USER MOD reduce.3.24.130724 H: found=0, std=0, add=879, rem=0, adj=36 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 -81:sc= 0.259 USER MOD Set 1.2: A 107 HIS : no HD1:sc= 0.237 K(o=0.5,f=-2.7!) USER MOD Set 2.1: A 74 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 92 THR OG1 : rot 180:sc= -0.0524 USER MOD Set 3.1: A 61 HIS : no HE2:sc= -4.73! C(o=-4.7!,f=-7.9!) USER MOD Set 3.2: A 82 THR OG1 : rot -33:sc= 0.0108 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 18:sc= 0.594 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 30:sc= 0.0025 USER MOD Single : A 10 LYS NZ :NH3+ -131:sc= 0.113 (180deg=0) USER MOD Single : A 13 TYR OH : rot 150:sc= -2.4! USER MOD Single : A 18 SER OG : rot 180:sc= -0.806 USER MOD Single : A 22 SER OG : rot 180:sc= -0.173 USER MOD Single : A 24 SER OG : rot 180:sc= 0.031 USER MOD Single : A 27 LYS NZ :NH3+ 156:sc= -0.0462 (180deg=-0.337) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 34 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 36 SER OG : rot 96:sc= -0.202 USER MOD Single : A 38 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 49 SER OG : rot -90:sc= 0.812 USER MOD Single : A 51 GLN : amide:sc= -1.75 K(o=-1.7,f=-3.8!) USER MOD Single : A 58 GLN : amide:sc= -5.57! K(o=-5.6!,f=-2.4) USER MOD Single : A 60 HIS : no HE2:sc= -5.94! C(o=-5.9!,f=-9.8!) USER MOD Single : A 62 CYS SG : rot 80:sc= -0.237 USER MOD Single : A 65 THR OG1 : rot -131:sc= -2.28! USER MOD Single : A 66 ASN : amide:sc= 0 K(o=0,f=-1.5) USER MOD Single : A 67 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 72 THR OG1 : rot 38:sc= 0.188 USER MOD Single : A 77 SER OG : rot 95:sc= 0.53 USER MOD Single : A 78 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 83 TYR OH : rot 30:sc= -0.476 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= 0.00922 USER MOD Single : A 94 MET CE :methyl -139:sc= -0.312 (180deg=-4.34!) USER MOD Single : A 96 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 97 SER OG : rot -8:sc= 0.342! USER MOD Single : A 99 MET CE :methyl 177:sc= -5.63! (180deg=-5.88!) USER MOD Single : A 102 GLN : amide:sc= -4.2! C(o=-4.2!,f=-8.1!) USER MOD Single : A 105 THR OG1 : rot 52:sc= -0.496 USER MOD Single : A 110 LYS NZ :NH3+ 158:sc= 0 (180deg=-0.337) USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -2.613 -22.557 -8.471 1.00 0.00 N ATOM 2 CA GLY A 1 -3.937 -22.870 -8.981 1.00 0.00 C ATOM 3 C GLY A 1 -4.980 -21.890 -8.438 1.00 0.00 C ATOM 4 O GLY A 1 -5.026 -20.734 -8.854 1.00 0.00 O ATOM 0 H1 GLY A 1 -1.924 -23.236 -8.854 1.00 0.00 H new ATOM 0 H2 GLY A 1 -2.348 -21.594 -8.761 1.00 0.00 H new ATOM 0 H3 GLY A 1 -2.618 -22.617 -7.433 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -3.929 -22.832 -10.070 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -4.208 -23.888 -8.700 1.00 0.00 H new ATOM 8 N SER A 2 -5.791 -22.390 -7.516 1.00 0.00 N ATOM 9 CA SER A 2 -6.830 -21.573 -6.912 1.00 0.00 C ATOM 10 C SER A 2 -7.198 -22.129 -5.535 1.00 0.00 C ATOM 11 O SER A 2 -7.999 -23.056 -5.430 1.00 0.00 O ATOM 12 CB SER A 2 -8.069 -21.508 -7.806 1.00 0.00 C ATOM 13 OG SER A 2 -7.883 -20.630 -8.913 1.00 0.00 O ATOM 0 H SER A 2 -5.749 -23.350 -7.173 1.00 0.00 H new ATOM 0 HA SER A 2 -6.445 -20.560 -6.797 1.00 0.00 H new ATOM 0 HB2 SER A 2 -8.305 -22.507 -8.172 1.00 0.00 H new ATOM 0 HB3 SER A 2 -8.923 -21.174 -7.218 1.00 0.00 H new ATOM 0 HG SER A 2 -6.926 -20.463 -9.041 1.00 0.00 H new ATOM 19 N SER A 3 -6.594 -21.540 -4.513 1.00 0.00 N ATOM 20 CA SER A 3 -6.848 -21.965 -3.147 1.00 0.00 C ATOM 21 C SER A 3 -7.096 -20.746 -2.257 1.00 0.00 C ATOM 22 O SER A 3 -8.171 -20.605 -1.677 1.00 0.00 O ATOM 23 CB SER A 3 -5.682 -22.792 -2.602 1.00 0.00 C ATOM 24 OG SER A 3 -5.863 -23.130 -1.229 1.00 0.00 O ATOM 0 H SER A 3 -5.929 -20.772 -4.604 1.00 0.00 H new ATOM 0 HA SER A 3 -7.737 -22.595 -3.145 1.00 0.00 H new ATOM 0 HB2 SER A 3 -5.579 -23.704 -3.189 1.00 0.00 H new ATOM 0 HB3 SER A 3 -4.754 -22.231 -2.718 1.00 0.00 H new ATOM 0 HG SER A 3 -5.099 -23.659 -0.919 1.00 0.00 H new ATOM 30 N GLY A 4 -6.083 -19.895 -2.178 1.00 0.00 N ATOM 31 CA GLY A 4 -6.178 -18.692 -1.368 1.00 0.00 C ATOM 32 C GLY A 4 -5.086 -18.666 -0.296 1.00 0.00 C ATOM 33 O GLY A 4 -4.348 -19.636 -0.133 1.00 0.00 O ATOM 0 H GLY A 4 -5.193 -20.015 -2.661 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -6.088 -17.812 -2.005 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -7.159 -18.644 -0.895 1.00 0.00 H new ATOM 37 N SER A 5 -5.020 -17.545 0.407 1.00 0.00 N ATOM 38 CA SER A 5 -4.031 -17.380 1.459 1.00 0.00 C ATOM 39 C SER A 5 -4.729 -17.207 2.810 1.00 0.00 C ATOM 40 O SER A 5 -5.891 -16.809 2.866 1.00 0.00 O ATOM 41 CB SER A 5 -3.120 -16.184 1.176 1.00 0.00 C ATOM 42 OG SER A 5 -1.804 -16.383 1.685 1.00 0.00 O ATOM 0 H SER A 5 -5.635 -16.743 0.269 1.00 0.00 H new ATOM 0 HA SER A 5 -3.411 -18.276 1.489 1.00 0.00 H new ATOM 0 HB2 SER A 5 -3.071 -16.012 0.101 1.00 0.00 H new ATOM 0 HB3 SER A 5 -3.550 -15.287 1.623 1.00 0.00 H new ATOM 0 HG SER A 5 -1.253 -15.598 1.483 1.00 0.00 H new ATOM 48 N SER A 6 -3.990 -17.516 3.865 1.00 0.00 N ATOM 49 CA SER A 6 -4.523 -17.401 5.212 1.00 0.00 C ATOM 50 C SER A 6 -3.415 -16.977 6.179 1.00 0.00 C ATOM 51 O SER A 6 -2.584 -17.794 6.573 1.00 0.00 O ATOM 52 CB SER A 6 -5.152 -18.718 5.671 1.00 0.00 C ATOM 53 OG SER A 6 -6.542 -18.781 5.364 1.00 0.00 O ATOM 0 H SER A 6 -3.026 -17.846 3.814 1.00 0.00 H new ATOM 0 HA SER A 6 -5.303 -16.640 5.206 1.00 0.00 H new ATOM 0 HB2 SER A 6 -4.637 -19.552 5.193 1.00 0.00 H new ATOM 0 HB3 SER A 6 -5.013 -18.831 6.746 1.00 0.00 H new ATOM 0 HG SER A 6 -6.722 -18.261 4.553 1.00 0.00 H new ATOM 59 N GLY A 7 -3.438 -15.700 6.532 1.00 0.00 N ATOM 60 CA GLY A 7 -2.446 -15.158 7.445 1.00 0.00 C ATOM 61 C GLY A 7 -2.848 -13.762 7.925 1.00 0.00 C ATOM 62 O GLY A 7 -2.355 -12.759 7.411 1.00 0.00 O ATOM 0 H GLY A 7 -4.128 -15.025 6.202 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -2.333 -15.823 8.302 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -1.477 -15.111 6.948 1.00 0.00 H new ATOM 66 N PRO A 8 -3.763 -13.741 8.932 1.00 0.00 N ATOM 67 CA PRO A 8 -4.236 -12.485 9.487 1.00 0.00 C ATOM 68 C PRO A 8 -3.177 -11.851 10.391 1.00 0.00 C ATOM 69 O PRO A 8 -3.259 -10.667 10.713 1.00 0.00 O ATOM 70 CB PRO A 8 -5.515 -12.840 10.229 1.00 0.00 C ATOM 71 CG PRO A 8 -5.462 -14.342 10.455 1.00 0.00 C ATOM 72 CD PRO A 8 -4.368 -14.909 9.565 1.00 0.00 C ATOM 0 HA PRO A 8 -4.430 -11.734 8.722 1.00 0.00 H new ATOM 0 HB2 PRO A 8 -5.579 -12.304 11.176 1.00 0.00 H new ATOM 0 HB3 PRO A 8 -6.394 -12.563 9.647 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -5.255 -14.563 11.502 1.00 0.00 H new ATOM 0 HG3 PRO A 8 -6.423 -14.798 10.216 1.00 0.00 H new ATOM 0 HD2 PRO A 8 -3.635 -15.469 10.146 1.00 0.00 H new ATOM 0 HD3 PRO A 8 -4.777 -15.594 8.823 1.00 0.00 H new ATOM 80 N GLU A 9 -2.206 -12.668 10.774 1.00 0.00 N ATOM 81 CA GLU A 9 -1.132 -12.202 11.634 1.00 0.00 C ATOM 82 C GLU A 9 0.014 -11.636 10.793 1.00 0.00 C ATOM 83 O GLU A 9 1.046 -11.237 11.331 1.00 0.00 O ATOM 84 CB GLU A 9 -0.638 -13.322 12.551 1.00 0.00 C ATOM 85 CG GLU A 9 -0.140 -14.518 11.736 1.00 0.00 C ATOM 86 CD GLU A 9 1.233 -14.982 12.227 1.00 0.00 C ATOM 87 OE1 GLU A 9 2.200 -14.221 12.009 1.00 0.00 O ATOM 88 OE2 GLU A 9 1.283 -16.087 12.809 1.00 0.00 O ATOM 0 H GLU A 9 -2.141 -13.650 10.504 1.00 0.00 H new ATOM 0 HA GLU A 9 -1.520 -11.404 12.267 1.00 0.00 H new ATOM 0 HB2 GLU A 9 0.166 -12.949 13.185 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -1.445 -13.638 13.212 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -0.854 -15.338 11.813 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -0.080 -14.245 10.682 1.00 0.00 H new ATOM 95 N LYS A 10 -0.205 -11.621 9.486 1.00 0.00 N ATOM 96 CA LYS A 10 0.797 -11.111 8.565 1.00 0.00 C ATOM 97 C LYS A 10 0.100 -10.393 7.407 1.00 0.00 C ATOM 98 O LYS A 10 0.248 -10.784 6.251 1.00 0.00 O ATOM 99 CB LYS A 10 1.734 -12.235 8.117 1.00 0.00 C ATOM 100 CG LYS A 10 0.944 -13.402 7.520 1.00 0.00 C ATOM 101 CD LYS A 10 1.518 -14.743 7.979 1.00 0.00 C ATOM 102 CE LYS A 10 2.314 -15.412 6.857 1.00 0.00 C ATOM 103 NZ LYS A 10 3.767 -15.235 7.075 1.00 0.00 N ATOM 0 H LYS A 10 -1.061 -11.954 9.043 1.00 0.00 H new ATOM 0 HA LYS A 10 1.432 -10.376 9.061 1.00 0.00 H new ATOM 0 HB2 LYS A 10 2.439 -11.853 7.379 1.00 0.00 H new ATOM 0 HB3 LYS A 10 2.320 -12.585 8.967 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -0.102 -13.329 7.818 1.00 0.00 H new ATOM 0 HG3 LYS A 10 0.970 -13.345 6.432 1.00 0.00 H new ATOM 0 HD2 LYS A 10 2.162 -14.590 8.845 1.00 0.00 H new ATOM 0 HD3 LYS A 10 0.708 -15.400 8.296 1.00 0.00 H new ATOM 0 HE2 LYS A 10 2.073 -16.474 6.816 1.00 0.00 H new ATOM 0 HE3 LYS A 10 2.030 -14.983 5.896 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 4.210 -14.893 6.199 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 3.922 -14.542 7.835 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 4.191 -16.145 7.345 1.00 0.00 H new ATOM 117 N LEU A 11 -0.644 -9.354 7.759 1.00 0.00 N ATOM 118 CA LEU A 11 -1.363 -8.578 6.764 1.00 0.00 C ATOM 119 C LEU A 11 -0.579 -7.301 6.455 1.00 0.00 C ATOM 120 O LEU A 11 0.198 -6.830 7.283 1.00 0.00 O ATOM 121 CB LEU A 11 -2.801 -8.321 7.221 1.00 0.00 C ATOM 122 CG LEU A 11 -3.623 -9.561 7.577 1.00 0.00 C ATOM 123 CD1 LEU A 11 -4.849 -9.185 8.412 1.00 0.00 C ATOM 124 CD2 LEU A 11 -4.004 -10.346 6.321 1.00 0.00 C ATOM 0 H LEU A 11 -0.764 -9.032 8.719 1.00 0.00 H new ATOM 0 HA LEU A 11 -1.444 -9.137 5.831 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -2.773 -7.666 8.092 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -3.321 -7.779 6.431 1.00 0.00 H new ATOM 0 HG LEU A 11 -3.004 -10.216 8.190 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -5.416 -10.085 8.651 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -4.527 -8.703 9.335 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -5.479 -8.499 7.845 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -4.588 -11.222 6.603 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -4.597 -9.712 5.661 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -3.100 -10.664 5.802 1.00 0.00 H new ATOM 136 N PRO A 12 -0.815 -6.764 5.228 1.00 0.00 N ATOM 137 CA PRO A 12 -0.140 -5.551 4.799 1.00 0.00 C ATOM 138 C PRO A 12 -0.732 -4.321 5.490 1.00 0.00 C ATOM 139 O PRO A 12 -1.949 -4.205 5.623 1.00 0.00 O ATOM 140 CB PRO A 12 -0.306 -5.522 3.288 1.00 0.00 C ATOM 141 CG PRO A 12 -1.458 -6.464 2.977 1.00 0.00 C ATOM 142 CD PRO A 12 -1.729 -7.296 4.220 1.00 0.00 C ATOM 0 HA PRO A 12 0.916 -5.538 5.070 1.00 0.00 H new ATOM 0 HB2 PRO A 12 -0.522 -4.512 2.938 1.00 0.00 H new ATOM 0 HB3 PRO A 12 0.608 -5.844 2.788 1.00 0.00 H new ATOM 0 HG2 PRO A 12 -2.347 -5.900 2.694 1.00 0.00 H new ATOM 0 HG3 PRO A 12 -1.208 -7.108 2.134 1.00 0.00 H new ATOM 0 HD2 PRO A 12 -2.767 -7.205 4.539 1.00 0.00 H new ATOM 0 HD3 PRO A 12 -1.544 -8.354 4.036 1.00 0.00 H new ATOM 150 N TYR A 13 0.158 -3.433 5.910 1.00 0.00 N ATOM 151 CA TYR A 13 -0.261 -2.216 6.584 1.00 0.00 C ATOM 152 C TYR A 13 0.430 -0.991 5.982 1.00 0.00 C ATOM 153 O TYR A 13 1.432 -1.121 5.280 1.00 0.00 O ATOM 154 CB TYR A 13 0.176 -2.369 8.042 1.00 0.00 C ATOM 155 CG TYR A 13 1.667 -2.665 8.216 1.00 0.00 C ATOM 156 CD1 TYR A 13 2.128 -3.963 8.127 1.00 0.00 C ATOM 157 CD2 TYR A 13 2.551 -1.634 8.464 1.00 0.00 C ATOM 158 CE1 TYR A 13 3.531 -4.241 8.291 1.00 0.00 C ATOM 159 CE2 TYR A 13 3.954 -1.913 8.628 1.00 0.00 C ATOM 160 CZ TYR A 13 4.375 -3.203 8.534 1.00 0.00 C ATOM 161 OH TYR A 13 5.700 -3.466 8.689 1.00 0.00 O ATOM 0 H TYR A 13 1.167 -3.532 5.796 1.00 0.00 H new ATOM 0 HA TYR A 13 -1.337 -2.072 6.484 1.00 0.00 H new ATOM 0 HB2 TYR A 13 -0.068 -1.454 8.582 1.00 0.00 H new ATOM 0 HB3 TYR A 13 -0.400 -3.173 8.501 1.00 0.00 H new ATOM 0 HD1 TYR A 13 1.436 -4.770 7.934 1.00 0.00 H new ATOM 0 HD2 TYR A 13 2.190 -0.618 8.535 1.00 0.00 H new ATOM 0 HE1 TYR A 13 3.905 -5.252 8.223 1.00 0.00 H new ATOM 0 HE2 TYR A 13 4.656 -1.116 8.821 1.00 0.00 H new ATOM 0 HH TYR A 13 6.224 -2.696 8.384 1.00 0.00 H new ATOM 171 N LEU A 14 -0.131 0.172 6.280 1.00 0.00 N ATOM 172 CA LEU A 14 0.419 1.419 5.777 1.00 0.00 C ATOM 173 C LEU A 14 0.921 2.260 6.953 1.00 0.00 C ATOM 174 O LEU A 14 0.126 2.779 7.734 1.00 0.00 O ATOM 175 CB LEU A 14 -0.605 2.140 4.898 1.00 0.00 C ATOM 176 CG LEU A 14 -1.111 1.362 3.682 1.00 0.00 C ATOM 177 CD1 LEU A 14 -2.491 1.860 3.248 1.00 0.00 C ATOM 178 CD2 LEU A 14 -0.097 1.414 2.537 1.00 0.00 C ATOM 0 H LEU A 14 -0.961 0.277 6.864 1.00 0.00 H new ATOM 0 HA LEU A 14 1.277 1.225 5.133 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -1.462 2.406 5.517 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -0.162 3.073 4.549 1.00 0.00 H new ATOM 0 HG LEU A 14 -1.221 0.316 3.968 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -2.828 1.290 2.382 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -3.199 1.729 4.066 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -2.431 2.916 2.986 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -0.481 0.853 