USER MOD reduce.3.24.130724 H: found=0, std=0, add=379, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 381 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 166 MET CE :methyl -109:sc= -5.93! (180deg=-8.11!) USER MOD Set 1.2: A 189 ASN : amide:sc= -1.2 K(o=-7.1,f=-7.9!) USER MOD Single : A 156 THR OG1 : rot 180:sc= 0 USER MOD Single : A 159 THR OG1 : rot 180:sc= -0.661 USER MOD Single : A 161 SER OG : rot 180:sc= -0.268 USER MOD Single : A 163 TYR OH : rot 173:sc= -0.753 USER MOD Single : A 165 THR OG1 : rot 70:sc= 0.0632 USER MOD Single : A 168 THR OG1 : rot 83:sc= 0.188 USER MOD Single : A 171 MET CE :methyl -137:sc= -10.8! (180deg=-16.2!) USER MOD Single : A 172 SER OG : rot 180:sc= 0 USER MOD Single : A 173 MET CE :methyl 179:sc= -8.73! (180deg=-8.9!) USER MOD Single : A 175 TYR OH : rot 180:sc= -0.185 USER MOD Single : A 187 SER OG : rot 76:sc= -1.63! USER MOD Single : A 188 TYR OH : rot 180:sc= 0 USER MOD Single : A 190 ASN : amide:sc= -4.1! C(o=-4.1!,f=-12!) USER MOD Single : A 192 HIS : no HD1:sc= -0.083 X(o=-0.083,f=0) USER MOD Single : A 197 TYR OH : rot 180:sc= -1.16! USER MOD Single : A 200 THR OG1 : rot -69:sc= -0.0968 USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 156 -13.589 18.071 2.520 1.00 0.00 N ATOM 2 CA THR A 156 -13.670 16.588 2.533 1.00 0.00 C ATOM 3 C THR A 156 -12.377 15.961 2.018 1.00 0.00 C ATOM 4 O THR A 156 -11.538 16.641 1.429 1.00 0.00 O ATOM 5 CB THR A 156 -14.850 16.156 1.660 1.00 0.00 C ATOM 6 OG1 THR A 156 -15.201 14.809 1.922 1.00 0.00 O ATOM 7 CG2 THR A 156 -14.573 16.277 0.178 1.00 0.00 C ATOM 0 HA THR A 156 -13.816 16.247 3.558 1.00 0.00 H new ATOM 0 HB THR A 156 -15.664 16.834 1.918 1.00 0.00 H new ATOM 0 HG1 THR A 156 -15.958 14.552 1.355 1.00 0.00 H new ATOM 0 HG21 THR A 156 -15.450 15.955 -0.384 1.00 0.00 H new ATOM 0 HG22 THR A 156 -14.347 17.315 -0.066 1.00 0.00 H new ATOM 0 HG23 THR A 156 -13.722 15.648 -0.086 1.00 0.00 H new ATOM 17 N LEU A 157 -12.224 14.661 2.246 1.00 0.00 N ATOM 18 CA LEU A 157 -11.032 13.943 1.805 1.00 0.00 C ATOM 19 C LEU A 157 -11.177 12.446 2.051 1.00 0.00 C ATOM 20 O LEU A 157 -11.326 12.006 3.190 1.00 0.00 O ATOM 21 CB LEU A 157 -9.795 14.474 2.531 1.00 0.00 C ATOM 22 CG LEU A 157 -8.486 13.757 2.189 1.00 0.00 C ATOM 23 CD1 LEU A 157 -7.985 14.187 0.819 1.00 0.00 C ATOM 24 CD2 LEU A 157 -7.436 14.032 3.254 1.00 0.00 C ATOM 0 H LEU A 157 -12.909 14.083 2.733 1.00 0.00 H new ATOM 0 HA LEU A 157 -10.914 14.107 0.734 1.00 0.00 H new ATOM 0 HB2 LEU A 157 -9.683 15.533 2.299 1.00 0.00 H new ATOM 0 HB3 LEU A 157 -9.963 14.399 3.605 1.00 0.00 H new ATOM 0 HG LEU A 157 -8.676 12.684 2.163 1.00 0.00 H new ATOM 0 HD11 LEU A 157 -7.054 13.667 0.593 1.00 0.00 H new ATOM 0 HD12 LEU A 157 -8.732 13.939 0.064 1.00 0.00 H new ATOM 0 HD13 LEU A 157 -7.810 15.263 0.817 1.00 0.00 H new ATOM 0 HD21 LEU A 157 -6.512 13.515 2.996 1.00 0.00 H new ATOM 0 HD22 LEU A 157 -7.248 15.104 3.312 1.00 0.00 H new ATOM 0 HD23 LEU A 157 -7.794 13.674 4.219 1.00 0.00 H new ATOM 36 N VAL A 158 -11.132 11.668 0.973 1.00 0.00 N ATOM 37 CA VAL A 158 -11.258 10.217 1.066 1.00 0.00 C ATOM 38 C VAL A 158 -10.610 9.686 2.339 1.00 0.00 C ATOM 39 O VAL A 158 -9.420 9.371 2.359 1.00 0.00 O ATOM 40 CB VAL A 158 -10.618 9.520 -0.148 1.00 0.00 C ATOM 41 CG1 VAL A 158 -10.560 8.016 0.067 1.00 0.00 C ATOM 42 CG2 VAL A 158 -11.380 9.857 -1.420 1.00 0.00 C ATOM 0 H VAL A 158 -11.009 12.019 0.023 1.00 0.00 H new ATOM 0 HA VAL A 158 -12.325 9.995 1.086 1.00 0.00 H new ATOM 0 HB VAL A 158 -9.597 9.886 -0.257 1.00 0.00 H new ATOM 0 HG11 VAL A 158 -10.104 7.542 -0.802 1.00 0.00 H new ATOM 0 HG12 VAL A 158 -9.964 7.798 0.953 1.00 0.00 H new ATOM 0 HG13 VAL A 158 -11.570 7.629 0.204 1.00 0.00 H new ATOM 0 HG21 VAL A 158 -10.913 9.355 -2.268 1.00 0.00 H new ATOM 0 HG22 VAL A 158 -12.413 9.523 -1.325 1.00 0.00 H new ATOM 0 HG23 VAL A 158 -11.361 10.935 -1.581 1.00 0.00 H new ATOM 52 N THR A 159 -11.405 9.594 3.401 1.00 0.00 N ATOM 53 CA THR A 159 -10.914 9.103 4.685 1.00 0.00 C ATOM 54 C THR A 159 -9.876 8.000 4.476 1.00 0.00 C ATOM 55 O THR A 159 -8.675 8.231 4.616 1.00 0.00 O ATOM 56 CB THR A 159 -12.088 8.568 5.540 1.00 0.00 C ATOM 57 OG1 THR A 159 -11.731 7.345 6.159 1.00 0.00 O ATOM 58 CG2 THR A 159 -13.344 8.310 4.731 1.00 0.00 C ATOM 0 H THR A 159 -12.392 9.853 3.398 1.00 0.00 H new ATOM 0 HA THR A 159 -10.442 9.932 5.212 1.00 0.00 H new ATOM 0 HB THR A 159 -12.294 9.347 6.274 1.00 0.00 H new ATOM 0 HG1 THR A 159 -12.482 7.019 6.698 1.00 0.00 H new ATOM 0 HG21 THR A 159 -14.130 7.937 5.388 1.00 0.00 H new ATOM 0 HG22 THR A 159 -13.673 9.238 4.263 1.00 0.00 H new ATOM 0 HG23 THR A 159 -13.134 7.570 3.959 1.00 0.00 H new ATOM 66 N GLY A 160 -10.345 6.802 4.143 1.00 0.00 N ATOM 67 CA GLY A 160 -9.442 5.689 3.923 1.00 0.00 C ATOM 68 C GLY A 160 -10.114 4.526 3.219 1.00 0.00 C ATOM 69 O GLY A 160 -9.733 3.372 3.409 1.00 0.00 O ATOM 0 H GLY A 160 -11.334 6.583 4.022 1.00 0.00 H new ATOM 0 HA2 GLY A 160 -8.592 6.027 3.330 1.00 0.00 H new ATOM 0 HA3 GLY A 160 -9.047 5.351 4.881 1.00 0.00 H new ATOM 73 N SER A 161 -11.118 4.832 2.403 1.00 0.00 N ATOM 74 CA SER A 161 -11.845 3.804 1.668 1.00 0.00 C ATOM 75 C SER A 161 -10.957 3.162 0.607 1.00 0.00 C ATOM 76 O SER A 161 -10.309 2.144 0.856 1.00 0.00 O ATOM 77 CB SER A 161 -13.093 4.400 1.015 1.00 0.00 C ATOM 78 OG SER A 161 -13.533 3.601 -0.069 1.00 0.00 O ATOM 0 H SER A 161 -11.446 5.783 2.235 1.00 0.00 H new ATOM 0 HA SER