USER MOD reduce.3.24.130724 H: found=0, std=0, add=998, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 998 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 22 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 45 LYS NZ :NH3+ -166:sc= -1.7! (180deg=-3.86!) USER MOD Set 2.2: A 73 THR OG1 : rot -139:sc= 0.698 USER MOD Set 3.1: A 49 HIS : +bothHN:sc= -1.25 K(o=0.15,f=-11!) USER MOD Set 3.2: A 63 SER OG : rot -34:sc= 1.4 USER MOD Set 4.1: A 47 THR OG1 : rot -169:sc= 0.679 USER MOD Set 4.2: A 71 GLN : amide:sc= 0.772 K(o=1.5,f=0.41) USER MOD Set 5.1: A 21 SER OG : rot -131:sc= 1.22 USER MOD Set 5.2: A 23 SER OG : rot 180:sc= 0.98 USER MOD Single : A 1 MET CE :methyl 164:sc= -0.0349 (180deg=-0.363) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 HIS : no HD1:sc= 0 X(o=0,f=-0.0089) USER MOD Single : A 4 HIS : no HD1:sc= 0 X(o=0,f=-6.6e-05) USER MOD Single : A 5 HIS : no HD1:sc= 0 X(o=0,f=-0.042) USER MOD Single : A 6 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 7 HIS : no HD1:sc= -0.0218 X(o=-0.022,f=-0.067) USER MOD Single : A 8 HIS : no HD1:sc= -0.0672 X(o=-0.067,f=-0.075) USER MOD Single : A 9 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 15 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 16 THR OG1 : rot 180:sc= 0.0249 USER MOD Single : A 17 GLN : amide:sc= -0.272 X(o=-0.27,f=-0.28) USER MOD Single : A 25 GLN : amide:sc= 0.908 K(o=0.91,f=-0.41) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ -172:sc= 1.27 (180deg=1.2) USER MOD Single : A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 38 THR OG1 : rot -139:sc= -3.62! USER MOD Single : A 39 LYS NZ :NH3+ 166:sc= -0.0456 (180deg=-0.31) USER MOD Single : A 41 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00855) USER MOD Single : A 59 GLN : amide:sc= -0.0189 K(o=-0.019,f=-1.3) USER MOD Single : A 62 SER OG : rot 34:sc= 0.256 USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 68 LYS NZ :NH3+ -135:sc= -1.45 (180deg=-3.64!) USER MOD Single : A 81 LYS NZ :NH3+ 169:sc= -0.0088 (180deg=-0.134) USER MOD Single : A 85 GLN : amide:sc= 0.0207 X(o=0.021,f=0) USER MOD Single : A 89 THR OG1 : rot -32:sc= 0.236 USER MOD Single : A 90 MET CE :methyl 177:sc= -2.87! (180deg=-3!) USER MOD Single : A 91 THR OG1 : rot -53:sc= 0.626 USER MOD Single : A 95 LYS NZ :NH3+ 165:sc= 1.1 (180deg=0.514) USER MOD Single : A 99 THR OG1 : rot 66:sc= -0.476 USER MOD Single : A 102 TYR OH : rot 180:sc= 0 USER MOD Single : A 103 GLN :FLIP amide:sc= 0 F(o=-0.84,f=0) USER MOD Single : A 106 TYR OH : rot 180:sc= 0 USER MOD Single : A 111 TYR OH : rot 180:sc= 0 USER MOD Single : A 120 THR OG1 : rot 151:sc= 0.51 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 3.752 -19.132 15.799 1.00 3.40 N ATOM 2 CA MET A 1 3.868 -20.607 15.722 1.00 10.21 C ATOM 3 C MET A 1 2.647 -21.192 15.022 1.00 31.33 C ATOM 4 O MET A 1 1.592 -21.364 15.638 1.00 3.30 O ATOM 5 CB MET A 1 4.010 -21.215 17.129 1.00 73.31 C ATOM 6 CG MET A 1 4.189 -22.731 17.129 1.00 65.15 C ATOM 7 SD MET A 1 4.356 -23.432 18.787 1.00 4.42 S ATOM 8 CE MET A 1 2.731 -23.103 19.466 1.00 65.21 C ATOM 0 H1 MET A 1 4.589 -18.742 16.278 1.00 3.40 H new ATOM 0 H2 MET A 1 3.688 -18.738 14.839 1.00 3.40 H new ATOM 0 H3 MET A 1 2.897 -18.878 16.335 1.00 3.40 H new ATOM 0 HA MET A 1 4.761 -20.853 15.147 1.00 10.21 H new ATOM 0 HB2 MET A 1 4.864 -20.757 17.628 1.00 73.31 H new ATOM 0 HB3 MET A 1 3.126 -20.963 17.715 1.00 73.31 H new ATOM 0 HG2 MET A 1 3.335 -23.191 16.632 1.00 65.15 H new ATOM 0 HG3 MET A 1 5.073 -22.985 16.544 1.00 65.15 H new ATOM 0 HE1 MET A 1 2.579 -23.712 20.357 1.00 65.21 H new ATOM 0 HE2 MET A 1 2.654 -22.048 19.730 1.00 65.21 H new ATOM 0 HE3 MET A 1 1.970 -23.348 18.725 1.00 65.21 H new ATOM 20 N ALA A 2 2.791 -21.467 13.730 1.00 11.55 N ATOM 21 CA ALA A 2 1.723 -22.048 12.926 1.00 5.04 C ATOM 22 C ALA A 2 2.315 -22.931 11.833 1.00 60.10 C ATOM 23 O ALA A 2 3.514 -22.860 11.546 1.00 53.10 O ATOM 24 CB ALA A 2 0.853 -20.948 12.320 1.00 52.24 C ATOM 0 H ALA A 2 3.652 -21.293 13.211 1.00 11.55 H new ATOM 0 HA ALA A 2 1.093 -22.664 13.568 1.00 5.04 H new ATOM 0 HB1 ALA A 2 0.060 -21.399 11.723 1.00 52.24 H new ATOM 0 HB2 ALA A 2 0.411 -20.352 13.119 1.00 52.24 H new ATOM 0 HB3 ALA A 2 1.466 -20.307 11.686 1.00 52.24 H new ATOM 30 N HIS A 3 1.479 -23.763 11.233 1.00 21.32 N ATOM 31 CA HIS A 3 1.919 -24.654 10.167 1.00 71.41 C ATOM 32 C HIS A 3 1.846 -23.952 8.816 1.00 74.23 C ATOM 33 O HIS A 3 0.912 -23.197 8.545 1.00 21.43 O ATOM 34 CB HIS A 3 1.068 -25.932 10.132 1.00 10.53 C ATOM 35 CG HIS A 3 1.302 -26.856 11.288 1.00 12.00 C ATOM 36 ND1 HIS A 3 0.295 -27.282 12.121 1.00 64.50 N ATOM 37 CD2 HIS A 3 2.430 -27.464 11.722 1.00 70.35 C ATOM 38 CE1 HIS A 3 0.790 -28.111 13.020 1.00 44.42 C ATOM 39 NE2 HIS A 3 2.086 -28.239 12.801 1.00 50.14 N ATOM 0 H HIS A 3 0.489 -23.841 11.466 1.00 21.32 H new ATOM 0 HA HIS A 3 2.954 -24.929 10.370 1.00 71.41 H new ATOM 0 HB2 HIS A 3 0.014 -25.653 10.111 1.00 10.53 H new ATOM 0 HB3 HIS A 3 1.274 -26.468 9.205 1.00 10.53 H new ATOM 0 HD2 HIS A 3 3.418 -27.359 11.298 1.00 70.35 H new ATOM 0 HE1 HIS A 3 0.230 -28.602 13.802 1.00 44.42 H new ATOM 0 HE2 HIS A 3 2.726 -28.818 13.344 1.00 50.14 H new ATOM 48 N HIS A 4 2.837 -24.206 7.976 1.00 41.44 N ATOM 49 CA HIS A 4 2.854 -23.702 6.607 1.00 61.42 C ATOM 50 C HIS A 4 2.906 -24.886 5.650 1.00 34.24 C ATOM 51 O HIS A 4 3.743 -24.942 4.745 1.00 73.23 O ATOM 52 CB HIS A 4 4.058 -22.770 6.382 1.00 70.34 C ATOM 53 CG HIS A 4 3.988 -21.492 7.161 1.00 12.14 C ATOM 54 ND1 HIS A 4 4.919 -21.131 8.111 1.00 24.54 N ATOM 55 CD2 HIS A 4 3.090 -20.480 7.116 1.00 32.52 C ATOM 56 CE1 HIS A 4 4.596 -19.955 8.616 1.00 45.00 C ATOM 57 NE2 HIS A 4 3.493 -19.542 8.029 1.00 44.43 N ATOM 0 H HIS A 4 3.653 -24.767 8.221 1.00 41.44 H new ATOM 0 HA HIS A 4 1.950 -23.121 6.423 1.00 61.42 H new ATOM 0 HB2 HIS A 4 4.971 -23.300 6.653 1.00 70.34 H new ATOM 0 HB3 HIS A 4 4.129 -22.534 5.320 1.00 70.34 H new ATOM 0 HD2 HIS A 4 2.219 -20.423 6.480 1.00 32.52 H new ATOM 0 HE1 HIS A 4 5.143 -19.423 9.380 1.00 45.00 H new ATOM 0 HE2 HIS A 4 3.014 -18.663 8.223 1.00 44.43 H new ATOM 66 N HIS A 5 1.998 -25.837 5.865 1.00 33.34 N ATOM 67 CA HIS A 5 1.966 -27.072 5.088 1.00 30.04 C ATOM 68 C HIS A 5 1.479 -26.794 3.668 1.00 71.42 C ATOM 69 O HIS A 5 1.618 -27.631 2.776 1.00 43.00 O ATOM 70 CB HIS A 5 1.077 -28.116 5.782 1.00 43.53 C ATOM 71 CG HIS A 5 1.389 -29.528 5.382 1.00 2.34 C ATOM 72 ND1 HIS A 5 2.598 -30.130 5.658 1.00 73.32 N ATOM 73 CD2 HIS A 5 0.648 -30.458 4.735 1.00 13.00 C ATOM 74 CE1 HIS A 5 2.587 -31.364 5.198 1.00 45.42 C ATOM 75 NE2 HIS A 5 1.416 -31.594 4.635 1.00 75.32 N ATOM 0 H HIS A 5 1.270 -25.773 6.577 1.00 33.34 H new ATOM 0 HA HIS A 5 2.977 -27.475 5.026 1.00 30.04 H new ATOM 0 HB2 HIS A 5 1.191 -28.019 6.862 1.00 43.53 H new ATOM 0 HB3 HIS A 5 0.033 -27.904 5.551 1.00 43.53 H new ATOM 0 HD2 HIS A 5 -0.359 -30.331 4.366 1.00 13.00 H new ATOM 0 HE1 HIS A 5 3.401 -32.070 5.270 1.00 45.42 H new ATOM 0 HE2 HIS A 5 1.128 -32.470 4.198 1.00 75.32 H new ATOM 84 N HIS A 6 0.893 -25.614 3.474 1.00 63.13 N ATOM 85 CA HIS A 6 0.547 -25.116 2.144 1.00 11.21 C ATOM 86 C HIS A 6 1.516 -23.996 1.774 1.00 65.13 C ATOM 87 O HIS A 6 2.118 -23.382 2.656 1.00 22.35 O ATOM 88 CB HIS A 6 -0.897 -24.598 2.108 1.00 13.32 C ATOM 89 CG HIS A 6 -1.927 -25.659 2.368 1.00 73.33 C ATOM 90 ND1 HIS A 6 -2.613 -26.306 1.363 1.00 11.11 N ATOM 91 CD2 HIS A 6 -2.386 -26.189 3.529 1.00 2.41 C ATOM 92 CE1 HIS A 6 -3.445 -27.184 1.891 1.00 15.55 C ATOM 93 NE2 HIS A 6 -3.326 -27.134 3.204 1.00 40.03 N ATOM 0 H HIS A 6 0.645 -24.978 4.232 1.00 63.13 H new ATOM 0 HA HIS A 6 0.625 -25.932 1.425 1.00 11.21 H new ATOM 0 HB2 HIS A 6 -1.008 -23.807 2.850 1.00 13.32 H new ATOM 0 HB3 HIS A 6 -1.088 -24.150 1.133 1.00 13.32 H new ATOM 0 HD2 HIS A 6 -2.070 -25.917 4.525 1.00 2.41 H new ATOM 0 HE1 HIS A 6 -4.110 -27.833 1.341 1.00 15.55 H new ATOM 0 HE2 HIS A 6 -3.848 -27.705 3.869 1.00 40.03 H new ATOM 102 N HIS A 7 1.677 -23.727 0.484 1.00 35.24 N ATOM 103 CA HIS A 7 2.627 -22.711 0.029 1.00 21.22 C ATOM 104 C HIS A 7 2.008 -21.852 -1.068 1.00 62.14 C ATOM 105 O HIS A 7 1.131 -22.307 -1.804 1.00 65.32 O ATOM 106 CB HIS A 7 3.928 -23.365 -0.460 1.00 40.00 C ATOM 107 CG HIS A 7 4.655 -24.123 0.614 1.00 5.42 C ATOM 108 ND1 HIS A 7 4.919 -25.472 0.539 1.00 32.01 N ATOM 109 CD2 HIS A 7 5.159 -23.711 1.803 1.00 63.42 C ATOM 110 CE1 HIS A 7 5.551 -25.859 1.633 1.00 15.31 C ATOM 111 NE2 HIS A 7 5.711 -24.809 2.417 1.00 2.11 N ATOM 0 H HIS A 7 1.166 -24.194 -0.265 1.00 35.24 H new ATOM 0 HA HIS A 7 2.869 -22.065 0.873 1.00 21.22 H new ATOM 0 HB2 HIS A 7 3.698 -24.044 -1.281 1.00 40.00 H new ATOM 0 HB3 HIS A 7 4.586 -22.593 -0.859 1.00 40.00 H new ATOM 0 HD2 HIS A 7 5.132 -22.705 2.195 1.00 63.42 H new ATOM 0 HE1 HIS A 7 5.881 -26.864 1.849 1.00 15.31 H new ATOM 0 HE2 HIS A 7 6.169 -24.812 3.328 1.00 2.11 H new ATOM 120 N HIS A 8 2.462 -20.604 -1.160 1.00 54.52 N ATOM 121 CA HIS A 8 1.897 -19.640 -2.105 1.00 71.42 C ATOM 122 C HIS A 8 2.698 -19.602 -3.405 1.00 60.23 C ATOM 123 O HIS A 8 3.929 -19.710 -3.396 1.00 64.12 O ATOM 124 CB HIS A 8 1.847 -18.239 -1.472 1.00 2.44 C ATOM 125 CG HIS A 8 3.190 -17.682 -1.094 1.00 43.31 C ATOM 126 ND1 HIS A 8 3.703 -17.758 0.183 1.00 41.21 N ATOM 127 CD2 HIS A 8 4.124 -17.034 -1.832 1.00 73.24 C ATOM 128 CE1 HIS A 8 4.888 -17.179 0.215 1.00 22.34 C ATOM 129 NE2 HIS A 8 5.166 -16.733 -0.995 1.00 54.34 N ATOM 0 H HIS A 8 3.223 -20.234 -0.590 1.00 54.52 H new ATOM 0 HA HIS A 8 0.883 -19.960 -2.343 1.00 71.42 H new ATOM 0 HB2 HIS A 8 1.367 -17.554 -2.171 1.00 2.44 H new ATOM 0 HB3 HIS A 8 1.219 -18.278 -0.582 1.00 2.44 H new ATOM 0 HD2 HIS A 8 4.059 -16.799 -2.884 1.00 73.24 H new ATOM 0 HE1 HIS A 8 5.523 -17.086 1.084 1.00 22.34 H new ATOM 0 HE2 HIS A 8 6.019 -16.243 -1.264 1.00 54.34 H new ATOM 138 N MET A 9 1.989 -19.449 -4.518 1.00 34.13 N ATOM 139 CA MET A 9 2.600 -19.328 -5.838 1.00 52.34 C ATOM 140 C MET A 9 1.547 -18.845 -6.837 1.00 10.22 C ATOM 141 O MET A 9 0.499 -19.474 -6.998 1.00 4.13 O ATOM 142 CB MET A 9 3.219 -20.663 -6.295 1.00 35.21 C ATOM 143 CG MET A 9 2.238 -21.826 -6.369 1.00 10.04 C ATOM 144 SD MET A 9 3.016 -23.351 -6.942 1.00 4.34 S ATOM 145 CE MET A 9 1.610 -24.463 -6.970 1.00 21.11 C ATOM 0 H MET A 9 0.970 -19.405 -4.531 1.00 34.13 H new ATOM 0 HA MET A 9 3.410 -18.600 -5.786 1.00 52.34 H new ATOM 0 HB2 MET A 9 3.669 -20.522 -7.278 1.00 35.21 H new ATOM 0 HB3 MET A 9 4.025 -20.928 -5.610 1.00 35.21 H new ATOM 0 HG2 MET A 9 1.802 -21.992 -5.384 1.00 10.04 H new ATOM 0 HG3 MET A 9 1.420 -21.565 -7.040 1.00 10.04 H new ATOM 0 HE1 MET A 9 1.932 -25.449 -7.305 1.00 21.11 H new ATOM 0 HE2 MET A 9 1.187 -24.540 -5.968 1.00 21.11 H new ATOM 0 HE3 MET A 9 0.854 -24.077 -7.654 1.00 21.11 H new ATOM 155 N GLY A 10 1.815 -17.714 -7.482 1.00 72.52 N ATOM 156 CA GLY A 10 0.843 -17.111 -8.378 1.00 63.23 C ATOM 157 C GLY A 10 1.296 -17.125 -9.824 1.00 1.24 C ATOM 158 O GLY A 10 1.837 -16.135 -10.323 1.00 31.32 O ATOM 0 H GLY A 10 2.693 -17.201 -7.400 1.00 72.52 H new ATOM 0 HA2 GLY A 10 -0.104 -17.644 -8.293 1.00 63.23 H new ATOM 0 HA3 GLY A 10 0.659 -16.082 -8.069 1.00 63.23 H new ATOM 162 N THR A 11 1.089 -18.250 -10.494 1.00 0.32 N ATOM 163 CA THR A 11 1.417 -18.375 -11.907 1.00 22.11 C ATOM 164 C THR A 11 0.218 -17.966 -12.760 1.00 23.13 C ATOM 165 O THR A 11 -0.762 -18.706 -12.867 1.00 3.55 O ATOM 166 CB THR A 11 1.849 -19.818 -12.254 1.00 61.11 C ATOM 167 OG1 THR A 11 2.956 -20.196 -11.421 1.00 12.15 O ATOM 168 CG2 THR A 11 2.248 -19.947 -13.724 1.00 23.11 C ATOM 0 H THR A 11 0.693 -19.093 -10.079 1.00 0.32 H new ATOM 0 HA THR A 11 2.254 -17.711 -12.122 1.00 22.11 H new ATOM 0 HB THR A 11 1.000 -20.479 -12.077 1.00 61.11 H new ATOM 0 HG1 THR A 11 3.231 -21.111 -11.638 1.00 12.15 H new ATOM 0 HG21 THR A 11 2.546 -20.975 -13.931 1.00 23.11 H new ATOM 0 HG22 THR A 11 1.401 -19.680 -14.356 1.00 23.11 H new ATOM 0 HG23 THR A 11 3.082 -19.278 -13.935 1.00 23.11 H new ATOM 176 N LEU A 12 0.292 -16.774 -13.333 1.00 23.05 N ATOM 177 CA LEU A 12 -0.780 -16.242 -14.162 1.00 13.01 C ATOM 178 C LEU A 12 -0.646 -16.783 -15.585 1.00 72.23 C ATOM 179 O LEU A 12 0.330 -16.488 -16.278 1.00 0.21 O ATOM 180 CB LEU A 12 -0.732 -14.697 -14.140 1.00 64.41 C ATOM 181 CG LEU A 12 -1.944 -13.955 -14.750 1.00 51.22 C ATOM 182 CD1 LEU A 12 -1.972 -12.504 -14.276 1.00 51.14 C ATOM 183 CD2 LEU A 12 -1.921 -13.994 -16.278 1.00 60.24 C ATOM 0 H LEU A 12 1.093 -16.150 -13.237 1.00 23.05 H new ATOM 0 HA LEU A 12 -1.746 -16.558 -13.769 1.00 13.01 H new ATOM 0 HB2 LEU A 12 -0.622 -14.375 -13.105 1.00 64.41 H new ATOM 0 HB3 LEU A 12 0.165 -14.377 -14.670 1.00 64.41 H new ATOM 0 HG LEU A 12 -2.844 -14.468 -14.410 1.00 51.22 H new ATOM 0 HD11 LEU A 12 -2.831 -11.995 -14.714 1.00 51.14 H new ATOM 0 HD12 LEU A 12 -2.050 -12.478 -13.189 1.00 51.14 H new ATOM 0 HD13 LEU A 12 -1.056 -12.002 -14.586 1.00 51.14 H new ATOM 0 HD21 LEU A 12 -2.789 -13.462 -16.669 1.00 60.24 H new ATOM 0 HD22 LEU A 12 -1.010 -13.518 -16.640 1.00 60.24 H new ATOM 0 HD23 LEU A 12 -1.948 -15.030 -16.616 1.00 60.24 H new ATOM 195 N GLU A 13 -1.613 -17.594 -16.003 1.00 22.00 N ATOM 196 CA GLU A 13 -1.630 -18.131 -17.362 1.00 22.14 C ATOM 197 C GLU A 13 -2.242 -17.111 -18.323 1.00 41.33 C ATOM 198 O GLU A 13 -3.272 -16.496 -18.020 1.00 42.24 O ATOM 199 CB GLU A 13 -2.399 -19.468 -17.437 1.00 43.13 C ATOM 200 CG GLU A 13 -3.837 -19.428 -16.911 1.00 63.33 C ATOM 201 CD GLU A 13 -3.937 -19.713 -15.419 1.00 30.35 C ATOM 202 OE1 GLU A 13 -4.080 -20.899 -15.045 1.00 14.15 O ATOM 203 OE2 GLU A 13 -3.877 -18.761 -14.611 1.00 43.21 O ATOM 0 H GLU A 13 -2.395 -17.894 -15.421 1.00 22.00 H new ATOM 0 HA GLU A 13 -0.599 -18.327 -17.656 1.00 22.14 H new ATOM 0 HB2 GLU A 13 -2.419 -19.799 -18.475 1.00 43.13 H new ATOM 0 HB3 GLU A 13 -1.845 -20.219 -16.874 1.00 43.13 H new ATOM 0 HG2 GLU A 13 -4.265 -18.447 -17.117 1.00 63.33 H new ATOM 0 HG3 GLU A 13 -4.437 -20.158 -17.455 1.00 63.33 H new ATOM 210 N ALA A 14 -1.601 -16.919 -19.470 1.00 14.03 N ATOM 211 CA ALA A 14 -2.071 -15.964 -20.468 1.00 33.23 C ATOM 212 C ALA A 14 -2.586 -16.687 -21.710 1.00 11.25 C ATOM 213 O ALA A 14 -1.806 -17.256 -22.479 1.00 22.03 O ATOM 214 CB ALA A 14 -0.954 -14.993 -20.834 1.00 1.45 C ATOM 0 H ALA A 14 -0.749 -17.415 -19.733 1.00 14.03 H new ATOM 0 HA ALA A 14 -2.899 -15.397 -20.042 1.00 33.23 H new ATOM 0 HB1 ALA A 14 -1.317 -14.285 -21.579 1.00 1.45 H new ATOM 0 HB2 ALA A 14 -0.637 -14.451 -19.943 1.00 1.45 H new ATOM 0 HB3 ALA A 14 -0.109 -15.548 -21.241 1.00 1.45 H new ATOM 220 N GLN A 15 -3.903 -16.681 -21.892 1.00 71.12 N ATOM 221 CA GLN A 15 -4.518 -17.292 -23.067 1.00 54.40 C ATOM 222 C GLN A 15 -4.457 -16.340 -24.261 1.00 43.42 C ATOM 223 O GLN A 15 -4.133 -15.156 -24.115 1.00 31.11 O ATOM 224 CB GLN A 15 -5.978 -17.674 -22.783 1.00 11.24 C ATOM 225 CG GLN A 15 -6.149 -18.712 -21.679 1.00 43.33 C ATOM 226 CD GLN A 15 -7.604 -19.119 -21.486 1.00 41.31 C ATOM 227 OE1 GLN A 15 -8.331 -18.511 -20.701 1.00 20.25 O ATOM 228 NE2 GLN A 15 -8.045 -20.143 -22.204 1.00 24.31 N ATOM 0 H GLN A 15 -4.566 -16.260 -21.241 1.00 71.12 H new ATOM 0 HA GLN A 15 -3.959 -18.197 -23.305 1.00 54.40 H new ATOM 0 HB2 GLN A 15 -6.530 -16.775 -22.510 1.00 11.24 H new ATOM 0 HB3 GLN A 15 -6.426 -18.057 -23.700 1.00 11.24 H new ATOM 0 HG2 GLN A 15 -5.556 -19.595 -21.919 1.00 43.33 H new ATOM 0 HG3 GLN A 15 -5.759 -18.311 -20.743 1.00 43.33 H new ATOM 0 HE21 GLN A 15 -7.415 -20.625 -22.846 1.00 24.31 H new ATOM 0 HE22 GLN A 15 -9.014 -20.449 -22.115 1.00 24.31 H new ATOM 237 N THR A 16 -4.773 -16.863 -25.437 1.00 0.12 N ATOM 238 CA THR A 16 -4.798 -16.072 -26.659 1.00 75.23 C ATOM 239 C THR A 16 -6.159 -15.400 -26.839 1.00 40.03 C ATOM 240 O THR A 16 -7.178 -15.898 -26.352 1.00 21.31 O ATOM 241 CB THR A 16 -4.482 -16.961 -27.881 1.00 75.20 C ATOM 242 OG1 THR A 16 -5.230 -18.183 -27.794 1.00 44.10 O ATOM 243 CG2 THR A 16 -2.991 -17.279 -27.956 1.00 2.15 C ATOM 0 H THR A 16 -5.018 -17.844 -25.571 1.00 0.12 H new ATOM 0 HA THR A 16 -4.036 -15.297 -26.579 1.00 75.23 H new ATOM 0 HB THR A 16 -4.764 -16.418 -28.783 1.00 75.20 H new ATOM 0 HG1 THR A 16 -5.030 -18.745 -28.571 1.00 44.10 H new ATOM 0 HG21 THR A 16 -2.796 -17.906 -28.826 1.00 2.15 H new ATOM 0 HG22 THR A 16 -2.425 -16.352 -28.043 1.00 2.15 H new ATOM 0 HG23 THR A 16 -2.686 -17.807 -27.052 1.00 2.15 H new ATOM 251 N GLN A 17 -6.163 -14.252 -27.506 1.00 23.22 N ATOM 252 CA GLN A 17 -7.396 -13.516 -27.782 1.00 3.02 C ATOM 253 C GLN A 17 -7.899 -13.818 -29.195 1.00 51.13 C ATOM 254 O GLN A 17 -7.204 -14.466 -29.987 1.00 53.23 O ATOM 255 CB GLN A 17 -7.179 -12.002 -27.604 1.00 70.42 C ATOM 256 CG GLN A 17 -7.152 -11.527 -26.151 1.00 72.33 C ATOM 257 CD GLN A 17 -5.968 -12.057 -25.360 1.00 71.23 C ATOM 258 OE1 GLN A 17 -4.901 -11.439 -25.329 1.00 71.31 O ATOM 259 NE2 GLN A 17 -6.141 -13.201 -24.714 1.00 44.13 N ATOM 0 H GLN A 17 -5.321 -13.806 -27.869 1.00 23.22 H new ATOM 0 HA GLN A 17 -8.152 -13.842 -27.068 1.00 3.02 H new ATOM 0 HB2 GLN A 17 -6.238 -11.725 -28.080 1.00 70.42 H new ATOM 0 HB3 GLN A 17 -7.971 -11.471 -28.131 1.00 70.42 H new ATOM 0 HG2 GLN A 17 -7.131 -10.437 -26.134 1.00 72.33 H new ATOM 0 HG3 GLN A 17 -8.074 -11.836 -25.659 1.00 72.33 H new ATOM 0 HE21 GLN A 17 -7.038 -13.684 -24.763 1.00 44.13 H new ATOM 0 HE22 GLN A 17 -5.377 -13.599 -24.168 1.00 44.13 H new ATOM 268 N GLY A 18 -9.102 -13.341 -29.503 1.00 10.21 N ATOM 269 CA GLY A 18 -9.705 -13.594 -30.800 1.00 61.13 C ATOM 270 C GLY A 18 -10.847 -12.639 -31.097 1.00 70.32 C ATOM 271 O GLY A 18 -10.911 -11.551 -30.516 1.00 74.25 O ATOM 0 H GLY A 18 -9.674 -12.779 -28.872 1.00 10.21 H new ATOM 0 HA2 GLY A 18 -8.945 -13.502 -31.576 1.00 61.13 H new ATOM 0 HA3 GLY A 18 -10.073 -14.619 -30.834 1.00 61.13 H new ATOM 275 N PRO A 19 -11.770 -13.018 -31.999 1.00 71.50 N ATOM 276 CA PRO A 19 -12.904 -12.169 -32.380 1.00 35.41 C ATOM 277 C PRO A 19 -13.861 -11.924 -31.215 1.00 54.13 C ATOM 278 O PRO A 19 -14.298 -10.794 -30.984 1.00 73.40 O ATOM 279 CB PRO A 19 -13.598 -12.968 -33.497 1.00 23.33 C ATOM 280 CG PRO A 19 -13.170 -14.381 -33.279 1.00 14.54 C ATOM 281 CD PRO A 19 -11.773 -14.303 -32.724 1.00 31.43 C ATOM 0 HA PRO A 19 -12.582 -11.176 -32.694 1.00 35.41 H new ATOM 0 HB2 PRO A 19 -14.682 -12.870 -33.438 1.00 23.33 H new ATOM 0 HB3 PRO A 19 -13.298 -12.612 -34.483 1.00 23.33 H new ATOM 0 HG2 PRO A 19 -13.839 -14.890 -32.585 1.00 14.54 H new ATOM 0 HG3 PRO A 19 -13.190 -14.944 -34.212 1.00 14.54 H new ATOM 0 HD2 PRO A 19 -11.556 -15.140 -32.061 1.00 31.43 H new ATOM 0 HD3 PRO A 19 -11.024 -14.321 -33.515 1.00 31.43 H new ATOM 289 N GLY A 20 -14.161 -12.981 -30.465 1.00 31.23 N ATOM 290 CA GLY A 20 -15.131 -12.882 -29.391 1.00 1.24 C ATOM 291 C GLY A 20 -16.536 -12.638 -29.913 1.00 25.15 C ATOM 292 O GLY A 20 -17.263 -13.584 -30.224 1.00 53.44 O ATOM 0 H GLY A 20 -13.748 -13.906 -30.583 1.00 31.23 H new ATOM 0 HA2 GLY A 20 -15.117 -13.800 -28.804 1.00 1.24 H new ATOM 0 HA3 GLY A 20 -14.848 -12.071 -28.720 1.00 1.24 H new ATOM 296 N SER A 21 -16.911 -11.369 -30.029 1.00 21.21 N ATOM 297 CA SER A 21 -18.230 -10.991 -30.525 1.00 53.15 C ATOM 298 C SER A 21 -18.167 -10.674 -32.019 1.00 14.20 C ATOM 299 O SER A 21 -17.126 -10.255 -32.532 1.00 73.52 O ATOM 300 CB SER A 21 -18.751 -9.777 -29.749 1.00 54.50 C ATOM 301 OG SER A 21 -20.040 -9.384 -30.193 1.00 2.55 O ATOM 0 H SER A 21 -16.315 -10.578 -29.784 1.00 21.21 H new ATOM 0 HA SER A 21 -18.913 -11.827 -30.377 1.00 53.15 H new ATOM 0 HB2 SER A 21 -18.789 -10.014 -28.686 1.00 54.50 H new ATOM 0 HB3 SER A 21 -18.057 -8.945 -29.866 1.00 54.50 H new ATOM 0 HG SER A 21 -20.048 -8.419 -30.361 1.00 2.55 H new ATOM 307 N MET A 22 -19.285 -10.880 -32.711 1.00 23.10 N ATOM 308 CA MET A 22 -19.381 -10.578 -34.140 1.00 1.00 C ATOM 309 C MET A 22 -19.787 -9.119 -34.353 1.00 72.15 C ATOM 310 O MET A 22 -19.852 -8.638 -35.487 1.00 54.32 O ATOM 311 CB MET A 22 -20.401 -11.513 -34.811 1.00 40.45 C ATOM 312 CG MET A 22 -21.839 -11.289 -34.352 1.00 23.11 C ATOM 313 SD MET A 22 -22.995 -12.487 -35.051 1.00 11.22 S ATOM 314 CE MET A 22 -24.533 -11.944 -34.307 1.00 2.32 C ATOM 0 H MET A 22 -20.141 -11.256 -32.305 1.00 23.10 H new ATOM 0 HA MET A 22 -18.403 -10.736 -34.594 1.00 1.00 H new ATOM 0 HB2 MET A 22 -20.349 -11.376 -35.891 1.00 40.45 H new ATOM 0 HB3 MET A 22 -20.121 -12.547 -34.607 1.00 40.45 H new ATOM 0 HG2 MET A 22 -21.880 -11.344 -33.264 1.00 23.11 H new ATOM 0 HG3 MET A 22 -22.152 -10.283 -34.633 1.00 23.11 H new ATOM 0 HE1 MET A 22 -25.346 -12.587 -34.642 1.00 2.32 H new ATOM 0 HE2 MET A 22 -24.451 -11.999 -33.221 1.00 2.32 H new ATOM 0 HE3 MET A 22 -24.738 -10.915 -34.604 1.00 2.32 H new ATOM 324 N SER A 23 -20.051 -8.420 -33.250 1.00 10.14 N ATOM 325 CA SER A 23 -20.499 -7.035 -33.295 1.00 32.11 C ATOM 326 C SER A 23 -19.446 -6.133 -33.946 1.00 62.52 C ATOM 327 O SER A 23 -18.305 -6.549 -34.179 1.00 32.10 O ATOM 328 CB SER A 23 -20.827 -6.551 -31.879 1.00 71.33 C ATOM 329 OG SER A 23 -19.734 -6.763 -30.999 1.00 5.30 O ATOM 0 H SER A 23 -19.960 -8.798 -32.307 1.00 10.14 H new ATOM 0 HA SER A 23 -21.400 -6.982 -33.907 1.00 32.11 H new ATOM 0 HB2 SER A 23 -21.078 -5.490 -31.903 1.00 71.33 H new ATOM 0 HB3 SER A 23 -21.705 -7.078 -31.506 1.00 71.33 H new ATOM 0 HG SER A 23 -19.969 -6.444 -30.103 1.00 5.30 H new ATOM 335 N ALA A 24 -19.832 -4.894 -34.234 1.00 60.44 N ATOM 336 CA ALA A 24 -18.952 -3.959 -34.924 1.00 54.02 C ATOM 337 C ALA A 24 -17.842 -3.455 -34.004 1.00 62.11 C ATOM 338 O ALA A 24 -18.027 -2.491 -33.259 1.00 62.02 O ATOM 339 CB ALA A 24 -19.753 -2.791 -35.487 1.00 34.21 C ATOM 0 H ALA A 24 -20.749 -4.514 -34.000 1.00 60.44 H new ATOM 0 HA ALA A 24 -18.481 -4.491 -35.750 1.00 54.02 H new ATOM 0 HB1 ALA A 24 -19.081 -2.102 -35.999 1.00 34.21 H new ATOM 0 HB2 ALA A 24 -20.495 -3.165 -36.192 1.00 34.21 H new ATOM 0 HB3 ALA A 24 -20.256 -2.269 -34.673 1.00 34.21 H new ATOM 345 N GLN A 25 -16.706 -4.139 -34.033 1.00 52.11 N ATOM 346 CA GLN A 25 -15.511 -3.696 -33.320 1.00 33.31 C ATOM 347 C GLN A 25 -14.660 -2.866 -34.275 1.00 11.54 C ATOM 348 O GLN A 25 -14.492 -3.247 -35.434 1.00 33.33 O ATOM 349 CB GLN A 25 -14.723 -4.912 -32.810 1.00 24.32 C ATOM 350 CG GLN A 25 -15.591 -5.921 -32.064 1.00 62.34 C ATOM 351 CD GLN A 25 -14.822 -7.145 -31.596 1.00 50.24 C ATOM 352 OE1 GLN A 25 -13.639 -7.065 -31.262 1.00 54.31 O ATOM 353 NE2 GLN A 25 -15.482 -8.294 -31.589 1.00 0.52 N ATOM 0 H GLN A 25 -16.585 -5.011 -34.547 1.00 52.11 H new ATOM 0 HA GLN A 25 -15.789 -3.090 -32.458 1.00 33.31 H new ATOM 0 HB2 GLN A 25 -14.246 -5.408 -33.655 1.00 24.32 H new ATOM 0 HB3 GLN A 25 -13.926 -4.570 -32.150 1.00 24.32 H new ATOM 0 HG2 GLN A 25 -16.043 -5.433 -31.201 1.00 62.34 H new ATOM 0 HG3 GLN A 25 -16.406 -6.239 -32.714 1.00 62.34 H new ATOM 0 HE21 GLN A 25 -16.461 -8.321 -31.872 1.00 0.52 H new ATOM 0 HE22 GLN A 25 -15.011 -9.151 -31.300 1.00 0.52 H new ATOM 362 N LEU A 26 -14.137 -1.736 -33.812 1.00 30.13 N ATOM 363 CA LEU A 26 -13.449 -0.807 -34.707 1.00 12.14 C ATOM 364 C LEU A 26 -12.043 -0.470 -34.209 1.00 51.43 C ATOM 365 O LEU A 26 -11.870 0.315 -33.276 1.00 61.15 O ATOM 366 CB LEU A 26 -14.276 0.480 -34.862 1.00 71.53 C ATOM 367 CG LEU A 26 -13.700 1.522 -35.838 1.00 4.02 C ATOM 368 CD1 LEU A 26 -13.600 0.941 -37.249 1.00 1.33 C ATOM 369 CD2 LEU A 26 -14.552 2.790 -35.835 1.00 14.44 C ATOM 0 H LEU A 26 -14.174 -1.442 -32.836 1.00 30.13 H new ATOM 0 HA LEU A 26 -13.346 -1.295 -35.676 1.00 12.14 H new ATOM 0 HB2 LEU A 26 -15.278 0.210 -35.195 1.00 71.53 H new ATOM 0 HB3 LEU A 26 -14.381 0.945 -33.882 1.00 71.53 H new ATOM 0 HG LEU A 26 -12.696 1.785 -35.506 1.00 4.02 H new ATOM 0 HD11 LEU A 26 -13.191 1.693 -37.924 1.00 1.33 H new ATOM 0 HD12 LEU A 26 -12.946 0.069 -37.238 1.00 1.33 H new ATOM 0 HD13 LEU A 26 -14.592 0.647 -37.592 1.00 1.33 H new ATOM 0 HD21 LEU A 26 -14.129 3.514 -36.531 1.00 14.44 H new ATOM 0 HD22 LEU A 26 -15.569 2.545 -36.140 1.00 14.44 H new ATOM 0 HD23 LEU A 26 -14.566 3.216 -34.832 1.00 14.44 H new ATOM 381 N GLU A 27 -11.044 -1.091 -34.825 1.00 2.20 N ATOM 382 CA GLU A 27 -9.652 -0.708 -34.629 1.00 14.02 C ATOM 383 C GLU A 27 -9.113 -0.068 -35.901 1.00 65.33 C ATOM 384 O GLU A 27 -9.020 -0.723 -36.943 1.00 60.33 O ATOM 385 CB GLU A 27 -8.779 -1.914 -34.258 1.00 53.11 C ATOM 386 CG GLU A 27 -8.950 -2.403 -32.825 1.00 1.14 C ATOM 387 CD GLU A 27 -7.941 -3.480 -32.461 1.00 4.22 C ATOM 388 OE1 GLU A 27 -6.742 -3.151 -32.308 1.00 43.34 O ATOM 389 OE2 GLU A 27 -8.332 -4.658 -32.335 1.00 35.30 O ATOM 0 H GLU A 27 -11.175 -1.870 -35.471 1.00 2.20 H new ATOM 0 HA GLU A 27 -9.615 0.004 -33.804 1.00 14.02 H new ATOM 0 HB2 GLU A 27 -9.008 -2.735 -34.938 1.00 53.11 H new ATOM 0 HB3 GLU A 27 -7.733 -1.651 -34.416 1.00 53.11 H new ATOM 0 HG2 GLU A 27 -8.843 -1.561 -32.141 1.00 1.14 H new ATOM 0 HG3 GLU A 27 -9.959 -2.794 -32.694 1.00 1.14 H new ATOM 396 N LYS A 28 -8.803 1.214 -35.820 1.00 20.23 N ATOM 397 CA LYS A 28 -8.121 1.919 -36.896 1.00 1.42 C ATOM 398 C LYS A 28 -6.736 2.330 -36.408 1.00 24.22 C ATOM 399 O LYS A 28 -6.588 3.280 -35.636 1.00 43.22 O ATOM 400 CB LYS A 28 -8.946 3.132 -37.367 1.00 13.42 C ATOM 401 CG LYS A 28 -9.425 4.052 -36.245 1.00 53.12 C ATOM 402 CD LYS A 28 -10.286 5.195 -36.779 1.00 50.34 C ATOM 403 CE LYS A 28 -10.802 6.088 -35.655 1.00 71.00 C ATOM 404 NZ LYS A 28 -11.660 7.191 -36.166 1.00 31.34 N ATOM 0 H LYS A 28 -9.015 1.796 -35.010 1.00 20.23 H new ATOM 0 HA LYS A 28 -8.011 1.263 -37.759 1.00 1.42 H new ATOM 0 HB2 LYS A 28 -8.344 3.715 -38.065 1.00 13.42 H new ATOM 0 HB3 LYS A 28 -9.814 2.772 -37.919 1.00 13.42 H new ATOM 0 HG2 LYS A 28 -9.997 3.474 -35.520 1.00 53.12 H new ATOM 0 HG3 LYS A 28 -8.563 4.461 -35.718 1.00 53.12 H new ATOM 0 HD2 LYS A 28 -9.703 5.793 -37.480 1.00 50.34 H new ATOM 0 HD3 LYS A 28 -11.130 4.786 -37.335 1.00 50.34 H new ATOM 0 HE2 LYS A 28 -11.370 5.486 -34.946 1.00 71.00 H new ATOM 0 HE3 LYS A 28 -9.957 6.509 -35.110 1.00 71.00 H new ATOM 0 HZ1 LYS A 28 -11.989 7.773 -35.369 1.00 31.34 H new ATOM 0 HZ2 LYS A 28 -11.111 7.782 -36.823 1.00 31.34 H new ATOM 0 HZ3 LYS A 28 -12.481 6.790 -36.664 1.00 31.34 H new ATOM 418 N LYS A 29 -5.730 1.566 -36.822 1.00 10.31 N ATOM 419 CA LYS A 29 -4.364 1.751 -36.345 1.00 4.51 C ATOM 420 C LYS A 29 -3.414 1.946 -37.517 1.00 32.22 C ATOM 421 O LYS A 29 -3.280 1.071 -38.373 1.00 50.14 O ATOM 422 CB LYS A 29 -3.951 0.539 -35.484 1.00 34.44 C ATOM 423 CG LYS A 29 -2.522 0.592 -34.923 1.00 63.44 C ATOM 424 CD LYS A 29 -1.503 -0.057 -35.862 1.00 73.32 C ATOM 425 CE LYS A 29 -0.096 -0.070 -35.272 1.00 34.34 C ATOM 426 NZ LYS A 29 0.452 1.302 -35.085 1.00 5.41 N ATOM 0 H LYS A 29 -5.837 0.806 -37.493 1.00 10.31 H new ATOM 0 HA LYS A 29 -4.313 2.648 -35.728 1.00 4.51 H new ATOM 0 HB2 LYS A 29 -4.648 0.451 -34.651 1.00 34.44 H new ATOM 0 HB3 LYS A 29 -4.055 -0.365 -36.084 1.00 34.44 H new ATOM 0 HG2 LYS A 29 -2.241 1.631 -34.748 1.00 63.44 H new ATOM 0 HG3 LYS A 29 -2.495 0.088 -33.957 1.00 63.44 H new ATOM 0 HD2 LYS A 29 -1.813 -1.079 -36.079 1.00 73.32 H new ATOM 0 HD3 LYS A 29 -1.492 0.481 -36.810 1.00 73.32 H new ATOM 0 HE2 LYS A 29 -0.112 -0.586 -34.312 1.00 34.34 H new ATOM 0 HE3 LYS A 29 0.565 -0.637 -35.928 1.00 34.34 H new ATOM 0 HZ1 LYS A 29 1.454 1.241 -34.812 1.00 5.41 H new ATOM 0 HZ2 LYS A 29 0.368 1.834 -35.975 1.00 5.41 H new ATOM 0 HZ3 LYS A 29 -0.082 1.790 -34.338 1.00 5.41 H new ATOM 440 N VAL A 30 -2.763 3.101 -37.554 1.00 1.11 N ATOM 441 CA VAL A 30 -1.800 3.407 -38.600 1.00 62.04 C ATOM 442 C VAL A 30 -0.580 2.497 -38.463 1.00 61.23 C ATOM 443 O VAL A 30 0.158 2.578 -37.480 1.00 52.32 O ATOM 444 CB VAL A 30 -1.360 4.893 -38.546 1.00 12.12 C ATOM 445 CG1 VAL A 30 -0.374 5.212 -39.668 1.00 33.10 C ATOM 446 CG2 VAL A 30 -2.578 5.818 -38.613 1.00 70.43 C ATOM 0 H VAL A 30 -2.886 3.845 -36.867 1.00 1.11 H new ATOM 0 HA VAL A 30 -2.279 3.233 -39.563 1.00 62.04 H new ATOM 0 HB VAL A 30 -0.853 5.063 -37.596 1.00 12.12 H new ATOM 0 HG11 VAL A 30 -0.081 6.260 -39.608 1.00 33.10 H new ATOM 0 HG12 VAL A 30 0.510 4.582 -39.566 1.00 33.10 H new ATOM 0 HG13 VAL A 30 -0.846 5.022 -40.632 1.00 33.10 H new ATOM 0 HG21 VAL A 30 -2.249 6.856 -38.574 1.00 70.43 H new ATOM 0 HG22 VAL A 30 -3.117 5.643 -39.544 1.00 70.43 H new ATOM 0 HG23 VAL A 30 -3.237 5.614 -37.769 1.00 70.43 H new ATOM 456 N LEU A 31 -0.395 1.616 -39.436 1.00 3.31 N ATOM 457 CA LEU A 31 0.692 0.642 -39.409 1.00 51.44 C ATOM 458 C LEU A 31 2.005 1.338 -39.774 1.00 63.53 C ATOM 459 O LEU A 31 3.052 1.085 -39.173 1.00 71.22 O ATOM 460 CB LEU A 31 0.377 -0.507 -40.390 1.00 73.13 C ATOM 461 CG LEU A 31 1.073 -1.862 -40.121 1.00 33.10 C ATOM 462 CD1 LEU A 31 2.582 -1.779 -40.353 1.00 41.32 C ATOM 463 CD2 LEU A 31 0.772 -2.350 -38.705 1.00 61.33 C ATOM 0 H LEU A 31 -0.989 1.554 -40.263 1.00 3.31 H new ATOM 0 HA LEU A 31 0.794 0.219 -38.409 1.00 51.44 H new ATOM 0 HB2 LEU A 31 -0.701 -0.672 -40.386 1.00 73.13 H new ATOM 0 HB3 LEU A 31 0.646 -0.180 -41.394 1.00 73.13 H new ATOM 0 HG LEU A 31 0.671 -2.584 -40.832 1.00 33.10 H new ATOM 0 HD11 LEU A 31 3.035 -2.750 -40.154 1.00 41.32 H new ATOM 0 HD12 LEU A 31 2.776 -1.493 -41.387 1.00 41.32 H new ATOM 0 HD13 LEU A 31 3.013 -1.034 -39.684 1.00 41.32 H new ATOM 0 HD21 LEU A 31 1.270 -3.304 -38.535 1.00 61.33 H new ATOM 0 HD22 LEU A 31 1.134 -1.618 -37.983 1.00 61.33 H new ATOM 0 HD23 LEU A 31 -0.304 -2.476 -38.585 1.00 61.33 H new ATOM 475 N THR A 32 1.930 2.223 -40.758 1.00 73.42 N ATOM 476 CA THR A 32 3.077 3.005 -41.200 1.00 63.14 C ATOM 477 C THR A 32 2.600 4.383 -41.669 1.00 74.03 C ATOM 478 O THR A 32 1.855 4.478 -42.644 1.00 24.43 O ATOM 479 CB THR A 32 3.833 2.285 -42.346 1.00 71.24 C ATOM 480 OG1 THR A 32 4.237 0.976 -41.910 1.00 42.12 O ATOM 481 CG2 THR A 32 5.063 3.074 -42.791 1.00 61.24 C ATOM 0 H THR A 32 1.072 2.420 -41.273 1.00 73.42 H new ATOM 0 HA THR A 32 3.766 3.120 -40.363 1.00 63.14 H new ATOM 0 HB THR A 32 3.156 2.205 -43.196 1.00 71.24 H new ATOM 0 HG1 THR A 32 4.713 0.522 -42.636 1.00 42.12 H new ATOM 0 HG21 THR A 32 5.567 2.539 -43.595 1.00 61.24 H new ATOM 0 HG22 THR A 32 4.755 4.057 -43.147 1.00 61.24 H new ATOM 0 HG23 THR A 32 5.745 3.190 -41.949 1.00 61.24 H new ATOM 489 N PRO A 33 2.998 5.463 -40.963 1.00 53.10 N ATOM 490 CA PRO A 33 2.531 6.827 -41.264 1.00 31.44 C ATOM 491 C PRO A 33 3.008 7.324 -42.630 1.00 3.51 C ATOM 492 O PRO A 33 4.080 6.936 -43.108 1.00 22.31 O ATOM 493 CB PRO A 33 3.137 7.673 -40.130 1.00 1.05 C ATOM 494 CG PRO A 33 4.319 6.891 -39.665 1.00 71.12 C ATOM 495 CD PRO A 33 3.940 5.443 -39.824 1.00 42.35 C ATOM 0 HA PRO A 33 1.444 6.882 -41.315 1.00 31.44 H new ATOM 0 HB2 PRO A 33 3.431 8.661 -40.486 1.00 1.05 H new ATOM 0 HB3 PRO A 33 2.420 7.825 -39.323 1.00 1.05 H new ATOM 0 HG2 PRO A 33 5.203 7.131 -40.255 1.00 71.12 H new ATOM 0 HG3 PRO A 33 4.557 7.121 -38.626 1.00 71.12 H new ATOM 0 HD2 PRO A 33 4.810 4.820 -40.032 1.00 42.35 H new ATOM 0 HD3 PRO A 33 3.473 5.048 -38.922 1.00 42.35 H new ATOM 503 N GLY A 34 2.210 8.192 -43.245 1.00 1.22 N ATOM 504 CA GLY A 34 2.542 8.741 -44.551 1.00 71.12 C ATOM 505 C GLY A 34 2.985 10.184 -44.463 1.00 51.22 C ATOM 506 O GLY A 34 3.789 10.540 -43.593 1.00 33.52 O ATOM 0 H GLY A 34 1.329 8.529 -42.858 1.00 1.22 H new ATOM 0 HA2 GLY A 34 3.335 8.145 -45.004 1.00 71.12 H new ATOM 0 HA3 GLY A 34 1.674 8.668 -45.206 1.00 71.12 H new ATOM 510 N ASP A 35 2.473 11.016 -45.364 1.00 1.32 N ATOM 511 CA ASP A 35 2.790 12.445 -45.356 1.00 65.45 C ATOM 512 C ASP A 35 2.086 13.159 -44.214 1.00 14.34 C ATOM 513 O ASP A 35 2.707 13.906 -43.460 1.00 32.43 O ATOM 514 CB ASP A 35 2.389 13.120 -46.674 1.00 64.24 C ATOM 515 CG ASP A 35 3.309 12.773 -47.830 1.00 72.41 C ATOM 516 OD1 ASP A 35 4.505 13.121 -47.759 1.00 4.21 O ATOM 517 OD2 ASP A 35 2.835 12.186 -48.822 1.00 51.11 O ATOM 0 H ASP A 35 1.838 10.729 -46.109 1.00 1.32 H new ATOM 0 HA ASP A 35 3.870 12.521 -45.226 1.00 65.45 H new ATOM 0 HB2 ASP A 35 1.370 12.827 -46.929 1.00 64.24 H new ATOM 0 HB3 ASP A 35 2.385 14.201 -46.534 1.00 64.24 H new ATOM 522 N GLY A 36 0.781 12.943 -44.106 1.00 33.03 N ATOM 523 CA GLY A 36 -0.017 13.668 -43.135 1.00 42.44 C ATOM 524 C GLY A 36 -0.535 14.988 -43.688 1.00 51.13 C ATOM 525 O GLY A 36 -1.558 15.503 -43.226 1.00 23.41 O ATOM 0 H GLY A 36 0.259 12.277 -44.675 1.00 33.03 H new ATOM 0 HA2 GLY A 36 -0.860 13.050 -42.826 1.00 42.44 H new ATOM 0 HA3 GLY A 36 0.582 13.859 -42.245 1.00 42.44 H new ATOM 529 N VAL A 37 0.173 15.537 -44.677 1.00 62.44 N ATOM 530 CA VAL A 37 -0.216 16.799 -45.314 1.00 70.24 C ATOM 531 C VAL A 37 -0.960 16.548 -46.630 1.00 51.32 C ATOM 532 O VAL A 37 -1.742 17.384 -47.087 1.00 73.24 O ATOM 533 CB VAL A 37 1.018 17.700 -45.584 1.00 11.24 C ATOM 534 CG1 VAL A 37 1.730 18.046 -44.279 1.00 11.54 C ATOM 535 CG2 VAL A 37 1.983 17.029 -46.557 1.00 52.31 C ATOM 0 H VAL A 37 1.025 15.125 -45.057 1.00 62.44 H new ATOM 0 HA VAL A 37 -0.882 17.313 -44.621 1.00 70.24 H new ATOM 0 HB VAL A 37 0.664 18.625 -46.040 1.00 11.24 H new ATOM 0 HG11 VAL A 37 2.592 18.678 -44.491 1.00 11.54 H new ATOM 0 HG12 VAL A 37 1.044 18.578 -43.620 1.00 11.54 H new ATOM 0 HG13 VAL A 37 2.063 17.129 -43.792 1.00 11.54 H new ATOM 0 HG21 VAL A 37 2.839 17.682 -46.729 1.00 52.31 H new ATOM 0 HG22 VAL A 37 2.326 16.084 -46.136 1.00 52.31 H new ATOM 0 HG23 VAL A 37 1.474 16.841 -47.503 1.00 52.31 H new ATOM 545 N THR A 38 -0.713 15.392 -47.240 1.00 10.01 N ATOM 546 CA THR A 38 -1.371 15.025 -48.484 1.00 12.05 C ATOM 547 C THR A 38 -2.784 14.520 -48.205 1.00 25.34 C ATOM 548 O THR A 38 -2.993 13.343 -47.906 1.00 54.22 O ATOM 549 CB THR A 38 -0.554 13.961 -49.250 1.00 44.23 C ATOM 550 OG1 THR A 38 -0.135 12.926 -48.345 1.00 15.11 O ATOM 551 CG2 THR A 38 0.669 14.588 -49.915 1.00 33.03 C ATOM 0 H THR A 38 -0.059 14.693 -46.889 1.00 10.01 H new ATOM 0 HA THR A 38 -1.435 15.914 -49.112 1.00 12.05 H new ATOM 0 HB THR A 38 -1.188 13.534 -50.027 1.00 44.23 H new ATOM 0 HG1 THR A 38 0.790 12.672 -48.544 1.00 15.11 H new ATOM 0 HG21 THR A 38 1.228 13.819 -50.448 1.00 33.03 H new ATOM 0 HG22 THR A 38 0.347 15.356 -50.619 1.00 33.03 H new ATOM 0 HG23 THR A 38 1.306 15.038 -49.154 1.00 33.03 H new ATOM 559 N LYS A 39 -3.745 15.433 -48.267 1.00 43.31 N ATOM 560 CA LYS A 39 -5.126 15.129 -47.910 1.00 13.11 C ATOM 561 C LYS A 39 -5.903 14.608 -49.123 1.00 41.21 C ATOM 562 O LYS A 39 -5.890 15.237 -50.185 1.00 63.14 O ATOM 563 CB LYS A 39 -5.803 16.388 -47.351 1.00 22.03 C ATOM 564 CG LYS A 39 -5.015 17.050 -46.222 1.00 14.54 C ATOM 565 CD LYS A 39 -5.712 18.297 -45.688 1.00 41.50 C ATOM 566 CE LYS A 39 -7.024 17.958 -44.988 1.00 4.21 C ATOM 567 NZ LYS A 39 -6.817 17.070 -43.814 1.00 32.51 N ATOM 0 H LYS A 39 -3.592 16.397 -48.563 1.00 43.31 H new ATOM 0 HA LYS A 39 -5.124 14.349 -47.148 1.00 13.11 H new ATOM 0 HB2 LYS A 39 -5.940 17.107 -48.159 1.00 22.03 H new ATOM 0 HB3 LYS A 39 -6.796 16.126 -46.986 1.00 22.03 H new ATOM 0 HG2 LYS A 39 -4.878 16.336 -45.410 1.00 14.54 H new ATOM 0 HG3 LYS A 39 -4.022 17.317 -46.582 1.00 14.54 H new ATOM 0 HD2 LYS A 39 -5.051 18.812 -44.991 1.00 41.50 H new ATOM 0 HD3 LYS A 39 -5.906 18.985 -46.511 1.00 41.50 H new ATOM 0 HE2 LYS A 39 -7.511 18.878 -44.665 1.00 4.21 H new ATOM 0 HE3 LYS A 39 -7.697 17.473 -45.695 1.00 4.21 H new ATOM 0 HZ1 LYS A 39 -7.680 17.055 -43.234 1.00 32.51 H new ATOM 0 HZ2 LYS A 39 -6.603 16.106 -44.141 1.00 32.51 H new ATOM 0 HZ3 LYS A 39 -6.023 17.427 -43.245 1.00 32.51 H new ATOM 581 N PRO A 40 -6.584 13.452 -48.984 1.00 42.33 N ATOM 582 CA PRO A 40 -7.387 12.876 -50.067 1.00 34.02 C ATOM 583 C PRO A 40 -8.728 13.600 -50.237 1.00 15.53 C ATOM 584 O PRO A 40 -9.516 13.707 -49.292 1.00 20.24 O ATOM 585 CB PRO A 40 -7.595 11.426 -49.611 1.00 14.44 C ATOM 586 CG PRO A 40 -7.570 11.494 -48.119 1.00 71.04 C ATOM 587 CD PRO A 40 -6.622 12.614 -47.764 1.00 13.23 C ATOM 0 HA PRO A 40 -6.901 12.960 -51.039 1.00 34.02 H new ATOM 0 HB2 PRO A 40 -8.543 11.028 -49.974 1.00 14.44 H new ATOM 0 HB3 PRO A 40 -6.809 10.774 -49.992 1.00 14.44 H new ATOM 0 HG2 PRO A 40 -8.566 11.687 -47.721 1.00 71.04 H new ATOM 0 HG3 PRO A 40 -7.234 10.549 -47.692 1.00 71.04 H new ATOM 0 HD2 PRO A 40 -6.977 13.179 -46.902 1.00 13.23 H new ATOM 0 HD3 PRO A 40 -5.633 12.234 -47.510 1.00 13.23 H new ATOM 595 N GLN A 41 -8.969 14.110 -51.442 1.00 71.30 N ATOM 596 CA GLN A 41 -10.209 14.814 -51.760 1.00 74.23 C ATOM 597 C GLN A 41 -11.263 13.844 -52.291 1.00 54.51 C ATOM 598 O GLN A 41 -10.935 12.845 -52.938 1.00 73.51 O ATOM 599 CB GLN A 41 -9.946 15.906 -52.808 1.00 32.32 C ATOM 600 CG GLN A 41 -9.020 17.021 -52.333 1.00 20.14 C ATOM 601 CD GLN A 41 -8.647 17.984 -53.452 1.00 75.11 C ATOM 602 OE1 GLN A 41 -9.333 18.981 -53.690 1.00 42.13 O ATOM 603 NE2 GLN A 41 -7.564 17.685 -54.153 1.00 32.25 N ATOM 0 H GLN A 41 -8.315 14.048 -52.222 1.00 71.30 H new ATOM 0 HA GLN A 41 -10.581 15.272 -50.844 1.00 74.23 H new ATOM 0 HB2 GLN A 41 -9.514 15.445 -53.696 1.00 32.32 H new ATOM 0 HB3 GLN A 41 -10.899 16.343 -53.107 1.00 32.32 H new ATOM 0 HG2 GLN A 41 -9.505 17.574 -51.528 1.00 20.14 H new ATOM 0 HG3 GLN A 41 -8.113 16.583 -51.917 1.00 20.14 H new ATOM 0 HE21 GLN A 41 -7.023 16.851 -53.925 1.00 32.25 H new ATOM 0 HE22 GLN A 41 -7.271 18.289 -54.921 1.00 32.25 H new ATOM 612 N ALA A 42 -12.528 14.147 -52.015 1.00 32.14 N ATOM 613 CA ALA A 42 -13.640 13.367 -52.546 1.00 64.43 C ATOM 614 C ALA A 42 -13.806 13.653 -54.035 1.00 53.00 C ATOM 615 O ALA A 42 -13.696 14.802 -54.467 1.00 74.42 O ATOM 616 CB ALA A 42 -14.927 13.681 -51.787 1.00 22.33 C ATOM 0 H ALA A 42 -12.809 14.930 -51.425 1.00 32.14 H new ATOM 0 HA ALA A 42 -13.424 12.307 -52.415 1.00 64.43 H new ATOM 0 HB1 ALA A 42 -15.745 13.089 -52.198 1.00 22.33 H new ATOM 0 HB2 ALA A 42 -14.796 13.437 -50.733 1.00 22.33 H new ATOM 0 HB3 ALA A 42 -15.160 14.741 -51.888 1.00 22.33 H new ATOM 622 N GLY A 43 -14.056 12.608 -54.816 1.00 22.23 N ATOM 623 CA GLY A 43 -14.189 12.759 -56.255 1.00 40.21 C ATOM 624 C GLY A 43 -12.885 12.486 -56.980 1.00 65.14 C ATOM 625 O GLY A 43 -12.833 12.494 -58.213 1.00 43.04 O ATOM 0 H GLY A 43 -14.170 11.653 -54.476 1.00 22.23 H new ATOM 0 HA2 GLY A 43 -14.957 12.077 -56.621 1.00 40.21 H new ATOM 0 HA3 GLY A 43 -14.526 13.770 -56.483 1.00 40.21 H new ATOM 629 N LYS A 44 -11.830 12.247 -56.207 1.00 15.02 N ATOM 630 CA LYS A 44 -10.513 11.940 -56.755 1.00 4.12 C ATOM 631 C LYS A 44 -10.325 10.435 -56.914 1.00 2.42 C ATOM 632 O LYS A 44 -10.659 9.657 -56.017 1.00 21.32 O ATOM 633 CB LYS A 44 -9.406 12.510 -55.846 1.00 74.43 C ATOM 634 CG LYS A 44 -9.107 13.989 -56.078 1.00 13.21 C ATOM 635 CD LYS A 44 -8.458 14.223 -57.444 1.00 25.44 C ATOM 636 CE LYS A 44 -7.120 13.496 -57.574 1.00 74.31 C ATOM 637 NZ LYS A 44 -6.563 13.590 -58.950 1.00 24.40 N ATOM 0 H LYS A 44 -11.863 12.260 -55.188 1.00 15.02 H new ATOM 0 HA LYS A 44 -10.443 12.405 -57.739 1.00 4.12 H new ATOM 0 HB2 LYS A 44 -9.697 12.368 -54.805 1.00 74.43 H new ATOM 0 HB3 LYS A 44 -8.492 11.937 -56.002 1.00 74.43 H new ATOM 0 HG2 LYS A 44 -10.031 14.563 -56.010 1.00 13.21 H new ATOM 0 HG3 LYS A 44 -8.446 14.355 -55.293 1.00 13.21 H new ATOM 0 HD2 LYS A 44 -9.133 13.883 -58.229 1.00 25.44 H new ATOM 0 HD3 LYS A 44 -8.306 15.292 -57.595 1.00 25.44 H new ATOM 0 HE2 LYS A 44 -6.408 13.919 -56.866 1.00 74.31 H new ATOM 0 HE3 LYS A 44 -7.250 12.447 -57.307 1.00 74.31 H new ATOM 0 HZ1 LYS A 44 -5.656 13.083 -58.993 1.00 24.40 H new ATOM 0 HZ2 LYS A 44 -7.230 13.163 -59.624 1.00 24.40 H new ATOM 0 HZ3 LYS A 44 -6.413 14.589 -59.196 1.00 24.40 H new ATOM 651 N LYS A 45 -9.807 10.035 -58.071 1.00 31.54 N ATOM 652 CA LYS A 45 -9.410 8.656 -58.303 1.00 2.24 C ATOM 653 C LYS A 45 -8.141 8.368 -57.507 1.00 43.32 C ATOM 654 O LYS A 45 -7.068 8.875 -57.845 1.00 1.42 O ATOM 655 CB LYS A 45 -9.162 8.414 -59.801 1.00 23.45 C ATOM 656 CG LYS A 45 -8.816 6.966 -60.151 1.00 51.53 C ATOM 657 CD LYS A 45 -9.996 6.014 -59.945 1.00 61.23 C ATOM 658 CE LYS A 45 -11.033 6.103 -61.070 1.00 43.20 C ATOM 659 NZ LYS A 45 -11.687 7.439 -61.166 1.00 55.24 N ATOM 0 H LYS A 45 -9.653 10.654 -58.867 1.00 31.54 H new ATOM 0 HA LYS A 45 -10.208 7.988 -57.978 1.00 2.24 H new ATOM 0 HB2 LYS A 45 -10.052 8.708 -60.358 1.00 23.45 H new ATOM 0 HB3 LYS A 45 -8.350 9.061 -60.133 1.00 23.45 H new ATOM 0 HG2 LYS A 45 -8.490 6.915 -61.190 1.00 51.53 H new ATOM 0 HG3 LYS A 45 -7.977 6.638 -59.537 1.00 51.53 H new ATOM 0 HD2 LYS A 45 -9.625 4.991 -59.879 1.00 61.23 H new ATOM 0 HD3 LYS A 45 -10.478 6.240 -58.994 1.00 61.23 H new ATOM 0 HE2 LYS A 45 -10.549 5.874 -62.019 1.00 43.20 H new ATOM 0 HE3 LYS A 45 -11.798 5.343 -60.911 1.00 43.20 H new ATOM 0 HZ1 LYS A 45 -12.529 7.370 -61.772 1.00 55.24 H new ATOM 0 HZ2 LYS A 45 -11.969 7.757 -60.217 1.00 55.24 H new ATOM 0 HZ3 LYS A 45 -11.020 8.123 -61.576 1.00 55.24 H new ATOM 673 N VAL A 46 -8.270 7.579 -56.450 1.00 62.24 N ATOM 674 CA VAL A 46 -7.147 7.276 -55.567 1.00 12.10 C ATOM 675 C VAL A 46 -6.656 5.847 -55.785 1.00 64.05 C ATOM 676 O VAL A 46 -7.440 4.953 -56.120 1.00 45.11 O ATOM 677 CB VAL A 46 -7.531 7.473 -54.075 1.00 33.35 C ATOM 678 CG1 VAL A 46 -7.875 8.937 -53.800 1.00 13.43 C ATOM 679 CG2 VAL A 46 -8.687 6.553 -53.674 1.00 33.14 C ATOM 0 H VAL A 46 -9.147 7.133 -56.180 1.00 62.24 H new ATOM 0 HA VAL A 46 -6.344 7.971 -55.813 1.00 12.10 H new ATOM 0 HB VAL A 46 -6.669 7.203 -53.465 1.00 33.35 H new ATOM 0 HG11 VAL A 46 -8.142 9.057 -52.750 1.00 13.43 H new ATOM 0 HG12 VAL A 46 -7.012 9.563 -54.029 1.00 13.43 H new ATOM 0 HG13 VAL A 46 -8.717 9.237 -54.425 1.00 13.43 H new ATOM 0 HG21 VAL A 46 -8.933 6.714 -52.624 1.00 33.14 H new ATOM 0 HG22 VAL A 46 -9.559 6.775 -54.289 1.00 33.14 H new ATOM 0 HG23 VAL A 46 -8.393 5.514 -53.823 1.00 33.14 H new ATOM 689 N THR A 47 -5.354 5.651 -55.613 1.00 20.33 N ATOM 690 CA THR A 47 -4.727 4.346 -55.778 1.00 43.45 C ATOM 691 C THR A 47 -4.398 3.745 -54.410 1.00 3.34 C ATOM 692 O THR A 47 -3.470 4.193 -53.714 1.00 53.32 O ATOM 693 CB THR A 47 -3.442 4.463 -56.626 1.00 31.33 C ATOM 694 OG1 THR A 47 -3.737 5.123 -57.866 1.00 10.14 O ATOM 695 CG2 THR A 47 -2.836 3.094 -56.909 1.00 54.21 C ATOM 0 H THR A 47 -4.703 6.393 -55.355 1.00 20.33 H new ATOM 0 HA THR A 47 -5.426 3.690 -56.297 1.00 43.45 H new ATOM 0 HB THR A 47 -2.717 5.046 -56.059 1.00 31.33 H new ATOM 0 HG1 THR A 47 -2.970 5.042 -58.470 1.00 10.14 H new ATOM 0 HG21 THR A 47 -1.933 3.213 -57.508 1.00 54.21 H new ATOM 0 HG22 THR A 47 -2.585 2.605 -55.967 1.00 54.21 H new ATOM 0 HG23 THR A 47 -3.556 2.483 -57.454 1.00 54.21 H new ATOM 703 N VAL A 48 -5.156 2.722 -54.035 1.00 1.43 N ATOM 704 CA VAL A 48 -5.072 2.134 -52.705 1.00 41.03 C ATOM 705 C VAL A 48 -4.832 0.633 -52.796 1.00 2.14 C ATOM 706 O VAL A 48 -4.752 0.074 -53.881 1.00 5.01 O ATOM 707 CB VAL A 48 -6.372 2.382 -51.902 1.00 25.31 C ATOM 708 CG1 VAL A 48 -6.706 3.871 -51.859 1.00 2.44 C ATOM 709 CG2 VAL A 48 -7.534 1.577 -52.485 1.00 31.14 C ATOM 0 H VAL A 48 -5.844 2.278 -54.643 1.00 1.43 H new ATOM 0 HA VAL A 48 -4.236 2.610 -52.192 1.00 41.03 H new ATOM 0 HB VAL A 48 -6.209 2.043 -50.879 1.00 25.31 H new ATOM 0 HG11 VAL A 48 -7.623 4.022 -51.290 1.00 2.44 H new ATOM 0 HG12 VAL A 48 -5.890 4.413 -51.382 1.00 2.44 H new ATOM 0 HG13 VAL A 48 -6.844 4.242 -52.874 1.00 2.44 H new ATOM 0 HG21 VAL A 48 -8.436 1.768 -51.904 1.00 31.14 H new ATOM 0 HG22 VAL A 48 -7.699 1.875 -53.520 1.00 31.14 H new ATOM 0 HG23 VAL A 48 -7.296 0.514 -52.447 1.00 31.14 H new ATOM 719 N HIS A 49 -4.701 -0.009 -51.652 1.00 0.12 N ATOM 720 CA HIS A 49 -4.640 -1.462 -51.578 1.00 21.40 C ATOM 721 C HIS A 49 -5.204 -1.910 -50.237 1.00 62.51 C ATOM 722 O HIS A 49 -5.194 -1.148 -49.277 1.00 12.42 O ATOM 723 CB HIS A 49 -3.198 -1.967 -51.758 1.00 65.53 C ATOM 724 CG HIS A 49 -3.082 -3.460 -51.691 1.00 3.22 C ATOM 725 ND1 HIS A 49 -3.109 -4.278 -52.803 1.00 4.14 N ATOM 726 CD2 HIS A 49 -2.984 -4.285 -50.626 1.00 44.34 C ATOM 727 CE1 HIS A 49 -3.044 -5.539 -52.416 1.00 71.41 C ATOM 728 NE2 HIS A 49 -2.967 -5.570 -51.099 1.00 60.41 N ATOM 0 H HIS A 49 -4.634 0.457 -50.747 1.00 0.12 H new ATOM 0 HA HIS A 49 -5.235 -1.887 -52.386 1.00 21.40 H new ATOM 0 HB2 HIS A 49 -2.817 -1.622 -52.719 1.00 65.53 H new ATOM 0 HB3 HIS A 49 -2.566 -1.525 -50.987 1.00 65.53 H new ATOM 0 HD1 HIS A 49 -3.170 -3.959 -53.770 1.00 4.14 H new ATOM 0 HD2 HIS A 49 -2.929 -3.986 -49.590 1.00 44.34 H new ATOM 0 HE1 HIS A 49 -3.052 -6.400 -53.068 1.00 71.41 H new ATOM 0 HE2 HIS A 49 -2.905 -6.412 -50.527 1.00 60.41 H new ATOM 737 N TYR A 50 -5.714 -3.132 -50.181 1.00 14.34 N ATOM 738 CA TYR