1.685 1.00 0.00 H new ATOM 0 HD22 LEU A 14 0.068 2.451 2.244 1.00 0.00 H new ATOM 0 HD23 LEU A 14 0.845 0.975 2.865 1.00 0.00 H new ATOM 190 N VAL A 15 2.239 2.369 7.040 1.00 0.00 N ATOM 191 CA VAL A 15 2.857 3.138 8.107 1.00 0.00 C ATOM 192 C VAL A 15 3.090 4.572 7.627 1.00 0.00 C ATOM 193 O VAL A 15 4.028 4.834 6.876 1.00 0.00 O ATOM 194 CB VAL A 15 4.140 2.448 8.574 1.00 0.00 C ATOM 195 CG1 VAL A 15 5.229 2.532 7.502 1.00 0.00 C ATOM 196 CG2 VAL A 15 4.628 3.037 9.899 1.00 0.00 C ATOM 0 H VAL A 15 2.896 1.938 6.389 1.00 0.00 H new ATOM 0 HA VAL A 15 2.197 3.188 8.973 1.00 0.00 H new ATOM 0 HB VAL A 15 3.913 1.395 8.739 1.00 0.00 H new ATOM 0 HG11 VAL A 15 6.130 2.034 7.859 1.00 0.00 H new ATOM 0 HG12 VAL A 15 4.882 2.044 6.591 1.00 0.00 H new ATOM 0 HG13 VAL A 15 5.452 3.578 7.291 1.00 0.00 H new ATOM 0 HG21 VAL A 15 5.541 2.529 10.209 1.00 0.00 H new ATOM 0 HG22 VAL A 15 4.830 4.101 9.772 1.00 0.00 H new ATOM 0 HG23 VAL A 15 3.861 2.902 10.662 1.00 0.00 H new ATOM 206 N GLU A 16 2.220 5.463 8.081 1.00 0.00 N ATOM 207 CA GLU A 16 2.319 6.863 7.707 1.00 0.00 C ATOM 208 C GLU A 16 3.767 7.343 7.825 1.00 0.00 C ATOM 209 O GLU A 16 4.432 7.081 8.826 1.00 0.00 O ATOM 210 CB GLU A 16 1.385 7.725 8.558 1.00 0.00 C ATOM 211 CG GLU A 16 1.581 9.212 8.253 1.00 0.00 C ATOM 212 CD GLU A 16 0.976 10.082 9.356 1.00 0.00 C ATOM 213 OE1 GLU A 16 -0.217 9.865 9.661 1.00 0.00 O ATOM 214 OE2 GLU A 16 1.719 10.945 9.870 1.00 0.00 O ATOM 0 H GLU A 16 1.444 5.242 8.704 1.00 0.00 H new ATOM 0 HA GLU A 16 2.007 6.964 6.668 1.00 0.00 H new ATOM 0 HB2 GLU A 16 0.349 7.444 8.366 1.00 0.00 H new ATOM 0 HB3 GLU A 16 1.575 7.539 9.615 1.00 0.00 H new ATOM 0 HG2 GLU A 16 2.645 9.430 8.155 1.00 0.00 H new ATOM 0 HG3 GLU A 16 1.117 9.455 7.297 1.00 0.00 H new ATOM 221 N LEU A 17 4.213 8.037 6.788 1.00 0.00 N ATOM 222 CA LEU A 17 5.570 8.555 6.762 1.00 0.00 C ATOM 223 C LEU A 17 5.527 10.083 6.682 1.00 0.00 C ATOM 224 O LEU A 17 4.492 10.661 6.353 1.00 0.00 O ATOM 225 CB LEU A 17 6.372 7.903 5.634 1.00 0.00 C ATOM 226 CG LEU A 17 6.698 6.419 5.814 1.00 0.00 C ATOM 227 CD1 LEU A 17 7.857 5.998 4.908 1.00 0.00 C ATOM 228 CD2 LEU A 17 6.971 6.092 7.284 1.00 0.00 C ATOM 0 H LEU A 17 3.658 8.253 5.960 1.00 0.00 H new ATOM 0 HA LEU A 17 6.093 8.298 7.683 1.00 0.00 H new ATOM 0 HB2 LEU A 17 5.816 8.022 4.704 1.00 0.00 H new ATOM 0 HB3 LEU A 17 7.308 8.449 5.518 1.00 0.00 H new ATOM 0 HG LEU A 17 5.826 5.839 5.512 1.00 0.00 H new ATOM 0 HD11 LEU A 17 8.068 4.939 5.056 1.00 0.00 H new ATOM 0 HD12 LEU A 17 7.587 6.172 3.867 1.00 0.00 H new ATOM 0 HD13 LEU A 17 8.743 6.583 5.155 1.00 0.00 H new ATOM 0 HD21 LEU A 17 7.200 5.031 7.384 1.00 0.00 H new ATOM 0 HD22 LEU A 17 7.818 6.681 7.637 1.00 0.00 H new ATOM 0 HD23 LEU A 17 6.090 6.331 7.880 1.00 0.00 H new ATOM 240 N SER A 18 6.663 10.692 6.989 1.00 0.00 N ATOM 241 CA SER A 18 6.767 12.141 6.956 1.00 0.00 C ATOM 242 C SER A 18 6.273 12.670 5.608 1.00 0.00 C ATOM 243 O SER A 18 5.965 11.892 4.706 1.00 0.00 O ATOM 244 CB SER A 18 8.206 12.595 7.209 1.00 0.00 C ATOM 245 OG SER A 18 8.296 13.490 8.315 1.00 0.00 O ATOM 0 H SER A 18 7.519 10.209 7.262 1.00 0.00 H new ATOM 0 HA SER A 18 6.141 12.548 7.750 1.00 0.00 H new ATOM 0 HB2 SER A 18 8.834 11.724 7.395 1.00 0.00 H new ATOM 0 HB3 SER A 18 8.595 13.083 6.315 1.00 0.00 H new ATOM 0 HG SER A 18 9.230 13.756 8.446 1.00 0.00 H new ATOM 251 N PRO A 19 6.211 14.026 5.511 1.00 0.00 N ATOM 252 CA PRO A 19 5.759 14.668 4.288 1.00 0.00 C ATOM 253 C PRO A 19 6.838 14.606 3.205 1.00 0.00 C ATOM 254 O PRO A 19 6.603 15.004 2.066 1.00 0.00 O ATOM 255 CB PRO A 19 5.410 16.090 4.697 1.00 0.00 C ATOM 256 CG PRO A 19 6.113 16.327 6.024 1.00 0.00 C ATOM 257 CD PRO A 19 6.567 14.978 6.558 1.00 0.00 C ATOM 0 HA PRO A 19 4.896 14.171 3.846 1.00 0.00 H new ATOM 0 HB2 PRO A 19 5.743 16.805 3.945 1.00 0.00 H new ATOM 0 HB3 PRO A 19 4.332 16.214 4.799 1.00 0.00 H new ATOM 0 HG2 PRO A 19 6.967 16.992 5.891 1.00 0.00 H new ATOM 0 HG3 PRO A 19 5.440 16.811 6.732 1.00 0.00 H new ATOM 0 HD2 PRO A 19 7.639 14.970 6.753 1.00 0.00 H new ATOM 0 HD3 PRO A 19 6.071 14.737 7.498 1.00 0.00 H new ATOM 265 N ASP A 20 7.998 14.102 3.599 1.00 0.00 N ATOM 266 CA ASP A 20 9.114 13.982 2.676 1.00 0.00 C ATOM 267 C ASP A 20 9.364 12.503 2.374 1.00 0.00 C ATOM 268 O ASP A 20 10.123 12.171 1.465 1.00 0.00 O ATOM 269 CB ASP A 20 10.394 14.564 3.281 1.00 0.00 C ATOM 270 CG ASP A 20 10.318 16.047 3.650 1.00 0.00 C ATOM 271 OD1 ASP A 20 9.343 16.411 4.341 1.00 0.00 O ATOM 272 OD2 ASP A 20 11.239 16.783 3.233 1.00 0.00 O ATOM 0 H ASP A 20 8.189 13.772 4.545 1.00 0.00 H new ATOM 0 HA ASP A 20 8.862 14.531 1.769 1.00 0.00 H new ATOM 0 HB2 ASP A 20 10.647 13.995 4.176 1.00 0.00 H new ATOM 0 HB3 ASP A 20 11.210 14.423 2.572 1.00 0.00 H new ATOM 277 N GLY A 21 8.711 11.654 3.154 1.00 0.00 N ATOM 278 CA GLY A 21 8.853 10.219 2.982 1.00 0.00 C ATOM 279 C GLY A 21 9.979 9.669 3.860 1.00 0.00 C ATOM 280 O GLY A 21 10.752 8.817 3.423 1.00 0.00 O ATOM 0 H GLY A 21 8.082 11.933 3.907 1.00 0.00 H new ATOM 0 HA2 GLY A 21 7.915 9.724 3.235 1.00 0.00 H new ATOM 0 HA3 GLY A 21 9.060 9.993 1.936 1.00 0.00 H new ATOM 284 N SER A 22 10.037 10.179 5.081 1.00 0.00 N ATOM 285 CA SER A 22 11.056 9.751 6.024 1.00 0.00 C ATOM 286 C SER A 22 10.399 9.244 7.309 1.00 0.00 C ATOM 287 O SER A 22 9.238 9.546 7.578 1.00 0.00 O ATOM 288 CB SER A 22 12.029 10.889 6.338 1.00 0.00 C ATOM 289 OG SER A 22 12.850 10.593 7.465 1.00 0.00 O ATOM 0 H SER A 22 9.394 10.885 5.439 1.00 0.00 H new ATOM 0 HA SER A 22 11.624 8.939 5.569 1.00 0.00 H new ATOM 0 HB2 SER A 22 12.660 11.077 5.469 1.00 0.00 H new ATOM 0 HB3 SER A 22 11.468 11.804 6.528 1.00 0.00 H new ATOM 0 HG SER A 22 13.459 11.343 7.632 1.00 0.00 H new ATOM 295 N ASP A 23 11.171 8.481 8.069 1.00 0.00 N ATOM 296 CA ASP A 23 10.679 7.929 9.320 1.00 0.00 C ATOM 297 C ASP A 23 10.950 8.922 10.452 1.00 0.00 C ATOM 298 O ASP A 23 12.094 9.095 10.870 1.00 0.00 O ATOM 299 CB ASP A 23 11.390 6.618 9.661 1.00 0.00 C ATOM 300 CG ASP A 23 12.881 6.583 9.320 1.00 0.00 C ATOM 301 OD1 ASP A 23 13.492 7.673 9.331 1.00 0.00 O ATOM 302 OD2 ASP A 23 13.377 5.466 9.056 1.00 0.00 O ATOM 0 H ASP A 23 12.134 8.232 7.842 1.00 0.00 H new ATOM 0 HA ASP A 23 9.611 7.742 9.209 1.00 0.00 H new ATOM 0 HB2 ASP A 23 11.272 6.425 10.727 1.00 0.00 H new ATOM 0 HB3 ASP A 23 10.893 5.804 9.133 1.00 0.00 H new ATOM 307 N SER A 24 9.879 9.547 10.917 1.00 0.00 N ATOM 308 CA SER A 24 9.986 10.518 11.993 1.00 0.00 C ATOM 309 C SER A 24 10.662 9.880 13.208 1.00 0.00 C ATOM 310 O SER A 24 11.020 8.703 13.177 1.00 0.00 O ATOM 311 CB SER A 24 8.612 11.068 12.378 1.00 0.00 C ATOM 312 OG SER A 24 8.705 12.337 13.020 1.00 0.00 O ATOM 0 H SER A 24 8.932 9.400 10.568 1.00 0.00 H new ATOM 0 HA SER A 24 10.595 11.351 11.642 1.00 0.00 H new ATOM 0 HB2 SER A 24 7.994 11.158 11.484 1.00 0.00 H new ATOM 0 HB3 SER A 24 8.112 10.362 13.041 1.00 0.00 H new ATOM 0 HG SER A 24 7.806 12.655 13.248 1.00 0.00 H new ATOM 318 N ARG A 25 10.817 10.684 14.249 1.00 0.00 N ATOM 319 CA ARG A 25 11.444 10.212 15.472 1.00 0.00 C ATOM 320 C ARG A 25 10.381 9.730 16.462 1.00 0.00 C ATOM 321 O ARG A 25 10.663 9.556 17.646 1.00 0.00 O ATOM 322 CB ARG A 25 12.275 11.317 16.127 1.00 0.00 C ATOM 323 CG ARG A 25 11.380 12.451 16.632 1.00 0.00 C ATOM 324 CD ARG A 25 11.779 12.876 18.047 1.00 0.00 C ATOM 325 NE ARG A 25 12.189 14.298 18.051 1.00 0.00 N ATOM 326 CZ ARG A 25 12.908 14.869 19.027 1.00 0.00 C ATOM 327 NH1 ARG A 25 13.301 14.143 20.083 1.00 0.00 N ATOM 328 NH2 ARG A 25 13.234 16.167 18.947 1.00 0.00 N ATOM 0 H ARG A 25 10.519 11.659 14.271 1.00 0.00 H new ATOM 0 HA ARG A 25 12.103 9.385 15.208 1.00 0.00 H new ATOM 0 HB2 ARG A 25 12.847 10.903 16.958 1.00 0.00 H new ATOM 0 HB3 ARG A 25 12.995 11.710 15.409 1.00 0.00 H new ATOM 0 HG2 ARG A 25 11.453 13.304 15.958 1.00 0.00 H new ATOM 0 HG3 ARG A 25 10.339 12.128 16.625 1.00 0.00 H new ATOM 0 HD2 ARG A 25 10.942 12.728 18.730 1.00 0.00 H new ATOM 0 HD3 ARG A 25 12.597 12.252 18.406 1.00 0.00 H new ATOM 0 HE ARG A 25 11.907 14.879 17.262 1.00 0.00 H new ATOM 0 HH11 ARG A 25 13.053 13.156 20.144 1.00 0.00 H new ATOM 0 HH12 ARG A 25 13.848 14.578 20.826 1.00 0.00 H new ATOM 0 HH21 ARG A 25 12.935 16.719 18.143 1.00 0.00 H new ATOM 0 HH22 ARG A 25 13.781 16.602 19.690 1.00 0.00 H new ATOM 342 N ASP A 26 9.180 9.527 15.939 1.00 0.00 N ATOM 343 CA ASP A 26 8.074 9.067 16.761 1.00 0.00 C ATOM 344 C ASP A 26 7.442 7.832 16.116 1.00 0.00 C ATOM 345 O ASP A 26 7.933 7.339 15.101 1.00 0.00 O ATOM 346 CB ASP A 26 6.993 10.143 16.880 1.00 0.00 C ATOM 347 CG ASP A 26 6.979 10.902 18.209 1.00 0.00 C ATOM 348 OD1 ASP A 26 7.362 10.278 19.223 1.00 0.00 O ATOM 349 OD2 ASP A 26 6.586 12.088 18.181 1.00 0.00 O ATOM 0 H ASP A 26 8.949 9.673 14.956 1.00 0.00 H new ATOM 0 HA ASP A 26 8.464 8.835 17.752 1.00 0.00 H new ATOM 0 HB2 ASP A 26 7.125 10.861 16.070 1.00 0.00 H new ATOM 0 HB3 ASP A 26 6.019 9.676 16.736 1.00 0.00 H new ATOM 354 N LYS A 27 6.364 7.369 16.730 1.00 0.00 N ATOM 355 CA LYS A 27 5.661 6.201 16.228 1.00 0.00 C ATOM 356 C LYS A 27 4.498 6.653 15.342 1.00 0.00 C ATOM 357 O LYS A 27 3.522 7.218 15.833 1.00 0.00 O ATOM 358 CB LYS A 27 5.236 5.293 17.384 1.00 0.00 C ATOM 359 CG LYS A 27 6.456 4.724 18.111 1.00 0.00 C ATOM 360 CD LYS A 27 6.272 4.791 19.628 1.00 0.00 C ATOM 361 CE LYS A 27 5.760 3.458 20.178 1.00 0.00 C ATOM 362 NZ LYS A 27 6.814 2.423 20.089 1.00 0.00 N ATOM 0 H LYS A 27 5.960 7.781 17.571 1.00 0.00 H new ATOM 0 HA LYS A 27 6.322 5.598 15.605 1.00 0.00 H new ATOM 0 HB2 LYS A 27 4.620 5.856 18.085 1.00 0.00 H new ATOM 0 HB3 LYS A 27 4.622 4.477 17.003 1.00 0.00 H new ATOM 0 HG2 LYS A 27 6.616 3.690 17.806 1.00 0.00 H new ATOM 0 HG3 LYS A 27 7.347 5.282 17.824 1.00 0.00 H new ATOM 0 HD2 LYS A 27 7.220 5.044 20.102 1.00 0.00 H new ATOM 0 HD3 LYS A 27 5.569 5.586 19.878 1.00 0.00 H new ATOM 0 HE2 LYS A 27 5.449 3.581 21.215 1.00 0.00 H new ATOM 0 HE3 LYS A 27 4.881 3.140 19.617 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 6.633 1.681 20.795 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 6.809 2.003 19.137 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 7.742 2.856 20.272 1.00 0.00 H new ATOM 376 N PRO A 28 4.644 6.380 14.018 1.00 0.00 N ATOM 377 CA PRO A 28 3.618 6.753 13.059 1.00 0.00 C ATOM 378 C PRO A 28 2.412 5.815 13.155 1.00 0.00 C ATOM 379 O PRO A 28 2.515 4.720 13.705 1.00 0.00 O ATOM 380 CB PRO A 28 4.306 6.699 11.705 1.00 0.00 C ATOM 381 CG PRO A 28 5.554 5.854 11.905 1.00 0.00 C ATOM 382 CD PRO A 28 5.786 5.712 13.401 1.00 0.00 C ATOM 0 HA PRO A 28 3.211 7.747 13.244 1.00 0.00 H new ATOM 0 HB2 PRO A 28 3.652 6.258 10.952 1.00 0.00 H new ATOM 0 HB3 PRO A 28 4.563 7.700 11.357 1.00 0.00 H new ATOM 0 HG2 PRO A 28 5.430 4.874 11.443 1.00 0.00 H new ATOM 0 HG3 PRO A 28 6.414 6.324 11.428 1.00 0.00 H new ATOM 0 HD2 PRO A 28 5.838 4.664 13.696 1.00 0.00 H new ATOM 0 HD3 PRO A 28 6.726 6.175 13.702 1.00 0.00 H new ATOM 390 N LYS A 29 1.297 6.280 12.610 1.00 0.00 N ATOM 391 CA LYS A 29 0.073 5.496 12.627 1.00 0.00 C ATOM 392 C LYS A 29 0.244 4.272 11.725 1.00 0.00 C ATOM 393 O LYS A 29 1.030 4.299 10.779 1.00 0.00 O ATOM 394 CB LYS A 29 -1.127 6.370 12.257 1.00 0.00 C ATOM 395 CG LYS A 29 -2.123 6.451 13.416 1.00 0.00 C ATOM 396 CD LYS A 29 -3.233 5.409 13.259 1.00 0.00 C ATOM 397 CE LYS A 29 -4.122 5.364 14.502 1.00 0.00 C ATOM 398 NZ LYS A 29 -4.858 4.082 14.567 1.00 0.00 N ATOM 0 H LYS A 29 1.215 7.189 12.154 1.00 0.00 H new ATOM 0 HA LYS A 29 -0.129 5.126 13.632 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -0.785 7.371 11.995 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -1.621 5.961 11.376 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -1.602 6.293 14.360 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -2.559 7.449 13.456 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -3.838 5.646 12.383 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -2.793 4.427 13.086 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -3.512 5.486 15.397 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -4.828 6.195 14.482 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -5.457 4.068 15.417 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -5.455 3.981 13.721 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -4.180 3.294 14.608 1.00 0.00 H new ATOM 412 N LEU A 30 -0.505 3.229 12.049 1.00 0.00 N ATOM 413 CA LEU A 30 -0.447 1.998 11.280 1.00 0.00 C ATOM 414 C LEU A 30 -1.869 1.550 10.934 1.00 0.00 C ATOM 415 O LEU A 30 -2.771 1.638 11.765 1.00 0.00 O ATOM 416 CB LEU A 30 0.367 0.938 12.025 1.00 0.00 C ATOM 417 CG LEU A 30 1.379 0.157 11.185 1.00 0.00 C ATOM 418 CD1 LEU A 30 2.808 0.414 11.669 1.00 0.00 C ATOM 419 CD2 LEU A 30 1.041 -1.335 11.167 1.00 0.00 C ATOM 0 H LEU A 30 -1.156 3.211 12.834 1.00 0.00 H new ATOM 0 HA LEU A 30 0.074 2.163 10.337 1.00 0.00 H new ATOM 0 HB2 LEU A 30 0.901 1.425 12.841 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -0.325 0.228 12.477 1.00 0.00 H new ATOM 0 HG LEU A 30 1.317 0.514 10.157 1.00 