A 161 -12.148 3.033 2.376 1.00 0.00 H new ATOM 0 HB2 SER A 161 -13.889 4.485 1.755 1.00 0.00 H new ATOM 0 HB3 SER A 161 -12.876 5.409 0.663 1.00 0.00 H new ATOM 0 HG SER A 161 -14.333 4.003 -0.468 1.00 0.00 H new ATOM 84 N GLU A 162 -10.931 3.765 -0.577 1.00 0.00 N ATOM 85 CA GLU A 162 -10.119 3.253 -1.676 1.00 0.00 C ATOM 86 C GLU A 162 -8.731 2.852 -1.190 1.00 0.00 C ATOM 87 O GLU A 162 -8.077 1.996 -1.784 1.00 0.00 O ATOM 88 CB GLU A 162 -10.004 4.303 -2.781 1.00 0.00 C ATOM 89 CG GLU A 162 -9.663 3.719 -4.142 1.00 0.00 C ATOM 90 CD GLU A 162 -9.968 4.675 -5.278 1.00 0.00 C ATOM 91 OE1 GLU A 162 -10.915 5.476 -5.142 1.00 0.00 O ATOM 92 OE2 GLU A 162 -9.258 4.620 -6.303 1.00 0.00 O ATOM 0 H GLU A 162 -11.462 4.607 -0.800 1.00 0.00 H new ATOM 0 HA GLU A 162 -10.611 2.366 -2.076 1.00 0.00 H new ATOM 0 HB2 GLU A 162 -10.946 4.846 -2.854 1.00 0.00 H new ATOM 0 HB3 GLU A 162 -9.239 5.028 -2.504 1.00 0.00 H new ATOM 0 HG2 GLU A 162 -8.605 3.457 -4.166 1.00 0.00 H new ATOM 0 HG3 GLU A 162 -10.224 2.796 -4.288 1.00 0.00 H new ATOM 99 N TYR A 163 -8.287 3.479 -0.106 1.00 0.00 N ATOM 100 CA TYR A 163 -6.974 3.191 0.461 1.00 0.00 C ATOM 101 C TYR A 163 -6.915 1.774 1.002 1.00 0.00 C ATOM 102 O TYR A 163 -6.055 0.983 0.613 1.00 0.00 O ATOM 103 CB TYR A 163 -6.654 4.168 1.592 1.00 0.00 C ATOM 104 CG TYR A 163 -5.186 4.468 1.748 1.00 0.00 C ATOM 105 CD1 TYR A 163 -4.358 4.590 0.643 1.00 0.00 C ATOM 106 CD2 TYR A 163 -4.631 4.629 3.007 1.00 0.00 C ATOM 107 CE1 TYR A 163 -3.014 4.865 0.789 1.00 0.00 C ATOM 108 CE2 TYR A 163 -3.288 4.905 3.164 1.00 0.00 C ATOM 109 CZ TYR A 163 -2.483 5.022 2.051 1.00 0.00 C ATOM 110 OH TYR A 163 -1.143 5.297 2.202 1.00 0.00 O ATOM 0 H TYR A 163 -8.817 4.190 0.398 1.00 0.00 H new ATOM 0 HA TYR A 163 -6.239 3.300 -0.337 1.00 0.00 H new ATOM 0 HB2 TYR A 163 -7.188 5.101 1.413 1.00 0.00 H new ATOM 0 HB3 TYR A 163 -7.032 3.759 2.529 1.00 0.00 H new ATOM 0 HD1 TYR A 163 -4.771 4.468 -0.347 1.00 0.00 H new ATOM 0 HD2 TYR A 163 -5.260 4.537 3.880 1.00 0.00 H new ATOM 0 HE1 TYR A 163 -2.381 4.957 -0.081 1.00 0.00 H new ATOM 0 HE2 TYR A 163 -2.870 5.029 4.152 1.00 0.00 H new ATOM 0 HH TYR A 163 -0.953 5.489 3.144 1.00 0.00 H new ATOM 120 N GLU A 164 -7.821 1.466 1.917 1.00 0.00 N ATOM 121 CA GLU A 164 -7.860 0.151 2.530 1.00 0.00 C ATOM 122 C GLU A 164 -8.247 -0.925 1.518 1.00 0.00 C ATOM 123 O GLU A 164 -7.975 -2.106 1.731 1.00 0.00 O ATOM 124 CB GLU A 164 -8.835 0.144 3.709 1.00 0.00 C ATOM 125 CG GLU A 164 -8.301 0.850 4.942 1.00 0.00 C ATOM 126 CD GLU A 164 -9.405 1.439 5.799 1.00 0.00 C ATOM 127 OE1 GLU A 164 -10.421 0.746 6.016 1.00 0.00 O ATOM 128 OE2 GLU A 164 -9.251 2.594 6.254 1.00 0.00 O ATOM 0 H GLU A 164 -8.538 2.110 2.250 1.00 0.00 H new ATOM 0 HA GLU A 164 -6.858 -0.077 2.895 1.00 0.00 H new ATOM 0 HB2 GLU A 164 -9.766 0.620 3.403 1.00 0.00 H new ATOM 0 HB3 GLU A 164 -9.074 -0.888 3.966 1.00 0.00 H new ATOM 0 HG2 GLU A 164 -7.721 0.145 5.537 1.00 0.00 H new ATOM 0 HG3 GLU A 164 -7.621 1.644 4.636 1.00 0.00 H new ATOM 135 N THR A 165 -8.877 -0.517 0.419 1.00 0.00 N ATOM 136 CA THR A 165 -9.283 -1.466 -0.616 1.00 0.00 C ATOM 137 C THR A 165 -8.111 -1.772 -1.540 1.00 0.00 C ATOM 138 O THR A 165 -7.969 -2.890 -2.035 1.00 0.00 O ATOM 139 CB THR A 165 -10.461 -0.929 -1.427 1.00 0.00 C ATOM 140 OG1 THR A 165 -11.507 -0.498 -0.573 1.00 0.00 O ATOM 141 CG2 THR A 165 -11.034 -1.957 -2.379 1.00 0.00 C ATOM 0 H THR A 165 -9.116 0.455 0.222 1.00 0.00 H new ATOM 0 HA THR A 165 -9.600 -2.385 -0.123 1.00 0.00 H new ATOM 0 HB THR A 165 -10.065 -0.095 -2.006 1.00 0.00 H new ATOM 0 HG1 THR A 165 -11.232 0.317 -0.104 1.00 0.00 H new ATOM 0 HG21 THR A 165 -11.868 -1.520 -2.928 1.00 0.00 H new ATOM 0 HG22 THR A 165 -10.262 -2.272 -3.081 1.00 0.00 H new ATOM 0 HG23 THR A 165 -11.385 -2.820 -1.814 1.00 0.00 H new ATOM 149 N MET A 166 -7.250 -0.779 -1.729 1.00 0.00 N ATOM 150 CA MET A 166 -6.072 -0.933 -2.538 1.00 0.00 C ATOM 151 C MET A 166 -5.143 -1.848 -1.796 1.00 0.00 C ATOM 152 O MET A 166 -4.469 -2.712 -2.359 1.00 0.00 O ATOM 153 CB MET A 166 -5.430 0.431 -2.723 1.00 0.00 C ATOM 154 CG MET A 166 -3.956 0.365 -2.974 1.00 0.00 C ATOM 155 SD MET A 166 -3.334 1.823 -3.835 1.00 0.00 S ATOM 156 CE MET A 166 -4.050 3.142 -2.856 1.00 0.00 C ATOM 0 H MET A 166 -7.359 0.150 -1.322 1.00 0.00 H new ATOM 0 HA MET A 166 -6.305 -1.347 -3.519 1.00 0.00 H new ATOM 0 HB2 MET A 166 -5.911 0.940 -3.558 1.00 0.00 H new ATOM 0 HB3 MET A 166 -5.613 1.034 -1.834 1.00 0.00 H new ATOM 0 HG2 MET A 166 -3.434 0.258 -2.023 1.00 0.00 H new ATOM 0 HG3 MET A 166 -3.731 -0.524 -3.563 1.00 0.00 H new ATOM 0 HE1 MET A 166 -4.837 3.634 -3.428 1.00 0.00 H new ATOM 0 HE2 MET A 166 -4.472 2.728 -1.940 1.00 0.00 H new ATOM 0 HE3 MET A 166 -3.277 3.868 -2.603 1.00 0.00 H new ATOM 166 N LEU A 167 -5.153 -1.637 -0.501 1.00 0.00 N ATOM 167 CA LEU A 167 -4.365 -2.408 0.415 1.00 0.00 C ATOM 168 C LEU A 167 -4.836 -3.842 0.424 1.00 0.00 C ATOM 169 O LEU A 167 -4.034 -4.758 0.376 1.00 0.00 O ATOM 170 CB LEU A 167 -4.493 -1.813 1.806 1.00 0.00 C ATOM 171 CG LEU A 167 -3.763 -0.487 1.995 1.00 0.00 C ATOM 172 CD1 LEU A 167 -3.992 0.046 3.413 1.00 0.00 C ATOM 173 CD2 LEU A 167 -2.266 -0.704 1.811 1.00 0.00 C ATOM 0 H LEU A 167 -5.718 -0.915 -0.054 1.00 0.00 H new ATOM 0 HA LEU A 167 -3.321 -2.386 0.103 1.00 0.00 H new ATOM 0 HB2 LEU A 167 -5.550 -1.667 2.029 1.00 0.00 H new ATOM 0 HB3 LEU A 167 -4.110 -2.531 2.531 1.00 0.00 H new ATOM 0 HG