USER MOD reduce.3.24.130724 H: found=0, std=0, add=1218, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1215 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 89 TYR OH : rot 0:sc= 0.528 USER MOD Set 1.2: A 110 SER OG : rot 113:sc= 0.656 USER MOD Set 1.3: A 124 SER OG : rot -149:sc= 0.669 USER MOD Set 2.1: A 100 ASN : amide:sc= 0.483 K(o=1.4,f=-2.8) USER MOD Set 2.2: A 102 LYS NZ :NH3+ 155:sc= 0.91 (180deg=-0.134) USER MOD Set 3.1: A 99 ASN : amide:sc=-0.00335 K(o=0.7,f=-1.7) USER MOD Set 3.2: A 101 TYR OH : rot 86:sc= 0.707 USER MOD Set 4.1: A 72 ASN : amide:sc= -0.0766 X(o=-0.15,f=-0.43) USER MOD Set 4.2: A 74 ASN : amide:sc= -0.0776 X(o=-0.15,f=-0.43) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 4 TYR OH : rot -30:sc= -0.255 USER MOD Single : A 5 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 13 THR OG1 : rot 180:sc= 0.176 USER MOD Single : A 15 THR OG1 : rot 180:sc= 0.043 USER MOD Single : A 21 ASN : amide:sc= -1.13 K(o=-1.1,f=-4.3!) USER MOD Single : A 24 ASN : amide:sc= -0.393 K(o=-0.39,f=-2!) USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 34 CYS SG : rot -170:sc= -0.467 USER MOD Single : A 38 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 SER OG : rot 130:sc= 0 USER MOD Single : A 48 GLN : amide:sc= 1.21 K(o=1.2,f=-6.7!) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 HIS : no HD1:sc= -0.0739 X(o=-0.074,f=-0.0049) USER MOD Single : A 67 HIS : no HE2:sc= -0.732 K(o=-0.73,f=-2.2) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 GLN :FLIP amide:sc= -0.248 F(o=-0.79,f=-0.25) USER MOD Single : A 91 SER OG : rot 15:sc= 0.717 USER MOD Single : A 94 LYS NZ :NH3+ -109:sc= 1.18 (180deg=-0.943) USER MOD Single : A 97 ASN : amide:sc= -0.122 K(o=-0.12,f=-4.1!) USER MOD Single : A 103 SER OG : rot 42:sc= 0.39 USER MOD Single : A 111 THR OG1 : rot -131:sc= 0.578 USER MOD Single : A 115 SER OG : rot 93:sc= 1.41 USER MOD Single : A 117 ASN : amide:sc= -0.0906 K(o=-0.091,f=-2.2!) USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 THR OG1 : rot 180:sc= 0 USER MOD Single : A 123 GLN : amide:sc= -0.277 K(o=-0.28,f=-1.4) USER MOD Single : A 126 ASN : amide:sc= 0 X(o=0,f=-0.41) USER MOD Single : A 127 HIS : no HD1:sc= -0.0967 X(o=-0.097,f=0) USER MOD Single : A 130 THR OG1 : rot 79:sc= 0.816 USER MOD Single : A 134 THR OG1 : rot 180:sc= 0 USER MOD Single : A 135 THR OG1 : rot 54:sc= -1.03! USER MOD Single : A 142 TYR OH : rot 133:sc= -0.486 USER MOD Single : A 143 CYS SG : rot 43:sc= 0.169 USER MOD Single : A 146 LYS NZ :NH3+ -162:sc= 0 (180deg=-0.000319) USER MOD Single : A 147 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 150 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 151 THR OG1 : rot 84:sc= 0.705 USER MOD Single : A 153 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 25 N SER A 3 -14.311 -9.207 3.851 1.00 1.32 N ATOM 26 CA SER A 3 -14.694 -9.034 2.460 1.00 1.22 C ATOM 27 C SER A 3 -13.576 -8.316 1.702 1.00 1.04 C ATOM 28 O SER A 3 -12.858 -7.492 2.269 1.00 1.09 O ATOM 29 CB SER A 3 -16.005 -8.247 2.397 1.00 1.90 C ATOM 30 OG SER A 3 -17.089 -9.142 2.565 1.00 1.98 O ATOM 0 HA SER A 3 -14.849 -10.004 1.988 1.00 1.22 H new ATOM 0 HB2 SER A 3 -16.023 -7.483 3.175 1.00 1.90 H new ATOM 0 HB3 SER A 3 -16.088 -7.730 1.441 1.00 1.90 H new ATOM 0 HG SER A 3 -17.933 -8.645 2.528 1.00 1.98 H new ATOM 36 N TYR A 4 -13.446 -8.628 0.409 1.00 0.94 N ATOM 37 CA TYR A 4 -12.473 -8.053 -0.497 1.00 0.85 C ATOM 38 C TYR A 4 -13.273 -7.505 -1.671 1.00 0.81 C ATOM 39 O TYR A 4 -14.122 -8.225 -2.198 1.00 0.93 O ATOM 40 CB TYR A 4 -11.498 -9.135 -0.998 1.00 0.95 C ATOM 41 CG TYR A 4 -11.295 -10.319 -0.072 1.00 1.11 C ATOM 42 CD1 TYR A 4 -12.258 -11.346 -0.036 1.00 1.70 C ATOM 43 CD2 TYR A 4 -10.168 -10.385 0.766 1.00 2.15 C ATOM 44 CE1 TYR A 4 -12.125 -12.413 0.865 1.00 1.94 C ATOM 45 CE2 TYR A 4 -10.020 -11.461 1.656 1.00 2.41 C ATOM 46 CZ TYR A 4 -11.010 -12.468 1.730 1.00 1.81 C ATOM 47 OH TYR A 4 -10.899 -13.488 2.629 1.00 2.24 O ATOM 0 H TYR A 4 -14.045 -9.318 -0.044 1.00 0.94 H new ATOM 0 HA TYR A 4 -11.883 -7.280 -0.005 1.00 0.85 H new ATOM 0 HB2 TYR A 4 -11.858 -9.506 -1.958 1.00 0.95 H new ATOM 0 HB3 TYR A 4 -10.529 -8.669 -1.179 1.00 0.95 H new ATOM 0 HD1 TYR A 4 -13.104 -11.312 -0.706 1.00 1.70 H new ATOM 0 HD2 TYR A 4 -9.417 -9.609 0.725 1.00 2.15 H new ATOM 0 HE1 TYR A 4 -12.874 -13.191 0.897 1.00 1.94 H new ATOM 0 HE2 TYR A 4 -9.146 -11.520 2.287 1.00 2.41 H new ATOM 0 HH TYR A 4 -11.793 -13.788 2.895 1.00 2.24 H new ATOM 57 N HIS A 5 -13.010 -6.276 -2.107 1.00 0.80 N ATOM 58 CA HIS A 5 -13.735 -5.672 -3.210 1.00 0.84 C ATOM 59 C HIS A 5 -12.714 -5.038 -4.142 1.00 0.88 C ATOM 60 O HIS A 5 -12.027 -4.094 -3.769 1.00 1.24 O ATOM 61 CB HIS A 5 -14.727 -4.642 -2.664 1.00 0.90 C ATOM 62 CG HIS A 5 -15.927 -4.417 -3.545 1.00 1.06 C ATOM 63 ND1 HIS A 5 -17.230 -4.365 -3.103 1.00 1.39 N ATOM 64 CD2 HIS A 5 -15.942 -4.244 -4.905 1.00 1.04 C ATOM 65 CE1 HIS A 5 -18.013 -4.172 -4.177 1.00 1.50 C ATOM 66 NE2 HIS A 5 -17.275 -4.094 -5.296 1.00 1.29 N ATOM 0 H HIS A 5 -12.290 -5.676 -1.704 1.00 0.80 H new ATOM 0 HA HIS A 5 -14.310 -6.413 -3.764 1.00 0.84 H new ATOM 0 HB2 HIS A 5 -15.067 -4.967 -1.681 1.00 0.90 H new ATOM 0 HB3 HIS A 5 -14.209 -3.693 -2.524 1.00 0.90 H new ATOM 0 HD2 HIS A 5 -15.080 -4.227 -5.556 1.00 1.04 H new ATOM 0 HE1 HIS A 5 -19.089 -4.091 -4.145 1.00 1.50 H new ATOM 0 HE2 HIS A 5 -17.620 -3.953 -6.245 1.00 1.29 H new ATOM 74 N VAL A 6 -12.574 -5.570 -5.349 1.00 0.64 N ATOM 75 CA VAL A 6 -11.556 -5.079 -6.264 1.00 0.60 C ATOM 76 C VAL A 6 -12.194 -4.081 -7.226 1.00 0.59 C ATOM 77 O VAL A 6 -13.307 -4.317 -7.695 1.00 0.64 O ATOM 78 CB VAL A 6 -10.832 -6.255 -6.926 1.00 0.68 C ATOM 79 CG1 VAL A 6 -11.713 -7.077 -7.866 1.00 2.20 C ATOM 80 CG2 VAL A 6 -9.593 -5.784 -7.680 1.00 1.86 C ATOM 0 H VAL A 6 -13.146 -6.332 -5.713 1.00 0.64 H new ATOM 0 HA VAL A 6 -10.774 -4.532 -5.738 1.00 0.60 H new ATOM 0 HB VAL A 6 -10.544 -6.910 -6.103 1.00 0.68 H new ATOM 0 HG11 VAL A 6 -11.128 -7.890 -8.295 1.00 2.20 H new ATOM 0 HG12 VAL A 6 -12.554 -7.490 -7.309 1.00 2.20 H new ATOM 0 HG13 VAL A 6 -12.087 -6.438 -8.666 1.00 2.20 H new ATOM 0 HG21 VAL A 6 -9.099 -6.640 -8.140 1.00 1.86 H new ATOM 0 HG22 VAL A 6 -9.886 -5.075 -8.455 1.00 1.86 H new ATOM 0 HG23 VAL A 6 -8.907 -5.299 -6.986 1.00 1.86 H new ATOM 90 N VAL A 7 -11.538 -2.942 -7.470 1.00 0.59 N ATOM 91 CA VAL A 7 -12.086 -1.882 -8.301 1.00 0.64 C ATOM 92 C VAL A 7 -10.981 -1.326 -9.192 1.00 0.63 C ATOM 93 O VAL A 7 -9.972 -0.820 -8.702 1.00 0.83 O ATOM 94 CB VAL A 7 -12.703 -0.782 -7.418 1.00 0.79 C ATOM 95 CG1 VAL A 7 -13.216 0.394 -8.259 1.00 1.71 C ATOM 96 CG2 VAL A 7 -13.879 -1.325 -6.595 1.00 1.78 C ATOM 0 H VAL A 7 -10.613 -2.736 -7.094 1.00 0.59 H new ATOM 0 HA VAL A 7 -12.879 -2.278 -8.935 1.00 0.64 H new ATOM 0 HB VAL A 7 -11.909 -0.440 -6.754 1.00 0.79 H new ATOM 0 HG11 VAL A 7 -13.645 1.151 -7.602 1.00 1.71 H new ATOM 0 HG12 VAL A 7 -12.389 0.827 -8.821 1.00 1.71 H new ATOM 0 HG13 VAL A 7 -13.979 0.040 -8.952 1.00 1.71 H new ATOM 0 HG21 VAL A 7 -14.294 -0.525 -5.982 1.00 1.78 H new ATOM 0 HG22 VAL A 7 -14.649 -1.704 -7.267 1.00 1.78 H new ATOM 0 HG23 VAL A 7 -13.530 -2.132 -5.951 1.00 1.78 H new ATOM 106 N ARG A 8 -11.219 -1.309 -10.505 1.00 0.61 N ATOM 107 CA ARG A 8 -10.207 -0.877 -11.452 1.00 0.62 C ATOM 108 C ARG A 8 -10.229 0.637 -11.491 1.00 0.61 C ATOM 109 O ARG A 8 -11.007 1.243 -12.228 1.00 0.73 O ATOM 110 CB ARG A 8 -10.486 -1.480 -12.834 1.00 0.77 C ATOM 111 CG ARG A 8 -9.469 -1.031 -13.892 1.00 1.94 C ATOM 112 CD ARG A 8 -9.949 0.200 -14.675 1.00 3.10 C ATOM 113 NE ARG A 8 -9.559 0.129 -16.094 1.00 4.49 N ATOM 114 CZ ARG A 8 -10.255 0.674 -17.102 1.00 5.45 C ATOM 115 NH1 ARG A 8 -9.887 0.446 -18.365 1.00 7.07 N ATOM 116 NH2 ARG A 8 -11.313 1.445 -16.851 1.00 5.40 N ATOM 0 H ARG A 8 -12.103 -1.590 -10.929 1.00 0.61 H new ATOM 0 HA ARG A 8 -9.218 -1.219 -11.148 1.00 0.62 H new ATOM 0 HB2 ARG A 8 -10.472 -2.567 -12.761 1.00 0.77 H new ATOM 0 HB3 ARG A 8 -11.488 -1.195 -13.155 1.00 0.77 H new ATOM 0 HG2 ARG A 8 -8.520 -0.803 -13.407 1.00 1.94 H new ATOM 0 HG3 ARG A 8 -9.284 -1.851 -14.586 1.00 1.94 H new ATOM 0 HD2 ARG A 8 -11.033 0.279 -14.599 1.00 3.10 H new ATOM 0 HD3 ARG A 8 -9.531 1.102 -14.227 1.00 3.10 H new ATOM 0 HE ARG A 8 -8.700 -0.369 -16.326 1.00 4.49 H new ATOM 0 HH11 ARG A 8 -9.077 -0.142 -18.562 1.00 7.07 H new ATOM 0 HH12 ARG A 8 -10.416 0.860 -19.133 1.00 7.07 H new ATOM 0 HH21 ARG A 8 -11.597 1.623 -15.888 1.00 5.40 H new ATOM 0 HH22 ARG A 8 -11.838 1.857 -17.622 1.00 5.40 H new ATOM 130 N GLY A 9 -9.338 1.234 -10.712 1.00 0.62 N ATOM 131 CA GLY A 9 -9.116 2.657 -10.641 1.00 0.66 C ATOM 132 C GLY A 9 -7.633 2.869 -10.385 1.00 0.65 C ATOM 133 O GLY A 9 -6.809 2.033 -10.756 1.00 0.74 O ATOM 0 H GLY A 9 -8.726 0.709 -10.087 1.00 0.62 H new ATOM 0 HA2 GLY A 9 -9.419 3.140 -11.570 1.00 0.66 H new ATOM 0 HA3 GLY A 9 -9.711 3.100 -9.842 1.00 0.66 H new ATOM 137 N ASP A 10 -7.302 3.976 -9.733 1.00 0.75 N ATOM 138 CA ASP A 10 -5.939 4.443 -9.572 1.00 0.77 C ATOM 139 C ASP A 10 -5.833 5.025 -8.172 1.00 0.64 C ATOM 140 O ASP A 10 -6.839 5.360 -7.559 1.00 0.54 O ATOM 141 CB ASP A 10 -5.616 5.522 -10.618 1.00 0.89 C ATOM 142 CG ASP A 10 -5.668 4.993 -12.052 1.00 1.97 C ATOM 143 OD1 ASP A 10 -6.784 4.933 -12.618 1.00 3.32 O ATOM 144 OD2 ASP A 10 -4.579 4.669 -12.571 1.00 2.57 O ATOM 0 H ASP A 10 -7.992 4.585 -9.293 1.00 0.75 H new ATOM 0 HA ASP A 10 -5.231 3.626 -9.711 1.00 0.77 H new ATOM 0 HB2 ASP A 10 -6.323 6.345 -10.514 1.00 0.89 H new ATOM 0 HB3 ASP A 10 -4.623 5.927 -10.421 1.00 0.89 H new ATOM 149 N ILE A 11 -4.622 5.191 -7.647 1.00 0.68 N ATOM 150 CA ILE A 11 -4.444 5.737 -6.304 1.00 0.62 C ATOM 151 C ILE A 11 -4.954 7.173 -6.238 1.00 0.58 C ATOM 152 O ILE A 11 -5.522 7.593 -5.234 1.00 0.57 O ATOM 153 CB ILE A 11 -2.963 5.587 -5.904 1.00 0.81 C ATOM 154 CG1 ILE A 11 -2.553 4.098 -5.888 1.00 1.76 C ATOM 155 CG2 ILE A 11 -2.627 6.186 -4.534 1.00 1.86 C ATOM 156 CD1 ILE A 11 -1.250 3.830 -6.624 1.00 3.13 C ATOM 0 H ILE A 11 -3.753 4.957 -8.128 1.00 0.68 H new ATOM 0 HA ILE A 11 -5.038 5.183 -5.578 1.00 0.62 H new ATOM 0 HB ILE A 11 -2.406 6.143 -6.658 1.00 0.81 H new ATOM 0 HG12 ILE A 11 -2.455 3.766 -4.855 1.00 1.76 H new ATOM 0 HG13 ILE A 11 -3.347 3.504 -6.340 1.00 1.76 H new ATOM 0 HG21 ILE A 11 -1.567 6.041 -4.324 1.00 1.86 H new ATOM 0 HG22 ILE A 11 -2.854 7.252 -4.537 1.00 1.86 H new ATOM 0 HG23 ILE A 11 -3.221 5.691 -3.765 1.00 1.86 H new ATOM 0 HD11 ILE A 11 -1.017 2.766 -6.576 1.00 3.13 H new ATOM 0 HD12 ILE A 11 -1.352 4.133 -7.666 1.00 3.13 H new ATOM 0 HD13 ILE A 11 -0.445 4.399 -6.158 1.00 3.13 H new ATOM 168 N ALA A 12 -4.801 7.919 -7.327 1.00 0.67 N ATOM 169 CA ALA A 12 -5.273 9.292 -7.401 1.00 0.74 C ATOM 170 C ALA A 12 -6.803 9.372 -7.486 1.00 0.69 C ATOM 171 O ALA A 12 -7.355 10.466 -7.402 1.00 0.78 O ATOM 172 CB ALA A 12 -4.616 10.004 -8.588 1.00 0.92 C ATOM 0 H ALA A 12 -4.348 7.588 -8.179 1.00 0.67 H new ATOM 0 HA ALA A 12 -4.985 9.798 -6.479 1.00 0.74 H new ATOM 0 HB1 ALA A 12 -4.973 11.032 -8.639 1.00 0.92 H new ATOM 0 HB2 ALA A 12 -3.534 10.002 -8.460 1.00 0.92 H new ATOM 0 HB3 ALA A 12 -4.873 9.485 -9.511 1.00 0.92 H new ATOM 178 N THR A 13 -7.488 8.238 -7.661 1.00 0.60 N ATOM 179 CA THR A 13 -8.937 8.159 -7.768 1.00 0.61 C ATOM 180 C THR A 13 -9.514 7.138 -6.779 1.00 0.55 C ATOM 181 O THR A 13 -10.702 6.835 -6.840 1.00 0.63 O ATOM 182 CB THR A 13 -9.313 7.818 -9.219 1.00 0.70 C ATOM 183 OG1 THR A 13 -8.703 6.609 -9.621 1.00 0.67 O ATOM 184 CG2 THR A 13 -8.842 8.912 -10.182 1.00 0.85 C ATOM 0 H THR A 13 -7.032 7.328 -7.733 1.00 0.60 H new ATOM 0 HA THR A 13 -9.371 9.124 -7.507 1.00 0.61 H new ATOM 0 HB THR A 13 -10.399 7.729 -9.253 1.00 0.70 H new ATOM 0 HG1 THR A 13 -8.955 6.407 -10.546 1.00 0.67 H new ATOM 0 HG21 THR A 13 -9.121 8.645 -11.201 1.00 0.85 H new ATOM 0 HG22 THR A 13 -9.310 9.859 -9.914 1.00 0.85 H new ATOM 0 HG23 THR A 13 -7.759 9.012 -10.117 1.00 0.85 H new ATOM 192 N ALA A 14 -8.708 6.636 -5.837 1.00 0.46 N ATOM 193 CA ALA A 14 -9.098 5.644 -4.845 1.00 0.47 C ATOM 194 C ALA A 14 -9.718 6.365 -3.656 1.00 0.52 C ATOM 195 O ALA A 14 -9.197 6.349 -2.546 1.00 0.57 O ATOM 196 CB ALA A 14 -7.862 4.844 -4.425 1.00 0.46 C ATOM 0 H ALA A 14 -7.733 6.923 -5.746 1.00 0.46 H new ATOM 0 HA ALA A 14 -9.831 4.950 -5.256 1.00 0.47 H new ATOM 0 HB1 ALA A 14 -8.146 4.099 -3.682 1.00 0.46 H new ATOM 0 HB2 ALA A 14 -7.439 4.344 -5.296 1.00 0.46 H new ATOM 0 HB3 ALA A 14 -7.120 5.518 -3.997 1.00 0.46 H new ATOM 202 N THR A 15 -10.812 7.070 -3.892 1.00 0.57 N ATOM 203 CA THR A 15 -11.415 7.979 -2.933 1.00 0.63 C ATOM 204 C THR A 15 -12.222 7.258 -1.844 1.00 0.61 C ATOM 205 O THR A 15 -13.240 7.777 -1.391 1.00 0.64 O ATOM 206 CB THR A 15 -12.273 8.973 -3.722 1.00 0.76 C ATOM 207 OG1 THR A 15 -13.119 8.292 -4.624 1.00 1.31 O ATOM 208 CG2 THR A 15 -11.382 9.914 -4.538 1.00 0.92 C ATOM 0 H THR A 15 -11.317 7.025 -4.777 1.00 0.57 H new ATOM 0 HA THR A 15 -10.630 8.502 -2.387 1.00 0.63 H new ATOM 0 HB THR A 15 -12.867 9.538 -3.004 1.00 0.76 H new ATOM 0 HG1 THR A 15 -13.661 8.942 -5.118 1.00 1.31 H new ATOM 0 HG21 THR A 15 -12.005 10.615 -5.093 1.00 0.92 H new ATOM 0 HG22 THR A 15 -10.725 10.466 -3.866 1.00 0.92 H new ATOM 0 HG23 THR A 15 -10.781 9.331 -5.236 1.00 0.92 H new ATOM 216 N GLU A 16 -11.758 6.108 -1.353 1.00 0.63 N ATOM 217 CA GLU A 16 -12.414 5.281 -0.347 1.00 0.64 C ATOM 218 C GLU A 16 -12.180 5.803 1.074 1.00 0.66 C ATOM 219 O GLU A 16 -11.972 5.044 2.018 1.00 0.66 O ATOM 220 CB GLU A 16 -11.885 3.852 -0.512 1.00 0.69 C ATOM 221 CG GLU A 16 -12.629 3.097 -1.619 1.00 0.89 C ATOM 222 CD GLU A 16 -12.489 3.795 -2.972 1.00 2.13 C ATOM 223 OE1 GLU A 16 -11.330 3.944 -3.421 1.00 3.19 O ATOM 224 OE2 GLU A 16 -13.532 4.228 -3.509 1.00 3.13 O ATOM 0 H GLU A 16 -10.871 5.711 -1.663 1.00 0.63 H new ATOM 0 HA GLU A 16 -13.494 5.309 -0.495 1.00 0.64 H new ATOM 0 HB2 GLU A 16 -10.820 3.882 -0.744 1.00 0.69 H new ATOM 0 HB3 GLU A 16 -11.990 3.314 0.430 1.00 0.69 H new ATOM 0 HG2 GLU A 16 -12.240 2.081 -1.692 1.00 0.89 H new ATOM 0 HG3 GLU A 16 -13.684 3.016 -1.359 1.00 0.89 H new ATOM 231 N GLY A 17 -12.183 7.121 1.252 1.00 0.74 N ATOM 232 CA GLY A 17 -11.949 7.763 2.537 1.00 0.83 C ATOM 233 C GLY A 17 -10.461 7.821 2.871 1.00 0.80 C ATOM 234 O GLY A 17 -9.993 8.825 3.403 1.00 0.89 O ATOM 0 H GLY A 17 -12.351 7.782 0.493 1.00 0.74 H new ATOM 0 HA2 GLY A 17 -12.359 8.773 2.520 1.00 0.83 H new ATOM 0 HA3 GLY A 17 -12.477 7.218 3.319 1.00 0.83 H new ATOM 238 N VAL A 18 -9.724 6.752 2.567 1.00 0.71 N ATOM 239 CA VAL A 18 -8.333 6.566 2.923 1.00 0.72 C ATOM 240 C VAL A 18 -7.635 6.016 1.691 1.00 0.69 C ATOM 241 O VAL A 18 -8.189 5.179 0.981 1.00 0.65 O ATOM 242 CB VAL A 18 -8.231 5.571 4.087 1.00 0.80 C ATOM 243 CG1 VAL A 18 -6.772 5.299 4.476 1.00 0.82 C ATOM 244 CG2 VAL A 18 -8.970 6.076 5.324 1.00 1.24 C ATOM 0 H VAL A 18 -10.104 5.963 2.044 1.00 0.71 H new ATOM 0 HA VAL A 18 -7.872 7.502 3.240 1.00 0.72 H new ATOM 0 HB VAL A 18 -8.692 4.648 3.736 1.00 0.80 H new ATOM 0 HG11 VAL A 18 -6.742 4.590 5.303 1.00 0.82 H new ATOM 0 HG12 VAL A 18 -6.239 4.882 3.621 1.00 0.82 H new ATOM 0 HG13 VAL A 18 -6.297 6.232 4.780 1.00 0.82 H new ATOM 0 HG21 VAL A 18 -8.876 5.346 6.128 1.00 1.24 H new ATOM 0 HG22 VAL A 18 -8.539 7.025 5.644 1.00 1.24 H new ATOM 0 HG23 VAL A 18 -10.024 6.219 5.085 1.00 1.24 H new ATOM 254 N ILE A 19 -6.412 6.485 1.463 1.00 0.76 N ATOM 255 CA ILE A 19 -5.566 6.124 0.350 1.00 0.81 C ATOM 256 C ILE A 19 -4.219 5.798 0.961 1.00 0.81 C ATOM 257 O ILE A 19 -3.716 6.590 1.755 1.00 0.89 O ATOM 258 CB ILE A 19 -5.472 7.323 -0.612 1.00 0.88 C ATOM 259 CG1 ILE A 19 -6.815 7.475 -1.329 1.00 0.83 C ATOM 260 CG2 ILE A 19 -4.359 7.124 -1.652 1.00 1.05 C ATOM 261 CD1 ILE A 19 -6.932 8.765 -2.148 1.00 1.43 C ATOM 0 H ILE A 19 -5.970 7.161 2.086 1.00 0.76 H new ATOM 0 HA ILE A 19 -5.945 5.277 -0.222 1.00 0.81 H new ATOM 0 HB ILE A 19 -5.235 8.217 -0.036 1.00 0.88 H new ATOM 0 HG12 ILE A 19 -6.963 6.621 -1.990 1.00 0.83 H new ATOM 0 HG13 ILE A 19 -7.616 7.450 -0.591 1.00 0.83 H new ATOM 0 HG21 ILE A 19 -4.321 7.989 -2.314 1.00 1.05 H new ATOM 0 HG22 ILE A 19 -3.401 7.014 -1.143 1.00 1.05 H new ATOM 0 HG23 ILE A 19 -4.564 6.228 -2.237 1.00 1.05 H new ATOM 0 HD11 ILE A 19 -7.910 8.804 -2.628 1.00 1.43 H new ATOM 0 HD12 ILE A 19 -6.816 9.626 -1.489 1.00 1.43 H new ATOM 0 HD13 ILE A 19 -6.153 8.784 -2.910 1.00 1.43 H new ATOM 273 N ILE A 20 -3.621 4.670 0.586 1.00 0.77 N ATOM 274 CA ILE A 20 -2.274 4.340 0.996 1.00 0.79 C ATOM 275 C ILE A 20 -1.458 4.314 -0.286 1.00 0.81 C ATOM 276 O ILE A 20 -1.926 3.833 -1.321 1.00 0.90 O ATOM 277 CB ILE A 20 -2.209 3.002 1.758 1.00 0.81 C ATOM 278 CG1 ILE A 20 -3.216 2.896 2.921 1.00 0.86 C ATOM 279 CG2 ILE A 20 -0.815 2.813 2.372 1.00 0.94 C ATOM 280 CD1 ILE A 20 -4.594 2.433 2.468 1.00 0.72 C ATOM 0 H ILE A 20 -4.061 3.967 -0.008 1.00 0.77 H new ATOM 0 HA ILE A 20 -1.881 5.073 1.701 1.00 0.79 H new ATOM 0 HB ILE A 20 -2.449 2.241 1.015 1.00 0.81 H new ATOM 0 HG12 ILE A 20 -2.831 2.200 3.667 1.00 0.86 H new ATOM 0 HG13 ILE A 20 -3.306 3.867 3.407 1.00 0.86 H new ATOM 0 HG21 ILE A 20 -0.779 1.865 2.908 1.00 0.94 H new ATOM 0 HG22 ILE A 20 -0.066 2.811 1.580 1.00 0.94 H new ATOM 0 HG23 ILE A 20 -0.609 3.629 3.064 1.00 0.94 H new ATOM 0 HD11 ILE A 20 -5.260 2.377 3.329 1.00 0.72 H new ATOM 0 HD12 ILE A 20 -4.996 3.141 1.744 1.00 0.72 H new ATOM 0 HD13 ILE A 20 -4.514 1.449 2.007 1.00 0.72 H new ATOM 292 N ASN A 21 -0.242 4.840 -0.208 1.00 0.77 N ATOM 293 CA ASN A 21 0.745 4.724 -1.263 1.00 0.74 C ATOM 294 C ASN A 21 2.062 4.301 -0.625 1.00 0.72 C ATOM 295 O ASN A 21 2.230 4.402 0.593 1.00 0.73 O ATOM 296 CB ASN A 21 0.878 6.052 -2.021 1.00 0.81 C ATOM 297 CG ASN A 21 1.338 5.834 -3.460 1.00 1.19 C ATOM 298 OD1 ASN A 21 1.699 4.731 -3.851 1.00 2.02 O ATOM 299 ND2 ASN A 21 1.332 6.875 -4.280 1.00 1.84 N ATOM 0 H ASN A 21 0.086 5.365 0.602 1.00 0.77 H new ATOM 0 HA ASN A 21 0.442 3.975 -1.995 1.00 0.74 H new ATOM 0 HB2 ASN A 21 -0.081 6.570 -2.020 1.00 0.81 H new ATOM 0 HB3 ASN A 21 1.589 6.697 -1.505 1.00 0.81 H new ATOM 0 HD21 ASN A 21 1.630 6.763 -5.249 1.00 1.84 H new ATOM 0 HD22 ASN A 21 1.029 7.789 -3.942 1.00 1.84 H new ATOM 306 N ALA A 22 3.003 3.828 -1.438 1.00 0.78 N ATOM 307 CA ALA A 22 4.345 3.575 -0.958 1.00 0.82 C ATOM 308 C ALA A 22 4.988 4.890 -0.514 1.00 1.01 C ATOM 309 O ALA A 22 4.534 5.979 -0.860 1.00 2.03 O ATOM 310 CB ALA A 22 5.160 2.888 -2.061 1.00 1.14 C ATOM 0 H ALA A 22 2.856 3.616 -2.425 1.00 0.78 H new ATOM 0 HA ALA A 22 4.317 2.909 -0.095 1.00 0.82 H new ATOM 0 HB1 ALA A 22 6.171 2.697 -1.701 1.00 1.14 H new ATOM 0 HB2 ALA A 22 4.686 1.944 -2.329 1.00 1.14 H new ATOM 0 HB3 ALA A 22 5.203 3.534 -2.938 1.00 1.14 H new ATOM 316 N ALA A 23 6.074 4.772 0.238 1.00 0.45 N ATOM 317 CA ALA A 23 6.836 5.897 0.761 1.00 0.70 C ATOM 318 C ALA A 23 8.299 5.505 0.940 1.00 0.60 C ATOM 319 O ALA A 23 9.221 6.248 0.604 1.00 0.74 O ATOM 320 CB ALA A 23 6.236 6.343 2.094 1.00 1.07 C ATOM 0 H ALA A 23 6.459 3.867 0.508 1.00 0.45 H new ATOM 0 HA ALA A 23 6.787 6.725 0.054 1.00 0.70 H new ATOM 0 HB1 ALA A 23 6.806 7.185 2.486 1.00 1.07 H new ATOM 0 HB2 ALA A 23 5.200 6.645 1.944 1.00 1.07 H new ATOM 0 HB3 ALA A 23 6.274 5.517 2.804 1.00 1.07 H new ATOM 326 N ASN A 24 8.527 4.310 1.483 1.00 0.53 N ATOM 327 CA ASN A 24 9.854 3.848 1.849 1.00 0.54 C ATOM 328 C ASN A 24 10.435 4.781 2.909 1.00 0.70 C ATOM 329 O ASN A 24 9.770 5.696 3.397 1.00 0.93 O ATOM 330 CB ASN A 24 10.775 3.764 0.622 1.00 0.60 C ATOM 331 CG ASN A 24 10.051 3.321 -0.644 1.00 1.10 C ATOM 332 OD1 ASN A 24 9.714 2.159 -0.809 1.00 1.42 O ATOM 333 ND2 ASN A 24 9.756 4.246 -1.547 1.00 1.87 N ATOM 0 H ASN A 24 7.788 3.635 1.680 1.00 0.53 H new ATOM 0 HA ASN A 24 9.778 2.841 2.259 1.00 0.54 H new ATOM 0 HB2 ASN A 24 11.230 4.739 0.450 1.00 0.60 H new ATOM 0 HB3 ASN A 24 11.586 3.067 0.832 1.00 0.60 H new ATOM 0 HD21 ASN A 24 9.242 3.990 -2.390 1.00 1.87 H new ATOM 0 HD22 ASN A 24 10.043 5.214 -1.398 1.00 1.87 H new ATOM 340 N SER A 25 11.719 4.622 3.214 1.00 0.70 N ATOM 341 CA SER A 25 12.420 5.519 4.119 1.00 0.93 C ATOM 342 C SER A 25 12.562 6.939 3.562 1.00 1.14 C ATOM 343 O SER A 25 13.180 7.778 4.205 1.00 1.29 O ATOM 344 CB SER A 25 13.799 4.929 4.386 1.00 0.97 C ATOM 345 OG SER A 25 14.480 4.744 3.158 1.00 1.65 O ATOM 0 H SER A 25 12.299 3.870 2.841 1.00 0.70 H new ATOM 0 HA SER A 25 11.837 5.606 5.036 1.00 0.93 H new ATOM 0 HB2 SER A 25 14.371 5.593 5.035 1.00 0.97 H new ATOM 0 HB3 SER A 25 13.704 3.977 4.908 1.00 0.97 H new ATOM 0 HG SER A 25 15.368 4.366 3.330 1.00 1.65 H new ATOM 351 N LYS A 26 12.043 7.219 2.363 1.00 1.29 N ATOM 352 CA LYS A 26 12.177 8.494 1.676 1.00 1.56 C ATOM 353 C LYS A 26 10.849 9.243 1.675 1.00 1.57 C ATOM 354 O LYS A 26 10.766 10.323 1.100 1.00 1.73 O ATOM 355 CB LYS A 26 12.602 8.224 0.227 1.00 1.57 C ATOM 356 CG LYS A 26 13.885 7.387 0.134 1.00 1.67 C ATOM 357 CD LYS A 26 14.112 6.909 -1.303 1.00 1.85 C ATOM 358 CE LYS A 26 14.935 5.619 -1.259 1.00 1.93 C ATOM 359 NZ LYS A 26 15.017 4.978 -2.587 1.00 2.27 N ATOM 0 H LYS A 26 11.501 6.538 1.832 1.00 1.29 H new ATOM 0 HA LYS A 26 12.921 9.103 2.189 1.00 1.56 H new ATOM 0 HB2 LYS A 26 11.796 7.706 -0.293 1.00 1.57 H new ATOM 0 HB3 LYS A 26 12.754 9.174 -0.286 1.00 1.57 H new ATOM 0 HG2 LYS A 26 14.738 7.980 0.465 1.00 1.67 H new ATOM 0 HG3 LYS A 26 13.815 6.529 0.802 1.00 1.67 H new ATOM 0 HD2 LYS A 26 13.158 6.733 -1.799 1.00 1.85 H new ATOM 0 HD3 LYS A 26 14.635 7.673 -1.879 1.00 1.85 H new ATOM 0 HE2 LYS A 26 15.940 5.840 -0.899 1.00 1.93 H new ATOM 0 HE3 LYS A 26 14.487 4.926 -0.547 1.00 1.93 H new ATOM 0 HZ1 LYS A 26 15.582 4.108 -2.518 1.00 2.27 H new ATOM 0 HZ2 LYS A 26 14.060 4.744 -2.919 1.00 2.27 H new ATOM 0 HZ3 LYS A 26 15.467 5.630 -3.260 1.00 2.27 H new ATOM 373 N GLY A 27 9.786 8.640 2.214 1.00 1.45 N ATOM 374 CA GLY A 27 8.476 9.266 2.212 1.00 1.54 C ATOM 375 C GLY A 27 7.922 9.467 0.800 1.00 1.45 C ATOM 376 O GLY A 27 6.973 10.221 0.626 1.00 1.59 O ATOM 0 H GLY A 27 9.814 7.721 2.655 1.00 1.45 H new ATOM 0 HA2 GLY A 27 7.783 8.651 2.786 1.00 1.54 H new ATOM 0 HA3 GLY A 27 8.538 10.231 2.715 1.00 1.54 H new ATOM 380 N GLN A 28 8.485 8.813 -0.220 1.00 1.28 N ATOM 381 CA GLN A 28 8.090 8.989 -1.599 1.00 1.28 C ATOM 382 C GLN A 28 7.741 7.619 -2.163 1.00 1.05 C ATOM 383 O GLN A 28 8.567 6.708 -2.098 1.00 1.04 O ATOM 384 CB GLN A 28 9.249 9.596 -2.393 1.00 1.48 C ATOM 385 CG GLN A 28 8.842 9.741 -3.864 1.00 1.30 C ATOM 386 CD GLN A 28 10.036 10.047 -4.753 1.00 1.42 C ATOM 387 OE1 GLN A 28 10.558 11.153 -4.774 1.00 2.02 O ATOM 388 NE2 GLN A 28 10.501 9.045 -5.490 1.00 2.12 N ATOM 0 H GLN A 28 9.240 8.138 -0.097 1.00 1.28 H new ATOM 0 HA GLN A 28 7.232 9.658 -1.668 1.00 1.28 H new ATOM 0 HB2 GLN A 28 9.515 10.569 -1.981 1.00 1.48 H new ATOM 0 HB3 GLN A 28 10.132 8.962 -2.310 1.00 1.48 H new ATOM 0 HG2 GLN A 28 8.364 8.821 -4.201 1.00 1.30 H new ATOM 0 HG3 GLN A 28 8.104 10.537 -3.960 1.00 1.30 H new ATOM 0 HE21 GLN A 28 10.047 8.132 -5.454 1.00 2.12 H new ATOM 0 HE22 GLN A 28 11.312 9.188 -6.092 1.00 2.12 H new ATOM 397 N PRO A 29 6.559 7.463 -2.761 1.00 0.94 N ATOM 398 CA PRO A 29 6.198 6.225 -3.414 1.00 0.81 C ATOM 399 C PRO A 29 7.165 5.876 -4.540 1.00 0.96 C ATOM 400 O PRO A 29 7.779 6.746 -5.159 1.00 1.43 O ATOM 401 CB PRO A 29 4.755 6.389 -3.902 1.00 0.79 C ATOM 402 CG PRO A 29 4.404 7.862 -3.679 1.00 1.02 C ATOM 403 CD PRO A 29 5.483 8.431 -2.771 1.00 1.08 C ATOM 0 HA PRO A 29 6.264 5.385 -2.722 1.00 0.81 H new ATOM 0 HB2 PRO A 29 4.665 6.121 -4.955 1.00 0.79 H new ATOM 0 HB3 PRO A 29 4.079 5.738 -3.348 1.00 0.79 H new ATOM 0 HG2 PRO A 29 4.371 8.400 -4.626 1.00 1.02 H new ATOM 0 HG3 PRO A 29 3.420 7.961 -3.221 1.00 1.02 H new ATOM 0 HD2 PRO A 29 5.832 9.396 -3.139 1.00 1.08 H new ATOM 0 HD3 PRO A 29 5.098 8.594 -1.765 1.00 1.08 H new ATOM 411 N GLY A 30 7.282 4.575 -4.808 1.00 0.85 N ATOM 412 CA GLY A 30 8.047 4.083 -5.945 1.00 0.96 C ATOM 413 C GLY A 30 7.682 4.842 -7.224 1.00 1.53 C ATOM 414 O GLY A 30 6.529 5.235 -7.421 1.00 2.43 O ATOM 0 H GLY A 30 6.851 3.841 -4.246 1.00 0.85 H new ATOM 0 HA2 GLY A 30 9.113 4.192 -5.745 1.00 0.96 H new ATOM 0 HA3 GLY A 30 7.856 3.019 -6.083 1.00 0.96 H new ATOM 418 N GLY A 31 8.688 5.072 -8.075 1.00 1.63 N ATOM 419 CA GLY A 31 8.539 5.856 -9.289 1.00 2.46 C ATOM 420 C GLY A 31 7.395 5.313 -10.134 1.00 1.32 C ATOM 421 O GLY A 31 7.318 4.113 -10.383 1.00 2.07 O ATOM 0 H GLY A 31 9.632 4.713 -7.932 1.00 1.63 H new ATOM 0 HA2 GLY A 31 8.349 6.899 -9.035 1.00 2.46 H new ATOM 0 HA3 GLY A 31 9.466 5.831 -9.862 1.00 2.46 H new ATOM 425 N GLY A 32 6.493 6.200 -10.548 1.00 1.17 N ATOM 426 CA GLY A 32 5.253 5.824 -11.192 1.00 1.44 C ATOM 427 C GLY A 32 4.161 6.696 -10.603 1.00 1.20 C ATOM 428 O GLY A 32 4.039 7.868 -10.954 1.00 1.23 O ATOM 0 H GLY A 32 6.611 7.208 -10.441 1.00 1.17 H new ATOM 0 HA2 GLY A 32 5.320 5.967 -12.270 1.00 1.44 H new ATOM 0 HA3 GLY A 32 5.036 4.769 -11.024 1.00 1.44 H new ATOM 432 N VAL A 33 3.389 6.153 -9.665 1.00 1.09 N ATOM 433 CA VAL A 33 2.224 6.853 -9.148 1.00 0.92 C ATOM 434 C VAL A 33 2.619 8.034 -8.260 1.00 0.94 C ATOM 435 O VAL A 33 1.794 8.916 -8.048 1.00 0.91 O ATOM 436 CB VAL A 33 1.259 5.875 -8.460 1.00 1.00 C ATOM 437 CG1 VAL A 33 -0.039 6.598 -8.068 1.00 2.33 C ATOM 438 CG2 VAL A 33 0.912 4.719 -9.411 1.00 2.86 C ATOM 0 H VAL A 33 3.551 5.235 -9.251 1.00 1.09 H new ATOM 0 HA VAL A 33 1.684 7.286 -9.990 1.00 0.92 H new ATOM 0 HB VAL A 33 1.746 5.485 -7.567 1.00 1.00 H new ATOM 0 HG11 VAL A 33 -0.715 5.895 -7.581 1.00 2.33 H new ATOM 0 HG12 VAL A 33 0.191 7.413 -7.382 1.00 2.33 H new ATOM 0 HG13 VAL A 33 -0.516 7.000 -8.962 1.00 2.33 H new ATOM 0 HG21 VAL A 33 0.228 4.032 -8.914 1.00 2.86 H new ATOM 0 HG22 VAL A 33 0.439 5.116 -10.309 1.00 2.86 H new ATOM 0 HG23 VAL A 33 1.823 4.188 -9.686 1.00 2.86 H new ATOM 448 N CYS A 34 3.876 8.137 -7.810 1.00 1.11 N ATOM 449 CA CYS A 34 4.398 9.383 -7.273 1.00 1.25 C ATOM 450 C CYS A 34 4.014 10.575 -8.159 1.00 1.24 C ATOM 451 O CYS A 34 3.597 11.606 -7.644 1.00 1.28 O ATOM 452 CB CYS A 34 5.915 9.216 -7.107 1.00 1.51 C ATOM 453 SG CYS A 34 6.641 10.681 -6.340 1.00 1.95 S ATOM 0 H CYS A 34 4.545 7.367 -7.811 1.00 1.11 H new ATOM 0 HA CYS A 34 3.959 9.602 -6.300 1.00 1.25 H new ATOM 0 HB2 CYS A 34 6.124 8.338 -6.495 1.00 1.51 H new ATOM 0 HB3 CYS A 34 6.375 9.043 -8.080 1.00 1.51 H new ATOM 0 HG CYS A 34 7.937 10.606 -6.401 1.00 1.95 H new ATOM 459 N GLY A 35 4.098 10.433 -9.485 1.00 1.23 N ATOM 460 CA GLY A 35 3.765 11.501 -10.413 1.00 1.27 C ATOM 461 C GLY A 35 2.277 11.856 -10.397 1.00 1.17 C ATOM 462 O GLY A 35 1.923 13.031 -10.393 1.00 1.24 O ATOM 0 H GLY A 35 4.400 9.571 -9.939 1.00 1.23 H new ATOM 0 HA2 GLY A 35 4.348 12.388 -10.164 1.00 1.27 H new ATOM 0 HA3 GLY A 35 4.052 11.203 -11.421 1.00 1.27 H new ATOM 466 N ALA A 36 1.383 10.864 -10.425 1.00 1.04 N ATOM 467 CA ALA A 36 -0.048 11.146 -10.506 1.00 0.95 C ATOM 468 C ALA A 36 -0.532 11.745 -9.192 1.00 0.89 C ATOM 469 O ALA A 36 -1.224 12.764 -9.182 1.00 0.92 O ATOM 470 CB ALA A 36 -0.826 9.872 -10.850 1.00 0.86 C ATOM 0 H ALA A 36 1.622 9.873 -10.393 1.00 1.04 H new ATOM 0 HA ALA A 36 -0.225 11.870 -11.301 1.00 0.95 H new ATOM 0 HB1 ALA A 36 -1.890 10.100 -10.906 1.00 0.86 H new ATOM 0 HB2 ALA A 36 -0.486 9.486 -11.811 1.00 0.86 H new ATOM 0 HB3 ALA A 36 -0.656 9.122 -10.077 1.00 0.86 H new ATOM 476 N LEU A 37 -0.153 11.122 -8.078 1.00 0.83 N ATOM 477 CA LEU A 37 -0.514 11.606 -6.764 1.00 0.79 C ATOM 478 C LEU A 37 0.054 12.996 -6.542 1.00 0.96 C ATOM 479 O LEU A 37 -0.614 13.820 -5.949 1.00 1.08 O ATOM 480 CB LEU A 37 -0.049 10.634 -5.672 1.00 0.78 C ATOM 481 CG LEU A 37 -0.680 10.981 -4.309 1.00 0.68 C ATOM 482 CD1 LEU A 37 -2.144 10.524 -4.276 1.00 0.80 C ATOM 483 CD2 LEU A 37 0.047 10.241 -3.186 1.00 0.74 C ATOM 0 H LEU A 37 0.410 10.272 -8.069 1.00 0.83 H new ATOM 0 HA LEU A 37 -1.601 11.668 -6.705 1.00 0.79 H new ATOM 0 HB2 LEU A 37 -0.317 9.615 -5.951 1.00 0.78 H new ATOM 0 HB3 LEU A 37 1.038 10.667 -5.591 1.00 0.78 H new ATOM 0 HG LEU A 37 -0.606 12.060 -4.172 1.00 0.68 H new ATOM 0 HD11 LEU A 37 -2.581 10.773 -3.309 1.00 0.80 H new ATOM 0 HD12 LEU A 37 -2.700 11.028 -5.067 1.00 0.80 H new ATOM 0 HD13 LEU A 37 -2.192 9.446 -4.429 1.00 0.80 H new ATOM 0 HD21 LEU A 37 -0.408 10.495 -2.229 1.00 0.74 H new ATOM 0 HD22 LEU A 37 -0.028 9.166 -3.350 1.00 0.74 H new ATOM 0 HD23 LEU A 37 1.097 10.534 -3.177 1.00 0.74 H new ATOM 495 N TYR A 38 1.245 13.298 -7.043 1.00 1.04 N ATOM 496 CA TYR A 38 1.773 14.654 -7.025 1.00 1.19 C ATOM 497 C TYR A 38 0.907 15.604 -7.849 1.00 1.21 C ATOM 498 O TYR A 38 0.707 16.752 -7.465 1.00 1.33 O ATOM 499 CB TYR A 38 3.189 14.580 -7.579 1.00 1.29 C ATOM 500 CG TYR A 38 3.890 15.875 -7.931 1.00 1.49 C ATOM 501 CD1 TYR A 38 4.134 16.850 -6.947 1.00 2.08 C ATOM 502 CD2 TYR A 38 4.363 16.068 -9.244 1.00 2.44 C ATOM 503 CE1 TYR A 38 4.854 18.013 -7.272 1.00 2.38 C ATOM 504 CE2 TYR A 38 5.089 17.224 -9.576 1.00 2.80 C ATOM 505 CZ TYR A 38 5.340 18.201 -8.585 1.00 2.32 C ATOM 506 OH TYR A 38 6.059 19.321 -8.884 1.00 2.81 O ATOM 0 H TYR A 38 1.868 12.613 -7.471 1.00 1.04 H new ATOM 0 HA TYR A 38 1.773 15.051 -6.010 1.00 1.19 H new ATOM 0 HB2 TYR A 38 3.805 14.056 -6.848 1.00 1.29 H new ATOM 0 HB3 TYR A 38 3.163 13.961 -8.476 1.00 1.29 H new ATOM 0 HD1 TYR A 38 3.768 16.705 -5.941 1.00 2.08 H new ATOM 0 HD2 TYR A 38 4.166 15.322 -10.000 1.00 2.44 H new ATOM 0 HE1 TYR A 38 5.036 18.764 -6.517 1.00 2.38 H new ATOM 0 HE2 TYR A 38 5.453 17.366 -10.583 1.00 2.80 H new ATOM 0 HH TYR A 38 6.321 19.299 -9.828 1.00 2.81 H new ATOM 516 N LYS A 39 0.396 15.162 -9.003 1.00 1.14 N ATOM 517 CA LYS A 39 -0.271 16.064 -9.930 1.00 1.22 C ATOM 518 C LYS A 39 -1.641 16.464 -9.394 1.00 1.23 C ATOM 519 O LYS A 39 -2.145 17.536 -9.716 1.00 1.37 O ATOM 520 CB LYS A 39 -0.359 15.405 -11.314 1.00 1.20 C ATOM 521 CG LYS A 39 -0.434 16.464 -12.415 1.00 1.65 C ATOM 522 CD LYS A 39 -0.201 15.831 -13.792 1.00 1.81 C ATOM 523 CE LYS A 39 0.019 16.932 -14.836 1.00 2.49 C ATOM 524 NZ LYS A 39 0.719 16.422 -16.035 1.00 3.15 N ATOM 0 H LYS A 39 0.434 14.190 -9.310 1.00 1.14 H new ATOM 0 HA LYS A 39 0.309 16.981 -10.032 1.00 1.22 H new ATOM 0 HB2 LYS A 39 0.511 14.768 -11.474 1.00 1.20 H new ATOM 0 HB3 LYS A 39 -1.238 14.762 -11.361 1.00 1.20 H new ATOM 0 HG2 LYS A 39 -1.409 16.950 -12.393 1.00 1.65 H new ATOM 0 HG3 LYS A 39 0.312 17.238 -12.234 1.00 1.65 H new ATOM 0 HD2 LYS A 39 0.666 15.171 -13.758 1.00 1.81 H new ATOM 0 HD3 LYS A 39 -1.058 15.218 -14.071 1.00 1.81 H new ATOM 0 HE2 LYS A 39 -0.943 17.353 -15.129 1.00 2.49 H new ATOM 0 HE3 LYS A 39 0.599 17.742 -14.393 1.00 2.49 H new ATOM 0 HZ1 LYS A 39 0.849 17.196 -16.717 1.00 3.15 H new ATOM 0 HZ2 LYS A 39 1.648 16.044 -15.760 1.00 3.15 H new ATOM 0 HZ3 LYS A 39 0.153 15.667 -16.472 1.00 3.15 H new ATOM 538 N LYS A 40 -2.261 15.585 -8.605 1.00 1.11 N ATOM 539 CA LYS A 40 -3.593 15.807 -8.052 1.00 1.10 C ATOM 540 C LYS A 40 -3.557 16.170 -6.567 1.00 1.15 C ATOM 541 O LYS A 40 -4.450 16.850 -6.075 1.00 1.27 O ATOM 542 CB LYS A 40 -4.402 14.538 -8.300 1.00 0.93 C ATOM 543 CG LYS A 40 -5.897 14.726 -7.992 1.00 1.01 C ATOM 544 CD LYS A 40 -6.777 14.501 -9.218 1.00 1.04 C ATOM 545 CE LYS A 40 -6.384 15.507 -10.303 1.00 1.39 C ATOM 546 NZ LYS A 40 -7.555 15.951 -11.087 1.00 1.87 N ATOM 0 H LYS A 40 -1.848 14.693 -8.331 1.00 1.11 H new ATOM 0 HA LYS A 40 -4.058 16.662 -8.544 1.00 1.10 H new ATOM 0 HB2 LYS A 40 -4.284 14.232 -9.340 1.00 0.93 H new ATOM 0 HB3 LYS A 40 -4.005 13.731 -7.683 1.00 0.93 H new ATOM 0 HG2 LYS A 40 -6.193 14.033 -7.204 1.00 1.01 H new ATOM 0 HG3 LYS A 40 -6.062 15.733 -7.609 1.00 1.01 H new ATOM 0 HD2 LYS A 40 -6.656 13.482 -9.587 1.00 1.04 H new ATOM 0 HD3 LYS A 40 -7.828 14.622 -8.955 1.00 1.04 H new ATOM 0 HE2 LYS A 40 -5.906 16.371 -9.842 1.00 1.39 H new ATOM 0 HE3 LYS A 40 -5.650 15.055 -10.970 1.00 1.39 H new ATOM 0 HZ1 LYS A 40 -7.250 16.631 -11.812 1.00 1.87 H new ATOM 0 HZ2 LYS A 40 -7.996 15.129 -11.547 1.00 1.87 H new ATOM 0 HZ3 LYS A 40 -8.244 16.405 -10.454 1.00 1.87 H new ATOM 560 N PHE A 41 -2.533 15.704 -5.863 1.00 1.12 N ATOM 561 CA PHE A 41 -2.347 15.885 -4.425 1.00 1.28 C ATOM 562 C PHE A 41 -0.887 16.259 -4.153 1.00 1.11 C ATOM 563 O PHE A 41 -0.167 15.512 -3.489 1.00 1.22 O ATOM 564 CB PHE A 41 -2.704 14.611 -3.623 1.00 1.69 C ATOM 565 CG PHE A 41 -4.006 13.903 -3.937 1.00 0.98 C ATOM 566 CD1 PHE A 41 -4.102 13.147 -5.114 1.00 1.24 C ATOM 567 CD2 PHE A 41 -5.073 13.891 -3.020 1.00 1.15 C ATOM 568 CE1 PHE A 41 -5.271 12.427 -5.407 1.00 0.90 C ATOM 569 CE2 PHE A 41 -6.242 13.164 -3.313 1.00 1.68 C ATOM 570 CZ PHE A 41 -6.346 12.438 -4.509 1.00 1.33 C ATOM 0 H PHE A 41 -1.779 15.168 -6.293 1.00 1.12 H new ATOM 0 HA PHE A 41 -3.019 16.679 -4.100 1.00 1.28 H new ATOM 0 HB2 PHE A 41 -1.895 13.894 -3.761 1.00 1.69 H new ATOM 0 HB3 PHE A 41 -2.717 14.877 -2.566 1.00 1.69 H new ATOM 0 HD1 PHE A 41 -3.269 13.118 -5.801 1.00 1.24 H new ATOM 0 HD2 PHE A 41 -4.995 14.439 -2.093 1.00 1.15 H new ATOM 0 HE1 PHE A 41 -5.342 11.864 -6.326 1.00 0.90 H new ATOM 0 HE2 PHE A 41 -7.064 13.165 -2.613 1.00 1.68 H new ATOM 0 HZ PHE A 41 -7.249 11.891 -4.736 1.00 1.33 H new ATOM 580 N PRO A 42 -0.419 17.428 -4.607 1.00 1.02 N ATOM 581 CA PRO A 42 0.960 17.841 -4.402 1.00 1.07 C ATOM 582 C PRO A 42 1.316 18.007 -2.918 1.00 1.18 C ATOM 583 O PRO A 42 2.489 18.104 -2.572 1.00 1.35 O ATOM 584 CB PRO A 42 1.136 19.130 -5.212 1.00 1.20 C ATOM 585 CG PRO A 42 -0.288 19.655 -5.415 1.00 1.25 C ATOM 586 CD PRO A 42 -1.161 18.404 -5.383 1.00 1.11 C ATOM 0 HA PRO A 42 1.654 17.074 -4.745 1.00 1.07 H new ATOM 0 HB2 PRO A 42 1.753 19.853 -4.678 1.00 1.20 H new ATOM 0 HB3 PRO A 42 1.627 18.935 -6.166 1.00 1.20 H new ATOM 0 HG2 PRO A 42 -0.569 20.356 -4.629 1.00 1.25 H new ATOM 0 HG3 PRO A 42 -0.385 20.184 -6.363 1.00 1.25 H new ATOM 0 HD2 PRO A 42 -2.129 18.613 -4.927 1.00 1.11 H new ATOM 0 HD3 PRO A 42 -1.356 18.037 -6.391 1.00 1.11 H new ATOM 594 N GLU A 43 0.341 17.996 -2.010 1.00 1.23 N ATOM 595 CA GLU A 43 0.579 18.147 -0.588 1.00 1.45 C ATOM 596 C GLU A 43 0.936 16.806 0.053 1.00 1.41 C ATOM 597 O GLU A 43 1.428 16.764 1.176 1.00 1.64 O ATOM 598 CB GLU A 43 -0.677 18.725 0.061 1.00 1.65 C ATOM 599 CG GLU A 43 -0.964 20.161 -0.394 1.00 1.80 C ATOM 600 CD GLU A 43 -1.559 20.234 -1.803 1.00 2.32 C ATOM 601 OE1 GLU A 43 -1.373 21.288 -2.443 1.00 3.31 O ATOM 602 OE2 GLU A 43 -2.184 19.228 -2.220 1.00 3.14 O ATOM 0 H GLU A 43 -0.644 17.880 -2.250 1.00 1.23 H new ATOM 0 HA GLU A 43 1.421 18.822 -0.435 1.00 1.45 H new ATOM 0 HB2 GLU A 43 -1.531 18.093 -0.181 1.00 1.65 H new ATOM 0 HB3 GLU A 43 -0.564 18.706 1.145 1.00 1.65 H new ATOM 0 HG2 GLU A 43 -1.652 20.629 0.310 1.00 1.80 H new ATOM 0 HG3 GLU A 43 -0.039 20.737 -0.366 1.00 1.80 H new ATOM 609 N SER A 44 0.708 15.698 -0.656 1.00 1.22 N ATOM 610 CA SER A 44 1.201 14.389 -0.255 1.00 1.33 C ATOM 611 C SER A 44 2.636 14.172 -0.735 1.00 1.39 C ATOM 612 O SER A 44 3.169 13.075 -0.609 1.00 1.61 O ATOM 613 CB SER A 44 0.281 13.313 -0.825 1.00 1.44 C ATOM 614 OG SER A 44 -1.030 13.540 -0.352 1.00 1.89 O ATOM 0 H SER A 44 0.175 15.689 -1.525 1.00 1.22 H new ATOM 0 HA SER A 44 1.204 14.330 0.833 1.00 1.33 H new ATOM 0 HB2 SER A 44 0.299 13.339 -1.915 1.00 1.44 H new ATOM 0 HB3 SER A 44 0.625 12.324 -0.524 1.00 1.44 H new ATOM 0 HG SER A 44 -1.656 13.530 -1.106 1.00 1.89 H new ATOM 620 N PHE A 45 3.288 15.203 -1.275 1.00 1.39 N ATOM 621 CA PHE A 45 4.695 15.188 -1.611 1.00 1.56 C ATOM 622 C PHE A 45 5.435 15.610 -0.347 1.00 1.45 C ATOM 623 O PHE A 45 6.122 16.626 -0.307 1.00 1.89 O ATOM 624 CB PHE A 45 4.871 16.154 -2.798 1.00 2.14 C ATOM 625 CG PHE A 45 5.815 15.723 -3.893 1.00 2.63 C ATOM 626 CD1 PHE A 45 5.537 14.550 -4.615 1.00 2.85 C ATOM 627 CD2 PHE A 45 6.880 16.553 -4.288 1.00 3.73 C ATOM 628 CE1 PHE A 45 6.324 14.205 -5.725 1.00 4.00 C ATOM 629 CE2 PHE A 45 7.677 16.198 -5.389 1.00 4.57 C ATOM 630 CZ PHE A 45 7.398 15.024 -6.110 1.00 4.66 C ATOM 0 H PHE A 45 2.832 16.089 -1.492 1.00 1.39 H new ATOM 0 HA PHE A 45 5.090 14.220 -1.919 1.00 1.56 H new ATOM 0 HB2 PHE A 45 3.891 16.327 -3.243 1.00 2.14 H new ATOM 0 HB3 PHE A 45 5.218 17.111 -2.408 1.00 2.14 H new ATOM 0 HD1 PHE A 45 4.717 13.914 -4.316 1.00 2.85 H new ATOM 0 HD2 PHE A 45 7.085 17.464 -3.745 1.00 3.73 H new ATOM 0 HE1 PHE A 45 6.103 13.308 -6.284 1.00 4.00 H new ATOM 0 HE2 PHE A 45 8.504 16.827 -5.682 1.00 4.57 H new ATOM 0 HZ PHE A 45 8.008 14.752 -6.958 1.00 4.66 H new ATOM 640 N ASP A 46 5.250 14.831 0.719 1.00 1.23 N ATOM 641 CA ASP A 46 5.901 15.077 1.989 1.00 1.62 C ATOM 642 C ASP A 46 7.354 14.647 1.874 1.00 1.71 C ATOM 643 O ASP A 46 8.224 15.335 2.399 1.00 2.49 O ATOM 644 CB ASP A 46 5.161 14.365 3.133 1.00 1.97 C ATOM 645 CG ASP A 46 5.200 12.838 3.061 1.00 3.12 C ATOM 646 OD1 ASP A 46 5.234 12.201 4.135 1.00 4.10 O ATOM 647 OD2 ASP A 46 5.174 12.304 1.933 1.00 4.30 O ATOM 0 H ASP A 46 4.642 14.012 0.718 1.00 1.23 H new ATOM 0 HA ASP A 46 5.872 16.139 2.231 1.00 1.62 H new ATOM 0 HB2 ASP A 46 5.594 14.682 4.082 1.00 1.97 H new ATOM 0 HB3 ASP A 46 4.120 14.690 3.133 1.00 1.97 H new ATOM 652 N LEU A 47 7.603 13.535 1.164 1.00 1.21 N ATOM 653 CA LEU A 47 8.918 12.975 0.840 1.00 1.23 C ATOM 654 C LEU A 47 9.943 13.165 1.964 1.00 1.23 C ATOM 655 O LEU A 47 11.118 13.452 1.748 1.00 1.32 O ATOM 656 CB LEU A 47 9.363 13.407 -0.565 1.00 1.32 C ATOM 657 CG LEU A 47 9.261 14.905 -0.892 1.00 1.81 C ATOM 658 CD1 LEU A 47 10.448 15.712 -0.372 1.00 2.49 C ATOM 659 CD2 LEU A 47 9.159 15.041 -2.407 1.00 2.10 C ATOM 0 H LEU A 47 6.844 12.972 0.780 1.00 1.21 H new ATOM 0 HA LEU A 47 8.834 11.890 0.786 1.00 1.23 H new ATOM 0 HB2 LEU A 47 10.399 13.098 -0.703 1.00 1.32 H new ATOM 0 HB3 LEU A 47 8.767 12.858 -1.294 1.00 1.32 H new ATOM 0 HG LEU A 47 8.380 15.310 -0.393 1.00 1.81 H new ATOM 0 HD11 LEU A 47 10.317 16.762 -0.634 1.00 2.49 H new ATOM 0 HD12 LEU A 47 10.508 15.614 0.712 1.00 2.49 H new ATOM 0 HD13 LEU A 47 11.368 15.337 -0.822 1.00 2.49 H new ATOM 0 HD21 LEU A 47 9.085 16.095 -2.673 1.00 2.10 H new ATOM 0 HD22 LEU A 47 10.046 14.611 -2.871 1.00 2.10 H new ATOM 0 HD23 LEU A 47 8.273 14.514 -2.761 1.00 2.10 H new ATOM 671 N GLN A 48 9.459 12.969 3.190 1.00 1.18 N ATOM 672 CA GLN A 48 10.241 13.066 4.412 1.00 1.19 C ATOM 673 C GLN A 48 10.993 11.756 4.634 1.00 1.17 C ATOM 674 O GLN A 48 10.532 10.698 4.208 1.00 1.15 O ATOM 675 CB GLN A 48 9.317 13.349 5.615 1.00 1.21 C ATOM 676 CG GLN A 48 8.123 12.381 5.646 1.00 2.81 C ATOM 677 CD GLN A 48 7.347 12.344 6.960 1.00 3.46 C ATOM 678 OE1 GLN A 48 7.903 12.438 8.051 1.00 3.43 O ATOM 679 NE2 GLN A 48 6.037 12.152 6.887 1.00 4.75 N ATOM 0 H GLN A 48 8.482 12.731 3.360 1.00 1.18 H new ATOM 0 HA GLN A 48 10.953 13.886 4.318 1.00 1.19 H new ATOM 0 HB2 GLN A 48 9.885 13.258 6.541 1.00 1.21 H new ATOM 0 HB3 GLN A 48 8.954 14.375 5.563 1.00 1.21 H new ATOM 0 HG2 GLN A 48 7.436 12.652 4.845 1.00 2.81 H new ATOM 0 HG3 GLN A 48 8.485 11.376 5.429 1.00 2.81 H new ATOM 0 HE21 GLN A 48 5.583 12.075 5.977 1.00 4.75 H new ATOM 0 HE22 GLN A 48 5.484 12.081 7.741 1.00 4.75 H new ATOM 688 N PRO A 49 12.107 11.773 5.369 1.00 1.21 N ATOM 689 CA PRO A 49 12.714 10.542 5.825 1.00 1.22 C ATOM 690 C PRO A 49 11.785 9.885 6.854 1.00 1.10 C ATOM 691 O PRO A 49 11.592 10.427 7.940 1.00 1.41 O ATOM 692 CB PRO A 49 14.069 10.953 6.402 1.00 1.32 C ATOM 693 CG PRO A 49 13.851 12.400 6.850 1.00 1.33 C ATOM 694 CD PRO A 49 12.825 12.937 5.852 1.00 1.28 C ATOM 0 HA PRO A 49 12.863 9.801 5.040 1.00 1.22 H new ATOM 0 HB2 PRO A 49 14.358 10.315 7.237 1.00 1.32 H new ATOM 0 HB3 PRO A 49 14.860 10.880 5.656 1.00 1.32 H new ATOM 0 HG2 PRO A 49 13.479 12.451 7.873 1.00 1.33 H new ATOM 0 HG3 PRO A 49 14.778 12.973 6.819 1.00 1.33 H new ATOM 0 HD2 PRO A 49 12.148 13.646 6.329 1.00 1.28 H new ATOM 0 HD3 PRO A 49 13.313 13.464 5.033 1.00 1.28 H new ATOM 702 N ILE A 50 11.195 8.734 6.521 1.00 0.76 N ATOM 703 CA ILE A 50 10.386 7.946 7.439 1.00 0.71 C ATOM 704 C ILE A 50 11.286 6.823 7.964 1.00 0.73 C ATOM 705 O ILE A 50 12.301 6.495 7.345 1.00 0.77 O ATOM 706 CB ILE A 50 9.097 7.452 6.734 1.00 0.70 C ATOM 707 CG1 ILE A 50 8.312 8.667 6.203 1.00 0.82 C ATOM 708 CG2 ILE A 50 8.221 6.628 7.683 1.00 0.68 C ATOM 709 CD1 ILE A 50 6.967 8.323 5.552 1.00 1.08 C ATOM 0 H ILE A 50 11.270 8.322 5.591 1.00 0.76 H new ATOM 0 HA ILE A 50 10.030 8.529 8.288 1.00 0.71 H new ATOM 0 HB ILE A 50 9.381 6.805 5.904 1.00 0.70 H new ATOM 0 HG12 ILE A 50 8.136 9.358 7.028 1.00 0.82 H new ATOM 0 HG13 ILE A 50 8.930 9.192 5.474 1.00 0.82 H new ATOM 0 HG21 ILE A 50 7.326 6.297 7.157 1.00 0.68 H new ATOM 0 HG22 ILE A 50 8.779 5.759 8.031 1.00 0.68 H new ATOM 0 HG23 ILE A 50 7.934 7.241 8.538 1.00 0.68 H new ATOM 0 HD11 ILE A 50 6.485 9.238 5.208 1.00 1.08 H new ATOM 0 HD12 ILE A 50 7.133 7.659 4.704 1.00 1.08 H new ATOM 0 HD13 ILE A 50 6.326 7.827 6.281 1.00 1.08 H new ATOM 721 N GLU A 51 10.929 6.246 9.114 1.00 0.74 N ATOM 722 CA GLU A 51 11.611 5.096 9.683 1.00 0.77 C ATOM 723 C GLU A 51 11.530 3.908 8.719 1.00 0.64 C ATOM 724 O GLU A 51 10.886 3.969 7.675 1.00 0.76 O ATOM 725 CB GLU A 51 10.953 4.709 11.021 1.00 0.86 C ATOM 726 CG GLU A 51 11.975 4.467 12.135 1.00 1.13 C ATOM 727 CD GLU A 51 12.148 5.725 12.983 1.00 1.30 C ATOM 728 OE1 GLU A 51 11.261 5.957 13.837 1.00 2.01 O ATOM 729 OE2 GLU A 51 13.138 6.446 12.738 1.00 2.11 O ATOM 0 H GLU A 51 10.146 6.574 9.679 1.00 0.74 H new ATOM 0 HA GLU A 51 12.656 5.355 9.851 1.00 0.77 H new ATOM 0 HB2 GLU A 51 10.269 5.501 11.327 1.00 0.86 H new ATOM 0 HB3 GLU A 51 10.355 3.808 10.880 1.00 0.86 H new ATOM 0 HG2 GLU A 51 11.647 3.639 12.764 1.00 1.13 H new ATOM 0 HG3 GLU A 51 12.933 4.178 11.702 1.00 1.13 H new ATOM 736 N VAL A 52 12.116 2.779 9.107 1.00 0.62 N ATOM 737 CA VAL A 52 12.085 1.583 8.286 1.00 0.57 C ATOM 738 C VAL A 52 11.206 0.550 8.969 1.00 0.58 C ATOM 739 O VAL A 52 11.626 -0.091 9.924 1.00 0.73 O ATOM 740 CB VAL A 52 13.505 1.072 7.994 1.00 0.69 C ATOM 741 CG1 VAL A 52 13.461 0.026 6.876 1.00 0.88 C ATOM 742 CG2 VAL A 52 14.423 2.219 7.554 1.00 0.99 C ATOM 0 H VAL A 52 12.618 2.672 9.988 1.00 0.62 H new ATOM 0 HA VAL A 52 11.652 1.806 7.311 1.00 0.57 H new ATOM 0 HB VAL A 52 13.897 0.631 8.911 1.00 0.69 H new ATOM 0 HG11 VAL A 52 14.470 -0.333 6.673 1.00 0.88 H new ATOM 0 HG12 VAL A 52 12.834 -0.810 7.185 1.00 0.88 H new ATOM 0 HG13 VAL A 52 13.048 0.476 5.973 1.00 0.88 H new ATOM 0 HG21 VAL A 52 15.421 1.830 7.354 1.00 0.99 H new ATOM 0 HG22 VAL A 52 14.024 2.678 6.649 1.00 0.99 H new ATOM 0 HG23 VAL A 52 14.477 2.966 8.346 1.00 0.99 H new ATOM 752 N GLY A 53 9.965 0.439 8.492 1.00 0.54 N ATOM 753 CA GLY A 53 8.959 -0.466 9.029 1.00 0.67 C ATOM 754 C GLY A 53 7.708 0.321 9.400 1.00 0.72 C ATOM 755 O GLY A 53 6.591 -0.171 9.296 1.00 1.18 O ATOM 0 H GLY A 53 9.628 0.991 7.703 1.00 0.54 H new ATOM 0 HA2 GLY A 53 8.714 -1.232 8.293 1.00 0.67 H new ATOM 0 HA3 GLY A 53 9.350 -0.981 9.906 1.00 0.67 H new ATOM 759 N LYS A 54 7.892 1.571 9.824 1.00 0.44 N ATOM 760 CA LYS A 54 6.847 2.400 10.368 1.00 0.40 C ATOM 761 C LYS A 54 6.093 3.020 9.200 1.00 0.42 C ATOM 762 O LYS A 54 6.712 3.515 8.262 1.00 0.47 O ATOM 763 CB LYS A 54 7.570 3.467 11.196 1.00 0.45 C ATOM 764 CG LYS A 54 6.661 4.463 11.897 1.00 1.62 C ATOM 765 CD LYS A 54 5.951 3.864 13.117 1.00 1.94 C ATOM 766 CE LYS A 54 5.145 4.947 13.847 1.00 3.39 C ATOM 767 NZ LYS A 54 5.894 5.544 14.977 1.00 3.59 N ATOM 0 H LYS A 54 8.800 2.036 9.793 1.00 0.44 H new ATOM 0 HA LYS A 54 6.129 1.860 10.986 1.00 0.40 H new ATOM 0 HB2 LYS A 54 8.184 2.969 11.946 1.00 0.45 H new ATOM 0 HB3 LYS A 54 8.248 4.015 10.542 1.00 0.45 H new ATOM 0 HG2 LYS A 54 7.249 5.325 12.212 1.00 1.62 H new ATOM 0 HG3 LYS A 54 5.915 4.827 11.190 1.00 1.62 H new ATOM 0 HD2 LYS A 54 5.288 3.058 12.802 1.00 1.94 H new ATOM 0 HD3 LYS A 54 6.684 3.427 13.795 1.00 1.94 H new ATOM 0 HE2 LYS A 54 4.873 5.731 13.141 1.00 3.39 H new ATOM 0 HE3 LYS A 54 4.215 4.516 14.218 1.00 3.39 H new ATOM 0 HZ1 LYS A 54 5.308 6.269 15.437 1.00 3.59 H new ATOM 0 HZ2 LYS A 54 6.132 4.802 15.666 1.00 3.59 H new ATOM 0 HZ3 LYS A 54 6.769 5.980 14.622 1.00 3.59 H new ATOM 781 N ALA A 55 4.767 3.060 9.275 1.00 0.43 N ATOM 782 CA ALA A 55 3.977 3.847 8.333 1.00 0.43 C ATOM 783 C ALA A 55 3.650 5.198 8.971 1.00 0.41 C ATOM 784 O ALA A 55 3.470 5.280 10.187 1.00 0.45 O ATOM 785 CB ALA A 55 2.696 3.093 7.966 1.00 0.45 C ATOM 0 H ALA A 55 4.218 2.560 9.974 1.00 0.43 H new ATOM 0 HA ALA A 55 4.544 4.012 7.417 1.00 0.43 H new ATOM 0 HB1 ALA A 55 2.113 3.687 7.263 1.00 0.45 H new ATOM 0 HB2 ALA A 55 2.954 2.139 7.507 1.00 0.45 H new ATOM 0 HB3 ALA A 55 2.108 2.915 8.866 1.00 0.45 H new ATOM 791 N ARG A 56 3.570 6.264 8.168 1.00 0.38 N ATOM 792 CA ARG A 56 3.263 7.607 8.648 1.00 0.34 C ATOM 793 C ARG A 56 2.280 8.253 7.673 1.00 0.35 C ATOM 794 O ARG A 56 2.488 8.202 6.466 1.00 0.37 O ATOM 795 CB ARG A 56 4.582 8.401 8.779 1.00 0.48 C ATOM 796 CG ARG A 56 4.833 8.908 10.206 1.00 1.00 C ATOM 797 CD ARG A 56 4.471 10.388 10.376 1.00 1.95 C ATOM 798 NE ARG A 56 5.626 11.273 10.122 1.00 2.13 N ATOM 799 CZ ARG A 56 5.805 12.471 10.699 1.00 2.93 C ATOM 800 NH1 ARG A 56 6.960 13.119 10.563 1.00 3.67 N ATOM 801 NH2 ARG A 56 4.824 13.023 11.413 1.00 3.98 N ATOM 0 H ARG A 56 3.718 6.214 7.160 1.00 0.38 H new ATOM 0 HA ARG A 56 2.794 7.589 9.632 1.00 0.34 H new ATOM 0 HB2 ARG A 56 5.414 7.767 8.472 1.00 0.48 H new ATOM 0 HB3 ARG A 56 4.559 9.250 8.096 1.00 0.48 H new ATOM 0 HG2 ARG A 56 4.250 8.312 10.908 1.00 1.00 H new ATOM 0 HG3 ARG A 56 5.883 8.763 10.460 1.00 1.00 H new ATOM 0 HD2 ARG A 56 3.661 10.644 9.693 1.00 1.95 H new ATOM 0 HD3 ARG A 56 4.100 10.557 11.387 1.00 1.95 H new ATOM 0 HE ARG A 56 6.335 10.952 9.463 1.00 2.13 H new ATOM 0 HH11 ARG A 56 7.716 12.705 10.017 1.00 3.67 H new ATOM 0 HH12 ARG A 56 7.089 14.029 11.004 1.00 3.67 H new ATOM 0 HH21 ARG A 56 3.935 12.535 11.522 1.00 3.98 H new ATOM 0 HH22 ARG A 56 4.962 13.934 11.851 1.00 3.98 H new ATOM 815 N LEU A 57 1.183 8.824 8.176 1.00 0.47 N ATOM 816 CA LEU A 57 0.227 9.524 7.329 1.00 0.61 C ATOM 817 C LEU A 57 0.733 10.916 6.963 1.00 0.68 C ATOM 818 O LEU A 57 1.627 11.446 7.623 1.00 0.81 O ATOM 819 CB LEU A 57 -1.173 9.585 7.964 1.00 0.81 C ATOM 820 CG LEU A 57 -1.284 10.424 9.250 1.00 1.18 C ATOM 821 CD1 LEU A 57 -2.565 11.262 9.209 1.00 1.92 C ATOM 822 CD2 LEU A 57 -1.335 9.523 10.489 1.00 1.33 C ATOM 0 H LEU A 57 0.939 8.813 9.166 1.00 0.47 H new ATOM 0 HA LEU A 57 0.132 8.949 6.408 1.00 0.61 H new ATOM 0 HB2 LEU A 57 -1.869 9.987 7.228 1.00 0.81 H new ATOM 0 HB3 LEU A 57 -1.496 8.568 8.186 1.00 0.81 H new ATOM 0 HG LEU A 57 -0.407 11.068 9.309 1.00 1.18 H new ATOM 0 HD11 LEU A 57 -2.641 11.855 10.120 1.00 1.92 H new ATOM 0 HD12 LEU A 57 -2.538 11.926 8.345 1.00 1.92 H new ATOM 0 HD13 LEU A 57 -3.429 10.602 9.132 1.00 1.92 H new ATOM 0 HD21 LEU A 57 -1.413 10.140 11.384 1.00 1.33 H new ATOM 0 HD22 LEU A 57 -2.201 8.865 10.425 1.00 1.33 H new ATOM 0 HD23 LEU A 57 -0.427 8.923 10.540 1.00 1.33 H new ATOM 834 N VAL A 58 0.135 11.515 5.929 1.00 0.71 N ATOM 835 CA VAL A 58 0.509 12.808 5.407 1.00 0.81 C ATOM 836 C VAL A 58 -0.761 13.646 5.265 1.00 0.89 C ATOM 837 O VAL A 58 -1.799 13.183 4.786 1.00 0.82 O ATOM 838 CB VAL A 58 1.280 12.646 4.085 1.00 0.88 C ATOM 839 CG1 VAL A 58 2.211 11.431 4.118 1.00 1.37 C ATOM 840 CG2 VAL A 58 0.383 12.502 2.856 1.00 1.29 C ATOM 0 H VAL A 58 -0.644 11.091 5.426 1.00 0.71 H new ATOM 0 HA VAL A 58 1.186 13.328 6.085 1.00 0.81 H new ATOM 0 HB VAL A 58 1.848 13.572 3.995 1.00 0.88 H new ATOM 0 HG11 VAL A 58 2.738 11.350 3.167 1.00 1.37 H new ATOM 0 HG12 VAL A 58 2.935 11.549 4.925 1.00 1.37 H new ATOM 0 HG13 VAL A 58 1.625 10.528 4.286 1.00 1.37 H new ATOM 0 HG21 VAL A 58 1.001 12.392 1.965 1.00 1.29 H new ATOM 0 HG22 VAL A 58 -0.250 11.622 2.969 1.00 1.29 H new ATOM 0 HG23 VAL A 58 -0.243 13.389 2.756 1.00 1.29 H new ATOM 850 N LYS A 59 -0.691 14.895 5.715 1.00 1.20 N ATOM 851 CA LYS A 59 -1.818 15.812 5.676 1.00 1.39 C ATOM 852 C LYS A 59 -1.920 16.449 4.294 1.00 1.35 C ATOM 853 O LYS A 59 -1.595 17.619 4.112 1.00 1.77 O ATOM 854 CB LYS A 59 -1.664 16.854 6.800 1.00 2.00 C ATOM 855 CG LYS A 59 -0.363 17.677 6.687 1.00 3.61 C ATOM 856 CD LYS A 59 0.315 17.912 8.040 1.00 3.88 C ATOM 857 CE LYS A 59 1.776 18.290 7.775 1.00 5.51 C ATOM 858 NZ LYS A 59 2.509 18.599 9.021 1.00 6.10 N ATOM 0 H LYS A 59 0.155 15.298 6.118 1.00 1.20 H new ATOM 0 HA LYS A 59 -2.752 15.277 5.849 1.00 1.39 H new ATOM 0 HB2 LYS A 59 -2.518 17.531 6.780 1.00 2.00 H new ATOM 0 HB3 LYS A 59 -1.683 16.346 7.764 1.00 2.00 H new ATOM 0 HG2 LYS A 59 0.331 17.160 6.024 1.00 3.61 H new ATOM 0 HG3 LYS A 59 -0.587 18.639 6.227 1.00 3.61 H new ATOM 0 HD2 LYS A 59 -0.191 18.707 8.588 1.00 3.88 H new ATOM 0 HD3 LYS A 59 0.259 17.015 8.656 1.00 3.88 H new ATOM 0 HE2 LYS A 59 2.273 17.470 7.257 1.00 5.51 H new ATOM 0 HE3 LYS A 59 1.811 19.154 7.111 1.00 5.51 H new ATOM 0 HZ1 LYS A 59 3.492 18.849 8.792 1.00 6.10 H new ATOM 0 HZ2 LYS A 59 2.052 19.399 9.504 1.00 6.10 H new ATOM 0 HZ3 LYS A 59 2.500 17.767 9.645 1.00 6.10 H new ATOM 872 N GLY A 60 -2.389 15.693 3.305 1.00 1.15 N ATOM 873 CA GLY A 60 -2.650 16.255 2.005 1.00 1.37 C ATOM 874 C GLY A 60 -3.848 17.182 2.142 1.00 1.31 C ATOM 875 O GLY A 60 -4.938 16.742 2.494 1.00 1.27 O ATOM 0 H GLY A 60 -2.592 14.697 3.389 1.00 1.15 H new ATOM 0 HA2 GLY A 60 -1.780 16.803 1.642 1.00 1.37 H new ATOM 0 HA3 GLY A 60 -2.855 15.467 1.280 1.00 1.37 H new ATOM 879 N ALA A 61 -3.652 18.468 1.861 1.00 1.42 N ATOM 880 CA ALA A 61 -4.742 19.439 1.864 1.00 1.50 C ATOM 881 C ALA A 61 -5.862 18.985 0.929 1.00 1.39 C ATOM 882 O ALA A 61 -7.040 19.146 1.233 1.00 1.41 O ATOM 883 CB ALA A 61 -4.230 20.826 1.470 1.00 1.72 C ATOM 0 H ALA A 61 -2.741 18.863 1.627 1.00 1.42 H new ATOM 0 HA ALA A 61 -5.146 19.504 2.874 1.00 1.50 H new ATOM 0 HB1 ALA A 61 -5.058 21.535 1.478 1.00 1.72 H new ATOM 0 HB2 ALA A 61 -3.469 21.148 2.181 1.00 1.72 H new ATOM 0 HB3 ALA A 61 -3.798 20.784 0.470 1.00 1.72 H new ATOM 889 N ALA A 62 -5.484 18.394 -0.206 1.00 1.31 N ATOM 890 CA ALA A 62 -6.428 17.815 -1.146 1.00 1.24 C ATOM 891 C ALA A 62 -7.182 16.642 -0.505 1.00 1.14 C ATOM 892 O ALA A 62 -8.402 16.549 -0.638 1.00 1.17 O ATOM 893 CB ALA A 62 -5.670 17.382 -2.405 1.00 1.24 C ATOM 0 H ALA A 62 -4.510 18.306 -0.494 1.00 1.31 H new ATOM 0 HA ALA A 62 -7.176 18.557 -1.424 1.00 1.24 H new ATOM 0 HB1 ALA A 62 -6.369 16.945 -3.118 1.00 1.24 H new ATOM 0 HB2 ALA A 62 -5.186 18.249 -2.855 1.00 1.24 H new ATOM 0 HB3 ALA A 62 -4.914 16.643 -2.139 1.00 1.24 H new ATOM 899 N LYS A 63 -6.481 15.724 0.172 1.00 1.02 N ATOM 900 CA LYS A 63 -7.104 14.665 0.958 1.00 0.92 C ATOM 901 C LYS A 63 -6.035 14.072 1.871 1.00 0.86 C ATOM 902 O LYS A 63 -4.859 14.071 1.514 1.00 0.90 O ATOM 903 CB LYS A 63 -7.669 13.575 0.031 1.00 0.84 C ATOM 904 CG LYS A 63 -8.765 12.722 0.685 1.00 1.37 C ATOM 905 CD LYS A 63 -10.101 13.473 0.724 1.00 2.26 C ATOM 906 CE LYS A 63 -11.177 12.568 1.332 1.00 3.02 C ATOM 907 NZ LYS A 63 -12.526 13.163 1.213 1.00 3.48 N ATOM 0 H LYS A 63 -5.461 15.699 0.187 1.00 1.02 H new ATOM 0 HA LYS A 63 -7.928 15.067 1.547 1.00 0.92 H new ATOM 0 HB2 LYS A 63 -8.072 14.045 -0.866 1.00 0.84 H new ATOM 0 HB3 LYS A 63 -6.855 12.924 -0.289 1.00 0.84 H new ATOM 0 HG2 LYS A 63 -8.884 11.791 0.131 1.00 1.37 H new ATOM 0 HG3 LYS A 63 -8.465 12.454 1.698 1.00 1.37 H new ATOM 0 HD2 LYS A 63 -10.001 14.384 1.314 1.00 2.26 H new ATOM 0 HD3 LYS A 63 -10.390 13.775 -0.283 1.00 2.26 H new ATOM 0 HE2 LYS A 63 -11.162 11.599 0.833 1.00 3.02 H new ATOM 0 HE3 LYS A 63 -10.950 12.389 2.383 1.00 3.02 H new ATOM 0 HZ1 LYS A 63 -13.227 12.521 1.636 1.00 3.48 H new ATOM 0 HZ2 LYS A 63 -12.548 14.076 1.711 1.00 3.48 H new ATOM 0 HZ3 LYS A 63 -12.753 13.311 0.209 1.00 3.48 H new ATOM 921 N HIS A 64 -6.430 13.531 3.024 1.00 0.92 N