0.00 H new ATOM 0 HD11 LEU A 30 3.508 -0.153 11.055 1.00 0.00 H new ATOM 0 HD12 LEU A 30 3.034 1.477 11.588 1.00 0.00 H new ATOM 0 HD13 LEU A 30 2.902 0.101 12.709 1.00 0.00 H new ATOM 0 HD21 LEU A 30 1.776 -1.867 10.563 1.00 0.00 H new ATOM 0 HD22 LEU A 30 1.058 -1.724 12.185 1.00 0.00 H new ATOM 0 HD23 LEU A 30 0.048 -1.478 10.740 1.00 0.00 H new ATOM 431 N TYR A 31 -2.024 1.079 9.705 1.00 0.00 N ATOM 432 CA TYR A 31 -3.320 0.617 9.239 1.00 0.00 C ATOM 433 C TYR A 31 -3.204 -0.751 8.564 1.00 0.00 C ATOM 434 O TYR A 31 -2.851 -0.840 7.389 1.00 0.00 O ATOM 435 CB TYR A 31 -3.787 1.644 8.206 1.00 0.00 C ATOM 436 CG TYR A 31 -4.264 2.965 8.813 1.00 0.00 C ATOM 437 CD1 TYR A 31 -5.537 3.064 9.336 1.00 0.00 C ATOM 438 CD2 TYR A 31 -3.421 4.057 8.837 1.00 0.00 C ATOM 439 CE1 TYR A 31 -5.986 4.307 9.908 1.00 0.00 C ATOM 440 CE2 TYR A 31 -3.870 5.300 9.409 1.00 0.00 C ATOM 441 CZ TYR A 31 -5.130 5.364 9.916 1.00 0.00 C ATOM 442 OH TYR A 31 -5.554 6.538 10.456 1.00 0.00 O ATOM 0 H TYR A 31 -1.273 1.008 9.018 1.00 0.00 H new ATOM 0 HA TYR A 31 -4.015 0.517 10.073 1.00 0.00 H new ATOM 0 HB2 TYR A 31 -2.968 1.848 7.516 1.00 0.00 H new ATOM 0 HB3 TYR A 31 -4.598 1.212 7.620 1.00 0.00 H new ATOM 0 HD1 TYR A 31 -6.197 2.209 9.316 1.00 0.00 H new ATOM 0 HD2 TYR A 31 -2.425 3.980 8.427 1.00 0.00 H new ATOM 0 HE1 TYR A 31 -6.980 4.398 10.321 1.00 0.00 H new ATOM 0 HE2 TYR A 31 -3.220 6.162 9.435 1.00 0.00 H new ATOM 0 HH TYR A 31 -4.838 7.204 10.394 1.00 0.00 H new ATOM 452 N ARG A 32 -3.509 -1.784 9.336 1.00 0.00 N ATOM 453 CA ARG A 32 -3.444 -3.144 8.827 1.00 0.00 C ATOM 454 C ARG A 32 -4.563 -3.385 7.812 1.00 0.00 C ATOM 455 O ARG A 32 -5.736 -3.438 8.178 1.00 0.00 O ATOM 456 CB ARG A 32 -3.565 -4.163 9.962 1.00 0.00 C ATOM 457 CG ARG A 32 -2.642 -3.799 11.126 1.00 0.00 C ATOM 458 CD ARG A 32 -1.769 -4.990 11.527 1.00 0.00 C ATOM 459 NE ARG A 32 -1.884 -5.235 12.982 1.00 0.00 N ATOM 460 CZ ARG A 32 -1.166 -6.149 13.649 1.00 0.00 C ATOM 461 NH1 ARG A 32 -0.279 -6.912 12.995 1.00 0.00 N ATOM 462 NH2 ARG A 32 -1.337 -6.302 14.969 1.00 0.00 N ATOM 0 H ARG A 32 -3.802 -1.707 10.310 1.00 0.00 H new ATOM 0 HA ARG A 32 -2.476 -3.271 8.342 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -4.597 -4.204 10.311 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -3.314 -5.157 9.591 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -2.009 -2.958 10.843 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -3.238 -3.476 11.980 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -2.076 -5.878 10.975 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -0.729 -4.794 11.264 1.00 0.00 H new ATOM 0 HE ARG A 32 -2.552 -4.673 13.510 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -0.151 -6.797 11.990 1.00 0.00 H new ATOM 0 HH12 ARG A 32 0.268 -7.608 13.503 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -2.014 -5.723 15.466 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -0.791 -6.998 15.477 1.00 0.00 H new ATOM 476 N LEU A 33 -4.161 -3.526 6.558 1.00 0.00 N ATOM 477 CA LEU A 33 -5.115 -3.760 5.488 1.00 0.00 C ATOM 478 C LEU A 33 -5.635 -5.196 5.580 1.00 0.00 C ATOM 479 O LEU A 33 -5.075 -6.103 4.967 1.00 0.00 O ATOM 480 CB LEU A 33 -4.495 -3.416 4.132 1.00 0.00 C ATOM 481 CG LEU A 33 -3.827 -2.044 4.029 1.00 0.00 C ATOM 482 CD1 LEU A 33 -3.070 -1.901 2.707 1.00 0.00 C ATOM 483 CD2 LEU A 33 -4.846 -0.921 4.230 1.00 0.00 C ATOM 0 H LEU A 33 -3.187 -3.483 6.259 1.00 0.00 H new ATOM 0 HA LEU A 33 -5.976 -3.101 5.595 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -3.754 -4.178 3.890 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -5.274 -3.477 3.373 1.00 0.00 H new ATOM 0 HG LEU A 33 -3.094 -1.960 4.831 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -2.604 -0.917 2.659 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -2.300 -2.670 2.643 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -3.765 -2.014 1.875 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -4.345 0.044 4.152 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -5.620 -0.991 3.466 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -5.301 -1.015 5.216 1.00 0.00 H new ATOM 495 N GLN A 34 -6.701 -5.358 6.350 1.00 0.00 N ATOM 496 CA GLN A 34 -7.302 -6.668 6.530 1.00 0.00 C ATOM 497 C GLN A 34 -8.025 -7.100 5.253 1.00 0.00 C ATOM 498 O GLN A 34 -8.388 -6.263 4.427 1.00 0.00 O ATOM 499 CB GLN A 34 -8.254 -6.674 7.728 1.00 0.00 C ATOM 500 CG GLN A 34 -7.506 -6.359 9.025 1.00 0.00 C ATOM 501 CD GLN A 34 -8.355 -6.715 10.247 1.00 0.00 C ATOM 502 OE1 GLN A 34 -9.258 -5.994 10.639 1.00 0.00 O ATOM 503 NE2 GLN A 34 -8.015 -7.863 10.826 1.00 0.00 N ATOM 0 H GLN A 34 -7.164 -4.603 6.856 1.00 0.00 H new ATOM 0 HA GLN A 34 -6.508 -7.386 6.735 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -9.044 -5.940 7.572 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -8.736 -7.648 7.809 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -6.569 -6.916 9.053 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -7.248 -5.300 9.053 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -7.248 -8.418 10.446 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -8.521 -8.188 11.650 1.00 0.00 H new ATOM 512 N LEU A 35 -8.213 -8.406 5.130 1.00 0.00 N ATOM 513 CA LEU A 35 -8.886 -8.959 3.967 1.00 0.00 C ATOM 514 C LEU A 35 -10.062 -8.058 3.587 1.00 0.00 C ATOM 515 O LEU A 35 -10.564 -7.303 4.419 1.00 0.00 O ATOM 516 CB LEU A 35 -9.283 -10.415 4.220 1.00 0.00 C ATOM 517 CG LEU A 35 -8.368 -11.476 3.606 1.00 0.00 C ATOM 518 CD1 LEU A 35 -8.795 -12.882 4.032 1.00 0.00 C ATOM 519 CD2 LEU A 35 -8.307 -11.333 2.083 1.00 0.00 C ATOM 0 H LEU A 35 -7.911 -9.097 5.817 1.00 0.00 H new ATOM 0 HA LEU A 35 -8.212 -8.981 3.111 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -9.323 -10.578 5.297 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -10.292 -10.568 3.836 1.00 0.00 H new ATOM 0 HG LEU A 35 -7.359 -11.317 3.986 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -8.128 -13.617 3.582 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -8.745 -12.964 5.118 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -9.817 -13.068 3.701 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -7.650 -12.099 1.672 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -9.307 -11.451 1.666 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -7.920 -10.347 1.825 1.00 0.00 H new ATOM 531 N SER A 36 -10.468 -8.167 2.331 1.00 0.00 N ATOM 532 CA SER A 36 -11.576 -7.371 1.830 1.00 0.00 C ATOM 533 C SER A 36 -11.070 -6.004 1.363 1.00 0.00 C ATOM 534 O SER A 36 -9.961 -5.598 1.707 1.00 0.00 O ATOM 535 CB SER A 36 -12.657 -7.199 2.899 1.00 0.00 C ATOM 536 OG SER A 36 -12.785 -8.357 3.721 1.00 0.00 O ATOM 0 H SER A 36 -10.050 -8.795 1.645 1.00 0.00 H new ATOM 0 HA SER A 36 -12.019 -7.896 0.984 1.00 0.00 H new ATOM 0 HB2 SER A 36 -12.417 -6.337 3.522 1.00 0.00 H new ATOM 0 HB3 SER A 36 -13.612 -6.989 2.418 1.00 0.00 H new ATOM 0 HG SER A 36 -12.253 -8.240 4.536 1.00 0.00 H new ATOM 542 N VAL A 37 -11.908 -5.333 0.586 1.00 0.00 N ATOM 543 CA VAL A 37 -11.559 -4.021 0.069 1.00 0.00 C ATOM 544 C VAL A 37 -11.581 -3.004 1.212 1.00 0.00 C ATOM 545 O VAL A 37 -12.475 -3.034 2.057 1.00 0.00 O ATOM 546 CB VAL A 37 -12.495 -3.647 -1.083 1.00 0.00 C ATOM 547 CG1 VAL A 37 -13.945 -3.556 -0.603 1.00 0.00 C ATOM 548 CG2 VAL A 37 -12.054 -2.341 -1.746 1.00 0.00 C ATOM 0 H VAL A 37 -12.827 -5.673 0.302 1.00 0.00 H new ATOM 0 HA VAL A 37 -10.549 -4.028 -0.340 1.00 0.00 H new ATOM 0 HB VAL A 37 -12.438 -4.438 -1.831 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -14.589 -3.289 -1.441 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -14.256 -4.520 -0.199 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -14.024 -2.795 0.173 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -12.736 -2.098 -2.561 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -12.067 -1.537 -1.010 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -11.044 -2.456 -2.140 1.00 0.00 H new ATOM 558 N THR A 38 -10.588 -2.127 1.200 1.00 0.00 N ATOM 559 CA THR A 38 -10.483 -1.103 2.225 1.00 0.00 C ATOM 560 C THR A 38 -10.502 0.290 1.592 1.00 0.00 C ATOM 561 O THR A 38 -9.506 0.729 1.019 1.00 0.00 O ATOM 562 CB THR A 38 -9.220 -1.381 3.044 1.00 0.00 C ATOM 563 OG1 THR A 38 -9.523 -2.579 3.754 1.00 0.00 O ATOM 564 CG2 THR A 38 -8.994 -0.342 4.144 1.00 0.00 C ATOM 0 H THR A 38 -9.849 -2.105 0.497 1.00 0.00 H new ATOM 0 HA THR A 38 -11.338 -1.131 2.900 1.00 0.00 H new ATOM 0 HB THR A 38 -8.355 -1.401 2.381 1.00 0.00 H new ATOM 0 HG1 THR A 38 -8.757 -2.833 4.310 1.00 0.00 H new ATOM 0 HG21 THR A 38 -8.085 -0.586 4.694 1.00 0.00 H new ATOM 0 HG22 THR A 38 -8.892 0.646 3.696 1.00 0.00 H new ATOM 0 HG23 THR A 38 -9.844 -0.345 4.827 1.00 0.00 H new ATOM 572 N GLU A 39 -11.646 0.946 1.716 1.00 0.00 N ATOM 573 CA GLU A 39 -11.808 2.280 1.163 1.00 0.00 C ATOM 574 C GLU A 39 -11.029 3.298 1.997 1.00 0.00 C ATOM 575 O GLU A 39 -11.017 3.221 3.225 1.00 0.00 O ATOM 576 CB GLU A 39 -13.287 2.660 1.074 1.00 0.00 C ATOM 577 CG GLU A 39 -14.019 1.781 0.058 1.00 0.00 C ATOM 578 CD GLU A 39 -14.874 0.725 0.762 1.00 0.00 C ATOM 579 OE1 GLU A 39 -14.646 0.527 1.975 1.00 0.00 O ATOM 580 OE2 GLU A 39 -15.736 0.140 0.071 1.00 0.00 O ATOM 0 H GLU A 39 -12.470 0.579 2.192 1.00 0.00 H new ATOM 0 HA GLU A 39 -11.404 2.285 0.151 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -13.753 2.554 2.054 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -13.380 3.708 0.788 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -14.651 2.402 -0.577 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -13.295 1.292 -0.594 1.00 0.00 H new ATOM 587 N VAL A 40 -10.398 4.230 1.297 1.00 0.00 N ATOM 588 CA VAL A 40 -9.618 5.263 1.958 1.00 0.00 C ATOM 589 C VAL A 40 -10.276 6.623 1.719 1.00 0.00 C ATOM 590 O VAL A 40 -11.171 6.746 0.884 1.00 0.00 O ATOM 591 CB VAL A 40 -8.166 5.208 1.481 1.00 0.00 C ATOM 592 CG1 VAL A 40 -7.274 6.113 2.333 1.00 0.00 C ATOM 593 CG2 VAL A 40 -7.643 3.770 1.476 1.00 0.00 C ATOM 0 H VAL A 40 -10.411 4.291 0.279 1.00 0.00 H new ATOM 0 HA VAL A 40 -9.598 5.097 3.035 1.00 0.00 H new ATOM 0 HB VAL A 40 -8.137 5.578 0.456 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -6.247 6.055 1.973 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -7.626 7.142 2.262 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -7.313 5.787 3.373 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -6.609 3.760 1.133 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -7.694 3.361 2.485 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -8.253 3.163 0.807 1.00 0.00 H new ATOM 603 N GLY A 41 -9.807 7.611 2.467 1.00 0.00 N ATOM 604 CA GLY A 41 -10.338 8.958 2.347 1.00 0.00 C ATOM 605 C GLY A 41 -10.772 9.500 3.710 1.00 0.00 C ATOM 606 O GLY A 41 -10.222 9.112 4.740 1.00 0.00 O ATOM 0 H GLY A 41 -9.065 7.505 3.159 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -9.582 9.614 1.915 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -11.188 8.958 1.664 1.00 0.00 H new ATOM 610 N THR A 42 -11.754 10.389 3.673 1.00 0.00 N ATOM 611 CA THR A 42 -12.267 10.989 4.893 1.00 0.00 C ATOM 612 C THR A 42 -13.621 10.377 5.259 1.00 0.00 C ATOM 613 O THR A 42 -14.072 10.495 6.397 1.00 0.00 O ATOM 614 CB THR A 42 -12.321 12.504 4.688 1.00 0.00 C ATOM 615 OG1 THR A 42 -13.237 12.677 3.611 1.00 0.00 O ATOM 616 CG2 THR A 42 -11.004 13.070 4.152 1.00 0.00 C ATOM 0 H THR A 42 -12.208 10.708 2.817 1.00 0.00 H new ATOM 0 HA THR A 42 -11.613 10.784 5.740 1.00 0.00 H new ATOM 0 HB THR A 42 -12.567 12.989 5.633 1.00 0.00 H new ATOM 0 HG1 THR A 42 -13.333 13.632 3.413 1.00 0.00 H new ATOM 0 HG21 THR A 42 -11.097 14.149 4.025 1.00 0.00 H new ATOM 0 HG22 THR A 42 -10.202 12.856 4.858 1.00 0.00 H new ATOM 0 HG23 THR A 42 -10.774 12.610 3.191 1.00 0.00 H new ATOM 624 N GLU A 43 -14.230 9.735 4.273 1.00 0.00 N ATOM 625 CA GLU A 43 -15.523 9.104 4.477 1.00 0.00 C ATOM 626 C GLU A 43 -15.350 7.752 5.172 1.00 0.00 C ATOM 627 O GLU A 43 -14.277 7.153 5.114 1.00 0.00 O ATOM 628 CB GLU A 43 -16.272 8.948 3.152 1.00 0.00 C ATOM 629 CG GLU A 43 -17.411 9.964 3.043 1.00 0.00 C ATOM 630 CD GLU A 43 -18.758 9.314 3.362 1.00 0.00 C ATOM 631 OE1 GLU A 43 -18.998 8.211 2.824 1.00 0.00 O ATOM 632 OE2 GLU A 43 -19.518 9.934 4.137 1.00 0.00 O ATOM 0 H GLU A 43 -13.852 9.638 3.331 1.00 0.00 H new ATOM 0 HA GLU A 43 -16.122 9.747 5.121 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -15.580 9.082 2.321 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -16.673 7.937 3.073 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -17.231 10.792 3.729 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -17.434 10.383 2.037 1.00 0.00 H new ATOM 639 N LYS A 44 -16.422 7.310 5.812 1.00 0.00 N ATOM 640 CA LYS A 44 -16.402 6.040 6.517 1.00 0.00 C ATOM 641 C LYS A 44 -17.307 5.043 5.790 1.00 0.00 C ATOM 642 O LYS A 44 -18.523 5.054 5.974 1.00 0.00 O ATOM 643 CB LYS A 44 -16.766 6.239 7.990 1.00 0.00 C ATOM 644 CG LYS A 44 -16.719 4.912 8.750 1.00 0.00 C ATOM 645 CD LYS A 44 -15.462 4.822 9.618 1.00 0.00 C ATOM 646 CE LYS A 44 -15.709 3.951 10.851 1.00 0.00 C ATOM 647 NZ LYS A 44 -16.061 4.791 12.018 1.00 0.00 N ATOM 0 H LYS A 44 -17.311 7.809 5.857 1.00 0.00 H new ATOM 0 HA LYS A 44 -15.396 5.619 6.514 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -16.076 6.948 8.446 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -17.764 6.671 8.067 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -17.606 4.816 9.377 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -16.737 4.083 8.043 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -14.641 4.407 9.033 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -15.158 5.821 9.929 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -16.514 3.244 10.649 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -14.818 3.364 11.073 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -16.225 4.184 12.846 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -15.281 5.449 12.220 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -16.924 5.332 11.809 1.00 0.00 H new ATOM 661 N PHE A 45 -16.678 4.206 4.977 1.00 0.00 N ATOM 662 CA PHE A 45 -17.411 3.205 4.221 1.00 0.00 C ATOM 663 C PHE A 45 -17.564 1.913 5.026 1.00 0.00 C ATOM 664 O PHE A 45 -18.680 1.451 5.258 1.00 0.00 O ATOM 665 CB PHE A 45 -16.596 2.913 2.960 1.00 0.00 C ATOM 666 CG PHE A 45 -16.589 4.057 1.944 1.00 0.00 C ATOM 667 CD1 PHE A 45 -15.976 5.232 2.248 1.00 0.00 C ATOM 668 CD2 PHE A 45 -17.195 3.899 0.737 1.00 0.00 C ATOM 669 CE1 PHE A 45 -15.970 6.294 1.306 1.00 0.00 C ATOM 670 CE2 PHE A 45 -17.189 4.961 -0.206 1.00 0.00 C ATOM 671 CZ PHE A 45 -16.576 6.136 0.098 1.00 0.00 C ATOM 0 H PHE A 45 -15.669 4.201 4.826 1.00 0.00 H new ATOM 0 HA PHE A 45 -18.409 3.574 3.985 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -15.569 2.690 3.248 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -16.994 2.018 2.481 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -15.494 5.357 3.206 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -17.681 2.965 0.495 1.00 0.00 H new ATOM 0 HE1 PHE A 45 -15.484 7.228 1.548 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -17.671 4.835 -1.164 1.00 0.00 H new ATOM 0 HZ PHE A 45 -16.570 6.944 -0.619 1.00 0.00 H new ATOM 681 N ASP A 46 -16.427 1.367 5.430 1.00 0.00 N ATOM 682 CA ASP A 46 -16.420 0.137 6.204 1.00 0.00 C ATOM 683 C ASP A 46 -16.124 0.464 7.669 1.00 0.00 C ATOM 684 O ASP A 46 -15.620 1.542 7.979 1.00 0.00 O ATOM 685 CB ASP A 46 -15.338 -0.822 5.705 1.00 0.00 C ATOM 686 CG ASP A 46 -15.802 -2.264 5.490 1.00 0.00 C ATOM 687 OD1 ASP A 46 -16.835 -2.433 4.807 1.00 0.00 O ATOM 688 OD2 ASP A 46 -15.113 -3.166 6.015 1.00 0.00 O ATOM 0 H ASP A 46 -15.503 1.754 5.236 1.00 0.00 H new ATOM 0 HA ASP A 46 -17.397 -0.335 6.096 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -14.941 -0.440 4.765 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -14.516 -0.823 6.421 1.00 0.00 H new ATOM 693 N ASP A 47 -16.448 -0.488 8.532 1.00 0.00 N ATOM 694 CA ASP A 47 -16.223 -0.315 9.957 1.00 0.00 C ATOM 695 C ASP A 47 -14.722 -0.177 10.218 1.00 0.00 C ATOM 696 O ASP A 47 -14.306 0.608 11.068 1.00 0.00 O ATOM 697 CB ASP A 47 -16.731 -1.524 10.745 1.00 0.00 C ATOM 698 CG ASP A 47 -16.987 -1.266 12.231 1.00 0.00 C ATOM 699 OD1 ASP A 47 -17.838 -0.397 12.518 1.00 0.00 O ATOM 700 OD2 ASP A 47 -16.324 -1.943 13.047 1.00 0.00 O ATOM 0 H ASP A 47 -16.865 -1.382 8.272 1.00 0.00 H new ATOM 0 HA ASP A 47 -16.761 0.577 10.278 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -17.656 -1.874 10.288 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -16.004 -2.331 10.652 1.00 0.00 H new ATOM 705 N ASN A 48 -13.950 -0.954 9.472 1.00 0.00 N ATOM 706 CA ASN A 48 -12.504 -0.928 9.613 1.00 0.00 C ATOM 707 C ASN A 48 -11.882 -0.361 8.335 1.00 0.00 C ATOM 708 O ASN A 48 -11.107 -1.041 7.663 1.00 0.00 O ATOM 709 CB ASN A 48 -11.946 -2.336 9.826 1.00 0.00 C ATOM 710 CG ASN A 48 -11.889 -2.684 11.315 1.00 0.00 C ATOM 711 OD1 ASN A 48 -12.763 -3.337 11.860 1.00 0.00 O ATOM 712 ND2 ASN A 48 -10.814 -2.212 11.940 1.00 0.00 N ATOM 0 H ASN A 48 -14.299 -1.605 8.768 1.00 0.00 H new ATOM 0 HA ASN A 48 -12.260 -0.309 10.477 1.00 0.00 H new ATOM 0 HB2 ASN A 48 -12.570 -3.061 9.303 1.00 0.00 H new ATOM 0 HB3 ASN A 48 -10.947 -2.404 9.394 1.00 0.00 H new ATOM 0 HD21 ASN A 48 -10.684 -2.390 12.936 1.00 0.00 H new ATOM 0 HD22 ASN A 48 -10.120 -1.672 11.423 1.00 0.00 H new ATOM 719 N SER A 49 -12.244 0.878 8.037 1.00 0.00 N ATOM 720 CA SER A 49 -11.731 1.544 6.852 1.00 0.00 C ATOM 721 C SER A 49 -10.657 2.559 7.246 1.00 0.00 C ATOM 722 O SER A 49 -10.406 2.775 8.431 1.00 0.00 O ATOM 723 CB SER A 49 -12.856 2.234 6.078 1.00 0.00 C ATOM 724 OG SER A 49 -13.548 3.188 6.879 1.00 0.00 O ATOM 0 H SER A 49 -12.887 1.439 8.596 1.00 0.00 H new ATOM 0 HA SER A 49 -11.288 0.791 6.201 1.00 0.00 H new ATOM 0 HB2 SER A 49 -12.441 2.730 5.201 1.00 0.00 H new ATOM 0 HB3 SER A 49 -13.560 1.485 5.717 1.00 0.00 H new ATOM 0 HG SER A 49 -14.294 2.749 7.339 1.00 0.00 H new ATOM 730 N ILE A 50 -10.050 3.155 6.230 1.00 0.00 N ATOM 731 CA ILE A 50 -9.008 4.143 6.455 1.00 0.00 C ATOM 732 C ILE A 50 -9.623 5.543 6.420 1.00 0.00 C ATOM 733 O ILE A 50 -10.192 5.950 5.408 1.00 0.00 O ATOM 734 CB ILE A 50 -7.862 3.949 5.460 1.00 0.00 C ATOM 735 CG1 ILE A 50 -7.381 2.497 5.454 1.00 0.00 C ATOM 736 CG2 ILE A 50 -6.722 4.930 5.740 1.00 0.00 C ATOM 737 CD1 ILE A 50 -6.126 2.339 4.593 1.00 0.00 C ATOM 0 H ILE A 50 -10.260 2.973 5.249 1.00 0.00 H new ATOM 0 HA ILE A 50 -8.566 4.013 7.443 1.00 0.00 H new ATOM 0 HB ILE A 50 -8.237 4.167 4.460 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -7.169 2.176 6.474 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -8.171 1.850 5.074 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -5.920 4.771 5.019 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -7.092 5.952 5.653 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -6.341 4.767 6.748 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -5.805 1.297 4.606 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -6.348 2.638 3.568 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -5.330 2.969 4.991 1.00 0.00 H new ATOM 749 N GLN A 51 -9.488 6.242 7.537 1.00 0.00 N ATOM 750 CA GLN A 51 -10.023 7.589 7.647 1.00 0.00 C ATOM 751 C GLN A 51 -8.884 8.606 7.751 1.00 0.00 C ATOM 752 O GLN A 51 -8.324 8.808 8.827 1.00 0.00 O ATOM 753 CB GLN A 51 -10.973 7.706 8.841 1.00 0.00 C ATOM 754 CG GLN A 51 -12.254 8.445 8.451 1.00 0.00 C ATOM 755 CD GLN A 51 -13.420 8.035 9.354 1.00 0.00 C ATOM 756 OE1 GLN A 51 -13.286 7.220 10.251 1.00 0.00 O ATOM 757 NE2 GLN A 51 -14.567 8.644 9.066 1.00 0.00 N ATOM 0 H GLN A 51 -9.016 5.901 8.374 1.00 0.00 H new ATOM 0 HA GLN A 51 -10.596 7.806 6.746 1.00 0.00 H new ATOM 0 HB2 GLN A 51 -11.221 6.712 9.212 1.00 0.00 H new ATOM 0 HB3 GLN A 51 -10.477 8.235 9.655 1.00 0.00 H new ATOM 0 HG2 GLN A 51 -12.094 9.521 8.524 1.00 0.00 H new ATOM 0 HG3 GLN A 51 -12.501 8.229 7.412 1.00 0.00 H new ATOM 0 HE21 GLN A 51 -14.609 9.317 8.301 1.00 0.00 H new ATOM 0 HE22 GLN A 51 -15.404 8.438 9.611 1.00 0.00 H new ATOM 766 N LEU A 52 -8.575 9.218 6.618 1.00 0.00 N ATOM 767 CA LEU A 52 -7.514 10.209 6.567 1.00 0.00 C ATOM 768 C LEU A 52 -8.130 11.608 6.516 1.00 0.00 C ATOM 769 O LEU A 52 -9.169 11.810 5.889 1.00 0.00 O ATOM 770 CB LEU A 52 -6.560 9.914 5.408 1.00 0.00 C ATOM 771 CG LEU A 52 -5.860 8.554 5.445 1.00 0.00 C ATOM 772 CD1 LEU A 52 -5.000 8.346 4.197 1.00 0.00 C ATOM 773 CD2 LEU A 52 -5.050 8.388 6.733 1.00 0.00 C ATOM 0 H LEU A 52 -9.041 9.047 5.727 1.00 0.00 H new ATOM 0 HA LEU A 52 -6.905 10.162 7.470 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -7.119 9.987 4.475 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -5.797 10.692 5.384 1.00 0.00 H new ATOM 0 HG LEU A 52 -6.624 7.777 5.443 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -4.514 7.372 4.249 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -5.631 8.390 3.309 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -4.242 9.128 4.143 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -4.563 7.413 6.733 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -4.294 9.171 6.791 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -5.715 8.462 7.593 1.00 0.00 H new ATOM 785 N PHE A 53 -7.463 12.539 7.184 1.00 0.00 N ATOM 786 CA PHE A 53 -7.932 13.913 7.222 1.00 0.00 C ATOM 787 C PHE A 53 -6.808 14.887 6.861 1.00 0.00 C ATOM 788 O PHE A 53 -5.846 15.034 7.612 1.00 0.00 O ATOM 789 CB PHE A 53 -8.390 14.190 8.655 1.00 0.00 C ATOM 790 CG PHE A 53 -9.143 13.027 9.303 1.00 0.00 C ATOM 791 CD1 PHE A 53 -10.481 12.887 9.103 1.00 0.00 C ATOM 792 CD2 PHE A 53 -8.475 12.132 10.080 1.00 0.00 C ATOM 793 CE1 PHE A 53 -11.180 11.807 9.704 1.00 0.00 C ATOM 794 CE2 PHE A 53 -9.174 11.053 10.682 1.00 0.00 C ATOM 795 CZ PHE A 53 -10.512 10.913 10.481 1.00 0.00 C ATOM 0 H PHE A 53 -6.602 12.368 7.703 1.00 0.00 H new ATOM 0 HA PHE A 53 -8.740 14.050 6.503 1.00 0.00 H new ATOM 0 HB2 PHE A 53 -7.518 14.430 9.264 1.00 0.00 H new ATOM 0 HB3 PHE A 53 -9.032 15.071 8.657 1.00 0.00 H new ATOM 0 HD1 PHE A 53 -11.012 13.598 8.487 1.00 0.00 H new ATOM 0 HD2 PHE A 53 -7.412 12.242 10.239 1.00 0.00 H new ATOM 0 HE1 PHE A 53 -12.242 11.696 9.544 1.00 0.00 H new ATOM 0 HE2 PHE A 53 -8.643 10.343 11.300 1.00 0.00 H new ATOM 0 HZ PHE A 53 -11.044 10.092 10.938 1.00 0.00 H new ATOM 805 N GLY A 54 -6.968 15.525 5.711 1.00 0.00 N ATOM 806 CA GLY A 54 -5.978 16.480 5.242 1.00 0.00 C ATOM 807 C GLY A 54 -6.595 17.465 4.247 1.00 0.00 C ATOM 808 O GLY A 54 -7.641 17.188 3.661 1.00 0.00 O ATOM 0 H GLY A 54 -7.768 15.400 5.090 1.00 0.00 H new ATOM 0 HA2 GLY A 54 -5.564 17.026 6.090 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -5.151 15.950 4.769 1.00 0.00 H new ATOM 812 N PRO A 55 -5.904 18.624 4.082 1.00 0.00 N ATOM 813 CA PRO A 55 -6.373 19.652 3.168 1.00 0.00 C ATOM 814 C PRO A 55 -6.116 19.251 1.714 1.00 0.00 C ATOM 815 O PRO A 55 -4.992 19.356 1.227 1.00 0.00 O ATOM 816 CB PRO A 55 -5.629 20.912 3.577 1.00 0.00 C ATOM 817 CG PRO A 55 -4.435 20.444 4.394 1.00 0.00 C ATOM 818 CD PRO A 55 -4.662 18.986 4.758 1.00 0.00 C ATOM 0 HA PRO A 55 -7.451 19.806 3.225 1.00 0.00 H new ATOM 0 HB2 PRO A 55 -5.307 21.477 2.702 1.00 0.00 H new ATOM 0 HB3 PRO A 55 -6.269 21.571 4.163 1.00 0.00 H new ATOM 0 HG2 PRO A 55 -3.514 20.556 3.822 1.00 0.00 H new ATOM 0 HG3 PRO A 55 -4.327 21.050 5.294 1.00 0.00 H new ATOM 0 HD2 PRO A 55 -3.833 18.361 4.425 1.00 0.00 H new ATOM 0 HD3 PRO A 55 -4.746 18.856 5.837 1.00 0.00 H new ATOM 826 N GLY A 56 -7.177 18.800 1.061 1.00 0.00 N ATOM 827 CA GLY A 56 -7.081 18.383 -0.327 1.00 0.00 C ATOM 828 C GLY A 56 -7.382 16.890 -0.474 1.00 0.00 C ATOM 829 O GLY A 56 -7.087 16.292 -1.507 1.00 0.00 O ATOM 0 H GLY A 56 -8.108 18.714 1.468 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -7.780 18.960 -0.933 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -6.081 18.595 -0.706 1.00 0.00 H new ATOM 833 N ILE A 57 -7.967 16.332 0.576 1.00 0.00 N ATOM 834 CA ILE A 57 -8.312 14.920 0.577 1.00 0.00 C ATOM 835 C ILE A 57 -9.796 14.762 0.241 1.00 0.00 C ATOM 836 O ILE A 57 -10.595 15.661 0.503 1.00 0.00 O ATOM 837 CB ILE A 57 -7.909 14.271 1.902 1.00 0.00 C ATOM 838 CG1 ILE A 57 -6.459 14.607 2.258 1.00 0.00 C ATOM 839 CG2 ILE A 57 -8.157 12.762 1.871 1.00 0.00 C ATOM 840 CD1 ILE A 57 -5.483 13.753 1.446 1.00 0.00 C ATOM 0 H ILE A 57 -8.211 16.832 1.431 1.00 0.00 H new ATOM 0 HA ILE A 57 -7.752 14.390 -0.194 1.00 0.00 H new ATOM 0 HB ILE A 57 -8.538 14.684 2.690 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -6.269 15.663 2.067 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -6.294 14.441 3.323 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -7.862 12.325 2.825 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -9.216 12.571 1.696 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -7.570 12.313 1.070 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -4.460 14.012 1.718 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -5.659 12.698 1.658 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -5.634 13.940 0.383 1.00 0.00 H new ATOM 852 N GLN A 58 -10.122 13.613 -0.333 1.00 0.00 N ATOM 853 CA GLN A 58 -11.496 13.326 -0.707 1.00 0.00 C ATOM 854 C GLN A 58 -12.056 12.196 0.159 1.00 0.00 C ATOM 855 O GLN A 58 -11.334 11.608 0.962 1.00 0.00 O ATOM 856 CB GLN A 58 -11.599 12.980 -2.194 1.00 0.00 C ATOM 857 CG GLN A 58 -10.366 13.468 -2.957 1.00 0.00 C ATOM 858 CD GLN A 58 -10.328 14.997 -3.017 1.00 0.00 C ATOM 859 OE1 GLN A 58 -11.177 15.642 -3.610 1.00 0.00 O ATOM 860 NE2 GLN A 58 -9.298 15.538 -2.372 1.00 0.00 N ATOM 0 H GLN A 58 -9.458 12.870 -0.548 1.00 0.00 H new ATOM 0 HA GLN A 58 -12.094 14.221 -0.534 1.00 0.00 H new ATOM 0 HB2 GLN A 58 -11.702 11.902 -2.314 1.00 0.00 H new ATOM 0 HB3 GLN A 58 -12.495 13.435 -2.616 1.00 0.00 H new ATOM 0 HG2 GLN A 58 -9.463 13.097 -2.472 1.00 0.00 H new ATOM 0 HG3 GLN A 58 -10.375 13.061 -3.968 1.00 0.00 H new ATOM 0 HE21 GLN A 58 -8.623 14.939 -1.896 1.00 