LEU A 167 -4.144 0.226 1.264 1.00 0.00 H new ATOM 0 HD11 LEU A 167 -3.466 0.993 3.535 1.00 0.00 H new ATOM 0 HD12 LEU A 167 -5.059 0.200 3.576 1.00 0.00 H new ATOM 0 HD13 LEU A 167 -3.615 -0.675 4.138 1.00 0.00 H new ATOM 0 HD21 LEU A 167 -1.742 0.242 1.946 1.00 0.00 H new ATOM 0 HD22 LEU A 167 -1.910 -1.424 2.547 1.00 0.00 H new ATOM 0 HD23 LEU A 167 -2.074 -1.086 0.808 1.00 0.00 H new ATOM 185 N THR A 168 -6.149 -4.015 0.483 1.00 0.00 N ATOM 186 CA THR A 168 -6.761 -5.333 0.505 1.00 0.00 C ATOM 187 C THR A 168 -6.440 -6.107 -0.768 1.00 0.00 C ATOM 188 O THR A 168 -6.318 -7.328 -0.738 1.00 0.00 O ATOM 189 CB THR A 168 -8.275 -5.207 0.689 1.00 0.00 C ATOM 190 OG1 THR A 168 -8.602 -5.060 2.059 1.00 0.00 O ATOM 191 CG2 THR A 168 -9.049 -6.394 0.160 1.00 0.00 C ATOM 0 H THR A 168 -6.818 -3.246 0.517 1.00 0.00 H new ATOM 0 HA THR A 168 -6.348 -5.888 1.347 1.00 0.00 H new ATOM 0 HB THR A 168 -8.560 -4.326 0.115 1.00 0.00 H new ATOM 0 HG1 THR A 168 -8.496 -4.122 2.322 1.00 0.00 H new ATOM 0 HG21 THR A 168 -10.115 -6.236 0.324 1.00 0.00 H new ATOM 0 HG22 THR A 168 -8.859 -6.506 -0.907 1.00 0.00 H new ATOM 0 HG23 THR A 168 -8.732 -7.297 0.682 1.00 0.00 H new ATOM 199 N GLU A 169 -6.275 -5.399 -1.876 1.00 0.00 N ATOM 200 CA GLU A 169 -5.932 -6.052 -3.127 1.00 0.00 C ATOM 201 C GLU A 169 -4.498 -6.563 -3.028 1.00 0.00 C ATOM 202 O GLU A 169 -4.241 -7.770 -2.887 1.00 0.00 O ATOM 203 CB GLU A 169 -6.076 -5.065 -4.286 1.00 0.00 C ATOM 204 CG GLU A 169 -7.135 -5.465 -5.299 1.00 0.00 C ATOM 205 CD GLU A 169 -6.576 -6.314 -6.424 1.00 0.00 C ATOM 206 OE1 GLU A 169 -5.482 -6.891 -6.244 1.00 0.00 O ATOM 207 OE2 GLU A 169 -7.230 -6.403 -7.482 1.00 0.00 O ATOM 0 H GLU A 169 -6.372 -4.385 -1.933 1.00 0.00 H new ATOM 0 HA GLU A 169 -6.604 -6.890 -3.313 1.00 0.00 H new ATOM 0 HB2 GLU A 169 -6.321 -4.081 -3.886 1.00 0.00 H new ATOM 0 HB3 GLU A 169 -5.116 -4.972 -4.794 1.00 0.00 H new ATOM 0 HG2 GLU A 169 -7.927 -6.016 -4.792 1.00 0.00 H new ATOM 0 HG3 GLU A 169 -7.589 -4.567 -5.718 1.00 0.00 H new ATOM 214 N ILE A 170 -3.562 -5.627 -3.049 1.00 0.00 N ATOM 215 CA ILE A 170 -2.161 -5.966 -2.912 1.00 0.00 C ATOM 216 C ILE A 170 -1.975 -6.840 -1.689 1.00 0.00 C ATOM 217 O ILE A 170 -1.039 -7.631 -1.596 1.00 0.00 O ATOM 218 CB ILE A 170 -1.304 -4.697 -2.791 1.00 0.00 C ATOM 219 CG1 ILE A 170 -1.503 -3.855 -4.043 1.00 0.00 C ATOM 220 CG2 ILE A 170 0.151 -5.066 -2.620 1.00 0.00 C ATOM 221 CD1 ILE A 170 -1.461 -2.364 -3.803 1.00 0.00 C ATOM 0 H ILE A 170 -3.750 -4.631 -3.159 1.00 0.00 H new ATOM 0 HA ILE A 170 -1.839 -6.509 -3.801 1.00 0.00 H new ATOM 0 HB ILE A 170 -1.609 -4.123 -1.916 1.00 0.00 H new ATOM 0 HG12 ILE A 170 -0.733 -4.116 -4.769 1.00 0.00 H new ATOM 0 HG13 ILE A 170 -2.463 -4.112 -4.491 1.00 0.00 H new ATOM 0 HG21 ILE A 170 0.749 -4.159 -2.535 1.00 0.00 H new ATOM 0 HG22 ILE A 170 0.271 -5.665 -1.717 1.00 0.00 H new ATOM 0 HG23 ILE A 170 0.485 -5.641 -3.484 1.00 0.00 H new ATOM 0 HD11 ILE A 170 -1.611 -1.839 -4.746 1.00 0.00 H new ATOM 0 HD12 ILE A 170 -2.249 -2.086 -3.104 1.00 0.00 H new ATOM 0 HD13 ILE A 170 -0.492 -2.090 -3.386 1.00 0.00 H new ATOM 233 N MET A 171 -2.909 -6.704 -0.763 1.00 0.00 N ATOM 234 CA MET A 171 -2.898 -7.496 0.460 1.00 0.00 C ATOM 235 C MET A 171 -2.960 -8.964 0.107 1.00 0.00 C ATOM 236 O MET A 171 -1.990 -9.701 0.254 1.00 0.00 O ATOM 237 CB MET A 171 -4.097 -7.146 1.331 1.00 0.00 C ATOM 238 CG MET A 171 -3.739 -6.276 2.504 1.00 0.00 C ATOM 239 SD MET A 171 -4.847 -6.474 3.904 1.00 0.00 S ATOM 240 CE MET A 171 -5.027 -4.761 4.387 1.00 0.00 C ATOM 0 H MET A 171 -3.689 -6.050 -0.834 1.00 0.00 H new ATOM 0 HA MET A 171 -1.982 -7.279 1.009 1.00 0.00 H new ATOM 0 HB2 MET A 171 -4.844 -6.636 0.723 1.00 0.00 H new ATOM 0 HB3 MET A 171 -4.555 -8.066 1.695 1.00 0.00 H new ATOM 0 HG2 MET A 171 -2.721 -6.506 2.820 1.00 0.00 H new ATOM 0 HG3 MET A 171 -3.747 -5.233 2.189 1.00 0.00 H new ATOM 0 HE1 MET A 171 -4.969 -4.681 5.473 1.00 0.00 H new ATOM 0 HE2 MET A 171 -4.229 -4.170 3.937 1.00 0.00 H new ATOM 0 HE3 MET A 171 -5.992 -4.386 4.046 1.00 0.00 H new ATOM 250 N SER A 172 -4.114 -9.377 -0.393 1.00 0.00 N ATOM 251 CA SER A 172 -4.310 -10.758 -0.812 1.00 0.00 C ATOM 252 C SER A 172 -3.028 -11.272 -1.454 1.00 0.00 C ATOM 253 O SER A 172 -2.713 -12.461 -1.387 1.00 0.00 O ATOM 254 CB SER A 172 -5.476 -10.861 -1.798 1.00 0.00 C ATOM 255 OG SER A 172 -6.709 -11.007 -1.117 1.00 0.00 O ATOM 0 H SER A 172 -4.929 -8.777 -0.519 1.00 0.00 H new ATOM 0 HA SER A 172 -4.550 -11.367 0.060 1.00 0.00 H new ATOM 0 HB2 SER A 172 -5.506 -9.969 -2.424 1.00 0.00 H new ATOM 0 HB3 SER A 172 -5.321 -11.712 -2.462 1.00 0.00 H new ATOM 0 HG SER A 172 -7.438 -11.069 -1.769 1.00 0.00 H new ATOM 261 N MET A 173 -2.284 -10.347 -2.063 1.00 0.00 N ATOM 262 CA MET A 173 -1.025 -10.659 -2.706 1.00 0.00 C ATOM 263 C MET A 173 0.117 -10.783 -1.690 1.00 0.00 C ATOM 264 O MET A 173 1.241 -10.360 -1.960 1.00 0.00 O ATOM 265 CB MET A 173 -0.706 -9.549 -3.698 1.00 0.00 C ATOM 266 CG MET A 173 -1.098 -9.890 -5.113 1.00 0.00 C ATOM 267 SD MET A 173 0.079 -9.279 -6.329 1.00 0.00 S ATOM 268 CE MET A 173 0.181 -7.558 -5.845 1.00 0.00 C ATOM 0 H MET A 173 -2.545 -9.363 -2.119 1.00 0.00 H new ATOM 0 HA MET A 173 -1.119 -11.620 -3.212 1.00 0.00 H new ATOM 0 HB2 MET A 173 -1.222 -8.639 -3.394 1.00 0.00 H new ATOM 0 HB3 MET A 173 0.362 -9.336 -3.665 1.00 0.00 H new ATOM 0 HG2 MET A 173 -1.185 -10.972 -5.210 1.00 0.00 H new ATOM 0 HG3 MET A 173 -2.082 -9.471 -5.324 1.00 0.00 H new ATOM 0 HE1 MET A 173 0.888 -7.039 -6.493 1.00 0.00 H new ATOM 0 HE2 MET A 173 -0.802 -7.096 -5.936 1.00 0.00 H new ATOM 0 HE3 MET A 173 0.519 -7.490 -4.811 1.00 0.00 H new ATOM 278 N GLY A 174 -0.171 -11.360 -0.526 1.00 0.00 N ATOM 279 CA GLY A 174 0.850 -11.519 0.494 1.00 0.00 C ATOM 280 C GLY A 174 1.531 -10.211 0.843 1.00 0.00 C ATOM 281 O GLY A 174 2.760 -10.134 0.875 1.00 0.00 O ATOM 0 H GLY A 174 -1.091 -11.719 -0.272 1.00 0.00 H new ATOM 0 HA2 GLY A 174 0.399 -11.941 1.392 1.00 0.00 H new ATOM 0 HA3 GLY A 174 1.597 -12.233 0.147 1.00 0.00 H new ATOM 285 N TYR A 175 0.734 -9.177 1.097 1.00 0.00 N ATOM 286 CA TYR A 175 1.271 -7.867 1.435 1.00 0.00 C ATOM 287 C TYR A 175 0.387 -7.136 2.446 1.00 0.00 C ATOM 288 O TYR A 175 -0.481 -6.349 2.075 1.00 0.00 O ATOM 289 CB TYR A 175 1.422 -7.029 0.170 1.00 0.00 C ATOM 290 CG TYR A 175 2.276 -7.696 -0.891 1.00 0.00 C ATOM 291 CD1 TYR A 175 3.547 -8.168 -0.585 1.00 0.00 C ATOM 292 CD2 TYR A 175 1.815 -7.864 -2.195 1.00 0.00 C ATOM 293 CE1 TYR A 175 4.332 -8.784 -1.539 1.00 0.00 C ATOM 294 CE2 TYR A 175 2.597 -8.479 -3.155 1.00 0.00 C ATOM 295 CZ TYR A 175 3.854 -8.936 -2.822 1.00 0.00 C ATOM 296 OH TYR A 175 4.634 -9.550 -3.775 1.00 0.00 O ATOM 0 H TYR A 175 -0.285 -9.223 1.075 1.00 0.00 H new ATOM 0 HA TYR A 175 2.248 -8.014 1.896 1.00 0.00 H new ATOM 0 HB2 TYR A 175 0.434 -6.826 -0.243 1.00 0.00 H new ATOM 0 HB3 TYR A 175 1.863 -6.067 0.430 1.00 0.00 H new ATOM 0 HD1 TYR A 175 3.928 -8.051 0.419 1.00 0.00 H new ATOM 0 HD2 TYR A 175 0.830 -7.508 -2.460 1.00 0.00 H new ATOM 0 HE1 TYR A 175 5.316 -9.145 -1.281 1.00 0.00 H new ATOM 0 HE2 TYR A 175 2.225 -8.601 -4.161 1.00 0.00 H new ATOM 0 HH TYR A 175 4.149 -9.578 -4.626 1.00 0.00 H new ATOM 306 N GLU A 176 0.622 -7.404 3.725 1.00 0.00 N ATOM 307 CA GLU A 176 -0.146 -6.779 4.801 1.00 0.00 C ATOM 308 C GLU A 176 -0.488 -5.328 4.475 1.00 0.00 C ATOM 309 O GLU A 176 0.196 -4.675 3.690 1.00 0.00 O ATOM 310 CB GLU A 176 0.620 -6.844 6.125 1.00 0.00 C ATOM 311 CG GLU A 176 2.052 -7.339 5.997 1.00 0.00 C ATOM 312 CD GLU A 176 2.153 -8.849 6.053 1.00 0.00 C ATOM 313 OE1 GLU A 176 1.910 -9.421 7.136 1.00 0.00 O ATOM 314 OE2 GLU A 176 2.476 -9.463 5.015 1.00 0.00 O ATOM 0 H GLU A 176 1.341 -8.053 4.046 1.00 0.00 H new ATOM 0 HA GLU A 176 -1.077 -7.338 4.899 1.00 0.00 H new ATOM 0 HB2 GLU A 176 0.630 -5.851 6.574 1.00 0.00 H new ATOM 0 HB3 GLU A 176 0.082 -7.498 6.811 1.00 0.00 H new ATOM 0 HG2 GLU A 176 2.472 -6.985 5.056 1.00 0.00 H new ATOM 0 HG3 GLU A 176 2.654 -6.908 6.797 1.00 0.00 H new ATOM 321 N ARG A 177 -1.559 -4.843 5.091 1.00 0.00 N ATOM 322 CA ARG A 177 -2.029 -3.476 4.889 1.00 0.00 C ATOM 323 C ARG A 177 -0.924 -2.454 5.113 1.00 0.00 C ATOM 324 O ARG A 177 -0.933 -1.388 4.521 1.00 0.00 O ATOM 325 CB ARG A 177 -3.204 -3.190 5.840 1.00 0.00 C ATOM 326 CG ARG A 177 -2.935 -2.118 6.895 1.00 0.00 C ATOM 327 CD ARG A 177 -3.805 -2.317 8.126 1.00 0.00 C ATOM 328 NE ARG A 177 -4.952 -3.178 7.854 1.00 0.00 N ATOM 329 CZ ARG A 177 -5.925 -2.862 7.004 1.00 0.00 C ATOM 330 NH1 ARG A 177 -5.889 -1.708 6.353 1.00 0.00 N ATOM 331 NH2 ARG A 177 -6.934 -3.699 6.810 1.00 0.00 N ATOM 0 H ARG A 177 -2.126 -5.384 5.744 1.00 0.00 H new ATOM 0 HA ARG A 177 -2.355 -3.385 3.853 1.00 0.00 H new ATOM 0 HB2 ARG A 177 -4.066 -2.886 5.247 1.00 0.00 H new ATOM 0 HB3 ARG A 177 -3.476 -4.116 6.346 1.00 0.00 H new ATOM 0 HG2 ARG A 177 -1.884 -2.145 7.183 1.00 0.00 H new ATOM 0 HG3 ARG A 177 -3.124 -1.132 6.470 1.00 0.00 H new ATOM 0 HD2 ARG A 177 -3.206 -2.753 8.926 1.00 0.00 H new ATOM 0 HD3 ARG A 177 -4.156 -1.348 8.482 1.00 0.00 H new ATOM 0 HE ARG A 177 -5.011 -4.071 8.343 1.00 0.00 H new ATOM 0 HH11 ARG A 177 -5.115 -1.061 6.504 1.00 0.00 H new ATOM 0 HH12 ARG A 177 -6.636 -1.467 5.701 1.00 0.00 H new ATOM 0 HH21 ARG A 177 -6.965 -4.586 7.313 1.00 0.00 H new ATOM 0 HH22 ARG A 177 -7.680 -3.456 6.158 1.00 0.00 H new ATOM 345 N GLU A 178 -0.017 -2.752 6.018 1.00 0.00 N ATOM 346 CA GLU A 178 1.038 -1.803 6.344 1.00 0.00 C ATOM 347 C GLU A 178 2.161 -1.762 5.312 1.00 0.00 C ATOM 348 O GLU A 178 2.746 -0.704 5.077 1.00 0.00 O ATOM 349 CB GLU A 178 1.612 -2.096 7.731 1.00 0.00 C ATOM 350 CG GLU A 178 2.883 -1.321 8.039 1.00 0.00 C ATOM 351 CD GLU A 178 3.523 -1.751 9.345 1.00 0.00 C ATOM 352 OE1 GLU A 178 3.600 -2.973 9.594 1.00 0.00 O ATOM 353 OE2 GLU A 178 3.946 -0.865 10.117 1.00 0.00 O ATOM 0 H GLU A 178 0.017 -3.629 6.537 1.00 0.00 H new ATOM 0 HA GLU A 178 0.571 -0.818 6.336 1.00 0.00 H new ATOM 0 HB2 GLU A 178 0.860 -1.859 8.484 1.00 0.00 H new ATOM 0 HB3 GLU A 178 1.818 -3.163 7.812 1.00 0.00 H new ATOM 0 HG2 GLU A 178 3.595 -1.460 7.226 1.00 0.00 H new ATOM 0 HG3 GLU A 178 2.654 -0.256 8.084 1.00 0.00 H new ATOM 360 N ARG A 179 2.477 -2.892 4.709 1.00 0.00 N ATOM 361 CA ARG A 179 3.537 -2.942 3.727 1.00 0.00 C ATOM 362 C ARG A 179 3.154 -2.212 2.459 1.00 0.00 C ATOM 363 O ARG A 179 3.972 -1.540 1.832 1.00 0.00 O ATOM 364 CB ARG A 179 3.857 -4.391 3.400 1.00 0.00 C ATOM 365 CG ARG A 179 4.429 -5.175 4.570 1.00 0.00 C ATOM 366 CD ARG A 179 4.774 -6.601 4.173 1.00 0.00 C ATOM 367 NE ARG A 179 4.984 -7.459 5.333 1.00 0.00 N ATOM 368 CZ ARG A 179 6.010 -7.332 6.167 1.00 0.00 C ATOM 369 NH1 ARG A 179 6.918 -6.387 5.965 1.00 0.00 N ATOM 370 NH2 ARG A 179 6.133 -8.152 7.201 1.00 0.00 N ATOM 0 H ARG A 179 2.015 -3.784 4.883 1.00 0.00 H new ATOM 0 HA ARG A 179 4.413 -2.449 4.150 1.00 0.00 H new ATOM 0 