A 50 -6.248 -3.686 -48.944 1.00 11.42 C ATOM 739 C TYR A 50 -5.740 -5.109 -48.735 1.00 70.24 C ATOM 740 O TYR A 50 -5.361 -5.783 -49.693 1.00 63.33 O ATOM 741 CB TYR A 50 -7.785 -3.657 -48.962 1.00 61.52 C ATOM 742 CG TYR A 50 -8.403 -4.332 -50.176 1.00 44.20 C ATOM 743 CD1 TYR A 50 -8.587 -3.630 -51.365 1.00 71.34 C ATOM 744 CD2 TYR A 50 -8.805 -5.663 -50.132 1.00 44.43 C ATOM 745 CE1 TYR A 50 -9.153 -4.234 -52.470 1.00 2.23 C ATOM 746 CE2 TYR A 50 -9.371 -6.273 -51.237 1.00 51.13 C ATOM 747 CZ TYR A 50 -9.541 -5.554 -52.404 1.00 62.13 C ATOM 748 OH TYR A 50 -10.105 -6.156 -53.506 1.00 33.15 O ATOM 0 H TYR A 50 -5.770 -3.762 -50.982 1.00 14.34 H new ATOM 0 HA TYR A 50 -5.903 -3.072 -48.112 1.00 11.42 H new ATOM 0 HB2 TYR A 50 -8.158 -4.143 -48.060 1.00 61.52 H new ATOM 0 HB3 TYR A 50 -8.119 -2.620 -48.927 1.00 61.52 H new ATOM 0 HD1 TYR A 50 -8.282 -2.596 -51.423 1.00 71.34 H new ATOM 0 HD2 TYR A 50 -8.673 -6.229 -49.221 1.00 44.43 H new ATOM 0 HE1 TYR A 50 -9.291 -3.674 -53.383 1.00 2.23 H new ATOM 0 HE2 TYR A 50 -9.679 -7.307 -51.187 1.00 51.13 H new ATOM 0 HH TYR A 50 -10.321 -7.088 -53.295 1.00 33.15 H new ATOM 758 N ASP A 51 -5.765 -5.560 -47.488 1.00 4.52 N ATOM 759 CA ASP A 51 -5.330 -6.917 -47.127 1.00 51.23 C ATOM 760 C ASP A 51 -6.353 -7.534 -46.175 1.00 52.23 C ATOM 761 O ASP A 51 -6.662 -6.964 -45.126 1.00 72.43 O ATOM 762 CB ASP A 51 -3.936 -6.895 -46.450 1.00 43.42 C ATOM 763 CG ASP A 51 -2.768 -7.189 -47.393 1.00 52.30 C ATOM 764 OD1 ASP A 51 -2.834 -6.829 -48.586 1.00 54.15 O ATOM 765 OD2 ASP A 51 -1.767 -7.787 -46.937 1.00 62.22 O ATOM 0 H ASP A 51 -6.085 -5.003 -46.695 1.00 4.52 H new ATOM 0 HA ASP A 51 -5.256 -7.513 -48.037 1.00 51.23 H new ATOM 0 HB2 ASP A 51 -3.782 -5.916 -45.996 1.00 43.42 H new ATOM 0 HB3 ASP A 51 -3.927 -7.626 -45.642 1.00 43.42 H new ATOM 770 N GLY A 52 -6.888 -8.692 -46.566 1.00 64.23 N ATOM 771 CA GLY A 52 -7.969 -9.324 -45.827 1.00 20.04 C ATOM 772 C GLY A 52 -7.479 -10.140 -44.647 1.00 41.33 C ATOM 773 O GLY A 52 -7.132 -11.315 -44.794 1.00 22.22 O ATOM 0 H GLY A 52 -6.586 -9.208 -47.393 1.00 64.23 H new ATOM 0 HA2 GLY A 52 -8.656 -8.556 -45.471 1.00 20.04 H new ATOM 0 HA3 GLY A 52 -8.533 -9.970 -46.500 1.00 20.04 H new ATOM 777 N ARG A 53 -7.462 -9.517 -43.476 1.00 44.32 N ATOM 778 CA ARG A 53 -7.016 -10.166 -42.251 1.00 1.42 C ATOM 779 C ARG A 53 -8.209 -10.495 -41.344 1.00 33.53 C ATOM 780 O ARG A 53 -9.131 -9.688 -41.175 1.00 63.13 O ATOM 781 CB ARG A 53 -6.016 -9.259 -41.517 1.00 71.31 C ATOM 782 CG ARG A 53 -5.401 -9.896 -40.278 1.00 52.10 C ATOM 783 CD ARG A 53 -4.422 -8.961 -39.579 1.00 42.02 C ATOM 784 NE ARG A 53 -3.290 -8.600 -40.438 1.00 21.24 N ATOM 785 CZ ARG A 53 -2.013 -8.837 -40.132 1.00 61.51 C ATOM 786 NH1 ARG A 53 -1.699 -9.536 -39.047 1.00 32.45 N ATOM 787 NH2 ARG A 53 -1.053 -8.392 -40.930 1.00 4.41 N ATOM 0 H ARG A 53 -7.757 -8.549 -43.349 1.00 44.32 H new ATOM 0 HA ARG A 53 -6.522 -11.102 -42.510 1.00 1.42 H new ATOM 0 HB2 ARG A 53 -5.218 -8.982 -42.206 1.00 71.31 H new ATOM 0 HB3 ARG A 53 -6.521 -8.337 -41.227 1.00 71.31 H new ATOM 0 HG2 ARG A 53 -6.193 -10.176 -39.584 1.00 52.10 H new ATOM 0 HG3 ARG A 53 -4.886 -10.814 -40.561 1.00 52.10 H new ATOM 0 HD2 ARG A 53 -4.945 -8.056 -39.270 1.00 42.02 H new ATOM 0 HD3 ARG A 53 -4.050 -9.439 -38.673 1.00 42.02 H new ATOM 0 HE ARG A 53 -3.491 -8.139 -41.325 1.00 21.24 H new ATOM 0 HH11 ARG A 53 -2.436 -9.896 -38.441 1.00 32.45 H new ATOM 0 HH12 ARG A 53 -0.720 -9.713 -38.820 1.00 32.45 H new ATOM 0 HH21 ARG A 53 -1.292 -7.871 -41.774 1.00 4.41 H new ATOM 0 HH22 ARG A 53 -0.075 -8.571 -40.700 1.00 4.41 H new ATOM 801 N PHE A 54 -8.184 -11.687 -40.766 1.00 54.13 N ATOM 802 CA PHE A 54 -9.235 -12.127 -39.858 1.00 71.03 C ATOM 803 C PHE A 54 -9.037 -11.481 -38.484 1.00 14.50 C ATOM 804 O PHE A 54 -7.913 -11.117 -38.135 1.00 62.12 O ATOM 805 CB PHE A 54 -9.219 -13.659 -39.739 1.00 75.12 C ATOM 806 CG PHE A 54 -9.381 -14.371 -41.063 1.00 4.21 C ATOM 807 CD1 PHE A 54 -10.644 -14.633 -41.579 1.00 43.03 C ATOM 808 CD2 PHE A 54 -8.270 -14.774 -41.794 1.00 10.32 C ATOM 809 CE1 PHE A 54 -10.793 -15.281 -42.791 1.00 64.24 C ATOM 810 CE2 PHE A 54 -8.415 -15.420 -43.006 1.00 10.31 C ATOM 811 CZ PHE A 54 -9.679 -15.674 -43.505 1.00 33.43 C ATOM 0 H PHE A 54 -7.442 -12.372 -40.911 1.00 54.13 H new ATOM 0 HA PHE A 54 -10.203 -11.820 -40.253 1.00 71.03 H new ATOM 0 HB2 PHE A 54 -8.280 -13.970 -39.282 1.00 75.12 H new ATOM 0 HB3 PHE A 54 -10.019 -13.971 -39.068 1.00 75.12 H new ATOM 0 HD1 PHE A 54 -11.520 -14.327 -41.027 1.00 43.03 H new ATOM 0 HD2 PHE A 54 -7.280 -14.579 -41.409 1.00 10.32 H new ATOM 0 HE1 PHE A 54 -11.781 -15.480 -43.179 1.00 64.24 H new ATOM 0 HE2 PHE A 54 -7.542 -15.726 -43.563 1.00 10.31 H new ATOM 0 HZ PHE A 54 -9.795 -16.179 -44.452 1.00 33.43 H new ATOM 821 N PRO A 55 -10.118 -11.326 -37.686 1.00 32.51 N ATOM 822 CA PRO A 55 -10.032 -10.761 -36.326 1.00 12.25 C ATOM 823 C PRO A 55 -9.010 -11.501 -35.460 1.00 74.21 C ATOM 824 O PRO A 55 -8.478 -10.952 -34.493 1.00 2.34 O ATOM 825 CB PRO A 55 -11.451 -10.944 -35.770 1.00 42.22 C ATOM 826 CG PRO A 55 -12.325 -11.001 -36.977 1.00 14.43 C ATOM 827 CD PRO A 55 -11.508 -11.678 -38.045 1.00 41.45 C ATOM 0 HA PRO A 55 -9.700 -9.723 -36.333 1.00 12.25 H new ATOM 0 HB2 PRO A 55 -11.531 -11.857 -35.180 1.00 42.22 H new ATOM 0 HB3 PRO A 55 -11.730 -10.117 -35.117 1.00 42.22 H new ATOM 0 HG2 PRO A 55 -13.239 -11.559 -36.772 1.00 14.43 H new ATOM 0 HG3 PRO A 55 -12.625 -10.001 -37.290 1.00 14.43 H new ATOM 0 HD2 PRO A 55 -11.662 -12.757 -38.046 1.00 41.45 H new ATOM 0 HD3 PRO A 55 -11.770 -11.318 -39.040 1.00 41.45 H new ATOM 835 N ASP A 56 -8.746 -12.752 -35.832 1.00 72.30 N ATOM 836 CA ASP A 56 -7.743 -13.592 -35.169 1.00 2.21 C ATOM 837 C ASP A 56 -6.369 -12.917 -35.169 1.00 31.10 C ATOM 838 O ASP A 56 -5.519 -13.196 -34.319 1.00 51.45 O ATOM 839 CB ASP A 56 -7.654 -14.940 -35.897 1.00 33.21 C ATOM 840 CG ASP A 56 -6.710 -15.926 -35.223 1.00 3.34 C ATOM 841 OD1 ASP A 56 -7.153 -16.633 -34.290 1.00 1.05 O ATOM 842 OD2 ASP A 56 -5.533 -16.012 -35.633 1.00 33.45 O ATOM 0 H ASP A 56 -9.223 -13.216 -36.605 1.00 72.30 H new ATOM 0 HA ASP A 56 -8.047 -13.743 -34.133 1.00 2.21 H new ATOM 0 HB2 ASP A 56 -8.649 -15.381 -35.954 1.00 33.21 H new ATOM 0 HB3 ASP A 56 -7.321 -14.771 -36.921 1.00 33.21 H new ATOM 847 N GLY A 57 -6.169 -12.019 -36.130 1.00 5.43 N ATOM 848 CA GLY A 57 -4.890 -11.352 -36.292 1.00 3.42 C ATOM 849 C GLY A 57 -4.074 -11.981 -37.404 1.00 52.54 C ATOM 850 O GLY A 57 -2.984 -11.507 -37.739 1.00 13.40 O ATOM 0 H GLY A 57 -6.880 -11.740 -36.806 1.00 5.43 H new ATOM 0 HA2 GLY A 57 -5.054 -10.297 -36.511 1.00 3.42 H new ATOM 0 HA3 GLY A 57 -4.332 -11.401 -35.357 1.00 3.42 H new ATOM 854 N LYS A 58 -4.621 -13.041 -37.985 1.00 22.23 N ATOM 855 CA LYS A 58 -3.953 -13.805 -39.036 1.00 64.14 C ATOM 856 C LYS A 58 -4.663 -13.588 -40.374 1.00 44.42 C ATOM 857 O LYS A 58 -5.844 -13.236 -40.399 1.00 32.12 O ATOM 858 CB LYS A 58 -3.979 -15.295 -38.667 1.00 2.04 C ATOM 859 CG LYS A 58 -3.176 -16.200 -39.599 1.00 64.13 C ATOM 860 CD LYS A 58 -3.362 -17.675 -39.247 1.00 2.12 C ATOM 861 CE LYS A 58 -3.009 -17.968 -37.790 1.00 51.22 C ATOM 862 NZ LYS A 58 -1.578 -17.692 -37.491 1.00 12.14 N ATOM 0 H LYS A 58 -5.545 -13.398 -37.741 1.00 22.23 H new ATOM 0 HA LYS A 58 -2.921 -13.468 -39.130 1.00 64.14 H new ATOM 0 HB2 LYS A 58 -3.596 -15.410 -37.653 1.00 2.04 H new ATOM 0 HB3 LYS A 58 -5.015 -15.634 -38.657 1.00 2.04 H new ATOM 0 HG2 LYS A 58 -3.486 -16.029 -40.630 1.00 64.13 H new ATOM 0 HG3 LYS A 58 -2.119 -15.941 -39.537 1.00 64.13 H new ATOM 0 HD2 LYS A 58 -4.396 -17.964 -39.434 1.00 2.12 H new ATOM 0 HD3 LYS A 58 -2.738 -18.284 -39.900 1.00 2.12 H new ATOM 0 HE2 LYS A 58 -3.638 -17.363 -37.137 1.00 51.22 H new ATOM 0 HE3 LYS A 58 -3.230 -19.012 -37.567 1.00 51.22 H new ATOM 0 HZ1 LYS A 58 -1.377 -17.937 -36.501 1.00 12.14 H new ATOM 0 HZ2 LYS A 58 -0.976 -18.263 -38.118 1.00 12.14 H new ATOM 0 HZ3 LYS A 58 -1.380 -16.683 -37.645 1.00 12.14 H new ATOM 876 N GLN A 59 -3.944 -13.792 -41.474 1.00 62.31 N ATOM 877 CA GLN A 59 -4.536 -13.732 -42.811 1.00 30.32 C ATOM 878 C GLN A 59 -3.934 -14.820 -43.695 1.00 0.55 C ATOM 879 O GLN A 59 -2.889 -15.384 -43.368 1.00 71.44 O ATOM 880 CB GLN A 59 -4.339 -12.350 -43.458 1.00 41.23 C ATOM 881 CG GLN A 59 -2.884 -11.941 -43.679 1.00 10.35 C ATOM 882 CD GLN A 59 -2.764 -10.681 -44.528 1.00 72.33 C ATOM 883 OE1 GLN A 59 -3.599 -10.427 -45.393 1.00 24.21 O ATOM 884 NE2 GLN A 59 -1.731 -9.887 -44.289 1.00 55.00 N ATOM 0 H GLN A 59 -2.946 -14.001 -41.468 1.00 62.31 H new ATOM 0 HA GLN A 59 -5.609 -13.899 -42.711 1.00 30.32 H new ATOM 0 HB2 GLN A 59 -4.854 -12.339 -44.419 1.00 41.23 H new ATOM 0 HB3 GLN A 59 -4.820 -11.600 -42.830 1.00 41.23 H new ATOM 0 HG2 GLN A 59 -2.404 -11.774 -42.714 1.00 10.35 H new ATOM 0 HG3 GLN A 59 -2.349 -12.757 -44.165 1.00 10.35 H new ATOM 0 HE21 GLN A 59 -1.058 -10.131 -43.562 1.00 55.00 H new ATOM 0 HE22 GLN A 59 -1.609 -9.032 -44.831 1.00 55.00 H new ATOM 893 N PHE A 60 -4.603 -15.105 -44.809 1.00 4.41 N ATOM 894 CA PHE A 60 -4.186 -16.179 -45.711 1.00 50.42 C ATOM 895 C PHE A 60 -2.834 -15.872 -46.361 1.00 13.13 C ATOM 896 O PHE A 60 -1.945 -16.731 -46.396 1.00 51.22 O ATOM 897 CB PHE A 60 -5.261 -16.421 -46.788 1.00 41.42 C ATOM 898 CG PHE A 60 -5.580 -15.209 -47.643 1.00 61.13 C ATOM 899 CD1 PHE A 60 -6.409 -14.200 -47.163 1.00 40.54 C ATOM 900 CD2 PHE A 60 -5.056 -15.080 -48.925 1.00 12.31 C ATOM 901 CE1 PHE A 60 -6.705 -13.093 -47.940 1.00 73.53 C ATOM 902 CE2 PHE A 60 -5.350 -13.975 -49.704 1.00 10.14 C ATOM 903 CZ PHE A 60 -6.174 -12.981 -49.212 1.00 13.11 C ATOM 0 H PHE A 60 -5.440 -14.606 -45.111 1.00 4.41 H new ATOM 0 HA PHE A 60 -4.070 -17.087 -45.119 1.00 50.42 H new ATOM 0 HB2 PHE A 60 -4.930 -17.231 -47.438 1.00 41.42 H new ATOM 0 HB3 PHE A 60 -6.176 -16.757 -46.301 1.00 41.42 H new ATOM 0 HD1 PHE A 60 -6.827 -14.281 -46.171 1.00 40.54 H new ATOM 0 HD2 PHE A 60 -4.411 -15.852 -49.317 1.00 12.31 H new ATOM 0 HE1 PHE A 60 -7.350 -12.318 -47.553 1.00 73.53 H new ATOM 0 HE2 PHE A 60 -4.935 -13.889 -50.697 1.00 10.14 H new ATOM 0 HZ PHE A 60 -6.403 -12.118 -49.820 1.00 13.11 H new ATOM 913 N ASP A 61 -2.680 -14.648 -46.865 1.00 72.13 N ATOM 914 CA ASP A 61 -1.455 -14.234 -47.552 1.00 21.25 C ATOM 915 C ASP A 61 -1.483 -12.729 -47.799 1.00 45.30 C ATOM 916 O ASP A 61 -2.496 -12.199 -48.254 1.00 20.32 O ATOM 917 CB ASP A 61 -1.309 -14.988 -48.885 1.00 71.44 C ATOM 918 CG ASP A 61 -0.036 -14.632 -49.642 1.00 31.53 C ATOM 919 OD1 ASP A 61 1.067 -14.890 -49.115 1.00 42.41 O ATOM 920 OD2 ASP A 61 -0.128 -14.101 -50.773 1.00 45.10 O ATOM 0 H ASP A 61 -3.393 -13.921 -46.810 1.00 72.13 H new ATOM 0 HA ASP A 61 -0.599 -14.475 -46.922 1.00 21.25 H new ATOM 0 HB2 ASP A 61 -1.320 -16.061 -48.691 1.00 71.44 H new ATOM 0 HB3 ASP A 61 -2.171 -14.769 -49.515 1.00 71.44 H new ATOM 925 N SER A 62 -0.384 -12.048 -47.491 1.00 2.52 N ATOM 926 CA SER A 62 -0.311 -10.600 -47.651 1.00 22.13 C ATOM 927 C SER A 62 -0.309 -10.232 -49.134 1.00 22.13 C ATOM 928 O SER A 62 0.690 -10.430 -49.836 1.00 25.20 O ATOM 929 CB SER A 62 0.943 -10.049 -46.956 1.00 73.41 C ATOM 930 OG SER A 62 0.992 -8.631 -47.016 1.00 51.41 O ATOM 0 H SER A 62 0.468 -12.476 -47.129 1.00 2.52 H new ATOM 0 HA SER A 62 -1.188 -10.151 -47.185 1.00 22.13 H new ATOM 0 HB2 SER A 62 0.954 -10.370 -45.915 1.00 73.41 H new ATOM 0 HB3 SER A 62 1.834 -10.465 -47.427 1.00 73.41 H new ATOM 0 HG SER A 62 0.082 -8.270 -46.979 1.00 51.41 H new ATOM 936 N SER A 63 -1.430 -9.700 -49.610 1.00 2.54 N ATOM 937 CA SER A 63 -1.582 -9.386 -51.025 1.00 61.15 C ATOM 938 C SER A 63 -0.821 -8.108 -51.382 1.00 30.33 C ATOM 939 O SER A 63 -0.407 -7.924 -52.527 1.00 20.53 O ATOM 940 CB SER A 63 -3.065 -9.259 -51.398 1.00 5.12 C ATOM 941 OG SER A 63 -3.686 -8.182 -50.715 1.00 11.23 O ATOM 0 H SER A 63 -2.245 -9.478 -49.038 1.00 2.54 H new ATOM 0 HA SER A 63 -1.156 -10.207 -51.602 1.00 61.15 H new ATOM 0 HB2 SER A 63 -3.159 -9.110 -52.474 1.00 5.12 H new ATOM 0 HB3 SER A 63 -3.582 -10.188 -51.159 1.00 5.12 H new ATOM 0 HG SER A 63 -3.288 -8.087 -49.824 1.00 11.23 H new ATOM 947 N ARG A 64 -0.627 -7.224 -50.400 1.00 62.05 N ATOM 948 CA ARG A 64 0.114 -5.984 -50.631 1.00 51.31 C ATOM 949 C ARG A 64 1.551 -6.301 -51.037 1.00 11.31 C ATOM 950 O ARG A 64 2.163 -5.573 -51.817 1.00 41.21 O ATOM 951 CB ARG A 64 0.052 -5.052 -49.399 1.00 11.31 C ATOM 952 CG ARG A 64 0.865 -5.485 -48.175 1.00 31.34 C ATOM 953 CD ARG A 64 2.324 -5.036 -48.262 1.00 61.25 C ATOM 954 NE ARG A 64 2.443 -3.627 -48.656 1.00 63.21 N ATOM 955 CZ ARG A 64 3.593 -3.030 -48.971 1.00 44.35 C ATOM 956 NH1 ARG A 64 4.744 -3.679 -48.847 1.00 70.45 N ATOM 957 NH2 ARG A 64 3.592 -1.770 -49.385 1.00 74.42 N ATOM 0 H ARG A 64 -0.969 -7.343 -49.447 1.00 62.05 H new ATOM 0 HA ARG A 64 -0.357 -5.444 -51.453 1.00 51.31 H new ATOM 0 HB2 ARG A 64 0.392 -4.062 -49.702 1.00 11.31 H new ATOM 0 HB3 ARG A 64 -0.991 -4.952 -49.098 1.00 11.31 H new ATOM 0 HG2 ARG A 64 0.412 -5.070 -47.275 1.00 31.34 H new ATOM 0 HG3 ARG A 64 0.826 -6.570 -48.080 1.00 31.34 H new ATOM 0 HD2 ARG A 64 2.807 -5.184 -47.296 1.00 61.25 H new ATOM 0 HD3 ARG A 64 2.853 -5.660 -48.982 1.00 61.25 H new ATOM 0 HE ARG A 64 1.590 -3.068 -48.691 1.00 63.21 H new ATOM 0 HH11 ARG A 64 4.753 -4.641 -48.509 1.00 70.45 H new ATOM 0 HH12 ARG A 64 5.620 -3.216 -49.090 1.00 70.45 H new ATOM 0 HH21 ARG A 64 2.712 -1.259 -49.462 1.00 74.42 H new ATOM 0 HH22 ARG A 64 4.471 -1.312 -49.626 1.00 74.42 H new ATOM 971 N SER A 65 2.066 -7.415 -50.516 1.00 10.31 N ATOM 972 CA SER A 65 3.429 -7.862 -50.799 1.00 43.24 C ATOM 973 C SER A 65 3.627 -8.129 -52.301 1.00 30.11 C ATOM 974 O SER A 65 4.758 -8.268 -52.767 1.00 40.21 O ATOM 975 CB SER A 65 3.733 -9.134 -49.984 1.00 13.31 C ATOM 976 OG SER A 65 5.104 -9.497 -50.056 1.00 52.33 O ATOM 0 H SER A 65 1.551 -8.031 -49.887 1.00 10.31 H new ATOM 0 HA SER A 65 4.121 -7.071 -50.509 1.00 43.24 H new ATOM 0 HB2 SER A 65 3.455 -8.972 -48.943 1.00 13.31 H new ATOM 0 HB3 SER A 65 3.120 -9.956 -50.353 1.00 13.31 H new ATOM 0 HG SER A 65 5.256 -10.307 -49.525 1.00 52.33 H new ATOM 982 N ARG A 66 2.521 -8.197 -53.048 1.00 45.31 N ATOM 983 CA ARG A 66 2.566 -8.445 -54.491 1.00 14.00 C ATOM 984 C ARG A 66 2.944 -7.175 -55.256 1.00 1.23 C ATOM 985 O ARG A 66 3.327 -7.234 -56.426 1.00 33.32 O ATOM 986 CB ARG A 66 1.204 -8.966 -54.979 1.00 41.14 C ATOM 987 CG ARG A 66 0.766 -10.263 -54.306 1.00 42.33 C ATOM 988 CD ARG A 66 1.680 -11.427 -54.667 1.00 1.51 C ATOM 989 NE ARG A 66 1.631 -11.735 -56.098 1.00 14.23 N ATOM 990 CZ ARG A 66 2.367 -12.678 -56.692 1.00 13.50 C ATOM 991 NH1 ARG A 66 3.236 -13.400 -55.989 1.00 2.55 N ATOM 992 NH2 ARG A 66 2.226 -12.897 -57.994 1.00 75.44 N ATOM 0 H ARG A 66 1.579 -8.083 -52.674 1.00 45.31 H new ATOM 0 HA