ATOM 922 CA HIS A 64 -5.506 12.796 3.873 1.00 0.88 C ATOM 923 C HIS A 64 -5.003 11.573 3.109 1.00 0.77 C ATOM 924 O HIS A 64 -5.813 10.821 2.567 1.00 0.75 O ATOM 925 CB HIS A 64 -6.216 12.357 5.159 1.00 0.97 C ATOM 926 CG HIS A 64 -6.780 13.486 5.988 1.00 1.16 C ATOM 927 ND1 HIS A 64 -7.682 13.340 7.020 1.00 1.42 N ATOM 928 CD2 HIS A 64 -6.500 14.822 5.867 1.00 1.21 C ATOM 929 CE1 HIS A 64 -7.936 14.565 7.509 1.00 1.58 C ATOM 930 NE2 HIS A 64 -7.242 15.498 6.838 1.00 1.44 N ATOM 0 H HIS A 64 -7.382 13.590 3.386 1.00 0.92 H new ATOM 0 HA HIS A 64 -4.663 13.433 4.142 1.00 0.88 H new ATOM 0 HB2 HIS A 64 -7.027 11.678 4.896 1.00 0.97 H new ATOM 0 HB3 HIS A 64 -5.513 11.792 5.771 1.00 0.97 H new ATOM 0 HD2 HIS A 64 -5.828 15.271 5.151 1.00 1.21 H new ATOM 0 HE1 HIS A 64 -8.607 14.771 8.330 1.00 1.58 H new ATOM 0 HE2 HIS A 64 -7.254 16.504 7.005 1.00 1.44 H new ATOM 938 N ILE A 65 -3.688 11.361 3.088 1.00 0.76 N ATOM 939 CA ILE A 65 -3.068 10.203 2.447 1.00 0.65 C ATOM 940 C ILE A 65 -2.284 9.463 3.526 1.00 0.58 C ATOM 941 O ILE A 65 -1.981 10.031 4.572 1.00 0.64 O ATOM 942 CB ILE A 65 -2.223 10.650 1.223 1.00 0.60 C ATOM 943 CG1 ILE A 65 -2.994 10.530 -0.103 1.00 0.84 C ATOM 944 CG2 ILE A 65 -0.955 9.827 0.973 1.00 0.76 C ATOM 945 CD1 ILE A 65 -3.995 11.651 -0.317 1.00 0.88 C ATOM 0 H ILE A 65 -3.016 11.995 3.520 1.00 0.76 H new ATOM 0 HA ILE A 65 -3.803 9.513 2.032 1.00 0.65 H new ATOM 0 HB ILE A 65 -1.976 11.677 1.492 1.00 0.60 H new ATOM 0 HG12 ILE A 65 -2.283 10.524 -0.930 1.00 0.84 H new ATOM 0 HG13 ILE A 65 -3.518 9.575 -0.126 1.00 0.84 H new ATOM 0 HG21 ILE A 65 -0.435 10.217 0.098 1.00 0.76 H new ATOM 0 HG22 ILE A 65 -0.301 9.893 1.843 1.00 0.76 H new ATOM 0 HG23 ILE A 65 -1.226 8.785 0.800 1.00 0.76 H new ATOM 0 HD11 ILE A 65 -4.504 11.507 -1.270 1.00 0.88 H new ATOM 0 HD12 ILE A 65 -4.727 11.644 0.491 1.00 0.88 H new ATOM 0 HD13 ILE A 65 -3.473 12.608 -0.326 1.00 0.88 H new ATOM 957 N ILE A 66 -1.950 8.197 3.290 1.00 0.53 N ATOM 958 CA ILE A 66 -1.164 7.384 4.198 1.00 0.49 C ATOM 959 C ILE A 66 0.065 6.942 3.413 1.00 0.45 C ATOM 960 O ILE A 66 -0.052 6.580 2.241 1.00 0.48 O ATOM 961 CB ILE A 66 -1.972 6.179 4.706 1.00 0.57 C ATOM 962 CG1 ILE A 66 -3.433 6.495 5.086 1.00 0.70 C ATOM 963 CG2 ILE A 66 -1.258 5.515 5.891 1.00 0.59 C ATOM 964 CD1 ILE A 66 -3.583 7.423 6.292 1.00 0.68 C ATOM 0 H ILE A 66 -2.227 7.702 2.442 1.00 0.53 H new ATOM 0 HA ILE A 66 -0.878 7.947 5.087 1.00 0.49 H new ATOM 0 HB ILE A 66 -2.026 5.495 3.859 1.00 0.57 H new ATOM 0 HG12 ILE A 66 -3.929 6.950 4.228 1.00 0.70 H new ATOM 0 HG13 ILE A 66 -3.952 5.560 5.295 1.00 0.70 H new ATOM 0 HG21 ILE A 66 -1.844 4.664 6.238 1.00 0.59 H new ATOM 0 HG22 ILE A 66 -0.272 5.173 5.576 1.00 0.59 H new ATOM 0 HG23 ILE A 66 -1.150 6.236 6.701 1.00 0.59 H new ATOM 0 HD11 ILE A 66 -4.641 7.593 6.491 1.00 0.68 H new ATOM 0 HD12 ILE A 66 -3.119 6.963 7.165 1.00 0.68 H new ATOM 0 HD13 ILE A 66 -3.096 8.375 6.081 1.00 0.68 H new ATOM 976 N HIS A 67 1.239 6.961 4.041 1.00 0.41 N ATOM 977 CA HIS A 67 2.488 6.633 3.373 1.00 0.44 C ATOM 978 C HIS A 67 3.136 5.470 4.120 1.00 0.42 C ATOM 979 O HIS A 67 3.352 5.530 5.329 1.00 0.46 O ATOM 980 CB HIS A 67 3.371 7.895 3.284 1.00 0.53 C ATOM 981 CG HIS A 67 3.311 8.636 1.960 1.00 1.10 C ATOM 982 ND1 HIS A 67 4.063 9.742 1.610 1.00 1.82 N ATOM 983 CD2 HIS A 67 2.503 8.350 0.887 1.00 1.71 C ATOM 984 CE1 HIS A 67 3.715 10.097 0.365 1.00 2.40 C ATOM 985 NE2 HIS A 67 2.768 9.278 -0.124 1.00 2.40 N ATOM 0 H HIS A 67 1.347 7.204 5.026 1.00 0.41 H new ATOM 0 HA HIS A 67 2.329 6.308 2.345 1.00 0.44 H new ATOM 0 HB2 HIS A 67 3.078 8.581 4.079 1.00 0.53 H new ATOM 0 HB3 HIS A 67 4.405 7.609 3.475 1.00 0.53 H new ATOM 0 HD1 HIS A 67 4.759 10.205 2.195 1.00 1.82 H new ATOM 0 HD2 HIS A 67 1.785 7.545 0.833 1.00 1.71 H new ATOM 0 HE1 HIS A 67 4.140 10.931 -0.174 1.00 2.40 H new ATOM 993 N ALA A 68 3.404 4.378 3.399 1.00 0.46 N ATOM 994 CA ALA A 68 3.887 3.139 3.988 1.00 0.50 C ATOM 995 C ALA A 68 5.319 2.866 3.541 1.00 0.41 C ATOM 996 O ALA A 68 5.658 2.991 2.361 1.00 0.49 O ATOM 997 CB ALA A 68 2.962 1.990 3.580 1.00 0.64 C ATOM 0 H ALA A 68 3.290 4.334 2.386 1.00 0.46 H new ATOM 0 HA ALA A 68 3.884 3.227 5.074 1.00 0.50 H new ATOM 0 HB1 ALA A 68 3.321 1.060 4.020 1.00 0.64 H new ATOM 0 HB2 ALA A 68 1.952 2.193 3.935 1.00 0.64 H new ATOM 0 HB3 ALA A 68 2.953 1.898 2.494 1.00 0.64 H new ATOM 1003 N VAL A 69 6.178 2.464 4.474 1.00 0.56 N ATOM 1004 CA VAL A 69 7.500 2.015 4.143 1.00 0.58 C ATOM 1005 C VAL A 69 7.379 0.570 3.680 1.00 0.64 C ATOM 1006 O VAL A 69 7.170 -0.329 4.488 1.00 0.72 O ATOM 1007 CB VAL A 69 8.398 2.200 5.366 1.00 0.71 C ATOM 1008 CG1 VAL A 69 9.720 1.490 5.112 1.00 1.22 C ATOM 1009 CG2 VAL A 69 8.625 3.693 5.619 1.00 1.50 C ATOM 0 H VAL A 69 5.966 2.445 5.471 1.00 0.56 H new ATOM 0 HA VAL A 69 7.959 2.587 3.336 1.00 0.58 H new ATOM 0 HB VAL A 69 7.925 1.773 6.250 1.00 0.71 H new ATOM 0 HG11 VAL A 69 10.371 1.614 5.977 1.00 1.22 H new ATOM 0 HG12 VAL A 69 9.537 0.429 4.945 1.00 1.22 H new ATOM 0 HG13 VAL A 69 10.200 1.919 4.232 1.00 1.22 H new ATOM 0 HG21 VAL A 69 9.266 3.821 6.492 1.00 1.50 H new ATOM 0 HG22 VAL A 69 9.104 4.141 4.748 1.00 1.50 H new ATOM 0 HG23 VAL A 69 7.667 4.182 5.797 1.00 1.50 H new ATOM 1019 N GLY A 70 7.493 0.358 2.370 1.00 0.82 N ATOM 1020 CA GLY A 70 7.580 -0.970 1.798 1.00 0.97 C ATOM 1021 C GLY A 70 9.050 -1.322 1.595 1.00 1.05 C ATOM 1022 O GLY A 70 9.862 -0.424 1.370 1.00 1.26 O ATOM 0 H GLY A 70 7.527 1.109 1.680 1.00 0.82 H new ATOM 0 HA2 GLY A 70 7.105 -1.697 2.457 1.00 0.97 H new ATOM 0 HA3 GLY A 70 7.048 -1.007 0.847 1.00 0.97 H new ATOM 1026 N PRO A 71 9.402 -2.609 1.665 1.00 1.43 N ATOM 1027 CA PRO A 71 10.753 -3.070 1.403 1.00 1.61 C ATOM 1028 C PRO A 71 11.061 -3.078 -0.090 1.00 1.17 C ATOM 1029 O PRO A 71 10.172 -2.957 -0.932 1.00 1.26 O ATOM 1030 CB PRO A 71 10.804 -4.492 1.958 1.00 2.35 C ATOM 1031 CG PRO A 71 9.352 -4.972 1.882 1.00 2.49 C ATOM 1032 CD PRO A 71 8.529 -3.700 2.056 1.00 1.98 C ATOM 0 HA PRO A 71 11.491 -2.414 1.865 1.00 1.61 H new ATOM 0 HB2 PRO A 71 11.466 -5.127 1.369 1.00 2.35 H new ATOM 0 HB3 PRO A 71 11.176 -4.508 2.982 1.00 2.35 H new ATOM 0 HG2 PRO A 71 9.142 -5.455 0.928 1.00 2.49 H new ATOM 0 HG3 PRO A 71 9.131 -5.699 2.663 1.00 2.49 H new ATOM 0 HD2 PRO A 71 7.633 -3.726 1.436 1.00 1.98 H new ATOM 0 HD3 PRO A 71 8.199 -3.586 3.088 1.00 1.98 H new ATOM 1040 N ASN A 72 12.329 -3.328 -0.421 1.00 1.05 N ATOM 1041 CA ASN A 72 12.775 -3.508 -1.785 1.00 0.87 C ATOM 1042 C ASN A 72 13.670 -4.738 -1.798 1.00 0.84 C ATOM 1043 O ASN A 72 14.856 -4.589 -1.540 1.00 0.91 O ATOM 1044 CB ASN A 72 13.575 -2.276 -2.246 1.00 1.13 C ATOM 1045 CG ASN A 72 12.690 -1.105 -2.645 1.00 1.76 C ATOM 1046 OD1 ASN A 72 12.387 -0.240 -1.834 1.00 2.62 O ATOM 1047 ND2 ASN A 72 12.296 -1.032 -3.909 1.00 2.57 N ATOM 0 H ASN A 72 13.077 -3.410 0.267 1.00 1.05 H new ATOM 0 HA ASN A 72 11.927 -3.631 -2.459 1.00 0.87 H new ATOM 0 HB2 ASN A 72 14.242 -1.962 -1.443 1.00 1.13 H new ATOM 0 HB3 ASN A 72 14.203 -2.554 -3.092 1.00 1.13 H new ATOM 0 HD21 ASN A 72 11.729 -0.244 -4.222 1.00 2.57 H new ATOM 0 HD22 ASN A 72 12.560 -1.764 -4.569 1.00 2.57 H new ATOM 1054 N PHE A 73 13.164 -5.940 -2.102 1.00 0.83 N ATOM 1055 CA PHE A 73 14.031 -7.108 -2.318 1.00 1.02 C ATOM 1056 C PHE A 73 15.053 -6.797 -3.410 1.00 1.24 C ATOM 1057 O PHE A 73 16.183 -7.270 -3.370 1.00 1.52 O ATOM 1058 CB PHE A 73 13.230 -8.380 -2.626 1.00 1.12 C ATOM 1059 CG PHE A 73 14.043 -9.639 -2.884 1.00 2.39 C ATOM 1060 CD1 PHE A 73 14.092 -10.665 -1.922 1.00 3.05 C ATOM 1061 CD2 PHE A 73 14.701 -9.821 -4.118 1.00 3.93 C ATOM 1062 CE1 PHE A 73 14.817 -11.841 -2.182 1.00 4.48 C ATOM 1063 CE2 PHE A 73 15.448 -10.984 -4.365 1.00 5.27 C ATOM 1064 CZ PHE A 73 15.515 -11.991 -3.390 1.00 5.38 C ATOM 0 H PHE A 73 12.167 -6.130 -2.204 1.00 0.83 H new ATOM 0 HA PHE A 73 14.565 -7.312 -1.390 1.00 1.02 H new ATOM 0 HB2 PHE A 73 12.557 -8.572 -1.790 1.00 1.12 H new ATOM 0 HB3 PHE A 73 12.607 -8.189 -3.500 1.00 1.12 H new ATOM 0 HD1 PHE A 73 13.572 -10.549 -0.983 1.00 3.05 H new ATOM 0 HD2 PHE A 73 14.630 -9.059 -4.880 1.00 3.93 H new ATOM 0 HE1 PHE A 73 14.837 -12.633 -1.448 1.00 4.48 H new ATOM 0 HE2 PHE A 73 15.970 -11.103 -5.303 1.00 5.27 H new ATOM 0 HZ PHE A 73 16.102 -12.879 -3.569 1.00 5.38 H new ATOM 1074 N ASN A 74 14.715 -5.933 -4.370 1.00 1.22 N ATOM 1075 CA ASN A 74 15.685 -5.556 -5.390 1.00 1.46 C ATOM 1076 C ASN A 74 16.958 -4.908 -4.814 1.00 1.82 C ATOM 1077 O ASN A 74 17.921 -4.735 -5.558 1.00 2.42 O ATOM 1078 CB ASN A 74 15.032 -4.672 -6.461 1.00 1.45 C ATOM 1079 CG ASN A 74 14.964 -3.206 -6.067 1.00 3.04 C ATOM 1080 OD1 ASN A 74 13.934 -2.718 -5.624 1.00 4.99 O ATOM 1081 ND2 ASN A 74 16.057 -2.477 -6.223 1.00 3.24 N ATOM 0 H ASN A 74 13.799 -5.493 -4.459 1.00 1.22 H new ATOM 0 HA ASN A 74 16.017 -6.481 -5.861 1.00 1.46 H new ATOM 0 HB2 ASN A 74 15.592 -4.766 -7.391 1.00 1.45 H new ATOM 0 HB3 ASN A 74 14.024 -5.036 -6.658 1.00 1.45 H new ATOM 0 HD21 ASN A 74 16.051 -1.488 -5.972 1.00 3.24 H new ATOM 0 HD22 ASN A 74 16.906 -2.904 -6.594 1.00 3.24 H new ATOM 1088 N LYS A 75 16.956 -4.493 -3.540 1.00 1.55 N ATOM 1089 CA LYS A 75 18.109 -3.977 -2.799 1.00 1.75 C ATOM 1090 C LYS A 75 18.151 -4.512 -1.357 1.00 1.53 C ATOM 1091 O LYS A 75 18.830 -3.932 -0.514 1.00 1.55 O ATOM 1092 CB LYS A 75 18.052 -2.443 -2.819 1.00 1.92 C ATOM 1093 CG LYS A 75 18.761 -1.903 -4.062 1.00 2.25 C ATOM 1094 CD LYS A 75 18.491 -0.412 -4.216 1.00 3.45 C ATOM 1095 CE LYS A 75 19.224 0.076 -5.470 1.00 3.86 C ATOM 1096 NZ LYS A 75 19.042 1.524 -5.710 1.00 5.32 N ATOM 0 H LYS A 75 16.108 -4.510 -2.973 1.00 1.55 H new ATOM 0 HA LYS A 75 19.025 -4.321 -3.280 1.00 1.75 H new ATOM 0 HB2 LYS A 75 17.014 -2.110 -2.811 1.00 1.92 H new ATOM 0 HB3 LYS A 75 18.522 -2.043 -1.921 1.00 1.92 H new ATOM 0 HG2 LYS A 75 19.834 -2.079 -3.983 1.00 2.25 H new ATOM 0 HG3 LYS A 75 18.415 -2.436 -4.947 1.00 2.25 H new ATOM 0 HD2 LYS A 75 17.421 -0.226 -4.304 1.00 3.45 H new ATOM 0 HD3 LYS A 75 18.838 0.131 -3.337 1.00 3.45 H new ATOM 0 HE2 LYS A 75 20.288 -0.141 -5.372 1.00 3.86 H new ATOM 0 HE3 LYS A 75 18.864 -0.480 -6.336 1.00 3.86 H new ATOM 0 HZ1 LYS A 75 19.558 1.801 -6.569 1.00 5.32 H new ATOM 0 HZ2 LYS A 75 18.030 1.731 -5.832 1.00 5.32 H new ATOM 0 HZ3 LYS A 75 19.410 2.059 -4.898 1.00 5.32 H new ATOM 1110 N VAL A 76 17.441 -5.595 -1.043 1.00 1.39 N ATOM 1111 CA VAL A 76 17.340 -6.100 0.327 1.00 1.34 C ATOM 1112 C VAL A 76 17.060 -7.609 0.304 1.00 1.35 C ATOM 1113 O VAL A 76 16.597 -8.127 -0.704 1.00 1.48 O ATOM 1114 CB VAL A 76 16.281 -5.272 1.098 1.00 1.32 C ATOM 1115 CG1 VAL A 76 14.916 -5.939 1.317 1.00 1.42 C ATOM 1116 CG2 VAL A 76 16.814 -4.890 2.471 1.00 1.13 C ATOM 0 H VAL A 76 16.922 -6.145 -1.727 1.00 1.39 H new ATOM 0 HA VAL A 76 18.281 -5.977 0.863 1.00 1.34 H new ATOM 0 HB VAL A 76 16.109 -4.416 0.445 1.00 1.32 H new ATOM 0 HG11 VAL A 76 14.264 -5.261 1.867 1.00 1.42 H new ATOM 0 HG12 VAL A 76 14.466 -6.172 0.352 1.00 1.42 H new ATOM 0 HG13 VAL A 76 15.048 -6.858 1.888 1.00 1.42 H new ATOM 0 HG21 VAL A 76 16.062 -4.308 3.004 1.00 1.13 H new ATOM 0 HG22 VAL A 76 17.043 -5.793 3.037 1.00 1.13 H new ATOM 0 HG23 VAL A 76 17.720 -4.294 2.357 1.00 1.13 H new ATOM 1126 N SER A 77 17.340 -8.346 1.381 1.00 1.26 N ATOM 1127 CA SER A 77 17.081 -9.778 1.395 1.00 1.32 C ATOM 1128 C SER A 77 15.628 -10.041 1.770 1.00 1.33 C ATOM 1129 O SER A 77 15.015 -9.252 2.484 1.00 1.26 O ATOM 1130 CB SER A 77 18.006 -10.451 2.409 1.00 1.30 C ATOM 1131 OG SER A 77 19.346 -10.284 2.002 1.00 1.88 O ATOM 0 H SER A 77 17.741 -7.976 2.243 1.00 1.26 H new ATOM 0 HA SER A 77 17.269 -10.187 0.402 1.00 1.32 H new ATOM 0 HB2 SER A 77 17.858 -10.017 3.398 1.00 1.30 H new ATOM 0 HB3 SER A 77 17.768 -11.512 2.488 1.00 1.30 H new ATOM 0 HG SER A 77 19.941 -10.713 2.652 1.00 1.88 H new ATOM 1137 N GLU A 78 15.104 -11.207 1.385 1.00 1.40 N ATOM 1138 CA GLU A 78 13.759 -11.662 1.719 1.00 1.39 C ATOM 1139 C GLU A 78 13.518 -11.654 3.223 1.00 1.29 C ATOM 1140 O GLU A 78 12.387 -11.520 3.658 1.00 1.21 O ATOM 1141 CB GLU A 78 13.536 -13.081 1.175 1.00 1.49 C ATOM 1142 CG GLU A 78 12.234 -13.161 0.376 1.00 1.54 C ATOM 1143 CD GLU A 78 11.990 -14.590 -0.115 1.00 1.80 C ATOM 1144 OE1 GLU A 78 11.131 -15.275 0.484 1.00 2.37 O ATOM 1145 OE2 GLU A 78 12.728 -15.004 -1.044 1.00 2.93 O ATOM 0 H GLU A 78 15.621 -11.877 0.816 1.00 1.40 H new ATOM 0 HA GLU A 78 13.054 -10.970 1.258 1.00 1.39 H new ATOM 0 HB2 GLU A 78 14.375 -13.368 0.541 1.00 1.49 H new ATOM 0 HB3 GLU A 78 13.504 -13.791 2.002 1.00 1.49 H new ATOM 0 HG2 GLU A 78 11.399 -12.837 0.997 1.00 1.54 H new ATOM 0 HG3 GLU A 78 12.281 -12.481 -0.475 1.00 1.54 H new ATOM 1152 N VAL A 79 14.569 -11.797 4.030 1.00 1.30 N ATOM 1153 CA VAL A 79 14.441 -11.765 5.481 1.00 1.27 C ATOM 1154 C VAL A 79 13.977 -10.373 5.905 1.00 1.19 C ATOM 1155 O VAL A 79 13.066 -10.213 6.716 1.00 1.17 O ATOM 1156 CB VAL A 79 15.792 -12.140 6.112 1.00 1.39 C ATOM 1157 CG1 VAL A 79 15.770 -12.028 7.639 1.00 1.40 C ATOM 1158 CG2 VAL A 79 16.164 -13.577 5.728 1.00 1.47 C ATOM 0 H VAL A 79 15.523 -11.937 3.698 1.00 1.30 H new ATOM 0 HA VAL A 79 13.700 -12.487 5.825 1.00 1.27 H new ATOM 0 HB VAL A 79 16.531 -11.436 5.730 1.00 1.39 H new ATOM 0 HG11 VAL A 79 16.746 -12.303 8.038 1.00 1.40 H new ATOM 0 HG12 VAL A 79 15.537 -11.002 7.925 1.00 1.40 H new ATOM 0 HG13 VAL A 79 15.011 -12.699 8.042 1.00 1.40 H new ATOM 0 HG21 VAL A 79 17.122 -13.837 6.178 1.00 1.47 H new ATOM 0 HG22 VAL A 79 15.396 -14.261 6.089 1.00 1.47 H new ATOM 0 HG23 VAL A 79 16.239 -13.656 4.643 1.00 1.47 H new ATOM 1168 N GLU A 80 14.617 -9.348 5.352 1.00 1.19 N ATOM 1169 CA GLU A 80 14.297 -7.980 5.706 1.00 1.16 C ATOM 1170 C GLU A 80 12.968 -7.590 5.076 1.00 1.06 C ATOM 1171 O GLU A 80 12.218 -6.818 5.657 1.00 1.03 O ATOM 1172 CB GLU A 80 15.424 -7.060 5.221 1.00 1.33 C ATOM 1173 CG GLU A 80 15.406 -5.712 5.943 1.00 1.26 C ATOM 1174 CD GLU A 80 15.994 -5.837 7.347 1.00 1.40 C ATOM 1175 OE1 GLU A 80 17.239 -5.780 7.449 1.00 2.23 O ATOM 1176 OE2 GLU A 80 15.189 -6.005 8.290 1.00 2.29 O ATOM 0 H GLU A 80 15.359 -9.444 4.658 1.00 1.19 H new ATOM 0 HA GLU A 80 14.206 -7.882 6.788 1.00 1.16 H new ATOM 0 HB2 GLU A 80 16.386 -7.547 5.383 1.00 1.33 H new ATOM 0 HB3 GLU A 80 15.325 -6.899 4.147 1.00 1.33 H new ATOM 0 HG2 GLU A 80 15.976 -4.980 5.370 1.00 1.26 H new ATOM 0 HG3 GLU A 80 14.383 -5.342 6.005 1.00 1.26 H new ATOM 1183 N GLY A 81 12.656 -8.117 3.892 1.00 1.04 N ATOM 1184 CA GLY A 81 11.404 -7.806 3.231 1.00 0.98 C ATOM 1185 C GLY A 81 10.231 -8.546 3.840 1.00 0.90 C ATOM 1186 O GLY A 81 9.115 -8.059 3.747 1.00 0.84 O ATOM 0 H GLY A 81 13.257 -8.760 3.377 1.00 1.04 H new ATOM 0 HA2 GLY A 81 11.223 -6.733 3.288 1.00 0.98 H new ATOM 0 HA3 GLY A 81 11.481 -8.060 2.174 1.00 0.98 H new ATOM 1190 N ASP A 82 10.452 -9.698 4.463 1.00 0.91 N ATOM 1191 CA ASP A 82 9.423 -10.397 5.212 1.00 0.85 C ATOM 1192 C ASP A 82 9.047 -9.520 6.391 1.00 0.77 C ATOM 1193 O ASP A 82 7.887 -9.153 6.567 1.00 0.68 O ATOM 1194 CB ASP A 82 9.941 -11.757 5.693 1.00 0.95 C ATOM 1195 CG ASP A 82 9.014 -12.360 6.748 1.00 1.02 C ATOM 1196 OD1 ASP A 82 9.451 -12.431 7.918 1.00 2.03 O ATOM 1197 OD2 ASP A 82 7.881 -12.727 6.369 1.00 2.19 O ATOM 0 H ASP A 82 11.355 -10.173 4.461 1.00 0.91 H new ATOM 0 HA ASP A 82 8.552 -10.585 4.584 1.00 0.85 H new ATOM 0 HB2 ASP A 82 10.024 -12.438 4.846 1.00 0.95 H new ATOM 0 HB3 ASP A 82 10.942 -11.642 6.108 1.00 0.95 H new ATOM 1202 N LYS A 83 10.047 -9.119 7.177 1.00 0.80 N ATOM 1203 CA LYS A 83 9.744 -8.349 8.367 1.00 0.70 C ATOM 1204 C LYS A 83 9.181 -6.997 7.985 1.00 0.61 C ATOM 1205 O LYS A 83 8.217 -6.567 8.595 1.00 0.52 O ATOM 1206 CB LYS A 83 10.961 -8.213 9.275 1.00 0.72 C ATOM 1207 CG LYS A 83 11.178 -9.544 10.004 1.00 0.99 C ATOM 1208 CD LYS A 83 12.368 -9.498 10.965 1.00 1.13 C ATOM 1209 CE LYS A 83 12.145 -8.432 12.044 1.00 2.52 C ATOM 1210 NZ LYS A 83 13.154 -8.525 13.119 1.00 3.02 N ATOM 0 H LYS A 83 11.036 -9.309 7.015 1.00 0.80 H new ATOM 0 HA LYS A 83 8.986 -8.887 8.937 1.00 0.70 H new ATOM 0 HB2 LYS A 83 11.843 -7.954 8.689 1.00 0.72 H new ATOM 0 HB3 LYS A 83 10.809 -7.408 9.994 1.00 0.72 H new ATOM 0 HG2 LYS A 83 10.276 -9.802 10.559 1.00 0.99 H new ATOM 0 HG3 LYS A 83 11.338 -10.335 9.271 1.00 0.99 H new ATOM 0 HD2 LYS A 83 12.504 -10.474 11.432 1.00 1.13 H new ATOM 0 HD3 LYS A 83 13.281 -9.279 10.412 1.00 1.13 H new ATOM 0 HE2 LYS A 83 12.186 -7.441 11.591 1.00 2.52 H new ATOM 0 HE3 LYS A 83 11.148 -8.547 12.469 1.00 2.52 H new ATOM 0 HZ1 LYS A 83 12.972 -7.789 13.831 1.00 3.02 H new ATOM 0 HZ2 LYS A 83 13.098 -9.462 13.567 1.00 3.02 H new ATOM 0 HZ3 LYS A 83 14.103 -8.390 12.717 1.00 3.02 H new ATOM 1224 N GLN A 84 9.742 -6.322 6.985 1.00 0.66 N ATOM 1225 CA GLN A 84 9.247 -5.016 6.586 1.00 0.64 C ATOM 1226 C GLN A 84 7.858 -5.148 5.982 1.00 0.61 C ATOM 1227 O GLN A 84 7.041 -4.254 6.160 1.00 0.60 O ATOM 1228 CB GLN A 84 10.168 -4.349 5.569 1.00 0.79 C ATOM 1229 CG GLN A 84 11.347 -3.631 6.228 1.00 1.65 C ATOM 1230 CD GLN A 84 12.106 -2.785 5.207 1.00 2.70 C ATOM 1231 OE1 GLN A 84 13.422 -2.913 5.135 1.00 2.60 O flip ATOM 1232 NE2 GLN A 84 11.520 -1.996 4.476 1.00 4.40 N flip ATOM 0 H GLN A 84 10.536 -6.659 6.441 1.00 0.66 H new ATOM 0 HA GLN A 84 9.212 -4.394 7.480 1.00 0.64 H new ATOM 0 HB2 GLN A 84 10.546 -5.102 4.877 1.00 0.79 H new ATOM 0 HB3 GLN A 84 9.595 -3.634 4.979 1.00 0.79 H new ATOM 0 HG2 GLN A 84 10.986 -2.996 7.037 1.00 1.65 H new ATOM 0 HG3 GLN A 84 12.021 -4.362 6.674 1.00 1.65 H new ATOM 0 HE21 GLN A 84 10.506 -1.902 4.536 1.00 4.40 H new ATOM 0 HE22 GLN A 84 12.046 -1.433 3.807 1.00 4.40 H new ATOM 1241 N LEU A 85 7.564 -6.231 5.259 1.00 0.63 N ATOM 1242 CA LEU A 85 6.214 -6.395 4.733 1.00 0.60 C ATOM 1243 C LEU A 85 5.241 -6.533 5.900 1.00 0.52 C ATOM 1244 O LEU A 85 4.165 -5.940 5.877 1.00 0.50 O ATOM 1245 CB LEU A 85 6.143 -7.580 3.758 1.00 0.68 C ATOM 1246 CG LEU A 85 4.781 -7.747 3.065 1.00 0.68 C ATOM 1247 CD1 LEU A 85 4.370 -6.470 2.323 1.00 0.99 C ATOM 1248 CD2 LEU A 85 4.884 -8.886 2.046 1.00 0.91 C ATOM 0 H LEU A 85 8.218 -6.980 5.032 1.00 0.63 H new ATOM 0 HA LEU A 85 5.930 -5.515 4.156 1.00 0.60 H new ATOM 0 HB2 LEU A 85 6.913 -7.455 2.996 1.00 0.68 H new ATOM 0 HB3 LEU A 85 6.377 -8.496 4.300 1.00 0.68 H new ATOM 0 HG LEU A 85 4.033 -7.963 3.828 1.00 0.68 H new ATOM 0 HD11 LEU A 85 3.403 -6.623 1.844 1.00 0.99 H new ATOM 0 HD12 LEU A 85 4.298 -5.645 3.031 1.00 0.99 H new ATOM 0 HD13 LEU A 85 5.117 -6.233 1.565 1.00 0.99 H new ATOM 0 HD21 LEU A 85 3.924 -9.015 1.547 1.00 0.91 H new ATOM 0 HD22 LEU A 85 5.648 -8.645 1.307 1.00 0.91 H new ATOM 0 HD23 LEU A 85 5.154 -9.809 2.558 1.00 0.91 H new ATOM 1260 N ALA A 86 5.628 -7.265 6.947 1.00 0.50 N ATOM 1261 CA ALA A 86 4.782 -7.442 8.118 1.00 0.44 C ATOM 1262 C ALA A 86 4.742 -6.190 8.991 1.00 0.39 C ATOM 1263 O ALA A 86 3.766 -5.982 9.695 1.00 0.37 O ATOM 1264 CB ALA A 86 5.286 -8.639 8.927 1.00 0.50 C ATOM 0 H ALA A 86 6.527 -7.745 7.003 1.00 0.50 H new ATOM 0 HA ALA A 86 3.763 -7.626 7.777 1.00 0.44 H new ATOM 0 HB1 ALA A 86 4.655 -8.776 9.806 1.00 0.50 H new ATOM 0 HB2 ALA A 86 5.249 -9.537 8.310 1.00 0.50 H new ATOM 0 HB3 ALA A 86 6.314 -8.458 9.243 1.00 0.50 H new ATOM 1270 N GLU A 87 5.775 -5.355 8.959 1.00 0.40 N ATOM 1271 CA GLU A 87 5.859 -4.106 9.705 1.00 0.38 C ATOM 1272 C GLU A 87 4.948 -3.083 9.033 1.00 0.40 C ATOM 1273 O GLU A 87 4.220 -2.347 9.687 1.00 0.43 O ATOM 1274 CB GLU A 87 7.310 -3.620 9.698 1.00 0.42 C ATOM 1275 CG GLU A 87 8.200 -4.413 10.666 1.00 0.59 C ATOM 1276 CD GLU A 87 8.493 -3.617 11.937 1.00 1.12 C ATOM 1277 OE1 GLU A 87 9.518 -2.901 11.935 1.00 1.67 O ATOM 1278 OE2 GLU A 87 7.695 -3.739 12.890 1.00 2.69 O ATOM 0 H GLU A 87 6.605 -5.536 8.394 1.00 0.40 H new ATOM 0 HA GLU A 87 5.542 -4.247 10.738 1.00 0.38 H new ATOM 0 HB2 GLU A 87 7.713 -3.703 8.689 1.00 0.42 H new ATOM 0 HB3 GLU A 87 7.337 -2.564 9.966 1.00 0.42 H new ATOM 0 HG2 GLU A 87 7.710 -5.351 10.928 1.00 0.59 H new ATOM 0 HG3 GLU A 87 9.137 -4.670 10.172 1.00 0.59 H new ATOM 1285 N ALA A 88 4.934 -3.076 7.702 1.00 0.43 N ATOM 1286 CA ALA A 88 4.059 -2.212 6.939 1.00 0.46 C ATOM 1287 C ALA A 88 2.628 -2.624 7.244 1.00 0.44 C ATOM 1288 O ALA A 88 1.787 -1.795 7.569 1.00 0.49 O ATOM 1289 CB ALA A 88 4.369 -2.339 5.444 1.00 0.50 C ATOM 0 H ALA A 88 5.532 -3.672 7.129 1.00 0.43 H new ATOM 0 HA ALA A 88 4.207 -1.167 7.211 1.00 0.46 H new ATOM 0 HB1 ALA A 88 3.705 -1.685 4.878 1.00 0.50 H new ATOM 0 HB2 ALA A 88 5.404 -2.051 5.261 1.00 0.50 H new ATOM 0 HB3 ALA A 88 4.218 -3.371 5.127 1.00 0.50 H new ATOM 1295 N TYR A 89 2.356 -3.924 7.144 1.00 0.41 N ATOM 1296 CA TYR A 89 1.048 -4.505 7.344 1.00 0.43 C ATOM 1297 C TYR A 89 0.611 -4.391 8.801 1.00 0.41 C ATOM 1298 O TYR A 89 -0.582 -4.252 9.037 1.00 0.42 O ATOM 1299 CB TYR A 89 1.083 -5.953 6.832 1.00 0.43 C ATOM 1300 CG TYR A 89 0.963 -6.122 5.319 1.00 0.50 C ATOM 1301 CD1 TYR A 89 0.601 -7.376 4.790 1.00 1.95 C ATOM 1302 CD2 TYR A 89 1.206 -5.050 4.432 1.00 1.90 C ATOM 1303 CE1 TYR A 89 0.488 -7.556 3.398 1.00 1.98 C ATOM 1304 CE2 TYR A 89 1.081 -5.223 3.043 1.00 1.94 C ATOM 1305 CZ TYR A 89 0.722 -6.481 2.517 1.00 0.68 C ATOM 1306 OH TYR A 89 0.606 -6.652 1.169 1.00 0.77 O ATOM 0 H TYR A 89 3.069 -4.616 6.914 1.00 0.41 H new ATOM 0 HA TYR A 89 0.295 -3.958 6.776 1.00 0.43 H new ATOM 0 HB2 TYR A 89 2.016 -6.412 7.158 1.00 0.43 H new ATOM 0 HB3 TYR A 89 0.273 -6.507 7.307 1.00 0.43 H new ATOM 0 HD1 TYR A 89 0.409 -8.204 5.456 1.00 1.95 H new ATOM 0 HD2 TYR A 89 1.491 -4.086 4.826 1.00 1.90 H new ATOM 0 HE1 TYR A 89 0.220 -8.525 3.003 1.00 1.98 H new ATOM 0 HE2 TYR A 89 1.260 -4.391 2.378 1.00 1.94 H new ATOM 0 HH TYR A 89 0.349 -7.578 0.978 1.00 0.77 H new ATOM 1316 N GLU A 90 1.514 -4.402 9.784 1.00 0.41 N ATOM 1317 CA GLU A 90 1.091 -4.245 11.176 1.00 0.47 C ATOM 1318 C GLU A 90 0.830 -2.782 11.473 1.00 0.44 C ATOM 1319 O GLU A 90 -0.104 -2.465 12.195 1.00 0.46 O ATOM 1320 CB GLU A 90 2.012 -4.917 12.207 1.00 0.73 C ATOM 1321 CG GLU A 90 3.274 -4.125 12.560 1.00 1.76 C ATOM 1322 CD GLU A 90 3.075 -3.067 13.657 1.00 2.75 C ATOM 1323 OE1 GLU A 90 2.826 -3.470 14.821 1.00 3.01 O ATOM 1324 OE2 GLU A 90 3.158 -1.861 13.329 1.00 4.14 O ATOM 0 H GLU A 90 2.519 -4.515 9.648 1.00 0.41 H new ATOM 0 HA GLU A 90 0.156 -4.795 11.286 1.00 0.47 H new ATOM 0 HB2 GLU A 90 1.443 -5.092 13.120 1.00 0.73 H new ATOM 0 HB3 GLU A 90 2.309 -5.894 11.825 1.00 0.73 H new ATOM 0 HG2 GLU A 90 4.048 -4.822 12.881 1.00 1.76 H new ATOM 0 HG3 GLU A 90 3.642 -3.633 11.660 1.00 1.76 H new ATOM 1331 N SER A 91 1.607 -1.878 10.886 1.00 0.44 N ATOM 1332 CA SER A 91 1.380 -0.462 11.062 1.00 0.43 C ATOM 1333 C SER A 91 0.056 -0.098 10.403 1.00 0.39 C ATOM 1334 O SER A 91 -0.717 0.665 10.966 1.00 0.41 O ATOM 1335 CB SER A 91 2.558 0.333 10.505 1.00 0.48 C ATOM 1336 OG SER A 91 3.628 0.290 11.429 1.00 1.01 O ATOM 0 H SER A 91 2.398 -2.108 10.285 1.00 0.44 H new ATOM 0 HA SER A 91 1.311 -0.209 12.120 1.00 0.43 H new ATOM 0 HB2 SER A 91 2.872 -0.083 9.547 1.00 0.48 H new ATOM 0 HB3 SER A 91 2.261 1.366 10.322 1.00 0.48 H new ATOM 0 HG SER A 91 3.467 -0.422 12.083 1.00 1.01 H new ATOM 1342 N ILE A 92 -0.250 -0.656 9.232 1.00 0.37 N ATOM 1343 CA ILE A 92 -1.480 -0.329 8.534 1.00 0.37 C ATOM 1344 C ILE A 92 -2.651 -0.970 9.274 1.00 0.38 C ATOM 1345 O ILE A 92 -3.682 -0.334 9.464 1.00 0.39 O ATOM 1346 CB ILE A 92 -1.369 -0.727 7.045 1.00 0.42 C ATOM 1347 CG1 ILE A 92 -1.012 0.499 6.187 1.00 0.53 C ATOM 1348 CG2 ILE A 92 -2.645 -1.317 6.465 1.00 0.45 C ATOM 1349 CD1 ILE A 92 0.476 0.797 6.274 1.00 0.83 C ATOM 0 H ILE A 92 0.340 -1.335 8.752 1.00 0.37 H new ATOM 0 HA ILE A 92 -1.661 0.746 8.532 1.00 0.37 H new ATOM 0 HB ILE A 92 -0.591 -1.490 7.017 1.00 0.42 H new ATOM 0 HG12 ILE A 92 -1.292 0.318 5.149 1.00 0.53 H new ATOM 0 HG13 ILE A 92 -1.582 1.364 6.524 1.00 0.53 H new ATOM 0 HG21 ILE A 92 -2.485 -1.570 5.417 1.00 0.45 H new ATOM 0 HG22 ILE A 92 -2.914 -2.216 7.019 1.00 0.45 H new ATOM 0 HG23 ILE A 92 -3.451 -0.588 6.543 1.00 0.45 H new ATOM 0 HD11 ILE A 92 0.709 1.667 5.661 1.00 0.83 H new ATOM 0 HD12 ILE A 92 0.746 1.000 7.310 1.00 0.83 H new ATOM 0 HD13 ILE A 92 1.041 -0.063 5.914 1.00 0.83 H new ATOM 1361 N ALA A 93 -2.508 -2.221 9.707 1.00 0.41 N ATOM 1362 CA ALA A 93 -3.594 -2.962 10.335 1.00 0.45 C ATOM 1363 C ALA A 93 -3.943 -2.329 11.681 1.00 0.43 C ATOM 1364 O ALA A 93 -5.105 -2.081 11.995 1.00 0.44 O ATOM 1365 CB ALA A 93 -3.201 -4.435 10.490 1.00 0.55 C ATOM 0 H ALA A 93 -1.637 -2.746 9.632 1.00 0.41 H new ATOM 0 HA ALA A 93 -4.481 -2.918 9.703 1.00 0.45 H new ATOM 0 HB1 ALA A 93 -4.018 -4.982 10.960 1.00 0.55 H new ATOM 0 HB2 ALA A 93 -2.996 -4.862 9.508 1.00 0.55 H new ATOM 0 HB3 ALA A 93 -2.309 -4.510 11.112 1.00 0.55 H new ATOM 1371 N LYS A 94 -2.932 -2.023 12.490 1.00 0.42 N ATOM 1372 CA LYS A 94 -3.164 -1.306 13.729 1.00 0.42 C ATOM 1373 C LYS A 94 -3.728 0.072 13.432 1.00 0.37 C ATOM 1374 O LYS A 94 -4.635 0.477 14.140 1.00 0.41 O ATOM 1375 CB LYS A 94 -1.910 -1.221 14.600 1.00 0.46 C ATOM 1376 CG LYS A 94 -1.518 -2.604 15.130 1.00 1.18 C ATOM 1377 CD LYS A 94 -0.498 -2.456 16.261 1.00 1.68 C ATOM 1378 CE LYS A 94 0.393 -3.696 16.287 1.00 2.61 C ATOM 1379 NZ LYS A 94 1.602 -3.486 17.105 1.00 3.39 N ATOM 0 H LYS A 94 -1.957 -2.260 12.308 1.00 0.42 H new ATOM 0 HA LYS A 94 -3.896 -1.870 14.307 1.00 0.42 H new ATOM 0 HB2 LYS A 94 -1.087 -0.803 14.020 1.00 0.46 H new ATOM 0 HB3 LYS A 94 -2.088 -0.544 15.435 1.00 0.46 H new ATOM 0 HG2 LYS A 94 -2.402 -3.129 15.492 1.00 1.18 H new ATOM 0 HG3 LYS A 94 -1.097 -3.206 14.325 1.00 1.18 H new ATOM 0 HD2 LYS A 94 0.106 -1.561 16.110 1.00 1.68 H new ATOM 0 HD3 LYS A 94 -1.009 -2.338 17.217 1.00 1.68 H new ATOM 0 HE2 LYS A 94 -0.171 -4.540 16.683 1.00 2.61 H new ATOM 0 HE3 LYS A 94 0.684 -3.956 15.269 1.00 2.61 H new ATOM 0 HZ1 LYS A 94 2.435 -3.425 16.485 1.00 3.39 H new ATOM 0 HZ2 LYS A 94 1.507 -2.602 17.645 1.00 3.39 H new ATOM 0 HZ3 LYS A 94 1.719 -4.283 17.763 1.00 3.39 H new ATOM 1393 N ILE A 95 -3.272 0.778 12.393 1.00 0.34 N ATOM 1394 CA ILE A 95 -3.851 2.080 12.043 1.00 0.33 C ATOM 1395 C ILE A 95 -5.332 1.923 11.681 1.00 0.34 C ATOM 1396 O ILE A 95 -6.144 2.794 11.974 1.00 0.35 O ATOM 1397 CB ILE A 95 -3.028 2.753 10.924 1.00 0.34 C ATOM 1398 CG1 ILE A 95 -1.758 3.367 11.541 1.00 0.57 C ATOM 1399 CG2 ILE A 95 -3.800 3.852 10.181 1.00 0.74 C ATOM 1400 CD1 ILE A 95 -0.711 3.745 10.483 1.00 0.56 C ATOM 0 H ILE A 95 -2.512 0.475 11.785 1.00 0.34 H new ATOM 0 HA ILE A 95 -3.805 2.742 12.907 1.00 0.33 H new ATOM 0 HB ILE A 95 -2.787 1.980 10.194 1.00 0.34 H new ATOM 0 HG12 ILE A 95 -2.029 4.255 12.112 1.00 0.57 H new ATOM 0 HG13 ILE A 95 -1.320 2.658 12.243 1.00 0.57 H new ATOM 0 HG21 ILE A 95 -3.164 4.284 9.408 1.00 0.74 H new ATOM 0 HG22 ILE A 95 -4.691 3.424 9.721 1.00 0.74 H new ATOM 0 HG23 ILE A 95 -4.094 4.630 10.886 1.00 0.74 H new ATOM 0 HD11 ILE A 95 0.163 4.173 10.973 1.00 0.56 H new ATOM 0 HD12 ILE A 95 -0.416 2.854 9.928 1.00 0.56 H new ATOM 0 HD13 ILE A 95 -1.136 4.476 9.796 1.00 0.56 H new ATOM 1412 N VAL A 96 -5.709 0.807 11.064 1.00 0.38 N ATOM 1413 CA VAL A 96 -7.082 0.509 10.692 1.00 0.45 C ATOM 1414 C VAL A 96 -7.917 0.340 11.955 1.00 0.48 C ATOM 1415 O VAL A 96 -9.084 0.715 11.984 1.00 0.52 O ATOM 1416 CB VAL A 96 -7.101 -0.717 9.754 1.00 0.53 C ATOM 1417 CG1 VAL A 96 -8.427 -1.487 9.732 1.00 0.68 C ATOM 1418 CG2 VAL A 96 -6.779 -0.266 8.325 1.00 0.60 C ATOM 0 H VAL A 96 -5.052 0.071 10.805 1.00 0.38 H new ATOM 0 HA VAL A 96 -7.532 1.329 10.133 1.00 0.45 H new ATOM 0 HB VAL A 96 -6.351 -1.402 10.150 1.00 0.53 H new ATOM 0 HG11 VAL A 96 -8.347 -2.330 9.046 1.00 0.68 H new ATOM 0 HG12 VAL A 96 -8.651 -1.854 10.734 1.00 0.68 H new ATOM 0 HG13 VAL A 96 -9.227 -0.825 9.400 1.00 0.68 H new ATOM 0 HG21 VAL A 96 -6.791 -1.129 7.660 1.00 0.60 H new ATOM 0 HG22 VAL A 96 -7.525 0.457 7.995 1.00 0.60 H new ATOM 0 HG23 VAL A 96 -5.792 0.195 8.303 1.00 0.60 H new ATOM 1428 N ASN A 97 -7.341 -0.185 13.031 1.00 0.54 N ATOM 1429 CA ASN A 97 -8.099 -0.385 14.254 1.00 0.66 C ATOM 1430 C ASN A 97 -8.152 0.908 15.048 1.00 0.66 C ATOM 1431 O ASN A 97 -9.172 1.227 15.654 1.00 0.75 O ATOM 1432 CB ASN A 97 -7.450 -1.474 15.120 1.00 0.76 C ATOM 1433 CG ASN A 97 -7.463 -2.830 14.436 1.00 0.95 C ATOM 1434 OD1 ASN A 97 -8.386 -3.141 13.695 1.00 1.39 O ATOM 1435 ND2 ASN A 97 -6.459 -3.662 14.683 1.00 1.57 N ATOM 0 H ASN A 97 -6.364 -0.475 13.079 1.00 0.54 H new ATOM 0 HA ASN A 97 -9.108 -0.696 13.982 1.00 0.66 H new ATOM 0 HB2 ASN A 97 -6.422 -1.192 15.346 1.00 0.76 H new ATOM 0 HB3 ASN A 97 -7.978 -1.543 16.071 1.00 0.76 H new ATOM 0 HD21 ASN A 97 -6.444 -4.586 14.251 1.00 1.57 H new ATOM 0 HD22 ASN A 97 -5.702 -3.378 15.305 1.00 1.57 H new ATOM 1442 N ASP A 98 -7.043 1.644 15.029 1.00 0.59 N ATOM 1443 CA ASP A 98 -6.820 2.850 15.813 1.00 0.64 C ATOM 1444 C ASP A 98 -7.776 3.927 15.323 1.00 0.68 C ATOM 1445 O ASP A 98 -8.453 4.596 16.098 1.00 0.76 O ATOM 1446 CB ASP A 98 -5.360 3.284 15.646 1.00 0.59 C ATOM 1447 CG ASP A 98 -5.012 4.433 16.583 1.00 1.47 C ATOM 1448 OD1 ASP A 98 -4.772 5.544 16.062 1.00 2.67 O ATOM 1449 OD2 ASP A 98 -4.963 4.165 17.803 1.00 2.34 O ATOM 0 H ASP A 98 -6.244 1.404 14.442 1.00 0.59 H new ATOM 0 HA ASP A 98 -7.007 2.672 16.872 1.00 0.64 H new ATOM 0 HB2 ASP A 98 -4.702 2.438 15.845 1.00 0.59 H new ATOM 0 HB3 ASP A 98 -5.185 3.588 14.614 1.00 0.59 H new ATOM 1454 N ASN A 99 -7.885 4.033 13.999 1.00 0.63 N ATOM 1455 CA ASN A 99 -8.838 4.929 13.355 1.00 0.64 C ATOM 1456 C ASN A 99 -10.208 4.264 13.193 1.00 0.68 C ATOM 1457 O ASN A 99 -11.173 4.899 12.774 1.00 0.70 O ATOM 1458 CB ASN A 99 -8.289 5.337 11.991 1.00 0.60 C ATOM 1459 CG ASN A 99 -8.588 6.795 11.670 1.00 0.75 C ATOM 1460 OD1 ASN A 99 -7.701 7.549 11.292 1.00 0.89 O ATOM 1461 ND2 ASN A 99 -9.836 7.230 11.771 1.00 2.23 N ATOM 0 H ASN A 99 -7.314 3.499 13.345 1.00 0.63 H new ATOM 0 HA ASN A 99 -8.972 5.809 13.984 1.00 0.64 H new ATOM 0 HB2 ASN A 99 -7.211 5.175 11.970 1.00 0.60 H new ATOM 0 HB3 ASN A 99 -8.722 4.700 11.220 1.00 0.60 H new ATOM 0 HD21 ASN A 99 -10.060 8.196 11.533 1.00 2.23 H new ATOM 0 HD22 ASN A 99 -10.572 6.598 12.086 1.00 2.23 H new ATOM 1468 N ASN A 100 -10.281 2.972 13.505 1.00 0.71 N ATOM 1469 CA ASN A 100 -11.470 2.132 13.520 1.00 0.79 C ATOM 1470 C ASN A 100 -12.098 1.970 12.135 1.00 0.72 C ATOM 1471 O ASN A 100 -13.290 1.699 12.006 1.00 0.89 O ATOM 1472 CB ASN A 100 -12.461 2.669 14.555 1.00 0.88 C ATOM 1473 CG ASN A 100 -13.193 1.523 15.234 1.00 1.19 C ATOM 1474 OD1 ASN A 100 -14.192 1.009 14.742 1.00 1.34 O ATOM 1475 ND2 ASN A 100 -12.661 1.047 16.348 1.00 2.17 N ATOM 0 H ASN A 100 -9.447 2.449 13.773 1.00 0.71 H new ATOM 0 HA ASN A 100 -11.174 1.125 13.814 1.00 0.79 H new ATOM 0 HB2 ASN A 100 -11.932 3.263 15.300 1.00 0.88 H new ATOM 0 HB3 ASN A 100 -13.179 3.331 14.071 1.00 0.88 H new ATOM 0 HD21 ASN A 100 -13.082 0.241 16.810 1.00 2.17 H new ATOM 0 HD22 ASN A 100 -11.830 1.486 16.744 1.00 2.17 H new ATOM 1482 N TYR A 101 -11.284 2.085 11.093 1.00 0.70 N ATOM 1483 CA TYR A 101 -11.701 2.022 9.706 1.00 0.68 C ATOM 1484 C TYR A 101 -12.339 0.689 9.357 1.00 0.86 C ATOM 1485 O TYR A 101 -11.767 -0.369 9.609 1.00 1.12 O ATOM 1486 CB TYR A 101 -10.472 2.170 8.831 1.00 0.82 C ATOM 1487 CG TYR A 101 -9.812 3.538 8.799 1.00 0.61 C ATOM 1488 CD1 TYR A 101 -10.585 4.713 8.896 1.00 2.11 C ATOM 1489 CD2 TYR A 101 -8.420 3.637 8.619 1.00 1.93 C ATOM 1490 CE1 TYR A 101 -9.976 5.972 8.790 1.00 2.32 C ATOM 1491 CE2 TYR A 101 -7.800 4.898 8.537 1.00 1.88 C ATOM 1492 CZ TYR A 101 -8.579 6.073 8.602 1.00 1.02 C ATOM 1493 OH TYR A 101 -7.989 7.294 8.479 1.00 1.42 O ATOM 0 H TYR A 101 -10.280 2.230 11.199 1.00 0.70 H new ATOM 0 HA TYR A 101 -12.431 2.815 9.545 1.00 0.68 H new ATOM 0 HB2 TYR A 101 -9.730 1.443 9.162 1.00 0.82 H new ATOM 0 HB3 TYR A 101 -10.748 1.902 7.811 1.00 0.82 H new ATOM 0 HD1 TYR A 101 -11.651 4.643 9.053 1.00 2.11 H new ATOM 0 HD2 TYR A 101 -7.824 2.740 8.543 1.00 1.93 H new ATOM 0 HE1 TYR A 101 -10.577 6.867 8.852 1.00 2.32 H new ATOM 0 HE2 TYR A 101 -6.728 4.966 8.424 1.00 1.88 H new ATOM 0 HH TYR A 101 -7.783 7.649 9.369 1.00 1.42 H new ATOM 1503 N LYS A 102 -13.538 0.728 8.773 1.00 0.92 N ATOM 1504 CA LYS A 102 -14.275 -0.468 8.416 1.00 1.25 C ATOM 1505 C LYS A 102 -14.160 -0.810 6.936 1.00 0.98 C ATOM 1506 O LYS A 102 -14.425 -1.948 6.576 1.00 1.19 O ATOM 1507 CB LYS A 102 -15.737 -0.309 8.831 1.00 1.81 C ATOM 1508 CG LYS A 102 -15.938 -0.275 10.354 1.00 2.51 C ATOM 1509 CD LYS A 102 -15.309 -1.479 11.074 1.00 4.02 C ATOM 1510 CE LYS A 102 -13.834 -1.222 11.424 1.00 4.29 C ATOM 1511 NZ LYS A 102 -13.629 -0.981 12.862 1.00 5.34 N ATOM 0 H LYS A 102 -14.019 1.596 8.537 1.00 0.92 H new ATOM 0 HA LYS A 102 -13.832 -1.305 8.955 1.00 1.25 H new ATOM 0 HB2 LYS A 102 -16.132 0.611 8.399 1.00 1.81 H new ATOM 0 HB3 LYS A 102 -16.317 -1.132 8.414 1.00 1.81 H new ATOM 0 HG2 LYS A 102 -15.506 0.644 10.751 1.00 2.51 H new ATOM 0 HG3 LYS A 102 -17.005 -0.246 10.573 1.00 2.51 H new ATOM 0 HD2 LYS A 102 -15.868 -1.691 11.985 1.00 4.02 H new ATOM 0 HD3 LYS A 102 -15.385 -2.363 10.440 1.00 4.02 H new ATOM 0 HE2 LYS A 102 -13.236 -2.079 11.114 1.00 4.29 H new ATOM 0 HE3 LYS A 102 -13.475 -0.361 10.860 1.00 4.29 H new ATOM 0 HZ1 LYS A 102 -12.653 -1.230 13.120 1.00 5.34 H new ATOM 0 HZ2 LYS A 102 -13.798 0.023 13.073 1.00 5.34 H new ATOM 0 HZ3 LYS A 102 -14.292 -1.566 13.410 1.00 5.34 H new ATOM 1525 N SER A 103 -13.771 0.138 6.088 1.00 0.75 N ATOM 1526 CA SER A 103 -13.626 -0.098 4.661 1.00 0.79 C ATOM 1527 C SER A 103 -12.554 0.850 4.146 1.00 0.76 C ATOM 1528 O SER A 103 -12.715 2.060 4.306 1.00 0.97 O ATOM 1529 CB SER A 103 -14.971 0.180 3.980 1.00 1.23 C ATOM 1530 OG SER A 103 -15.477 1.437 4.396 1.00 1.83 O ATOM 0 H SER A 103 -13.548 1.091 6.374 1.00 0.75 H new ATOM 0 HA SER A 103 -13.336 -1.127 4.449 1.00 0.79 H new ATOM 0 HB2 SER A 103 -14.848 0.169 2.897 1.00 1.23 H new ATOM 0 HB3 SER A 103 -15.683 -0.607 4.228 1.00 1.23 H new ATOM 0 HG SER A 103 -14.749 2.092 4.416 1.00 1.83 H new ATOM 1536 N VAL A 104 -11.468 0.331 3.569 1.00 0.68 N ATOM 1537 CA VAL A 104 -10.354 1.138 3.086 1.00 0.71 C ATOM 1538 C VAL A 104 -9.820 0.494 1.819 1.00 0.66 C ATOM 1539 O VAL A 104 -9.772 -0.733 1.725 1.00 0.71 O ATOM 1540 CB VAL A 104 -9.253 1.205 4.159 1.00 0.88 C ATOM 1541 CG1 VAL A 104 -7.915 1.737 3.630 1.00 1.35 C ATOM 1542 CG2 VAL A 104 -9.714 2.106 5.304 1.00 1.98 C ATOM 0 H VAL A 104 -11.340 -0.670 3.424 1.00 0.68 H new ATOM 0 HA VAL A 104 -10.684 2.155 2.875 1.00 0.71 H new ATOM 0 HB VAL A 104 -9.087 0.181 4.495 1.00 0.88 H new ATOM 0 HG11 VAL A 104 -7.186 1.757 4.440 1.00 1.35 H new ATOM 0 HG12 VAL A 104 -7.554 1.087 2.833 1.00 1.35 H new ATOM 0 HG13 VAL A 104 -8.053 2.746 3.241 1.00 1.35 H new ATOM 0 HG21 VAL A 104 -8.935 2.155 6.065 1.00 1.98 H new ATOM 0 HG22 VAL A 104 -9.911 3.108 4.922 1.00 1.98 H new ATOM 0 HG23 VAL A 104 -10.625 1.699 5.743 1.00 1.98 H new ATOM 1552 N ALA A 105 -9.366 1.312 0.867 1.00 0.66 N ATOM 1553 CA ALA A 105 -8.682 0.782 -0.289 1.00 0.69 C ATOM 1554 C ALA A 105 -7.216 0.624 0.096 1.00 0.74 C ATOM 1555 O ALA A 105 -6.524 1.613 0.316 1.00 0.74 O ATOM 1556 CB ALA A 105 -8.885 1.738 -1.467 1.00 0.72 C ATOM 0 H ALA A 105 -9.463 2.327 0.882 1.00 0.66 H new ATOM 0 HA ALA A 105 -9.071 -0.188 -0.599 1.00 0.69 H new ATOM 0 HB1 ALA A 105 -8.372 1.347 -2.346 1.00 0.72 H new ATOM 0 HB2 ALA A 105 -9.950 1.832 -1.680 1.00 0.72 H new ATOM 0 HB3 ALA A 105 -8.478 2.717 -1.215 1.00 0.72 H new ATOM 1562 N ILE A 106 -6.740 -0.620 0.178 1.00 0.89 N ATOM 1563 CA ILE A 106 -5.371 -0.980 0.500 1.00 1.02 C ATOM 1564 C ILE A 106 -4.792 -1.786 -0.678 1.00 1.19 C ATOM 1565 O ILE A 106 -5.326 -2.834 -1.033 1.00 1.44 O ATOM 1566 CB ILE A 106 -5.359 -1.701 1.865 1.00 1.30 C ATOM 1567 CG1 ILE A 106 -3.956 -2.128 2.295 1.00 2.03 C ATOM 1568 CG2 ILE A 106 -6.257 -2.944 1.916 1.00 1.55 C ATOM 1569 CD1 ILE A 106 -3.077 -0.946 2.710 1.00 3.23 C ATOM 0 H ILE A 106 -7.330 -1.435 0.013 1.00 0.89 H new ATOM 0 HA ILE A 106 -4.719 -0.115 0.619 1.00 1.02 H new ATOM 0 HB ILE A 106 -5.751 -0.951 2.552 1.00 1.30 H new ATOM 0 HG12 ILE A 106 -4.033 -2.827 3.128 1.00 2.03 H new ATOM 0 HG13 ILE A 106 -3.476 -2.661 1.474 1.00 2.03 H new ATOM 0 HG21 ILE A 106 -6.196 -3.396 2.906 1.00 1.55 H new ATOM 0 HG22 ILE A 106 -7.288 -2.656 1.711 1.00 1.55 H new ATOM 0 HG23 ILE A 106 -5.925 -3.663 1.167 1.00 1.55 H new ATOM 0 HD11 ILE A 106 -2.093 -1.310 3.005 1.00 3.23 H new ATOM 0 HD12 ILE A 106 -2.973 -0.258 1.871 1.00 3.23 H new ATOM 0 HD13 ILE A 106 -3.538 -0.427 3.550 1.00 3.23 H new ATOM 1581 N PRO A 107 -3.749 -1.279 -1.354 1.00 1.14 N ATOM 1582 CA PRO A 107 -3.174 -1.931 -2.516 1.00 1.29 C ATOM 1583 C PRO A 107 -2.178 -2.999 -2.051 1.00 1.37 C ATOM 1584 O PRO A 107 -2.109 -3.329 -0.868 1.00 1.45 O ATOM 1585 CB PRO A 107 -2.521 -0.788 -3.299 1.00 1.23 C ATOM 1586 CG PRO A 107 -2.016 0.140 -2.195 1.00 1.05 C ATOM 1587 CD PRO A 107 -3.027 -0.052 -1.062 1.00 1.05 C ATOM 0 HA PRO A 107 -3.893 -2.458 -3.143 1.00 1.29 H new ATOM 0 HB2 PRO A 107 -1.707 -1.145 -3.930 1.00 1.23 H new ATOM 0 HB3 PRO A 107 -3.235 -0.287 -3.952 1.00 1.23 H new ATOM 0 HG2 PRO A 107 -1.007 -0.126 -1.880 1.00 1.05 H new ATOM 0 HG3 PRO A 107 -1.982 1.177 -2.529 1.00 1.05 H new ATOM 0 HD2 PRO A 107 -2.521 -0.120 -0.099 1.00 1.05 H new ATOM 0 HD3 PRO A 107 -3.710 0.795 -1.004 1.00 1.05 H new ATOM 1595 N LEU A 108 -1.389 -3.552 -2.976 1.00 1.47 N ATOM 1596 CA LEU A 108 -0.472 -4.645 -2.688 1.00 1.61 C ATOM 1597 C LEU A 108 0.917 -4.230 -3.138 1.00 1.39 C ATOM 1598 O LEU A 108 1.099 -3.865 -4.300 1.00 1.47 O ATOM 1599 CB LEU A 108 -0.918 -5.900 -3.442 1.00 2.01 C ATOM 1600 CG LEU A 108 -2.230 -6.477 -2.893 1.00 2.26 C ATOM 1601 CD1 LEU A 108 -2.909 -7.340 -3.956 1.00 2.65 C ATOM 1602 CD2 LEU A 108 -1.916 -7.342 -1.676 1.00 2.73 C ATOM 0 H LEU A 108 -1.372 -3.248 -3.950 1.00 1.47 H new ATOM 0 HA LEU A 108 -0.465 -4.866 -1.621 1.00 1.61 H new ATOM 0 HB2 LEU A 108 -1.043 -5.661 -4.498 1.00 2.01 H new ATOM 0 HB3 LEU A 108 -0.136 -6.657 -3.377 1.00 2.01 H new ATOM 0 HG LEU A 108 -2.896 -5.660 -2.617 1.00 2.26 H new ATOM 0 HD11 LEU A 108 -3.839 -7.745 -3.557 1.00 2.65 H new ATOM 0 HD12 LEU A 108 -3.126 -6.732 -4.834 1.00 2.65 H new ATOM 0 HD13 LEU A 108 -2.247 -8.160 -4.236 1.00 2.65 H new ATOM 0 HD21 LEU A 108 -2.841 -7.758 -1.277 1.00 2.73 H new ATOM 0 HD22 LEU A 108 -1.250 -8.154 -1.969 1.00 2.73 H new ATOM 0 HD23 LEU A 108 -1.432 -6.733 -0.912 1.00 2.73 H new ATOM 1614 N LEU A 109 1.884 -4.274 -2.222 1.00 1.36 N ATOM 1615 CA LEU A 109 3.251 -3.864 -2.501 1.00 1.17 C ATOM 1616 C LEU A 109 4.050 -5.073 -2.983 1.00 0.93 C ATOM 1617 O LEU A 109 3.491 -6.141 -3.228 1.00 0.95 O ATOM 1618 CB LEU A 109 3.900 -3.226 -1.260 1.00 1.48 C ATOM 1619 CG LEU A 109 3.069 -2.074 -0.669 1.00 1.25 C ATOM 1620 CD1 LEU A 109 2.288 -2.549 0.558 1.00 1.80 C ATOM 1621 CD2 LEU A 109 3.983 -0.921 -0.249 1.00 1.47 C ATOM 0 H LEU A 109 1.737 -4.596 -1.266 1.00 1.36 H new ATOM 0 HA LEU A 109 3.245 -3.107 -3.285 1.00 1.17 H new ATOM 0 HB2 LEU A 109 4.042 -3.992 -0.498 1.00 1.48 H new ATOM 0 HB3 LEU A 109 4.889 -2.853 -1.526 1.00 1.48 H new ATOM 0 HG LEU A 109 2.374 -1.735 -1.437 1.00 1.25 H new ATOM 0 HD11 LEU A 109 1.706 -1.721 0.962 1.00 1.80 H new ATOM 0 HD12 LEU A 109 1.616 -3.358 0.271 1.00 1.80 H new ATOM 0 HD13 LEU A 109 2.984 -2.907 1.316 1.00 1.80 H new ATOM 0 HD21 LEU A 109 3.381 -0.113 0.167 1.00 1.47 H new ATOM 0 HD22 LEU A 109 4.689 -1.272 0.503 1.00 1.47 H new ATOM 0 HD23 LEU A 109 4.530 -0.555 -1.118 1.00 1.47 H new ATOM 1633 N SER A 110 5.364 -4.887 -3.151 1.00 0.93 N ATOM 1634 CA SER A 110 6.302 -5.893 -3.645 1.00 0.93 C ATOM 1635 C SER A 110 6.232 -6.047 -5.169 1.00 1.19 C ATOM 1636 O SER A 110 7.109 -6.667 -5.761 1.00 2.12 O ATOM 1637 CB SER A 110 6.126 -7.235 -2.940 1.00 1.46 C ATOM 1638 OG SER A 110 5.779 -7.047 -1.578 1.00 1.66 O ATOM 0 H SER A 110 5.817 -3.998 -2.938 1.00 0.93 H new ATOM 0 HA SER A 110 7.301 -5.530 -3.404 1.00 0.93 H new ATOM 0 HB2 SER A 110 5.351 -7.815 -3.441 1.00 1.46 H new ATOM 0 HB3 SER A 110 7.049 -7.811 -3.009 1.00 1.46 H new ATOM 0 HG SER A 110 4.864 -7.363 -1.427 1.00 1.66 H new ATOM 1644 N THR A 111 5.229 -5.450 -5.806 1.00 1.23 N ATOM 1645 CA THR A 111 4.794 -5.733 -7.163 1.00 1.60 C ATOM 1646 C THR A 111 5.446 -4.784 -8.159 1.00 1.94 C ATOM 1647 O THR A 111 6.167 -5.243 -9.036 1.00 2.07 O ATOM 1648 CB THR A 111 3.265 -5.602 -7.181 1.00 1.74 C ATOM 1649 OG1 THR A 111 2.924 -4.464 -6.399 1.00 2.36 O ATOM 1650 CG2 THR A 111 2.645 -6.880 -6.607 1.00 1.50 C ATOM 0 H THR A 111 4.672 -4.719 -5.364 1.00 1.23 H new ATOM 0 HA THR A 111 5.093 -6.738 -7.461 1.00 1.60 H new ATOM 0 HB THR A 111 2.884 -5.473 -8.194 1.00 1.74 H new ATOM 0 HG1 THR A 111 2.216 -4.703 -5.765 1.00 2.36 H new ATOM 0 HG21 THR A 111 1.558 -6.794 -6.617 1.00 1.50 H new ATOM 0 HG22 THR A 111 2.947 -7.735 -7.213 1.00 1.50 H new ATOM 0 HG23 THR A 111 2.988 -7.022 -5.582 1.00 1.50 H new ATOM 1658 N GLY A 112 5.180 -3.478 -8.034 1.00 3.17 N ATOM 1659 CA GLY A 112 5.620 -2.457 -8.982 1.00 3.75 C ATOM 1660 C GLY A 112 7.118 -2.541 -9.267 1.00 2.51 C ATOM 1661 O GLY A 112 7.528 -3.036 -10.309 1.00 2.62 O ATOM 0 H GLY A 112 4.642 -3.098 -7.255 1.00 3.17 H new ATOM 0 HA2 GLY A 112 5.068 -2.568 -9.915 1.00 3.75 H new ATOM 0 HA3 GLY A 112 5.382 -1.470 -8.586 1.00 3.75 H new ATOM 1665 N ILE A 113 7.937 -2.038 -8.340 1.00 1.94 N ATOM 1666 CA ILE A 113 9.387 -2.152 -8.405 1.00 0.99 C ATOM 1667 C ILE A 113 9.905 -2.218 -6.970 1.00 0.97 C ATOM 1668 O ILE A 113 10.544 -1.291 -6.478 1.00 1.53 O ATOM 1669 CB ILE A 113 10.019 -0.997 -9.222 1.00 2.03 C ATOM 1670 CG1 ILE A 113 9.324 0.355 -8.964 1.00 1.85 C ATOM 1671 CG2 ILE A 113 10.000 -1.327 -10.722 1.00 3.68 C ATOM 1672 CD1 ILE A 113 10.051 1.529 -9.629 1.00 2.68 C ATOM 0 H ILE A 113 7.604 -1.536 -7.517 1.00 1.94 H new ATOM 0 HA ILE A 113 9.676 -3.059 -8.936 1.00 0.99 H new ATOM 0 HB ILE A 113 11.052 -0.898 -8.888 1.00 2.03 H new ATOM 0 HG12 ILE A 113 8.300 0.309 -9.335 1.00 1.85 H new ATOM 0 HG13 ILE A 113 9.266 0.530 -7.890 1.00 1.85 H new ATOM 0 HG21 ILE A 113 10.448 -0.505 -11.281 1.00 3.68 H new ATOM 0 HG22 ILE A 113 10.568 -2.240 -10.901 1.00 3.68 H new ATOM 0 HG23 ILE A 113 8.970 -1.471 -11.050 1.00 3.68 H new ATOM 0 HD11 ILE A 113 9.518 2.455 -9.414 1.00 2.68 H new ATOM 0 HD12 ILE A 113 11.067 1.596 -9.239 1.00 2.68 H new ATOM 0 HD13 ILE A 113 10.086 1.372 -10.707 1.00 2.68 H new ATOM 1684 N PHE A 114 9.598 -3.321 -6.280 1.00 0.73 N ATOM 1685 CA PHE A 114 9.935 -3.483 -4.881 1.00 0.85 C ATOM 1686 C PHE A 114 10.609 -4.836 -4.692 1.00 0.83 C ATOM 1687 O PHE A 114 11.793 -4.901 -4.370 1.00 0.86 O ATOM 1688 CB PHE A 114 8.669 -3.299 -4.047 1.00 1.15 C ATOM 1689 CG PHE A 114 8.134 -1.886 -4.089 1.00 1.19 C ATOM 1690 CD1 PHE A 114 7.023 -1.578 -4.898 1.00 2.75 C ATOM 1691 CD2 PHE A 114 8.770 -0.872 -3.353 1.00 1.53 C ATOM 1692 CE1 PHE A 114 6.551 -0.258 -4.972 1.00 2.86 C ATOM 1693 CE2 PHE A 114 8.301 0.449 -3.433 1.00 1.61 C ATOM 1694 CZ PHE A 114 7.191 0.756 -4.238 1.00 1.51 C ATOM 0 H PHE A 114 9.109 -4.120 -6.684 1.00 0.73 H new ATOM 0 HA PHE A 114 10.646 -2.730 -4.541 1.00 0.85 H new ATOM 0 HB2 PHE A 114 7.901 -3.983 -4.407 1.00 1.15 H new ATOM 0 HB3 PHE A 114 8.879 -3.571 -3.013 1.00 1.15 H new ATOM 0 HD1 PHE A 114 6.534 -2.358 -5.462 1.00 2.75 H new ATOM 0 HD2 PHE A 114 9.618 -1.108 -2.727 1.00 1.53 H new ATOM 0 HE1 PHE A 114 5.698 -0.022 -5.591 1.00 2.86 H new ATOM 0 HE2 PHE A 114 8.794 1.231 -2.875 1.00 1.61 H new ATOM 0 HZ PHE A 114 6.829 1.772 -4.293 1.00 1.51 H new ATOM 1704 N SER A 115 9.903 -5.935 -4.960 1.00 0.83 N ATOM 1705 CA SER A 115 10.525 -7.247 -4.933 1.00 0.84 C ATOM 1706 C SER A 115 11.641 -7.368 -5.988 1.00 0.88 C ATOM 1707 O SER A 115 12.506 -8.238 -5.910 1.00 0.99 O ATOM 1708 CB SER A 115 9.481 -8.350 -5.114 1.00 0.97 C ATOM 1709 OG SER A 115 10.099 -9.601 -4.926 1.00 1.96 O ATOM 0 H SER A 115 8.911 -5.938 -5.195 1.00 0.83 H new ATOM 0 HA SER A 115 10.986 -7.371 -3.953 1.00 0.84 H new ATOM 0 HB2 SER A 115 8.668 -8.220 -4.399 1.00 0.97 H new ATOM 0 HB3 SER A 115 9.042 -8.293 -6.110 1.00 0.97 H new ATOM 0 HG SER A 115 10.002 -9.877 -3.991 1.00 1.96 H new ATOM 1715 N GLY A 116 11.640 -6.522 -7.017 1.00 1.01 N ATOM 1716 CA GLY A 116 12.537 -6.709 -8.139 1.00 1.16 C ATOM 1717 C GLY A 116 11.979 -7.823 -9.006 1.00 1.40 C ATOM 1718 O GLY A 116 11.270 -7.549 -9.969 1.00 2.38 O ATOM 0 H GLY A 116 11.030 -5.708 -7.090 1.00 1.01 H new ATOM 0 HA2 GLY A 116 12.626 -5.787 -8.714 1.00 1.16 H new ATOM 0 HA3 GLY A 116 13.537 -6.964 -7.789 1.00 1.16 H new ATOM 1722 N ASN A 117 12.273 -9.080 -8.662 1.00 1.25 N ATOM 1723 CA ASN A 117 11.703 -10.216 -9.370 1.00 1.59 C ATOM 1724 C ASN A 117 11.756 -11.475 -8.500 1.00 1.51 C ATOM 1725 O ASN A 117 12.572 -12.366 -8.734 1.00 2.06 O ATOM 1726 CB ASN A 117 12.437 -10.418 -10.705 1.00 2.46 C ATOM 1727 CG ASN A 117 11.626 -11.294 -11.652 1.00 3.04 C ATOM 1728 OD1 ASN A 117 10.728 -12.024 -11.246 1.00 3.37 O ATOM 1729 ND2 ASN A 117 11.899 -11.199 -12.946 1.00 3.76 N ATOM 0 H ASN A 117 12.901 -9.330 -7.899 1.00 1.25 H new ATOM 0 HA ASN A 117 10.654 -10.015 -9.586 1.00 1.59 H new ATOM 0 HB2 ASN A 117 12.624 -9.450 -11.171 1.00 2.46 H new ATOM 0 HB3 ASN A 117 13.409 -10.877 -10.523 1.00 2.46 H new ATOM 0 HD21 ASN A 117 11.358 -11.738 -13.622 1.00 3.76 H new ATOM 0 HD22 ASN A 117 12.650 -10.587 -13.265 1.00 3.76 H new ATOM 1736 N LYS A 118 10.884 -11.560 -7.491 1.00 1.88 N ATOM 1737 CA LYS A 118 10.633 -12.804 -6.774 1.00 2.13 C ATOM 1738 C LYS A 118 9.190 -12.814 -6.288 1.00 1.85 C ATOM 1739 O LYS A 118 8.324 -13.430 -6.904 1.00 2.56 O ATOM 1740 CB LYS A 118 11.599 -12.991 -5.584 1.00 2.93 C ATOM 1741 CG LYS A 118 12.828 -13.833 -5.948 1.00 3.53 C ATOM 1742 CD LYS A 118 13.329 -14.657 -4.747 1.00 4.29 C ATOM 1743 CE LYS A 118 13.613 -16.099 -5.173 1.00 4.74 C ATOM 1744 NZ LYS A 118 14.774 -16.185 -6.083 1.00 4.83 N ATOM 0 H LYS A 118 10.336 -10.769 -7.153 1.00 1.88 H new ATOM 0 HA LYS A 118 10.805 -13.635 -7.458 1.00 2.13 H new ATOM 0 HB2 LYS A 118 11.925 -12.014 -5.229 1.00 2.93 H new ATOM 0 HB3 LYS A 118 11.067 -13.468 -4.761 1.00 2.93 H new ATOM 0 HG2 LYS A 118 12.579 -14.503 -6.771 1.00 3.53 H new ATOM 0 HG3 LYS A 118 13.626 -13.179 -6.299 1.00 3.53 H new ATOM 0 HD2 LYS A 118 14.234 -14.206 -4.340 1.00 4.29 H new ATOM 0 HD3 LYS A 118 12.582 -14.646 -3.953 1.00 4.29 H new ATOM 0 HE2 LYS A 118 13.798 -16.709 -4.289 1.00 4.74 H new ATOM 0 HE3 LYS A 118 12.733 -16.512 -5.667 1.00 4.74 H new ATOM 0 HZ1 LYS A 118 14.934 -17.178 -6.349 1.00 4.83 H new ATOM 0 HZ2 LYS A 118 14.587 -15.623 -6.938 1.00 4.83 H new ATOM 0 HZ3 LYS A 118 15.619 -15.815 -5.603 1.00 4.83 H new ATOM 1758 N ASP A 119 8.959 -12.151 -5.161 1.00 2.08 N ATOM 1759 CA ASP A 119 7.703 -12.168 -4.439 1.00 1.84 C ATOM 1760 C ASP A 119 6.690 -11.424 -5.290 1.00 1.39 C ATOM 1761 O ASP A 119 6.866 -10.234 -5.556 1.00 2.24 O ATOM 1762 CB ASP A 119 7.837 -11.492 -3.062 1.00 2.47 C ATOM 1763 CG ASP A 119 9.173 -11.782 -2.385 1.00 3.54 C ATOM 1764 OD1 ASP A 119 10.039 -10.881 -2.469 1.00 4.86 O ATOM 1765 OD2 ASP A 119 9.333 -12.908 -1.872 1.00 4.04 O ATOM 0 H ASP A 119 9.668 -11.569 -4.714 1.00 2.08 H new ATOM 0 HA ASP A 119 7.390 -13.196 -4.259 1.00 1.84 H new ATOM 0 HB2 ASP A 119 7.721 -10.415 -3.179 1.00 2.47 H new ATOM 0 HB3 ASP A 119 7.027 -11.831 -2.416 1.00 2.47 H new ATOM 1770 N ARG A 120 5.641 -12.103 -5.756 1.00 0.88 N ATOM 1771 CA ARG A 120 4.663 -11.422 -6.594 1.00 1.00 C ATOM 1772 C ARG A 120 3.471 -10.998 -5.761 1.00 0.89 C ATOM 1773 O ARG A 120 3.465 -11.072 -4.531 1.00 0.86 O ATOM 1774 CB ARG A 120 4.234 -12.259 -7.804 1.00 1.64 C ATOM 1775 CG ARG A 120 5.397 -13.033 -8.427 1.00 1.98 C ATOM 1776 CD ARG A 120 5.053 -13.343 -9.883 1.00 2.66 C ATOM 1777 NE ARG A 120 6.023 -14.280 -10.468 1.00 3.17 N ATOM 1778 CZ ARG A 120 5.924 -15.617 -10.463 1.00 3.65 C ATOM 1779 NH1 ARG A 120 6.893 -16.358 -11.002 1.00 4.30 N ATOM 1780 NH2 ARG A 120 4.862 -16.216 -9.921 1.00 4.21 N ATOM 0 H ARG A 120 5.453 -13.089 -5.574 1.00 0.88 H new ATOM 0 HA ARG A 120 5.143 -10.532 -7.001 1.00 1.00 H new ATOM 0 HB2 ARG A 120 3.458 -12.961 -7.499 1.00 1.64 H new ATOM 0 HB3 ARG A 120 3.794 -11.604 -8.556 1.00 1.64 H new ATOM 0 HG2 ARG A 120 6.314 -12.447 -8.372 1.00 1.98 H new ATOM 0 HG3 ARG A 120 5.575 -13.956 -7.876 1.00 1.98 H new ATOM 0 HD2 ARG A 120 4.051 -13.769 -9.941 1.00 2.66 H new ATOM 0 HD3 ARG A 120 5.040 -12.419 -10.462 1.00 2.66 H new ATOM 0 HE ARG A 120 6.845 -13.877 -10.918 1.00 3.17 H new ATOM 0 HH11 ARG A 120 7.708 -15.907 -11.417 1.00 4.30 H new ATOM 0 HH12 ARG A 120 6.819 -17.375 -10.999 1.00 4.30 H new ATOM 0 HH21 ARG A 120 4.117 -15.656 -9.506 1.00 4.21 H new ATOM 0 HH22 ARG A 120 4.795 -17.234 -9.922 1.00 4.21 H new ATOM 1794 N LEU A 121 2.412 -10.604 -6.457 1.00 0.87 N ATOM 1795 CA LEU A 121 1.200 -10.168 -5.810 1.00 0.78 C ATOM 1796 C LEU A 121 0.587 -11.294 -5.055 1.00 0.83 C ATOM 1797 O LEU A 121 0.114 -11.069 -3.963 1.00 0.84 O ATOM 1798 CB LEU A 121 0.236 -9.503 -6.762 1.00 0.82 C ATOM 1799 CG LEU A 121 -1.043 -10.210 -7.216 1.00 1.29 C ATOM 1800 CD1 LEU A 121 -0.845 -11.372 -8.190 1.00 2.09 C ATOM 1801 CD2 LEU A 121 -2.054 -10.561 -6.119 1.00 3.85 C ATOM 0 H LEU A 121 2.377 -10.581 -7.476 1.00 0.87 H new ATOM 0 HA LEU A 121 1.463 -9.392 -5.092 1.00 0.78 H new ATOM 0 HB2 LEU A 121 -0.066 -8.562 -6.303 1.00 0.82 H new ATOM 0 HB3 LEU A 121 0.798 -9.253 -7.662 1.00 0.82 H new ATOM 0 HG LEU A 121 -1.508 -9.407 -7.788 1.00 1.29 H new ATOM 0 HD11 LEU A 121 -1.814 -11.801 -8.446 1.00 2.09 H new ATOM 0 HD12 LEU A 121 -0.358 -11.009 -9.095 1.00 2.09 H new ATOM 0 HD13 LEU A 121 -0.222 -12.135 -7.724 1.00 2.09 H new ATOM 0 HD21 LEU A 121 -2.916 -11.057 -6.564 1.00 3.85 H new ATOM 0 HD22 LEU A 121 -1.587 -11.227 -5.393 1.00 3.85 H new ATOM 0 HD23 LEU A 121 -2.379 -9.649 -5.618 1.00 3.85 H new ATOM 1813 N THR A 122 0.645 -12.500 -5.595 1.00 0.94 N ATOM 1814 CA THR A 122 0.180 -13.697 -4.951 1.00 1.04 C ATOM 1815 C THR A 122 0.740 -13.792 -3.539 1.00 0.97 C ATOM 1816 O THR A 122 0.050 -14.247 -2.630 1.00 1.00 O ATOM 1817 CB THR A 122 0.631 -14.834 -5.865 1.00 1.22 C ATOM 1818 OG1 THR A 122 -0.079 -14.717 -7.078 1.00 1.28 O ATOM 1819 CG2 THR A 122 0.397 -16.195 -5.238 1.00 1.45 C ATOM 0 H THR A 122 1.031 -12.668 -6.524 1.00 0.94 H new ATOM 0 HA THR A 122 -0.902 -13.726 -4.820 1.00 1.04 H new ATOM 0 HB THR A 122 1.705 -14.755 -6.036 1.00 1.22 H new ATOM 0 HG1 THR A 122 0.193 -15.435 -7.687 1.00 1.28 H new ATOM 0 HG21 THR A 122 0.732 -16.974 -5.923 1.00 1.45 H new ATOM 0 HG22 THR A 122 0.956 -16.267 -4.305 1.00 1.45 H new ATOM 0 HG23 THR A 122 -0.666 -16.324 -5.035 1.00 1.45 H new ATOM 1827 N GLN A 123 1.978 -13.339 -3.343 1.00 0.93 N ATOM 1828 CA GLN A 123 2.592 -13.398 -2.036 1.00 0.92 C ATOM 1829 C GLN A 123 2.029 -12.281 -1.168 1.00 0.75 C ATOM 1830 O GLN A 123 1.502 -12.527 -0.085 1.00 0.74 O ATOM 1831 CB GLN A 123 4.117 -13.320 -2.180 1.00 1.03 C ATOM 1832 CG GLN A 123 4.765 -14.477 -1.420 1.00 1.66 C ATOM 1833 CD GLN A 123 6.230 -14.609 -1.815 1.00 1.87 C ATOM 1834 OE1 GLN A 123 6.518 -14.915 -2.967 1.00 2.37 O ATOM 1835 NE2 GLN A 123 7.152 -14.357 -0.896 1.00 2.81 N ATOM 0 H GLN A 123 2.564 -12.932 -4.072 1.00 0.93 H new ATOM 0 HA GLN A 123 2.363 -14.344 -1.545 1.00 0.92 H new ATOM 0 HB2 GLN A 123 4.395 -13.362 -3.233 1.00 1.03 H new ATOM 0 HB3 GLN A 123 4.481 -12.368 -1.792 1.00 1.03 H new ATOM 0 HG2 GLN A 123 4.684 -14.307 -0.346 1.00 1.66 H new ATOM 0 HG3 GLN A 123 4.237 -15.406 -1.637 1.00 1.66 H new ATOM 0 HE21 GLN A 123 6.872 -14.105 0.052 1.00 2.81 H new ATOM 0 HE22 GLN A 123 8.141 -14.415 -1.137 1.00 2.81 H new ATOM 1844 N SER A 124 2.100 -11.042 -1.657 1.00 0.69 N ATOM 1845 CA SER A 124 1.709 -9.885 -0.863 1.00 0.64 C ATOM 1846 C SER A 124 0.232 -9.950 -0.479 1.00 0.64 C ATOM 1847 O SER A 124 -0.160 -9.472 0.582 1.00 0.64 O ATOM 1848 CB SER A 124 2.063 -8.593 -1.613 1.00 0.70 C ATOM 1849 OG SER A 124 3.095 -7.928 -0.921 1.00 1.39 O ATOM 0 H SER A 124 2.425 -10.818 -2.598 1.00 0.69 H new ATOM 0 HA SER A 124 2.269 -9.891 0.072 1.00 0.64 H new ATOM 0 HB2 SER A 124 2.380 -8.823 -2.630 1.00 0.70 H new ATOM 0 HB3 SER A 124 1.186 -7.950 -1.690 1.00 0.70 H new ATOM 0 HG SER A 124 3.005 -6.961 -1.050 1.00 1.39 H new ATOM 1855 N LEU A 125 -0.575 -10.561 -1.340 1.00 0.73 N ATOM 1856 CA LEU A 125 -1.986 -10.836 -1.200 1.00 0.89 C ATOM 1857 C LEU A 125 -2.167 -11.862 -0.129 1.00 0.94 C ATOM 1858 O LEU A 125 -3.018 -11.692 0.720 1.00 1.01 O ATOM 1859 CB LEU A 125 -2.526 -11.319 -2.553 1.00 1.06 C ATOM 1860 CG LEU A 125 -3.868 -12.061 -2.622 1.00 1.05 C ATOM 1861 CD1 LEU A 125 -3.744 -13.569 -2.370 1.00 1.48 C ATOM 1862 CD2 LEU A 125 -4.948 -11.465 -1.725 1.00 1.96 C ATOM 0 H LEU A 125 -0.218 -10.904 -2.232 1.00 0.73 H new ATOM 0 HA LEU A 125 -2.541 -9.943 -0.912 1.00 0.89 H new ATOM 0 HB2 LEU A 125 -2.604 -10.446 -3.201 1.00 1.06 H new ATOM 0 HB3 LEU A 125 -1.771 -11.973 -2.989 1.00 1.06 H new ATOM 0 HG LEU A 125 -4.188 -11.920 -3.654 1.00 1.05 H new ATOM 0 HD11 LEU A 125 -4.729 -14.031 -2.434 1.00 1.48 H new ATOM 0 HD12 LEU A 125 -3.087 -14.010 -3.120 1.00 1.48 H new ATOM 0 HD13 LEU A 125 -3.327 -13.739 -1.377 1.00 1.48 H new ATOM 0 HD21 LEU A 125 -5.866 -12.043 -1.828 1.00 1.96 H new ATOM 0 HD22 LEU A 125 -4.616 -11.494 -0.687 1.00 1.96 H new ATOM 0 HD23 LEU A 125 -5.135 -10.432 -2.018 1.00 1.96 H new ATOM 1874 N ASN A 126 -1.363 -12.910 -0.129 1.00 0.93 N ATOM 1875 CA ASN A 126 -1.491 -13.938 0.895 1.00 1.01 C ATOM 1876 C ASN A 126 -1.396 -13.298 2.277 1.00 0.91 C ATOM 1877 O ASN A 126 -2.219 -13.529 3.163 1.00 0.99 O ATOM 1878 CB ASN A 126 -0.431 -15.028 0.703 1.00 1.03 C ATOM 1879 CG ASN A 126 -0.949 -16.362 1.217 1.00 1.34 C ATOM 1880 OD1 ASN A 126 -1.363 -16.480 2.360 1.00 1.93 O ATOM 1881 ND2 ASN A 126 -0.965 -17.385 0.371 1.00 2.12 N ATOM 0 H ASN A 126 -0.625 -13.073 -0.814 1.00 0.93 H new ATOM 0 HA ASN A 126 -2.466 -14.417 0.805 1.00 1.01 H new ATOM 0 HB2 ASN A 126 -0.173 -15.112 -0.353 1.00 1.03 H new ATOM 0 HB3 ASN A 126 0.481 -14.755 1.233 1.00 1.03 H new ATOM 0 HD21 ASN A 126 -1.328 -18.290 0.672 1.00 2.12 H new ATOM 0 HD22 ASN A 126 -0.615 -17.266 -0.580 1.00 2.12 H new ATOM 1888 N HIS A 127 -0.420 -12.411 2.430 1.00 0.75 N ATOM 1889 CA HIS A 127 -0.186 -11.732 3.690 1.00 0.70 C ATOM 1890 C HIS A 127 -1.250 -10.664 3.918 1.00 0.79 C ATOM 1891 O HIS A 127 -1.608 -10.403 5.063 1.00 0.84 O ATOM 1892 CB HIS A 127 1.233 -11.149 3.695 1.00 0.66 C ATOM 1893 CG HIS A 127 2.301 -12.202 3.528 1.00 0.72 C ATOM 1894 ND1 HIS A 127 2.613 -13.199 4.426 1.00 0.95 N ATOM 1895 CD2 HIS A 127 3.124 -12.348 2.445 1.00 0.67 C ATOM 1896 CE1 HIS A 127 3.608 -13.928 3.885 1.00 1.03 C ATOM 1897 NE2 HIS A 127 3.944 -13.455 2.674 1.00 0.85 N ATOM 0 H HIS A 127 0.226 -12.146 1.686 1.00 0.75 H new ATOM 0 HA HIS A 127 -0.262 -12.439 4.516 1.00 0.70 H new ATOM 0 HB2 HIS A 127 1.323 -10.417 2.892 1.00 0.66 H new ATOM 0 HB3 HIS A 127 1.398 -10.616 4.632 1.00 0.66 H new ATOM 0 HD2 HIS A 127 3.137 -11.718 1.568 1.00 0.67 H new ATOM 0 HE1 HIS A 127 4.073 -14.779 4.361 1.00 1.03 H new ATOM 0 HE2 HIS A 127 4.656 -13.829 2.047 1.00 0.85 H new ATOM 1905 N LEU A 128 -1.781 -10.051 2.857 1.00 0.86 N ATOM 1906 CA LEU A 128 -2.744 -8.969 3.003 1.00 0.97 C ATOM 1907 C LEU A 128 -4.048 -9.547 3.524 1.00 1.08 C ATOM 1908 O LEU A 128 -4.620 -9.020 4.465 1.00 1.17 O ATOM 1909 CB LEU A 128 -2.967 -8.245 1.667 1.00 1.00 C ATOM 1910 CG LEU A 128 -3.831 -6.987 1.856 1.00 0.97 C ATOM 1911 CD1 LEU A 128 -2.987 -5.828 2.379 1.00 1.51 C ATOM 1912 CD2 LEU A 128 -4.527 -6.581 0.556 1.00 1.21 C ATOM 0 H LEU A 128 -1.557 -10.289 1.891 1.00 0.86 H new ATOM 0 HA LEU A 128 -2.358 -8.234 3.709 1.00 0.97 H new ATOM 0 HB2 LEU A 128 -2.005 -7.968 1.235 1.00 1.00 H new ATOM 0 HB3 LEU A 128 -3.451 -8.920 0.961 1.00 1.00 H new ATOM 0 HG LEU A 128 -4.600 -7.228 2.590 1.00 0.97 H new ATOM 0 HD11 LEU A 128 -3.617 -4.947 2.506 1.00 1.51 H new ATOM 0 HD12 LEU A 128 -2.548 -6.102 3.338 1.00 1.51 H new ATOM 0 HD13 LEU A 128 -2.192 -5.606 1.667 1.00 1.51 H new ATOM 0 HD21 LEU A 128 -5.128 -5.688 0.729 1.00 1.21 H new ATOM 0 HD22 LEU A 128 -3.778 -6.372 -0.208 1.00 1.21 H new ATOM 0 HD23 LEU A 128 -5.171 -7.393 0.219 1.00 1.21 H new ATOM 1924 N LEU A 129 -4.486 -10.650 2.923 1.00 1.11 N ATOM 1925 CA LEU A 129 -5.619 -11.472 3.306 1.00 1.33 C ATOM 1926 C LEU A 129 -5.444 -11.927 4.737 1.00 1.18 C ATOM 1927 O LEU A 129 -6.404 -11.926 5.488 1.00 1.22 O ATOM 1928 CB LEU A 129 -5.765 -12.616 2.283 1.00 1.48 C ATOM 1929 CG LEU A 129 -6.419 -13.944 2.698 1.00 2.82 C ATOM 1930 CD1 LEU A 129 -5.434 -14.903 3.376 1.00 3.92 C ATOM 1931 CD2 LEU A 129 -7.695 -13.810 3.534 1.00 3.79 C ATOM 0 H LEU A 129 -4.019 -11.016 2.093 1.00 1.11 H new ATOM 0 HA LEU A 129 -6.556 -10.915 3.284 1.00 1.33 H new ATOM 0 HB2 LEU A 129 -6.334 -12.225 1.439 1.00 1.48 H new ATOM 0 HB3 LEU A 129 -4.766 -12.849 1.913 1.00 1.48 H new ATOM 0 HG LEU A 129 -6.730 -14.375 1.747 1.00 2.82 H new ATOM 0 HD11 LEU A 129 -5.951 -15.824 3.647 1.00 3.92 H new ATOM 0 HD12 LEU A 129 -4.619 -15.133 2.689 1.00 3.92 H new ATOM 0 HD13 LEU A 129 -5.031 -14.435 4.274 1.00 3.92 H new ATOM 0 HD21 LEU A 129 -8.078 -14.802 3.775 1.00 3.79 H new ATOM 0 HD22 LEU A 129 -7.471 -13.274 4.456 1.00 3.79 H new ATOM 0 HD23 LEU A 129 -8.445 -13.259 2.967 1.00 3.79 H new ATOM 1943 N THR A 130 -4.229 -12.263 5.151 1.00 1.01 N ATOM 1944 CA THR A 130 -4.036 -12.733 6.512 1.00 0.98 C ATOM 1945 C THR A 130 -4.225 -11.567 7.478 1.00 1.00 C ATOM 1946 O THR A 130 -4.845 -11.706 8.531 1.00 1.03 O ATOM 1947 CB THR A 130 -2.677 -13.432 6.630 1.00 0.93 C ATOM 1948 OG1 THR A 130 -2.679 -14.574 5.802 1.00 0.95 O ATOM 1949 CG2 THR A 130 -2.400 -13.920 8.052 1.00 0.99 C ATOM 0 H THR A 130 -3.385 -12.220 4.580 1.00 1.01 H new ATOM 0 HA THR A 130 -4.782 -13.481 6.781 1.00 0.98 H new ATOM 0 HB THR A 130 -1.915 -12.707 6.343 1.00 0.93 H new ATOM 0 HG1 THR A 130 -2.528 -14.304 4.872 1.00 0.95 H new ATOM 0 HG21 THR A 130 -1.426 -14.408 8.086 1.00 0.99 H new ATOM 0 HG22 THR A 130 -2.404 -13.071 8.735 1.00 0.99 H new ATOM 0 HG23 THR A 130 -3.172 -14.629 8.350 1.00 0.99 H new ATOM 1957 N ALA A 131 -3.733 -10.386 7.113 1.00 1.04 N ATOM 1958 CA ALA A 131 -3.899 -9.217 7.954 1.00 1.15 C ATOM 1959 C ALA A 131 -5.359 -8.799 8.062 1.00 1.29 C ATOM 1960 O ALA A 131 -5.864 -8.484 9.142 1.00 1.40 O ATOM 1961 CB ALA A 131 -3.065 -8.074 7.375 1.00 1.29 C ATOM 0 H ALA A 131 -3.221 -10.219 6.247 1.00 1.04 H new ATOM 0 HA ALA A 131 -3.560 -9.462 8.961 1.00 1.15 H new ATOM 0 HB1 ALA A 131 -3.181 -7.187 7.998 1.00 1.29 H new ATOM 0 HB2 ALA A 131 -2.015 -8.366 7.350 1.00 1.29 H new ATOM 0 HB3 ALA A 131 -3.404 -7.853 6.363 1.00 1.29 H new ATOM 1967 N LEU A 132 -6.036 -8.770 6.923 1.00 1.29 N ATOM 1968 CA LEU A 132 -7.399 -8.260 6.865 1.00 1.39 C ATOM 1969 C LEU A 132 -8.360 -9.296 7.458 1.00 1.32 C ATOM 1970 O LEU A 132 -9.435 -8.974 7.965 1.00 1.32 O ATOM 1971 CB LEU A 132 -7.744 -7.772 5.456 1.00 1.48 C ATOM 1972 CG LEU A 132 -7.792 -8.883 4.422 1.00 3.93 C ATOM 1973 CD1 LEU A 132 -9.116 -9.642 4.458 1.00 5.30 C ATOM 1974 CD2 LEU A 132 -7.574 -8.332 3.011 1.00 5.24 C ATOM 0 H LEU A 132 -5.666 -9.092 6.029 1.00 1.29 H new ATOM 0 HA LEU A 132 -7.504 -7.370 7.486 1.00 1.39 H new ATOM 0 HB2 LEU A 132 -8.711 -7.269 5.481 1.00 1.48 H new ATOM 0 HB3 LEU A 132 -7.007 -7.031 5.147 1.00 1.48 H new ATOM 0 HG LEU A 132 -6.987 -9.573 4.674 1.00 3.93 H new ATOM 0 HD11 LEU A 132 -9.106 -10.427 3.702 1.00 5.30 H new ATOM 0 HD12 LEU A 132 -9.253 -10.088 5.443 1.00 5.30 H new ATOM 0 HD13 LEU A 132 -9.936 -8.953 4.255 1.00 5.30 H new ATOM 0 HD21 LEU A 132 -7.613 -9.149 2.291 1.00 5.24 H new ATOM 0 HD22 LEU A 132 -8.354 -7.606 2.779 1.00 5.24 H new ATOM 0 HD23 LEU A 132 -6.599 -7.847 2.956 1.00 5.24 H new ATOM 1986 N ASP A 133 -7.938 -10.560 7.445 1.00 1.30 N ATOM 1987 CA ASP A 133 -8.655 -11.645 8.111 1.00 1.26 C ATOM 1988 C ASP A 133 -8.636 -11.435 9.622 1.00 1.26 C ATOM 1989 O ASP A 133 -9.618 -11.709 10.301 1.00 1.24 O ATOM 1990 CB ASP A 133 -8.069 -12.997 7.694 1.00 1.32 C ATOM 1991 CG ASP A 133 -8.787 -14.181 8.329 1.00 1.63 C ATOM 1992 OD1 ASP A 133 -8.213 -14.759 9.277 1.00 3.00 O ATOM 1993 OD2 ASP A 133 -9.866 -14.531 7.800 1.00 2.29 O ATOM 0 H ASP A 133 -7.086 -10.860 6.971 1.00 1.30 H new ATOM 0 HA ASP A 133 -9.700 -11.642 7.802 1.00 1.26 H new ATOM 0 HB2 ASP A 133 -8.119 -13.089 6.609 1.00 1.32 H new ATOM 0 HB3 ASP A 133 -7.015 -13.029 7.968 1.00 1.32 H new ATOM 1998 N THR A 134 -7.560 -10.848 10.149 1.00 1.33 N ATOM 1999 CA THR A 134 -7.427 -10.559 11.569 1.00 1.47 C ATOM 2000 C THR A 134 -8.239 -9.314 11.977 1.00 1.33 C ATOM 2001 O THR A 134 -8.221 -8.923 13.142 1.00 1.46 O ATOM 2002 CB THR A 134 -5.919 -10.515 11.895 1.00 1.83 C ATOM 2003 OG1 THR A 134 -5.594 -11.494 12.859 1.00 2.36 O ATOM 2004 CG2 THR A 134 -5.387 -9.182 12.405 1.00 2.01 C ATOM 0 H THR A 134 -6.754 -10.560 9.595 1.00 1.33 H new ATOM 0 HA THR A 134 -7.868 -11.343 12.184 1.00 1.47 H new ATOM 0 HB THR A 134 -5.444 -10.698 10.931 1.00 1.83 H new ATOM 0 HG1 THR A 134 -4.634 -11.455 13.054 1.00 2.36 H new ATOM 0 HG21 THR A 134 -4.318 -9.268 12.601 1.00 2.01 H new ATOM 0 HG22 THR A 134 -5.557 -8.411 11.654 1.00 2.01 H new ATOM 0 HG23 THR A 134 -5.904 -8.912 13.326 1.00 2.01 H new ATOM 2012 N THR A 135 -8.972 -8.676 11.056 1.00 1.16 N ATOM 2013 CA THR A 135 -9.652 -7.411 11.339 1.00 1.12 C ATOM 2014 C THR A 135 -11.159 -7.475 11.151 1.00 0.96 C ATOM 2015 O THR A 135 -11.888 -6.726 11.799 1.00 2.54 O ATOM 2016 CB THR A 135 -9.070 -6.293 10.478 1.00 1.44 C ATOM 2017 OG1 THR A 135 -8.320 -6.782 9.401 1.00 2.11 O ATOM 2018 CG2 THR A 135 -8.123 -5.468 11.320 1.00 1.33 C ATOM 0 H THR A 135 -9.108 -9.019 10.105 1.00 1.16 H new ATOM 0 HA THR A 135 -9.478 -7.203 12.395 1.00 1.12 H new ATOM 0 HB THR A 135 -9.912 -5.715 10.098 1.00 1.44 H new ATOM 0 HG1 THR A 135 -8.860 -7.419 8.889 1.00 2.11 H new ATOM 0 HG21 THR A 135 -7.702 -4.666 10.714 1.00 1.33 H new ATOM 0 HG22 THR A 135 -8.665 -5.039 12.163 1.00 1.33 H new ATOM 0 HG23 THR A 135 -7.319 -6.103 11.691 1.00 1.33 H new ATOM 2026 N ASP A 136 -11.630 -8.346 10.262 1.00 1.87 N ATOM 2027 CA ASP A 136 -13.054 -8.621 10.082 1.00 1.69 C ATOM 2028 C ASP A 136 -13.812 -7.380 9.585 1.00 1.60 C ATOM 2029 O ASP A 136 -15.026 -7.282 9.763 1.00 1.90 O ATOM 2030 CB ASP A 136 -13.658 -9.220 11.380 1.00 2.05 C ATOM 2031 CG ASP A 136 -13.919 -10.716 11.253 1.00 3.87 C ATOM 2032 OD1 ASP A 136 -13.567 -11.459 12.190 1.00 5.03 O ATOM 2033 OD2 ASP A 136 -14.540 -11.075 10.224 1.00 4.73 O ATOM 0 H ASP A 136 -11.028 -8.886 9.640 1.00 1.87 H new ATOM 0 HA ASP A 136 -13.167 -9.371 9.299 1.00 1.69 H new ATOM 0 HB2 ASP A 136 -12.978 -9.040 12.212 1.00 2.05 H new ATOM 0 HB3 ASP A 136 -14.591 -8.708 11.615 1.00 2.05 H new ATOM 2038 N ALA A 137 -13.115 -6.454 8.921 1.00 1.39 N ATOM 2039 CA ALA A 137 -13.665 -5.187 8.478 1.00 1.51 C ATOM 2040 C ALA A 137 -14.112 -5.318 7.019 1.00 1.22 C ATOM 2041 O ALA A 137 -15.092 -6.001 6.743 1.00 1.29 O ATOM 2042 CB ALA A 137 -12.600 -4.107 8.713 1.00 1.76 C ATOM 0 H ALA A 137 -12.132 -6.575 8.675 1.00 1.39 H new ATOM 0 HA ALA A 137 -14.553 -4.897 9.040 1.00 1.51 H new ATOM 0 HB1 ALA A 137 -12.985 -3.140 8.389 1.00 1.76 H new ATOM 0 HB2 ALA A 137 -12.355 -4.063 9.774 1.00 1.76 H new ATOM 0 HB3 ALA A 137 -11.703 -4.350 8.143 1.00 1.76 H new ATOM 2048 N ASP A 138 -13.400 -4.684 6.091 1.00 1.11 N ATOM 2049 CA ASP A 138 -13.594 -4.794 4.649 1.00 1.04 C ATOM 2050 C ASP A 138 -12.361 -4.162 4.003 1.00 1.12 C ATOM 2051 O ASP A 138 -11.775 -3.237 4.573 1.00 1.33 O ATOM 2052 CB ASP A 138 -14.870 -4.074 4.190 1.00 1.25 C ATOM 2053 CG ASP A 138 -15.238 -4.478 2.763 1.00 1.27 C ATOM 2054 OD1 ASP A 138 -16.243 -5.205 2.599 1.00 2.42 O ATOM 2055 OD2 ASP A 138 -14.503 -4.062 1.843 1.00 1.98 O ATOM 0 H ASP A 138 -12.638 -4.051 6.335 1.00 1.11 H new ATOM 0 HA ASP A 138 -13.712 -5.838 4.358 1.00 1.04 H new ATOM 0 HB2 ASP A 138 -15.692 -4.315 4.864 1.00 1.25 H new ATOM 0 HB3 ASP A 138 -14.722 -2.995 4.241 1.00 1.25 H new ATOM 2060 N VAL A 139 -11.921 -4.677 2.858 1.00 1.01 N ATOM 2061 CA VAL A 139 -10.732 -4.204 2.172 1.00 1.07 C ATOM 2062 C VAL A 139 -11.057 -4.032 0.700 1.00 0.93 C ATOM 2063 O VAL A 139 -11.759 -4.856 0.115 1.00 1.04 O ATOM 2064 CB VAL A 139 -9.582 -5.194 2.424 1.00 1.16 C ATOM 2065 CG1 VAL A 139 -8.620 -5.349 1.235 1.00 2.30 C ATOM 2066 CG2 VAL A 139 -8.816 -4.739 3.671 1.00 2.47 C ATOM 0 H VAL A 139 -12.390 -5.445 2.378 1.00 1.01 H new ATOM 0 HA VAL A 139 -10.409 -3.234 2.550 1.00 1.07 H new ATOM 0 HB VAL A 139 -10.025 -6.179 2.569 1.00 1.16 H new ATOM 0 HG11 VAL A 139 -7.837 -6.063 1.491 1.00 2.30 H new ATOM 0 HG12 VAL A 139 -9.171 -5.710 0.366 1.00 2.30 H new ATOM 0 HG13 VAL A 139 -8.169 -4.384 1.004 1.00 2.30 H new ATOM 0 HG21 VAL A 139 -7.996 -5.430 3.866 1.00 2.47 H new ATOM 0 HG22 VAL A 139 -8.417 -3.738 3.508 1.00 2.47 H new ATOM 0 HG23 VAL A 139 -9.490 -4.725 4.527 1.00 2.47 H new ATOM 2076 N ALA A 140 -10.471 -3.011 0.074 1.00 0.73 N ATOM 2077 CA ALA A 140 -10.663 -2.764 -1.342 1.00 0.61 C ATOM 2078 C ALA A 140 -9.299 -2.773 -2.015 1.00 0.63 C ATOM 2079 O ALA A 140 -8.331 -2.305 -1.428 1.00 0.86 O ATOM 2080 CB ALA A 140 -11.439 -1.460 -1.561 1.00 0.62 C ATOM 0 H ALA A 140 -9.856 -2.341 0.536 1.00 0.73 H new ATOM 0 HA ALA A 140 -11.270 -3.547 -1.796 1.00 0.61 H new ATOM 0 HB1 ALA A 140 -11.573 -1.292 -2.630 1.00 0.62 H new ATOM 0 HB2 ALA A 140 -12.414 -1.532 -1.080 1.00 0.62 H new ATOM 0 HB3 ALA A 140 -10.882 -0.628 -1.130 1.00 0.62 H new ATOM 2086 N ILE A 141 -9.200 -3.320 -3.225 1.00 0.65 N ATOM 2087 CA ILE A 141 -7.942 -3.527 -3.919 1.00 0.70 C ATOM 2088 C ILE A 141 -8.114 -2.889 -5.291 1.00 0.76 C ATOM 2089 O ILE A 141 -9.120 -3.114 -5.941 1.00 0.86 O ATOM 2090 CB ILE A 141 -7.643 -5.036 -4.003 1.00 0.86 C ATOM 2091 CG1 ILE A 141 -7.529 -5.639 -2.589 1.00 1.10 C ATOM 2092 CG2 ILE A 141 -6.343 -5.229 -4.787 1.00 1.23 C ATOM 2093 CD1 ILE A 141 -7.165 -7.127 -2.592 1.00 1.06 C ATOM 0 H ILE A 141 -10.011 -3.636 -3.756 1.00 0.65 H new ATOM 0 HA ILE A 141 -7.094 -3.076 -3.404 1.00 0.70 H new ATOM 0 HB ILE A 141 -8.456 -5.551 -4.515 1.00 0.86 H new ATOM 0 HG12 ILE A 141 -6.775 -5.089 -2.027 1.00 1.10 H new ATOM 0 HG13 ILE A 141 -8.476 -5.505 -2.067 1.00 1.10 H new ATOM 0 HG21 ILE A 141 -6.115 -6.293 -4.857 1.00 1.23 H new ATOM 0 HG22 ILE A 141 -6.458 -4.816 -5.789 1.00 1.23 H new ATOM 0 HG23 ILE A 141 -5.529 -4.716 -4.274 1.00 1.23 H new ATOM 0 HD11 ILE A 141 -7.101 -7.488 -1.566 1.00 1.06 H new ATOM 0 HD12 ILE A 141 -7.931 -7.688 -3.127 1.00 1.06 H new ATOM 0 HD13 ILE A 141 -6.203 -7.265 -3.086 1.00 1.06 H new ATOM 2105 N TYR A 142 -7.178 -2.050 -5.710 1.00 0.78 N ATOM 2106 CA TYR A 142 -7.315 -1.160 -6.847 1.00 0.83 C ATOM 2107 C TYR A 142 -5.992 -1.132 -7.600 1.00 0.79 C ATOM 2108 O TYR A 142 -4.980 -0.788 -6.993 1.00 0.87 O ATOM 2109 CB TYR A 142 -7.711 0.237 -6.326 1.00 0.94 C ATOM 2110 CG TYR A 142 -6.800 0.847 -5.258 1.00 1.79 C ATOM 2111 CD1 TYR A 142 -6.732 0.291 -3.964 1.00 2.90 C ATOM 2112 CD2 TYR A 142 -6.039 1.998 -5.541 1.00 2.78 C ATOM 2113 CE1 TYR A 142 -5.901 0.859 -2.983 1.00 4.41 C ATOM 2114 CE2 TYR A 142 -5.246 2.588 -4.537 1.00 4.32 C ATOM 2115 CZ TYR A 142 -5.168 2.028 -3.251 1.00 5.02 C ATOM 2116 OH TYR A 142 -4.416 2.613 -2.270 1.00 6.61 O ATOM 0 H TYR A 142 -6.271 -1.970 -5.249 1.00 0.78 H new ATOM 0 HA TYR A 142 -8.090 -1.500 -7.534 1.00 0.83 H new ATOM 0 HB2 TYR A 142 -7.748 0.920 -7.174 1.00 0.94 H new ATOM 0 HB3 TYR A 142 -8.721 0.177 -5.920 1.00 0.94 H new ATOM 0 HD1 TYR A 142 -7.324 -0.580 -3.724 1.00 2.90 H new ATOM 0 HD2 TYR A 142 -6.063 2.430 -6.531 1.00 2.78 H new ATOM 0 HE1 TYR A 142 -5.825 0.392 -2.012 1.00 4.41 H new ATOM 0 HE2 TYR A 142 -4.689 3.486 -4.760 1.00 4.32 H new ATOM 0 HH TYR A 142 -3.529 2.831 -2.624 1.00 6.61 H new ATOM 2126 N CYS A 143 -5.959 -1.493 -8.888 1.00 0.75 N ATOM 2127 CA CYS A 143 -4.793 -1.216 -9.729 1.00 0.71 C ATOM 2128 C CYS A 143 -5.175 -1.265 -11.204 1.00 0.80 C ATOM 2129 O CYS A 143 -6.143 -1.907 -11.609 1.00 0.82 O ATOM 2130 CB CYS A 143 -3.662 -2.230 -9.499 1.00 0.80 C ATOM 2131 SG CYS A 143 -2.365 -1.591 -8.403 1.00 2.02 S ATOM 0 H CYS A 143 -6.721 -1.974 -9.366 1.00 0.75 H new ATOM 0 HA CYS A 143 -4.442 -0.221 -9.454 1.00 0.71 H new ATOM 0 HB2 CYS A 143 -4.078 -3.142 -9.071 1.00 0.80 H new ATOM 0 HB3 CYS A 143 -3.221 -2.501 -10.458 1.00 0.80 H new ATOM 0 HG CYS A 143 -2.911 -0.964 -7.404 1.00 2.02 H new ATOM 2137 N ARG A 144 -4.352 -0.631 -12.035 1.00 1.05 N ATOM 2138 CA ARG A 144 -4.486 -0.700 -13.478 1.00 1.22 C ATOM 2139 C ARG A 144 -3.760 -1.935 -13.988 1.00 1.26 C ATOM 2140 O ARG A 144 -2.537 -1.963 -14.001 1.00 1.52 O ATOM 2141 CB ARG A 144 -3.862 0.558 -14.089 1.00 1.55 C ATOM 2142 CG ARG A 144 -4.611 1.840 -13.707 1.00 1.60 C ATOM 2143 CD ARG A 144 -5.821 2.092 -14.608 1.00 2.94 C ATOM 2144 NE ARG A 144 -5.375 2.411 -15.972 1.00 3.14 N ATOM 2145 CZ ARG A 144 -6.159 2.629 -17.029 1.00 4.20 C ATOM 2146 NH1 ARG A 144 -5.615 2.910 -18.215 1.00 4.63 N ATOM 2147 NH2 ARG A 144 -7.484 2.560 -16.899 1.00 5.54 N ATOM 0 H ARG A 144 -3.572 -0.054 -11.720 1.00 1.05 H new