HB2 ARG A 179 2.949 -4.884 3.054 1.00 0.00 H new ATOM 0 HB3 ARG A 179 4.568 -4.418 2.575 1.00 0.00 H new ATOM 0 HG2 ARG A 179 5.323 -4.674 4.942 1.00 0.00 H new ATOM 0 HG3 ARG A 179 3.708 -5.189 5.387 1.00 0.00 H new ATOM 0 HD2 ARG A 179 3.971 -7.011 3.561 1.00 0.00 H new ATOM 0 HD3 ARG A 179 5.674 -6.598 3.558 1.00 0.00 H new ATOM 0 HE ARG A 179 4.305 -8.198 5.514 1.00 0.00 H new ATOM 0 HH11 ARG A 179 6.829 -5.756 5.168 1.00 0.00 H new ATOM 0 HH12 ARG A 179 7.705 -6.291 6.606 1.00 0.00 H new ATOM 0 HH21 ARG A 179 5.439 -8.883 7.358 1.00 0.00 H new ATOM 0 HH22 ARG A 179 6.922 -8.052 7.840 1.00 0.00 H new ATOM 384 N VAL A 180 1.906 -2.367 2.095 1.00 0.00 N ATOM 385 CA VAL A 180 1.369 -1.753 0.892 1.00 0.00 C ATOM 386 C VAL A 180 0.975 -0.319 1.142 1.00 0.00 C ATOM 387 O VAL A 180 1.336 0.549 0.362 1.00 0.00 O ATOM 388 CB VAL A 180 0.216 -2.594 0.329 1.00 0.00 C ATOM 389 CG1 VAL A 180 -0.489 -3.315 1.455 1.00 0.00 C ATOM 390 CG2 VAL A 180 -0.737 -1.764 -0.514 1.00 0.00 C ATOM 0 H VAL A 180 1.229 -2.921 2.619 1.00 0.00 H new ATOM 0 HA VAL A 180 2.150 -1.729 0.132 1.00 0.00 H new ATOM 0 HB VAL A 180 0.631 -3.343 -0.346 1.00 0.00 H new ATOM 0 HG11 VAL A 180 -1.307 -3.911 1.050 1.00 0.00 H new ATOM 0 HG12 VAL A 180 0.217 -3.969 1.967 1.00 0.00 H new ATOM 0 HG13 VAL A 180 -0.886 -2.586 2.161 1.00 0.00 H new ATOM 0 HG21 VAL A 180 -1.537 -2.400 -0.892 1.00 0.00 H new ATOM 0 HG22 VAL A 180 -1.164 -0.968 0.096 1.00 0.00 H new ATOM 0 HG23 VAL A 180 -0.195 -1.327 -1.352 1.00 0.00 H new ATOM 400 N VAL A 181 0.286 -0.052 2.242 1.00 0.00 N ATOM 401 CA VAL A 181 -0.081 1.318 2.560 1.00 0.00 C ATOM 402 C VAL A 181 1.180 2.139 2.695 1.00 0.00 C ATOM 403 O VAL A 181 1.254 3.277 2.236 1.00 0.00 O ATOM 404 CB VAL A 181 -0.927 1.424 3.844 1.00 0.00 C ATOM 405 CG1 VAL A 181 -0.064 1.652 5.068 1.00 0.00 C ATOM 406 CG2 VAL A 181 -1.930 2.534 3.723 1.00 0.00 C ATOM 0 H VAL A 181 -0.025 -0.751 2.917 1.00 0.00 H new ATOM 0 HA VAL A 181 -0.702 1.699 1.749 1.00 0.00 H new ATOM 0 HB VAL A 181 -1.448 0.474 3.966 1.00 0.00 H new ATOM 0 HG11 VAL A 181 -0.698 1.721 5.952 1.00 0.00 H new ATOM 0 HG12 VAL A 181 0.631 0.820 5.184 1.00 0.00 H new ATOM 0 HG13 VAL A 181 0.497 2.579 4.950 1.00 0.00 H new ATOM 0 HG21 VAL A 181 -2.518 2.594 4.639 1.00 0.00 H new ATOM 0 HG22 VAL A 181 -1.410 3.478 3.563 1.00 0.00 H new ATOM 0 HG23 VAL A 181 -2.591 2.337 2.879 1.00 0.00 H new ATOM 416 N ALA A 182 2.187 1.520 3.289 1.00 0.00 N ATOM 417 CA ALA A 182 3.483 2.154 3.437 1.00 0.00 C ATOM 418 C ALA A 182 4.086 2.247 2.055 1.00 0.00 C ATOM 419 O ALA A 182 4.826 3.179 1.740 1.00 0.00 O ATOM 420 CB ALA A 182 4.386 1.346 4.383 1.00 0.00 C ATOM 0 H ALA A 182 2.130 0.578 3.676 1.00 0.00 H new ATOM 0 HA ALA A 182 3.381 3.145 3.879 1.00 0.00 H new ATOM 0 HB1 ALA A 182 5.352 1.843 4.477 1.00 0.00 H new ATOM 0 HB2 ALA A 182 3.916 1.278 5.364 1.00 0.00 H new ATOM 0 HB3 ALA A 182 4.531 0.344 3.980 1.00 0.00 H new ATOM 426 N ALA A 183 3.705 1.290 1.212 1.00 0.00 N ATOM 427 CA ALA A 183 4.146 1.284 -0.167 1.00 0.00 C ATOM 428 C ALA A 183 3.363 2.339 -0.931 1.00 0.00 C ATOM 429 O ALA A 183 3.763 2.766 -2.005 1.00 0.00 O ATOM 430 CB ALA A 183 3.957 -0.084 -0.794 1.00 0.00 C ATOM 0 H ALA A 183 3.094 0.514 1.465 1.00 0.00 H new ATOM 0 HA ALA A 183 5.211 1.514 -0.208 1.00 0.00 H new ATOM 0 HB1 ALA A 183 4.296 -0.060 -1.830 1.00 0.00 H new ATOM 0 HB2 ALA A 183 4.537 -0.822 -0.239 1.00 0.00 H new ATOM 0 HB3 ALA A 183 2.902 -0.355 -0.764 1.00 0.00 H new ATOM 436 N LEU A 184 2.256 2.783 -0.327 1.00 0.00 N ATOM 437 CA LEU A 184 1.422 3.826 -0.898 1.00 0.00 C ATOM 438 C LEU A 184 2.023 5.161 -0.487 1.00 0.00 C ATOM 439 O LEU A 184 1.959 6.152 -1.203 1.00 0.00 O ATOM 440 CB LEU A 184 -0.023 3.718 -0.391 1.00 0.00 C ATOM 441 CG LEU A 184 -0.746 2.394 -0.688 1.00 0.00 C ATOM 442 CD1 LEU A 184 -2.099 2.341 0.007 1.00 0.00 C ATOM 443 CD2 LEU A 184 -0.920 2.219 -2.179 1.00 0.00 C ATOM 0 H LEU A 184 1.920 2.426 0.568 1.00 0.00 H new ATOM 0 HA LEU A 184 1.391 3.728 -1.983 1.00 0.00 H new ATOM 0 HB2 LEU A 184 -0.021 3.873 0.688 1.00 0.00 H new ATOM 0 HB3 LEU A 184 -0.602 4.531 -0.829 1.00 0.00 H new ATOM 0 HG LEU A 184 -0.134 1.579 -0.302 1.00 0.00 H new ATOM 0 HD11 LEU A 184 -2.588 1.394 -0.221 1.00 0.00 H new ATOM 0 HD12 LEU A 184 -1.958 2.427 1.084 1.00 0.00 H new ATOM 0 HD13 LEU A 184 -2.721 3.164 -0.344 1.00 0.00 H new ATOM 0 HD21 LEU A 184 -1.433 1.278 -2.377 1.00 0.00 H new ATOM 0 HD22 LEU A 184 -1.510 3.045 -2.576 1.00 0.00 H new ATOM 0 HD23 LEU A 184 0.058 2.208 -2.661 1.00 0.00 H new ATOM 455 N ARG A 185 2.660 5.157 0.670 1.00 0.00 N ATOM 456 CA ARG A 185 3.336 6.339 1.160 1.00 0.00 C ATOM 457 C ARG A 185 4.678 6.435 0.455 1.00 0.00 C ATOM 458 O ARG A 185 5.270 7.509 0.346 1.00 0.00 O ATOM 459 CB ARG A 185 3.546 6.272 2.674 1.00 0.00 C ATOM 460 CG ARG A 185 2.280 5.983 3.456 1.00 0.00 C ATOM 461 CD ARG A 185 2.569 5.821 4.940 1.00 0.00 C ATOM 462 NE ARG A 185 1.461 6.286 5.767 1.00 0.00 N ATOM 463 CZ ARG A 185 1.596 6.650 7.039 1.00 0.00 C ATOM 464 NH1 ARG A 185 2.786 6.604 7.621 1.00 0.00 N ATOM 465 NH2 ARG A 185 0.541 7.062 7.729 1.00 0.00 N ATOM 0 H ARG A 185 2.722 4.347 1.286 1.00 0.00 H new ATOM 0 HA ARG A 185 2.726 7.218 0.954 1.00 0.00 H new ATOM 0 HB2 ARG A 185 4.283 5.500 2.895 1.00 0.00 H new ATOM 0 HB3 ARG A 185 3.964 7.219 3.015 1.00 0.00 H new ATOM 0 HG2 ARG A 185 1.567 6.794 3.309 1.00 0.00 H new ATOM 0 HG3 ARG A 185 1.814 5.075 3.073 1.00 0.00 H new ATOM 0 HD2 