 66 -4.427 -9.936 0.188 1.00 0.00 O ATOM 980 ND2 ASN A 66 -4.485 -9.545 2.405 1.00 0.00 N ATOM 0 H ASN A 66 -7.670 -6.658 0.107 1.00 0.00 H new ATOM 0 HA ASN A 66 -5.033 -7.373 -0.857 1.00 0.00 H new ATOM 0 HB2 ASN A 66 -5.482 -7.287 1.564 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -6.797 -8.433 1.397 1.00 0.00 H new ATOM 0 HD21 ASN A 66 -3.829 -10.297 2.615 1.00 0.00 H new ATOM 0 HD22 ASN A 66 -4.869 -8.977 3.161 1.00 0.00 H new ATOM 987 N MET A 67 -5.748 -9.229 -2.373 1.00 0.00 N ATOM 988 CA MET A 67 -6.060 -10.374 -3.212 1.00 0.00 C ATOM 989 C MET A 67 -4.857 -11.312 -3.327 1.00 0.00 C ATOM 990 O MET A 67 -3.958 -11.078 -4.133 1.00 0.00 O ATOM 991 CB MET A 67 -6.467 -9.891 -4.605 1.00 0.00 C ATOM 992 CG MET A 67 -7.974 -10.044 -4.820 1.00 0.00 C ATOM 993 SD MET A 67 -8.348 -11.707 -5.350 1.00 0.00 S ATOM 994 CE MET A 67 -9.827 -12.010 -4.398 1.00 0.00 C ATOM 0 H MET A 67 -4.985 -8.645 -2.715 1.00 0.00 H new ATOM 0 HA MET A 67 -6.883 -10.923 -2.754 1.00 0.00 H new ATOM 0 HB2 MET A 67 -6.183 -8.846 -4.729 1.00 0.00 H new ATOM 0 HB3 MET A 67 -5.928 -10.460 -5.363 1.00 0.00 H new ATOM 0 HG2 MET A 67 -8.506 -9.819 -3.896 1.00 0.00 H new ATOM 0 HG3 MET A 67 -8.318 -9.329 -5.568 1.00 0.00 H new ATOM 0 HE1 MET A 67 -10.197 -13.013 -4.610 1.00 0.00 H new ATOM 0 HE2 MET A 67 -9.600 -11.924 -3.335 1.00 0.00 H new ATOM 0 HE3 MET A 67 -10.589 -11.278 -4.666 1.00 0.00 H new ATOM 1004 N ASP A 68 -4.879 -12.354 -2.510 1.00 0.00 N ATOM 1005 CA ASP A 68 -3.801 -13.329 -2.510 1.00 0.00 C ATOM 1006 C ASP A 68 -2.541 -12.690 -1.924 1.00 0.00 C ATOM 1007 O ASP A 68 -1.511 -12.612 -2.592 1.00 0.00 O ATOM 1008 CB ASP A 68 -3.478 -13.792 -3.932 1.00 0.00 C ATOM 1009 CG ASP A 68 -4.694 -14.168 -4.781 1.00 0.00 C ATOM 1010 OD1 ASP A 68 -5.280 -13.238 -5.376 1.00 0.00 O ATOM 1011 OD2 ASP A 68 -5.010 -15.377 -4.817 1.00 0.00 O ATOM 0 H ASP A 68 -5.627 -12.545 -1.843 1.00 0.00 H new ATOM 0 HA ASP A 68 -4.120 -14.185 -1.915 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -2.930 -12.999 -4.441 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -2.813 -14.654 -3.875 1.00 0.00 H new ATOM 1016 N GLY A 69 -2.664 -12.248 -0.681 1.00 0.00 N ATOM 1017 CA GLY A 69 -1.547 -11.618 0.003 1.00 0.00 C ATOM 1018 C GLY A 69 -0.972 -10.470 -0.828 1.00 0.00 C ATOM 1019 O GLY A 69 0.168 -10.058 -0.620 1.00 0.00 O ATOM 0 H GLY A 69 -3.520 -12.314 -0.130 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -1.875 -11.241 0.972 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -0.770 -12.358 0.195 1.00 0.00 H new ATOM 1023 N VAL A 70 -1.787 -9.985 -1.754 1.00 0.00 N ATOM 1024 CA VAL A 70 -1.374 -8.893 -2.618 1.00 0.00 C ATOM 1025 C VAL A 70 -2.392 -7.756 -2.518 1.00 0.00 C ATOM 1026 O VAL A 70 -3.585 -7.999 -2.342 1.00 0.00 O ATOM 1027 CB VAL A 70 -1.183 -9.401 -4.048 1.00 0.00 C ATOM 1028 CG1 VAL A 70 -0.918 -8.241 -5.011 1.00 0.00 C ATOM 1029 CG2 VAL A 70 -0.061 -10.438 -4.117 1.00 0.00 C ATOM 0 H VAL A 70 -2.732 -10.329 -1.924 1.00 0.00 H new ATOM 0 HA VAL A 70 -0.411 -8.496 -2.297 1.00 0.00 H new ATOM 0 HB VAL A 70 -2.108 -9.888 -4.356 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -0.786 -8.629 -6.021 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -1.764 -7.554 -4.994 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -0.015 -7.713 -4.704 1.00 0.00 H new ATOM 0 HG21 VAL A 70 0.053 -10.782 -5.145 1.00 0.00 H new ATOM 0 HG22 VAL A 70 0.872 -9.987 -3.779 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -0.308 -11.284 -3.476 1.00 0.00 H new ATOM 1039 N VAL A 71 -1.884 -6.537 -2.635 1.00 0.00 N ATOM 1040 CA VAL A 71 -2.735 -5.362 -2.560 1.00 0.00 C ATOM 1041 C VAL A 71 -2.490 -4.481 -3.787 1.00 0.00 C ATOM 1042 O VAL A 71 -1.360 -4.371 -4.261 1.00 0.00 O ATOM 1043 CB VAL A 71 -2.497 -4.627 -1.239 1.00 0.00 C ATOM 1044 CG1 VAL A 71 -3.197 -3.266 -1.235 1.00 0.00 C ATOM 1045 CG2 VAL A 71 -2.944 -5.478 -0.049 1.00 0.00 C ATOM 0 H VAL A 71 -0.894 -6.338 -2.781 1.00 0.00 H new ATOM 0 HA VAL A 71 -3.786 -5.650 -2.571 1.00 0.00 H new ATOM 0 HB VAL A 71 -1.426 -4.453 -1.141 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -3.012 -2.764 -0.285 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -2.809 -2.655 -2.050 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -4.270 -3.408 -1.367 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -2.764 -4.932 0.877 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -4.008 -5.699 -0.139 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -2.380 -6.410 -0.036 1.00 0.00 H new ATOM 1055 N THR A 72 -3.567 -3.876 -4.266 1.00 0.00 N ATOM 1056 CA THR A 72 -3.483 -3.009 -5.428 1.00 0.00 C ATOM 1057 C THR A 72 -4.308 -1.739 -5.207 1.00 0.00 C ATOM 1058 O THR A 72 -5.517 -1.809 -4.995 1.00 0.00 O ATOM 1059 CB THR A 72 -3.924 -3.814 -6.652 1.00 0.00 C ATOM 1060 OG1 THR A 72 -5.128 -4.452 -6.232 1.00 0.00 O ATOM 1061 CG2 THR A 72 -2.976 -4.974 -6.962 1.00 0.00 C ATOM 0 H THR A 72 -4.502 -3.969 -3.870 1.00 0.00 H new ATOM 0 HA THR A 72 -2.461 -2.670 -5.595 1.00 0.00 H new ATOM 0 HB THR A 72 -3.986 -3.155 -7.518 1.00 0.00 H new ATOM 0 HG1 THR A 72 -5.651 -3.833 -5.681 1.00 0.00 H new ATOM 0 HG21 THR A 72 -3.335 -5.513 -7.839 1.00 0.00 H new ATOM 0 HG22 THR A 72 -1.977 -4.585 -7.158 1.00 0.00 H new ATOM 0 HG23 THR A 72 -2.940 -5.652 -6.110 1.00 0.00 H new ATOM 1069 N VAL A 73 -3.620 -0.608 -5.264 1.00 0.00 N ATOM 1070 CA VAL A 73 -4.273 0.676 -5.072 1.00 0.00 C ATOM 1071 C VAL A 73 -5.177 0.967 -6.272 1.00 0.00 C ATOM 1072 O VAL A 73 -4.719 0.965 -7.414 1.00 0.00 O ATOM 1073 CB VAL A 73 -3.226 1.765 -4.834 1.00 0.00 C ATOM 1074 CG1 VAL A 73 -2.180 1.775 -5.950 1.00 0.00 C ATOM 1075 CG2 VAL A 73 -3.887 3.138 -4.690 1.00 0.00 C ATOM 0 H VAL A 73 -2.617 -0.554 -5.440 1.00 0.00 H new ATOM 0 HA VAL A 73 -4.906 0.654 -4.185 1.00 0.00 H new ATOM 0 HB VAL A 73 -2.714 1.539 -3.899 1.00 0.00 H new ATOM 0 HG11 VAL A 73 -1.448 2.559 -5.756 1.00 0.00 H new ATOM 0 HG12 VAL A 73 -1.677 0.809 -5.985 1.00 0.00 H new ATOM 0 HG13 VAL A 73 -2.669 1.964 -6.905 1.00 0.00 H new ATOM 0 HG21 VAL A 73 -3.121 3.895 -4.522 1.00 0.00 H new ATOM 0 HG22 VAL A 73 -4.437 3.375 -5.601 1.00 0.00 H new ATOM 0 HG23 VAL A 73 -4.575 3.124 -3.845 1.00 0.00 H new ATOM 1085 N THR A 74 -6.444 1.211 -5.973 1.00 0.00 N ATOM 1086 CA THR A 74 -7.416 1.503 -7.012 1.00 0.00 C ATOM 1087 C THR A 74 -8.102 2.844 -6.740 1.00 0.00 C ATOM 1088 O THR A 74 -8.948 2.943 -5.853 1.00 0.00 O ATOM 1089 CB THR A 74 -8.391 0.327 -7.093 1.00 0.00 C ATOM 1090 OG1 THR A 74 -7.560 -0.795 -7.376 1.00 0.00 O ATOM 1091 CG2 THR A 74 -9.320 0.418 -8.305 1.00 0.00 C ATOM 0 H THR A 74 -6.820 1.212 -5.025 1.00 0.00 H new ATOM 0 HA THR A 74 -6.934 1.611 -7.984 1.00 0.00 H new ATOM 0 HB THR A 74 -8.987 0.287 -6.181 1.00 0.00 H new ATOM 0 HG1 THR A 74 -7.704 -1.084 -8.301 1.00 0.00 H new ATOM 0 HG21 THR A 74 -9.991 -0.441 -8.314 1.00 0.00 H new ATOM 0 HG22 THR A 74 -9.906 1.335 -8.246 1.00 0.00 H new ATOM 0 HG23 THR A 74 -8.726 0.424 -9.219 1.00 0.00 H new ATOM 1099 N PRO A 75 -7.700 3.868 -7.539 1.00 0.00 N ATOM 1100 CA PRO A 75 -8.266 5.198 -7.393 1.00 0.00 C ATOM 1101 C PRO A 75 -9.682 5.258 -7.969 1.00 0.00 C ATOM 1102 O PRO A 75 -9.896 4.932 -9.136 1.00 0.00 O ATOM 1103 CB PRO A 75 -7.294 6.121 -8.110 1.00 0.00 C ATOM 1104 CG PRO A 75 -6.470 5.229 -9.024 1.00 0.00 C ATOM 1105 CD PRO A 75 -6.700 3.787 -8.600 1.00 0.00 C ATOM 0 HA PRO A 75 -8.380 5.494 -6.350 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -7.827 6.881 -8.682 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -6.657 6.646 -7.398 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -6.764 5.373 -10.064 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -5.412 5.483 -8.954 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -7.055 3.181 -9.433 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -5.779 3.328 -8.242 1.00 0.00 H new ATOM 1113 N ARG A 76 -10.614 5.675 -7.124 1.00 0.00 N ATOM 1114 CA ARG A 76 -12.003 5.782 -7.535 1.00 0.00 C ATOM 1115 C ARG A 76 -12.496 7.221 -7.374 1.00 0.00 C ATOM 1116 O ARG A 76 -13.700 7.466 -7.309 1.00 0.00 O ATOM 1117 CB ARG A 76 -12.894 4.850 -6.711 1.00 0.00 C ATOM 1118 CG ARG A 76 -12.454 3.393 -6.866 1.00 0.00 C ATOM 1119 CD ARG A 76 -12.813 2.855 -8.252 1.00 0.00 C ATOM 1120 NE ARG A 76 -14.199 2.336 -8.251 1.00 0.00 N ATOM 1121 CZ ARG A 76 -15.276 3.069 -8.562 1.00 0.00 C ATOM 1122 NH1 ARG A 76 -15.135 4.357 -8.902 1.00 0.00 N ATOM 1123 NH2 ARG A 76 -16.496 2.513 -8.533 1.00 0.00 N ATOM 0 H ARG A 76 -10.434 5.943 -6.156 1.00 0.00 H new ATOM 0 HA ARG A 76 -12.062 5.490 -8.584 1.00 0.00 H new ATOM 0 HB2 ARG A 76 -12.853 5.136 -5.660 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -13.931 4.956 -7.030 1.00 0.00 H new ATOM 0 HG2 ARG A 76 -11.378 3.316 -6.710 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -12.932 2.782 -6.100 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -12.713 3.646 -8.995 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -12.120 2.063 -8.534 1.00 0.00 H new ATOM 0 HE ARG A 76 -14.343 1.359 -7.998 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -14.207 4.780 -8.924 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -15.956 4.915 -9.139 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -16.603 1.532 -8.274 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -17.316 3.071 -8.770 1.00 0.00 H new ATOM 1137 N SER A 77 -11.540 8.137 -7.314 1.00 0.00 N ATOM 1138 CA SER A 77 -11.861 9.546 -7.161 1.00 0.00 C ATOM 1139 C SER A 77 -11.190 10.359 -8.270 1.00 0.00 C ATOM 1140 O SER A 77 -9.970 10.325 -8.418 1.00 0.00 O ATOM 1141 CB SER A 77 -11.430 10.063 -5.788 1.00 0.00 C ATOM 1142 OG SER A 77 -12.536 10.215 -4.903 1.00 0.00 O ATOM 0 H SER A 77 -10.543 7.931 -7.369 1.00 0.00 H new ATOM 0 HA SER A 77 -12.942 9.661 -7.239 1.00 0.00 H new ATOM 0 HB2 SER A 77 -10.708 9.373 -5.351 1.00 0.00 H new ATOM 0 HB3 SER A 77 -10.924 11.022 -5.904 1.00 0.00 H new ATOM 0 HG SER A 77 -12.881 9.332 -4.656 1.00 0.00 H new ATOM 1148 N MET A 78 -12.018 11.070 -9.021 1.00 0.00 N ATOM 1149 CA MET A 78 -11.520 11.891 -10.112 1.00 0.00 C ATOM 1150 C MET A 78 -10.954 13.213 -9.590 1.00 0.00 C ATOM 1151 O MET A 78 -11.459 14.284 -9.925 1.00 0.00 O ATOM 1152 CB MET A 78 -12.655 12.174 -11.098 1.00 0.00 C ATOM 1153 CG MET A 78 -12.154 12.119 -12.542 1.00 0.00 C ATOM 1154 SD MET A 78 -13.418 11.436 -13.601 1.00 0.00 S ATOM 1155 CE MET A 78 -12.473 10.177 -14.442 1.00 0.00 C ATOM 0 H MET A 78 -13.030 11.095 -8.896 1.00 0.00 H new ATOM 0 HA MET A 78 -10.719 11.348 -10.614 1.00 0.00 H new ATOM 0 HB2 MET A 78 -13.453 11.445 -10.958 1.00 0.00 H new ATOM 0 HB3 MET A 78 -13.082 13.156 -10.895 1.00 0.00 H new ATOM 0 HG2 MET A 78 -11.886 13.120 -12.881 1.00 0.00 H new ATOM 0 HG3 MET A 78 -11.252 11.510 -12.600 1.00 0.00 H new ATOM 0 HE1 MET A 78 -13.116 9.650 -15.147 1.00 0.00 H new ATOM 0 HE2 MET A 78 -11.647 10.641 -14.981 1.00 0.00 H new ATOM 0 HE3 MET A 78 -12.078 9.470 -13.712 1.00 0.00 H new ATOM 1165 N ASP A 79 -9.914 13.096 -8.778 1.00 0.00 N ATOM 1166 CA ASP A 79 -9.275 14.269 -8.206 1.00 0.00 C ATOM 1167 C ASP A 79 -8.255 13.827 -7.154 1.00 0.00 C ATOM 1168 O ASP A 79 -7.222 14.470 -6.978 1.00 0.00 O ATOM 1169 CB ASP A 79 -10.299 15.175 -7.520 1.00 0.00 C ATOM 1170 CG ASP A 79 -10.877 16.282 -8.404 1.00 0.00 C ATOM 1171 OD1 ASP A 79 -10.091 16.844 -9.197 1.00 0.00 O ATOM 1172 OD2 ASP A 79 -12.092 16.541 -8.267 1.00 0.00 O ATOM 0 H ASP A 79 -9.498 12.207 -8.502 1.00 