USER MOD reduce.3.24.130724 H: found=0, std=0, add=760, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 762 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 187 SER OG : rot 90:sc= 0.319 USER MOD Set 1.2: A 189 GLN : amide:sc= -2.43 K(o=-2.1,f=-9.5!) USER MOD Set 1.3: B 28 SER OG : rot 180:sc= 0.0445 USER MOD Set 2.1: A 222 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 224 SER OG : rot 85:sc= 1.37 USER MOD Set 3.1: A 194 SER OG : rot -170:sc= 0 USER MOD Set 3.2: A 260 LYS NZ :NH3+ 157:sc= -0.931 (180deg=-1.74!) USER MOD Single : A 182 TYR OH : rot 180:sc= 0 USER MOD Single : A 183 GLN : amide:sc= -0.261 X(o=-0.26,f=-0.099) USER MOD Single : A 184 TYR OH : rot 180:sc= -1.8! USER MOD Single : A 186 MET CE :methyl -120:sc= -0.72 (180deg=-2.38!) USER MOD Single : A 192 MET CE :methyl 145:sc= -0.41 (180deg=-2.32!) USER MOD Single : A 196 GLN : amide:sc= -1.73 K(o=-1.7,f=-6.7!) USER MOD Single : A 199 HIS : no HE2:sc= -1.22 K(o=-1.2,f=-3.6!) USER MOD Single : A 203 ASN : amide:sc= -0.087 K(o=-0.087,f=-0.91) USER MOD Single : A 204 TYR OH : rot 180:sc= 0 USER MOD Single : A 207 THR OG1 : rot 180:sc= -0.113 USER MOD Single : A 214 ASN : amide:sc= -0.839 K(o=-0.84,f=-7!) USER MOD Single : A 219 GLN :FLIP amide:sc= 0 F(o=-2.8!,f=0) USER MOD Single : A 221 TYR OH : rot 180:sc= 0 USER MOD Single : A 228 LYS NZ :NH3+ -167:sc= -0.0226 (180deg=-0.237) USER MOD Single : A 230 THR OG1 : rot 180:sc= 0 USER MOD Single : A 233 ASN :FLIP amide:sc= -0.019 F(o=-1.1,f=-0.019) USER MOD Single : A 234 SER OG : rot 180:sc= -0.658 USER MOD Single : A 235 HIS : no HD1:sc= -0.111 X(o=-0.11,f=-0.091) USER MOD Single : A 240 ASN : amide:sc= -0.156 X(o=-0.16,f=-0.16) USER MOD Single : A 242 ASN :FLIP amide:sc= -0.286 F(o=-4.5!,f=-0.29) USER MOD Single : A 248 THR OG1 : rot 180:sc= 0 USER MOD Single : A 251 LYS NZ :NH3+ 165:sc= -0.0371 (180deg=-0.284) USER MOD Single : A 266 ASN :FLIP amide:sc= 0.564 F(o=-0.2,f=0.56) USER MOD Single : A 267 ASN : amide:sc= -0.0212 X(o=-0.021,f=0) USER MOD Single : B 29 ASN : amide:sc=-0.00875 K(o=-0.0087,f=-1.1) USER MOD Single : B 30 THR OG1 : rot 180:sc= 0 USER MOD Single : B 34 ASN :FLIP amide:sc= 0.625 F(o=-1.9!,f=0.63) USER MOD ----------------------------------------------------------------- ATOM 66 N TYR A 182 11.734 2.349 1.101 1.00 0.00 N ATOM 67 CA TYR A 182 10.366 1.862 1.080 1.00 0.00 C ATOM 68 C TYR A 182 10.338 0.365 0.803 1.00 0.00 C ATOM 69 O TYR A 182 10.379 -0.068 -0.350 1.00 0.00 O ATOM 70 CB TYR A 182 9.556 2.610 0.020 1.00 0.00 C ATOM 71 CG TYR A 182 10.408 3.296 -1.026 1.00 0.00 C ATOM 72 CD1 TYR A 182 10.895 4.581 -0.817 1.00 0.00 C ATOM 73 CD2 TYR A 182 10.726 2.661 -2.220 1.00 0.00 C ATOM 74 CE1 TYR A 182 11.674 5.213 -1.767 1.00 0.00 C ATOM 75 CE2 TYR A 182 11.505 3.287 -3.175 1.00 0.00 C ATOM 76 CZ TYR A 182 11.976 4.562 -2.944 1.00 0.00 C ATOM 77 OH TYR A 182 12.754 5.186 -3.891 1.00 0.00 O ATOM 0 HA TYR A 182 9.918 2.042 2.057 1.00 0.00 H new ATOM 0 HB2 TYR A 182 8.885 1.907 -0.474 1.00 0.00 H new ATOM 0 HB3 TYR A 182 8.931 3.355 0.512 1.00 0.00 H new ATOM 0 HD1 TYR A 182 10.660 5.094 0.104 1.00 0.00 H new ATOM 0 HD2 TYR A 182 10.359 1.662 -2.405 1.00 0.00 H new ATOM 0 HE1 TYR A 182 12.044 6.212 -1.588 1.00 0.00 H new ATOM 0 HE2 TYR A 182 11.744 2.780 -4.098 1.00 0.00 H new ATOM 0 HH TYR A 182 12.874 4.591 -4.660 1.00 0.00 H new ATOM 87 N GLN A 183 10.276 -0.419 1.871 1.00 0.00 N ATOM 88 CA GLN A 183 10.234 -1.873 1.756 1.00 0.00 C ATOM 89 C GLN A 183 8.809 -2.384 1.930 1.00 0.00 C ATOM 90 O GLN A 183 8.308 -2.488 3.049 1.00 0.00 O ATOM 91 CB GLN A 183 11.150 -2.514 2.796 1.00 0.00 C ATOM 92 CG GLN A 183 11.285 -4.020 2.643 1.00 0.00 C ATOM 93 CD GLN A 183 11.925 -4.420 1.329 1.00 0.00 C ATOM 94 OE1 GLN A 183 13.146 -4.544 1.230 1.00 0.00 O ATOM 95 NE2 GLN A 183 11.100 -4.624 0.308 1.00 0.00 N ATOM 0 H GLN A 183 10.254 -0.072 2.830 1.00 0.00 H new ATOM 0 HA GLN A 183 10.583 -2.148 0.761 1.00 0.00 H new ATOM 0 HB2 GLN A 183 12.139 -2.060 2.726 1.00 0.00 H new ATOM 0 HB3 GLN A 183 10.767 -2.291 3.792 1.00 0.00 H new ATOM 0 HG2 GLN A 183 11.881 -4.413 3.467 1.00 0.00 H new ATOM 0 HG3 GLN A 183 10.299 -4.478 2.716 1.00 0.00 H new ATOM 0 HE21 GLN A 183 10.094 -4.510 0.434 1.00 0.00 H new ATOM 0 HE22 GLN A 183 11.472 -4.895 -0.602 1.00 0.00 H new ATOM 104 N TYR A 184 8.157 -2.702 0.816 1.00 0.00 N ATOM 105 CA TYR A 184 6.785 -3.193 0.851 1.00 0.00 C ATOM 106 C TYR A 184 6.636 -4.494 0.069 1.00 0.00 C ATOM 107 O TYR A 184 7.278 -4.694 -0.962 1.00 0.00 O ATOM 108 CB TYR A 184 5.830 -2.142 0.283 1.00 0.00 C ATOM 109 CG TYR A 184 5.602 -0.966 1.205 1.00 0.00 C ATOM 110 CD1 TYR A 184 6.522 0.070 1.282 1.00 0.00 C ATOM 111 CD2 TYR A 184 4.463 -0.894 1.996 1.00 0.00 C ATOM 112 CE1 TYR A 184 6.315 1.146 2.123 1.00 0.00 C ATOM 113 CE2 TYR A 184 4.247 0.178 2.839 1.00 0.00 C ATOM 114 CZ TYR A 184 5.175 1.195 2.900 1.00 0.00 C ATOM 115 OH TYR A 184 4.963 2.262 3.740 1.00 0.00 O ATOM 0 H TYR A 184 8.556 -2.629 -0.120 1.00 0.00 H new ATOM 0 HA TYR A 184 6.533 -3.389 1.893 1.00 0.00 H new ATOM 0 HB2 TYR A 184 6.227 -1.778 -0.665 1.00 0.00 