ARG A 66 3.330 -9.199 -54.682 1.00 14.00 H new ATOM 0 HB2 ARG A 66 0.448 -8.201 -54.801 1.00 41.14 H new ATOM 0 HB3 ARG A 66 1.250 -9.124 -56.057 1.00 41.14 H new ATOM 0 HG2 ARG A 66 0.761 -10.127 -53.225 1.00 42.33 H new ATOM 0 HG3 ARG A 66 -0.256 -10.499 -54.602 1.00 42.33 H new ATOM 0 HD2 ARG A 66 2.704 -11.186 -54.382 1.00 1.51 H new ATOM 0 HD3 ARG A 66 1.389 -12.308 -54.096 1.00 1.51 H new ATOM 0 HE ARG A 66 0.992 -11.193 -56.680 1.00 14.23 H new ATOM 0 HH11 ARG A 66 3.344 -13.235 -54.988 1.00 2.55 H new ATOM 0 HH12 ARG A 66 3.794 -14.118 -56.451 1.00 2.55 H new ATOM 0 HH21 ARG A 66 1.559 -12.347 -58.534 1.00 75.44 H new ATOM 0 HH22 ARG A 66 2.785 -13.616 -58.454 1.00 75.44 H new ATOM 1006 N GLY A 67 2.836 -6.028 -54.587 1.00 34.51 N ATOM 1007 CA GLY A 67 3.152 -4.756 -55.218 1.00 34.10 C ATOM 1008 C GLY A 67 2.141 -4.373 -56.281 1.00 63.33 C ATOM 1009 O GLY A 67 2.490 -3.764 -57.292 1.00 1.24 O ATOM 0 H GLY A 67 2.534 -5.957 -53.615 1.00 34.51 H new ATOM 0 HA2 GLY A 67 3.190 -3.976 -54.458 1.00 34.10 H new ATOM 0 HA3 GLY A 67 4.144 -4.812 -55.667 1.00 34.10 H new ATOM 1013 N LYS A 68 0.881 -4.732 -56.052 1.00 75.34 N ATOM 1014 CA LYS A 68 -0.190 -4.441 -57.001 1.00 45.14 C ATOM 1015 C LYS A 68 -1.392 -3.827 -56.273 1.00 23.21 C ATOM 1016 O LYS A 68 -2.019 -4.482 -55.431 1.00 4.34 O ATOM 1017 CB LYS A 68 -0.596 -5.726 -57.745 1.00 40.24 C ATOM 1018 CG LYS A 68 -1.693 -5.528 -58.793 1.00 60.33 C ATOM 1019 CD LYS A 68 -1.300 -4.540 -59.901 1.00 74.22 C ATOM 1020 CE LYS A 68 -0.185 -5.067 -60.810 1.00 64.14 C ATOM 1021 NZ LYS A 68 1.155 -5.036 -60.158 1.00 71.10 N ATOM 0 H LYS A 68 0.576 -5.227 -55.214 1.00 75.34 H new ATOM 0 HA LYS A 68 0.169 -3.718 -57.733 1.00 45.14 H new ATOM 0 HB2 LYS A 68 0.285 -6.143 -58.233 1.00 40.24 H new ATOM 0 HB3 LYS A 68 -0.935 -6.462 -57.016 1.00 40.24 H new ATOM 0 HG2 LYS A 68 -1.935 -6.491 -59.243 1.00 60.33 H new ATOM 0 HG3 LYS A 68 -2.597 -5.170 -58.300 1.00 60.33 H new ATOM 0 HD2 LYS A 68 -2.178 -4.315 -60.507 1.00 74.22 H new ATOM 0 HD3 LYS A 68 -0.977 -3.603 -59.446 1.00 74.22 H new ATOM 0 HE2 LYS A 68 -0.417 -6.090 -61.105 1.00 64.14 H new ATOM 0 HE3 LYS A 68 -0.154 -4.471 -61.722 1.00 64.14 H new ATOM 0 HZ1 LYS A 68 1.856 -4.653 -60.824 1.00 71.10 H new ATOM 0 HZ2 LYS A 68 1.115 -4.433 -59.312 1.00 71.10 H new ATOM 0 HZ3 LYS A 68 1.430 -6.001 -59.883 1.00 71.10 H new ATOM 1035 N PRO A 69 -1.702 -2.546 -56.554 1.00 1.43 N ATOM 1036 CA PRO A 69 -2.818 -1.840 -55.934 1.00 41.05 C ATOM 1037 C PRO A 69 -4.098 -1.865 -56.782 1.00 63.34 C ATOM 1038 O PRO A 69 -4.118 -2.398 -57.893 1.00 73.21 O ATOM 1039 CB PRO A 69 -2.260 -0.420 -55.842 1.00 65.54 C ATOM 1040 CG PRO A 69 -1.423 -0.266 -57.076 1.00 33.42 C ATOM 1041 CD PRO A 69 -0.966 -1.658 -57.476 1.00 34.41 C ATOM 0 HA PRO A 69 -3.124 -2.283 -54.986 1.00 41.05 H new ATOM 0 HB2 PRO A 69 -3.060 0.320 -55.810 1.00 65.54 H new ATOM 0 HB3 PRO A 69 -1.665 -0.285 -54.939 1.00 65.54 H new ATOM 0 HG2 PRO A 69 -1.999 0.197 -57.878 1.00 33.42 H new ATOM 0 HG3 PRO A 69 -0.567 0.381 -56.884 1.00 33.42 H new ATOM 0 HD2 PRO A 69 -1.206 -1.874 -58.517 1.00 34.41 H new ATOM 0 HD3 PRO A 69 0.112 -1.772 -57.367 1.00 34.41 H new ATOM 1049 N PHE A 70 -5.155 -1.284 -56.229 1.00 41.12 N ATOM 1050 CA PHE A 70 -6.434 -1.111 -56.910 1.00 52.04 C ATOM 1051 C PHE A 70 -6.819 0.367 -56.855 1.00 55.23 C ATOM 1052 O PHE A 70 -6.571 1.036 -55.850 1.00 31.10 O ATOM 1053 CB PHE A 70 -7.510 -1.975 -56.233 1.00 51.25 C ATOM 1054 CG PHE A 70 -8.898 -1.806 -56.810 1.00 44.01 C ATOM 1055 CD1 PHE A 70 -9.255 -2.434 -57.997 1.00 50.33 C ATOM 1056 CD2 PHE A 70 -9.845 -1.018 -56.166 1.00 54.02 C ATOM 1057 CE1 PHE A 70 -10.524 -2.278 -58.527 1.00 71.23 C ATOM 1058 CE2 PHE A 70 -11.114 -0.861 -56.693 1.00 42.20 C ATOM 1059 CZ PHE A 70 -11.453 -1.491 -57.874 1.00 20.44 C ATOM 0 H PHE A 70 -5.149 -0.913 -55.279 1.00 41.12 H new ATOM 0 HA PHE A 70 -6.351 -1.427 -57.950 1.00 52.04 H new ATOM 0 HB2 PHE A 70 -7.221 -3.023 -56.313 1.00 51.25 H new ATOM 0 HB3 PHE A 70 -7.539 -1.732 -55.171 1.00 51.25 H new ATOM 0 HD1 PHE A 70 -8.534 -3.051 -58.512 1.00 50.33 H new ATOM 0 HD2 PHE A 70 -9.586 -0.522 -55.242 1.00 54.02 H new ATOM 0 HE1 PHE A 70 -10.788 -2.771 -59.451 1.00 71.23 H new ATOM 0 HE2 PHE A 70 -11.839 -0.246 -56.181 1.00 42.20 H new ATOM 0 HZ PHE A 70 -12.443 -1.369 -58.287 1.00 20.44 H new ATOM 1069 N GLN A 71 -7.408 0.880 -57.928 1.00 45.33 N ATOM 1070 CA GLN A 71 -7.742 2.299 -58.007 1.00 52.35 C ATOM 1071 C GLN A 71 -9.256 2.493 -58.010 1.00 12.44 C ATOM 1072 O GLN A 71 -9.975 1.782 -58.713 1.00 73.44 O ATOM 1073 CB GLN A 71 -7.134 2.918 -59.274 1.00 41.45 C ATOM 1074 CG GLN A 71 -5.637 2.652 -59.435 1.00 24.22 C ATOM 1075 CD GLN A 71 -5.057 3.313 -60.673 1.00 52.53 C ATOM 1076 OE1 GLN A 71 -5.073 2.738 -61.762 1.00 33.44 O ATOM 1077 NE2 GLN A 71 -4.526 4.517 -60.520 1.00 75.03 N ATOM 0 H GLN A 71 -7.664 0.338 -58.753 1.00 45.33 H new ATOM 0 HA GLN A 71 -7.326 2.799 -57.132 1.00 52.35 H new ATOM 0 HB2 GLN A 71 -7.659 2.527 -60.146 1.00 41.45 H new ATOM 0 HB3 GLN A 71 -7.302 3.995 -59.257 1.00 41.45 H new ATOM 0 HG2 GLN A 71 -5.110 3.015 -58.553 1.00 24.22 H new ATOM 0 HG3 GLN A 71 -5.466 1.577 -59.488 1.00 24.22 H new ATOM 0 HE21 GLN A 71 -4.530 4.964 -59.603 1.00 75.03 H new ATOM 0 HE22 GLN A 71 -4.113 4.998 -61.319 1.00 75.03 H new ATOM 1086 N PHE A 72 -9.734 3.453 -57.224 1.00 73.33 N ATOM 1087 CA PHE A 72 -11.160 3.768 -57.177 1.00 2.55 C ATOM 1088 C PHE A 72 -11.352 5.242 -56.832 1.00 20.34 C ATOM 1089 O PHE A 72 -10.436 5.884 -56.323 1.00 61.22 O ATOM 1090 CB PHE A 72 -11.893 2.877 -56.155 1.00 25.13 C ATOM 1091 CG PHE A 72 -11.741 3.317 -54.716 1.00 43.44 C ATOM 1092 CD1 PHE A 72 -10.609 2.989 -53.985 1.00 1.40 C ATOM 1093 CD2 PHE A 72 -12.738 4.060 -54.096 1.00 73.40 C ATOM 1094 CE1 PHE A 72 -10.476 3.394 -52.669 1.00 5.31 C ATOM 1095 CE2 PHE A 72 -12.607 4.467 -52.782 1.00 1.11 C ATOM 1096 CZ PHE A 72 -11.476 4.133 -52.069 1.00 32.03 C ATOM 0 H PHE A 72 -9.156 4.027 -56.610 1.00 73.33 H new ATOM 0 HA PHE A 72 -11.589 3.571 -58.159 1.00 2.55 H new ATOM 0 HB2 PHE A 72 -12.954 2.856 -56.405 1.00 25.13 H new ATOM 0 HB3 PHE A 72 -11.523 1.856 -56.251 1.00 25.13 H new ATOM 0 HD1 PHE A 72 -9.823 2.411 -54.448 1.00 1.40 H new ATOM 0 HD2 PHE A 72 -13.628 4.323 -54.649 1.00 73.40 H new ATOM 0 HE1 PHE A 72 -9.589 3.132 -52.111 1.00 5.31 H new ATOM 0 HE2 PHE A 72 -13.390 5.046 -52.315 1.00 1.11 H new ATOM 0 HZ PHE A 72 -11.372 4.449 -51.042 1.00 32.03 H new ATOM 1106 N THR A 73 -12.531 5.776 -57.122 1.00 51.11 N ATOM 1107 CA THR A 73 -12.840 7.168 -56.823 1.00 1.20 C ATOM 1108 C THR A 73 -13.355 7.310 -55.391 1.00 62.13 C ATOM 1109 O THR A 73 -14.407 6.764 -55.047 1.00 74.23 O ATOM 1110 CB THR A 73 -13.886 7.722 -57.813 1.00 52.41 C ATOM 1111 OG1 THR A 73 -13.416 7.548 -59.157 1.00 54.54 O ATOM 1112 CG2 THR A 73 -14.172 9.200 -57.558 1.00 75.20 C ATOM 0 H THR A 73 -13.293 5.263 -57.566 1.00 51.11 H new ATOM 0 HA THR A 73 -11.921 7.745 -56.926 1.00 1.20 H new ATOM 0 HB THR A 73 -14.814 7.169 -57.667 1.00 52.41 H new ATOM 0 HG1 THR A 73 -13.627 8.347 -59.683 1.00 54.54 H new ATOM 0 HG21 THR A 73 -14.913 9.556 -58.274 1.00 75.20 H new ATOM 0 HG22 THR A 73 -14.555 9.327 -56.546 1.00 75.20 H new ATOM 0 HG23 THR A 73 -13.252 9.774 -57.672 1.00 75.20 H new ATOM 1120 N LEU A 74 -12.601 8.028 -54.563 1.00 41.42 N ATOM 1121 CA LEU A 74 -12.968 8.239 -53.166 1.00 2.01 C ATOM 1122 C LEU A 74 -14.267 9.038 -53.070 1.00 50.22 C ATOM 1123 O LEU A 74 -14.467 9.997 -53.822 1.00 44.43 O ATOM 1124 CB LEU A 74 -11.841 8.980 -52.430 1.00 4.02 C ATOM 1125 CG LEU A 74 -12.098 9.257 -50.938 1.00 75.13 C ATOM 1126 CD1 LEU A 74 -12.247 7.953 -50.158 1.00 51.31 C ATOM 1127 CD2 LEU A 74 -10.984 10.118 -50.350 1.00 40.31 C ATOM 0 H LEU A 74 -11.727 8.476 -54.838 1.00 41.42 H new ATOM 0 HA LEU A 74 -13.120 7.267 -52.697 1.00 2.01 H new ATOM 0 HB2 LEU A 74 -10.925 8.396 -52.521 1.00 4.02 H new ATOM 0 HB3 LEU A 74 -11.665 9.930 -52.934 1.00 4.02 H new ATOM 0 HG LEU A 74 -13.035 9.807 -50.852 1.00 75.13 H new ATOM 0 HD11 LEU A 74 -12.428 8.177 -49.107 1.00 51.31 H new ATOM 0 HD12 LEU A 74 -13.086 7.384 -50.558 1.00 51.31 H new ATOM 0 HD13 LEU A 74 -11.333 7.366 -50.252 1.00 51.31 H new ATOM 0 HD21 LEU A 74 -11.185 10.302 -49.295 1.00 40.31 H new ATOM 0 HD22 LEU A 74 -10.031 9.600 -50.453 1.00 40.31 H new ATOM 0 HD23 LEU A 74 -10.939 11.068 -50.882 1.00 40.31 H new ATOM 1139 N GLY A 75 -15.142 8.643 -52.148 1.00 21.12 N ATOM 1140 CA GLY A 75 -16.415 9.320 -51.983 1.00 51.53 C ATOM 1141 C GLY A 75 -17.440 8.852 -52.994 1.00 33.31 C ATOM 1142 O GLY A 75 -18.299 9.624 -53.432 1.00 41.10 O ATOM 0 H GLY A 75 -14.990 7.862 -51.510 1.00 21.12 H new ATOM 0 HA2 GLY A 75 -16.792 9.143 -50.976 1.00 51.53 H new ATOM 0 HA3 GLY A 75 -16.270 10.395 -52.085 1.00 51.53 H new ATOM 1146 N ALA A 76 -17.343 7.583 -53.370 1.00 23.41 N ATOM 1147 CA ALA A 76 -18.259 6.983 -54.332 1.00 10.02 C ATOM 1148 C ALA A 76 -18.458 5.509 -54.013 1.00 2.44 C ATOM 1149 O ALA A 76 -17.625 4.896 -53.343 1.00 74.43 O ATOM 1150 CB ALA A 76 -17.726 7.156 -55.752 1.00 13.12 C ATOM 0 H ALA A 76 -16.631 6.943 -53.019 1.00 23.41 H new ATOM 0 HA ALA A 76 -19.222 7.488 -54.263 1.00 10.02 H new ATOM 0 HB1 ALA A 76 -18.421 6.703 -56.459 1.00 13.12 H new ATOM 0 HB2 ALA A 76 -17.622 8.218 -55.975 1.00 13.12 H new ATOM 0 HB3 ALA A 76 -16.754 6.671 -55.837 1.00 13.12 H new ATOM 1156 N GLY A 77 -19.540 4.930 -54.522 1.00 45.30 N ATOM 1157 CA GLY A 77 -19.878 3.548 -54.219 1.00 54.35 C ATOM 1158 C GLY A 77 -19.032 2.537 -54.978 1.00 33.32 C ATOM 1159 O GLY A 77 -19.488 1.426 -55.260 1.00 54.41 O ATOM 0 H GLY A 77 -20.197 5.398 -55.146 1.00 45.30 H new ATOM 0 HA2 GLY A 77 -19.759 3.379 -53.149 1.00 54.35 H new ATOM 0 HA3 GLY A 77 -20.929 3.379 -54.453 1.00 54.35 H new ATOM 1163 N GLU A 78 -17.799 2.917 -55.308 1.00 32.55 N ATOM 1164 CA GLU A 78 -16.868 2.022 -55.989 1.00 75.44 C ATOM 1165 C GLU A 78 -16.577 0.817 -55.102 1.00 54.02 C ATOM 1166 O GLU A 78 -16.617 -0.335 -55.545 1.00 2.52 O ATOM 1167 CB GLU A 78 -15.558 2.760 -56.303 1.00 2.50 C ATOM 1168 CG GLU A 78 -15.748 4.111 -56.985 1.00 4.04 C ATOM 1169 CD GLU A 78 -16.527 4.011 -58.284 1.00 63.04 C ATOM 1170 OE1 GLU A 78 -15.920 3.679 -59.324 1.00 1.53 O ATOM 1171 OE2 GLU A 78 -17.749 4.261 -58.276 1.00 75.43 O ATOM 0 H GLU A 78 -17.421 3.844 -55.113 1.00 32.55 H new ATOM 0 HA GLU A 78 -17.318 1.687 -56.924 1.00 75.44 H new ATOM 0 HB2 GLU A 78 -15.007 2.909 -55.375 1.00 2.50 H new ATOM 0 HB3 GLU A 78 -14.942 2.127 -56.942 1.00 2.50 H new ATOM 0 HG2 GLU A 78 -16.269 4.786 -56.306 1.00 4.04 H new ATOM 0 HG3 GLU A 78 -14.772 4.552 -57.185 1.00 4.04 H new ATOM 1178 N VAL A 79 -16.300 1.112 -53.838 1.00 13.45 N ATOM 1179 CA VAL A 79 -16.009 0.098 -52.833 1.00 1.34 C ATOM 1180 C VAL A 79 -16.886 0.323 -51.608 1.00 20.50 C ATOM 1181 O VAL A 79 -17.667 1.276 -51.568 1.00 12.22 O ATOM 1182 CB VAL A 79 -14.519 0.123 -52.407 1.00 22.51 C ATOM 1183 CG1 VAL A 79 -13.602 -0.144 -53.600 1.00 2.53 C ATOM 1184 CG2 VAL A 79 -14.169 1.451 -51.739 1.00 32.01 C ATOM 0 H VAL A 79 -16.271 2.067 -53.480 1.00 13.45 H new ATOM 0 HA VAL A 79 -16.220 -0.876 -53.274 1.00 1.34 H new ATOM 0 HB VAL A 79 -14.364 -0.675 -51.681 1.00 22.51 H new ATOM 0 HG11 VAL A 79 -12.563 -0.121 -53.272 1.00 2.53 H new ATOM 0 HG12 VAL A 79 -13.828 -1.124 -54.020 1.00 2.53 H new ATOM 0 HG13 VAL A 79 -13.760 0.622 -54.359 1.00 2.53 H new ATOM 0 HG21 VAL A 79 -13.119 1.446 -51.448 1.00 32.01 H new ATOM 0 HG22 VAL A 79 -14.348 2.268 -52.438 1.00 32.01 H new ATOM 0 HG23 VAL A 79 -14.790 1.588 -50.854 1.00 32.01 H new ATOM 1194 N ILE A 80 -16.754 -0.553 -50.621 1.00 75.42 N ATOM 1195 CA ILE A 80 -17.515 -0.440 -49.383 1.00 23.41 C ATOM 1196 C ILE A 80 -17.057 0.780 -48.572 1.00 60.52 C ATOM 1197 O ILE A 80 -15.868 1.130 -48.573 1.00 13.14 O ATOM 1198 CB ILE A 80 -17.372 -1.724 -48.522 1.00 73.33 C ATOM 1199 CG1 ILE A 80 -15.894 -1.970 -48.162 1.00 72.25 C ATOM 1200 CG2 ILE A 80 -17.961 -2.926 -49.265 1.00 24.01 C ATOM 1201 CD1 ILE A 80 -15.664 -3.209 -47.323 1.00 43.25 C ATOM 0 H ILE A 80 -16.123 -1.354 -50.654 1.00 75.42 H new ATOM 0 HA ILE A 80 -18.564 -0.314 -49.651 1.00 23.41 H new ATOM 0 HB ILE A 80 -17.927 -1.588 -47.594 1.00 73.33 H new ATOM 0 HG12 ILE A 80 -15.315 -2.054 -49.082 1.00 72.25 H new ATOM 0 HG13 ILE A 80 -15.512 -1.103 -47.623 1.00 72.25 H new ATOM 0 HG21 ILE A 80 -17.855 -3.821 -48.651 1.00 24.01 H new ATOM 0 HG22 ILE A 80 -19.017 -2.747 -49.467 1.00 24.01 H new ATOM 0 HG23 ILE A 80 -17.431 -3.067 -50.207 1.00 24.01 H new ATOM 0 HD11 ILE A 80 -14.600 -3.313 -47.112 1.00 43.25 H new ATOM 0 HD12 ILE A 80 -16.213 -3.121 -46.386 1.00 43.25 H new ATOM 0 HD13 ILE A 80 -16.013 -4.087 -47.867 1.00 43.25 H new ATOM 1213 N LYS A 81 -18.004 1.418 -47.878 1.00 23.20 N ATOM 1214 CA LYS A 81 -17.709 2.598 -47.059 1.00 11.25 C ATOM 1215 C LYS A 81 -16.631 2.305 -46.021 1.00 2.21 C ATOM 1216 O LYS A 81 -16.007 3.226 -45.494 1.00 14.32 O ATOM 1217 CB LYS A 81 -18.979 3.111 -46.365 1.00 0.11 C ATOM 1218 CG LYS A 81 -19.916 3.885 -47.288 1.00 41.11 C ATOM 1219 CD LYS A 81 -19.261 5.161 -47.819 1.00 62.14 C ATOM 1220 CE LYS A 81 -20.195 5.947 -48.736 1.00 73.31 C ATOM 1221 NZ LYS A 81 -21.407 6.426 -48.017 1.00 30.33 N ATOM 0 H LYS A 81 -18.984 1.136 -47.867 1.00 23.20 H new ATOM 0 HA LYS A 81 -17.334 3.372 -47.729 1.00 11.25 H new ATOM 0 HB2 LYS A 81 -19.519 2.263 -45.943 1.00 0.11 H new ATOM 0 HB3 LYS A 81 -18.692 3.753 -45.532 1.00 0.11 H new ATOM 0 HG2 LYS A 81 -20.208 3.251 -48.125 1.00 41.11 H new ATOM 0 HG3 LYS A 81 -20.828 4.141 -46.749 1.00 41.11 H new ATOM 0 HD2 LYS A 81 -18.962 5.791 -46.981 1.00 62.14 H new ATOM 0 HD3 LYS A 81 -18.353 4.902 -48.363 1.00 62.14 H new ATOM 0 HE2 LYS A 81 -19.660 6.800 -49.154 1.00 73.31 H new ATOM 0 HE3 LYS A 81 -20.495 5.318 -49.574 1.00 73.31 H new ATOM 0 HZ1 LYS A 81 -21.920 7.105 -48.615 1.00 30.33 H new ATOM 0 HZ2 LYS A 81 -22.026 5.618 -47.803 1.00 30.33 H new ATOM 0 HZ3 LYS A 81 -21.124 6.890 -47.130 1.00 30.33 H new ATOM 1235 N GLY A 82 -16.432 1.028 -45.713 1.00 34.43 N ATOM 1236 CA GLY A 82 -15.345 0.644 -44.837 1.00 31.53 C ATOM 1237 C GLY A 82 -14.001 1.077 -45.394 1.00 11.44 C ATOM 1238 O GLY A 82 -13.263 1.830 -44.752 1.00 11.05 O ATOM 0 H GLY A 82 -17.003 0.255 -46.054 1.00 34.43 H new ATOM 0 HA2 GLY A 82 -15.494 1.091 -43.854 1.00 31.53 H new ATOM 0 HA3 GLY A 82 -15.352 -0.437 -44.700 1.00 31.53 H new ATOM 1242 N TRP A 83 -13.698 0.628 -46.611 1.00 20.04 N ATOM 1243 CA TRP A 83 -12.437 0.966 -47.265 1.00 54.32 C ATOM 1244 C TRP A 83 -12.412 2.445 -47.633 1.00 71.34 C ATOM 1245 O TRP A 83 -11.376 3.101 -47.527 1.00 52.20 O ATOM 1246 CB TRP A 83 -12.221 0.116 -48.525 1.00 1.15 C ATOM 1247 CG TRP A 83 -12.207 -1.367 -48.273 1.00 60.24 C ATOM 1248 CD1 TRP A 83 -11.982 -2.002 -47.084 1.00 