0.00 H new ATOM 0 HA ASP A 79 -8.793 14.818 -9.015 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -11.119 14.558 -7.153 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -9.830 15.633 -6.649 1.00 0.00 H new ATOM 1177 N ALA A 80 -8.582 12.732 -6.484 1.00 0.00 N ATOM 1178 CA ALA A 80 -7.707 12.196 -5.454 1.00 0.00 C ATOM 1179 C ALA A 80 -6.364 11.816 -6.079 1.00 0.00 C ATOM 1180 O ALA A 80 -6.311 10.999 -6.997 1.00 0.00 O ATOM 1181 CB ALA A 80 -8.389 11.009 -4.772 1.00 0.00 C ATOM 0 H ALA A 80 -9.440 12.201 -6.634 1.00 0.00 H new ATOM 0 HA ALA A 80 -7.513 12.946 -4.687 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -7.733 10.607 -4.000 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -9.324 11.338 -4.319 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -8.596 10.235 -5.511 1.00 0.00 H new ATOM 1187 N GLU A 81 -5.310 12.428 -5.558 1.00 0.00 N ATOM 1188 CA GLU A 81 -3.970 12.164 -6.053 1.00 0.00 C ATOM 1189 C GLU A 81 -3.326 11.025 -5.261 1.00 0.00 C ATOM 1190 O GLU A 81 -3.195 11.109 -4.041 1.00 0.00 O ATOM 1191 CB GLU A 81 -3.107 13.427 -5.998 1.00 0.00 C ATOM 1192 CG GLU A 81 -3.883 14.643 -6.507 1.00 0.00 C ATOM 1193 CD GLU A 81 -3.178 15.945 -6.117 1.00 0.00 C ATOM 1194 OE1 GLU A 81 -2.980 16.140 -4.898 1.00 0.00 O ATOM 1195 OE2 GLU A 81 -2.854 16.715 -7.047 1.00 0.00 O ATOM 0 H GLU A 81 -5.358 13.106 -4.798 1.00 0.00 H new ATOM 0 HA GLU A 81 -4.043 11.858 -7.097 1.00 0.00 H new ATOM 0 HB2 GLU A 81 -2.779 13.603 -4.974 1.00 0.00 H new ATOM 0 HB3 GLU A 81 -2.210 13.285 -6.600 1.00 0.00 H new ATOM 0 HG2 GLU A 81 -3.981 14.589 -7.591 1.00 0.00 H new ATOM 0 HG3 GLU A 81 -4.892 14.634 -6.095 1.00 0.00 H new ATOM 1202 N THR A 82 -2.941 9.986 -5.987 1.00 0.00 N ATOM 1203 CA THR A 82 -2.314 8.831 -5.367 1.00 0.00 C ATOM 1204 C THR A 82 -1.000 8.494 -6.075 1.00 0.00 C ATOM 1205 O THR A 82 -1.006 7.913 -7.159 1.00 0.00 O ATOM 1206 CB THR A 82 -3.323 7.681 -5.379 1.00 0.00 C ATOM 1207 OG1 THR A 82 -4.449 8.200 -4.677 1.00 0.00 O ATOM 1208 CG2 THR A 82 -2.868 6.494 -4.529 1.00 0.00 C ATOM 0 H THR A 82 -3.051 9.920 -6.999 1.00 0.00 H new ATOM 0 HA THR A 82 -2.046 9.036 -4.331 1.00 0.00 H new ATOM 0 HB THR A 82 -3.485 7.351 -6.405 1.00 0.00 H new ATOM 0 HG1 THR A 82 -4.146 8.841 -4.001 1.00 0.00 H new ATOM 0 HG21 THR A 82 -3.620 5.706 -4.572 1.00 0.00 H new ATOM 0 HG22 THR A 82 -1.921 6.114 -4.913 1.00 0.00 H new ATOM 0 HG23 THR A 82 -2.738 6.815 -3.496 1.00 0.00 H new ATOM 1216 N TYR A 83 0.095 8.872 -5.433 1.00 0.00 N ATOM 1217 CA TYR A 83 1.414 8.617 -5.988 1.00 0.00 C ATOM 1218 C TYR A 83 2.126 7.503 -5.218 1.00 0.00 C ATOM 1219 O TYR A 83 2.375 7.632 -4.020 1.00 0.00 O ATOM 1220 CB TYR A 83 2.200 9.919 -5.821 1.00 0.00 C ATOM 1221 CG TYR A 83 1.455 11.163 -6.310 1.00 0.00 C ATOM 1222 CD1 TYR A 83 1.519 11.527 -7.640 1.00 0.00 C ATOM 1223 CD2 TYR A 83 0.720 11.920 -5.421 1.00 0.00 C ATOM 1224 CE1 TYR A 83 0.818 12.698 -8.100 1.00 0.00 C ATOM 1225 CE2 TYR A 83 0.019 13.091 -5.881 1.00 0.00 C ATOM 1226 CZ TYR A 83 0.102 13.422 -7.197 1.00 0.00 C ATOM 1227 OH TYR A 83 -0.560 14.528 -7.632 1.00 0.00 O ATOM 0 H TYR A 83 0.096 9.353 -4.534 1.00 0.00 H new ATOM 0 HA TYR A 83 1.339 8.305 -7.030 1.00 0.00 H new ATOM 0 HB2 TYR A 83 2.450 10.048 -4.768 1.00 0.00 H new ATOM 0 HB3 TYR A 83 3.142 9.835 -6.364 1.00 0.00 H new ATOM 0 HD1 TYR A 83 2.094 10.934 -8.335 1.00 0.00 H new ATOM 0 HD2 TYR A 83 0.670 11.635 -4.381 1.00 0.00 H new ATOM 0 HE1 TYR A 83 0.860 12.995 -9.138 1.00 0.00 H new ATOM 0 HE2 TYR A 83 -0.560 13.693 -5.196 1.00 0.00 H new ATOM 0 HH TYR A 83 -0.823 14.405 -8.568 1.00 0.00 H new ATOM 1237 N VAL A 84 2.434 6.434 -5.938 1.00 0.00 N ATOM 1238 CA VAL A 84 3.113 5.298 -5.337 1.00 0.00 C ATOM 1239 C VAL A 84 4.624 5.457 -5.522 1.00 0.00 C ATOM 1240 O VAL A 84 5.177 5.032 -6.535 1.00 0.00 O ATOM 1241 CB VAL A 84 2.573 3.994 -5.927 1.00 0.00 C ATOM 1242 CG1 VAL A 84 3.416 2.799 -5.479 1.00 0.00 C ATOM 1243 CG2 VAL A 84 1.101 3.795 -5.560 1.00 0.00 C ATOM 0 H VAL A 84 2.226 6.330 -6.931 1.00 0.00 H new ATOM 0 HA VAL A 84 2.918 5.260 -4.265 1.00 0.00 H new ATOM 0 HB VAL A 84 2.641 4.064 -7.013 1.00 0.00 H new ATOM 0 HG11 VAL A 84 3.011 1.885 -5.912 1.00 0.00 H new ATOM 0 HG12 VAL A 84 4.445 2.934 -5.813 1.00 0.00 H new ATOM 0 HG13 VAL A 84 3.394 2.726 -4.392 1.00 0.00 H new ATOM 0 HG21 VAL A 84 0.741 2.861 -5.992 1.00 0.00 H new ATOM 0 HG22 VAL A 84 0.998 3.757 -4.476 1.00 0.00 H new ATOM 0 HG23 VAL A 84 0.513 4.625 -5.951 1.00 0.00 H new ATOM 1253 N ASP A 85 5.248 6.069 -4.526 1.00 0.00 N ATOM 1254 CA ASP A 85 6.684 6.289 -4.566 1.00 0.00 C ATOM 1255 C ASP A 85 6.979 7.557 -5.370 1.00 0.00 C ATOM 1256 O ASP A 85 8.034 7.670 -5.992 1.00 0.00 O ATOM 1257 CB ASP A 85 7.401 5.121 -5.245 1.00 0.00 C ATOM 1258 CG ASP A 85 8.755 4.751 -4.635 1.00 0.00 C ATOM 1259 OD1 ASP A 85 8.792 4.581 -3.397 1.00 0.00 O ATOM 1260 OD2 ASP A 85 9.721 4.645 -5.421 1.00 0.00 O ATOM 0 H ASP A 85 4.786 6.419 -3.687 1.00 0.00 H new ATOM 0 HA ASP A 85 7.040 6.383 -3.540 1.00 0.00 H new ATOM 0 HB2 ASP A 85 6.752 4.246 -5.210 1.00 0.00 H new ATOM 0 HB3 ASP A 85 7.548 5.366 -6.297 1.00 0.00 H new ATOM 1265 N GLY A 86 6.029 8.479 -5.330 1.00 0.00 N ATOM 1266 CA GLY A 86 6.174 9.735 -6.047 1.00 0.00 C ATOM 1267 C GLY A 86 5.746 9.584 -7.509 1.00 0.00 C ATOM 1268 O GLY A 86 6.169 10.359 -8.366 1.00 0.00 O ATOM 0 H GLY A 86 5.156 8.382 -4.812 1.00 0.00 H new ATOM 0 HA2 GLY A 86 5.571 10.505 -5.565 1.00 0.00 H new ATOM 0 HA3 GLY A 86 7.211 10.067 -6.000 1.00 0.00 H new ATOM 1272 N GLN A 87 4.914 8.582 -7.748 1.00 0.00 N ATOM 1273 CA GLN A 87 4.424 8.320 -9.091 1.00 0.00 C ATOM 1274 C GLN A 87 2.910 8.100 -9.070 1.00 0.00 C ATOM 1275 O GLN A 87 2.431 7.106 -8.526 1.00 0.00 O ATOM 1276 CB GLN A 