H new ATOM 0 HB3 TYR A 184 4.872 -2.614 0.067 1.00 0.00 H new ATOM 0 HD1 TYR A 184 7.414 0.034 0.675 1.00 0.00 H new ATOM 0 HD2 TYR A 184 3.734 -1.690 1.951 1.00 0.00 H new ATOM 0 HE1 TYR A 184 7.041 1.944 2.172 1.00 0.00 H new ATOM 0 HE2 TYR A 184 3.356 0.219 3.447 1.00 0.00 H new ATOM 0 HH TYR A 184 4.114 2.141 4.214 1.00 0.00 H new ATOM 125 N VAL A 185 5.781 -5.375 0.577 1.00 0.00 N ATOM 126 CA VAL A 185 5.517 -6.654 -0.066 1.00 0.00 C ATOM 127 C VAL A 185 4.021 -6.922 -0.116 1.00 0.00 C ATOM 128 O VAL A 185 3.341 -6.904 0.909 1.00 0.00 O ATOM 129 CB VAL A 185 6.225 -7.816 0.661 1.00 0.00 C ATOM 130 CG1 VAL A 185 7.732 -7.723 0.471 1.00 0.00 C ATOM 131 CG2 VAL A 185 5.871 -7.826 2.140 1.00 0.00 C ATOM 0 H VAL A 185 5.256 -5.224 1.438 1.00 0.00 H new ATOM 0 HA VAL A 185 5.913 -6.595 -1.080 1.00 0.00 H new ATOM 0 HB VAL A 185 5.879 -8.753 0.224 1.00 0.00 H new ATOM 0 HG11 VAL A 185 8.216 -8.550 0.990 1.00 0.00 H new ATOM 0 HG12 VAL A 185 7.969 -7.774 -0.592 1.00 0.00 H new ATOM 0 HG13 VAL A 185 8.092 -6.778 0.878 1.00 0.00 H new ATOM 0 HG21 VAL A 185 6.382 -8.654 2.631 1.00 0.00 H new ATOM 0 HG22 VAL A 185 6.183 -6.886 2.595 1.00 0.00 H new ATOM 0 HG23 VAL A 185 4.794 -7.945 2.255 1.00 0.00 H new ATOM 141 N MET A 186 3.509 -7.170 -1.314 1.00 0.00 N ATOM 142 CA MET A 186 2.082 -7.424 -1.486 1.00 0.00 C ATOM 143 C MET A 186 1.819 -8.824 -2.023 1.00 0.00 C ATOM 144 O MET A 186 2.517 -9.301 -2.917 1.00 0.00 O ATOM 145 CB MET A 186 1.454 -6.376 -2.413 1.00 0.00 C ATOM 146 CG MET A 186 2.080 -6.321 -3.795 1.00 0.00 C ATOM 147 SD MET A 186 1.403 -4.994 -4.811 1.00 0.00 S ATOM 148 CE MET A 186 2.493 -5.059 -6.231 1.00 0.00 C ATOM 0 H MET A 186 4.054 -7.201 -2.176 1.00 0.00 H new ATOM 0 HA MET A 186 1.619 -7.351 -0.502 1.00 0.00 H new ATOM 0 HB2 MET A 186 0.390 -6.587 -2.515 1.00 0.00 H new ATOM 0 HB3 MET A 186 1.541 -5.395 -1.947 1.00 0.00 H new ATOM 0 HG2 MET A 186 3.157 -6.185 -3.697 1.00 0.00 H new ATOM 0 HG3 MET A 186 1.924 -7.275 -4.299 1.00 0.00 H new ATOM 0 HE1 MET A 186 3.004 -4.103 -6.341 1.00 0.00 H new ATOM 0 HE2 MET A 186 3.229 -5.850 -6.089 1.00 0.00 H new ATOM 0 HE3 MET A 186 1.909 -5.264 -7.129 1.00 0.00 H new ATOM 158 N SER A 187 0.804 -9.478 -1.464 1.00 0.00 N ATOM 159 CA SER A 187 0.436 -10.821 -1.884 1.00 0.00 C ATOM 160 C SER A 187 0.102 -10.828 -3.372 1.00 0.00 C ATOM 161 O SER A 187 -0.612 -9.950 -3.858 1.00 0.00 O ATOM 162 CB SER A 187 -0.753 -11.328 -1.070 1.00 0.00 C ATOM 163 OG SER A 187 -1.936 -10.618 -1.393 1.00 0.00 O ATOM 0 H SER A 187 0.223 -9.096 -0.718 1.00 0.00 H new ATOM 0 HA SER A 187 1.281 -11.487 -1.709 1.00 0.00 H new ATOM 0 HB2 SER A 187 -0.900 -12.391 -1.260 1.00 0.00 H new ATOM 0 HB3 SER A 187 -0.541 -11.221 -0.006 1.00 0.00 H new ATOM 0 HG SER A 187 -2.400 -11.072 -2.127 1.00 0.00 H new ATOM 169 N GLU A 188 0.616 -11.818 -4.092 1.00 0.00 N ATOM 170 CA GLU A 188 0.383 -11.910 -5.530 1.00 0.00 C ATOM 171 C GLU A 188 -0.635 -12.993 -5.871 1.00 0.00 C ATOM 172 O GLU A 188 -0.318 -14.183 -5.870 1.00 0.00 O ATOM 173 CB GLU A 188 1.702 -12.183 -6.252 1.00 0.00 C ATOM 174 CG GLU A 188 1.620 -12.043 -7.763 1.00 0.00 C ATOM 175 CD GLU A 188 1.058 -10.704 -8.196 1.00 0.00 C ATOM 176 OE1 GLU A 188 1.850 -9.750 -8.353 1.00 0.00 O ATOM 177 OE2 GLU A 188 -0.174 -10.608 -8.378 1.00 0.00 O ATOM 0 H GLU A 188 1.194 -12.565 -3.707 1.00 0.00 H new ATOM 0 HA GLU A 188 -0.027 -10.957 -5.864 1.00 0.00 H new ATOM 0 HB2 GLU A 188 2.460 -11.497 -5.874 1.00 0.00 H new ATOM 0 HB3 GLU A 188 2.036 -13.192 -6.008 1.00 0.00 H new ATOM 0 HG2 GLU A 188 2.615 -12.170 -8.190 1.00 0.00 H new ATOM 0 HG3 GLU A 188 0.996 -12.841 -8.165 1.00 0.00 H new ATOM 184 N GLN A 189 -1.861 -12.568 -6.159 1.00 0.00 N ATOM 185 CA GLN A 189 -2.933 -13.488 -6.521 1.00 0.00 C ATOM 186 C GLN A 189 -3.743 -12.922 -7.689 1.00 0.00 C ATOM 187 O GLN A 189 -4.053 -11.731 -7.712 1.00 0.00 O ATOM 188 CB GLN A 189 -3.853 -13.751 -5.324 1.00 0.00 C ATOM 189 CG GLN A 189 -3.194 -14.540 -4.202 1.00 0.00 C ATOM 190 CD GLN A 189 -2.217 -13.706 -3.398 1.00 0.00 C ATOM 191 OE1 GLN A 189 -2.376 -12.493 -3.276 1.00 0.00 O ATOM 192 NE2 GLN A 189 -1.199 -14.356 -2.846 1.00 0.00 N ATOM 0 H GLN A 189 -2.138 -11.586 -6.148 1.00 0.00 H new ATOM 0 HA GLN A 189 -2.483 -14.433 -6.824 1.00 0.00 H new ATOM 0 HB2 GLN A 189 -4.200 -12.797 -4.928 1.00 0.00 H new ATOM 0 HB3 GLN A 189 -4.734 -14.293 -5.667 1.00 0.00 H new ATOM 0 HG2 GLN A 189 -3.964 -14.932 -3.537 1.00 0.00 H new ATOM 0 HG3 GLN A 189 -2.671 -15.398 -4.625 1.00 0.00 H new ATOM 0 HE21 GLN A 189 -1.108 -15.364 -2.974 1.00 0.00 H new ATOM 0 HE22 GLN A 189 -0.509 -13.847 -2.294 1.00 0.00 H new ATOM 201 N PRO A 190 -4.093 -13.765 -8.678 1.00 0.00 N ATOM 202 CA PRO A 190 -4.865 -13.329 -9.850 1.00 0.00 C ATOM 203 C PRO A 190 -6.219 -12.737 -9.471 1.00 0.00 C ATOM 204 O PRO A 190 -6.782 -11.928 -10.208 1.00 0.00 O ATOM 205 CB PRO A 190 -5.058 -14.618 -10.660 1.00 0.00 C ATOM 206 CG PRO A 190 -3.987 -15.537 -10.185 1.00 0.00 C ATOM 207 CD PRO A 190 -3.768 -15.201 -8.739 1.00 0.00 C ATOM 0 HA PRO A 190 -4.350 -12.539 -10.397 1.00 0.00 H new ATOM 0 HB2 PRO A 