0.00 H new ATOM 0 HE22 GLN A 58 -9.183 16.551 -2.354 1.00 0.00 H new ATOM 869 N PRO A 59 -13.373 11.919 -0.040 1.00 0.00 N ATOM 870 CA PRO A 59 -14.039 10.870 0.714 1.00 0.00 C ATOM 871 C PRO A 59 -13.635 9.486 0.201 1.00 0.00 C ATOM 872 O PRO A 59 -13.247 8.619 0.983 1.00 0.00 O ATOM 873 CB PRO A 59 -15.524 11.152 0.554 1.00 0.00 C ATOM 874 CG PRO A 59 -15.646 12.065 -0.656 1.00 0.00 C ATOM 875 CD PRO A 59 -14.259 12.594 -0.983 1.00 0.00 C ATOM 0 HA PRO A 59 -13.759 10.867 1.767 1.00 0.00 H new ATOM 0 HB2 PRO A 59 -16.083 10.228 0.405 1.00 0.00 H new ATOM 0 HB3 PRO A 59 -15.929 11.629 1.446 1.00 0.00 H new ATOM 0 HG2 PRO A 59 -16.057 11.520 -1.506 1.00 0.00 H new ATOM 0 HG3 PRO A 59 -16.329 12.888 -0.446 1.00 0.00 H new ATOM 0 HD2 PRO A 59 -13.983 12.372 -2.014 1.00 0.00 H new ATOM 0 HD3 PRO A 59 -14.210 13.677 -0.866 1.00 0.00 H new ATOM 883 N HIS A 60 -13.740 9.322 -1.109 1.00 0.00 N ATOM 884 CA HIS A 60 -13.390 8.058 -1.736 1.00 0.00 C ATOM 885 C HIS A 60 -12.078 8.213 -2.507 1.00 0.00 C ATOM 886 O HIS A 60 -12.084 8.352 -3.729 1.00 0.00 O ATOM 887 CB HIS A 60 -14.536 7.551 -2.612 1.00 0.00 C ATOM 888 CG HIS A 60 -14.726 6.053 -2.569 1.00 0.00 C ATOM 889 ND1 HIS A 60 -15.900 5.435 -2.962 1.00 0.00 N ATOM 890 CD2 HIS A 60 -13.880 5.058 -2.176 1.00 0.00 C ATOM 891 CE1 HIS A 60 -15.756 4.127 -2.808 1.00 0.00 C ATOM 892 NE2 HIS A 60 -14.503 3.896 -2.320 1.00 0.00 N ATOM 0 H HIS A 60 -14.062 10.043 -1.754 1.00 0.00 H new ATOM 0 HA HIS A 60 -13.233 7.299 -0.970 1.00 0.00 H new ATOM 0 HB2 HIS A 60 -15.461 8.033 -2.297 1.00 0.00 H new ATOM 0 HB3 HIS A 60 -14.353 7.854 -3.643 1.00 0.00 H new ATOM 0 HD1 HIS A 60 -16.735 5.906 -3.311 1.00 0.00 H new ATOM 0 HD2 HIS A 60 -12.873 5.193 -1.810 1.00 0.00 H new ATOM 0 HE1 HIS A 60 -16.500 3.376 -3.030 1.00 0.00 H new ATOM 900 N HIS A 61 -10.983 8.185 -1.761 1.00 0.00 N ATOM 901 CA HIS A 61 -9.666 8.320 -2.359 1.00 0.00 C ATOM 902 C HIS A 61 -9.341 7.068 -3.175 1.00 0.00 C ATOM 903 O HIS A 61 -9.308 7.115 -4.404 1.00 0.00 O ATOM 904 CB HIS A 61 -8.613 8.622 -1.291 1.00 0.00 C ATOM 905 CG HIS A 61 -7.437 9.423 -1.797 1.00 0.00 C ATOM 906 ND1 HIS A 61 -7.267 10.767 -1.513 1.00 0.00 N ATOM 907 CD2 HIS A 61 -6.374 9.056 -2.570 1.00 0.00 C ATOM 908 CE1 HIS A 61 -6.151 11.180 -2.094 1.00 0.00 C ATOM 909 NE2 HIS A 61 -5.599 10.118 -2.749 1.00 0.00 N ATOM 0 H HIS A 61 -10.981 8.071 -0.747 1.00 0.00 H new ATOM 0 HA HIS A 61 -9.659 9.168 -3.043 1.00 0.00 H new ATOM 0 HB2 HIS A 61 -9.085 9.166 -0.473 1.00 0.00 H new ATOM 0 HB3 HIS A 61 -8.248 7.681 -0.879 1.00 0.00 H new ATOM 0 HD1 HIS A 61 -7.895 11.342 -0.951 1.00 0.00 H new ATOM 0 HD2 HIS A 61 -6.194 8.068 -2.969 1.00 0.00 H new ATOM 0 HE1 HIS A 61 -5.748 12.181 -2.056 1.00 0.00 H new ATOM 917 N CYS A 62 -9.111 5.977 -2.459 1.00 0.00 N ATOM 918 CA CYS A 62 -8.790 4.714 -3.102 1.00 0.00 C ATOM 919 C CYS A 62 -9.263 3.579 -2.192 1.00 0.00 C ATOM 920 O CYS A 62 -9.617 3.810 -1.037 1.00 0.00 O ATOM 921 CB CYS A 62 -7.298 4.605 -3.423 1.00 0.00 C ATOM 922 SG CYS A 62 -6.330 4.516 -1.872 1.00 0.00 S ATOM 0 H CYS A 62 -9.141 5.942 -1.440 1.00 0.00 H new ATOM 0 HA CYS A 62 -9.305 4.649 -4.060 1.00 0.00 H new ATOM 0 HB2 CYS A 62 -7.112 3.718 -4.029 1.00 0.00 H new ATOM 0 HB3 CYS A 62 -6.980 5.466 -4.011 1.00 0.00 H new ATOM 0 HG CYS A 62 -6.373 3.304 -1.403 1.00 0.00 H new ATOM 928 N ASP A 63 -9.253 2.375 -2.747 1.00 0.00 N ATOM 929 CA ASP A 63 -9.677 1.203 -1.999 1.00 0.00 C ATOM 930 C ASP A 63 -8.583 0.136 -2.070 1.00 0.00 C ATOM 931 O ASP A 63 -8.202 -0.296 -3.157 1.00 0.00 O ATOM 932 CB ASP A 63 -10.957 0.608 -2.587 1.00 0.00 C ATOM 933 CG ASP A 63 -11.984 1.633 -3.071 1.00 0.00 C ATOM 934 OD1 ASP A 63 -12.057 2.707 -2.436 1.00 0.00 O ATOM 935 OD2 ASP A 63 -12.674 1.320 -4.066 1.00 0.00 O ATOM 0 H ASP A 63 -8.958 2.186 -3.705 1.00 0.00 H new ATOM 0 HA ASP A 63 -9.862 1.508 -0.969 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -10.689 -0.038 -3.423 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -11.425 -0.025 -1.833 1.00 0.00 H new ATOM 940 N LEU A 64 -8.108 -0.258 -0.898 1.00 0.00 N ATOM 941 CA LEU A 64 -7.065 -1.267 -0.814 1.00 0.00 C ATOM 942 C LEU A 64 -7.706 -2.655 -0.773 1.00 0.00 C ATOM 943 O LEU A 64 -8.415 -2.988 0.175 1.00 0.00 O ATOM 944 CB LEU A 64 -6.139 -0.982 0.371 1.00 0.00 C ATOM 945 CG LEU A 64 -5.284 0.282 0.265 1.00 0.00 C ATOM 946 CD1 LEU A 64 -5.316 0.849 -1.155 1.00 0.00 C ATOM 947 CD2 LEU A 64 -5.709 1.320 1.306 1.00 0.00 C ATOM 0 H LEU A 64 -8.426 0.103 0.002 1.00 0.00 H new ATOM 0 HA LEU A 64 -6.431 -1.235 -1.700 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -6.747 -0.911 1.273 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -5.475 -1.836 0.501 1.00 0.00 H new ATOM 0 HG LEU A 64 -4.250 0.013 0.481 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -4.700 1.747 -1.202 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -4.928 0.106 -1.852 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -6.342 1.098 -1.424 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -5.085 2.209 1.209 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -6.753 1.590 1.146 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -5.592 0.902 2.306 1.00 0.00 H new ATOM 959 N THR A 65 -7.435 -3.428 -1.815 1.00 0.00 N ATOM 960 CA THR A 65 -7.977 -4.772 -1.911 1.00 0.00 C ATOM 961 C THR A 65 -6.850 -5.806 -1.872 1.00 0.00 C ATOM 962 O THR A 65 -5.984 -5.818 -2.746 1.00 0.00 O ATOM 963 CB THR A 65 -8.829 -4.850 -3.179 1.00 0.00 C ATOM 964 OG1 THR A 65 -9.782 -3.801 -3.022 1.00 0.00 O ATOM 965 CG2 THR A 65 -9.680 -6.120 -3.237 1.00 0.00 C ATOM 0 H THR A 65 -6.847 -3.148 -2.600 1.00 0.00 H new ATOM 0 HA THR A 65 -8.616 -5.002 -1.058 1.00 0.00 H new ATOM 0 HB THR A 65 -8.181 -4.808 -4.054 1.00 0.00 H new ATOM 0 HG1 THR A 65 -10.681 -4.146 -3.203 1.00 0.00 H new ATOM 0 HG21 THR A 65 -10.265 -6.124 -4.157 1.00 0.00 H new ATOM 0 HG22 THR A 65 -9.030 -6.995 -3.216 1.00 0.00 H new ATOM 0 HG23 THR A 65 -10.352 -6.147 -2.380 1.00 0.00 H new ATOM 973 N ASN A 66 -6.896 -6.648 -0.851 1.00 0.00 N ATOM 974 CA ASN A 66 -5.889 -7.682 -0.687 1.00 0.00 C ATOM 975 C ASN A 66 -6.372 -8.969 -1.359 1.00 0.00 C ATOM 976 O ASN A 66 -7.264 -9.644 -0.848 1.00 0.00 O ATOM 977 CB ASN A 66 -5.646 -7.985 0.793 1.00 0.00 C ATOM 978 CG ASN A 66 -4.512 -8.997 0.967 1.00 0.00 C ATOM 979 OD1 ASN A 66 -3.673 -9.182 0.100 1.00 0.00 O ATOM 980 ND2 ASN A 66 -4.533 -9.638 2.131 1.00 0.00 N ATOM 0 H ASN A 66 -7.616 -6.635 -0.128 1.00 0.00 H new ATOM 0 HA ASN A 66 -4.963 -7.326 -1.139 1.00 0.00 H new ATOM 0 HB2 ASN A 66 -5.400 -7.064 1.321 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -6.559 -8.376 1.242 1.00 0.00 H new ATOM 0 HD21 ASN A 66 -3.818 -10.333 2.343 1.00 0.00 H new ATOM 0 HD22 ASN A 66 -5.264 -9.434 2.812 1.00 0.00 H new ATOM 987 N MET A 67 -5.762 -9.270 -2.496 1.00 0.00 N ATOM 988 CA MET A 67 -6.118 -10.463 -3.244 1.00 0.00 C ATOM 989 C MET A 67 -4.923 -11.410 -3.368 1.00 0.00 C ATOM 990 O MET A 67 -4.074 -11.233 -4.240 1.00 0.00 O ATOM 991 CB MET A 67 -6.602 -10.066 -4.640 1.00 0.00 C ATOM 992 CG MET A 67 -8.127 -10.149 -4.737 1.00 0.00 C ATOM 993 SD MET A 67 -8.637 -11.854 -4.879 1.00 0.00 S ATOM 994 CE MET A 67 -9.974 -11.877 -3.696 1.00 0.00 C ATOM 0 H MET A 67 -5.023 -8.707 -2.917 1.00 0.00 H new ATOM 0 HA MET A 67 -6.913 -10.981 -2.708 1.00 0.00 H new ATOM 0 HB2 MET A 67 -6.274 -9.052 -4.867 1.00 0.00 H new ATOM 0 HB3 MET A 67 -6.151 -10.721 -5.385 1.00 0.00 H new ATOM 0 HG2 MET A 67 -8.581 -9.697 -3.855 1.00 0.00 H new ATOM 0 HG3 MET A 67 -8.476 -9.583 -5.601 1.00 0.00 H new ATOM 0 HE1 MET A 67 -10.409 -12.876 -3.658 1.00 0.00 H new ATOM 0 HE2 MET A 67 -9.593 -11.609 -2.711 1.00 0.00 H new ATOM 0 HE3 MET A 67 -10.738 -11.160 -3.996 1.00 0.00 H new ATOM 1004 N ASP A 68 -4.895 -12.396 -2.482 1.00 0.00 N ATOM 1005 CA ASP A 68 -3.818 -13.371 -2.481 1.00 0.00 C ATOM 1006 C ASP A 68 -2.514 -12.683 -2.074 1.00 0.00 C ATOM 1007 O ASP A 68 -1.606 -12.532 -2.890 1.00 0.00 O ATOM 1008 CB ASP A 68 -3.620 -13.974 -3.873 1.00 0.00 C ATOM 1009 CG ASP A 68 -4.908 -14.383 -4.590 1.00 0.00 C ATOM 1010 OD1 ASP A 68 -5.888 -13.615 -4.478 1.00 0.00 O ATOM 1011 OD2 ASP A 68 -4.884 -15.454 -5.234 1.00 0.00 O ATOM 0 H ASP A 68 -5.601 -12.540 -1.760 1.00 0.00 H new ATOM 0 HA ASP A 68 -4.080 -14.163 -1.779 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -3.090 -13.251 -4.494 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -2.977 -14.850 -3.785 1.00 0.00 H new ATOM 1016 N GLY A 69 -2.461 -12.284 -0.812 1.00 0.00 N ATOM 1017 CA GLY A 69 -1.283 -11.616 -0.286 1.00 0.00 C ATOM 1018 C GLY A 69 -0.797 -10.526 -1.245 1.00 0.00 C ATOM 1019 O GLY A 69 0.388 -10.197 -1.267 1.00 0.00 O ATOM 0 H GLY A 69 -3.216 -12.411 -0.138 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -1.513 -11.176 0.684 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -0.489 -12.345 -0.125 1.00 0.00 H new ATOM 1023 N VAL A 70 -1.737 -9.997 -2.014 1.00 0.00 N ATOM 1024 CA VAL A 70 -1.420 -8.952 -2.972 1.00 0.00 C ATOM 1025 C VAL A 70 -2.409 -7.796 -2.805 1.00 0.00 C ATOM 1026 O VAL A 70 -3.614 -8.016 -2.698 1.00 0.00 O ATOM 1027 CB VAL A 70 -1.407 -9.528 -4.389 1.00 0.00 C ATOM 1028 CG1 VAL A 70 -0.992 -8.466 -5.409 1.00 0.00 C ATOM 1029 CG2 VAL A 70 -0.497 -10.755 -4.474 1.00 0.00 C ATOM 0 H VAL A 70 -2.719 -10.273 -1.993 1.00 0.00 H new ATOM 0 HA VAL A 70 -0.422 -8.555 -2.788 1.00 0.00 H new ATOM 0 HB VAL A 70 -2.421 -9.846 -4.630 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -0.991 -8.902 -6.408 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -1.697 -7.635 -5.376 1.00 0.00 H new ATOM 0 HG13 VAL A 70 0.008 -8.103 -5.170 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -0.506 -11.145 -5.492 1.00 0.00 H new ATOM 0 HG22 VAL A 70 0.520 -10.473 -4.202 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -0.856 -11.523 -3.788 1.00 0.00 H new ATOM 1039 N VAL A 71 -1.862 -6.590 -2.789 1.00 0.00 N ATOM 1040 CA VAL A 71 -2.681 -5.399 -2.637 1.00 0.00 C ATOM 1041 C VAL A 71 -2.406 -4.445 -3.801 1.00 0.00 C ATOM 1042 O VAL A 71 -1.259 -4.275 -4.212 1.00 0.00 O ATOM 1043 CB VAL A 71 -2.429 -4.761 -1.270 1.00 0.00 C ATOM 1044 CG1 VAL A 71 -2.934 -3.317 -1.236 1.00 0.00 C ATOM 1045 CG2 VAL A 71 -3.066 -5.591 -0.153 1.00 0.00 C ATOM 0 H VAL A 71 -0.862 -6.411 -2.879 1.00 0.00 H new ATOM 0 HA VAL A 71 -3.740 -5.657 -2.670 1.00 0.00 H new ATOM 0 HB VAL A 71 -1.352 -4.742 -1.102 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -2.742 -2.888 -0.253 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -2.415 -2.732 -1.995 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -4.005 -3.301 -1.436 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -2.872 -5.116 0.809 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -4.142 -5.655 -0.316 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -2.638 -6.593 -0.155 1.00 0.00 H new ATOM 1055 N THR A 72 -3.478 -3.847 -4.301 1.00 0.00 N ATOM 1056 CA THR A 72 -3.366 -2.914 -5.409 1.00 0.00 C ATOM 1057 C THR A 72 -4.179 -1.649 -5.125 1.00 0.00 C ATOM 1058 O THR A 72 -5.375 -1.724 -4.847 1.00 0.00 O ATOM 1059 CB THR A 72 -3.799 -3.641 -6.684 1.00 0.00 C ATOM 1060 OG1 THR A 72 -5.040 -4.248 -6.333 1.00 0.00 O ATOM 1061 CG2 THR A 72 -2.889 -4.823 -7.022 1.00 0.00 C ATOM 0 H THR A 72 -4.428 -3.991 -3.959 1.00 0.00 H new ATOM 0 HA THR A 72 -2.337 -2.579 -5.542 1.00 0.00 H new ATOM 0 HB THR A 72 -3.806 -2.939 -7.517 1.00 0.00 H new ATOM 0 HG1 THR A 72 -5.545 -3.645 -5.748 1.00 0.00 H new ATOM 0 HG21 THR A 72 -3.241 -5.303 -7.935 1.00 0.00 H new ATOM 0 HG22 THR A 72 -1.869 -4.467 -7.169 1.00 0.00 H new ATOM 0 HG23 THR A 72 -2.908 -5.542 -6.203 1.00 0.00 H new ATOM 1069 N VAL A 73 -3.497 -0.516 -5.205 1.00 0.00 N ATOM 1070 CA VAL A 73 -4.140 0.764 -4.961 1.00 0.00 C ATOM 1071 C VAL A 73 -5.098 1.076 -6.111 1.00 0.00 C ATOM 1072 O VAL A 73 -4.695 1.091 -7.273 1.00 0.00 O ATOM 1073 CB VAL A 73 -3.082 1.849 -4.752 1.00 0.00 C ATOM 1074 CG1 VAL A 73 -2.038 1.820 -5.870 1.00 0.00 C ATOM 1075 CG2 VAL A 73 -3.730 3.231 -4.642 1.00 0.00 C ATOM 0 H VAL A 73 -2.505 -0.458 -5.435 1.00 0.00 H new ATOM 0 HA VAL A 73 -4.732 0.726 -4.047 1.00 0.00 H new ATOM 0 HB VAL A 73 -2.571 1.642 -3.812 1.00 0.00 H new ATOM 0 HG11 VAL A 73 -1.298 2.601 -5.697 1.00 0.00 H new ATOM 0 HG12 VAL A 73 -1.544 0.848 -5.881 1.00 0.00 H new ATOM 0 HG13 VAL A 73 -2.527 1.990 -6.829 1.00 0.00 H new ATOM 0 HG21 VAL A 73 -2.957 3.985 -4.494 1.00 0.00 H new ATOM 0 HG22 VAL A 73 -4.279 3.449 -5.558 1.00 0.00 H new ATOM 0 HG23 VAL A 73 -4.417 3.245 -3.796 1.00 0.00 H new ATOM 1085 N THR A 74 -6.349 1.318 -5.748 1.00 0.00 N ATOM 1086 CA THR A 74 -7.369 1.629 -6.736 1.00 0.00 C ATOM 1087 C THR A 74 -8.016 2.981 -6.426 1.00 0.00 C ATOM 1088 O THR A 74 -8.817 3.092 -5.500 1.00 0.00 O ATOM 1089 CB THR A 74 -8.367 0.470 -6.766 1.00 0.00 C ATOM 1090 OG1 THR A 74 -7.546 -0.694 -6.807 1.00 0.00 O ATOM 1091 CG2 THR A 74 -9.158 0.414 -8.075 1.00 0.00 C ATOM 0 H THR A 74 -6.680 1.305 -4.783 1.00 0.00 H new ATOM 0 HA THR A 74 -6.938 1.731 -7.732 1.00 0.00 H new ATOM 0 HB