87 5.144 7.122 -9.713 1.00 0.00 C ATOM 1277 CG GLN A 87 6.299 7.580 -10.606 1.00 0.00 C ATOM 1278 CD GLN A 87 7.433 6.552 -10.605 1.00 0.00 C ATOM 1279 OE1 GLN A 87 7.429 5.584 -11.348 1.00 0.00 O ATOM 1280 NE2 GLN A 87 8.402 6.815 -9.733 1.00 0.00 N ATOM 0 H GLN A 87 4.566 7.941 -7.035 1.00 0.00 H new ATOM 0 HA GLN A 87 4.636 9.191 -9.711 1.00 0.00 H new ATOM 0 HB2 GLN A 87 5.524 6.472 -8.925 1.00 0.00 H new ATOM 0 HB3 GLN A 87 4.438 6.533 -10.299 1.00 0.00 H new ATOM 0 HG2 GLN A 87 5.939 7.729 -11.624 1.00 0.00 H new ATOM 0 HG3 GLN A 87 6.675 8.542 -10.256 1.00 0.00 H new ATOM 0 HE21 GLN A 87 8.344 7.643 -9.140 1.00 0.00 H new ATOM 0 HE22 GLN A 87 9.204 6.189 -9.657 1.00 0.00 H new ATOM 1289 N ARG A 88 2.199 9.043 -9.670 1.00 0.00 N ATOM 1290 CA ARG A 88 0.749 8.965 -9.727 1.00 0.00 C ATOM 1291 C ARG A 88 0.316 7.776 -10.588 1.00 0.00 C ATOM 1292 O ARG A 88 1.035 7.371 -11.500 1.00 0.00 O ATOM 1293 CB ARG A 88 0.151 10.249 -10.304 1.00 0.00 C ATOM 1294 CG ARG A 88 -1.264 10.482 -9.771 1.00 0.00 C ATOM 1295 CD ARG A 88 -1.679 11.946 -9.938 1.00 0.00 C ATOM 1296 NE ARG A 88 -2.866 12.038 -10.816 1.00 0.00 N ATOM 1297 CZ ARG A 88 -3.242 13.153 -11.457 1.00 0.00 C ATOM 1298 NH1 ARG A 88 -2.526 14.277 -11.321 1.00 0.00 N ATOM 1299 NH2 ARG A 88 -4.334 13.145 -12.234 1.00 0.00 N ATOM 0 H ARG A 88 2.600 9.865 -10.121 1.00 0.00 H new ATOM 0 HA ARG A 88 0.383 8.833 -8.709 1.00 0.00 H new ATOM 0 HB2 ARG A 88 0.785 11.097 -10.046 1.00 0.00 H new ATOM 0 HB3 ARG A 88 0.128 10.187 -11.392 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -1.966 9.838 -10.301 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -1.310 10.205 -8.718 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -1.902 12.383 -8.965 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -0.856 12.520 -10.364 1.00 0.00 H new ATOM 0 HE ARG A 88 -3.434 11.200 -10.941 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -1.695 14.284 -10.730 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -2.812 15.126 -11.809 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -4.880 12.290 -12.338 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -4.619 13.994 -12.721 1.00 0.00 H new ATOM 1313 N ILE A 89 -0.858 7.252 -10.268 1.00 0.00 N ATOM 1314 CA ILE A 89 -1.396 6.118 -11.001 1.00 0.00 C ATOM 1315 C ILE A 89 -2.642 6.559 -11.772 1.00 0.00 C ATOM 1316 O ILE A 89 -3.095 7.694 -11.629 1.00 0.00 O ATOM 1317 CB ILE A 89 -1.642 4.939 -10.058 1.00 0.00 C ATOM 1318 CG1 ILE A 89 -2.683 5.295 -8.995 1.00 0.00 C ATOM 1319 CG2 ILE A 89 -0.332 4.451 -9.436 1.00 0.00 C ATOM 1320 CD1 ILE A 89 -3.252 4.034 -8.340 1.00 0.00 C ATOM 0 H ILE A 89 -1.452 7.591 -9.511 1.00 0.00 H new ATOM 0 HA ILE A 89 -0.674 5.763 -11.737 1.00 0.00 H new ATOM 0 HB ILE A 89 -2.048 4.113 -10.643 1.00 0.00 H new ATOM 0 HG12 ILE A 89 -2.229 5.931 -8.235 1.00 0.00 H new ATOM 0 HG13 ILE A 89 -3.491 5.869 -9.450 1.00 0.00 H new ATOM 0 HG21 ILE A 89 -0.536 3.612 -8.770 1.00 0.00 H new ATOM 0 HG22 ILE A 89 0.348 4.131 -10.225 1.00 0.00 H new ATOM 0 HG23 ILE A 89 0.126 5.262 -8.869 1.00 0.00 H new ATOM 0 HD11 ILE A 89 -3.989 4.316 -7.588 1.00 0.00 H new ATOM 0 HD12 ILE A 89 -3.727 3.412 -9.099 1.00 0.00 H new ATOM 0 HD13 ILE A 89 -2.446 3.475 -7.865 1.00 0.00 H new ATOM 1332 N SER A 90 -3.160 5.639 -12.572 1.00 0.00 N ATOM 1333 CA SER A 90 -4.344 5.919 -13.366 1.00 0.00 C ATOM 1334 C SER A 90 -5.247 4.685 -13.412 1.00 0.00 C ATOM 1335 O SER A 90 -6.119 4.581 -14.273 1.00 0.00 O ATOM 1336 CB SER A 90 -3.967 6.354 -14.783 1.00 0.00 C ATOM 1337 OG SER A 90 -3.687 7.750 -14.856 1.00 0.00 O ATOM 0 H SER A 90 -2.781 4.699 -12.687 1.00 0.00 H new ATOM 0 HA SER A 90 -4.885 6.740 -12.895 1.00 0.00 H new ATOM 0 HB2 SER A 90 -3.094 5.791 -15.115 1.00 0.00 H new ATOM 0 HB3 SER A 90 -4.781 6.111 -15.466 1.00 0.00 H new ATOM 0 HG SER A 90 -3.449 7.988 -15.776 1.00 0.00 H new ATOM 1343 N GLU A 91 -5.006 3.780 -12.475 1.00 0.00 N ATOM 1344 CA GLU A 91 -5.787 2.556 -12.398 1.00 0.00 C ATOM 1345 C GLU A 91 -5.234 1.642 -11.303 1.00 0.00 C ATOM 1346 O GLU A 91 -4.324 2.026 -10.570 1.00 0.00 O ATOM 1347 CB GLU A 91 -5.815 1.838 -13.749 1.00 0.00 C ATOM 1348 CG GLU A 91 -4.439 1.871 -14.416 1.00 0.00 C ATOM 1349 CD GLU A 91 -4.048 0.486 -14.934 1.00 0.00 C ATOM 1350 OE1 GLU A 91 -4.893 -0.121 -15.626 1.00 0.00 O ATOM 1351 OE2 GLU A 91 -2.911 0.065 -14.627 1.00 0.00 O ATOM 0 H GLU A 91 -4.281 3.869 -11.763 1.00 0.00 H new ATOM 0 HA GLU A 91 -6.813 2.818 -12.141 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -6.130 0.804 -13.609 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -6.550 2.310 -14.401 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -4.448 2.583 -15.241 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -3.693 2.220 -13.702 1.00 0.00 H new ATOM 1358 N THR A 92 -5.807 0.450 -11.226 1.00 0.00 N ATOM 1359 CA THR A 92 -5.383 -0.522 -10.233 1.00 0.00 C ATOM 1360 C THR A 92 -3.891 -0.824 -10.385 1.00 0.00 C ATOM 1361 O THR A 92 -3.492 -1.566 -11.281 1.00 0.00 O ATOM 1362 CB THR A 92 -6.270 -1.760 -10.374 1.00 0.00 C ATOM 1363 OG1 THR A 92 -7.563 -1.308 -9.979 1.00 0.00 O ATOM 1364 CG2 THR A 92 -5.927 -2.847 -9.353 1.00 0.00 C ATOM 0 H THR A 92 -6.562 0.135 -11.836 1.00 0.00 H new ATOM 0 HA THR A 92 -5.503 -0.132 -9.222 1.00 0.00 H new ATOM 0 HB THR A 92 -6.170 -2.164 -11.381 1.00 0.00 H new ATOM 0 HG1 THR A 92 -8.202 -2.049 -10.042 1.00 0.00 H new ATOM 0 HG21 THR A 92 -6.586 -3.703 -9.497 1.00 0.00 H new ATOM 0 HG22 THR A 92 -4.892 -3.160 -9.488 1.00 0.00 H new ATOM 0 HG23 THR A 92 -6.058 -2.454 -8.345 1.00 0.00 H new ATOM 1372 N THR A 93 -3.107 -0.232 -9.496 1.00 0.00 N ATOM 1373 CA THR A 93 -1.667 -0.428 -9.520 1.00 0.00 C ATOM 1374 C THR A 93 -1.222 -1.262 -8.316 