190 -6.047 -15.045 -10.493 1.00 0.00 H new ATOM 0 HB3 PRO A 190 -4.970 -14.429 -11.730 1.00 0.00 H new ATOM 0 HG2 PRO A 190 -4.285 -16.579 -10.303 1.00 0.00 H new ATOM 0 HG3 PRO A 190 -3.072 -15.401 -10.761 1.00 0.00 H new ATOM 0 HD2 PRO A 190 -4.413 -15.789 -8.086 1.00 0.00 H new ATOM 0 HD3 PRO A 190 -2.741 -15.396 -8.431 1.00 0.00 H new ATOM 215 N GLU A 191 -6.736 -13.146 -8.318 1.00 0.00 N ATOM 216 CA GLU A 191 -8.027 -12.659 -7.842 1.00 0.00 C ATOM 217 C GLU A 191 -7.883 -11.320 -7.127 1.00 0.00 C ATOM 218 O GLU A 191 -8.847 -10.807 -6.560 1.00 0.00 O ATOM 219 CB GLU A 191 -8.654 -13.681 -6.893 1.00 0.00 C ATOM 220 CG GLU A 191 -7.893 -13.838 -5.586 1.00 0.00 C ATOM 221 CD GLU A 191 -8.451 -14.947 -4.716 1.00 0.00 C ATOM 222 OE1 GLU A 191 -9.349 -14.664 -3.896 1.00 0.00 O ATOM 223 OE2 GLU A 191 -7.988 -16.099 -4.854 1.00 0.00 O ATOM 0 H GLU A 191 -6.282 -13.814 -7.695 1.00 0.00 H new ATOM 0 HA GLU A 191 -8.673 -12.518 -8.709 1.00 0.00 H new ATOM 0 HB2 GLU A 191 -9.679 -13.382 -6.674 1.00 0.00 H new ATOM 0 HB3 GLU A 191 -8.704 -14.648 -7.394 1.00 0.00 H new ATOM 0 HG2 GLU A 191 -6.845 -14.044 -5.803 1.00 0.00 H new ATOM 0 HG3 GLU A 191 -7.926 -12.898 -5.035 1.00 0.00 H new ATOM 230 N MET A 192 -6.680 -10.757 -7.154 1.00 0.00 N ATOM 231 CA MET A 192 -6.424 -9.485 -6.487 1.00 0.00 C ATOM 232 C MET A 192 -5.668 -8.516 -7.392 1.00 0.00 C ATOM 233 O MET A 192 -5.161 -7.493 -6.931 1.00 0.00 O ATOM 234 CB MET A 192 -5.636 -9.729 -5.203 1.00 0.00 C ATOM 235 CG MET A 192 -6.288 -10.753 -4.293 1.00 0.00 C ATOM 236 SD MET A 192 -5.211 -11.290 -2.955 1.00 0.00 S ATOM 237 CE MET A 192 -6.140 -12.693 -2.344 1.00 0.00 C ATOM 0 H MET A 192 -5.871 -11.158 -7.628 1.00 0.00 H new ATOM 0 HA MET A 192 -7.385 -9.029 -6.247 1.00 0.00 H new ATOM 0 HB2 MET A 192 -4.631 -10.065 -5.458 1.00 0.00 H new ATOM 0 HB3 MET A 192 -5.530 -8.788 -4.664 1.00 0.00 H new ATOM 0 HG2 MET A 192 -7.199 -10.328 -3.871 1.00 0.00 H new ATOM 0 HG3 MET A 192 -6.584 -11.620 -4.884 1.00 0.00 H new ATOM 0 HE1 MET A 192 -5.451 -13.468 -2.009 1.00 0.00 H new ATOM 0 HE2 MET A 192 -6.766 -12.379 -1.509 1.00 0.00 H new ATOM 0 HE3 MET A 192 -6.770 -13.087 -3.141 1.00 0.00 H new ATOM 247 N ARG A 193 -5.599 -8.838 -8.678 1.00 0.00 N ATOM 248 CA ARG A 193 -4.903 -7.993 -9.641 1.00 0.00 C ATOM 249 C ARG A 193 -5.686 -6.711 -9.919 1.00 0.00 C ATOM 250 O ARG A 193 -5.108 -5.687 -10.282 1.00 0.00 O ATOM 251 CB ARG A 193 -4.671 -8.755 -10.948 1.00 0.00 C ATOM 252 CG ARG A 193 -5.953 -9.215 -11.621 1.00 0.00 C ATOM 253 CD ARG A 193 -5.669 -9.953 -12.919 1.00 0.00 C ATOM 254 NE ARG A 193 -4.830 -11.130 -12.707 1.00 0.00 N ATOM 255 CZ ARG A 193 -4.532 -12.005 -13.662 1.00 0.00 C ATOM 256 NH1 ARG A 193 -5.003 -11.837 -14.891 1.00 0.00 N ATOM 257 NH2 ARG A 193 -3.763 -13.050 -13.389 1.00 0.00 N ATOM 0 H ARG A 193 -6.016 -9.678 -9.078 1.00 0.00 H new ATOM 0 HA ARG A 193 -3.940 -7.719 -9.210 1.00 0.00 H new ATOM 0 HB2 ARG A 193 -4.118 -8.117 -11.637 1.00 0.00 H new ATOM 0 HB3 ARG A 193 -4.045 -9.624 -10.746 1.00 0.00 H new ATOM 0 HG2 ARG A 193 -6.506 -9.867 -10.945 1.00 0.00 H new ATOM 0 HG3 ARG A 193 -6.588 -8.353 -11.823 1.00 0.00 H new ATOM 0 HD2 ARG A 193 -6.610 -10.257 -13.377 1.00 0.00 H new ATOM 0 HD3 ARG A 193 -5.177 -9.278 -13.619 1.00 0.00 H new ATOM 0 HE ARG A 193 -4.452 -11.289 -11.773 1.00 0.00 H new ATOM 0 HH11 ARG A 193 -5.595 -11.035 -15.105 1.00 0.00 H new ATOM 0 HH12 ARG A 193 -4.773 -12.510 -15.622 1.00 0.00 H new ATOM 0 HH21 ARG A 193 -3.399 -13.183 -12.445 1.00 0.00 H new ATOM 0 HH22 ARG A 193 -3.535 -13.721 -14.123 1.00 0.00 H new ATOM 271 N SER A 194 -7.003 -6.778 -9.746 1.00 0.00 N ATOM 272 CA SER A 194 -7.868 -5.626 -9.989 1.00 0.00 C ATOM 273 C SER A 194 -7.509 -4.451 -9.083 1.00 0.00 C ATOM 274 O SER A 194 -7.298 -3.335 -9.559 1.00 0.00 O ATOM 275 CB SER A 194 -9.333 -6.013 -9.779 1.00 0.00 C ATOM 276 OG SER A 194 -9.719 -7.052 -10.663 1.00 0.00 O ATOM 0 H SER A 194 -7.495 -7.617 -9.439 1.00 0.00 H new ATOM 0 HA SER A 194 -7.718 -5.313 -11.022 1.00 0.00 H new ATOM 0 HB2 SER A 194 -9.483 -6.334 -8.748 1.00 0.00 H new ATOM 0 HB3 SER A 194 -9.969 -5.142 -9.937 1.00 0.00 H new ATOM 0 HG SER A 194 -10.691 -7.173 -10.621 1.00 0.00 H new ATOM 282 N ILE A 195 -7.442 -4.702 -7.778 1.00 0.00 N ATOM 283 CA ILE A 195 -7.116 -3.653 -6.816 1.00 0.00 C ATOM 284 C ILE A 195 -5.651 -3.716 -6.398 1.00 0.00 C ATOM 285 O ILE A 195 -5.246 -3.079 -5.425 1.00 0.00 O ATOM 286 CB ILE A 195 -8.002 -3.745 -5.559 1.00 0.00 C ATOM 287 CG1 ILE A 195 -7.790 -5.087 -4.852 1.00 0.00 C ATOM 288 CG2 ILE A 195 -9.465 -3.559 -5.930 1.00 0.00 C ATOM 289 CD1 ILE A 195 -8.484 -5.182 -3.510 1.00 0.00 C ATOM 0 H ILE A 195 -7.608 -5.619 -7.364 1.00 0.00 H new ATOM 0 HA ILE A 195 -7.304 -2.703 -7.316 1.00 0.00 H new ATOM 0 HB ILE A 195 -7.717 -2.948 -4.872 1.00 0.00 H new ATOM 0 HG12 ILE A 195 -8.152 -5.888 -5.496 1.00 0.00 H new ATOM 0 HG13 ILE A 195 -6.721 -5.249 -4.711 1.00 0.00 H new ATOM 0 HG21 ILE A 195 -10.079 -3.626 -5.032 1.00 0.00 H new ATOM 0 HG22 ILE A 195 -9.602 -2.581 -6.391 1.00 0.00 H new ATOM 0 HG23 ILE A 195 -9.764 -4.336 -6.633 1.00 