THR A 74 -9.057 0.563 -5.928 1.00 0.00 H new ATOM 0 HG1 THR A 74 -8.113 -1.493 -6.827 1.00 0.00 H new ATOM 0 HG21 THR A 74 -9.852 -0.426 -8.045 1.00 0.00 H new ATOM 0 HG22 THR A 74 -9.716 1.341 -8.203 1.00 0.00 H new ATOM 0 HG23 THR A 74 -8.470 0.287 -8.911 1.00 0.00 H new ATOM 1099 N PRO A 75 -7.635 4.001 -7.241 1.00 0.00 N ATOM 1100 CA PRO A 75 -8.169 5.340 -7.064 1.00 0.00 C ATOM 1101 C PRO A 75 -9.610 5.427 -7.572 1.00 0.00 C ATOM 1102 O PRO A 75 -9.859 5.291 -8.768 1.00 0.00 O ATOM 1103 CB PRO A 75 -7.215 6.248 -7.824 1.00 0.00 C ATOM 1104 CG PRO A 75 -6.452 5.344 -8.779 1.00 0.00 C ATOM 1105 CD PRO A 75 -6.688 3.906 -8.349 1.00 0.00 C ATOM 0 HA PRO A 75 -8.228 5.634 -6.016 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -7.760 7.020 -8.368 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -6.535 6.759 -7.142 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -6.792 5.497 -9.803 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -5.388 5.579 -8.758 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -7.093 3.310 -9.166 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -5.759 3.429 -8.036 1.00 0.00 H new ATOM 1113 N ARG A 76 -10.520 5.654 -6.636 1.00 0.00 N ATOM 1114 CA ARG A 76 -11.929 5.761 -6.974 1.00 0.00 C ATOM 1115 C ARG A 76 -12.233 7.144 -7.553 1.00 0.00 C ATOM 1116 O ARG A 76 -13.215 7.317 -8.273 1.00 0.00 O ATOM 1117 CB ARG A 76 -12.809 5.526 -5.745 1.00 0.00 C ATOM 1118 CG ARG A 76 -13.025 4.031 -5.502 1.00 0.00 C ATOM 1119 CD ARG A 76 -13.928 3.425 -6.579 1.00 0.00 C ATOM 1120 NE ARG A 76 -15.347 3.544 -6.176 1.00 0.00 N ATOM 1121 CZ ARG A 76 -16.134 4.581 -6.493 1.00 0.00 C ATOM 1122 NH1 ARG A 76 -15.645 5.596 -7.220 1.00 0.00 N ATOM 1123 NH2 ARG A 76 -17.410 4.605 -6.084 1.00 0.00 N ATOM 0 H ARG A 76 -10.309 5.767 -5.644 1.00 0.00 H new ATOM 0 HA ARG A 76 -12.150 4.996 -7.718 1.00 0.00 H new ATOM 0 HB2 ARG A 76 -12.343 5.977 -4.869 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -13.772 6.018 -5.883 1.00 0.00 H new ATOM 0 HG2 ARG A 76 -12.064 3.517 -5.497 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -13.473 3.880 -4.520 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -13.767 3.935 -7.529 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -13.672 2.377 -6.732 1.00 0.00 H new ATOM 0 HE ARG A 76 -15.751 2.789 -5.622 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -14.674 5.579 -7.532 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -16.244 6.385 -7.461 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -17.783 3.833 -5.531 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -18.008 5.395 -6.326 1.00 0.00 H new ATOM 1137 N SER A 77 -11.371 8.093 -7.218 1.00 0.00 N ATOM 1138 CA SER A 77 -11.535 9.455 -7.696 1.00 0.00 C ATOM 1139 C SER A 77 -10.241 9.937 -8.355 1.00 0.00 C ATOM 1140 O SER A 77 -9.157 9.767 -7.800 1.00 0.00 O ATOM 1141 CB SER A 77 -11.932 10.395 -6.556 1.00 0.00 C ATOM 1142 OG SER A 77 -13.154 9.999 -5.938 1.00 0.00 O ATOM 0 H SER A 77 -10.557 7.945 -6.621 1.00 0.00 H new ATOM 0 HA SER A 77 -12.337 9.464 -8.434 1.00 0.00 H new ATOM 0 HB2 SER A 77 -11.138 10.415 -5.809 1.00 0.00 H new ATOM 0 HB3 SER A 77 -12.033 11.410 -6.941 1.00 0.00 H new ATOM 0 HG SER A 77 -12.959 9.441 -5.156 1.00 0.00 H new ATOM 1148 N MET A 78 -10.398 10.530 -9.529 1.00 0.00 N ATOM 1149 CA MET A 78 -9.255 11.038 -10.270 1.00 0.00 C ATOM 1150 C MET A 78 -8.628 12.237 -9.555 1.00 0.00 C ATOM 1151 O MET A 78 -7.410 12.406 -9.571 1.00 0.00 O ATOM 1152 CB MET A 78 -9.701 11.455 -11.673 1.00 0.00 C ATOM 1153 CG MET A 78 -9.317 10.396 -12.707 1.00 0.00 C ATOM 1154 SD MET A 78 -7.746 10.807 -13.449 1.00 0.00 S ATOM 1155 CE MET A 78 -7.536 9.402 -14.529 1.00 0.00 C ATOM 0 H MET A 78 -11.299 10.670 -9.986 1.00 0.00 H new ATOM 0 HA MET A 78 -8.508 10.247 -10.337 1.00 0.00 H new ATOM 0 HB2 MET A 78 -10.780 11.606 -11.686 1.00 0.00 H new ATOM 0 HB3 MET A 78 -9.243 12.408 -11.936 1.00 0.00 H new ATOM 0 HG2 MET A 78 -9.259 9.417 -12.232 1.00 0.00 H new ATOM 0 HG3 MET A 78 -10.086 10.332 -13.477 1.00 0.00 H new ATOM 0 HE1 MET A 78 -6.596 9.499 -15.073 1.00 0.00 H new ATOM 0 HE2 MET A 78 -7.520 8.487 -13.937 1.00 0.00 H new ATOM 0 HE3 MET A 78 -8.363 9.361 -15.238 1.00 0.00 H new ATOM 1165 N ASP A 79 -9.490 13.039 -8.946 1.00 0.00 N ATOM 1166 CA ASP A 79 -9.035 14.217 -8.227 1.00 0.00 C ATOM 1167 C ASP A 79 -8.093 13.790 -7.099 1.00 0.00 C ATOM 1168 O ASP A 79 -7.082 14.444 -6.849 1.00 0.00 O ATOM 1169 CB ASP A 79 -10.212 14.968 -7.601 1.00 0.00 C ATOM 1170 CG ASP A 79 -11.149 15.650 -8.600 1.00 0.00 C ATOM 1171 OD1 ASP A 79 -12.102 14.970 -9.038 1.00 0.00 O ATOM 1172 OD2 ASP A 79 -10.892 16.835 -8.902 1.00 0.00 O ATOM 0 H ASP A 79 -10.500 12.896 -8.936 1.00 0.00 H new ATOM 0 HA ASP A 79 -8.526 14.869 -8.937 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -10.793 14.267 -7.001 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -9.820 15.723 -6.919 1.00 0.00 H new ATOM 1177 N ALA A 80 -8.459 12.695 -6.449 1.00 0.00 N ATOM 1178 CA ALA A 80 -7.659 12.173 -5.354 1.00 0.00 C ATOM 1179 C ALA A 80 -6.288 11.750 -5.886 1.00 0.00 C ATOM 1180 O ALA A 80 -6.139 10.656 -6.428 1.00 0.00 O ATOM 1181 CB ALA A 80 -8.405 11.018 -4.682 1.00 0.00 C ATOM 0 H ALA A 80 -9.298 12.155 -6.659 1.00 0.00 H new ATOM 0 HA ALA A 80 -7.497 12.941 -4.597 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -7.805 10.626 -3.861 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -9.359 11.377 -4.296 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -8.583 10.227 -5.411 1.00 0.00 H new ATOM 1187 N GLU A 81 -5.322 12.640 -5.713 1.00 0.00 N ATOM 1188 CA GLU A 81 -3.968 12.373 -6.169 1.00 0.00 C ATOM 1189 C GLU A 81 -3.346 11.240 -5.350 1.00 0.00 C ATOM 1190 O GLU A 81 -3.219 11.348 -4.131 1.00 0.00 O ATOM 1191 CB GLU A 81 -3.107 13.636 -6.101 1.00 0.00 C ATOM 1192 CG GLU A 81 -3.834 14.829 -6.725 1.00 0.00 C ATOM 1193 CD GLU A 81 -4.484 15.699 -5.647 1.00 0.00 C ATOM 1194 OE1 GLU A 81 -4.822 15.131 -4.586 1.00 0.00 O ATOM 1195 OE2 GLU A 81 -4.629 16.913 -5.908 1.00 0.00 O ATOM 0 H GLU A 81 -5.450 13.547 -5.263 1.00 0.00 H new ATOM 0 HA GLU A 81 -4.012 12.059 -7.212 1.00 0.00 H new ATOM 0 HB2 GLU A 81 -2.862 13.858 -5.062 1.00 0.00 H new ATOM 0 HB3 GLU A 81 -2.165 13.467 -6.622 1.00 0.00 H new ATOM 0 HG2 GLU A 81 -3.130 15.426 -7.304 1.00 0.00 H new ATOM 0 HG3 GLU A 81 -4.596 14.473 -7.419 1.00 0.00 H new ATOM 1202 N THR A 82 -2.974 10.180 -6.052 1.00 0.00 N ATOM 1203 CA THR A 82 -2.368 9.029 -5.405 1.00 0.00 C ATOM 1204 C THR A 82 -1.058 8.655 -6.100 1.00 0.00 C ATOM 1205 O THR A 82 -1.067 8.172 -7.231 1.00 0.00 O ATOM 1206 CB THR A 82 -3.396 7.896 -5.396 1.00 0.00 C ATOM 1207 OG1 THR A 82 -4.513 8.446 -4.703 1.00 0.00 O ATOM 1208 CG2 THR A 82 -2.961 6.717 -4.524 1.00 0.00 C ATOM 0 H THR A 82 -3.081 10.094 -7.063 1.00 0.00 H new ATOM 0 HA THR A 82 -2.099 9.252 -4.372 1.00 0.00 H new ATOM 0 HB THR A 82 -3.563 7.551 -6.416 1.00 0.00 H new ATOM 0 HG1 THR A 82 -4.197 9.072 -4.018 1.00 0.00 H new ATOM 0 HG21 THR A 82 -3.726 5.941 -4.553 1.00 0.00 H new ATOM 0 HG22 THR A 82 -2.021 6.314 -4.900 1.00 0.00 H new ATOM 0 HG23 THR A 82 -2.826 7.055 -3.497 1.00 0.00 H new ATOM 1216 N TYR A 83 0.038 8.892 -5.395 1.00 0.00 N ATOM 1217 CA TYR A 83 1.354 8.586 -5.930 1.00 0.00 C ATOM 1218 C TYR A 83 2.019 7.458 -5.138 1.00 0.00 C ATOM 1219 O TYR A 83 2.264 7.597 -3.941 1.00 0.00 O ATOM 1220 CB TYR A 83 2.182 9.862 -5.770 1.00 0.00 C ATOM 1221 CG TYR A 83 1.473 11.128 -6.256 1.00 0.00 C ATOM 1222 CD1 TYR A 83 1.539 11.488 -7.587 1.00 0.00 C ATOM 1223 CD2 TYR A 83 0.769 11.910 -5.364 1.00 0.00 C ATOM 1224 CE1 TYR A 83 0.872 12.680 -8.044 1.00 0.00 C ATOM 1225 CE2 TYR A 83 0.102 13.102 -5.821 1.00 0.00 C ATOM 1226 CZ TYR A 83 0.186 13.428 -7.139 1.00 0.00 C ATOM 1227 OH TYR A 83 -0.443 14.553 -7.571 1.00 0.00 O ATOM 0 H TYR A 83 0.042 9.293 -4.457 1.00 0.00 H new ATOM 0 HA TYR A 83 1.280 8.263 -6.969 1.00 0.00 H new ATOM 0 HB2 TYR A 83 2.443 9.985 -4.719 1.00 0.00 H new ATOM 0 HB3 TYR A 83 3.117 9.748 -6.319 1.00 0.00 H new ATOM 0 HD1 TYR A 83 2.091 10.876 -8.285 1.00 0.00 H new ATOM 0 HD2 TYR A 83 0.718 11.628 -4.323 1.00 0.00 H new ATOM 0 HE1 TYR A 83 0.916 12.973 -9.083 1.00 0.00 H new ATOM 0 HE2 TYR A 83 -0.452 13.723 -5.133 1.00 0.00 H new ATOM 0 HH TYR A 83 -0.717 14.437 -8.505 1.00 0.00 H new ATOM 1237 N VAL A 84 2.292 6.367 -5.839 1.00 0.00 N ATOM 1238 CA VAL A 84 2.925 5.217 -5.216 1.00 0.00 C ATOM 1239 C VAL A 84 4.442 5.325 -5.378 1.00 0.00 C ATOM 1240 O VAL A 84 4.998 4.866 -6.375 1.00 0.00 O ATOM 1241 CB VAL A 84 2.351 3.924 -5.802 1.00 0.00 C ATOM 1242 CG1 VAL A 84 3.153 2.708 -5.333 1.00 0.00 C ATOM 1243 CG2 VAL A 84 0.870 3.773 -5.451 1.00 0.00 C ATOM 0 H VAL A 84 2.086 6.255 -6.832 1.00 0.00 H new ATOM 0 HA VAL A 84 2.714 5.196 -4.147 1.00 0.00 H new ATOM 0 HB VAL A 84 2.433 3.982 -6.887 1.00 0.00 H new ATOM 0 HG11 VAL A 84 2.725 1.802 -5.763 1.00 0.00 H new ATOM 0 HG12 VAL A 84 4.189 2.809 -5.656 1.00 0.00 H new ATOM 0 HG13 VAL A 84 3.117 2.646 -4.245 1.00 0.00 H new ATOM 0 HG21 VAL A 84 0.487 2.847 -5.879 1.00 0.00 H new ATOM 0 HG22 VAL A 84 0.754 3.747 -4.368 1.00 0.00 H new ATOM 0 HG23 VAL A 84 0.312 4.618 -5.856 1.00 0.00 H new ATOM 1253 N ASP A 85 5.069 5.933 -4.382 1.00 0.00 N ATOM 1254 CA ASP A 85 6.512 6.107 -4.401 1.00 0.00 C ATOM 1255 C ASP A 85 6.864 7.310 -5.278 1.00 0.00 C ATOM 1256 O ASP A 85 7.864 7.288 -5.995 1.00 0.00 O ATOM 1257 CB ASP A 85 7.207 4.876 -4.984 1.00 0.00 C ATOM 1258 CG ASP A 85 8.507 4.475 -4.284 1.00 0.00 C ATOM 1259 OD1 ASP A 85 8.408 4.001 -3.132 1.00 0.00 O ATOM 1260 OD2 ASP A 85 9.570 4.652 -4.917 1.00 0.00 O ATOM 0 H ASP A 85 4.605 6.311 -3.556 1.00 0.00 H new ATOM 0 HA ASP A 85 6.848 6.258 -3.375 1.00 0.00 H new ATOM 0 HB2 ASP A 85 6.516 4.034 -4.944 1.00 0.00 H new ATOM 0 HB3 ASP A 85 7.421 5.063 -6.036 1.00 0.00 H new ATOM 1265 N GLY A 86 6.025 8.331 -5.193 1.00 0.00 N ATOM 1266 CA GLY A 86 6.236 9.540 -5.970 1.00 0.00 C ATOM 1267 C GLY A 86 5.809 9.338 -7.426 1.00 0.00 C ATOM 1268 O GLY A 86 6.212 10.097 -8.306 1.00 0.00 O ATOM 0 H GLY A 86 5.197 8.346 -4.597 1.00 0.00 H new ATOM 0 HA2 GLY A 86 5.669 10.362 -5.532 1.00 0.00 H new ATOM 0 HA3 GLY A 86 7.288 9.822 -5.932 1.00 0.00 H new ATOM 1272 N GLN A 87 4.998 8.311 -7.634 1.00 0.00 N ATOM 1273 CA GLN A 87 4.512 7.999 -8.967 1.00 0.00 C ATOM 1274 C GLN A 87 2.987 7.882 -8.962 1.00 0.00 C ATOM 1275 O GLN A 87 2.430 6.996 -8.316 1.00 0.00 O ATOM 1276 CB GLN A 87 5.158 6.719 -9.501 1.00 0.00 C ATOM 1277 CG GLN A 87 6.379 7.041 -10.366 1.00 0.00 C ATOM 1278 CD GLN A 87 7.370 5.875 -10.370 1.00 0.00 C ATOM 1279 OE1 GLN A 87 7.408 5.062 -11.278 1.00 0.00 O ATOM 1280 NE2 GLN A 87 8.169 5.841 -9.306 1.00 0.00 N ATOM 0 H GLN A 87 4.665 7.684 -6.901 1.00 0.00 H new ATOM 0 HA GLN A 87 4.792 8.814 -9.634 1.00 0.00 H new ATOM 0 HB2 GLN A 87 5.456 6.083 -8.668 1.00 0.00 H new ATOM 0 HB3 GLN A 87 4.431 6.157 -10.087 1.00 0.00 H new ATOM 0 HG2 GLN A 87 6.060 7.256 -11.386 1.00 0.00 H new ATOM 0 HG3 GLN A 87 6.869 7.939 -9.990 1.00 0.00 H new ATOM 0 HE21 GLN A 87 8.084 6.554 -8.581 1.00 0.00 H new ATOM 0 HE22 GLN A 87 8.866 5.102 -9.215 1.00 0.00 H new ATOM 1289 N ARG A 88 2.353 8.790 -9.691 1.00 0.00 N ATOM 1290 CA ARG A 88 0.903 8.800 -9.779 1.00 0.00 C ATOM 1291 C ARG A 88 0.409 7.564 -10.533 1.00 0.00 C ATOM 1292 O ARG A 88 1.133 7.001 -11.352 1.00 0.00 O ATOM 1293 CB ARG A 88 0.403 10.058 -10.492 1.00 0.00 C ATOM 1294 CG ARG A 88 -1.008 10.427 -10.028 1.00 0.00 C ATOM 1295 CD ARG A 88 -1.333 11.883 -10.368 1.00 0.00 C ATOM 1296 NE ARG A 88 -2.716 11.984 -10.886 1.00 0.00 N ATOM 1297 CZ ARG A 88 -3.069 11.700 -12.147 1.00 0.00 C ATOM 1298 NH1 ARG A 88 -2.143 11.295 -13.026 1.00 0.00 N ATOM 1299 NH2 ARG A 88 -4.348 11.821 -12.528 1.00 0.00 N ATOM 0 H ARG A 88 2.818 9.524 -10.226 1.00 0.00 H new ATOM 0 HA ARG A 88 0.509 8.792 -8.763 1.00 0.00 H new ATOM 0 HB2 ARG A 88 1.083 10.887 -10.295 1.00 0.00 H new ATOM 0 HB3 ARG A 88 0.404 9.894 -11.570 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -1.735 9.768 -10.503 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -1.093 10.273 -8.952 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -1.222 12.506 -9.481 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -0.629 12.258 -11.111 1.00 0.00 H new ATOM 0 HE ARG A 88 -3.446 12.289 -10.242 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -1.170 11.203 -12.735 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -2.411 11.079 -13.986 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -5.053 12.129 -11.858 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -4.617 11.605 -13.488 1.00 0.00 H new ATOM 1313 N ILE A 89 -0.822 7.178 -10.230 1.00 0.00 N ATOM 1314 CA ILE A 89 -1.422 6.019 -10.869 1.00 0.00 C ATOM 1315 C ILE A 89 -2.696 6.448 -11.600 1.00 0.00 C ATOM 1316 O ILE A 89 -3.201 7.548 -11.381 1.00 0.00 O ATOM 1317 CB ILE A 89 -1.645 4.901 -9.849 1.00 0.00 C ATOM 1318 CG1 ILE A 89 -2.684 5.312 -8.803 1.00 0.00 C ATOM 1319 CG2 ILE A 89 -0.324 4.472 -9.208 1.00 0.00 C ATOM 1320 CD1 ILE A 89 -3.317 4.083 -8.148 1.00 0.00 C ATOM 0 H ILE A 89 -1.420 7.648 -9.550 1.00 0.00 H new ATOM 0 HA ILE A 89 -0.748 5.605 -11.619 1.00 0.00 H new ATOM 0 HB ILE A 89 -2.044 4.033 -10.375 1.00 0.00 H new ATOM 0 HG12 ILE A 89 -2.213 5.933 -8.041 1.00 0.00 H new ATOM 0 HG13 ILE A 89 -3.459 5.918 -9.273 1.00 0.00 H new ATOM 0 HG21 ILE A 89 -0.511 3.676 -8.487 1.00 0.00 H new ATOM 0 HG22 ILE A 89 0.354 4.110 -9.980 1.00 0.00 H new ATOM 0 HG23 ILE A 89 0.127 5.324 -8.699 1.00 0.00 H new ATOM 0 HD11 ILE A 89 -4.052 4.402 -7.409 1.00 0.00 H new ATOM 0 HD12 ILE A 89 -3.808 3.477 -8.910 1.00 0.00 H new ATOM 0 HD13 ILE A 89 -2.543 3.492 -7.658 1.00 0.00 H new ATOM 1332 N SER A 90 -3.178 5.557 -12.454 1.00 0.00 N ATOM 1333 CA SER A 90 -4.383 5.829 -13.219 1.00 0.00 C ATOM 1334 C SER A 90 -5.300 4.604 -13.204 1.00 0.00 C ATOM 1335 O SER A 90 -6.281 4.551 -13.944 1.00 0.00 O ATOM 1336 CB SER A 90 -4.045 6.222 -14.659 1.00 0.00 C ATOM 1337 OG SER A 90 -3.647 7.586 -14.761 1.00 0.00 O ATOM 0 H SER A 90 -2.756 4.646 -12.633 1.00 0.00 H new ATOM 0 HA SER A 90 -4.901 6.668 -12.754 1.00 0.00 H new ATOM 0 HB2 SER A 90 -3.245 5.582 -15.031 1.00 0.00 H new ATOM 0 HB3 SER A 90 -4.913 6.049 -15.295 1.00 0.00 H new ATOM 0 HG SER A 90 -3.438 7.797 -15.695 1.00 0.00 H new ATOM 1343 N GLU A 91 -4.947 3.651 -12.355 1.00 0.00 N ATOM 1344 CA GLU A 91 -5.726 2.430 -12.234 1.00 0.00 C ATOM 1345 C GLU A 91 -5.108 1.508 -11.181 1.00 0.00 C ATOM 1346 O GLU A 91 -4.149 1.883 -10.509 1.00 0.00 O ATOM 1347 CB GLU A 91 -5.845 1.720 -13.584 1.00 0.00 C ATOM 1348 CG GLU A 91 -4.520 1.770 -14.348 1.00 0.00 C ATOM 1349 CD GLU A 91 -4.107 0.375 -14.821 1.00 0.00 C ATOM 1350 OE1 GLU A 91 -3.756 -0.442 -13.943 1.00 0.00 O ATOM 1351 OE2 GLU A 91 -4.151 0.157 -16.051 1.00 0.00 O ATOM 0 H GLU A 91 -4.132 3.699 -11.744 1.00 0.00 H new ATOM 0 HA GLU A 91 -6.733 2.695 -11.910 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -6.140 0.682 -13.429 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -6.629 2.189 -14.178 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -4.616 2.435 -15.206 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -3.742 2.186 -13.707 1.00 0.00 H new ATOM 1358 N THR A 92 -5.684 0.320 -11.070 1.00 0.00 N ATOM 1359 CA THR A 92 -5.202 -0.659 -10.111 1.00 0.00 C ATOM 1360 C THR A 92 -3.693 -0.858 -10.264 1.00 0.00 C ATOM 1361 O THR A 92 -3.239 -1.470 -11.230 1.00 0.00 O ATOM 1362 CB THR A 92 -6.007 -1.945 -10.302 1.00 0.00 C ATOM 1363 OG1 THR A 92 -7.364 -1.524 -10.200 1.00 0.00 O ATOM 1364 CG2 THR A 92 -5.832 -2.924 -9.139 1.00 0.00 C ATOM 0 H THR A 92 -6.480 0.013 -11.629 1.00 0.00 H new ATOM 0 HA THR A 92 -5.350 -0.315 -9.087 1.00 0.00 H new ATOM 0 HB THR A 92 -5.704 -2.428 -11.231 1.00 0.00 H new ATOM 0 HG1 THR A 92 -7.956 -2.297 -10.314 1.00 0.00 H new ATOM 0 HG21 THR A 92 -6.425 -3.820 -9.325 1.00 0.00 H new ATOM 0 HG22 THR A 92 -4.781 -3.197 -9.048 1.00 0.00 H new ATOM 0 HG23 THR A 92 -6.166 -2.454 -8.214 1.00 0.00 H new ATOM 1372 N THR A 93 -2.957 -0.328 -9.298 1.00 0.00 N ATOM 1373 CA THR A 93 -1.508 -0.440 -9.314 1.00 0.00 C ATOM 1374 C THR A 93 -1.027 -1.306 -8.148 1.00 0.00 C ATOM 1375 O THR A 93 -1.249 -0.968 -6.986 1.00 0.00 O ATOM 1376 CB THR A 93 -0.925 0.974 -9.301 1.00 0.00 C ATOM 1377 OG1 THR A 93 -0.938 1.368 -10.671 1.00 0.00 O ATOM 1378 CG2 THR A 93 0.558 0.993 -8.923 1.00 0.00 C ATOM 0 H THR A 93 -3.337 0.180 -8.499 1.00 0.00 H new ATOM 0 HA THR A 93 -1.160 -0.943 -10.216 1.00 0.00 H new ATOM 0 HB THR A 93 -1.487 1.591 -8.600 1.00 0.00 H new ATOM 0 HG1 THR A 93 -1.852 1.602 -10.936 1.00 0.00 H new ATOM 0 HG21 THR A 93 0.922 2.020 -8.929 1.00 0.00 H new ATOM 0 HG22 THR A 93 0.685 0.569 -7.927 1.00 0.00 H new ATOM 0 HG23 THR A 93 1.125 0.403 -9.644 1.00 0.00 H new ATOM 1386 N MET A 94 -0.378 -2.407 -8.498 1.00 0.00 N ATOM 1387 CA MET A 94 0.136 -3.324 -7.496 1.00 0.00 C ATOM 1388 C MET A 94 1.006 -2.588 -6.474 1.00 0.00 C ATOM 1389 O MET A 94 1.788 -1.710 -6.837 1.00 0.00 O ATOM 1390 CB MET A 94 0.963 -4.416 -8.178 1.00 0.00 C ATOM 1391 CG MET A 94 1.395 -5.485 -7.172 1.00 0.00 C ATOM 1392 SD MET A 94 1.851 -6.982 -8.031 1.00 0.00 S ATOM 1393 CE MET A 94 0.233 -7.588 -8.478 1.00 0.00 C ATOM 0 H MET A 94 -0.196 -2.684 -9.463 1.00 0.00 H new ATOM 0 HA MET A 94 -0.709 -3.770 -6.972 1.00 0.00 H new ATOM 0 HB2 MET A 94 0.378 -4.876 -8.974 1.00 0.00 H new ATOM 0 HB3 MET A 94 1.843 -3.973 -8.644 1.00 0.00 H new ATOM 0 HG2 MET A 94 2.238 -5.123 -6.583 1.00 0.00 H new ATOM 0 HG3 MET A 94 0.583 -5.689 -6.474 1.00 0.00 H new ATOM 0 HE1 MET A 94 0.196 -8.668 -8.334 1.00 0.00 H new ATOM 0 HE2 MET A 94 -0.520 -7.112 -7.850 1.00 0.00 H new ATOM 0 HE3 MET A 94 0.033 -7.355 -9.524 1.00 0.00 H new ATOM 1403 N LEU A 95 0.842 -2.974 -5.218 1.00 0.00 N ATOM 1404 CA LEU A 95 1.602 -2.362 -4.141 1.00 0.00 C ATOM 1405 C LEU A 95 2.659 -3.350 -3.644 1.00 0.00 C ATOM 1406 O LEU A 95 2.415 -4.554 -3.597 1.00 0.00 O ATOM 1407 CB LEU A 95 0.665 -1.858 -3.042 1.00 0.00 C ATOM 1408 CG LEU A 95 -0.157 -0.613 -3.380 1.00 0.00 C ATOM 1409 CD1 LEU A 95 -1.159 -0.299 -2.267 1.00 0.00 C ATOM 1410 CD2 LEU A 95 0.753 0.579 -3.684 1.00 0.00 C ATOM 0 H LEU A 95 0.194 -3.703 -4.921 1.00 0.00 H new ATOM 0 HA LEU A 95 2.133 -1.481 -4.502 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -0.022 -2.663 -2.781 1.00 0.00 H new ATOM 0 HB3 LEU A 95 1.260 -1.646 -2.154 1.00 0.00 H new ATOM 0 HG LEU A 95 -0.732 -0.818 -4.283 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -1.730 0.590 -2.532 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -1.838 -1.142 -2.140 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -0.623 -0.121 -1.335 1.00 0.00 H new ATOM 0 HD21 LEU A 95 0.143 1.451 -3.921 1.00 0.00 H new ATOM 0 HD22 LEU A 95 1.372 0.795 -2.814 1.00 0.00 H new ATOM 0 HD23 LEU A 95 1.392 0.341 -4.534 1.00 0.00 H new ATOM 1422 N GLN A 96 3.812 -2.803 -3.285 1.00 0.00 N ATOM 1423 CA GLN A 96 4.907 -3.621 -2.792 1.00 0.00 C ATOM 1424 C GLN A 96 5.439 -3.058 -1.473 1.00 0.00 C ATOM 1425 O GLN A 96 5.306 -1.865 -1.205 1.00 0.00 O ATOM 1426 CB GLN A 96 6.023 -3.727 -3.833 1.00 0.00 C ATOM 1427 CG GLN A 96 5.562 -4.528 -5.053 1.00 0.00 C ATOM 1428 CD GLN A 96 6.054 -3.883 -6.350 1.00 0.00 C ATOM 1429 OE1 GLN A 96 5.290 -3.351 -7.138 1.00 0.00 O ATOM 1430 NE2 GLN A 96 7.370 -3.961 -6.527 1.00 0.00 N ATOM 0 H GLN A 96 4.011 -1.803 -3.326 1.00 0.00 H new ATOM 0 HA GLN A 96 4.529 -4.627 -2.608 1.00 0.00 H new ATOM 0 HB2 GLN A 96 6.331 -2.729 -4.144 1.00 0.00 H new ATOM 0 HB3 GLN A 96 6.896 -4.205 -3.388 1.00 0.00 H new ATOM 0 HG2 GLN A 96 5.937 -5.549 -4.985 1.00 0.00 H new ATOM 0 HG3 GLN A 96 4.474 -4.589 -5.063 1.00 0.00 H new ATOM 0 HE21 GLN A 96 7.952 -4.421 -5.827 1.00 0.00 H new ATOM 0 HE22 GLN A 96 7.797 -3.561 -7.363 1.00 0.00 H new ATOM 1439 N SER A 97 6.030 -3.943 -0.684 1.00 0.00 N ATOM 1440 CA SER A 97 6.583 -3.549 0.601 1.00 0.00 C ATOM 1441 C SER A 97 7.702 -2.526 0.397 1.00 0.00 C ATOM 1442 O SER A 97 8.653 -2.779 -0.341 1.00 0.00 O ATOM 1443 CB SER A 97 7.107 -4.763 1.370 1.00 0.00 C ATOM 1444 OG SER A 97 8.463 -5.057 1.045 1.00 0.00 O ATOM 0 H SER A 97 6.138 -4.932 -0.910 1.00 0.00 H new ATOM 0 HA SER A 97 5.787 -3.095 1.192 1.00 0.00 H new ATOM 0 HB2 SER A 97 7.023 -4.578 2.441 1.00 0.00 H new ATOM 0 HB3 SER A 97 6.485 -5.630 1.147 1.00 0.00 H new ATOM 0 HG SER A 97 8.747 -4.500 0.290 1.00 0.00 H new ATOM 1450 N GLY A 98 7.552 -1.392 1.065 1.00 0.00 N ATOM 1451 CA GLY A 98 8.538 -0.329 0.967 1.00 0.00 C ATOM 1452 C GLY A 98 7.995 0.850 0.158 1.00 0.00 C ATOM 1453 O GLY A 98 8.313 2.003 0.444 1.00 0.00 O ATOM 0 H GLY A 98 6.762 -1.186 1.677 1.00 0.00 H new ATOM 0 HA2 GLY A 98 8.815 0.008 1.966 1.00 0.00 H new ATOM 0 HA3 GLY A 98 9.444 -0.711 0.496 1.00 0.00 H new ATOM 1457 N MET A 99 7.185 0.520 -0.837 1.00 0.00 N ATOM 1458 CA MET A 99 6.595 1.538 -1.690 1.00 0.00 C ATOM 1459 C MET A 99 5.828 2.570 -0.862 1.00 0.00 C ATOM 1460 O MET A 99 5.075 2.211 0.042 1.00 0.00 O ATOM 1461 CB MET A 99 5.644 0.877 -2.690 1.00 0.00 C ATOM 1462 CG MET A 99 6.413 0.305 -3.883 1.00 0.00 C ATOM 1463 SD MET A 99 5.562 0.694 -5.402 1.00 0.00 S ATOM 1464 CE MET A 99 4.090 -0.296 -5.195 1.00 0.00 C ATOM 0 H MET A 99 6.923 -0.438 -1.072 1.00 0.00 H new ATOM 0 HA MET A 99 7.397 2.050 -2.221 1.00 0.00 H new ATOM 0 HB2 MET A 99 5.087 0.081 -2.196 1.00 0.00 H new ATOM 0 HB3 MET A 99 4.914 1.607 -3.040 1.00 0.00 H new ATOM 0 HG2 MET A 99 7.422 0.716 -3.906 1.00 0.00 H new ATOM 0 HG3 MET A 99 6.511 -0.775 -3.778 1.00 0.00 H new ATOM 0 HE1 MET A 99 3.418 -0.129 -6.037 1.00 0.00 H new ATOM 0 HE2 MET A 99 4.364 -1.350 -5.153 1.00 0.00 H new ATOM 0 HE3 MET A 99 3.589 -0.014 -4.269 1.00 0.00 H new ATOM 1474 N ARG A 100 6.045 3.833 -1.200 1.00 0.00 N ATOM 1475 CA ARG A 100 5.384 4.920 -0.498 1.00 0.00 C ATOM 1476 C ARG A 100 4.041 5.239 -1.160 1.00 0.00 C ATOM 1477 O ARG A 100 3.812 4.877 -2.313 1.00 0.00 O ATOM 1478 CB ARG A 100 6.253 6.179 -0.489 1.00 0.00 C ATOM 1479 CG ARG A 100 6.730 6.506 0.927 1.00 0.00 C ATOM 1480 CD ARG A 100 7.628 7.744 0.931 1.00 0.00 C ATOM 1481 NE ARG A 100 9.051 7.338 0.961 1.00 0.00 N ATOM 1482 CZ ARG A 100 9.793 7.119 -0.133 1.00 0.00 C ATOM 1483 NH1 ARG A 100 9.252 7.266 -1.350 1.00 0.00 N ATOM 1484 NH2 ARG A 100 11.076 6.752 -0.009 1.00 0.00 N ATOM 0 H ARG A 100 6.669 4.128 -1.951 1.00 0.00 H new ATOM 0 HA ARG A 100 5.219 4.600 0.531 1.00 0.00 H new ATOM 0 HB2 ARG A 100 7.114 6.036 -1.142 1.00 0.00 H new ATOM 0 HB3 ARG A 100 5.686 7.020 -0.889 1.00 0.00 H new ATOM 0 HG2 ARG A 100 5.870 6.675 1.575 1.00 0.00 H new ATOM 0 HG3 ARG A 100 7.275 5.656 1.336 1.00 0.00 H new ATOM 0 HD2 ARG A 100 7.432 8.348 0.045 1.00 0.00 H new ATOM 0 HD3 ARG A 100 7.400 8.366 1.797 1.00 0.00 H new ATOM 0 HE ARG A 100 9.495 7.217 1.872 1.00 0.00 H new ATOM 0 HH11 ARG A 100 8.275 7.545 -1.444 1.00 0.00 H new ATOM 0 HH12 ARG A 100 9.817 7.099 -2.183 1.00 0.00 H new ATOM 0 HH21 ARG A 100 11.487 6.640 0.918 1.00 0.00 H new ATOM 0 HH22 ARG A 100 11.641 6.585 -0.841 1.00 0.00 H new ATOM 1498 N LEU A 101 3.190 5.914 -0.401 1.00 0.00 N ATOM 1499 CA LEU A 101 1.877 6.286 -0.899 1.00 0.00 C ATOM 1500 C LEU A 101 1.551 7.712 -0.450 1.00 0.00 C ATOM 1501 O LEU A 101 1.280 7.950 0.726 1.00 0.00 O ATOM 1502 CB LEU A 101 0.830 5.254 -0.475 1.00 0.00 C ATOM 1503 CG LEU A 101 0.472 4.194 -1.519 1.00 0.00 C ATOM 1504 CD1 LEU A 101 0.702 2.785 -0.971 1.00 0.00 C ATOM 1505 CD2 LEU A 101 -0.959 4.386 -2.025 1.00 0.00 C ATOM 0 H LEU A 101 3.384 6.213 0.555 1.00 0.00 H new ATOM 0 HA LEU A 101 1.869 6.284 -1.989 1.00 0.00 H new ATOM 0 HB2 LEU A 101 1.190 4.747 0.420 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -0.081 5.783 -0.196 1.00 0.00 H new ATOM 0 HG LEU A 101 1.136 4.318 -2.374 1.00 0.00 H new ATOM 0 HD11 LEU A 101 0.440 2.051 -1.733 1.00 0.00 H new ATOM 0 HD12 LEU A 101 1.751 2.667 -0.699 1.00 0.00 H new ATOM 0 HD13 LEU A 101 0.079 2.631 -0.090 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -1.189 3.620 -2.766 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -1.654 4.303 -1.190 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -1.055 5.372 -2.480 1.00 0.00 H new ATOM 1517 N GLN A 102 1.588 8.624 -1.411 1.00 0.00 N ATOM 1518 CA GLN A 102 1.300 10.020 -1.129 1.00 0.00 C ATOM 1519 C GLN A 102 -0.164 10.334 -1.442 1.00 0.00 C ATOM 1520 O GLN A 102 -0.591 10.239 -2.591 1.00 0.00 O ATOM 1521 CB GLN A 102 2.238 10.942 -1.911 1.00 0.00 C ATOM 1522 CG GLN A 102 2.048 12.401 -1.491 1.00 0.00 C ATOM 1523 CD GLN A 102 3.342 13.197 -1.678 1.00 0.00 C ATOM 1524 OE1 GLN A 102 4.240 13.172 -0.853 1.00 0.00 O ATOM 1525 NE2 GLN A 102 3.385 13.903 -2.804 1.00 0.00 N ATOM 0 H GLN A 102 1.813 8.423 -2.385 1.00 0.00 H new ATOM 0 HA GLN A 102 1.470 10.198 -0.067 1.00 0.00 H new ATOM 0 HB2 GLN A 102 3.272 10.643 -1.742 1.00 0.00 H new ATOM 0 HB3 GLN A 102 2.047 10.840 -2.979 1.00 0.00 H new ATOM 0 HG2 GLN A 102 1.250 12.852 -2.081 1.00 0.00 H new ATOM 0 HG3 GLN A 102 1.737 12.445 -0.447 1.00 0.00 H new ATOM 0 HE21 GLN A 102 2.597 13.879 -3.452 1.00 0.00 H new ATOM 0 HE22 GLN A 102 4.206 14.469 -3.020 1.00 0.00 H new ATOM 1534 N PHE A 103 -0.894 10.700 -0.398 1.00 0.00 N ATOM 1535 CA PHE A 103 -2.301 11.028 -0.547 1.00 0.00 C ATOM 1536 C PHE A 103 -2.536 12.530 -0.368 1.00 0.00 C ATOM 1537 O PHE A 103 -2.476 13.043 0.748 1.00 0.00 O ATOM 1538 CB PHE A 103 -3.055 10.273 0.550 1.00 0.00 C ATOM 1539 CG PHE A 103 -3.061 8.754 0.367 1.00 0.00 C ATOM 1540 CD1 PHE A 103 -3.828 8.188 -0.603 1.00 0.00 C ATOM 1541 CD2 PHE A 103 -2.298 7.969 1.175 1.00 0.00 C ATOM 1542 CE1 PHE A 103 -3.833 6.778 -0.772 1.00 0.00 C ATOM 1543 CE2 PHE A 103 -2.303 6.559 1.005 1.00 0.00 C ATOM 1544 CZ PHE A 103 -3.071 5.993 0.035 1.00 0.00 C ATOM 0 H PHE A 103 -0.537 10.776 0.554 1.00 0.00 H new ATOM 0 HA PHE A 103 -2.644 10.749 -1.543 1.00 0.00 H new ATOM 0 HB2 PHE A 103 -2.607 10.511 1.515 1.00 0.00 H new ATOM 0 HB3 PHE A 103 -4.085 10.629 0.580 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -4.433 8.811 -1.245 1.00 0.00 H new ATOM 0 HD2 PHE A 103 -1.689 8.418 1.945 1.00 0.00 H new ATOM 0 HE1 PHE A 