1.00 0.00 C ATOM 1375 O THR A 93 -1.576 -0.955 -7.179 1.00 0.00 O ATOM 1376 CB THR A 93 -1.004 0.949 -9.584 1.00 0.00 C ATOM 1377 OG1 THR A 93 -1.138 1.336 -10.948 1.00 0.00 O ATOM 1378 CG2 THR A 93 0.509 0.881 -9.362 1.00 0.00 C ATOM 0 H THR A 93 -3.441 0.383 -8.755 1.00 0.00 H new ATOM 0 HA THR A 93 -1.359 -0.994 -10.399 1.00 0.00 H new ATOM 0 HB THR A 93 -1.452 1.603 -8.835 1.00 0.00 H new ATOM 0 HG1 THR A 93 -2.060 1.623 -11.118 1.00 0.00 H new ATOM 0 HG21 THR A 93 0.930 1.885 -9.417 1.00 0.00 H new ATOM 0 HG22 THR A 93 0.714 0.455 -8.380 1.00 0.00 H new ATOM 0 HG23 THR A 93 0.962 0.255 -10.131 1.00 0.00 H new ATOM 1386 N MET A 94 -0.453 -2.301 -8.608 1.00 0.00 N ATOM 1387 CA MET A 94 0.044 -3.181 -7.564 1.00 0.00 C ATOM 1388 C MET A 94 0.867 -2.402 -6.536 1.00 0.00 C ATOM 1389 O MET A 94 1.498 -1.401 -6.871 1.00 0.00 O ATOM 1390 CB MET A 94 0.911 -4.276 -8.189 1.00 0.00 C ATOM 1391 CG MET A 94 1.464 -5.216 -7.117 1.00 0.00 C ATOM 1392 SD MET A 94 2.294 -6.597 -7.885 1.00 0.00 S ATOM 1393 CE MET A 94 0.919 -7.720 -8.072 1.00 0.00 C ATOM 0 H MET A 94 -0.162 -2.553 -9.553 1.00 0.00 H new ATOM 0 HA MET A 94 -0.810 -3.628 -7.054 1.00 0.00 H new ATOM 0 HB2 MET A 94 0.322 -4.845 -8.908 1.00 0.00 H new ATOM 0 HB3 MET A 94 1.735 -3.822 -8.740 1.00 0.00 H new ATOM 0 HG2 MET A 94 2.158 -4.677 -6.472 1.00 0.00 H new ATOM 0 HG3 MET A 94 0.653 -5.575 -6.483 1.00 0.00 H new ATOM 0 HE1 MET A 94 1.074 -8.593 -7.438 1.00 0.00 H new ATOM 0 HE2 MET A 94 -0.003 -7.218 -7.780 1.00 0.00 H new ATOM 0 HE3 MET A 94 0.846 -8.036 -9.113 1.00 0.00 H new ATOM 1403 N LEU A 95 0.834 -2.891 -5.306 1.00 0.00 N ATOM 1404 CA LEU A 95 1.569 -2.254 -4.227 1.00 0.00 C ATOM 1405 C LEU A 95 2.619 -3.227 -3.686 1.00 0.00 C ATOM 1406 O LEU A 95 2.362 -4.425 -3.578 1.00 0.00 O ATOM 1407 CB LEU A 95 0.607 -1.731 -3.158 1.00 0.00 C ATOM 1408 CG LEU A 95 -0.185 -0.474 -3.526 1.00 0.00 C ATOM 1409 CD1 LEU A 95 -1.192 -0.121 -2.430 1.00 0.00 C ATOM 1410 CD2 LEU A 95 0.753 0.693 -3.840 1.00 0.00 C ATOM 0 H LEU A 95 0.309 -3.722 -5.032 1.00 0.00 H new ATOM 0 HA LEU A 95 2.104 -1.379 -4.596 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -0.100 -2.524 -2.915 1.00 0.00 H new ATOM 0 HB3 LEU A 95 1.178 -1.525 -2.253 1.00 0.00 H new ATOM 0 HG LEU A 95 -0.754 -0.682 -4.432 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -1.742 0.776 -2.716 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -1.890 -0.948 -2.297 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -0.663 0.061 -1.495 1.00 0.00 H new ATOM 0 HD21 LEU A 95 0.165 1.573 -4.098 1.00 0.00 H new ATOM 0 HD22 LEU A 95 1.368 0.911 -2.967 1.00 0.00 H new ATOM 0 HD23 LEU A 95 1.396 0.427 -4.679 1.00 0.00 H new ATOM 1422 N GLN A 96 3.779 -2.675 -3.360 1.00 0.00 N ATOM 1423 CA GLN A 96 4.868 -3.480 -2.833 1.00 0.00 C ATOM 1424 C GLN A 96 5.243 -3.009 -1.427 1.00 0.00 C ATOM 1425 O GLN A 96 4.952 -1.875 -1.049 1.00 0.00 O ATOM 1426 CB GLN A 96 6.080 -3.440 -3.766 1.00 0.00 C ATOM 1427 CG GLN A 96 6.157 -4.707 -4.620 1.00 0.00 C ATOM 1428 CD GLN A 96 7.362 -4.660 -5.563 1.00 0.00 C ATOM 1429 OE1 GLN A 96 8.272 -5.469 -5.489 1.00 0.00 O ATOM 1430 NE2 GLN A 96 7.316 -3.671 -6.450 1.00 0.00 N ATOM 0 H GLN A 96 3.988 -1.681 -3.451 1.00 0.00 H new ATOM 0 HA GLN A 96 4.532 -4.515 -2.771 1.00 0.00 H new ATOM 0 HB2 GLN A 96 6.017 -2.565 -4.413 1.00 0.00 H new ATOM 0 HB3 GLN A 96 6.992 -3.337 -3.179 1.00 0.00 H new ATOM 0 HG2 GLN A 96 6.230 -5.582 -3.974 1.00 0.00 H new ATOM 0 HG3 GLN A 96 5.241 -4.815 -5.200 1.00 0.00 H new ATOM 0 HE21 GLN A 96 6.524 -3.029 -6.457 1.00 0.00 H new ATOM 0 HE22 GLN A 96 8.073 -3.555 -7.124 1.00 0.00 H new ATOM 1439 N SER A 97 5.883 -3.905 -0.689 1.00 0.00 N ATOM 1440 CA SER A 97 6.300 -3.595 0.668 1.00 0.00 C ATOM 1441 C SER A 97 7.447 -2.583 0.645 1.00 0.00 C ATOM 1442 O SER A 97 8.504 -2.851 0.075 1.00 0.00 O ATOM 1443 CB SER A 97 6.724 -4.861 1.416 1.00 0.00 C ATOM 1444 OG SER A 97 8.051 -5.259 1.082 1.00 0.00 O ATOM 0 H SER A 97 6.123 -4.845 -1.005 1.00 0.00 H new ATOM 0 HA SER A 97 5.451 -3.160 1.196 1.00 0.00 H new ATOM 0 HB2 SER A 97 6.657 -4.687 2.490 1.00 0.00 H new ATOM 0 HB3 SER A 97 6.033 -5.670 1.180 1.00 0.00 H new ATOM 0 HG SER A 97 8.384 -4.704 0.346 1.00 0.00 H new ATOM 1450 N GLY A 98 7.201 -1.443 1.272 1.00 0.00 N ATOM 1451 CA GLY A 98 8.200 -0.389 1.330 1.00 0.00 C ATOM 1452 C GLY A 98 7.762 0.828 0.512 1.00 0.00 C ATOM 1453 O GLY A 98 8.107 1.960 0.846 1.00 0.00 O ATOM 0 H GLY A 98 6.324 -1.225 1.745 1.00 0.00 H new ATOM 0 HA2 GLY A 98 8.364 -0.095 2.367 1.00 0.00 H new ATOM 0 HA3 GLY A 98 9.151 -0.763 0.951 1.00 0.00 H new ATOM 1457 N MET A 99 7.010 0.552 -0.543 1.00 0.00 N ATOM 1458 CA MET A 99 6.522 1.610 -1.411 1.00 0.00 C ATOM 1459 C MET A 99 5.839 2.713 -0.600 1.00 0.00 C ATOM 1460 O MET A 99 5.176 2.436 0.398 1.00 0.00 O ATOM 1461 CB MET A 99 5.527 1.027 -2.417 1.00 0.00 C ATOM 1462 CG MET A 99 6.251 0.224 -3.500 1.00 0.00 C ATOM 1463 SD MET A 99 5.839 0.865 -5.114 1.00 0.00 S ATOM 1464 CE MET A 99 4.520 -0.250 -5.564 1.00 0.00 C ATOM 0 H MET A 99 6.727 -0.389 -0.816 1.00 0.00 H new ATOM 0 HA MET A 99 7.373 2.044 -1.937 1.00 0.00 H new ATOM 0 HB2 MET A 99 4.814 0.386 -1.899 1.00 0.00 H new ATOM 0 HB3 MET A 99 4.955 1.833 -2.877 1.00 0.00 H new ATOM 0 HG2 MET A 99 7.328 0.276 -3.343 1.00 0.00 H new ATOM 0 HG3 MET A 99 5.969 -0.827 -3.434 1.00 0.00 H new ATOM 0 HE1 MET A 99 4.145 0.011 -6.553 1.00 0.00 H new ATOM 0 HE2 MET A 99 4.897 -1.273 -5.577 1.00 0.00 H new ATOM 0 HE3 MET A 99 3.712 -0.170 -4.837 1.00 0.00 H new ATOM 1474 N ARG A 100 6.026 3.942 -1.058 1.00 0.00 N ATOM 1475 CA ARG A 100 5.437 5.089 -0.388 1.00 0.00 C ATOM 1476 C ARG A 100 4.035 5.361 -0.936 1.00 0.00 C ATOM 1477 O ARG A 100 3.769 5.130 -2.114 1.00 0.00 O ATOM 1478 CB ARG A 100 6.301 6.339 -0.573 1.00 0.00 C ATOM 1479 CG ARG A 100 7.164 6.596 0.664 1.00 0.00 C ATOM 1480 CD ARG A 100 8.394 7.434 0.310 1.00 0.00 C ATOM 1481 NE ARG A 100 9.530 6.548 -0.027 1.00 0.00 N ATOM 1482 CZ ARG A 100 10.647 6.959 -0.643 1.00 0.00 C ATOM 1483 NH1 ARG A 100 10.783 8.245 -0.995 1.00 0.00 N ATOM 1484 NH2 ARG A 100 11.626 6.084 -0.909 1.00 0.00 N ATOM 0 H ARG A 100 6.577 4.169 -1.886 1.00 0.00 H new ATOM 0 HA ARG A 100 5.377 4.857 0.675 1.00 0.00 H new ATOM 0 HB2 ARG A 100 6.940 6.218 -1.448 1.00 0.00 H new ATOM 0 HB3 ARG A 100 5.663 7.202 -0.761 1.00 0.00 H new ATOM 0 HG2 ARG A 100 6.575 7.111 1.422 1.00 0.00 H new ATOM 0 HG3 ARG A 100 7.479 5.646 1.096 1.00 0.00 H new ATOM 0 HD2 ARG A 100 8.169 8.087 -0.533 1.00 0.00 H new ATOM 0 HD3 ARG A 100 8.660 8.077 1.149 1.00 0.00 H new ATOM 0 HE ARG A 100 9.459 5.562 0.225 1.00 0.00 H new ATOM 0 HH11 ARG A 100 10.037 8.910 -0.794 1.00 0.00 H new ATOM 0 HH12 ARG A 100 11.633 8.558 -1.464 1.00 0.00 H new ATOM 0 HH21 ARG A 100 11.521 5.105 -0.643 1.00 0.00 H new ATOM 0 HH22 ARG A 100 12.476 6.397 -1.378 1.00 0.00 H new ATOM 1498 N LEU A 101 3.174 5.848 -0.054 1.00 0.00 N ATOM 1499 CA LEU A 101 1.806 6.155 -0.434 1.00 0.00 C ATOM 1500 C LEU A 101 1.526 7.635 -0.169 1.00 0.00 C ATOM 1501 O LEU A 101 1.548 8.080 0.977 1.00 0.00 O ATOM 1502 CB LEU A 101 0.830 5.209 0.270 1.00 0.00 C ATOM 1503 CG LEU A 101 0.001 4.301 -0.641 1.00 0.00 C ATOM 1504 CD1 LEU A 101 -0.378 5.022 -1.936 1.00 0.00 C ATOM 1505 CD2 LEU A 101 0.729 2.983 -0.911 1.00 0.00 C ATOM 0 H LEU A 101 3.398 6.037 0.923 1.00 0.00 H new ATOM 0 HA LEU A 101 1.662 5.990 -1.502 1.00 0.00 H new ATOM 0 HB2 LEU A 101 1.396 4.581 0.958 1.00 0.00 H new ATOM 0 HB3 LEU A 101 0.147 5.807 0.873 1.00 0.00 H new ATOM 0 HG LEU A 101 -0.928 4.056 -0.125 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -0.967 4.354 -2.565 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -0.965 5.910 -1.700 1.00 0.00 H new ATOM 0 HD13 LEU A 101 0.527 5.316 -2.467 1.00 0.00 H new ATOM 0 HD21 LEU A 101 0.118 2.356 -1.561 1.00 0.00 H new ATOM 0 HD22 LEU A 101 1.683 3.187 -1.396 1.00 0.00 H new ATOM 0 HD23 LEU A 101 0.905 2.465 0.032 1.00 0.00 H new ATOM 1517 N GLN A 102 1.271 8.359 -1.250 1.00 0.00 N ATOM 1518 CA GLN A 102 0.988 9.780 -1.149 1.00 0.00 C ATOM 1519 C GLN A 102 -0.446 10.069 -1.596 1.00 0.00 C ATOM 1520 O GLN A 102 -0.771 9.937 -2.776 1.00 0.00 O ATOM 1521 CB GLN A 102 1.992 10.599 -1.963 1.00 0.00 C ATOM 1522 CG GLN A 102 2.047 12.046 -1.470 1.00 0.00 C ATOM 1523 CD GLN A 102 3.394 12.689 -1.808 1.00 0.00 C ATOM 1524 OE1 GLN A 102 4.437 12.311 -1.299 1.00 0.00 O ATOM 1525 NE2 GLN A 102 3.315 13.678 -2.693 1.00 0.00 N ATOM 0 H GLN A 102 1.255 7.987 -2.200 1.00 0.00 H new ATOM 0 HA GLN A 102 1.089 10.077 -0.105 1.00 0.00 H new ATOM 0 HB2 GLN A 102 2.981 10.147 -1.887 1.00 0.00 H new ATOM 0 HB3 GLN A 102 1.713 10.580 -3.016 1.00 0.00 H new ATOM 0 HG2 GLN A 102 1.241 12.620 -1.926 1.00 0.00 H new ATOM 0 HG3 GLN A 102 1.887 12.073 -0.392 1.00 0.00 H new ATOM 0 HE21 GLN A 102 2.410 13.945 -3.081 1.00 0.00 H new ATOM 0 HE22 GLN A 102 4.159 14.170 -2.984 1.00 0.00 H new ATOM 1534 N PHE A 103 -1.267 10.458 -0.632 1.00 0.00 N ATOM 1535 CA PHE A 103 -2.659 10.767 -0.912 1.00 0.00 C ATOM 1536 C PHE A 103 -2.948 12.251 -0.683 1.00 0.00 C ATOM 1537 O PHE A 103 -3.371 12.645 0.404 1.00 0.00 O ATOM 1538 CB PHE A 103 -3.504 9.939 0.058 1.00 0.00 C ATOM 1539 CG PHE A 103 -3.336 8.427 -0.104 1.00 0.00 C ATOM 1540 CD1 PHE A 103 -3.879 7.793 -1.178 1.00 0.00 C ATOM 1541 CD2 PHE A 103 -2.643 7.716 0.826 1.00 0.00 C ATOM 1542 CE1 PHE A 103 -3.723 6.390 -1.328 1.00 0.00 C ATOM 1543 CE2 PHE A 103 -2.486 6.313 0.675 1.00 0.00 C ATOM 1544 CZ PHE A 103 -3.029 5.679 -0.399 1.00 0.00 C ATOM 0 H PHE A 103 -0.995 10.566 0.345 1.00 0.00 H new ATOM 0 HA PHE A 103 -2.890 10.536 -1.952 1.00 0.00 H new ATOM 0 HB2 PHE A 103 -3.242 10.216 1.079 1.00 0.00 H new ATOM 0 HB3 PHE A 103 -4.554 10.194 -0.082 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -4.429 8.357 -1.917 1.00 0.00 H new ATOM 0 HD2 PHE A 103 -2.212 8.219 1.679 1.00 0.00 H new ATOM 0 HE1 PHE A 103 -4.156 5.887 -2.180 1.00 0.00 H new ATOM 0 HE2 PHE A 103 -1.935 5.749 1.413 1.00 0.00 H new ATOM 0 HZ PHE A 103 -2.909 4.612 -0.514 1.00 0.00 H new ATOM 1554 N GLY A 104 -2.709 13.036 -1.723 1.00 0.00 N ATOM 1555 CA GLY A 104 -2.939 14.469 -1.649 1.00 0.00 C ATOM 1556 C GLY A 104 -1.681 15.202 -1.179 1.00 0.00 C ATOM 1557 O GLY A 104 -1.768 16.287 -0.606 1.00 0.00 O ATOM 0 H GLY A 104 -2.358 12.707 -2.622 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -3.239 14.844 -2.628 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -3.761 14.674 -0.964 1.00 0.00 H new ATOM 1561 N THR A 105 -0.540 14.580 -1.439 1.00 0.00 N ATOM 1562 CA THR A 105 0.734 15.160 -1.050 1.00 0.00 C ATOM 1563 C THR A 105 0.621 15.820 0.326 1.00 0.00 C ATOM 1564 O THR A 105 0.996 16.980 0.494 1.00 0.00 O ATOM 1565 CB THR A 105 1.171 16.126 -2.153 1.00 0.00 C ATOM 1566 OG1 THR A 105 2.377 16.699 -1.655 1.00 0.00 O ATOM 1567 CG2 THR A 105 0.223 17.318 -2.297 1.00 0.00 C ATOM 0 H THR A 105 -0.472 13.680 -1.914 1.00 0.00 H new ATOM 0 HA THR A 105 1.502 14.394 -0.947 1.00 0.00 H new ATOM 0 HB THR A 105 1.228 15.592 -3.101 1.00 0.00 H new ATOM 0 HG1 THR A 105 2.184 17.215 -0.844 1.00 0.00 H new ATOM 0 HG21 THR A 105 0.579 17.972 -3.093 1.00 0.00 H new ATOM 0 HG22 THR A 105 -0.777 16.960 -2.542 1.00 0.00 H new ATOM 0 HG23 THR A 105 0.191 17.872 -1.359 1.00 0.00 H new ATOM 1575 N SER A 106 0.104 15.053 1.274 1.00 0.00 N ATOM 1576 CA SER A 106 -0.063 15.549 2.630 1.00 0.00 C ATOM 1577 C SER A 106 0.150 14.413 3.632 1.00 0.00 C ATOM 1578 O SER A 106 