0.00 H new ATOM 0 HD11 ILE A 195 -8.290 -6.159 -3.068 1.00 0.00 H new ATOM 0 HD12 ILE A 195 -8.105 -4.403 -2.849 1.00 0.00 H new ATOM 0 HD13 ILE A 195 -9.558 -5.052 -3.646 1.00 0.00 H new ATOM 301 N GLN A 196 -4.860 -4.482 -7.141 1.00 0.00 N ATOM 302 CA GLN A 196 -3.438 -4.625 -6.848 1.00 0.00 C ATOM 303 C GLN A 196 -2.729 -3.272 -6.929 1.00 0.00 C ATOM 304 O GLN A 196 -2.671 -2.663 -7.997 1.00 0.00 O ATOM 305 CB GLN A 196 -2.797 -5.608 -7.830 1.00 0.00 C ATOM 306 CG GLN A 196 -1.370 -5.987 -7.472 1.00 0.00 C ATOM 307 CD GLN A 196 -1.296 -6.907 -6.269 1.00 0.00 C ATOM 308 OE1 GLN A 196 -1.206 -6.452 -5.128 1.00 0.00 O ATOM 309 NE2 GLN A 196 -1.334 -8.211 -6.519 1.00 0.00 N ATOM 0 H GLN A 196 -5.179 -5.014 -7.951 1.00 0.00 H new ATOM 0 HA GLN A 196 -3.333 -5.010 -5.834 1.00 0.00 H new ATOM 0 HB2 GLN A 196 -3.404 -6.513 -7.873 1.00 0.00 H new ATOM 0 HB3 GLN A 196 -2.808 -5.170 -8.828 1.00 0.00 H new ATOM 0 HG2 GLN A 196 -0.902 -6.475 -8.327 1.00 0.00 H new ATOM 0 HG3 GLN A 196 -0.798 -5.082 -7.269 1.00 0.00 H new ATOM 0 HE21 GLN A 196 -1.409 -8.544 -7.480 1.00 0.00 H new ATOM 0 HE22 GLN A 196 -1.288 -8.879 -5.750 1.00 0.00 H new ATOM 318 N PRO A 197 -2.178 -2.781 -5.801 1.00 0.00 N ATOM 319 CA PRO A 197 -1.474 -1.494 -5.767 1.00 0.00 C ATOM 320 C PRO A 197 -0.223 -1.499 -6.638 1.00 0.00 C ATOM 321 O PRO A 197 0.633 -2.373 -6.503 1.00 0.00 O ATOM 322 CB PRO A 197 -1.097 -1.320 -4.291 1.00 0.00 C ATOM 323 CG PRO A 197 -1.127 -2.695 -3.721 1.00 0.00 C ATOM 324 CD PRO A 197 -2.192 -3.434 -4.479 1.00 0.00 C ATOM 0 HA PRO A 197 -2.093 -0.685 -6.155 1.00 0.00 H new ATOM 0 HB2 PRO A 197 -0.109 -0.871 -4.186 1.00 0.00 H new ATOM 0 HB3 PRO A 197 -1.801 -0.665 -3.778 1.00 0.00 H new ATOM 0 HG2 PRO A 197 -0.159 -3.184 -3.831 1.00 0.00 H new ATOM 0 HG3 PRO A 197 -1.353 -2.671 -2.655 1.00 0.00 H new ATOM 0 HD2 PRO A 197 -1.969 -4.498 -4.553 1.00 0.00 H new ATOM 0 HD3 PRO A 197 -3.165 -3.345 -3.996 1.00 0.00 H new ATOM 332 N VAL A 198 -0.125 -0.521 -7.534 1.00 0.00 N ATOM 333 CA VAL A 198 1.023 -0.414 -8.427 1.00 0.00 C ATOM 334 C VAL A 198 2.324 -0.392 -7.632 1.00 0.00 C ATOM 335 O VAL A 198 3.098 -1.349 -7.662 1.00 0.00 O ATOM 336 CB VAL A 198 0.944 0.855 -9.299 1.00 0.00 C ATOM 337 CG1 VAL A 198 2.033 0.844 -10.359 1.00 0.00 C ATOM 338 CG2 VAL A 198 -0.430 0.979 -9.938 1.00 0.00 C ATOM 0 H VAL A 198 -0.827 0.208 -7.660 1.00 0.00 H new ATOM 0 HA VAL A 198 1.006 -1.289 -9.077 1.00 0.00 H new ATOM 0 HB VAL A 198 1.102 1.723 -8.659 1.00 0.00 H new ATOM 0 HG11 VAL A 198 1.961 1.748 -10.964 1.00 0.00 H new ATOM 0 HG12 VAL A 198 3.010 0.807 -9.877 1.00 0.00 H new ATOM 0 HG13 VAL A 198 1.911 -0.031 -10.997 1.00 0.00 H new ATOM 0 HG21 VAL A 198 -0.467 1.880 -10.550 1.00 0.00 H new ATOM 0 HG22 VAL A 198 -0.620 0.107 -10.564 1.00 0.00 H new ATOM 0 HG23 VAL A 198 -1.190 1.038 -9.159 1.00 0.00 H new ATOM 348 N HIS A 199 2.558 0.706 -6.919 1.00 0.00 N ATOM 349 CA HIS A 199 3.760 0.848 -6.104 1.00 0.00 C ATOM 350 C HIS A 199 3.442 1.582 -4.805 1.00 0.00 C ATOM 351 O HIS A 199 2.466 2.325 -4.729 1.00 0.00 O ATOM 352 CB HIS A 199 4.855 1.595 -6.865 1.00 0.00 C ATOM 353 CG HIS A 199 5.271 0.932 -8.142 1.00 0.00 C ATOM 354 ND1 HIS A 199 5.632 -0.397 -8.218 1.00 0.00 N ATOM 355 CD2 HIS A 199 5.385 1.423 -9.400 1.00 0.00 C ATOM 356 CE1 HIS A 199 5.952 -0.693 -9.465 1.00 0.00 C ATOM 357 NE2 HIS A 199 5.809 0.393 -10.202 1.00 0.00 N ATOM 0 H HIS A 199 1.931 1.510 -6.889 1.00 0.00 H new ATOM 0 HA HIS A 199 4.122 -0.153 -5.869 1.00 0.00 H new ATOM 0 HB2 HIS A 199 4.505 2.603 -7.088 1.00 0.00 H new ATOM 0 HB3 HIS A 199 5.727 1.696 -6.219 1.00 0.00 H new ATOM 0 HD1 HIS A 199 5.649 -1.049 -7.434 1.00 0.00 H new ATOM 0 HD2 HIS A 199 5.180 2.436 -9.713 1.00 0.00 H new ATOM 0 HE1 HIS A 199 6.276 -1.660 -9.821 1.00 0.00 H new ATOM 366 N VAL A 200 4.271 1.370 -3.787 1.00 0.00 N ATOM 367 CA VAL A 200 4.068 2.013 -2.493 1.00 0.00 C ATOM 368 C VAL A 200 5.394 2.420 -1.856 1.00 0.00 C ATOM 369 O VAL A 200 6.340 1.633 -1.804 1.00 0.00 O ATOM 370 CB VAL A 200 3.304 1.093 -1.520 1.00 0.00 C ATOM 371 CG1 VAL A 200 3.185 1.740 -0.149 1.00 0.00 C ATOM 372 CG2 VAL A 200 1.929 0.750 -2.074 1.00 0.00 C ATOM 0 H VAL A 200 5.087 0.760 -3.833 1.00 0.00 H new ATOM 0 HA VAL A 200 3.474 2.907 -2.681 1.00 0.00 H new ATOM 0 HB VAL A 200 3.869 0.167 -1.411 1.00 0.00 H new ATOM 0 HG11 VAL A 200 2.643 1.074 0.522 1.00 0.00 H new ATOM 0 HG12 VAL A 200 4.181 1.927 0.253 1.00 0.00 H new ATOM 0 HG13 VAL A 200 2.646 2.683 -0.237 1.00 0.00 H new ATOM 0 HG21 VAL A 200 1.406 0.100 -1.373 1.00 0.00 H new ATOM 0 HG22 VAL A 200 1.355 1.666 -2.217 1.00 0.00 H new ATOM 0 HG23 VAL A 200 2.039 0.238 -3.030 1.00 0.00 H new ATOM 382 N TRP A 201 5.450 3.656 -1.370 1.00 0.00 N ATOM 383 CA TRP A 201 6.648 4.181 -0.725 1.00 0.00 C ATOM 384 C TRP A 201 6.272 5.074 0.452 1.00 0.00 C ATOM 385 O TRP A 201 5.292 5.818 0.388 1.00 0.00 O ATOM 386 CB TRP A 201 7.500 4.960 -1.730 1.00 0.00 C ATOM 387 CG TRP A 201 6.720 5.956 -2.533 1.00 0.00 C ATOM 388 CD1 TRP A 201 6.340 7.208 -2.143 1.00 0.00 C ATOM 389 CD2 TRP A 201 6.226 5.783 -3.866 1.00 0.00 C ATOM 390 NE1 