103 -4.443 6.329 -1.542 1.00 0.00 H new ATOM 0 HE2 PHE A 103 -1.697 5.936 1.646 1.00 0.00 H new ATOM 0 HZ PHE A 103 -3.075 4.921 -0.094 1.00 0.00 H new ATOM 1554 N GLY A 104 -2.798 13.192 -1.486 1.00 0.00 N ATOM 1555 CA GLY A 104 -3.042 14.624 -1.467 1.00 0.00 C ATOM 1556 C GLY A 104 -1.765 15.393 -1.125 1.00 0.00 C ATOM 1557 O GLY A 104 -1.817 16.422 -0.453 1.00 0.00 O ATOM 0 H GLY A 104 -2.847 12.763 -2.410 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -3.415 14.946 -2.439 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -3.817 14.855 -0.736 1.00 0.00 H new ATOM 1561 N THR A 105 -0.648 14.865 -1.604 1.00 0.00 N ATOM 1562 CA THR A 105 0.641 15.490 -1.358 1.00 0.00 C ATOM 1563 C THR A 105 0.692 16.066 0.059 1.00 0.00 C ATOM 1564 O THR A 105 0.950 17.255 0.240 1.00 0.00 O ATOM 1565 CB THR A 105 0.875 16.537 -2.448 1.00 0.00 C ATOM 1566 OG1 THR A 105 -0.346 17.270 -2.494 1.00 0.00 O ATOM 1567 CG2 THR A 105 0.989 15.915 -3.842 1.00 0.00 C ATOM 0 H THR A 105 -0.609 14.012 -2.161 1.00 0.00 H new ATOM 0 HA THR A 105 1.450 14.761 -1.409 1.00 0.00 H new ATOM 0 HB THR A 105 1.783 17.097 -2.224 1.00 0.00 H new ATOM 0 HG1 THR A 105 -0.581 17.571 -1.591 1.00 0.00 H new ATOM 0 HG21 THR A 105 1.155 16.701 -4.579 1.00 0.00 H new ATOM 0 HG22 THR A 105 1.826 15.217 -3.862 1.00 0.00 H new ATOM 0 HG23 THR A 105 0.068 15.383 -4.080 1.00 0.00 H new ATOM 1575 N SER A 106 0.442 15.196 1.026 1.00 0.00 N ATOM 1576 CA SER A 106 0.457 15.604 2.421 1.00 0.00 C ATOM 1577 C SER A 106 0.473 14.370 3.326 1.00 0.00 C ATOM 1578 O SER A 106 1.220 14.322 4.303 1.00 0.00 O ATOM 1579 CB SER A 106 -0.749 16.487 2.749 1.00 0.00 C ATOM 1580 OG SER A 106 -1.983 15.815 2.513 1.00 0.00 O ATOM 0 H SER A 106 0.228 14.211 0.872 1.00 0.00 H new ATOM 0 HA SER A 106 1.360 16.188 2.598 1.00 0.00 H new ATOM 0 HB2 SER A 106 -0.699 16.796 3.793 1.00 0.00 H new ATOM 0 HB3 SER A 106 -0.709 17.394 2.146 1.00 0.00 H new ATOM 0 HG SER A 106 -2.200 15.856 1.558 1.00 0.00 H new ATOM 1586 N HIS A 107 -0.360 13.403 2.970 1.00 0.00 N ATOM 1587 CA HIS A 107 -0.450 12.173 3.739 1.00 0.00 C ATOM 1588 C HIS A 107 0.340 11.069 3.034 1.00 0.00 C ATOM 1589 O HIS A 107 -0.186 10.390 2.153 1.00 0.00 O ATOM 1590 CB HIS A 107 -1.911 11.792 3.984 1.00 0.00 C ATOM 1591 CG HIS A 107 -2.588 12.614 5.056 1.00 0.00 C ATOM 1592 ND1 HIS A 107 -2.513 12.299 6.401 1.00 0.00 N ATOM 1593 CD2 HIS A 107 -3.352 13.740 4.966 1.00 0.00 C ATOM 1594 CE1 HIS A 107 -3.204 13.201 7.082 1.00 0.00 C ATOM 1595 NE2 HIS A 107 -3.724 14.094 6.190 1.00 0.00 N ATOM 0 H HIS A 107 -0.978 13.446 2.160 1.00 0.00 H new ATOM 0 HA HIS A 107 -0.004 12.321 4.722 1.00 0.00 H new ATOM 0 HB2 HIS A 107 -2.466 11.901 3.052 1.00 0.00 H new ATOM 0 HB3 HIS A 107 -1.960 10.739 4.262 1.00 0.00 H new ATOM 0 HD2 HIS A 107 -3.611 14.256 4.053 1.00 0.00 H new ATOM 0 HE1 HIS A 107 -3.333 13.226 8.154 1.00 0.00 H new ATOM 0 HE2 HIS A 107 -4.303 14.900 6.425 1.00 0.00 H new ATOM 1603 N VAL A 108 1.590 10.922 3.448 1.00 0.00 N ATOM 1604 CA VAL A 108 2.457 9.912 2.868 1.00 0.00 C ATOM 1605 C VAL A 108 2.472 8.678 3.772 1.00 0.00 C ATOM 1606 O VAL A 108 2.578 8.799 4.992 1.00 0.00 O ATOM 1607 CB VAL A 108 3.852 10.494 2.628 1.00 0.00 C ATOM 1608 CG1 VAL A 108 4.865 9.387 2.335 1.00 0.00 C ATOM 1609 CG2 VAL A 108 3.827 11.528 1.500 1.00 0.00 C ATOM 0 H VAL A 108 2.023 11.486 4.179 1.00 0.00 H new ATOM 0 HA VAL A 108 2.079 9.598 1.895 1.00 0.00 H new ATOM 0 HB VAL A 108 4.166 11.001 3.541 1.00 0.00 H new ATOM 0 HG11 VAL A 108 5.848 9.828 2.168 1.00 0.00 H new ATOM 0 HG12 VAL A 108 4.913 8.704 3.183 1.00 0.00 H new ATOM 0 HG13 VAL A 108 4.558 8.839 1.444 1.00 0.00 H new ATOM 0 HG21 VAL A 108 4.830 11.926 1.349 1.00 0.00 H new ATOM 0 HG22 VAL A 108 3.482 11.055 0.580 1.00 0.00 H new ATOM 0 HG23 VAL A 108 3.150 12.340 1.766 1.00 0.00 H new ATOM 1619 N PHE A 109 2.365 7.519 3.140 1.00 0.00 N ATOM 1620 CA PHE A 109 2.365 6.264 3.873 1.00 0.00 C ATOM 1621 C PHE A 109 3.268 5.232 3.194 1.00 0.00 C ATOM 1622 O PHE A 109 3.505 5.306 1.989 1.00 0.00 O ATOM 1623 CB PHE A 109 0.926 5.744 3.870 1.00 0.00 C ATOM 1624 CG PHE A 109 0.021 6.415 4.905 1.00 0.00 C ATOM 1625 CD1 PHE A 109 -0.298 7.731 4.780 1.00 0.00 C ATOM 1626 CD2 PHE A 109 -0.466 5.694 5.952 1.00 0.00 C ATOM 1627 CE1 PHE A 109 -1.138 8.353 5.740 1.00 0.00 C ATOM 1628 CE2 PHE A 109 -1.306 6.316 6.912 1.00 0.00 C ATOM 1629 CZ PHE A 109 -1.625 7.632 6.786 1.00 0.00 C ATOM 0 H PHE A 109 2.278 7.422 2.128 1.00 0.00 H new ATOM 0 HA PHE A 109 2.738 6.425 4.885 1.00 0.00 H new ATOM 0 HB2 PHE A 109 0.499 5.892 2.878 1.00 0.00 H new ATOM 0 HB3 PHE A 109 0.938 4.670 4.055 1.00 0.00 H new ATOM 0 HD1 PHE A 109 0.088 8.303 3.949 1.00 0.00 H new ATOM 0 HD2 PHE A 109 -0.213 4.649 6.052 1.00 0.00 H new ATOM 0 HE1 PHE A 109 -1.391 9.398 5.640 1.00 0.00 H new ATOM 0 HE2 PHE A 109 -1.692 5.744 7.743 1.00 0.00 H new ATOM 0 HZ PHE A 109 -2.265 8.105 7.516 1.00 0.00 H new ATOM 1639 N LYS A 110 3.749 4.294 3.996 1.00 0.00 N ATOM 1640 CA LYS A 110 4.621 3.249 3.488 1.00 0.00 C ATOM 1641 C LYS A 110 3.955 1.888 3.698 1.00 0.00 C ATOM 1642 O LYS A 110 3.673 1.499 4.831 1.00 0.00 O ATOM 1643 CB LYS A 110 6.011 3.357 4.118 1.00 0.00 C ATOM 1644 CG LYS A 110 6.926 2.234 3.625 1.00 0.00 C ATOM 1645 CD LYS A 110 7.343 1.321 4.779 1.00 0.00 C ATOM 1646 CE LYS A 110 8.666 1.783 5.393 1.00 0.00 C ATOM 1647 NZ LYS A 110 8.782 1.308 6.790 1.00 0.00 N ATOM 0 H LYS A 110 3.551 4.236 4.995 1.00 0.00 H new ATOM 0 HA LYS A 110 4.773 3.368 2.415 1.00 0.00 H new ATOM 0 HB2 LYS A 110 6.451 4.324 3.873 1.00 0.00 H new ATOM 0 HB3 LYS A 110 5.926 3.312 5.204 1.00 0.00 H new ATOM 0 HG2 LYS A 110 6.412 1.650 2.862 1.00 0.00 H new ATOM 0 HG3 LYS A 110 7.812 2.661 3.156 1.00 0.00 H new ATOM 0 HD2 LYS A 110 6.565 1.316 5.543 1.00 0.00 H new ATOM 0 HD3 LYS A 110 7.443 0.297 4.419 1.00 0.00 H new ATOM 0 HE2 LYS A 110 9.500 1.403 4.803 1.00 0.00 H new ATOM 0 HE3 LYS A 110 8.726 2.871 5.366 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 9.784 1.291 7.069 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 8.258 1.949 7.419 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 8.385 0.350 6.865 1.00 0.00 H new ATOM 1661 N PHE A 111 3.723 1.201 2.589 1.00 0.00 N ATOM 1662 CA PHE A 111 3.095 -0.109 2.638 1.00 0.00 C ATOM 1663 C PHE A 111 4.138 -1.209 2.850 1.00 0.00 C ATOM 1664 O PHE A 111 5.175 -1.222 2.190 1.00 0.00 O ATOM 1665 CB PHE A 111 2.409 -0.327 1.288 1.00 0.00 C ATOM 1666 CG PHE A 111 1.903 -1.754 1.070 1.00 0.00 C ATOM 1667 CD1 PHE A 111 2.790 -2.768 0.884 1.00 0.00 C ATOM 1668 CD2 PHE A 111 0.567 -2.008 1.063 1.00 0.00 C ATOM 1669 CE1 PHE A 111 2.320 -4.093 0.681 1.00 0.00 C ATOM 1670 CE2 PHE A 111 0.098 -3.333 0.860 1.00 0.00 C ATOM 1671 CZ PHE A 111 0.984 -4.348 0.674 1.00 0.00 C ATOM 0 H PHE A 111 3.958 1.527 1.651 1.00 0.00 H new ATOM 0 HA PHE A 111 2.387 -0.152 3.466 1.00 0.00 H new ATOM 0 HB2 PHE A 111 1.569 0.362 1.204 1.00 0.00 H new ATOM 0 HB3 PHE A 111 3.109 -0.075 0.491 1.00 0.00 H new ATOM 0 HD1 PHE A 111 3.851 -2.566 0.891 1.00 0.00 H new ATOM 0 HD2 PHE A 111 -0.137 -1.203 1.212 1.00 0.00 H new ATOM 0 HE1 PHE A 111 3.024 -4.898 0.532 1.00 0.00 H new ATOM 0 HE2 PHE A 111 -0.963 -3.535 0.853 1.00 0.00 H new ATOM 0 HZ PHE A 111 0.627 -5.356 0.521 1.00 0.00 H new ATOM 1681 N VAL A 112 3.825 -2.105 3.774 1.00 0.00 N ATOM 1682 CA VAL A 112 4.722 -3.207 4.082 1.00 0.00 C ATOM 1683 C VAL A 112 3.926 -4.513 4.115 1.00 0.00 C ATOM 1684 O VAL A 112 2.782 -4.535 4.568 1.00 0.00 O ATOM 1685 CB VAL A 112 5.466 -2.927 5.389 1.00 0.00 C ATOM 1686 CG1 VAL A 112 6.031 -4.217 5.985 1.00 0.00 C ATOM 1687 CG2 VAL A 112 6.571 -1.889 5.180 1.00 0.00 C ATOM 0 H VAL A 112 2.963 -2.091 4.320 1.00 0.00 H new ATOM 0 HA VAL A 112 5.482 -3.309 3.307 1.00 0.00 H new ATOM 0 HB VAL A 112 4.750 -2.515 6.100 1.00 0.00 H new ATOM 0 HG11 VAL A 112 6.555 -3.990 6.913 1.00 0.00 H new ATOM 0 HG12 VAL A 112 5.216 -4.911 6.189 1.00 0.00 H new ATOM 0 HG13 VAL A 112 6.726 -4.671 5.278 1.00 0.00 H new ATOM 0 HG21 VAL A 112 7.084 -1.708 6.125 1.00 0.00 H new ATOM 0 HG22 VAL A 112 7.285 -2.260 4.445 1.00 0.00 H new ATOM 0 HG23 VAL A 112 6.132 -0.958 4.822 1.00 0.00 H new ATOM 1697 N ASP A 113 4.562 -5.569 3.630 1.00 0.00 N ATOM 1698 CA ASP A 113 3.927 -6.876 3.598 1.00 0.00 C ATOM 1699 C ASP A 113 4.657 -7.816 4.560 1.00 0.00 C ATOM 1700 O ASP A 113 5.754 -8.285 4.262 1.00 0.00 O ATOM 1701 CB ASP A 113 3.994 -7.487 2.197 1.00 0.00 C ATOM 1702 CG ASP A 113 3.651 -8.976 2.125 1.00 0.00 C ATOM 1703 OD1 ASP A 113 2.532 -9.322 2.561 1.00 0.00 O ATOM 1704 OD2 ASP A 113 4.515 -9.735 1.634 1.00 0.00 O ATOM 0 H ASP A 113 5.511 -5.546 3.256 1.00 0.00 H new ATOM 0 HA ASP A 113 2.883 -6.751 3.887 1.00 0.00 H new ATOM 0 HB2 ASP A 113 3.312 -6.940 1.545 1.00 0.00 H new ATOM 0 HB3 ASP A 113 4.999 -7.341 1.801 1.00 0.00 H new ATOM 1709 N PRO A 114 4.001 -8.069 5.724 1.00 0.00 N ATOM 1710 CA PRO A 114 4.576 -8.945 6.731 1.00 0.00 C ATOM 1711 C PRO A 114 4.466 -10.411 6.310 1.00 0.00 C ATOM 1712 O PRO A 114 5.102 -11.281 6.904 1.00 0.00 O ATOM 1713 CB PRO A 114 3.810 -8.634 8.007 1.00 0.00 C ATOM 1714 CG PRO A 114 2.531 -7.939 7.566 1.00 0.00 C ATOM 1715 CD PRO A 114 2.701 -7.531 6.111 1.00 0.00 C ATOM 0 HA PRO A 114 5.644 -8.779 6.873 1.00 0.00 H new ATOM 0 HB2 PRO A 114 3.588 -9.546 8.561 1.00 0.00 H new ATOM 0 HB3 PRO A 114 4.395 -7.994 8.668 1.00 0.00 H new ATOM 0 HG2 PRO A 114 1.676 -8.606 7.678 1.00 0.00 H new ATOM 0 HG3 PRO A 114 2.338 -7.065 8.188 1.00 0.00 H new ATOM 0 HD2 PRO A 114 1.903 -7.938 5.490 1.00 0.00 H new ATOM 0 HD3 PRO A 114 2.671 -6.447 5.998 1.00 0.00 H new ATOM 1723 N SER A 115 3.655 -10.641 5.288 1.00 0.00 N ATOM 1724 CA SER A 115 3.454 -11.988 4.780 1.00 0.00 C ATOM 1725 C SER A 115 4.781 -12.564 4.285 1.00 0.00 C ATOM 1726 O SER A 115 5.134 -13.694 4.617 1.00 0.00 O ATOM 1727 CB SER A 115 2.416 -12.003 3.656 1.00 0.00 C ATOM 1728 OG SER A 115 1.749 -13.259 3.562 1.00 0.00 O ATOM 0 H SER A 115 3.129 -9.917 4.798 1.00 0.00 H new ATOM 0 HA SER A 115 3.078 -12.608 5.594 1.00 0.00 H new ATOM 0 HB2 SER A 115 1.683 -11.215 3.829 1.00 0.00 H new ATOM 0 HB3 SER A 115 2.905 -11.780 2.708 1.00 0.00 H new ATOM 0 HG SER A 115 1.093 -13.228 2.834 1.00 0.00 H new ATOM 1734 N GLY A 116 5.481 -11.760 3.497 1.00 0.00 N ATOM 1735 CA GLY A 116 6.762 -12.176 2.952 1.00 0.00 C ATOM 1736 C GLY A 116 6.753 -12.118 1.423 1.00 0.00 C ATOM 1737 O GLY A 116 5.740 -12.418 0.793 1.00 0.00 O ATOM 0 H GLY A 116 5.185 -10.823 3.223 1.00 0.00 H new ATOM 0 HA2 GLY A 116 7.552 -11.532 3.339 1.00 0.00 H new ATOM 0 HA3 GLY A 116 6.988 -13.191 3.280 1.00 0.00 H new ATOM 1741 N PRO A 117 7.923 -11.720 0.856 1.00 0.00 N ATOM 1742 CA PRO A 117 8.058 -11.619 -0.588 1.00 0.00 C ATOM 1743 C PRO A 117 8.180 -13.004 -1.225 1.00 0.00 C ATOM 1744 O PRO A 117 9.253 -13.385 -1.691 1.00 0.00 O ATOM 1745 CB PRO A 117 9.288 -10.754 -0.807 1.00 0.00 C ATOM 1746 CG PRO A 117 10.061 -10.788 0.501 1.00 0.00 C ATOM 1747 CD PRO A 117 9.143 -11.357 1.570 1.00 0.00 C ATOM 0 HA PRO A 117 7.184 -11.174 -1.063 1.00 0.00 H new ATOM 0 HB2 PRO A 117 9.894 -11.137 -1.628 1.00 0.00 H new ATOM 0 HB3 PRO A 117 9.006 -9.734 -1.068 1.00 0.00 H new ATOM 0 HG2 PRO A 117 10.956 -11.402 0.400 1.00 0.00 H new ATOM 0 HG3 PRO A 117 10.391 -9.786 0.775 1.00 0.00 H new ATOM 0 HD2 PRO A 117 9.591 -12.224 2.056 1.00 0.00 H new ATOM 0 HD3 PRO A 117 8.942 -10.623 2.350 1.00 0.00 H new ATOM 1755 N SER A 118 7.066 -13.721 -1.226 1.00 0.00 N ATOM 1756 CA SER A 118 7.034 -15.056 -1.799 1.00 0.00 C ATOM 1757 C SER A 118 8.163 -15.904 -1.210 1.00 0.00 C ATOM 1758 O SER A 118 9.260 -15.956 -1.765 1.00 0.00 O ATOM 1759 CB SER A 118 7.149 -15.003 -3.324 1.00 0.00 C ATOM 1760 OG SER A 118 6.520 -16.121 -3.945 1.00 0.00 O ATOM 0 H SER A 118 6.178 -13.402 -0.839 1.00 0.00 H new ATOM 0 HA SER A 118 6.077 -15.514 -1.550 1.00 0.00 H new ATOM 0 HB2 SER A 118 6.695 -14.082 -3.690 1.00 0.00 H new ATOM 0 HB3 SER A 118 8.201 -14.975 -3.608 1.00 0.00 H new ATOM 0 HG SER A 118 6.613 -16.050 -4.918 1.00 0.00 H new ATOM 1766 N SER A 119 7.856 -16.549 -0.094 1.00 0.00 N ATOM 1767 CA SER A 119 8.831 -17.393 0.575 1.00 0.00 C ATOM 1768 C SER A 119 10.003 -16.545 1.072 1.00 0.00 C ATOM 1769 O SER A 119 10.410 -15.592 0.408 1.00 0.00 O ATOM 1770 CB SER A 119 9.332 -18.500 -0.354 1.00 0.00 C ATOM 1771 OG SER A 119 9.648 -19.693 0.358 1.00 0.00 O ATOM 0 H SER A 119 6.946 -16.504 0.364 1.00 0.00 H new ATOM 0 HA SER A 119 8.345 -17.866 1.429 1.00 0.00 H new ATOM 0 HB2 SER A 119 8.571 -18.716 -1.104 1.00 0.00 H new ATOM 0 HB3 SER A 119 10.216 -18.152 -0.889 1.00 0.00 H new ATOM 0 HG SER A 119 9.962 -20.376 -0.271 1.00 0.00 H new ATOM 1777 N GLY A 120 10.514 -16.922 2.235 1.00 0.00 N ATOM 1778 CA GLY A 120 11.632 -16.208 2.827 1.00 0.00 C ATOM 1779 C GLY A 120 11.467 -16.093 4.344 1.00 0.00 C ATOM 1780 O GLY A 120 11.769 -17.032 5.078 1.00 0.00 O ATOM 0 H GLY A 120 10.174 -17.712 2.783 1.00 0.00 H new ATOM 0 HA2 GLY A 120 12.563 -16.727 2.597 1.00 0.00 H new ATOM 0 HA3 GLY A 120 11.706 -15.213 2.389 1.00 0.00 H new TER 1784 GLY A 120