62.11 C ATOM 1249 CD2 TRP A 83 -12.413 -2.400 -49.244 1.00 23.23 C ATOM 1250 NE1 TRP A 83 -12.052 -3.360 -47.256 1.00 5.04 N ATOM 1251 CE2 TRP A 83 -12.312 -3.631 -48.571 1.00 4.34 C ATOM 1252 CE3 TRP A 83 -12.682 -2.405 -50.616 1.00 42.12 C ATOM 1253 CZ2 TRP A 83 -12.464 -4.852 -49.222 1.00 13.44 C ATOM 1254 CZ3 TRP A 83 -12.834 -3.618 -51.261 1.00 3.14 C ATOM 1255 CH2 TRP A 83 -12.726 -4.827 -50.563 1.00 54.32 C ATOM 0 H TRP A 83 -14.310 0.028 -47.164 1.00 20.04 H new ATOM 0 HA TRP A 83 -11.630 0.755 -46.563 1.00 54.32 H new ATOM 0 HB2 TRP A 83 -13.009 0.344 -49.243 1.00 1.15 H new ATOM 0 HB3 TRP A 83 -11.276 0.404 -48.986 1.00 1.15 H new ATOM 0 HD1 TRP A 83 -11.779 -1.506 -46.146 1.00 62.11 H new ATOM 0 HE1 TRP A 83 -11.930 -4.057 -46.521 1.00 5.04 H new ATOM 0 HE3 TRP A 83 -12.769 -1.477 -51.162 1.00 42.12 H new ATOM 0 HZ2 TRP A 83 -12.378 -5.786 -48.686 1.00 13.44 H new ATOM 0 HZ3 TRP A 83 -13.040 -3.634 -52.321 1.00 3.14 H new ATOM 0 HH2 TRP A 83 -12.852 -5.758 -51.095 1.00 54.32 H new ATOM 1266 N ASP A 84 -13.564 2.957 -48.061 1.00 72.43 N ATOM 1267 CA ASP A 84 -13.693 4.363 -48.456 1.00 32.24 C ATOM 1268 C ASP A 84 -13.228 5.282 -47.325 1.00 32.32 C ATOM 1269 O ASP A 84 -12.322 6.098 -47.500 1.00 11.55 O ATOM 1270 CB ASP A 84 -15.155 4.668 -48.818 1.00 51.14 C ATOM 1271 CG ASP A 84 -15.370 6.086 -49.337 1.00 24.20 C ATOM 1272 OD1 ASP A 84 -15.488 7.021 -48.515 1.00 3.24 O ATOM 1273 OD2 ASP A 84 -15.451 6.264 -50.573 1.00 41.55 O ATOM 0 H ASP A 84 -14.426 2.419 -48.144 1.00 72.43 H new ATOM 0 HA ASP A 84 -13.063 4.543 -49.327 1.00 32.24 H new ATOM 0 HB2 ASP A 84 -15.489 3.958 -49.575 1.00 51.14 H new ATOM 0 HB3 ASP A 84 -15.779 4.513 -47.938 1.00 51.14 H new ATOM 1278 N GLN A 85 -13.818 5.103 -46.149 1.00 53.44 N ATOM 1279 CA GLN A 85 -13.478 5.920 -44.990 1.00 73.31 C ATOM 1280 C GLN A 85 -12.089 5.559 -44.470 1.00 50.41 C ATOM 1281 O GLN A 85 -11.342 6.426 -44.002 1.00 43.23 O ATOM 1282 CB GLN A 85 -14.533 5.749 -43.892 1.00 11.22 C ATOM 1283 CG GLN A 85 -15.925 6.199 -44.322 1.00 25.14 C ATOM 1284 CD GLN A 85 -16.984 5.958 -43.261 1.00 22.14 C ATOM 1285 OE1 GLN A 85 -17.243 6.815 -42.415 1.00 20.15 O ATOM 1286 NE2 GLN A 85 -17.605 4.789 -43.303 1.00 2.41 N ATOM 0 H GLN A 85 -14.535 4.399 -45.973 1.00 53.44 H new ATOM 0 HA GLN A 85 -13.464 6.967 -45.293 1.00 73.31 H new ATOM 0 HB2 GLN A 85 -14.572 4.701 -43.595 1.00 11.22 H new ATOM 0 HB3 GLN A 85 -14.229 6.318 -43.013 1.00 11.22 H new ATOM 0 HG2 GLN A 85 -15.898 7.261 -44.565 1.00 25.14 H new ATOM 0 HG3 GLN A 85 -16.206 5.671 -45.233 1.00 25.14 H new ATOM 0 HE21 GLN A 85 -17.360 4.107 -44.021 1.00 2.41 H new ATOM 0 HE22 GLN A 85 -18.328 4.571 -42.618 1.00 2.41 H new ATOM 1295 N GLY A 86 -11.745 4.275 -44.570 1.00 70.40 N ATOM 1296 CA GLY A 86 -10.430 3.813 -44.161 1.00 62.34 C ATOM 1297 C GLY A 86 -9.315 4.573 -44.856 1.00 13.43 C ATOM 1298 O GLY A 86 -8.381 5.054 -44.212 1.00 1.43 O ATOM 0 H GLY A 86 -12.359 3.544 -44.929 1.00 70.40 H new ATOM 0 HA2 GLY A 86 -10.326 3.925 -43.082 1.00 62.34 H new ATOM 0 HA3 GLY A 86 -10.335 2.750 -44.381 1.00 62.34 H new ATOM 1302 N VAL A 87 -9.406 4.679 -46.177 1.00 54.13 N ATOM 1303 CA VAL A 87 -8.424 5.430 -46.953 1.00 50.24 C ATOM 1304 C VAL A 87 -8.643 6.942 -46.807 1.00 54.40 C ATOM 1305 O VAL A 87 -7.692 7.722 -46.840 1.00 10.11 O ATOM 1306 CB VAL A 87 -8.441 5.027 -48.450 1.00 55.44 C ATOM 1307 CG1 VAL A 87 -8.196 3.525 -48.604 1.00 34.31 C ATOM 1308 CG2 VAL A 87 -9.749 5.434 -49.122 1.00 62.31 C ATOM 0 H VAL A 87 -10.149 4.255 -46.733 1.00 54.13 H new ATOM 0 HA VAL A 87 -7.442 5.180 -46.551 1.00 50.24 H new ATOM 0 HB VAL A 87 -7.634 5.563 -48.949 1.00 55.44 H new ATOM 0 HG11 VAL A 87 -8.211 3.260 -49.661 1.00 34.31 H new ATOM 0 HG12 VAL A 87 -7.225 3.269 -48.180 1.00 34.31 H new ATOM 0 HG13 VAL A 87 -8.977 2.973 -48.081 1.00 34.31 H new ATOM 0 HG21 VAL A 87 -9.727 5.137 -50.170 1.00 62.31 H new ATOM 0 HG22 VAL A 87 -10.583 4.942 -48.622 1.00 62.31 H new ATOM 0 HG23 VAL A 87 -9.872 6.515 -49.054 1.00 62.31 H new ATOM 1318 N ALA A 88 -9.900 7.349 -46.633 1.00 43.42 N ATOM 1319 CA ALA A 88 -10.238 8.766 -46.494 1.00 63.54 C ATOM 1320 C ALA A 88 -9.614 9.372 -45.233 1.00 61.41 C ATOM 1321 O ALA A 88 -9.274 10.559 -45.207 1.00 62.12 O ATOM 1322 CB ALA A 88 -11.751 8.957 -46.477 1.00 72.34 C ATOM 0 H ALA A 88 -10.701 6.719 -46.585 1.00 43.42 H new ATOM 0 HA ALA A 88 -9.825 9.288 -47.357 1.00 63.54 H new ATOM 0 HB1 ALA A 88 -11.983 10.017 -46.373 1.00 72.34 H new ATOM 0 HB2 ALA A 88 -12.176 8.582 -47.408 1.00 72.34 H new ATOM 0 HB3 ALA A 88 -12.178 8.408 -45.637 1.00 72.34 H new ATOM 1328 N THR A 89 -9.472 8.561 -44.186 1.00 71.10 N ATOM 1329 CA THR A 89 -8.934 9.043 -42.916 1.00 21.14 C ATOM 1330 C THR A 89 -7.398 9.081 -42.924 1.00 72.32 C ATOM 1331 O THR A 89 -6.788 9.664 -42.023 1.00 61.43 O ATOM 1332 CB THR A 89 -9.439 8.186 -41.719 1.00 10.23 C ATOM 1333 OG1 THR A 89 -9.090 8.809 -40.472 1.00 70.41 O ATOM 1334 CG2 THR A 89 -8.859 6.777 -41.753 1.00 23.35 C ATOM 0 H THR A 89 -9.721 7.572 -44.192 1.00 71.10 H new ATOM 0 HA THR A 89 -9.300 10.062 -42.791 1.00 21.14 H new ATOM 0 HB THR A 89 -10.523 8.118 -41.806 1.00 10.23 H new ATOM 0 HG1 THR A 89 -8.246 9.296 -40.574 1.00 70.41 H new ATOM 0 HG21 THR A 89 -9.234 6.209 -40.902 1.00 23.35 H new ATOM 0 HG22 THR A 89 -9.156 6.283 -42.678 1.00 23.35 H new ATOM 0 HG23 THR A 89 -7.771 6.830 -41.703 1.00 23.35 H new ATOM 1342 N MET A 90 -6.772 8.487 -43.944 1.00 23.21 N ATOM 1343 CA MET A 90 -5.303 8.444 -44.024 1.00 52.35 C ATOM 1344 C MET A 90 -4.780 9.459 -45.044 1.00 34.44 C ATOM 1345 O MET A 90 -5.537 10.292 -45.549 1.00 64.34 O ATOM 1346 CB MET A 90 -4.809 7.032 -44.389 1.00 2.44 C ATOM 1347 CG MET A 90 -5.106 6.613 -45.824 1.00 20.52 C ATOM 1348 SD MET A 90 -4.358 5.032 -46.259 1.00 33.02 S ATOM 1349 CE MET A 90 -5.029 3.983 -44.980 1.00 71.33 C ATOM 0 H MET A 90 -7.251 8.032 -44.721 1.00 23.21 H new ATOM 0 HA MET A 90 -4.914 8.705 -43.040 1.00 52.35 H new ATOM 0 HB2 MET A 90 -3.733 6.983 -44.224 1.00 2.44 H new ATOM 0 HB3 MET A 90 -5.268 6.313 -43.711 1.00 2.44 H new ATOM 0 HG2 MET A 90 -6.185 6.550 -45.963 1.00 20.52 H new ATOM 0 HG3 MET A 90 -4.741 7.382 -46.505 1.00 20.52 H new ATOM 0 HE1 MET A 90 -4.701 2.956 -45.142 1.00 71.33 H new ATOM 0 HE2 MET A 90 -4.678 4.326 -44.007 1.00 71.33 H new ATOM 0 HE3 MET A 90 -6.118 4.025 -45.009 1.00 71.33 H new ATOM 1359 N THR A 91 -3.477 9.397 -45.322 1.00 54.53 N ATOM 1360 CA THR A 91 -2.836 10.286 -46.289 1.00 60.53 C ATOM 1361 C THR A 91 -1.930 9.494 -47.240 1.00 4.54 C ATOM 1362 O THR A 91 -1.822 8.272 -47.127 1.00 62.15 O ATOM 1363 CB THR A 91 -2.019 11.393 -45.575 1.00 2.34 C ATOM 1364 OG1 THR A 91 -1.093 10.812 -44.645 1.00 75.53 O ATOM 1365 CG2 THR A 91 -2.937 12.367 -44.837 1.00 54.53 C ATOM 0 H THR A 91 -2.839 8.732 -44.885 1.00 54.53 H new ATOM 0 HA THR A 91 -3.624 10.762 -46.872 1.00 60.53 H new ATOM 0 HB THR A 91 -1.469 11.942 -46.339 1.00 2.34 H new ATOM 0 HG1 THR A 91 -1.573 10.211 -44.038 1.00 75.53 H new ATOM 0 HG21 THR A 91 -2.336 13.132 -44.346 1.00 54.53 H new ATOM 0 HG22 THR A 91 -3.614 12.839 -45.549 1.00 54.53 H new ATOM 0 HG23 THR A 91 -3.516 11.825 -44.089 1.00 54.53 H new ATOM 1373 N LEU A 92 -1.300 10.189 -48.187 1.00 74.01 N ATOM 1374 CA LEU A 92 -0.438 9.543 -49.178 1.00 25.41 C ATOM 1375 C LEU A 92 0.757 8.873 -48.495 1.00 32.24 C ATOM 1376 O LEU A 92 1.348 9.431 -47.558 1.00 31.23 O ATOM 1377 CB LEU A 92 0.025 10.585 -50.224 1.00 14.43 C ATOM 1378 CG LEU A 92 0.829 10.074 -51.442 1.00 74.12 C ATOM 1379 CD1 LEU A 92 2.295 9.807 -51.088 1.00 1.01 C ATOM 1380 CD2 LEU A 92 0.175 8.829 -52.032 1.00 24.41 C ATOM 0 H LEU A 92 -1.370 11.201 -48.289 1.00 74.01 H new ATOM 0 HA LEU A 92 -1.002 8.765 -49.692 1.00 25.41 H new ATOM 0 HB2 LEU A 92 -0.860 11.100 -50.599 1.00 14.43 H new ATOM 0 HB3 LEU A 92 0.633 11.329 -49.709 1.00 14.43 H new ATOM 0 HG LEU A 92 0.819 10.861 -52.196 1.00 74.12 H new ATOM 0 HD11 LEU A 92 2.823 9.450 -51.972 1.00 1.01 H new ATOM 0 HD12 LEU A 92 2.758 10.729 -50.736 1.00 1.01 H new ATOM 0 HD13 LEU A 92 2.348 9.052 -50.304 1.00 1.01 H new ATOM 0 HD21 LEU A 92 0.755 8.484 -52.888 1.00 24.41 H new ATOM 0 HD22 LEU A 92 0.141 8.044 -51.277 1.00 24.41 H new ATOM 0 HD23 LEU A 92 -0.839 9.068 -52.353 1.00 24.41 H new ATOM 1392 N GLY A 93 1.089 7.667 -48.969 1.00 34.21 N ATOM 1393 CA GLY A 93 2.238 6.937 -48.459 1.00 5.55 C ATOM 1394 C GLY A 93 1.999 6.382 -47.073 1.00 72.25 C ATOM 1395 O GLY A 93 2.945 6.140 -46.320 1.00 64.11 O ATOM 0 H GLY A 93 0.574 7.182 -49.704 1.00 34.21 H new ATOM 0 HA2 GLY A 93 2.476 6.119 -49.139 1.00 5.55 H new ATOM 0 HA3 GLY A 93 3.105 7.597 -48.439 1.00 5.55 H new ATOM 1399 N GLU A 94 0.729 6.173 -46.739 1.00 71.34 N ATOM 1400 CA GLU A 94 0.341 5.757 -45.399 1.00 13.03 C ATOM 1401 C GLU A 94 -0.409 4.426 -45.440 1.00 35.11 C ATOM 1402 O GLU A 94 -1.270 4.207 -46.294 1.00 11.33 O ATOM 1403 CB GLU A 94 -0.509 6.864 -44.756 1.00 33.44 C ATOM 1404 CG GLU A 94 -0.820 6.657 -43.279 1.00 42.11 C ATOM 1405 CD GLU A 94 -1.177 7.964 -42.583 1.00 1.35 C ATOM 1406 OE1 GLU A 94 -2.240 8.542 -42.890 1.00 1.51 O ATOM 1407 OE2 GLU A 94 -0.375 8.436 -41.747 1.00 22.02 O ATOM 0 H GLU A 94 -0.053 6.286 -47.385 1.00 71.34 H new ATOM 0 HA GLU A 94 1.233 5.602 -44.792 1.00 13.03 H new ATOM 0 HB2 GLU A 94 0.010 7.815 -44.873 1.00 33.44 H new ATOM 0 HB3 GLU A 94 -1.449 6.944 -45.303 1.00 33.44 H new ATOM 0 HG2 GLU A 94 -1.647 5.954 -43.178 1.00 42.11 H new ATOM 0 HG3 GLU A 94 0.042 6.208 -42.786 1.00 42.11 H new ATOM 1414 N LYS A 95 -0.044 3.535 -44.524 1.00 63.35 N ATOM 1415 CA LYS A 95 -0.657 2.215 -44.406 1.00 74.54 C ATOM 1416 C LYS A 95 -1.328 2.090 -43.043 1.00 2.34 C ATOM 1417 O LYS A 95 -0.700 2.347 -42.015 1.00 24.43 O ATOM 1418 CB LYS A 95 0.415 1.124 -44.566 1.00 62.30 C ATOM 1419 CG LYS A 95 -0.117 -0.303 -44.437 1.00 64.33 C ATOM 1420 CD LYS A 95 1.016 -1.327 -44.405 1.00 65.41 C ATOM 1421 CE LYS A 95 0.494 -2.759 -44.318 1.00 1.24 C ATOM 1422 NZ LYS A 95 -0.270 -3.148 -45.533 1.00 21.52 N ATOM 0 H LYS A 95 0.690 3.709 -43.838 1.00 63.35 H new ATOM 0 HA LYS A 95 -1.404 2.091 -45.190 1.00 74.54 H new ATOM 0 HB2 LYS A 95 0.888 1.236 -45.541 1.00 62.30 H new ATOM 0 HB3 LYS A 95 1.190 1.280 -43.816 1.00 62.30 H new ATOM 0 HG2 LYS A 95 -0.711 -0.389 -43.527 1.00 64.33 H new ATOM 0 HG3 LYS A 95 -0.781 -0.521 -45.273 1.00 64.33 H new ATOM 0 HD2 LYS A 95 1.628 -1.218 -45.301 1.00 65.41 H new ATOM 0 HD3 LYS A 95 1.663 -1.125 -43.551 1.00 65.41 H new ATOM 0 HE2 LYS A 95 1.332 -3.443 -44.182 1.00 1.24 H new ATOM 0 HE3 LYS A 95 -0.145 -2.859 -43.440 1.00 1.24 H new ATOM 0 HZ1 LYS A 95 -0.387 -4.181 -45.553 1.00 21.52 H new ATOM 0 HZ2 LYS A 95 -1.205 -2.694 -45.515 1.00 21.52 H new ATOM 0 HZ3 LYS A 95 0.248 -2.842 -46.381 1.00 21.52 H new ATOM 1436 N ALA A 96 -2.595 1.691 -43.028 1.00 20.50 N ATOM 1437 CA ALA A 96 -3.350 1.579 -41.786 1.00 55.24 C ATOM 1438 C ALA A 96 -4.163 0.288 -41.745 1.00 22.35 C ATOM 1439 O ALA A 96 -4.710 -0.150 -42.756 1.00 52.31 O ATOM 1440 CB ALA A 96 -4.266 2.785 -41.613 1.00 14.21 C ATOM 0 H ALA A 96 -3.122 1.439 -43.864 1.00 20.50 H new ATOM 0 HA ALA A 96 -2.637 1.553 -40.962 1.00 55.24 H new ATOM 0 HB1 ALA A 96 -4.824 2.688 -40.681 1.00 14.21 H new ATOM 0 HB2 ALA A 96 -3.667 3.695 -41.584 1.00 14.21 H new ATOM 0 HB3 ALA A 96 -4.963 2.835 -42.449 1.00 14.21 H new ATOM 1446 N LEU A 97 -4.220 -0.315 -40.568 1.00 62.33 N ATOM 1447 CA LEU A 97 -5.044 -1.489 -40.328 1.00 4.54 C ATOM 1448 C LEU A 97 -6.418 -1.030 -39.842 1.00 23.15 C ATOM 1449 O LEU A 97 -6.527 -0.411 -38.778 1.00 2.53 O ATOM 1450 CB LEU A 97 -4.347 -2.403 -39.295 1.00 62.35 C ATOM 1451 CG LEU A 97 -5.101 -3.687 -38.884 1.00 23.42 C ATOM 1452 CD1 LEU A 97 -4.114 -4.772 -38.453 1.00 52.33 C ATOM 1453 CD2 LEU A 97 -6.097 -3.407 -37.752 1.00 12.41 C ATOM 0 H LEU A 97 -3.695 -0.003 -39.751 1.00 62.33 H new ATOM 0 HA LEU A 97 -5.176 -2.065 -41.244 1.00 4.54 H new ATOM 0 HB2 LEU A 97 -3.376 -2.693 -39.697 1.00 62.35 H new ATOM 0 HB3 LEU A 97 -4.157 -1.817 -38.396 1.00 62.35 H new ATOM 0 HG LEU A 97 -5.659 -4.037 -39.752 1.00 23.42 H new ATOM 0 HD11 LEU A 97 -4.662 -5.670 -38.167 1.00 52.33 H new ATOM 0 HD12 LEU A 97 -3.444 -5.004 -39.281 1.00 52.33 H new ATOM 0 HD13 LEU A 97 -3.531 -4.417 -37.603 1.00 52.33 H new ATOM 0 HD21 LEU A 97 -6.612 -4.329 -37.484 1.00 12.41 H new ATOM 0 HD22 LEU A 97 -5.562 -3.025 -36.883 1.00 12.41 H new ATOM 0 HD23 LEU A 97 -6.826 -2.667 -38.083 1.00 12.41 H new ATOM 1465 N PHE A 98 -7.453 -1.304 -40.630 1.00 33.43 N ATOM 1466 CA PHE A 98 -8.800 -0.824 -40.328 1.00 22.33 C ATOM 1467 C PHE A 98 -9.761 -2.006 -40.191 1.00 65.01 C ATOM 1468 O PHE A 98 -9.893 -2.824 -41.104 1.00 52.24 O ATOM 1469 CB PHE A 98 -9.266 0.133 -41.443 1.00 14.23 C ATOM 1470 CG PHE A 98 -10.460 0.991 -41.081 1.00 54.22 C ATOM 1471 CD1 PHE A 98 -11.749 0.484 -41.151 1.00 1.45 C ATOM 1472 CD2 PHE A 98 -10.289 2.311 -40.680 1.00 54.43 C ATOM 1473 CE1 PHE A 98 -12.840 1.270 -40.829 1.00 61.40 C ATOM 1474 CE2 PHE A 98 -11.378 3.101 -40.358 1.00 53.50 C ATOM 1475 CZ PHE A 98 -12.653 2.580 -40.433 1.00 43.13 C ATOM 0 H PHE A 98 -7.386 -1.857 -41.484 1.00 33.43 H new ATOM 0 HA PHE A 98 -8.790 -0.283 -39.382 1.00 22.33 H new ATOM 0 HB2 PHE A 98 -8.436 0.785 -41.714 1.00 14.23 H new ATOM 0 HB3 PHE A 98 -9.512 -0.454 -42.328 1.00 14.23 H new ATOM 0 HD1 PHE A 98 -11.903 -0.539 -41.461 1.00 1.45 H new ATOM 0 HD2 PHE A 98 -9.293 2.725 -40.619 1.00 54.43 H new ATOM 0 HE1 PHE A 98 -13.837 0.860 -40.887 1.00 61.40 H new ATOM 0 HE2 PHE A 98 -11.230 4.125 -40.048 1.00 53.50 H new ATOM 0 HZ PHE A 98 -13.504 3.196 -40.182 1.00 43.13 H new ATOM 1485 N THR A 99 -10.413 -2.105 -39.039 1.00 0.52 N ATOM 1486 CA THR A 99 -11.379 -3.167 -38.800 1.00 41.40 C ATOM 1487 C THR A 99 -12.709 -2.816 -39.466 1.00 32.20 C ATOM 1488 O THR A 99 -13.414 -1.910 -39.020 1.00 23.33 O ATOM 1489 CB THR A 99 -11.597 -3.394 -37.288 1.00 71.14 C ATOM 1490 OG1 THR A 99 -10.335 -3.347 -36.604 1.00 32.31 O ATOM 1491 CG2 THR A 99 -12.262 -4.740 -37.026 1.00 45.34 C ATOM 0 H THR A 99 -10.290 -1.462 -38.257 1.00 0.52 H new ATOM 0 HA THR A 99 -10.985 -4.088 -39.230 1.00 41.40 H new ATOM 0 HB THR A 99 -12.251 -2.605 -36.917 1.00 71.14 H new ATOM 0 HG1 THR A 99 -9.961 -2.443 -36.669 1.00 32.31 H new ATOM 0 HG21 THR A 99 -12.403 -4.873 -35.953 1.00 45.34 H new ATOM 0 HG22 THR A 99 -13.230 -4.771 -37.526 1.00 45.34 H new ATOM 0 HG23 THR A 99 -11.629 -5.540 -37.411 1.00 45.34 H new ATOM 1499 N ILE A 100 -13.025 -3.515 -40.549 1.00 21.32 N ATOM 1500 CA ILE A 100 -14.238 -3.256 -41.316 1.00 55.40 C ATOM 1501 C ILE A 100 -15.438 -3.957 -40.677 1.00 14.24 C ATOM 1502 O ILE A 100 -15.525 -5.192 -40.694 1.00 1.33 O ATOM 1503 CB ILE A 100 -14.090 -3.736 -42.781 1.00 12.11 C ATOM 1504 CG1 ILE A 100 -12.830 -3.131 -43.422 1.00 60.11 C ATOM 1505 CG2 ILE