TRP A 201 5.638 7.822 -3.151 1.00 0.00 N ATOM 391 CE2 TRP A 201 5.554 6.969 -4.219 1.00 0.00 C ATOM 392 CE3 TRP A 201 6.285 4.739 -4.796 1.00 0.00 C ATOM 393 CZ2 TRP A 201 4.949 7.140 -5.461 1.00 0.00 C ATOM 394 CZ3 TRP A 201 5.684 4.911 -6.028 1.00 0.00 C ATOM 395 CH2 TRP A 201 5.023 6.103 -6.351 1.00 0.00 C ATOM 0 H TRP A 201 4.674 4.316 -1.411 1.00 0.00 H new ATOM 0 HA TRP A 201 7.233 3.341 -0.351 1.00 0.00 H new ATOM 0 HB2 TRP A 201 8.294 5.480 -1.194 1.00 0.00 H new ATOM 0 HB3 TRP A 201 7.981 4.256 -2.409 1.00 0.00 H new ATOM 0 HD1 TRP A 201 6.559 7.651 -1.183 1.00 0.00 H new ATOM 0 HE1 TRP A 201 5.243 8.762 -3.111 1.00 0.00 H new ATOM 0 HE3 TRP A 201 6.791 3.816 -4.555 1.00 0.00 H new ATOM 0 HZ2 TRP A 201 4.439 8.058 -5.713 1.00 0.00 H new ATOM 0 HZ3 TRP A 201 5.724 4.113 -6.754 1.00 0.00 H new ATOM 0 HH2 TRP A 201 4.562 6.206 -7.322 1.00 0.00 H new ATOM 406 N ASP A 202 7.050 4.997 1.527 1.00 0.00 N ATOM 407 CA ASP A 202 6.783 5.796 2.719 1.00 0.00 C ATOM 408 C ASP A 202 7.873 6.836 2.946 1.00 0.00 C ATOM 409 O ASP A 202 8.890 6.851 2.253 1.00 0.00 O ATOM 410 CB ASP A 202 6.668 4.895 3.950 1.00 0.00 C ATOM 411 CG ASP A 202 7.966 4.177 4.264 1.00 0.00 C ATOM 412 OD1 ASP A 202 8.172 3.065 3.734 1.00 0.00 O ATOM 413 OD2 ASP A 202 8.776 4.726 5.040 1.00 0.00 O ATOM 0 H ASP A 202 7.868 4.392 1.598 1.00 0.00 H new ATOM 0 HA ASP A 202 5.838 6.317 2.562 1.00 0.00 H new ATOM 0 HB2 ASP A 202 6.371 5.495 4.810 1.00 0.00 H new ATOM 0 HB3 ASP A 202 5.880 4.160 3.787 1.00 0.00 H new ATOM 418 N ASN A 203 7.647 7.703 3.927 1.00 0.00 N ATOM 419 CA ASN A 203 8.600 8.749 4.265 1.00 0.00 C ATOM 420 C ASN A 203 8.829 8.783 5.772 1.00 0.00 C ATOM 421 O ASN A 203 8.335 7.923 6.501 1.00 0.00 O ATOM 422 CB ASN A 203 8.097 10.110 3.780 1.00 0.00 C ATOM 423 CG ASN A 203 7.871 10.144 2.281 1.00 0.00 C ATOM 424 OD1 ASN A 203 8.550 9.453 1.523 1.00 0.00 O ATOM 425 ND2 ASN A 203 6.911 10.953 1.846 1.00 0.00 N ATOM 0 H ASN A 203 6.806 7.700 4.504 1.00 0.00 H new ATOM 0 HA ASN A 203 9.545 8.530 3.767 1.00 0.00 H new ATOM 0 HB2 ASN A 203 7.165 10.352 4.290 1.00 0.00 H new ATOM 0 HB3 ASN A 203 8.819 10.879 4.053 1.00 0.00 H new ATOM 0 HD21 ASN A 203 6.713 11.019 0.848 1.00 0.00 H new ATOM 0 HD22 ASN A 203 6.372 11.508 2.510 1.00 0.00 H new ATOM 432 N TYR A 204 9.577 9.776 6.232 1.00 0.00 N ATOM 433 CA TYR A 204 9.865 9.912 7.653 1.00 0.00 C ATOM 434 C TYR A 204 8.629 10.351 8.433 1.00 0.00 C ATOM 435 O TYR A 204 8.531 10.113 9.637 1.00 0.00 O ATOM 436 CB TYR A 204 11.005 10.907 7.873 1.00 0.00 C ATOM 437 CG TYR A 204 12.344 10.415 7.371 1.00 0.00 C ATOM 438 CD1 TYR A 204 13.126 9.565 8.143 1.00 0.00 C ATOM 439 CD2 TYR A 204 12.825 10.798 6.125 1.00 0.00 C ATOM 440 CE1 TYR A 204 14.350 9.113 7.689 1.00 0.00 C ATOM 441 CE2 TYR A 204 14.048 10.350 5.664 1.00 0.00 C ATOM 442 CZ TYR A 204 14.806 9.507 6.449 1.00 0.00 C ATOM 443 OH TYR A 204 16.024 9.058 5.993 1.00 0.00 O ATOM 0 H TYR A 204 9.994 10.497 5.644 1.00 0.00 H new ATOM 0 HA TYR A 204 10.169 8.933 8.025 1.00 0.00 H new ATOM 0 HB2 TYR A 204 10.760 11.843 7.372 1.00 0.00 H new ATOM 0 HB3 TYR A 204 11.084 11.127 8.938 1.00 0.00 H new ATOM 0 HD1 TYR A 204 12.771 9.252 9.114 1.00 0.00 H new ATOM 0 HD2 TYR A 204 12.233 11.457 5.507 1.00 0.00 H new ATOM 0 HE1 TYR A 204 14.947 8.454 8.302 1.00 0.00 H new ATOM 0 HE2 TYR A 204 14.408 10.658 4.694 1.00 0.00 H new ATOM 0 HH TYR A 204 16.196 9.428 5.102 1.00 0.00 H new ATOM 453 N ARG A 205 7.688 10.992 7.745 1.00 0.00 N ATOM 454 CA ARG A 205 6.469 11.469 8.391 1.00 0.00 C ATOM 455 C ARG A 205 5.221 10.817 7.801 1.00 0.00 C ATOM 456 O ARG A 205 4.559 10.016 8.461 1.00 0.00 O ATOM 457 CB ARG A 205 6.365 12.990 8.264 1.00 0.00 C ATOM 458 CG ARG A 205 7.531 13.736 8.893 1.00 0.00 C ATOM 459 CD ARG A 205 7.371 15.240 8.752 1.00 0.00 C ATOM 460 NE ARG A 205 7.289 15.653 7.353 1.00 0.00 N ATOM 461 CZ ARG A 205 7.037 16.901 6.966 1.00 0.00 C ATOM 462 NH1 ARG A 205 6.844 17.853 7.869 1.00 0.00 N ATOM 463 NH2 ARG A 205 6.978 17.197 5.674 1.00 0.00 N ATOM 0 H ARG A 205 7.745 11.192 6.746 1.00 0.00 H new ATOM 0 HA ARG A 205 6.527 11.192 9.444 1.00 0.00 H new ATOM 0 HB2 ARG A 205 6.303 13.254 7.208 1.00 0.00 H new ATOM 0 HB3 ARG A 205 5.438 13.322 8.731 1.00 0.00 H new ATOM 0 HG2 ARG A 205 7.605 13.474 9.949 1.00 0.00 H new ATOM 0 HG3 ARG A 205 8.462 13.422 8.421 1.00 0.00 H new ATOM 0 HD2 ARG A 205 6.471 15.560 9.278 1.00 0.00 H new ATOM 0 HD3 ARG A 205 8.214 15.741 9.229 1.00 0.00 H new ATOM 0 HE ARG A 205 7.433 14.945 6.633 1.00 0.00 H new ATOM 0 HH11 ARG A 205 6.889 17.629 8.863 1.00 0.00 H new ATOM 0 HH12 ARG A 205 6.651 18.809 7.569 1.00 0.00 H new ATOM 0 HH21 ARG A 205 7.126 16.468 4.976 1.00 0.00 H new ATOM 0 HH22 ARG A 205 6.785 18.154 5.378 1.00 0.00 H new ATOM 477 N PHE A 206 4.907 11.163 6.556 1.00 0.00 N ATOM 478 CA PHE A 206 3.725 10.627 5.887 1.00 0.00 C ATOM 479 C PHE A 206 4.082 9.482 4.942 1.00 0.00 C ATOM 480 O PHE A 206 5.256 9.217 4.683 1.00 0.00 O ATOM 481 CB PHE A 206 3.013 11.735 5.108 1.00 0.00 C ATOM 482 CG PHE A 206 2.717 12.954 5.933 1.00 0.00 C ATOM 483 CD1 PHE A 206 1.596 13.001 6.747 