ATOM 0 HA ARG A 144 -5.538 -0.761 -13.758 1.00 1.22 H new ATOM 0 HB2 ARG A 144 -2.825 0.638 -13.763 1.00 1.55 H new ATOM 0 HB3 ARG A 144 -3.849 0.461 -15.175 1.00 1.55 H new ATOM 0 HG2 ARG A 144 -4.940 1.771 -12.670 1.00 1.60 H new ATOM 0 HG3 ARG A 144 -3.930 2.689 -13.770 1.00 1.60 H new ATOM 0 HD2 ARG A 144 -6.463 1.211 -14.623 1.00 2.94 H new ATOM 0 HD3 ARG A 144 -6.416 2.914 -14.210 1.00 2.94 H new ATOM 0 HE ARG A 144 -4.368 2.472 -16.125 1.00 3.14 H new ATOM 0 HH11 ARG A 144 -4.601 2.958 -18.312 1.00 4.63 H new ATOM 0 HH12 ARG A 144 -6.213 3.077 -19.024 1.00 4.63 H new ATOM 0 HH21 ARG A 144 -7.897 2.341 -15.992 1.00 5.54 H new ATOM 0 HH22 ARG A 144 -8.085 2.726 -17.706 1.00 5.54 H new ATOM 2161 N ASP A 145 -4.525 -2.923 -14.444 1.00 1.15 N ATOM 2162 CA ASP A 145 -4.012 -4.068 -15.194 1.00 1.24 C ATOM 2163 C ASP A 145 -5.182 -4.842 -15.795 1.00 1.17 C ATOM 2164 O ASP A 145 -5.167 -5.261 -16.949 1.00 1.39 O ATOM 2165 CB ASP A 145 -3.226 -5.017 -14.289 1.00 1.27 C ATOM 2166 CG ASP A 145 -2.748 -6.191 -15.134 1.00 1.76 C ATOM 2167 OD1 ASP A 145 -1.703 -6.045 -15.799 1.00 1.84 O ATOM 2168 OD2 ASP A 145 -3.493 -7.194 -15.151 1.00 3.18 O ATOM 0 H ASP A 145 -5.535 -2.952 -14.301 1.00 1.15 H new ATOM 0 HA ASP A 145 -3.350 -3.690 -15.974 1.00 1.24 H new ATOM 0 HB2 ASP A 145 -2.377 -4.500 -13.841 1.00 1.27 H new ATOM 0 HB3 ASP A 145 -3.853 -5.368 -13.470 1.00 1.27 H new ATOM 2173 N LYS A 146 -6.216 -5.035 -14.974 1.00 1.08 N ATOM 2174 CA LYS A 146 -7.412 -5.809 -15.277 1.00 1.07 C ATOM 2175 C LYS A 146 -7.193 -7.315 -15.240 1.00 1.04 C ATOM 2176 O LYS A 146 -7.976 -7.983 -14.572 1.00 1.02 O ATOM 2177 CB LYS A 146 -8.097 -5.356 -16.580 1.00 1.14 C ATOM 2178 CG LYS A 146 -9.595 -5.696 -16.562 1.00 1.35 C ATOM 2179 CD LYS A 146 -10.391 -4.641 -15.781 1.00 2.50 C ATOM 2180 CE LYS A 146 -10.820 -3.489 -16.698 1.00 2.43 C ATOM 2181 NZ LYS A 146 -12.000 -3.849 -17.519 1.00 2.82 N ATOM 0 H LYS A 146 -6.239 -4.635 -14.036 1.00 1.08 H new ATOM 0 HA LYS A 146 -8.103 -5.592 -14.462 1.00 1.07 H new ATOM 0 HB2 LYS A 146 -7.966 -4.282 -16.709 1.00 1.14 H new ATOM 0 HB3 LYS A 146 -7.621 -5.840 -17.433 1.00 1.14 H new ATOM 0 HG2 LYS A 146 -9.970 -5.756 -17.584 1.00 1.35 H new ATOM 0 HG3 LYS A 146 -9.743 -6.677 -16.110 1.00 1.35 H new ATOM 0 HD2 LYS A 146 -11.271 -5.102 -15.333 1.00 2.50 H new ATOM 0 HD3 LYS A 146 -9.784 -4.253 -14.963 1.00 2.50 H new ATOM 0 HE2 LYS A 146 -11.051 -2.611 -16.095 1.00 2.43 H new ATOM 0 HE3 LYS A 146 -9.991 -3.217 -17.352 1.00 2.43 H new ATOM 0 HZ1 LYS A 146 -12.077 -3.193 -18.322 1.00 2.82 H new ATOM 0 HZ2 LYS A 146 -11.892 -4.821 -17.874 1.00 2.82 H new ATOM 0 HZ3 LYS A 146 -12.860 -3.786 -16.937 1.00 2.82 H new ATOM 2195 N LYS A 147 -6.162 -7.884 -15.872 1.00 1.08 N ATOM 2196 CA LYS A 147 -5.906 -9.311 -15.655 1.00 1.13 C ATOM 2197 C LYS A 147 -5.693 -9.577 -14.169 1.00 1.09 C ATOM 2198 O LYS A 147 -6.083 -10.634 -13.677 1.00 1.08 O ATOM 2199 CB LYS A 147 -4.707 -9.836 -16.466 1.00 1.30 C ATOM 2200 CG LYS A 147 -5.153 -10.642 -17.691 1.00 1.68 C ATOM 2201 CD LYS A 147 -5.593 -9.735 -18.847 1.00 2.57 C ATOM 2202 CE LYS A 147 -4.656 -9.968 -20.037 1.00 2.72 C ATOM 2203 NZ LYS A 147 -4.747 -8.885 -21.038 1.00 3.76 N ATOM 0 H LYS A 147 -5.520 -7.408 -16.507 1.00 1.08 H new ATOM 0 HA LYS A 147 -6.784 -9.852 -16.009 1.00 1.13 H new ATOM 0 HB2 LYS A 147 -4.092 -8.996 -16.789 1.00 1.30 H new ATOM 0 HB3 LYS A 147 -4.083 -10.462 -15.828 1.00 1.30 H new ATOM 0 HG2 LYS A 147 -4.334 -11.280 -18.023 1.00 1.68 H new ATOM 0 HG3 LYS A 147 -5.977 -11.299 -17.412 1.00 1.68 H new ATOM 0 HD2 LYS A 147 -6.623 -9.954 -19.128 1.00 2.57 H new ATOM 0 HD3 LYS A 147 -5.562 -8.690 -18.540 1.00 2.57 H new ATOM 0 HE2 LYS A 147 -3.629 -10.045 -19.679 1.00 2.72 H new ATOM 0 HE3 LYS A 147 -4.901 -10.919 -20.510 1.00 2.72 H new ATOM 0 HZ1 LYS A 147 -4.097 -9.084 -21.825 1.00 3.76 H new ATOM 0 HZ2 LYS A 147 -5.720 -8.827 -21.400 1.00 3.76 H new ATOM 0 HZ3 LYS A 147 -4.488 -7.980 -20.595 1.00 3.76 H new ATOM 2217 N TRP A 148 -5.105 -8.633 -13.437 1.00 1.12 N ATOM 2218 CA TRP A 148 -4.807 -8.839 -12.030 1.00 1.16 C ATOM 2219 C TRP A 148 -6.095 -8.822 -11.226 1.00 1.09 C ATOM 2220 O TRP A 148 -6.227 -9.539 -10.241 1.00 1.07 O ATOM 2221 CB TRP A 148 -3.708 -7.877 -11.537 1.00 1.43 C ATOM 2222 CG TRP A 148 -4.082 -6.861 -10.507 1.00 1.89 C ATOM 2223 CD1 TRP A 148 -5.110 -6.016 -10.651 1.00 3.18 C ATOM 2224 CD2 TRP A 148 -3.460 -6.502 -9.237 1.00 2.59 C ATOM 2225 NE1 TRP A 148 -5.288 -5.269 -9.510 1.00 4.73 N ATOM 2226 CE2 TRP A 148 -4.278 -5.518 -8.604 1.00 4.31 C ATOM 2227 CE3 TRP A 148 -2.267 -6.859 -8.574 1.00 2.47 C ATOM 2228 CZ2 TRP A 148 -3.946 -4.939 -7.373 1.00 5.36 C ATOM 2229 CZ3 TRP A 148 -1.905 -6.258 -7.353 1.00 3.27 C ATOM 2230 CH2 TRP A 148 -2.740 -5.296 -6.759 1.00 4.63 C ATOM 0 H TRP A 148 -4.828 -7.720 -13.799 1.00 1.12 H new ATOM 0 HA TRP A 148 -4.374 -9.828 -11.878 1.00 1.16 H new ATOM 0 HB2 TRP A 148 -2.893 -8.478 -11.134 1.00 1.43 H new ATOM 0 HB3 TRP A 148 -3.314 -7.346 -12.404 1.00 1.43 H new ATOM 0 HD1 TRP A 148 -5.716 -5.932 -11.541 1.00 3.18 H new ATOM 0 HE1 TRP A 148 -6.060 -4.621 -9.355 1.00 4.73 H new ATOM 0 HE3 TRP A 148 -1.620 -7.606 -9.010 1.00 2.47 H new ATOM 0 HZ2 TRP A 148 -4.610 -4.228 -6.905 1.00 5.36 H new ATOM 0 HZ3 TRP A 148 -0.980 -6.538 -6.870 1.00 3.27 H new ATOM 0 HH2 TRP A 148 -2.451 -4.832 -5.828 1.00 4.63 H new ATOM 2241 N GLU A 149 -7.067 -8.027 -11.669 1.00 1.10 N ATOM 2242 CA GLU A 149 -8.326 -7.908 -10.976 1.00 1.12 C ATOM 2243 C GLU A 149 -9.141 -9.156 -11.255 1.00 1.00 C ATOM 2244 O GLU A 149 -9.836 -9.645 -10.375 1.00 1.02 O ATOM 2245 CB GLU A 149 -9.058 -6.641 -11.424 1.00 1.30 C ATOM 2246 CG GLU A 149 -8.273 -5.404 -10.971 1.00 2.95 C ATOM 2247 CD GLU A 149 -9.101 -4.163 -10.659 1.00 3.81 C ATOM 2248 OE1 GLU A 149 -8.499 -3.252 -10.044 1.00 5.15 O ATOM 2249 OE2 GLU A 149 -10.300 -4.147 -11.013 1.00 3.53 O ATOM 0 H GLU A 149 -6.995 -7.456 -12.511 1.00 1.10 H new ATOM 0 HA GLU A 149 -8.166 -7.821 -9.901 1.00 1.12 H new ATOM 0 HB2 GLU A 149 -9.168 -6.637 -12.508 1.00 1.30 H new ATOM 0 HB3 GLU A 149 -10.063 -6.621 -11.002 1.00 1.30 H new ATOM 0 HG2 GLU A 149 -7.701 -5.667 -10.082 1.00 2.95 H new ATOM 0 HG3 GLU A 149 -7.554 -5.150 -11.749 1.00 2.95 H new ATOM 2256 N MET A 150 -9.039 -9.705 -12.466 1.00 0.97 N ATOM 2257 CA MET A 150 -9.765 -10.911 -12.795 1.00 1.08 C ATOM 2258 C MET A 150 -9.219 -12.055 -11.957 1.00 1.01 C ATOM 2259 O MET A 150 -9.974 -12.719 -11.262 1.00 1.02 O ATOM 2260 CB MET A 150 -9.681 -11.224 -14.297 1.00 1.27 C ATOM 2261 CG MET A 150 -11.010 -10.901 -14.983 1.00 1.54 C ATOM 2262 SD MET A 150 -11.064 -11.384 -16.728 1.00 1.94 S ATOM 2263 CE MET A 150 -12.853 -11.333 -17.006 1.00 2.94 C ATOM 0 H MET A 150 -8.465 -9.331 -13.222 1.00 0.97 H new ATOM 0 HA MET A 150 -10.821 -10.770 -12.566 1.00 1.08 H new ATOM 0 HB2 MET A 150 -8.879 -10.643 -14.752 1.00 1.27 H new ATOM 0 HB3 MET A 150 -9.435 -12.276 -14.443 1.00 1.27 H new ATOM 0 HG2 MET A 150 -11.816 -11.406 -14.450 1.00 1.54 H new ATOM 0 HG3 MET A 150 -11.198 -9.830 -14.905 1.00 1.54 H new ATOM 0 HE1 MET A 150 -13.069 -11.606 -18.039 1.00 2.94 H new ATOM 0 HE2 MET A 150 -13.346 -12.036 -16.335 1.00 2.94 H new ATOM 0 HE3 MET A 150 -13.223 -10.326 -16.812 1.00 2.94 H new ATOM 2273 N THR A 151 -7.911 -12.289 -11.983 1.00 1.03 N ATOM 2274 CA THR A 151 -7.318 -13.391 -11.261 1.00 1.11 C ATOM 2275 C THR A 151 -7.554 -13.255 -9.768 1.00 0.97 C ATOM 2276 O THR A 151 -7.974 -14.213 -9.121 1.00 1.03 O ATOM 2277 CB THR A 151 -5.827 -13.450 -11.604 1.00 1.29 C ATOM 2278 OG1 THR A 151 -5.637 -13.409 -13.003 1.00 1.43 O ATOM 2279 CG2 THR A 151 -5.206 -14.744 -11.105 1.00 1.50 C ATOM 0 H THR A 151 -7.243 -11.720 -12.503 1.00 1.03 H new ATOM 0 HA THR A 151 -7.788 -14.328 -11.560 1.00 1.11 H new ATOM 0 HB THR A 151 -5.356 -12.592 -11.125 1.00 1.29 H new ATOM 0 HG1 THR A 151 -5.645 -12.477 -13.307 1.00 1.43 H new ATOM 0 HG21 THR A 151 -4.147 -14.762 -11.361 1.00 1.50 H new ATOM 0 HG22 THR A 151 -5.319 -14.808 -10.023 1.00 1.50 H new ATOM 0 HG23 THR A 151 -5.706 -15.592 -11.573 1.00 1.50 H new ATOM 2287 N LEU A 152 -7.322 -12.074 -9.202 1.00 0.90 N ATOM 2288 CA LEU A 152 -7.525 -11.908 -7.776 1.00 0.93 C ATOM 2289 C LEU A 152 -9.005 -12.042 -7.443 1.00 0.80 C ATOM 2290 O LEU A 152 -9.325 -12.531 -6.364 1.00 0.79 O ATOM 2291 CB LEU A 152 -6.855 -10.630 -7.245 1.00 1.30 C ATOM 2292 CG LEU A 152 -7.719 -9.359 -7.168 1.00 1.57 C ATOM 2293 CD1 LEU A 152 -8.654 -9.370 -5.948 1.00 3.19 C ATOM 2294 CD2 LEU A 152 -6.770 -8.163 -7.047 1.00 2.34 C ATOM 0 H LEU A 152 -7.002 -11.242 -9.697 1.00 0.90 H new ATOM 0 HA LEU A 152 -7.019 -12.711 -7.240 1.00 0.93 H new ATOM 0 HB2 LEU A 152 -6.474 -10.840 -6.246 1.00 1.30 H new ATOM 0 HB3 LEU A 152 -5.993 -10.414 -7.876 1.00 1.30 H new ATOM 0 HG LEU A 152 -8.341 -9.302 -8.061 1.00 1.57 H new ATOM 0 HD11 LEU A 152 -9.245 -8.454 -5.934 1.00 3.19 H new ATOM 0 HD12 LEU A 152 -9.320 -10.231 -6.008 1.00 3.19 H new ATOM 0 HD13 LEU A 152 -8.061 -9.433 -5.036 1.00 3.19 H new ATOM 0 HD21 LEU A 152 -7.351 -7.242 -6.990 1.00 2.34 H new ATOM 0 HD22 LEU A 152 -6.166 -8.268 -6.146 1.00 2.34 H new ATOM 0 HD23 LEU A 152 -6.117 -8.127 -7.919 1.00 2.34 H new ATOM 2306 N LYS A 153 -9.920 -11.672 -8.352 1.00 0.84 N ATOM 2307 CA LYS A 153 -11.340 -11.874 -8.073 1.00 1.00 C ATOM 2308 C LYS A 153 -11.682 -13.344 -8.189 1.00 1.04 C ATOM 2309 O LYS A 153 -12.603 -13.814 -7.538 1.00 1.15 O ATOM 2310 CB LYS A 153 -12.274 -10.956 -8.893 1.00 1.34 C ATOM 2311 CG LYS A 153 -12.738 -11.325 -10.306 1.00 1.51 C ATOM 2312 CD LYS A 153 -13.611 -12.571 -10.474 1.00 2.76 C ATOM 2313 CE LYS A 153 -14.225 -12.532 -11.875 1.00 4.16 C ATOM 2314 NZ LYS A 153 -14.902 -13.802 -12.211 1.00 5.54 N ATOM 0 H LYS A 153 -9.709 -11.246 -9.255 1.00 0.84 H new ATOM 0 HA LYS A 153 -11.522 -11.566 -7.043 1.00 1.00 H new ATOM 0 HB2 LYS A 153 -13.173 -10.808 -8.295 1.00 1.34 H new ATOM 0 HB3 LYS A 153 -11.778 -9.988 -8.968 1.00 1.34 H new ATOM 0 HG2 LYS A 153 -13.288 -10.475 -10.709 1.00 1.51 H new ATOM 0 HG3 LYS A 153 -11.851 -11.453 -10.926 1.00 1.51 H new ATOM 0 HD2 LYS A 153 -13.015 -13.474 -10.344 1.00 2.76 H new ATOM 0 HD3 LYS A 153 -14.393 -12.593 -9.715 1.00 2.76 H new ATOM 0 HE2 LYS A 153 -14.940 -11.711 -11.936 1.00 4.16 H new ATOM 0 HE3 LYS A 153 -13.445 -12.330 -12.609 1.00 4.16 H new ATOM 0 HZ1 LYS A 153 -15.306 -13.738 -13.167 1.00 5.54 H new ATOM 0 HZ2 LYS A 153 -14.214 -14.582 -12.177 1.00 5.54 H new ATOM 0 HZ3 LYS A 153 -15.663 -13.982 -11.525 1.00 5.54 H new ATOM 2328 N GLU A 154 -10.964 -14.082 -9.030 1.00 1.06 N ATOM 2329 CA GLU A 154 -11.258 -15.477 -9.293 1.00 1.29 C ATOM 2330 C GLU A 154 -10.857 -16.289 -8.076 1.00 1.22 C ATOM 2331 O GLU A 154 -11.563 -17.202 -7.672 1.00 1.37 O ATOM 2332 CB GLU A 154 -10.522 -15.956 -10.550 1.00 1.47 C ATOM 2333 CG GLU A 154 -11.495 -16.715 -11.452 1.00 1.97 C ATOM 2334 CD GLU A 154 -10.776 -17.288 -12.671 1.00 2.37 C ATOM 2335 OE1 GLU A 154 -10.753 -16.574 -13.698 1.00 3.41 O ATOM 2336 OE2 GLU A 154 -10.271 -18.425 -12.554 1.00 2.77 O ATOM 0 H GLU A 154 -10.161 -13.724 -9.547 1.00 1.06 H new ATOM 0 HA GLU A 154 -12.324 -15.606 -9.478 1.00 1.29 H new ATOM 0 HB2 GLU A 154 -10.102 -15.104 -11.085 1.00 1.47 H new ATOM 0 HB3 GLU A 154 -9.688 -16.601 -10.273 1.00 1.47 H new ATOM 0 HG2 GLU A 154 -11.964 -17.522 -10.889 1.00 1.97 H new ATOM 0 HG3 GLU A 154 -12.293 -16.047 -11.776 1.00 1.97 H new ATOM 2343 N ALA A 155 -9.732 -15.930 -7.465 1.00 1.09 N ATOM 2344 CA ALA A 155 -9.250 -16.580 -6.264 1.00 1.14 C ATOM 2345 C ALA A 155 -10.061 -16.143 -5.062 1.00 0.98 C ATOM 2346 O ALA A 155 -10.404 -16.981 -4.237 1.00 1.11 O ATOM 2347 CB ALA A 155 -7.762 -16.280 -6.066 1.00 1.23 C ATOM 0 H ALA A 155 -9.130 -15.176 -7.796 1.00 1.09 H new ATOM 0 HA ALA A 155 -9.370 -17.658 -6.372 1.00 1.14 H new ATOM 0 HB1 ALA A 155 -7.409 -16.773 -5.160 1.00 1.23 H new ATOM 0 HB2 ALA A 155 -7.199 -16.649 -6.923 1.00 1.23 H new ATOM 0 HB3 ALA A 155 -7.617 -15.204 -5.973 1.00 1.23 H new ATOM 2353 N VAL A 156 -10.409 -14.857 -4.967 1.00 0.82 N ATOM 2354 CA VAL A 156 -11.308 -14.394 -3.926 1.00 0.82 C ATOM 2355 C VAL A 156 -12.613 -15.170 -4.039 1.00 0.97 C ATOM 2356 O VAL A 156 -13.166 -15.566 -3.023 1.00 1.05 O ATOM 2357 CB VAL A 156 -11.495 -12.867 -4.013 1.00 0.83 C ATOM 2358 CG1 VAL A 156 -12.830 -12.382 -3.449 1.00 0.85 C ATOM 2359 CG2 VAL A 156 -10.371 -12.171 -3.238 1.00 0.90 C ATOM 0 H VAL A 156 -10.080 -14.127 -5.599 1.00 0.82 H new ATOM 0 HA VAL A 156 -10.889 -14.583 -2.938 1.00 0.82 H new ATOM 0 HB VAL A 156 -11.474 -12.617 -5.074 1.00 0.83 H new ATOM 0 HG11 VAL A 156 -12.893 -11.298 -3.543 1.00 0.85 H new ATOM 0 HG12 VAL A 156 -13.648 -12.842 -4.003 1.00 0.85 H new ATOM 0 HG13 VAL A 156 -12.903 -12.659 -2.397 1.00 0.85 H new ATOM 0 HG21 VAL A 156 -10.502 -11.091 -3.299 1.00 0.90 H new ATOM 0 HG22 VAL A 156 -10.402 -12.482 -2.194 1.00 0.90 H new ATOM 0 HG23 VAL A 156 -9.408 -12.444 -3.669 1.00 0.90 H new ATOM 2369 N ALA A 157 -13.078 -15.428 -5.261 1.00 1.14 N ATOM 2370 CA ALA A 157 -14.384 -16.035 -5.479 1.00 1.47 C ATOM 2371 C ALA A 157 -14.314 -17.509 -5.108 1.00 1.57 C ATOM 2372 O ALA A 157 -15.174 -18.041 -4.418 1.00 1.71 O ATOM 2373 CB ALA A 157 -14.805 -15.863 -6.941 1.00 1.73 C ATOM 0 H ALA A 157 -12.564 -15.223 -6.118 1.00 1.14 H new ATOM 0 HA ALA A 157 -15.129 -15.544 -4.853 1.00 1.47 H new ATOM 0 HB1 ALA A 157 -15.783 -16.320 -7.094 1.00 1.73 H new ATOM 0 HB2 ALA A 157 -14.859 -14.801 -7.182 1.00 1.73 H new ATOM 0 HB3 ALA A 157 -14.073 -16.345 -7.589 1.00 1.73 H new ATOM 2379 N ARG A 158 -13.265 -18.187 -5.567 1.00 1.59 N ATOM 2380 CA ARG A 158 -13.073 -19.600 -5.308 1.00 1.84 C ATOM 2381 C ARG A 158 -12.738 -19.841 -3.835 1.00 1.76 C ATOM 2382 O ARG A 158 -12.777 -20.980 -3.381 1.00 2.03 O ATOM 2383 CB ARG A 158 -11.991 -20.147 -6.249 1.00 2.01 C ATOM 2384 CG ARG A 158 -12.044 -21.676 -6.343 1.00 2.14 C ATOM 2385 CD ARG A 158 -10.822 -22.208 -7.095 1.00 2.08 C ATOM 2386 NE ARG A 158 -10.646 -23.652 -6.875 1.00 2.58 N ATOM 2387 CZ ARG A 158 -10.195 -24.209 -5.741 1.00 3.71 C ATOM 2388 NH1 ARG A 158 -10.067 -25.533 -5.650 1.00 4.50 N ATOM 2389 NH2 ARG A 158 -9.875 -23.443 -4.695 1.00 4.65 N ATOM 0 H ARG A 158 -12.526 -17.765 -6.130 1.00 1.59 H new ATOM 0 HA ARG A 158 -13.999 -20.139 -5.508 1.00 1.84 H new ATOM 0 HB2 ARG A 158 -12.120 -19.716 -7.242 1.00 2.01 H new ATOM 0 HB3 ARG A 158 -11.008 -19.838 -5.893 1.00 2.01 H new ATOM 0 HG2 ARG A 158 -12.079 -22.107 -5.342 1.00 2.14 H new ATOM 0 HG3 ARG A 158 -12.956 -21.984 -6.855 1.00 2.14 H new ATOM 0 HD2 ARG A 158 -10.934 -22.011 -8.161 1.00 2.08 H new ATOM 0 HD3 ARG A 158 -9.929 -21.676 -6.765 1.00 2.08 H new ATOM 0 HE ARG A 158 -10.885 -24.278 -7.644 1.00 2.58 H new ATOM 0 HH11 ARG A 158 -10.312 -26.125 -6.444 1.00 4.50 H new ATOM 0 HH12 ARG A 158 -9.724 -25.954 -4.787 1.00 4.50 H new ATOM 0 HH21 ARG A 158 -9.973 -22.430 -4.756 1.00 4.65 H new ATOM 0 HH22 ARG A 158 -9.533 -23.871 -3.835 1.00 4.65 H new ATOM 2403 N ARG A 159 -12.354 -18.803 -3.089 1.00 1.45 N ATOM 2404 CA ARG A 159 -12.163 -18.960 -1.651 1.00 1.46 C ATOM 2405 C ARG A 159 -13.483 -19.075 -0.900 1.00 1.50 C ATOM 2406 O ARG A 159 -13.474 -19.557 0.230 1.00 1.79 O ATOM 2407 CB ARG A 159 -11.300 -17.823 -1.088 1.00 1.41 C ATOM 2408 CG ARG A 159 -12.035 -16.782 -0.232 1.00 3.24 C ATOM 2409 CD ARG A 159 -11.150 -15.559 0.029 1.00 3.33 C ATOM 2410 NE ARG A 159 -9.756 -15.917 0.336 1.00 3.42 N ATOM 2411 CZ ARG A 159 -9.338 -16.502 1.464 1.00 3.94 C ATOM 2412 NH1 ARG A 159 -8.068 -16.895 1.581 1.00 4.38 N ATOM 2413 NH2 ARG A 159 -10.188 -16.700 2.471 1.00 4.53 N ATOM 0 H ARG A 159 -12.173 -17.866 -3.449 1.00 1.45 H new ATOM 0 HA ARG A 159 -11.634 -19.900 -1.498 1.00 1.46 H new ATOM 0 HB2 ARG A 159 -10.503 -18.261 -0.487 1.00 1.41 H new ATOM 0 HB3 ARG A 159 -10.824 -17.308 -1.922 1.00 1.41 H new ATOM 0 HG2 ARG A 159 -12.950 -16.472 -0.737 1.00 3.24 H new ATOM 0 HG3 ARG A 159 -12.331 -17.230 0.717 1.00 3.24 H new ATOM 0 HD2 ARG A 159 -11.169 -14.910 -0.846 1.00 3.33 H new ATOM 0 HD3 ARG A 159 -11.564 -14.987 0.859 1.00 3.33 H new ATOM 0 HE ARG A 159 -9.051 -15.701 -0.369 1.00 3.42 H new ATOM 0 HH11 ARG A 159 -7.416 -16.749 0.810 1.00 4.38 H new ATOM 0 HH12 ARG A 159 -7.749 -17.341 2.441 1.00 4.38 H new ATOM 0 HH21 ARG A 159 -11.160 -16.405 2.383 1.00 4.53 H new ATOM 0 HH22 ARG A 159 -9.866 -17.146 3.330 1.00 4.53 H new ATOM 2427 N GLU A 160 -14.560 -18.515 -1.451 1.00 1.42 N ATOM 2428 CA GLU A 160 -15.835 -18.446 -0.754 1.00 1.60 C ATOM 2429 C GLU A 160 -16.434 -19.841 -0.589 1.00 2.37 C ATOM 2430 O GLU A 160 -17.134 -20.032 0.429 1.00 3.04 O ATOM 2431 CB GLU A 160 -16.814 -17.495 -1.467 1.00 2.51 C ATOM 2432 CG GLU A 160 -16.202 -16.102 -1.667 1.00 3.56 C ATOM 2433 CD GLU A 160 -17.230 -15.040 -2.078 1.00 5.13 C ATOM 2434 OE1 GLU A 160 -17.774 -14.382 -1.162 1.00 6.04 O ATOM 2435 OE2 GLU A 160 -17.430 -14.864 -3.302 1.00 5.88 O ATOM 0 H GLU A 160 -14.570 -18.102 -2.383 1.00 1.42 H new ATOM 0 HA GLU A 160 -15.654 -18.037 0.240 1.00 1.60 H new ATOM 0 HB2 GLU A 160 -17.090 -17.914 -2.435 1.00 2.51 H new ATOM 0 HB3 GLU A 160 -17.730 -17.410 -0.883 1.00 2.51 H new ATOM 0 HG2 GLU A 160 -15.717 -15.790 -0.742 1.00 3.56 H new ATOM 0 HG3 GLU A 160 -15.425 -16.160 -2.430 1.00 3.56 H new