A 100 -15.331 -3.371 -43.594 1.00 11.45 C ATOM 1506 CD1 ILE A 100 -12.860 -1.623 -43.545 1.00 2.12 C ATOM 0 H ILE A 100 -12.452 -4.273 -40.919 1.00 21.32 H new ATOM 0 HA ILE A 100 -14.401 -2.178 -41.313 1.00 55.40 H new ATOM 0 HB ILE A 100 -13.988 -4.821 -42.777 1.00 12.11 H new ATOM 0 HG12 ILE A 100 -11.961 -3.419 -42.830 1.00 60.11 H new ATOM 0 HG13 ILE A 100 -12.698 -3.563 -44.414 1.00 60.11 H new ATOM 0 HG21 ILE A 100 -15.208 -3.716 -44.620 1.00 11.45 H new ATOM 0 HG22 ILE A 100 -16.207 -3.847 -43.154 1.00 11.45 H new ATOM 0 HG23 ILE A 100 -15.464 -2.289 -43.589 1.00 11.45 H new ATOM 0 HD11 ILE A 100 -11.935 -1.277 -44.007 1.00 2.12 H new ATOM 0 HD12 ILE A 100 -13.707 -1.325 -44.163 1.00 2.12 H new ATOM 0 HD13 ILE A 100 -12.959 -1.179 -42.554 1.00 2.12 H new ATOM 1518 N PRO A 101 -16.372 -3.181 -40.095 1.00 5.44 N ATOM 1519 CA PRO A 101 -17.568 -3.735 -39.463 1.00 42.13 C ATOM 1520 C PRO A 101 -18.568 -4.254 -40.494 1.00 14.34 C ATOM 1521 O PRO A 101 -18.658 -3.733 -41.610 1.00 14.05 O ATOM 1522 CB PRO A 101 -18.142 -2.546 -38.683 1.00 51.24 C ATOM 1523 CG PRO A 101 -17.680 -1.345 -39.437 1.00 0.42 C ATOM 1524 CD PRO A 101 -16.331 -1.704 -40.006 1.00 24.24 C ATOM 0 HA PRO A 101 -17.345 -4.595 -38.831 1.00 42.13 H new ATOM 0 HB2 PRO A 101 -19.230 -2.591 -38.636 1.00 51.24 H new ATOM 0 HB3 PRO A 101 -17.779 -2.533 -37.655 1.00 51.24 H new ATOM 0 HG2 PRO A 101 -18.382 -1.089 -40.230 1.00 0.42 H new ATOM 0 HG3 PRO A 101 -17.608 -0.477 -38.782 1.00 0.42 H new ATOM 0 HD2 PRO A 101 -16.174 -1.248 -40.983 1.00 24.24 H new ATOM 0 HD3 PRO A 101 -15.521 -1.364 -39.361 1.00 24.24 H new ATOM 1532 N TYR A 102 -19.331 -5.267 -40.097 1.00 62.24 N ATOM 1533 CA TYR A 102 -20.299 -5.921 -40.976 1.00 42.32 C ATOM 1534 C TYR A 102 -21.282 -4.916 -41.598 1.00 55.45 C ATOM 1535 O TYR A 102 -21.793 -5.135 -42.695 1.00 63.25 O ATOM 1536 CB TYR A 102 -21.074 -6.988 -40.184 1.00 22.34 C ATOM 1537 CG TYR A 102 -21.859 -6.425 -39.009 1.00 74.23 C ATOM 1538 CD1 TYR A 102 -21.253 -6.230 -37.771 1.00 34.34 C ATOM 1539 CD2 TYR A 102 -23.200 -6.078 -39.141 1.00 52.43 C ATOM 1540 CE1 TYR A 102 -21.958 -5.707 -36.706 1.00 44.51 C ATOM 1541 CE2 TYR A 102 -23.912 -5.555 -38.078 1.00 11.43 C ATOM 1542 CZ TYR A 102 -23.285 -5.371 -36.863 1.00 3.53 C ATOM 1543 OH TYR A 102 -23.984 -4.841 -35.800 1.00 60.43 O ATOM 0 H TYR A 102 -19.297 -5.659 -39.156 1.00 62.24 H new ATOM 0 HA TYR A 102 -19.747 -6.388 -41.792 1.00 42.32 H new ATOM 0 HB2 TYR A 102 -21.761 -7.500 -40.857 1.00 22.34 H new ATOM 0 HB3 TYR A 102 -20.372 -7.736 -39.816 1.00 22.34 H new ATOM 0 HD1 TYR A 102 -20.213 -6.492 -37.642 1.00 34.34 H new ATOM 0 HD2 TYR A 102 -23.693 -6.220 -40.091 1.00 52.43 H new ATOM 0 HE1 TYR A 102 -21.471 -5.562 -35.753 1.00 44.51 H new ATOM 0 HE2 TYR A 102 -24.953 -5.292 -38.198 1.00 11.43 H new ATOM 0 HH TYR A 102 -24.907 -4.657 -36.074 1.00 60.43 H new ATOM 1553 N GLN A 103 -21.526 -3.813 -40.891 1.00 54.01 N ATOM 1554 CA GLN A 103 -22.508 -2.810 -41.321 1.00 73.14 C ATOM 1555 C GLN A 103 -21.956 -1.909 -42.430 1.00 73.11 C ATOM 1556 O GLN A 103 -22.721 -1.311 -43.193 1.00 64.20 O ATOM 1557 CB GLN A 103 -22.956 -1.961 -40.121 1.00 20.21 C ATOM 1558 CG GLN A 103 -21.807 -1.320 -39.347 1.00 52.32 C ATOM 1559 CD GLN A 103 -22.274 -0.447 -38.190 1.00 12.35 C ATOM 1560 OE1 GLN A 103 -23.423 -0.772 -37.615 1.00 44.32 O flip ATOM 1561 NE2 GLN A 103 -21.598 0.511 -37.815 1.00 41.41 N flip ATOM 0 H GLN A 103 -21.056 -3.588 -40.014 1.00 54.01 H new ATOM 0 HA GLN A 103 -23.367 -3.343 -41.728 1.00 73.14 H new ATOM 0 HB2 GLN A 103 -23.624 -1.176 -40.475 1.00 20.21 H new ATOM 0 HB3 GLN A 103 -23.533 -2.588 -39.441 1.00 20.21 H new ATOM 0 HG2 GLN A 103 -21.156 -2.104 -38.962 1.00 52.32 H new ATOM 0 HG3 GLN A 103 -21.210 -0.717 -40.030 1.00 52.32 H new ATOM 0 HE21 GLN A 103 -20.719 0.729 -38.283 1.00 41.41 H new ATOM 0 HE22 GLN A 103 -21.917 1.087 -37.036 1.00 41.41 H new ATOM 1570 N LEU A 104 -20.631 -1.822 -42.528 1.00 62.14 N ATOM 1571 CA LEU A 104 -19.979 -0.973 -43.531 1.00 32.30 C ATOM 1572 C LEU A 104 -19.381 -1.832 -44.639 1.00 63.52 C ATOM 1573 O LEU A 104 -18.471 -1.403 -45.356 1.00 31.32 O ATOM 1574 CB LEU A 104 -18.885 -0.108 -42.878 1.00 72.14 C ATOM 1575 CG LEU A 104 -19.386 0.955 -41.882 1.00 20.21 C ATOM 1576 CD1 LEU A 104 -18.215 1.743 -41.298 1.00 1.30 C ATOM 1577 CD2 LEU A 104 -20.383 1.897 -42.555 1.00 71.42 C ATOM 0 H LEU A 104 -19.984 -2.329 -41.925 1.00 62.14 H new ATOM 0 HA LEU A 104 -20.729 -0.312 -43.965 1.00 32.30 H new ATOM 0 HB2 LEU A 104 -18.187 -0.766 -42.360 1.00 72.14 H new ATOM 0 HB3 LEU A 104 -18.324 0.394 -43.667 1.00 72.14 H new ATOM 0 HG LEU A 104 -19.895 0.443 -41.066 1.00 20.21 H new ATOM 0 HD11 LEU A 104 -18.591 2.488 -40.597 1.00 1.30 H new ATOM 0 HD12 LEU A 104 -17.542 1.062 -40.777 1.00 1.30 H new ATOM 0 HD13 LEU A 104 -17.675 2.242 -42.103 1.00 1.30 H new ATOM 0 HD21 LEU A 104 -20.725 2.640 -41.835 1.00 71.42 H new ATOM 0 HD22 LEU A 104 -19.900 2.399 -43.393 1.00 71.42 H new ATOM 0 HD23 LEU A 104 -21.236 1.324 -42.918 1.00 71.42 H new ATOM 1589 N ALA A 105 -19.911 -3.043 -44.783 1.00 62.01 N ATOM 1590 CA ALA A 105 -19.414 -3.990 -45.771 1.00 15.02 C ATOM 1591 C ALA A 105 -20.449 -5.069 -46.064 1.00 14.10 C ATOM 1592 O ALA A 105 -21.576 -5.026 -45.568 1.00 75.53 O ATOM 1593 CB ALA A 105 -18.121 -4.630 -45.279 1.00 53.05 C ATOM 0 H ALA A 105 -20.689 -3.391 -44.223 1.00 62.01 H new ATOM 0 HA ALA A 105 -19.217 -3.445 -46.694 1.00 15.02 H new ATOM 0 HB1 ALA A 105 -17.758 -5.337 -46.025 1.00 53.05 H new ATOM 0 HB2 ALA A 105 -17.371 -3.856 -45.117 1.00 53.05 H new ATOM 0 HB3 ALA A 105 -18.309 -5.156 -44.343 1.00 53.05 H new ATOM 1599 N TYR A 106 -20.050 -6.039 -46.876 1.00 54.43 N ATOM 1600 CA TYR A 106 -20.889 -7.192 -47.189 1.00 22.33 C ATOM 1601 C TYR A 106 -20.829 -8.214 -46.053 1.00 52.22 C ATOM 1602 O TYR A 106 -21.521 -9.232 -46.086 1.00 2.43 O ATOM 1603 CB TYR A 106 -20.426 -7.839 -48.503 1.00 62.33 C ATOM 1604 CG TYR A 106 -18.981 -8.324 -48.474 1.00 72.41 C ATOM 1605 CD1 TYR A 106 -17.931 -7.464 -48.785 1.00 61.54 C ATOM 1606 CD2 TYR A 106 -18.668 -9.637 -48.126 1.00 15.41 C ATOM 1607 CE1 TYR A 106 -16.617 -7.897 -48.754 1.00 50.11 C ATOM 1608 CE2 TYR A 106 -17.357 -10.073 -48.091 1.00 43.13 C ATOM 1609 CZ TYR A 106 -16.336 -9.202 -48.406 1.00 60.03 C ATOM 1610 OH TYR A 106 -15.030 -9.634 -48.370 1.00 3.12 O ATOM 0 H TYR A 106 -19.139 -6.051 -47.336 1.00 54.43 H new ATOM 0 HA TYR A 106 -21.919 -6.855 -47.304 1.00 22.33 H new ATOM 0 HB2 TYR A 106 -21.078 -8.682 -48.731 1.00 62.33 H new ATOM 0 HB3 TYR A 106 -20.541 -7.118 -49.313 1.00 62.33 H new ATOM 0 HD1 TYR A 106 -18.146 -6.441 -49.055 1.00 61.54 H new ATOM 0 HD2 TYR A 106 -19.463 -10.325 -47.880 1.00 15.41 H new ATOM 0 HE1 TYR A 106 -15.815 -7.217 -49.001 1.00 50.11 H new ATOM 0 HE2 TYR A 106 -17.133 -11.094 -47.818 1.00 43.13 H new ATOM 0 HH TYR A 106 -15.005 -10.577 -48.106 1.00 3.12 H new ATOM 1620 N GLY A 107 -19.998 -7.921 -45.047 1.00 75.14 N ATOM 1621 CA GLY A 107 -19.766 -8.842 -43.942 1.00 10.44 C ATOM 1622 C GLY A 107 -21.034 -9.242 -43.213 1.00 30.53 C ATOM 1623 O GLY A 107 -21.082 -10.298 -42.583 1.00 60.22 O ATOM 0 H GLY A 107 -19.475 -7.048 -44.980 1.00 75.14 H new ATOM 0 HA2 GLY A 107 -19.277 -9.739 -44.323 1.00 10.44 H new ATOM 0 HA3 GLY A 107 -19.079 -8.381 -43.233 1.00 10.44 H new ATOM 1627 N GLU A 108 -22.056 -8.391 -43.289 1.00 42.23 N ATOM 1628 CA GLU A 108 -23.352 -8.687 -42.686 1.00 2.53 C ATOM 1629 C GLU A 108 -23.989 -9.881 -43.401 1.00 1.12 C ATOM 1630 O GLU A 108 -24.430 -10.840 -42.763 1.00 70.21 O ATOM 1631 CB GLU A 108 -24.264 -7.447 -42.764 1.00 42.32 C ATOM 1632 CG GLU A 108 -25.489 -7.481 -41.844 1.00 4.21 C ATOM 1633 CD GLU A 108 -26.552 -8.493 -42.261 1.00 31.05 C ATOM 1634 OE1 GLU A 108 -26.998 -8.444 -43.426 1.00 42.51 O ATOM 1635 OE2 GLU A 108 -26.965 -9.320 -41.420 1.00 64.21 O ATOM 0 H GLU A 108 -22.010 -7.489 -43.764 1.00 42.23 H new ATOM 0 HA GLU A 108 -23.216 -8.943 -41.635 1.00 2.53 H new ATOM 0 HB2 GLU A 108 -23.672 -6.564 -42.522 1.00 42.32 H new ATOM 0 HB3 GLU A 108 -24.605 -7.330 -43.793 1.00 42.32 H new ATOM 0 HG2 GLU A 108 -25.162 -7.710 -40.830 1.00 4.21 H new ATOM 0 HG3 GLU A 108 -25.938 -6.488 -41.818 1.00 4.21 H new ATOM 1642 N ARG A 109 -23.992 -9.821 -44.729 1.00 41.24 N ATOM 1643 CA ARG A 109 -24.612 -10.852 -45.558 1.00 2.14 C ATOM 1644 C ARG A 109 -23.712 -12.081 -45.666 1.00 64.15 C ATOM 1645 O ARG A 109 -24.116 -13.192 -45.313 1.00 50.12 O ATOM 1646 CB ARG A 109 -24.911 -10.292 -46.960 1.00 42.44 C ATOM 1647 CG ARG A 109 -25.407 -11.328 -47.975 1.00 24.32 C ATOM 1648 CD ARG A 109 -26.844 -11.780 -47.719 1.00 60.10 C ATOM 1649 NE ARG A 109 -27.012 -12.449 -46.427 1.00 12.51 N ATOM 1650 CZ ARG A 109 -27.255 -13.753 -46.274 1.00 71.52 C ATOM 1651 NH1 ARG A 109 -27.283 -14.566 -47.325 1.00 63.01 N ATOM 1652 NH2 ARG A 109 -27.457 -14.244 -45.059 1.00 72.20 N ATOM 0 H ARG A 109 -23.567 -9.061 -45.260 1.00 41.24 H new ATOM 0 HA ARG A 109 -25.547 -11.154 -45.085 1.00 2.14 H new ATOM 0 HB2 ARG A 109 -25.660 -9.506 -46.869 1.00 42.44 H new ATOM 0 HB3 ARG A 109 -24.006 -9.826 -47.350 1.00 42.44 H new ATOM 0 HG2 ARG A 109 -25.339 -10.907 -48.978 1.00 24.32 H new ATOM 0 HG3 ARG A 109 -24.749 -12.197 -47.949 1.00 24.32 H new ATOM 0 HD2 ARG A 109 -27.505 -10.914 -47.762 1.00 60.10 H new ATOM 0 HD3 ARG A 109 -27.153 -12.457 -48.515 1.00 60.10 H new ATOM 0 HE ARG A 109 -26.938 -11.879 -45.585 1.00 12.51 H new ATOM 0 HH11 ARG A 109 -27.118 -14.196 -48.261 1.00 63.01 H new ATOM 0 HH12 ARG A 109 -27.470 -15.560 -47.196 1.00 63.01 H new ATOM 0 HH21 ARG A 109 -27.426 -13.626 -44.248 1.00 72.20 H new ATOM 0 HH22 ARG A 109 -27.643 -15.239 -44.936 1.00 72.20 H new ATOM 1666 N GLY A 110 -22.486 -11.868 -46.134 1.00 51.44 N ATOM 1667 CA GLY A 110 -21.591 -12.975 -46.422 1.00 74.31 C ATOM 1668 C GLY A 110 -21.909 -13.613 -47.763 1.00 44.44 C ATOM 1669 O GLY A 110 -22.990 -13.396 -48.313 1.00 52.23 O ATOM 0 H GLY A 110 -22.095 -10.944 -46.320 1.00 51.44 H new ATOM 0 HA2 GLY A 110 -20.560 -12.621 -46.422 1.00 74.31 H new ATOM 0 HA3 GLY A 110 -21.671 -13.723 -45.634 1.00 74.31 H new ATOM 1673 N TYR A 111 -20.969 -14.382 -48.305 1.00 14.34 N ATOM 1674 CA TYR A 111 -21.171 -15.062 -49.589 1.00 51.25 C ATOM 1675 C TYR A 111 -20.513 -16.452 -49.581 1.00 15.01 C ATOM 1676 O TYR A 111 -21.197 -17.457 -49.777 1.00 51.22 O ATOM 1677 CB TYR A 111 -20.649 -14.215 -50.770 1.00 51.01 C ATOM 1678 CG TYR A 111 -21.416 -12.923 -51.013 1.00 1.55 C ATOM 1679 CD1 TYR A 111 -22.657 -12.934 -51.647 1.00 14.33 C ATOM 1680 CD2 TYR A 111 -20.896 -11.693 -50.619 1.00 62.24 C ATOM 1681 CE1 TYR A 111 -23.351 -11.760 -51.880 1.00 51.32 C ATOM 1682 CE2 TYR A 111 -21.588 -10.517 -50.848 1.00 42.35 C ATOM 1683 CZ TYR A 111 -22.813 -10.557 -51.478 1.00 75.40 C ATOM 1684 OH TYR A 111 -23.506 -9.389 -51.709 1.00 34.13 O ATOM 0 H TYR A 111 -20.058 -14.552 -47.878 1.00 14.34 H new ATOM 0 HA TYR A 111 -22.245 -15.191 -49.726 1.00 51.25 H new ATOM 0 HB2 TYR A 111 -19.602 -13.972 -50.590 1.00 51.01 H new ATOM 0 HB3 TYR A 111 -20.685 -14.819 -51.677 1.00 51.01 H new ATOM 0 HD1 TYR A 111 -23.084 -13.875 -51.962 1.00 14.33 H new ATOM 0 HD2 TYR A 111 -19.936 -11.656 -50.126 1.00 62.24 H new ATOM 0 HE1 TYR A 111 -24.311 -11.786 -52.375 1.00 51.32 H new ATOM 0 HE2 TYR A 111 -21.170 -9.572 -50.534 1.00 42.35 H new ATOM 0 HH TYR A 111 -22.991 -8.630 -51.364 1.00 34.13 H new ATOM 1694 N PRO A 112 -19.182 -16.552 -49.346 1.00 71.14 N ATOM 1695 CA PRO A 112 -18.507 -17.848 -49.305 1.00 74.05 C ATOM 1696 C PRO A 112 -18.651 -18.513 -47.932 1.00 44.53 C ATOM 1697 O PRO A 112 -18.564 -17.838 -46.906 1.00 35.22 O ATOM 1698 CB PRO A 112 -17.050 -17.475 -49.587 1.00 3.14 C ATOM 1699 CG PRO A 112 -16.891 -16.133 -48.957 1.00 55.31 C ATOM 1700 CD PRO A 112 -18.230 -15.441 -49.102 1.00 34.32 C ATOM 0 HA PRO A 112 -18.917 -18.569 -50.012 1.00 74.05 H new ATOM 0 HB2 PRO A 112 -16.362 -18.202 -49.156 1.00 3.14 H new ATOM 0 HB3 PRO A 112 -16.847 -17.440 -50.657 1.00 3.14 H new ATOM 0 HG2 PRO A 112 -16.612 -16.226 -47.908 1.00 55.31 H new ATOM 0 HG3 PRO A 112 -16.102 -15.563 -49.448 1.00 55.31 H new ATOM 0 HD2 PRO A 112 -18.490 -14.882 -48.203 1.00 34.32 H new ATOM 0 HD3 PRO A 112 -18.225 -14.731 -49.929 1.00 34.32 H new ATOM 1708 N PRO A 113 -18.854 -19.847 -47.892 1.00 75.52 N ATOM 1709 CA PRO A 113 -19.010 -20.595 -46.629 1.00 14.13 C ATOM 1710 C PRO A 113 -17.790 -20.470 -45.703 1.00 51.33 C ATOM 1711 O PRO A 113 -17.804 -20.967 -44.574 1.00 50.55 O ATOM 1712 CB PRO A 113 -19.189 -22.050 -47.092 1.00 71.32 C ATOM 1713 CG PRO A 113 -19.655 -21.948 -48.505 1.00 43.15 C ATOM 1714 CD PRO A 113 -18.975 -20.731 -49.067 1.00 14.23 C ATOM 0 HA PRO A 113 -19.844 -20.214 -46.039 1.00 14.13 H new ATOM 0 HB2 PRO A 113 -18.253 -22.604 -47.024 1.00 71.32 H new ATOM 0 HB3 PRO A 113 -19.916 -22.575 -46.473 1.00 71.32 H new ATOM 0 HG2 PRO A 113 -19.390 -22.841 -49.071 1.00 43.15 H new ATOM 0 HG3 PRO A 113 -20.739 -21.849 -48.554 1.00 43.15 H new ATOM 0 HD2 PRO A 113 -18.001 -20.973 -49.492 1.00 14.23 H new ATOM 0 HD3 PRO A 113 -19.563 -20.270 -49.860 1.00 14.23 H new ATOM 1722 N VAL A 114 -16.734 -19.826 -46.199 1.00 63.42 N ATOM 1723 CA VAL A 114 -15.527 -19.587 -45.412 1.00 23.21 C ATOM 1724 C VAL A 114 -15.714 -18.369 -44.500 1.00 74.31 C ATOM 1725 O VAL A 114 -15.129 -18.293 -43.416 1.00 2.15 O ATOM 1726 CB VAL A 114 -14.299 -19.356 -46.333 1.00 34.22 C ATOM 1727 CG1 VAL A 114 -13.009 -19.262 -45.519 1.00 33.32 C ATOM 1728 CG2 VAL A 114 -14.203 -20.455 -47.393 1.00 53.14 C ATOM 0 H VAL A 114 -16.692 -19.458 -47.150 1.00 63.42 H new ATOM 0 HA VAL A 114 -15.348 -20.472 -44.802 1.00 23.21 H new ATOM 0 HB VAL A 114 -14.436 -18.404 -46.845 1.00 34.22 H new ATOM 0 HG11 VAL A 114 -12.166 -19.100 -46.191 1.00 33.32 H new ATOM 0 HG12 VAL A 114 -13.080 -18.430 -44.819 1.00 33.32 H new ATOM 0 HG13 VAL A 114 -12.859 -20.189 -44.966 1.00 33.32 H new ATOM 0 HG21 VAL A 114 -13.336 -20.274 -48.028 1.00 53.14 H new ATOM 0 HG22 VAL A 114 -14.099 -21.424 -46.904 1.00 53.14 H new ATOM 0 HG23 VAL A 114 -15.106 -20.452 -48.003 1.00 53.14 H new ATOM 1738 N ILE A 115 -16.542 -17.428 -44.947 1.00 51.04 N ATOM 1739 CA ILE A 115 -16.779 -16.185 -44.220 1.00 15.41 C ATOM 1740 C ILE A 115 -18.209 -16.161 -43.674 1.00 5.40 C ATOM 1741 O ILE A 115 -19.168 -16.053 -44.442 1.00 35.31 O ATOM 1742 CB ILE A 115 -16.551 -14.946 -45.131 1.00 64.33 C ATOM 1743 CG1 ILE A 115 -15.123 -14.952 -45.713 1.00 53.33 C ATOM 1744 CG2 ILE A 115 -16.814 -13.653 -44.357 1.00 50.30 C ATOM 1745 CD1 ILE A 115 -14.026 -14.899 -44.666 1.00 54.20 C ATOM 0 H ILE A 115 -17.065 -17.505 -45.819 1.00 51.04 H new ATOM 0 HA ILE A 115 -16.069 -16.141 -43.394 1.00 15.41 H new ATOM 0 HB ILE A 115 -17.256 -14.998 -45.961 1.00 64.33 H new ATOM 0 HG12 ILE A 115 -14.992 -15.851 -46.316 1.00 53.33 H new ATOM 0 HG13 ILE A 115 -15.012 -14.100 -46.383 1.00 53.33 H new ATOM 0 HG21 ILE A 115 -16.649 -12.797 -45.012 1.00 50.30 H new ATOM 0 HG22 ILE A 115 -17.844 -13.645 -44.002 1.00 50.30 H new ATOM 0 HG23 ILE A 115 -16.136 -13.594 -43.505 1.00 50.30 H new ATOM 0 HD11 ILE A 115 -13.053 -14.907 -45.158 1.00 54.20 H new ATOM 0 HD12 ILE A 115 -14.128 -13.987 -44.078 1.00 54.20 H new ATOM 0 HD13 ILE A 115 -14.108 -15.765 -44.009 1.00 54.20 H new ATOM 1757 N PRO A 116 -18.373 -16.284 -42.343 1.00 1.54 N ATOM 1758 CA PRO A 116 -19.693 -16.256 -41.700 1.00 4.42 C ATOM 1759 C PRO A 116 -20.376 -14.893 -41.850 1.00 1.54 C ATOM 1760 O PRO A 116 -19.704 -13.864 -41.949 1.00 44.24 O ATOM 1761 CB PRO A 116 -19.386 -16.549 -40.216 1.00 0.11 C ATOM 1762 CG PRO A 116 -18.002 -17.111 -40.204 1.00 2.34 C ATOM 1763 CD PRO A 116 -17.293 -16.465 -41.360 1.00 73.41 C ATOM 0 HA PRO A 116 -20.380 -16.974 -42.149 1.00 4.42 H new ATOM 0 HB2 PRO A 116 -19.447 -15.642 -39.615 1.00 0.11 H new ATOM 0 HB3 PRO A 116 -20.102 -17.257 -39.798 1.00 0.11 H new ATOM 0 HG2 PRO A 116 -17.498 -16.891 -39.263 1.00 2.34 H new ATOM 0 HG3 PRO A 116 -18.019 -18.196 -40.311 1.00 2.34 H new ATOM 0 HD2 PRO A 116 -16.840 -15.515 -41.077 1.00 73.41 H new ATOM 0 HD3 PRO A 116 -16.494 -17.096 -41.748 1.00 73.41 H new ATOM 1771 N PRO A 117 -21.720 -14.872 -41.892 1.00 32.11 N ATOM 1772 CA PRO A 117 -22.494 -13.624 -41.952 1.00 23.42 C ATOM 1773 C PRO A 117 -22.354 -12.799 -40.670 1.00 61.41 C ATOM 1774 O PRO A 117 -22.097 -13.350 -39.595 1.00 22.34 O ATOM 1775 CB PRO A 117 -23.945 -14.103 -42.134 1.00 44.33 C ATOM 1776 CG PRO A 117 -23.834 -15.524 -42.576 1.00 52.33 C ATOM 1777 CD PRO A 117 -22.596 -16.055 -41.915 1.00 32.41 C ATOM 0 HA PRO A 117 -22.152 -12.969 -42.753 1.00 23.42 H new ATOM 0 HB2 PRO A 117 -24.506 -14.023 -41.203 1.00 44.33 H new ATOM 0 HB3 PRO A 117 -24.469 -13.500 -42.875 1.00 44.33 H new ATOM 0 HG2 PRO A 117 -24.713 -16.097 -42.280 1.00 52.33 H new ATOM 0 HG3 PRO A 117 -23.759 -15.593 -43.661 1.00 52.33 H new ATOM 0 HD2 PRO A 117 -22.800 -16.430 -40.912 1.00 32.41 H new ATOM 0 HD3 PRO A 117 -22.155 -16.877 -42.479 1.00 32.41 H new ATOM 1785 N LYS A 118 -22.534 -11.483 -40.793 1.00 12.23 N ATOM 1786 CA LYS A 118 -22.385 -10.552 -39.669 1.00 22.13 C ATOM 1787 C LYS A 118 -20.977 -10.628 -39.087 1.00 41.51 C ATOM 1788 O LYS A 118 -20.773 -10.425 -37.891 1.00 20.11 O ATOM 1789 CB LYS A 118 -23.445 -10.830 -38.591 1.00 64.12 C ATOM 1790 CG LYS A 118 -24.856 -10.435 -39.016 1.00 0.22 C ATOM 1791 CD LYS A 118 -25.915 -10.952 -38.050 1.00 12.22 C ATOM 1792 CE LYS A 118 -25.960 -12.473 -38.038 1.00 54.44 C ATOM 1793 NZ LYS A 118 -27.093 -12.986 -37.230 1.00 73.32 N ATOM 0 H LYS A 118 -22.787 -11.031 -41.672 1.00 12.23 H new ATOM 0 HA LYS A 118 -22.539 -9.539 -40.040 1.00 22.13 H new ATOM 0 HB2 LYS A 118 -23.431 -11.891 -38.343 1.00 64.12 H new ATOM 0 HB3 LYS A 118 -23.181 -10.287 -37.683 1.00 64.12 H new ATOM 0 HG2 LYS A 118 -24.924 -9.349 -39.079 1.00 0.22 H new ATOM 0 HG3 LYS A 118 -25.056 -10.825 -40.014 1.00 0.22 H new ATOM 0 HD2 LYS A 118 -25.704 -10.585 -37.046 1.00 12.22 H new ATOM 0 HD3 LYS A 118 -26.891 -10.560 -38.334 1.00 12.22 H new ATOM 0 HE2 LYS A 118 -26.047 -12.842 -39.060 1.00 54.44 H new ATOM 0 HE3 LYS A 118 -25.023 -12.861 -37.637 1.00 54.44 H new ATOM 0 HZ1 LYS A 118 -27.089 -14.026 -37.247 1.00 73.32 H new ATOM 0 HZ2 LYS A 118 -26.997 -12.655 -36.249 1.00 73.32 H new ATOM 0 HZ3 LYS A 118 -27.989 -12.637 -37.627 1.00 73.32 H new ATOM 1807 N ALA A 119 -20.006 -10.892 -39.950 1.00 25.12 N ATOM 1808 CA ALA A 119 -18.619 -11.018 -39.526 1.00 55.24 C ATOM 1809 C ALA A 119 -17.846 -9.731 -39.787 1.00 12.24 C ATOM 1810 O ALA A 119 -17.701 -9.301 -40.932 1.00 74.12 O ATOM 1811 CB ALA A 119 -17.949 -12.188 -40.232 1.00 71.50 C ATOM 0 H ALA A 119 -20.154 -11.023 -40.951 1.00 25.12 H new ATOM 0 HA ALA A 119 -18.613 -11.206 -38.452 1.00 55.24 H new ATOM 0 HB1 ALA A 119 -16.913 -12.267 -39.903 1.00 71.50 H new ATOM 0 HB2 ALA A 119 -18.478 -13.110 -39.990 1.00 71.50 H new ATOM 0 HB3 ALA A 119 -17.976 -12.026 -41.310 1.00 71.50 H new ATOM 1817 N THR A 120 -17.372 -9.111 -38.714 1.00 51.12 N ATOM 1818 CA THR A 120 -16.472 -7.976 -38.815 1.00 71.23 C ATOM 1819 C THR A 120 -15.083 -8.467 -39.236 1.00 20.24 C ATOM 1820 O THR A 120 -14.507 -9.347 -38.591 1.00 3.02 O ATOM 1821 CB THR A 120 -16.399 -7.222 -37.465 1.00 65.31 C ATOM 1822 OG1 THR A 120 -17.713 -6.784 -37.084 1.00 65.31 O ATOM 1823 CG2 THR A 120 -15.466 -6.019 -37.542 1.00 44.33 C ATOM 0 H THR A 120 -17.600 -9.380 -37.757 1.00 51.12 H new ATOM 0 HA THR A 120 -16.848 -7.283 -39.567 1.00 71.23 H new ATOM 0 HB THR A 120 -16.002 -7.911 -36.719 1.00 65.31 H new ATOM 0 HG1 THR A 120 -17.771 -6.736 -36.107 1.00 65.31 H new ATOM 0 HG21 THR A 120 -15.441 -5.515 -36.576 1.00 44.33 H new ATOM 0 HG22 THR A 120 -14.462 -6.353 -37.803 1.00 44.33 H new ATOM 0 HG23 THR A 120 -15.827 -5.327 -38.303 1.00 44.33 H new ATOM 1831 N LEU A 121 -14.555 -7.913 -40.325 1.00 2.41 N ATOM 1832 CA LEU A 121 -13.311 -8.408 -40.919 1.00 73.03 C ATOM 1833 C LEU A 121 -12.267 -7.291 -40.897 1.00 70.13 C ATOM 1834 O LEU A 121 -12.605 -6.125 -41.079 1.00 70.31 O ATOM 1835 CB LEU A 121 -13.590 -8.899 -42.358 1.00 5.25 C ATOM 1836 CG LEU A 121 -12.613 -9.945 -42.948 1.00 44.23 C ATOM 1837 CD1 LEU A 121 -11.257 -9.331 -43.285 1.00 63.11 C ATOM 1838 CD2 LEU A 121 -12.449 -11.130 -41.994 1.00 11.54 C ATOM 0 H LEU A 121 -14.968 -7.120 -40.816 1.00 2.41 H new ATOM 0 HA LEU A 121 -12.922 -9.250 -40.346 1.00 73.03 H new ATOM 0 HB2 LEU A 121 -14.594 -9.323 -42.382 1.00 5.25 H new ATOM 0 HB3 LEU A 121 -13.594 -8.031 -43.017 1.00 5.25 H new ATOM 0 HG LEU A 121 -13.047 -10.306 -43.881 1.00 44.23 H new ATOM 0 HD11 LEU A 121 -10.602 -10.099 -43.696 1.00 63.11 H new ATOM 0 HD12 LEU A 121 -11.390 -8.536 -44.019 1.00 63.11 H new ATOM 0 HD13 LEU A 121 -10.810 -8.919 -42.381 1.00 63.11 H new ATOM 0 HD21 LEU A 121 -11.758 -11.853 -42.428 1.00 11.54 H new ATOM 0 HD22 LEU A 121 -12.054 -10.778 -41.041 1.00 11.54 H new ATOM 0 HD23 LEU A 121 -13.417 -11.604 -41.833 1.00 11.54 H new ATOM 1850 N VAL A 122 -11.001 -7.643 -40.687 1.00 31.41 N ATOM 1851 CA VAL A 122 -9.953 -6.643 -40.522 1.00 43.23 C ATOM 1852 C VAL A 122 -9.206 -6.444 -41.834 1.00 70.11 C ATOM 1853 O VAL A 122 -8.494 -7.330 -42.287 1.00 44.44 O ATOM 1854 CB VAL A 122 -8.948 -7.063 -39.417 1.00 61.11 C ATOM 1855 CG1 VAL A 122 -7.853 -6.015 -39.251 1.00 50.24 C ATOM 1856 CG2 VAL A 122 -9.669 -7.311 -38.091 1.00 74.23 C ATOM 0 H VAL A 122 -10.678 -8.609 -40.627 1.00 31.41 H new ATOM 0 HA VAL A 122 -10.428 -5.708 -40.225 1.00 43.23 H new ATOM 0 HB VAL A 122 -8.478 -7.996 -39.726 1.00 61.11 H new ATOM 0 HG11 VAL A 122 -7.161 -6.332 -38.471 1.00 50.24 H new ATOM 0 HG12 VAL A 122 -7.313 -5.901 -40.191 1.00 50.24 H new ATOM 0 HG13 VAL A 122 -8.301 -5.061 -38.972 1.00 50.24 H new ATOM 0 HG21 VAL A 122 -8.944 -7.604 -37.332 1.00 74.23 H new ATOM 0 HG22 VAL A 122 -10.175 -6.399 -37.776 1.00 74.23 H new ATOM 0 HG23 VAL A 122 -10.402 -8.107 -38.219 1.00 74.23 H new ATOM 1866 N PHE A 123 -9.372 -5.284 -42.448 1.00 33.02 N ATOM 1867 CA PHE A 123 -8.714 -4.997 -43.714 1.00 14.15 C ATOM 1868 C PHE A 123 -7.606 -3.975 -43.528 1.00 24.01 C ATOM 1869 O PHE A 123 -7.844 -2.842 -43.095 1.00 14.25 O ATOM 1870 CB PHE A 123 -9.721 -4.501 -44.764 1.00 30.11 C ATOM 1871 CG PHE A 123 -10.504 -5.608 -45.437 1.00 10.14 C ATOM 1872 CD1 PHE A 123 -9.986 -6.262 -46.547 1.00 52.10 C ATOM 1873 CD2 PHE A 123 -11.755 -5.989 -44.969 1.00 51.11 C ATOM 1874 CE1 PHE A 123 -10.696 -7.269 -47.173 1.00 34.12 C ATOM 1875 CE2 PHE A 123 -12.469 -6.994 -45.594 1.00 23.22 C ATOM 1876 CZ PHE A 123 -11.938 -7.636 -46.697 1.00 24.21 C ATOM 0 H PHE A 123 -9.955 -4.527 -42.092 1.00 33.02 H new ATOM 0 HA PHE A 123 -8.274 -5.927 -44.074 1.00 14.15 H new ATOM 0 HB2 PHE A 123 -10.420 -3.814 -44.286 1.00 30.11 H new ATOM 0 HB3 PHE A 123 -9.186 -3.933 -45.526 1.00 30.11 H new ATOM 0 HD1 PHE A 123 -9.015 -5.980 -46.926 1.00 52.10 H new ATOM 0 HD2 PHE A 123 -12.175 -5.494 -44.106 1.00 51.11 H new ATOM 0 HE1 PHE A 123 -10.279 -7.769 -48.035 1.00 34.12 H new ATOM 0 HE2 PHE A 123 -13.442 -7.278 -45.221 1.00 23.22 H new ATOM 0 HZ PHE A 123 -12.494 -8.423 -47.185 1.00 24.21 H new ATOM 1886 N GLU A 124 -6.388 -4.389 -43.832 1.00 64.31 N ATOM 1887 CA GLU A 124 -5.265 -3.476 -43.877 1.00 51.31 C ATOM 1888 C GLU A 124 -5.367 -2.655 -45.152 1.00 24.30 C ATOM 1889 O GLU A 124 -5.198 -3.191 -46.247 1.00 64.22 O ATOM 1890 CB GLU A 124 -3.939 -4.241 -43.852 1.00 15.04 C ATOM 1891 CG GLU A 124 -3.714 -5.061 -42.588 1.00 23.21 C ATOM 1892 CD GLU A 124 -2.427 -5.866 -42.652 1.00 12.02 C ATOM 1893 OE1 GLU A 124 -1.335 -5.266 -42.568 1.00 32.21 O ATOM 1894 OE2 GLU A 124 -2.497 -7.105 -42.796 1.00 21.31 O ATOM 0 H GLU A 124 -6.154 -5.357 -44.052 1.00 64.31 H new ATOM 0 HA GLU A 124 -5.291 -2.825 -43.003 1.00 51.31 H new ATOM 0 HB2 GLU A 124 -3.900 -4.906 -44.715 1.00 15.04 H new ATOM 0 HB3 GLU A 124 -3.120 -3.530 -43.961 1.00 15.04 H new ATOM 0 HG2 GLU A 124 -3.683 -4.396 -41.725 1.00 23.21 H new ATOM 0 HG3 GLU A 124 -4.557 -5.736 -42.439 1.00 23.21 H new ATOM 1901 N VAL A 125 -5.688 -1.374 -45.004 1.00 22.33 N ATOM 1902 CA VAL A 125 -5.799 -0.464 -46.135 1.00 0.42 C ATOM 1903 C VAL A 125 -4.490 0.300 -46.309 1.00 41.00 C ATOM 1904 O VAL A 125 -3.773 0.551 -45.340 1.00 20.15 O ATOM 1905 CB VAL A 125 -6.990 0.522 -45.970 1.00 20.05 C ATOM 1906 CG1 VAL A 125 -8.318 -0.210 -46.156 1.00 34.15 C ATOM 1907 CG2 VAL A 125 -6.950 1.206 -44.605 1.00 11.44 C ATOM 0 H VAL A 125 -5.877 -0.940 -44.100 1.00 22.33 H new ATOM 0 HA VAL A 125 -5.995 -1.057 -47.029 1.00 0.42 H new ATOM 0 HB VAL A 125 -6.901 1.290 -46.738 1.00 20.05 H new ATOM 0 HG11 VAL A 125 -9.141 0.494 -46.037 1.00 34.15 H new ATOM 0 HG12 VAL A 125 -8.356 -0.648 -47.154 1.00 34.15 H new ATOM 0 HG13 VAL A 125 -8.406 -1.000 -45.410 1.00 34.15 H new ATOM 0 HG21 VAL A 125 -7.794 1.890 -44.516 1.00 11.44 H new ATOM 0 HG22 VAL A 125 -7.009 0.453 -43.819 1.00 11.44 H new ATOM 0 HG23 VAL A 125 -6.019 1.764 -44.505 1.00 11.44 H new ATOM 1917 N GLU A 126 -4.178 0.650 -47.547 1.00 43.13 N ATOM 1918 CA GLU A 126 -2.864 1.179 -47.892 1.00 63.02 C ATOM 1919 C GLU A 126 -2.985 2.191 -49.036 1.00 75.21 C ATOM 1920 O GLU A 126 -3.469 1.854 -50.116 1.00 73.13 O ATOM 1921 CB GLU A 126 -1.975 -0.008 -48.295 1.00 51.44 C ATOM 1922 CG GLU A 126 -0.485 0.287 -48.367 1.00 43.20 C ATOM 1923 CD GLU A 126 0.326 -0.976 -48.614 1.00 3.30 C ATOM 1924 OE1 GLU A 126 0.345 -1.858 -47.727 1.00 33.31 O ATOM 1925 OE2 GLU A 126 0.937 -1.103 -49.691 1.00 32.43 O ATOM 0 H GLU A 126 -4.821 0.577 -48.336 1.00 43.13 H new ATOM 0 HA GLU A 126 -2.422 1.701 -47.043 1.00 63.02 H new ATOM 0 HB2 GLU A 126 -2.134 -0.817 -47.582 1.00 51.44 H new ATOM 0 HB3 GLU A 126 -2.303 -0.372 -49.269 1.00 51.44 H new ATOM 0 HG2 GLU A 126 -0.294 1.004 -49.165 1.00 43.20 H new ATOM 0 HG3 GLU A 126 -0.160 0.752 -47.436 1.00 43.20 H new ATOM 1932 N LEU A 127 -2.576 3.433 -48.781 1.00 44.31 N ATOM 1933 CA LEU A 127 -2.646 4.500 -49.783 1.00 71.21 C ATOM 1934 C LEU A 127 -1.337 4.540 -50.579 1.00 21.13 C ATOM 1935 O LEU A 127 -0.318 5.027 -50.081 1.00 72.31 O ATOM 1936 CB LEU A 127 -2.899 5.858 -49.086 1.00 2.35 C ATOM 1937 CG LEU A 127 -3.651 6.933 -49.907 1.00 62.44 C ATOM 1938 CD1 LEU A 127 -2.940 7.238 -51.224 1.00 31.13 C ATOM 1939 CD2 LEU A 127 -5.099 6.507 -50.154 1.00 41.12 C ATOM 0 H LEU A 127 -2.190 3.728 -47.884 1.00 44.31 H new ATOM 0 HA LEU A 127 -3.470 4.304 -50.469 1.00 71.21 H new ATOM 0 HB2 LEU A 127 -3.464 5.671 -48.173 1.00 2.35 H new ATOM 0 HB3 LEU A 127 -1.936 6.271 -48.787 1.00 2.35 H new ATOM 0 HG LEU A 127 -3.657 7.852 -49.321 1.00 62.44 H new ATOM 0 HD11 LEU A 127 -3.498 7.997 -51.772 1.00 31.13 H new ATOM 0 HD12 LEU A 127 -1.935 7.605 -51.018 1.00 31.13 H new ATOM 0 HD13 LEU A 127 -2.879 6.330 -51.823 1.00 31.13 H new ATOM 0 HD21 LEU A 127 -5.611 7.276 -50.733 1.00 41.12 H new ATOM 0 HD22 LEU A 127 -5.113 5.568 -50.707 1.00 41.12 H new ATOM 0 HD23 LEU A 127 -5.607 6.373 -49.199 1.00 41.12 H new ATOM 1951 N LEU A 128 -1.368 4.035 -51.816 1.00 14.43 N ATOM 1952 CA LEU A 128 -0.158 3.945 -52.635 1.00 30.41 C ATOM 1953 C LEU A 128 0.084 5.250 -53.387 1.00 2.23 C ATOM 1954 O LEU A 128 1.212 5.745 -53.446 1.00 15.42 O ATOM 1955 CB LEU A 128 -0.246 2.773 -53.634 1.00 73.21 C ATOM 1956 CG LEU A 128 -0.061 1.363 -53.043 1.00 25.15 C ATOM 1957 CD1 LEU A 128 1.284 1.239 -52.333 1.00 61.42 C ATOM 1958 CD2 LEU A 128 -1.209 1.007 -52.102 1.00 51.52 C ATOM 0 H LEU A 128 -2.212 3.685 -52.269 1.00 14.43 H new ATOM 0 HA LEU A 128 0.681 3.763 -51.963 1.00 30.41 H new ATOM 0 HB2 LEU A 128 -1.218 2.814 -54.126 1.00 73.21 H new ATOM 0 HB3 LEU A 128 0.509 2.923 -54.406 1.00 73.21 H new ATOM 0 HG LEU A 128 -0.072 0.652 -53.869 1.00 25.15 H new ATOM 0 HD11 LEU A 128 1.389 0.234 -51.925 1.00 61.42 H new ATOM 0 HD12 LEU A 128 2.089 1.428 -53.043 1.00 61.42 H new ATOM 0 HD13 LEU A 128 1.336 1.966 -51.523 1.00 61.42 H new ATOM 0 HD21 LEU A 128 -1.052 0.006 -51.699 1.00 51.52 H new ATOM 0 HD22 LEU A 128 -1.245 1.726 -51.284 1.00 51.52 H new ATOM 0 HD23 LEU A 128 -2.151 1.034 -52.650 1.00 51.52 H new ATOM 1970 N ALA A 129 -0.981 5.804 -53.956 1.00 4.43 N ATOM 1971 CA ALA A 129 -0.878 7.019 -54.755 1.00 1.24 C ATOM 1972 C ALA A 129 -2.233 7.707 -54.855 1.00 55.22 C ATOM 1973 O ALA A 129 -3.264 7.101 -54.561 1.00 1.51 O ATOM 1974 CB ALA A 129 -0.335 6.698 -56.145 1.00 14.11 C ATOM 0 H ALA A 129 -1.927 5.430 -53.878 1.00 4.43 H new ATOM 0 HA ALA A 129 -0.183 7.699 -54.263 1.00 1.24 H new ATOM 0 HB1 ALA A 129 -0.264 7.616 -56.729 1.00 14.11 H new ATOM 0 HB2 ALA A 129 0.654 6.248 -56.054 1.00 14.11 H new ATOM 0 HB3 ALA A 129 -1.006 6.000 -56.646 1.00 14.11 H new ATOM 1980 N VAL A 130 -2.228 8.967 -55.270 1.00 71.35 N ATOM 1981 CA VAL A 130 -3.458 9.727 -55.446 1.00 3.33 C ATOM 1982 C VAL A 130 -3.327 10.653 -56.666 1.00 10.44 C ATOM 1983 O VAL A 130 -2.862 11.800 -56.531 1.00 70.32 O ATOM 1984 CB VAL A 130 -3.850 10.511 -54.151 1.00 20.24 C ATOM 1985 CG1 VAL A 130 -2.678 11.328 -53.600 1.00 51.34 C ATOM 1986 CG2 VAL A 130 -5.071 11.404 -54.392 1.00 32.12 C ATOM 1987 OXT VAL A 130 -3.637 10.188 -57.782 1.00 0.00 O ATOM 0 H VAL A 130 -1.379 9.487 -55.492 1.00 71.35 H new ATOM 0 HA VAL A 130 -4.273 9.028 -55.633 1.00 3.33 H new ATOM 0 HB VAL A 130 -4.114 9.770 -53.397 1.00 20.24 H new ATOM 0 HG11 VAL A 130 -2.994 11.857 -52.701 1.00 51.34 H new ATOM 0 HG12 VAL A 130 -1.851 10.660 -53.357 1.00 51.34 H new ATOM 0 HG13 VAL A 130 -2.353 12.049 -54.350 1.00 51.34 H new ATOM 0 HG21 VAL A 130 -5.319 11.936 -53.474 1.00 32.12 H new ATOM 0 HG22 VAL A 130 -4.846 12.124 -55.179 1.00 32.12 H new ATOM 0 HG23 VAL A 130 -5.918 10.788 -54.695 1.00 32.12 H new TER 1997 VAL A 130