1.00 0.00 C ATOM 484 CD2 PHE A 206 3.560 14.053 5.895 1.00 0.00 C ATOM 485 CE1 PHE A 206 1.322 14.122 7.506 1.00 0.00 C ATOM 486 CE2 PHE A 206 3.290 15.177 6.653 1.00 0.00 C ATOM 487 CZ PHE A 206 2.169 15.211 7.459 1.00 0.00 C ATOM 0 H PHE A 206 5.454 11.812 5.990 1.00 0.00 H new ATOM 0 HA PHE A 206 3.061 10.235 6.657 1.00 0.00 H new ATOM 0 HB2 PHE A 206 3.630 12.023 4.257 1.00 0.00 H new ATOM 0 HB3 PHE A 206 2.079 11.343 4.706 1.00 0.00 H new ATOM 0 HD1 PHE A 206 0.930 12.152 6.788 1.00 0.00 H new ATOM 0 HD2 PHE A 206 4.438 14.031 5.266 1.00 0.00 H new ATOM 0 HE1 PHE A 206 0.445 14.147 8.136 1.00 0.00 H new ATOM 0 HE2 PHE A 206 3.955 16.027 6.615 1.00 0.00 H new ATOM 0 HZ PHE A 206 1.955 16.088 8.052 1.00 0.00 H new ATOM 497 N THR A 207 3.053 8.807 4.434 1.00 0.00 N ATOM 498 CA THR A 207 3.238 7.690 3.515 1.00 0.00 C ATOM 499 C THR A 207 2.353 7.864 2.284 1.00 0.00 C ATOM 500 O THR A 207 1.253 8.407 2.378 1.00 0.00 O ATOM 501 CB THR A 207 2.909 6.345 4.191 1.00 0.00 C ATOM 502 OG1 THR A 207 3.698 6.186 5.375 1.00 0.00 O ATOM 503 CG2 THR A 207 3.172 5.182 3.244 1.00 0.00 C ATOM 0 H THR A 207 2.078 9.017 4.646 1.00 0.00 H new ATOM 0 HA THR A 207 4.286 7.682 3.216 1.00 0.00 H new ATOM 0 HB THR A 207 1.851 6.347 4.455 1.00 0.00 H new ATOM 0 HG1 THR A 207 3.482 5.330 5.800 1.00 0.00 H new ATOM 0 HG21 THR A 207 2.932 4.244 3.744 1.00 0.00 H new ATOM 0 HG22 THR A 207 2.550 5.289 2.355 1.00 0.00 H new ATOM 0 HG23 THR A 207 4.223 5.180 2.953 1.00 0.00 H new ATOM 511 N ARG A 208 2.832 7.403 1.132 1.00 0.00 N ATOM 512 CA ARG A 208 2.073 7.530 -0.107 1.00 0.00 C ATOM 513 C ARG A 208 1.859 6.178 -0.782 1.00 0.00 C ATOM 514 O ARG A 208 2.727 5.305 -0.746 1.00 0.00 O ATOM 515 CB ARG A 208 2.787 8.482 -1.068 1.00 0.00 C ATOM 516 CG ARG A 208 2.988 9.878 -0.503 1.00 0.00 C ATOM 517 CD ARG A 208 3.641 10.800 -1.519 1.00 0.00 C ATOM 518 NE ARG A 208 3.877 12.134 -0.974 1.00 0.00 N ATOM 519 CZ ARG A 208 4.547 13.086 -1.617 1.00 0.00 C ATOM 520 NH1 ARG A 208 5.046 12.851 -2.823 1.00 0.00 N ATOM 521 NH2 ARG A 208 4.718 14.274 -1.054 1.00 0.00 N ATOM 0 H ARG A 208 3.736 6.941 1.031 1.00 0.00 H new ATOM 0 HA ARG A 208 1.094 7.935 0.149 1.00 0.00 H new ATOM 0 HB2 ARG A 208 3.758 8.061 -1.329 1.00 0.00 H new ATOM 0 HB3 ARG A 208 2.212 8.552 -1.991 1.00 0.00 H new ATOM 0 HG2 ARG A 208 2.026 10.291 -0.200 1.00 0.00 H new ATOM 0 HG3 ARG A 208 3.608 9.824 0.392 1.00 0.00 H new ATOM 0 HD2 ARG A 208 4.588 10.369 -1.844 1.00 0.00 H new ATOM 0 HD3 ARG A 208 3.005 10.876 -2.401 1.00 0.00 H new ATOM 0 HE ARG A 208 3.507 12.348 -0.048 1.00 0.00 H new ATOM 0 HH11 ARG A 208 4.916 11.938 -3.260 1.00 0.00 H new ATOM 0 HH12 ARG A 208 5.559 13.583 -3.314 1.00 0.00 H new ATOM 0 HH21 ARG A 208 4.336 14.459 -0.127 1.00 0.00 H new ATOM 0 HH22 ARG A 208 5.232 15.003 -1.548 1.00 0.00 H new ATOM 535 N PHE A 209 0.691 6.021 -1.399 1.00 0.00 N ATOM 536 CA PHE A 209 0.339 4.790 -2.099 1.00 0.00 C ATOM 537 C PHE A 209 -0.083 5.101 -3.532 1.00 0.00 C ATOM 538 O PHE A 209 -0.996 5.893 -3.757 1.00 0.00 O ATOM 539 CB PHE A 209 -0.804 4.073 -1.378 1.00 0.00 C ATOM 540 CG PHE A 209 -0.417 3.458 -0.065 1.00 0.00 C ATOM 541 CD1 PHE A 209 -0.148 4.251 1.039 1.00 0.00 C ATOM 542 CD2 PHE A 209 -0.332 2.082 0.067 1.00 0.00 C ATOM 543 CE1 PHE A 209 0.203 3.682 2.248 1.00 0.00 C ATOM 544 CE2 PHE A 209 0.017 1.507 1.273 1.00 0.00 C ATOM 545 CZ PHE A 209 0.285 2.308 2.365 1.00 0.00 C ATOM 0 H PHE A 209 -0.033 6.738 -1.428 1.00 0.00 H new ATOM 0 HA PHE A 209 1.215 4.142 -2.112 1.00 0.00 H new ATOM 0 HB2 PHE A 209 -1.613 4.783 -1.209 1.00 0.00 H new ATOM 0 HB3 PHE A 209 -1.196 3.292 -2.030 1.00 0.00 H new ATOM 0 HD1 PHE A 209 -0.213 5.326 0.953 1.00 0.00 H new ATOM 0 HD2 PHE A 209 -0.541 1.451 -0.784 1.00 0.00 H new ATOM 0 HE1 PHE A 209 0.413 4.311 3.101 1.00 0.00 H new ATOM 0 HE2 PHE A 209 0.080 0.433 1.362 1.00 0.00 H new ATOM 0 HZ PHE A 209 0.558 1.861 3.309 1.00 0.00 H new ATOM 555 N GLU A 210 0.573 4.471 -4.500 1.00 0.00 N ATOM 556 CA GLU A 210 0.251 4.703 -5.905 1.00 0.00 C ATOM 557 C GLU A 210 -0.627 3.587 -6.464 1.00 0.00 C ATOM 558 O GLU A 210 -0.210 2.430 -6.536 1.00 0.00 O ATOM 559 CB GLU A 210 1.529 4.821 -6.735 1.00 0.00 C ATOM 560 CG GLU A 210 1.283 5.334 -8.145 1.00 0.00 C ATOM 561 CD GLU A 210 2.490 5.166 -9.047 1.00 0.00 C ATOM 562 OE1 GLU A 210 2.654 4.069 -9.621 1.00 0.00 O ATOM 563 OE2 GLU A 210 3.272 6.131 -9.180 1.00 0.00 O ATOM 0 H GLU A 210 1.325 3.801 -4.341 1.00 0.00 H new ATOM 0 HA GLU A 210 -0.303 5.639 -5.966 1.00 0.00 H new ATOM 0 HB2 GLU A 210 2.223 5.491 -6.228 1.00 0.00 H new ATOM 0 HB3 GLU A 210 2.010 3.845 -6.790 1.00 0.00 H new ATOM 0 HG2 GLU A 210 0.435 4.804 -8.577 1.00 0.00 H new ATOM 0 HG3 GLU A 210 1.011 6.389 -8.101 1.00 0.00 H new ATOM 570 N PHE A 211 -1.845 3.949 -6.864 1.00 0.00 N ATOM 571 CA PHE A 211 -2.793 2.991 -7.423 1.00 0.00 C ATOM 572 C PHE A 211 -3.084 3.306 -8.890 1.00 0.00 C ATOM 573 O PHE A 211 -2.871 4.432 -9.340 1.00 0.00 O ATOM 574 CB PHE A 211 -4.099 3.009 -6.627 1.00 0.00 C ATOM 575 CG PHE A 211 -3.982 2.417 -5.253 1.00 0.00 C ATOM 576 CD1 PHE A 211 -3.585 3.195 -4.179 