0.906 14.561 4.592 1.00 0.00 O ATOM 1579 CB SER A 106 -1.446 16.174 2.821 1.00 0.00 C ATOM 1580 OG SER A 106 -1.830 16.210 4.193 1.00 0.00 O ATOM 0 H SER A 106 -0.205 14.092 1.130 1.00 0.00 H new ATOM 0 HA SER A 106 0.683 16.324 2.806 1.00 0.00 H new ATOM 0 HB2 SER A 106 -1.445 17.187 2.418 1.00 0.00 H new ATOM 0 HB3 SER A 106 -2.182 15.606 2.253 1.00 0.00 H new ATOM 0 HG SER A 106 -2.718 16.617 4.274 1.00 0.00 H new ATOM 1586 N HIS A 107 -0.530 13.305 3.376 1.00 0.00 N ATOM 1587 CA HIS A 107 -0.425 12.145 4.244 1.00 0.00 C ATOM 1588 C HIS A 107 0.358 11.040 3.532 1.00 0.00 C ATOM 1589 O HIS A 107 -0.217 10.251 2.783 1.00 0.00 O ATOM 1590 CB HIS A 107 -1.808 11.687 4.708 1.00 0.00 C ATOM 1591 CG HIS A 107 -2.368 12.489 5.859 1.00 0.00 C ATOM 1592 ND1 HIS A 107 -2.131 12.166 7.184 1.00 0.00 N ATOM 1593 CD2 HIS A 107 -3.154 13.604 5.869 1.00 0.00 C ATOM 1594 CE1 HIS A 107 -2.752 13.052 7.948 1.00 0.00 C ATOM 1595 NE2 HIS A 107 -3.386 13.942 7.131 1.00 0.00 N ATOM 0 H HIS A 107 -1.156 13.186 2.579 1.00 0.00 H new ATOM 0 HA HIS A 107 0.127 12.410 5.146 1.00 0.00 H new ATOM 0 HB2 HIS A 107 -2.500 11.746 3.868 1.00 0.00 H new ATOM 0 HB3 HIS A 107 -1.752 10.639 5.002 1.00 0.00 H new ATOM 0 HD2 HIS A 107 -3.525 14.123 4.998 1.00 0.00 H new ATOM 0 HE1 HIS A 107 -2.756 13.067 9.028 1.00 0.00 H new ATOM 0 HE2 HIS A 107 -3.946 14.737 7.440 1.00 0.00 H new ATOM 1603 N VAL A 108 1.658 11.019 3.790 1.00 0.00 N ATOM 1604 CA VAL A 108 2.525 10.024 3.182 1.00 0.00 C ATOM 1605 C VAL A 108 2.534 8.764 4.050 1.00 0.00 C ATOM 1606 O VAL A 108 2.605 8.850 5.275 1.00 0.00 O ATOM 1607 CB VAL A 108 3.921 10.611 2.965 1.00 0.00 C ATOM 1608 CG1 VAL A 108 4.927 9.514 2.606 1.00 0.00 C ATOM 1609 CG2 VAL A 108 3.897 11.703 1.894 1.00 0.00 C ATOM 0 H VAL A 108 2.131 11.675 4.412 1.00 0.00 H new ATOM 0 HA VAL A 108 2.150 9.739 2.199 1.00 0.00 H new ATOM 0 HB VAL A 108 4.241 11.067 3.902 1.00 0.00 H new ATOM 0 HG11 VAL A 108 5.911 9.958 2.457 1.00 0.00 H new ATOM 0 HG12 VAL A 108 4.976 8.786 3.416 1.00 0.00 H new ATOM 0 HG13 VAL A 108 4.611 9.016 1.689 1.00 0.00 H new ATOM 0 HG21 VAL A 108 4.902 12.103 1.760 1.00 0.00 H new ATOM 0 HG22 VAL A 108 3.545 11.281 0.952 1.00 0.00 H new ATOM 0 HG23 VAL A 108 3.226 12.504 2.206 1.00 0.00 H new ATOM 1619 N PHE A 109 2.462 7.623 3.381 1.00 0.00 N ATOM 1620 CA PHE A 109 2.460 6.347 4.075 1.00 0.00 C ATOM 1621 C PHE A 109 3.409 5.354 3.400 1.00 0.00 C ATOM 1622 O PHE A 109 3.909 5.614 2.307 1.00 0.00 O ATOM 1623 CB PHE A 109 1.033 5.800 4.004 1.00 0.00 C ATOM 1624 CG PHE A 109 0.091 6.380 5.061 1.00 0.00 C ATOM 1625 CD1 PHE A 109 0.089 5.872 6.322 1.00 0.00 C ATOM 1626 CD2 PHE A 109 -0.745 7.403 4.738 1.00 0.00 C ATOM 1627 CE1 PHE A 109 -0.785 6.411 7.303 1.00 0.00 C ATOM 1628 CE2 PHE A 109 -1.619 7.942 5.719 1.00 0.00 C ATOM 1629 CZ PHE A 109 -1.621 7.434 6.981 1.00 0.00 C ATOM 0 H PHE A 109 2.405 7.556 2.365 1.00 0.00 H new ATOM 0 HA PHE A 109 2.792 6.483 5.104 1.00 0.00 H new ATOM 0 HB2 PHE A 109 0.624 6.007 3.015 1.00 0.00 H new ATOM 0 HB3 PHE A 109 1.064 4.716 4.115 1.00 0.00 H new ATOM 0 HD1 PHE A 109 0.752 5.059 6.578 1.00 0.00 H new ATOM 0 HD2 PHE A 109 -0.744 7.805 3.736 1.00 0.00 H new ATOM 0 HE1 PHE A 109 -0.786 6.008 8.305 1.00 0.00 H new ATOM 0 HE2 PHE A 109 -2.282 8.755 5.463 1.00 0.00 H new ATOM 0 HZ PHE A 109 -2.286 7.843 7.727 1.00 0.00 H new ATOM 1639 N LYS A 110 3.627 4.238 4.079 1.00 0.00 N ATOM 1640 CA LYS A 110 4.506 3.205 3.558 1.00 0.00 C ATOM 1641 C LYS A 110 3.813 1.845 3.673 1.00 0.00 C ATOM 1642 O LYS A 110 3.593 1.348 4.776 1.00 0.00 O ATOM 1643 CB LYS A 110 5.869 3.261 4.252 1.00 0.00 C ATOM 1644 CG LYS A 110 6.716 2.038 3.896 1.00 0.00 C ATOM 1645 CD LYS A 110 6.927 1.143 5.119 1.00 0.00 C ATOM 1646 CE LYS A 110 8.292 1.403 5.760 1.00 0.00 C ATOM 1647 NZ LYS A 110 8.418 2.826 6.149 1.00 0.00 N ATOM 0 H LYS A 110 3.210 4.026 4.986 1.00 0.00 H new ATOM 0 HA LYS A 110 4.705 3.373 2.500 1.00 0.00 H new ATOM 0 HB2 LYS A 110 6.394 4.170 3.957 1.00 0.00 H new ATOM 0 HB3 LYS A 110 5.730 3.309 5.332 1.00 0.00 H new ATOM 0 HG2 LYS A 110 6.226 1.470 3.105 1.00 0.00 H new ATOM 0 HG3 LYS A 110 7.681 2.361 3.506 1.00 0.00 H new ATOM 0 HD2 LYS A 110 6.138 1.326 5.848 1.00 0.00 H new ATOM 0 HD3 LYS A 110 6.853 0.096 4.825 1.00 0.00 H new ATOM 0 HE2 LYS A 110 8.416 0.768 6.637 1.00 0.00 H new ATOM 0 HE3 LYS A 110 9.085 1.139 5.061 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 9.108 3.296 5.529 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 7.494 3.294 6.056 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 8.741 2.889 7.136 1.00 0.00 H new ATOM 1661 N PHE A 111 3.489 1.283 2.518 1.00 0.00 N ATOM 1662 CA PHE A 111 2.826 -0.010 2.476 1.00 0.00 C ATOM 1663 C PHE A 111 3.824 -1.146 2.704 1.00 0.00 C ATOM 1664 O PHE A 111 4.920 -1.136 2.145 1.00 0.00 O ATOM 1665 CB PHE A 111 2.217 -0.154 1.079 1.00 0.00 C ATOM 1666 CG PHE A 111 1.616 -1.533 0.802 1.00 0.00 C ATOM 1667 CD1 PHE A 111 2.426 -2.620 0.697 1.00 0.00 C ATOM 1668 CD2 PHE A 111 0.270 -1.672 0.662 1.00 0.00 C ATOM 1669 CE1 PHE A 111 1.868 -3.900 0.440 1.00 0.00 C ATOM 1670 CE2 PHE A 111 -0.289 -2.952 0.405 1.00 0.00 C ATOM 1671 CZ PHE A 111 0.522 -4.039 0.299 1.00 0.00 C ATOM 0 H PHE A 111 3.673 1.698 1.605 1.00 0.00 H new ATOM 0 HA PHE A 111 2.069 -0.066 3.258 1.00 0.00 H new ATOM 0 HB2 PHE A 111 1.441 0.601 0.952 1.00 0.00 H new ATOM 0 HB3 PHE A 111 2.987 0.052 0.335 1.00 0.00 H new ATOM 0 HD1 PHE A 111 3.494 -2.510 0.809 1.00 0.00 H new ATOM 0 HD2 PHE A 111 -0.374 -0.809 0.746 1.00 0.00 H new ATOM 0 HE1 PHE A 111 2.512 -4.763 0.356 1.00 0.00 H new ATOM 0 HE2 PHE A 111 -1.358 -3.062 0.294 1.00 0.00 H new ATOM 0 HZ PHE A 111 0.097 -5.012 0.103 1.00 0.00 H new ATOM 1681 N VAL A 