ARG A 185 2.768 4.772 5.158 1.00 0.00 H new ATOM 0 HD3 ARG A 185 3.471 6.377 5.196 1.00 0.00 H new ATOM 0 HE ARG A 185 0.533 6.335 5.347 1.00 0.00 H new ATOM 0 HH11 ARG A 185 3.600 6.289 7.093 1.00 0.00 H new ATOM 0 HH12 ARG A 185 2.888 6.884 8.597 1.00 0.00 H new ATOM 0 HH21 ARG A 185 -0.376 7.100 7.284 1.00 0.00 H new ATOM 0 HH22 ARG A 185 0.647 7.341 8.704 1.00 0.00 H new ATOM 479 N ALA A 186 5.147 5.281 -0.025 1.00 0.00 N ATOM 480 CA ALA A 186 6.419 5.200 -0.725 1.00 0.00 C ATOM 481 C ALA A 186 6.229 5.092 -2.241 1.00 0.00 C ATOM 482 O ALA A 186 7.185 5.238 -3.001 1.00 0.00 O ATOM 483 CB ALA A 186 7.219 4.018 -0.205 1.00 0.00 C ATOM 0 H ALA A 186 4.658 4.390 0.062 1.00 0.00 H new ATOM 0 HA ALA A 186 6.968 6.122 -0.532 1.00 0.00 H new ATOM 0 HB1 ALA A 186 8.171 3.962 -0.733 1.00 0.00 H new ATOM 0 HB2 ALA A 186 7.403 4.144 0.862 1.00 0.00 H new ATOM 0 HB3 ALA A 186 6.658 3.098 -0.370 1.00 0.00 H new ATOM 489 N SER A 187 4.994 4.847 -2.680 1.00 0.00 N ATOM 490 CA SER A 187 4.705 4.737 -4.110 1.00 0.00 C ATOM 491 C SER A 187 3.953 5.975 -4.595 1.00 0.00 C ATOM 492 O SER A 187 3.967 6.286 -5.783 1.00 0.00 O ATOM 493 CB SER A 187 3.903 3.464 -4.428 1.00 0.00 C ATOM 494 OG SER A 187 4.653 2.304 -4.114 1.00 0.00 O ATOM 0 H SER A 187 4.184 4.722 -2.072 1.00 0.00 H new ATOM 0 HA SER A 187 5.656 4.670 -4.638 1.00 0.00 H new ATOM 0 HB2 SER A 187 2.972 3.465 -3.861 1.00 0.00 H new ATOM 0 HB3 SER A 187 3.633 3.453 -5.484 1.00 0.00 H new ATOM 0 HG SER A 187 4.656 2.169 -3.143 1.00 0.00 H new ATOM 500 N TYR A 188 3.319 6.676 -3.645 1.00 0.00 N ATOM 501 CA TYR A 188 2.562 7.907 -3.923 1.00 0.00 C ATOM 502 C TYR A 188 1.048 7.680 -3.869 1.00 0.00 C ATOM 503 O TYR A 188 0.285 8.522 -4.342 1.00 0.00 O ATOM 504 CB TYR A 188 2.946 8.506 -5.279 1.00 0.00 C ATOM 505 CG TYR A 188 2.373 9.890 -5.521 1.00 0.00 C ATOM 506 CD1 TYR A 188 2.014 10.715 -4.459 1.00 0.00 C ATOM 507 CD2 TYR A 188 2.190 10.377 -6.812 1.00 0.00 C ATOM 508 CE1 TYR A 188 1.492 11.976 -4.677 1.00 0.00 C ATOM 509 CE2 TYR A 188 1.670 11.636 -7.035 1.00 0.00 C ATOM 510 CZ TYR A 188 1.323 12.432 -5.965 1.00 0.00 C ATOM 511 OH TYR A 188 0.803 13.687 -6.183 1.00 0.00 O ATOM 0 H TYR A 188 3.316 6.406 -2.661 1.00 0.00 H new ATOM 0 HA TYR A 188 2.828 8.613 -3.136 1.00 0.00 H new ATOM 0 HB2 TYR A 188 4.033 8.555 -5.349 1.00 0.00 H new ATOM 0 HB3 TYR A 188 2.605 7.838 -6.070 1.00 0.00 H new ATOM 0 HD1 TYR A 188 2.146 10.363 -3.446 1.00 0.00 H new ATOM 0 HD2 TYR A 188 2.460 9.758 -7.655 1.00 0.00 H new ATOM 0 HE1 TYR A 188 1.218 12.601 -3.840 1.00 0.00 H new ATOM 0 HE2 TYR A 188 1.536 11.996 -8.044 1.00 0.00 H new ATOM 0 HH TYR A 188 0.750 13.856 -7.147 1.00 0.00 H new ATOM 521 N ASN A 189 0.630 6.546 -3.298 1.00 0.00 N ATOM 522 CA ASN A 189 -0.784 6.188 -3.177 1.00 0.00 C ATOM 523 C ASN A 189 -1.133 5.130 -4.196 1.00 0.00 C ATOM 524 O ASN A 189 -2.093 4.379 -4.034 1.00 0.00 O ATOM 525 CB ASN A 189 -1.702 7.398 -3.347 1.00 0.00 C ATOM 526 CG ASN A 189 -3.146 7.080 -3.014 1.00 0.00 C ATOM 527 OD1 ASN A 189 -3.744 6.173 -3.592 1.00 0.00 O ATOM 528 ND2 ASN A 189 -3.715 7.829 -2.077 1.00 0.00 N ATOM 0 H ASN A 189 1.265 5.850 -2.906 1.00 0.00 H new ATOM 0 HA ASN A 189 -0.940 5.799 -2.171 1.00 0.00 H new ATOM 0 HB2 ASN A 189 -1.354 8.207 -2.705 1.00 0.00 H new ATOM 0 HB3 ASN A 189 -1.640 7.756 -4.375 1.00 0.00 H new ATOM 0 HD21 ASN A 189 -4.685 7.663 -1.811 1.00 0.00 H new ATOM 0 HD22 ASN A 189 -3.182 8.571 -1.623 1.00 0.00 H new ATOM 535 N ASN A 190 -0.330 5.062 -5.244 1.00 0.00 N ATOM 536 CA ASN A 190 -0.543 4.073 -6.280 1.00 0.00 C ATOM 537 C ASN A 190 -0.529 2.689 -5.658 1.00 0.00 C ATOM 538 O ASN A 190 0.178 2.455 -4.685 1.00 0.00 O ATOM 539 CB ASN A 190 0.538 4.133 -7.346 1.00 0.00 C ATOM 540 CG ASN A 190 1.118 5.515 -7.544 1.00 0.00 C ATOM 541 OD1 ASN A 190 1.879 6.011 -6.718 1.00 0.00 O ATOM 542 ND2 ASN A 190 0.764 6.142 -8.655 1.00 0.00 N ATOM 0 H ASN A 190 0.470 5.677 -5.397 1.00 0.00 H new ATOM 0 HA ASN A 190 -1.504 4.283 -6.749 1.00 0.00 H new ATOM 0 HB2 ASN A 190 1.341 3.447 -7.076 1.00 0.00 H new ATOM 0 HB3 ASN A 190 0.124 3.783 -8.292 1.00 0.00 H new ATOM 0 HD21 ASN A 190 1.127 7.075 -8.852 1.00 0.00 H new ATOM 0 HD22 ASN A 190 0.129 5.692 -9.314 1.00 0.00 H new ATOM 549 N PRO A 191 -1.308 1.759 -6.207 1.00 0.00 N ATOM 550 CA PRO A 191 -1.407 0.392 -5.719 1.00 0.00 C ATOM 551 C PRO A 191 -0.429 -0.524 -6.424 1.00 0.00 C ATOM 552 O PRO A 191 0.490 -1.065 -5.820 1.00 0.00 O ATOM 553 CB PRO A 191 -2.820 -0.008 -6.114 1.00 0.00 C ATOM 554 CG PRO A 191 -3.375 1.161 -6.877 1.00 0.00 C ATOM 555 CD PRO A 191 -2.184 1.939 -7.345 1.00 0.00 C ATOM 0 HA PRO A 191 -1.191 0.320 -4.653 1.00 0.00 H new ATOM 0 HB2 PRO A 191 -2.815 -0.909 -6.727 1.00 0.00 H new ATOM 0 HB3 PRO A 191 -3.426 -0.225 -5.234 1.00 0.00 H new ATOM 0 HG2 PRO A 191 -3.981 0.827 -7.719 1.00 0.00 H new ATOM 0 HG3 PRO A 191 -4.018 1.772 -6.244 1.00 0.00 H new ATOM 0 HD2 PRO A 191 -1.760 1.539 -8.266 1.00 0.00 H new ATOM 0 HD3 PRO A 191 -2.417 2.987 -7.531 1.00 0.00 H new ATOM 563 N HIS A 192 -0.653 -0.691 -7.722 1.00 0.00 N ATOM 564 CA HIS A 192 0.196 -1.530 -8.537 1.00 0.00 C ATOM 565 C HIS A 192 1.653 -1.220 -8.241 1.00 0.00 C ATOM 566 O HIS A 192 2.446 -2.121 -7.981 1.00 0.00 O ATOM 567 CB HIS A 192 -0.108 -1.299 -10.018 1.00 0.00 C ATOM 568 CG HIS A 192 0.390 -2.393 -10.910 1.00 0.00 C ATOM 569 ND1 HIS A 192 0.048 -2.490 -12.242 1.00 0.00 N ATOM 570 CD2 HIS A 192 1.210 -3.442 -10.658 1.00 0.00 