1.00 0.00 C ATOM 577 CD2 PHE A 211 -4.274 1.079 -5.037 1.00 0.00 C ATOM 578 CE1 PHE A 211 -3.482 2.650 -2.913 1.00 0.00 C ATOM 579 CE2 PHE A 211 -4.173 0.529 -3.774 1.00 0.00 C ATOM 580 CZ PHE A 211 -3.776 1.316 -2.710 1.00 0.00 C ATOM 0 H PHE A 211 -2.198 4.904 -6.810 1.00 0.00 H new ATOM 0 HA PHE A 211 -2.346 1.999 -7.359 1.00 0.00 H new ATOM 0 HB2 PHE A 211 -4.446 4.039 -6.540 1.00 0.00 H new ATOM 0 HB3 PHE A 211 -4.860 2.462 -7.184 1.00 0.00 H new ATOM 0 HD1 PHE A 211 -3.353 4.239 -4.332 1.00 0.00 H new ATOM 0 HD2 PHE A 211 -4.584 0.460 -5.866 1.00 0.00 H new ATOM 0 HE1 PHE A 211 -3.172 3.267 -2.083 1.00 0.00 H new ATOM 0 HE2 PHE A 211 -4.404 -0.514 -3.618 1.00 0.00 H new ATOM 0 HZ PHE A 211 -3.696 0.889 -1.721 1.00 0.00 H new ATOM 590 N PRO A 212 -3.576 2.314 -9.656 1.00 0.00 N ATOM 591 CA PRO A 212 -3.902 2.503 -11.075 1.00 0.00 C ATOM 592 C PRO A 212 -4.956 3.585 -11.281 1.00 0.00 C ATOM 593 O PRO A 212 -5.584 4.043 -10.326 1.00 0.00 O ATOM 594 CB PRO A 212 -4.448 1.137 -11.510 1.00 0.00 C ATOM 595 CG PRO A 212 -3.929 0.173 -10.500 1.00 0.00 C ATOM 596 CD PRO A 212 -3.847 0.936 -9.209 1.00 0.00 C ATOM 0 HA PRO A 212 -3.035 2.828 -11.650 1.00 0.00 H new ATOM 0 HB2 PRO A 212 -5.538 1.137 -11.532 1.00 0.00 H new ATOM 0 HB3 PRO A 212 -4.109 0.878 -12.513 1.00 0.00 H new ATOM 0 HG2 PRO A 212 -4.592 -0.687 -10.404 1.00 0.00 H new ATOM 0 HG3 PRO A 212 -2.951 -0.209 -10.791 1.00 0.00 H new ATOM 0 HD2 PRO A 212 -4.776 0.871 -8.642 1.00 0.00 H new ATOM 0 HD3 PRO A 212 -3.053 0.557 -8.566 1.00 0.00 H new ATOM 604 N ALA A 213 -5.147 3.991 -12.532 1.00 0.00 N ATOM 605 CA ALA A 213 -6.126 5.022 -12.860 1.00 0.00 C ATOM 606 C ALA A 213 -7.449 4.405 -13.300 1.00 0.00 C ATOM 607 O ALA A 213 -8.508 5.018 -13.159 1.00 0.00 O ATOM 608 CB ALA A 213 -5.582 5.938 -13.946 1.00 0.00 C ATOM 0 H ALA A 213 -4.637 3.622 -13.335 1.00 0.00 H new ATOM 0 HA ALA A 213 -6.312 5.610 -11.961 1.00 0.00 H new ATOM 0 HB1 ALA A 213 -6.322 6.703 -14.181 1.00 0.00 H new ATOM 0 HB2 ALA A 213 -4.667 6.415 -13.595 1.00 0.00 H new ATOM 0 HB3 ALA A 213 -5.367 5.354 -14.841 1.00 0.00 H new ATOM 614 N ASN A 214 -7.383 3.189 -13.834 1.00 0.00 N ATOM 615 CA ASN A 214 -8.577 2.491 -14.297 1.00 0.00 C ATOM 616 C ASN A 214 -9.244 1.730 -13.161 1.00 0.00 C ATOM 617 O ASN A 214 -10.393 1.303 -13.270 1.00 0.00 O ATOM 618 CB ASN A 214 -8.230 1.538 -15.444 1.00 0.00 C ATOM 619 CG ASN A 214 -7.116 0.574 -15.082 1.00 0.00 C ATOM 620 OD1 ASN A 214 -6.954 0.197 -13.921 1.00 0.00 O ATOM 621 ND2 ASN A 214 -6.339 0.168 -16.080 1.00 0.00 N ATOM 0 H ASN A 214 -6.515 2.667 -13.957 1.00 0.00 H new ATOM 0 HA ASN A 214 -9.281 3.238 -14.663 1.00 0.00 H new ATOM 0 HB2 ASN A 214 -9.119 0.972 -15.724 1.00 0.00 H new ATOM 0 HB3 ASN A 214 -7.934 2.119 -16.318 1.00 0.00 H new ATOM 0 HD21 ASN A 214 -5.573 -0.481 -15.899 1.00 0.00 H new ATOM 0 HD22 ASN A 214 -6.508 0.505 -17.028 1.00 0.00 H new ATOM 628 N ALA A 215 -8.509 1.567 -12.075 1.00 0.00 N ATOM 629 CA ALA A 215 -9.010 0.851 -10.906 1.00 0.00 C ATOM 630 C ALA A 215 -9.499 1.818 -9.833 1.00 0.00 C ATOM 631 O ALA A 215 -9.088 2.978 -9.794 1.00 0.00 O ATOM 632 CB ALA A 215 -7.929 -0.060 -10.344 1.00 0.00 C ATOM 0 H ALA A 215 -7.558 1.921 -11.974 1.00 0.00 H new ATOM 0 HA ALA A 215 -9.858 0.243 -11.221 1.00 0.00 H new ATOM 0 HB1 ALA A 215 -8.315 -0.588 -9.472 1.00 0.00 H new ATOM 0 HB2 ALA A 215 -7.631 -0.783 -11.104 1.00 0.00 H new ATOM 0 HB3 ALA A 215 -7.065 0.537 -10.053 1.00 0.00 H new ATOM 638 N GLU A 216 -10.380 1.333 -8.963 1.00 0.00 N ATOM 639 CA GLU A 216 -10.926 2.151 -7.886 1.00 0.00 C ATOM 640 C GLU A 216 -9.973 2.179 -6.695 1.00 0.00 C ATOM 641 O GLU A 216 -9.176 1.261 -6.505 1.00 0.00 O ATOM 642 CB GLU A 216 -12.291 1.611 -7.450 1.00 0.00 C ATOM 643 CG GLU A 216 -12.996 2.486 -6.426 1.00 0.00 C ATOM 644 CD GLU A 216 -13.307 3.872 -6.957 1.00 0.00 C ATOM 645 OE1 GLU A 216 -14.386 4.048 -7.560 1.00 0.00 O ATOM 646 OE2 GLU A 216 -12.472 4.781 -6.770 1.00 0.00 O ATOM 0 H GLU A 216 -10.731 0.376 -8.983 1.00 0.00 H new ATOM 0 HA GLU A 216 -11.048 3.168 -8.258 1.00 0.00 H new ATOM 0 HB2 GLU A 216 -12.929 1.509 -8.328 1.00 0.00 H new ATOM 0 HB3 GLU A 216 -12.160 0.612 -7.033 1.00 0.00 H new ATOM 0 HG2 GLU A 216 -13.923 2.003 -6.118 1.00 0.00 H new ATOM 0 HG3 GLU A 216 -12.371 2.573 -5.537 1.00 0.00 H new ATOM 653 N LEU A 217 -10.058 3.239 -5.897 1.00 0.00 N ATOM 654 CA LEU A 217 -9.199 3.384 -4.727 1.00 0.00 C ATOM 655 C LEU A 217 -9.804 2.689 -3.509 1.00 0.00 C ATOM 656 O LEU A 217 -10.858 3.090 -3.016 1.00 0.00 O ATOM 657 CB LEU A 217 -8.962 4.863 -4.422 1.00 0.00 C ATOM 658 CG LEU A 217 -8.283 5.656 -5.541 1.00 0.00 C ATOM 659 CD1 LEU A 217 -8.066 7.096 -5.109 1.00 0.00 C ATOM 660 CD2 LEU A 217 -6.960 5.012 -5.931 1.00 0.00 C ATOM 0 H LEU A 217 -10.712 4.009 -6.039 1.00 0.00 H new ATOM 0 HA LEU A 217 -8.244 2.909 -4.951 1.00 0.00 H new ATOM 0 HB2 LEU A 217 -9.921 5.330 -4.197 1.00 0.00 H new ATOM 0 HB3 LEU A 217 -8.352 4.939 -3.522 1.00 0.00 H new ATOM 0 HG LEU A 217 -8.936 5.648 -6.414 1.00 0.00 H new ATOM 0 HD11 LEU A 217 -7.582 7.649 -5.914 1.00 0.00 H new ATOM 0 HD12 LEU A 