112 3.410 -2.099 3.526 1.00 0.00 N ATOM 1682 CA VAL A 112 4.254 -3.240 3.835 1.00 0.00 C ATOM 1683 C VAL A 112 3.453 -4.529 3.640 1.00 0.00 C ATOM 1684 O VAL A 112 2.225 -4.516 3.700 1.00 0.00 O ATOM 1685 CB VAL A 112 4.828 -3.100 5.247 1.00 0.00 C ATOM 1686 CG1 VAL A 112 4.296 -1.840 5.932 1.00 0.00 C ATOM 1687 CG2 VAL A 112 4.532 -4.346 6.084 1.00 0.00 C ATOM 0 H VAL A 112 2.500 -2.104 3.988 1.00 0.00 H new ATOM 0 HA VAL A 112 5.105 -3.280 3.156 1.00 0.00 H new ATOM 0 HB VAL A 112 5.910 -3.003 5.161 1.00 0.00 H new ATOM 0 HG11 VAL A 112 4.719 -1.764 6.934 1.00 0.00 H new ATOM 0 HG12 VAL A 112 4.580 -0.963 5.351 1.00 0.00 H new ATOM 0 HG13 VAL A 112 3.209 -1.894 6.000 1.00 0.00 H new ATOM 0 HG21 VAL A 112 4.950 -4.221 7.083 1.00 0.00 H new ATOM 0 HG22 VAL A 112 3.454 -4.487 6.157 1.00 0.00 H new ATOM 0 HG23 VAL A 112 4.981 -5.218 5.609 1.00 0.00 H new ATOM 1697 N ASP A 113 4.182 -5.612 3.411 1.00 0.00 N ATOM 1698 CA ASP A 113 3.554 -6.907 3.207 1.00 0.00 C ATOM 1699 C ASP A 113 4.315 -7.968 4.003 1.00 0.00 C ATOM 1700 O ASP A 113 5.292 -8.535 3.514 1.00 0.00 O ATOM 1701 CB ASP A 113 3.587 -7.308 1.731 1.00 0.00 C ATOM 1702 CG ASP A 113 3.311 -8.788 1.458 1.00 0.00 C ATOM 1703 OD1 ASP A 113 2.130 -9.178 1.585 1.00 0.00 O ATOM 1704 OD2 ASP A 113 4.287 -9.496 1.127 1.00 0.00 O ATOM 0 H ASP A 113 5.201 -5.619 3.362 1.00 0.00 H new ATOM 0 HA ASP A 113 2.518 -6.836 3.538 1.00 0.00 H new ATOM 0 HB2 ASP A 113 2.852 -6.711 1.191 1.00 0.00 H new ATOM 0 HB3 ASP A 113 4.565 -7.055 1.323 1.00 0.00 H new ATOM 1709 N PRO A 114 3.827 -8.212 5.249 1.00 0.00 N ATOM 1710 CA PRO A 114 4.451 -9.196 6.118 1.00 0.00 C ATOM 1711 C PRO A 114 4.111 -10.619 5.668 1.00 0.00 C ATOM 1712 O PRO A 114 4.607 -11.589 6.238 1.00 0.00 O ATOM 1713 CB PRO A 114 3.935 -8.874 7.511 1.00 0.00 C ATOM 1714 CG PRO A 114 2.691 -8.025 7.309 1.00 0.00 C ATOM 1715 CD PRO A 114 2.673 -7.561 5.862 1.00 0.00 C ATOM 0 HA PRO A 114 5.540 -9.151 6.091 1.00 0.00 H new ATOM 0 HB2 PRO A 114 3.701 -9.785 8.061 1.00 0.00 H new ATOM 0 HB3 PRO A 114 4.685 -8.336 8.091 1.00 0.00 H new ATOM 0 HG2 PRO A 114 1.794 -8.602 7.536 1.00 0.00 H new ATOM 0 HG3 PRO A 114 2.699 -7.169 7.984 1.00 0.00 H new ATOM 0 HD2 PRO A 114 1.746 -7.849 5.366 1.00 0.00 H new ATOM 0 HD3 PRO A 114 2.748 -6.476 5.793 1.00 0.00 H new ATOM 1723 N SER A 115 3.266 -10.697 4.650 1.00 0.00 N ATOM 1724 CA SER A 115 2.854 -11.985 4.118 1.00 0.00 C ATOM 1725 C SER A 115 4.023 -12.647 3.387 1.00 0.00 C ATOM 1726 O SER A 115 4.023 -13.860 3.179 1.00 0.00 O ATOM 1727 CB SER A 115 1.657 -11.834 3.177 1.00 0.00 C ATOM 1728 OG SER A 115 0.746 -12.924 3.293 1.00 0.00 O ATOM 0 H SER A 115 2.856 -9.890 4.180 1.00 0.00 H new ATOM 0 HA SER A 115 2.550 -12.618 4.951 1.00 0.00 H new ATOM 0 HB2 SER A 115 1.137 -10.902 3.398 1.00 0.00 H new ATOM 0 HB3 SER A 115 2.011 -11.765 2.148 1.00 0.00 H new ATOM 0 HG SER A 115 -0.005 -12.790 2.678 1.00 0.00 H new ATOM 1734 N GLY A 116 4.992 -11.823 3.017 1.00 0.00 N ATOM 1735 CA GLY A 116 6.165 -12.314 2.314 1.00 0.00 C ATOM 1736 C GLY A 116 7.444 -11.993 3.090 1.00 0.00 C ATOM 1737 O GLY A 116 7.497 -12.169 4.306 1.00 0.00 O ATOM 0 H GLY A 116 4.989 -10.818 3.191 1.00 0.00 H new ATOM 0 HA2 GLY A 116 6.083 -13.391 2.171 1.00 0.00 H new ATOM 0 HA3 GLY A 116 6.214 -11.864 1.323 1.00 0.00 H new ATOM 1741 N PRO A 117 8.469 -11.515 2.335 1.00 0.00 N ATOM 1742 CA PRO A 117 9.745 -11.168 2.939 1.00 0.00 C ATOM 1743 C PRO A 117 9.647 -9.847 3.704 1.00 0.00 C ATOM 1744 O PRO A 117 10.005 -8.793 3.179 1.00 0.00 O ATOM 1745 CB PRO A 117 10.726 -11.112 1.780 1.00 0.00 C ATOM 1746 CG PRO A 117 9.881 -10.971 0.524 1.00 0.00 C ATOM 1747 CD PRO A 117 8.442 -11.294 0.892 1.00 0.00 C ATOM 0 HA PRO A 117 10.070 -11.895 3.684 1.00 0.00 H new ATOM 0 HB2 PRO A 117 11.409 -10.270 1.887 1.00 0.00 H new ATOM 0 HB3 PRO A 117 11.336 -12.014 1.741 1.00 0.00 H new ATOM 0 HG2 PRO A 117 9.955 -9.959 0.126 1.00 0.00 H new ATOM 0 HG3 PRO A 117 10.237 -11.647 -0.254 1.00 0.00 H new ATOM 0 HD2 PRO A 117 7.773 -10.475 0.629 1.00 0.00 H new ATOM 0 HD3 PRO A 117 8.087 -12.178 0.363 1.00 0.00 H new ATOM 1755 N SER A 118 9.162 -9.946 4.933 1.00 0.00 N ATOM 1756 CA SER A 118 9.012 -8.772 5.776 1.00 0.00 C ATOM 1757 C SER A 118 10.352 -8.044 5.901 1.00 0.00 C ATOM 1758 O SER A 118 11.347 -8.634 6.320 1.00 0.00 O ATOM 1759 CB SER A 118 8.484 -9.152 7.161 1.00 0.00 C ATOM 1760 OG SER A 118 9.504 -9.704 7.989 1.00 0.00 O ATOM 0 H SER A 118 8.868 -10.822 5.365 1.00 0.00 H new ATOM 0 HA SER A 118 8.285 -8.107 5.310 1.00 0.00 H new ATOM 0 HB2 SER A 118 8.064 -8.269 7.643 1.00 0.00 H new ATOM 0 HB3 SER A 118 7.674 -9.873 7.055 1.00 0.00 H new ATOM 0 HG SER A 118 10.377 -9.572 7.564 1.00 0.00 H new ATOM 1766 N SER A 119 10.335 -6.772 5.528 1.00 0.00 N ATOM 1767 CA SER A 119 11.536 -5.957 5.593 1.00 0.00 C ATOM 1768 C SER A 119 12.618 -6.547 4.686 1.00 0.00 C ATOM 1769 O SER A 119 12.708 -7.764 4.531 1.00 0.00 O ATOM 1770 CB SER A 119 12.050 -5.847 7.030 1.00 0.00 C ATOM 1771 OG SER A 119 12.864 -4.692 7.219 1.00 0.00 O ATOM 0 H SER A 119 9.508 -6.286 5.180 1.00 0.00 H new ATOM 0 HA SER A 119 11.288 -4.954 5.247 1.00 0.00 H new ATOM 0 HB2 SER A 119 11.204 -5.810 7.716 1.00 0.00 H new ATOM 0 HB3 SER A 119 12.624 -6.740 7.279 1.00 0.00 H new ATOM 0 HG SER A 119 13.171 -4.657 8.149 1.00 0.00 H new ATOM 1777 N GLY A 120 13.412 -5.656 4.110 1.00 0.00 N ATOM 1778 CA GLY A 120 14.485 -6.073 3.223 1.00 0.00 C ATOM 1779 C GLY A 120 14.271 -5.525 1.810 1.00 0.00 C ATOM 1780 O GLY A 120 13.195 -5.023 1.491 1.00 0.00 O ATOM 0 H GLY A 120 13.334 -4.647 4.240 1.00 0.00 H new ATOM 0 HA2 GLY A 120 15.441 -5.722 3.612 1.00 0.00 H new ATOM 0 HA3 GLY A 120 14.534 -7.161 3.192 1.00 0.00 H new TER 1784 GLY A 120