C ATOM 571 CE1 HIS A 192 0.636 -3.550 -12.769 1.00 0.00 C ATOM 572 NE2 HIS A 192 1.347 -4.144 -11.829 1.00 0.00 N ATOM 0 H HIS A 192 -1.421 -0.251 -8.228 1.00 0.00 H new ATOM 0 HA HIS A 192 0.002 -2.577 -8.303 1.00 0.00 H new ATOM 0 HB2 HIS A 192 -1.186 -1.198 -10.148 1.00 0.00 H new ATOM 0 HB3 HIS A 192 0.340 -0.355 -10.329 1.00 0.00 H new ATOM 0 HD2 HIS A 192 1.670 -3.681 -9.711 1.00 0.00 H new ATOM 0 HE1 HIS A 192 0.549 -3.875 -13.795 1.00 0.00 H new ATOM 0 HE2 HIS A 192 1.907 -4.987 -11.953 1.00 0.00 H new ATOM 580 N ARG A 193 1.989 0.068 -8.248 1.00 0.00 N ATOM 581 CA ARG A 193 3.343 0.499 -7.936 1.00 0.00 C ATOM 582 C ARG A 193 3.616 0.195 -6.478 1.00 0.00 C ATOM 583 O ARG A 193 4.732 -0.137 -6.091 1.00 0.00 O ATOM 584 CB ARG A 193 3.509 1.998 -8.197 1.00 0.00 C ATOM 585 CG ARG A 193 4.774 2.589 -7.597 1.00 0.00 C ATOM 586 CD ARG A 193 5.808 2.902 -8.664 1.00 0.00 C ATOM 587 NE ARG A 193 6.379 1.691 -9.246 1.00 0.00 N ATOM 588 CZ ARG A 193 7.351 1.695 -10.152 1.00 0.00 C ATOM 589 NH1 ARG A 193 7.856 2.845 -10.578 1.00 0.00 N ATOM 590 NH2 ARG A 193 7.818 0.552 -10.632 1.00 0.00 N ATOM 0 H ARG A 193 1.343 0.826 -8.466 1.00 0.00 H new ATOM 0 HA ARG A 193 4.050 -0.032 -8.573 1.00 0.00 H new ATOM 0 HB2 ARG A 193 3.513 2.172 -9.273 1.00 0.00 H new ATOM 0 HB3 ARG A 193 2.645 2.526 -7.792 1.00 0.00 H new ATOM 0 HG2 ARG A 193 4.527 3.500 -7.051 1.00 0.00 H new ATOM 0 HG3 ARG A 193 5.196 1.889 -6.875 1.00 0.00 H new ATOM 0 HD2 ARG A 193 5.347 3.500 -9.451 1.00 0.00 H new ATOM 0 HD3 ARG A 193 6.605 3.506 -8.230 1.00 0.00 H new ATOM 0 HE ARG A 193 6.011 0.790 -8.940 1.00 0.00 H new ATOM 0 HH11 ARG A 193 7.498 3.727 -10.210 1.00 0.00 H new ATOM 0 HH12 ARG A 193 8.602 2.848 -11.273 1.00 0.00 H new ATOM 0 HH21 ARG A 193 7.431 -0.334 -10.306 1.00 0.00 H new ATOM 0 HH22 ARG A 193 8.564 0.558 -11.327 1.00 0.00 H new ATOM 604 N ALA A 194 2.557 0.304 -5.681 1.00 0.00 N ATOM 605 CA ALA A 194 2.617 0.035 -4.251 1.00 0.00 C ATOM 606 C ALA A 194 3.147 -1.362 -3.978 1.00 0.00 C ATOM 607 O ALA A 194 3.828 -1.595 -2.979 1.00 0.00 O ATOM 608 CB ALA A 194 1.230 0.172 -3.645 1.00 0.00 C ATOM 0 H ALA A 194 1.633 0.582 -6.011 1.00 0.00 H new ATOM 0 HA ALA A 194 3.295 0.758 -3.799 1.00 0.00 H new ATOM 0 HB1 ALA A 194 1.279 -0.030 -2.575 1.00 0.00 H new ATOM 0 HB2 ALA A 194 0.861 1.185 -3.807 1.00 0.00 H new ATOM 0 HB3 ALA A 194 0.554 -0.540 -4.118 1.00 0.00 H new ATOM 614 N VAL A 195 2.814 -2.293 -4.861 1.00 0.00 N ATOM 615 CA VAL A 195 3.236 -3.666 -4.700 1.00 0.00 C ATOM 616 C VAL A 195 4.542 -3.923 -5.405 1.00 0.00 C ATOM 617 O VAL A 195 5.396 -4.648 -4.908 1.00 0.00 O ATOM 618 CB VAL A 195 2.150 -4.635 -5.169 1.00 0.00 C ATOM 619 CG1 VAL A 195 1.821 -4.453 -6.619 1.00 0.00 C ATOM 620 CG2 VAL A 195 2.537 -6.071 -4.860 1.00 0.00 C ATOM 0 H VAL A 195 2.253 -2.117 -5.694 1.00 0.00 H new ATOM 0 HA VAL A 195 3.398 -3.841 -3.636 1.00 0.00 H new ATOM 0 HB VAL A 195 1.242 -4.403 -4.611 1.00 0.00 H new ATOM 0 HG11 VAL A 195 1.045 -5.162 -6.908 1.00 0.00 H new ATOM 0 HG12 VAL A 195 1.464 -3.437 -6.786 1.00 0.00 H new ATOM 0 HG13 VAL A 195 2.714 -4.628 -7.219 1.00 0.00 H new ATOM 0 HG21 VAL A 195 1.749 -6.742 -5.203 1.00 0.00 H new ATOM 0 HG22 VAL A 195 3.469 -6.315 -5.371 1.00 0.00 H new ATOM 0 HG23 VAL A 195 2.671 -6.188 -3.785 1.00 0.00 H new ATOM 630 N GLU A 196 4.735 -3.250 -6.511 1.00 0.00 N ATOM 631 CA GLU A 196 6.012 -3.340 -7.199 1.00 0.00 C ATOM 632 C GLU A 196 7.040 -2.789 -6.221 1.00 0.00 C ATOM 633 O GLU A 196 8.233 -3.097 -6.282 1.00 0.00 O ATOM 634 CB GLU A 196 6.002 -2.530 -8.499 1.00 0.00 C ATOM 635 CG GLU A 196 6.556 -3.290 -9.692 1.00 0.00 C ATOM 636 CD GLU A 196 6.392 -2.532 -10.992 1.00 0.00 C ATOM 637 OE1 GLU A 196 5.664 -1.514 -11.000 1.00 0.00 O ATOM 638 OE2 GLU A 196 6.987 -2.954 -12.006 1.00 0.00 O ATOM 0 H GLU A 196 4.044 -2.643 -6.953 1.00 0.00 H new ATOM 0 HA GLU A 196 6.238 -4.367 -7.487 1.00 0.00 H new ATOM 0 HB2 GLU A 196 4.980 -2.222 -8.718 1.00 0.00 H new ATOM 0 HB3 GLU A 196 6.585 -1.620 -8.355 1.00 0.00 H new ATOM 0 HG2 GLU A 196 7.613 -3.497 -9.527 1.00 0.00 H new ATOM 0 HG3 GLU A 196 6.051 -4.253 -9.771 1.00 0.00 H new ATOM 645 N TYR A 197 6.515 -2.003 -5.276 1.00 0.00 N ATOM 646 CA TYR A 197 7.281 -1.415 -4.206 1.00 0.00 C ATOM 647 C TYR A 197 7.486 -2.477 -3.146 1.00 0.00 C ATOM 648 O TYR A 197 8.596 -2.706 -2.664 1.00 0.00 O ATOM 649 CB TYR A 197 6.500 -0.239 -3.632 1.00 0.00 C ATOM 650 CG TYR A 197 7.373 0.863 -3.117 1.00 0.00 C ATOM 651 CD1 TYR A 197 7.966 0.780 -1.869 1.00 0.00 C ATOM 652 CD2 TYR A 197 7.597 1.984 -3.892 1.00 0.00 C ATOM 653 CE1 TYR A 197 8.776 1.812 -1.400 1.00 0.00 C ATOM 654 CE2 TYR A 197 8.403 3.019 -3.438 1.00 0.00 C ATOM 655 CZ TYR A 197 8.988 2.925 -2.190 1.00 0.00 C ATOM 656 OH TYR A 197 9.788 3.946 -1.734 1.00 0.00 O ATOM 0 H TYR A 197 5.525 -1.761 -5.245 1.00 0.00 H new ATOM 0 HA TYR A 197 8.247 -1.056 -4.561 1.00 0.00 H new ATOM 0 HB2 TYR A 197 5.841 0.160 -4.403 1.00 0.00 H new ATOM 0 HB3 TYR A 197 5.864 -0.596 -2.822 1.00 0.00 H new ATOM 0 HD1 TYR A 197 7.799 -0.092 -1.254 1.00 0.00 H new ATOM 0 HD2 TYR A 197 7.138 2.057 -4.867 1.00 0.00 H new ATOM 0 HE1 TYR A 197 9.235 1.742 -0.425 1.00 0.00 H new ATOM 0 HE2 TYR A 197 8.571 3.890 -4.055 1.00 0.00 H new ATOM 0 HH TYR A 197 9.834 4.653 -2.411 1.00 0.00 H new ATOM 666 N LEU A 198 6.388 -3.158 -2.837 1.00 0.00 N ATOM 667 CA LEU A 198 6.399 -4.251 -1.889 1.00 0.00 C ATOM 668 C LEU A 198 7.550 -5.182 -2.242 1.00 0.00 C ATOM 669 O LEU A 198 8.157 -5.825 -1.386 1.00 0.00 O ATOM 670 CB LEU A 198 5.087 -5.018 -2.017 1.00 0.00 C ATOM 671 CG LEU A 198 4.000 -4.760 -0.967 1.00 0.00 C ATOM 672 CD1 LEU A 198 4.375 -3.642 -0.026 1.00 0.00 C ATOM 673 CD2 LEU A 198 2.689 -4.438 -1.649 1.00 0.00 C ATOM 0 H LEU A 198 5.471 -2.964 -3.239 1.00 0.00 H new ATOM 0 HA LEU A 198 6.516 -3.875 -0.873 1.00 0.00 H new ATOM 0 HB2 LEU A 198 4.664 -4.797 -2.997 1.00 0.00 H new ATOM 0 HB3 LEU A 198 5.319 -6.083 -2.003 1.00 0.00 H new ATOM 0 HG LEU A 198 3.895 -5.669 -0.375 1.00 0.00 H new ATOM 0 HD11 LEU A 198 3.576 -3.494 0.700 1.00 0.00 H new ATOM 0 HD12 LEU A 198 5.297 -3.899 0.496 1.00 0.00 H new ATOM 0 HD13 LEU A 198 4.524 -2.723 -0.593 1.00 0.00 H new ATOM 0 HD21 LEU A 198 1.922 -4.256 -0.896 1.00 0.00 H new ATOM 0 HD22 LEU A 198 2.809 -3.548 -2.267 1.00 0.00 H new ATOM 0 HD23 LEU A 198 2.389 -5.277 -2.276 1.00 0.00 H new ATOM 685 N LEU A 199 7.815 -5.236 -3.543 1.00 0.00 N ATOM 686 CA LEU A 199 8.861 -6.063 -4.112 1.00 0.00 C ATOM 687 C LEU A 199 10.242 -5.494 -3.809 1.00 0.00 C ATOM 688 O LEU A 199 11.028 -6.099 -3.080 1.00 0.00 O ATOM 689 CB LEU A 199 8.647 -6.142 -5.627 1.00 0.00 C ATOM 690 CG LEU A 199 7.588 -7.148 -6.102 1.00 0.00 C ATOM 691 CD1 LEU A 199 8.170 -8.060 -7.165 1.00 0.00 C ATOM 692 CD2 LEU A 199 7.038 -7.967 -4.942 1.00 0.00 C ATOM 0 H LEU A 199 7.299 -4.697 -4.238 1.00 0.00 H new ATOM 0 HA LEU A 199 8.811 -7.058 -3.669 1.00 0.00 H new ATOM 0 HB2 LEU A 199 8.368 -5.152 -5.987 1.00 0.00 H new ATOM 0 HB3 LEU A 199 9.598 -6.395 -6.096 1.00 0.00 H new ATOM 0 HG LEU A 199 6.760 -6.585 -6.533 1.00 0.00 H new ATOM 0 HD11 LEU A 199 7.409 -8.768 -7.493 1.00 0.00 H new ATOM 0 HD12 LEU A 199 8.501 -7.463 -8.015 1.00 0.00 H new ATOM 0 HD13 LEU A 199 9.019 -8.605 -6.752 1.00 0.00 H new ATOM 0 HD21 LEU A 199 6.291 -8.669 -5.314 1.00 0.00 H new ATOM 0 HD22 LEU A 199 7.850 -8.519 -4.469 1.00 0.00 H new ATOM 0 HD23 LEU A 199 6.578 -7.301 -4.212 1.00 0.00 H new ATOM 704 N THR A 200 10.526 -4.327 -4.377 1.00 0.00 N ATOM 705 CA THR A 200 11.813 -3.670 -4.172 1.00 0.00 C ATOM 706 C THR A 200 12.336 -3.920 -2.762 1.00 0.00 C ATOM 707 O THR A 200 13.468 -4.370 -2.580 1.00 0.00 O ATOM 708 CB THR A 200 11.686 -2.167 -4.423 1.00 0.00 C ATOM 709 OG1 THR A 200 11.244 -1.499 -3.253 1.00 0.00 O ATOM 710 CG2 THR A 200 10.720 -1.829 -5.534 1.00 0.00 C ATOM 0 H THR A 200 9.883 -3.816 -4.983 1.00 0.00 H new ATOM 0 HA THR A 200 12.525 -4.092 -4.882 1.00 0.00 H new ATOM 0 HB THR A 200 12.683 -1.836 -4.714 1.00 0.00 H new ATOM 0 HG1 THR A 200 10.311 -1.737 -3.073 1.00 0.00 H new ATOM 0 HG21 THR A 200 10.676 -0.747 -5.661 1.00 0.00 H new ATOM 0 HG22 THR A 200 11.057 -2.290 -6.462 1.00 0.00 H new ATOM 0 HG23 THR A 200 9.729 -2.205 -5.281 1.00 0.00 H new ATOM 718 N GLY A 201 11.503 -3.630 -1.770 1.00 0.00 N ATOM 719 CA GLY A 201 11.902 -3.839 -0.389 1.00 0.00 C ATOM 720 C GLY A 201 11.759 -2.591 0.459 1.00 0.00 C ATOM 721 O GLY A 201 12.435 -2.446 1.477 1.00 0.00 O ATOM 0 H GLY A 201 10.562 -3.256 -1.895 1.00 0.00 H new ATOM 0 HA2 GLY A 201 11.298 -4.637 0.042 1.00 0.00 H new ATOM 0 HA3 GLY A 201 12.939 -4.174 -0.362 1.00 0.00 H new ATOM 725 N ILE A 202 10.873 -1.694 0.041 1.00 0.00 N ATOM 726 CA ILE A 202 10.630 -0.454 0.762 1.00 0.00 C ATOM 727 C ILE A 202 11.897 0.048 1.448 1.00 0.00 C ATOM 728 O ILE A 202 12.224 -0.374 2.557 1.00 0.00 O ATOM 729 CB ILE A 202 9.523 -0.634 1.812 1.00 0.00 C ATOM 730 CG1 ILE A 202 8.207 -1.027 1.138 1.00 0.00 C ATOM 731 CG2 ILE A 202 9.352 0.639 2.620 1.00 0.00 C ATOM 732 CD1 ILE A 202 7.140 -1.481 2.111 1.00 0.00 C ATOM 0 H ILE A 202 10.308 -1.806 -0.801 1.00 0.00 H new ATOM 0 HA ILE A 202 10.311 0.285 0.027 1.00 0.00 H new ATOM 0 HB ILE A 202 9.813 -1.436 2.491 1.00 0.00 H new ATOM 0 HG12 ILE A 202 7.831 -0.176 0.570 1.00 0.00 H new ATOM 0 HG13 ILE A 202 8.399 -1.827 0.423 1.00 0.00 H new ATOM 0 HG21 ILE A 202 8.564 0.497 3.360 1.00 0.00 H new ATOM 0 HG22 ILE A 202 10.287 0.877 3.127 1.00 0.00 H new ATOM 0 HG23 ILE A 202 9.081 1.459 1.955 1.00 0.00 H new ATOM 0 HD11 ILE A 202 6.235 -1.744 1.563 1.00 0.00 H new ATOM 0 HD12 ILE A 202 7.496 -2.352 2.661 1.00 0.00 H new ATOM 0 HD13 ILE A 202 6.919 -0.675 2.811 1.00 0.00 H new ATOM 744 N PRO A 203 12.626 0.962 0.793 1.00 0.00 N ATOM 745 CA PRO A 203 13.864 1.529 1.335 1.00 0.00 C ATOM 746 C PRO A 203 13.683 2.075 2.745 1.00 0.00 C ATOM 747 O PRO A 203 14.535 1.887 3.612 1.00 0.00 O ATOM 748 CB PRO A 203 14.194 2.659 0.361 1.00 0.00 C ATOM 749 CG PRO A 203 13.548 2.256 -0.917 1.00 0.00 C ATOM 750 CD PRO A 203 12.298 1.513 -0.533 1.00 0.00 C ATOM 0 HA PRO A 203 14.651 0.780 1.421 1.00 0.00 H new ATOM 0 HB2 PRO A 203 13.807 3.614 0.717 1.00 0.00 H new ATOM 0 HB3 PRO A 203 15.271 2.776 0.241 1.00 0.00 H new ATOM 0 HG2 PRO A 203 13.312 3.128 -1.527 1.00 0.00 H new ATOM 0 HG3 PRO A 203 14.212 1.624 -1.508 1.00 0.00 H new ATOM 0 HD2 PRO A 203 11.433 2.175 -0.491 1.00 0.00 H new ATOM 0 HD3 PRO A 203 12.062 0.726 -1.249 1.00 0.00 H new ATOM 758 N GLY A 204 12.563 2.754 2.966 1.00 0.00 N ATOM 759 CA GLY A 204 12.284 3.322 4.272 1.00 0.00 C ATOM 760 C GLY A 204 11.305 4.478 4.205 1.00 0.00 C ATOM 761 O GLY A 204 10.761 4.857 5.262 1.00 0.00 O ATOM 762 OXT GLY A 204 11.084 5.005 3.094 1.00 0.00 O ATOM 0 H GLY A 204 11.843 2.921 2.264 1.00 0.00 H new ATOM 0 HA2 GLY A 204 11.881 2.546 4.924 1.00 0.00 H new ATOM 0 HA3 GLY A 204 13.216 3.665 4.722 1.00 0.00 H new TER 766 GLY A 204