217 -9.027 7.556 -4.880 1.00 0.00 H new ATOM 0 HD13 LEU A 217 -7.433 7.118 -4.222 1.00 0.00 H new ATOM 0 HD21 LEU A 217 -6.494 5.592 -6.728 1.00 0.00 H new ATOM 0 HD22 LEU A 217 -6.298 4.988 -5.065 1.00 0.00 H new ATOM 0 HD23 LEU A 217 -7.139 3.995 -6.279 1.00 0.00 H new ATOM 672 N PRO A 218 -9.138 1.632 -3.008 1.00 0.00 N ATOM 673 CA PRO A 218 -9.608 0.876 -1.846 1.00 0.00 C ATOM 674 C PRO A 218 -9.269 1.557 -0.523 1.00 0.00 C ATOM 675 O PRO A 218 -8.531 2.541 -0.490 1.00 0.00 O ATOM 676 CB PRO A 218 -8.850 -0.443 -1.973 1.00 0.00 C ATOM 677 CG PRO A 218 -7.568 -0.075 -2.637 1.00 0.00 C ATOM 678 CD PRO A 218 -7.876 1.085 -3.545 1.00 0.00 C ATOM 0 HA PRO A 218 -10.693 0.773 -1.835 1.00 0.00 H new ATOM 0 HB2 PRO A 218 -8.676 -0.896 -0.997 1.00 0.00 H new ATOM 0 HB3 PRO A 218 -9.410 -1.167 -2.565 1.00 0.00 H new ATOM 0 HG2 PRO A 218 -6.814 0.199 -1.900 1.00 0.00 H new ATOM 0 HG3 PRO A 218 -7.169 -0.916 -3.204 1.00 0.00 H new ATOM 0 HD2 PRO A 218 -7.079 1.828 -3.528 1.00 0.00 H new ATOM 0 HD3 PRO A 218 -7.989 0.763 -4.580 1.00 0.00 H new ATOM 686 N GLN A 219 -9.817 1.022 0.565 1.00 0.00 N ATOM 687 CA GLN A 219 -9.573 1.567 1.895 1.00 0.00 C ATOM 688 C GLN A 219 -8.426 0.826 2.574 1.00 0.00 C ATOM 689 O GLN A 219 -8.506 -0.380 2.804 1.00 0.00 O ATOM 690 CB GLN A 219 -10.839 1.469 2.748 1.00 0.00 C ATOM 691 CG GLN A 219 -12.026 2.219 2.163 1.00 0.00 C ATOM 692 CD GLN A 219 -13.284 2.071 2.996 1.00 0.00 C ATOM 693 OE1 GLN A 219 -13.115 1.916 4.305 1.00 0.00 O flip ATOM 694 NE2 GLN A 219 -14.396 2.097 2.470 1.00 0.00 N flip ATOM 0 H GLN A 219 -10.434 0.210 0.550 1.00 0.00 H new ATOM 0 HA GLN A 219 -9.297 2.616 1.792 1.00 0.00 H new ATOM 0 HB2 GLN A 219 -11.106 0.419 2.868 1.00 0.00 H new ATOM 0 HB3 GLN A 219 -10.628 1.860 3.743 1.00 0.00 H new ATOM 0 HG2 GLN A 219 -11.775 3.276 2.077 1.00 0.00 H new ATOM 0 HG3 GLN A 219 -12.219 1.854 1.154 1.00 0.00 H new ATOM 0 HE21 GLN A 219 -14.480 2.218 1.461 1.00 0.00 H new ATOM 0 HE22 GLN A 219 -15.234 1.997 3.043 1.00 0.00 H new ATOM 703 N VAL A 220 -7.362 1.555 2.894 1.00 0.00 N ATOM 704 CA VAL A 220 -6.196 0.962 3.537 1.00 0.00 C ATOM 705 C VAL A 220 -6.299 1.033 5.059 1.00 0.00 C ATOM 706 O VAL A 220 -6.594 2.086 5.624 1.00 0.00 O ATOM 707 CB VAL A 220 -4.898 1.659 3.086 1.00 0.00 C ATOM 708 CG1 VAL A 220 -3.680 0.959 3.671 1.00 0.00 C ATOM 709 CG2 VAL A 220 -4.816 1.708 1.569 1.00 0.00 C ATOM 0 H VAL A 220 -7.283 2.557 2.719 1.00 0.00 H new ATOM 0 HA VAL A 220 -6.167 -0.084 3.233 1.00 0.00 H new ATOM 0 HB VAL A 220 -4.912 2.683 3.459 1.00 0.00 H new ATOM 0 HG11 VAL A 220 -2.774 1.467 3.340 1.00 0.00 H new ATOM 0 HG12 VAL A 220 -3.733 0.985 4.759 1.00 0.00 H new ATOM 0 HG13 VAL A 220 -3.659 -0.077 3.333 1.00 0.00 H new ATOM 0 HG21 VAL A 220 -3.892 2.204 1.270 1.00 0.00 H new ATOM 0 HG22 VAL A 220 -4.828 0.693 1.171 1.00 0.00 H new ATOM 0 HG23 VAL A 220 -5.669 2.262 1.176 1.00 0.00 H new ATOM 719 N TYR A 221 -6.054 -0.099 5.713 1.00 0.00 N ATOM 720 CA TYR A 221 -6.107 -0.178 7.170 1.00 0.00 C ATOM 721 C TYR A 221 -4.720 -0.419 7.750 1.00 0.00 C ATOM 722 O TYR A 221 -3.748 -0.581 7.013 1.00 0.00 O ATOM 723 CB TYR A 221 -7.044 -1.302 7.616 1.00 0.00 C ATOM 724 CG TYR A 221 -8.508 -0.933 7.596 1.00 0.00 C ATOM 725 CD1 TYR A 221 -9.076 -0.293 6.502 1.00 0.00 C ATOM 726 CD2 TYR A 221 -9.322 -1.235 8.676 1.00 0.00 C ATOM 727 CE1 TYR A 221 -10.419 0.036 6.489 1.00 0.00 C ATOM 728 CE2 TYR A 221 -10.662 -0.910 8.672 1.00 0.00 C ATOM 729 CZ TYR A 221 -11.208 -0.275 7.577 1.00 0.00 C ATOM 730 OH TYR A 221 -12.545 0.049 7.568 1.00 0.00 O ATOM 0 H TYR A 221 -5.816 -0.978 5.254 1.00 0.00 H new ATOM 0 HA TYR A 221 -6.487 0.774 7.539 1.00 0.00 H new ATOM 0 HB2 TYR A 221 -6.890 -2.166 6.970 1.00 0.00 H new ATOM 0 HB3 TYR A 221 -6.772 -1.607 8.626 1.00 0.00 H new ATOM 0 HD1 TYR A 221 -8.460 -0.049 5.649 1.00 0.00 H new ATOM 0 HD2 TYR A 221 -8.900 -1.734 9.536 1.00 0.00 H new ATOM 0 HE1 TYR A 221 -10.848 0.534 5.632 1.00 0.00 H new ATOM 0 HE2 TYR A 221 -11.281 -1.152 9.523 1.00 0.00 H new ATOM 0 HH TYR A 221 -12.957 -0.240 8.409 1.00 0.00 H new ATOM 740 N MET A 222 -4.639 -0.450 9.075 1.00 0.00 N ATOM 741 CA MET A 222 -3.370 -0.679 9.756 1.00 0.00 C ATOM 742 C MET A 222 -3.571 -1.506 11.021 1.00 0.00 C ATOM 743 O MET A 222 -4.597 -1.393 11.693 1.00 0.00 O ATOM 744 CB MET A 222 -2.699 0.652 10.091 1.00 0.00 C ATOM 745 CG MET A 222 -3.590 1.615 10.857 1.00 0.00 C ATOM 746 SD MET A 222 -3.477 1.389 12.641 1.00 0.00 S ATOM 747 CE MET A 222 -2.572 2.860 13.110 1.00 0.00 C ATOM 0 H MET A 222 -5.436 -0.320 9.699 1.00 0.00 H new ATOM 0 HA MET A 222 -2.720 -1.240 9.084 1.00 0.00 H new ATOM 0 HB2 MET A 222 -1.802 0.458 10.678 1.00 0.00 H new ATOM 0 HB3 MET A 222 -2.377 1.129 9.165 1.00 0.00 H new ATOM 0 HG2 MET A 222 -3.314 2.639 10.606 1.00 0.00 H new ATOM 0 HG3 MET A 222 -4.624 1.477 10.541 1.00 0.00 H new ATOM 0 HE1 MET A 222 -2.422 2.866 14.190 1.00 0.00 H new ATOM 0 HE2 MET A 222 -1.604 2.867 12.609 1.00 0.00 H new ATOM 0 HE3 MET A 222 -3.138 3.744 12.817 1.00 0.00 H new ATOM 757 N ILE A 223 -2.584 -2.338 11.339 1.00 0.00 N ATOM 758 CA ILE A 223 -2.653 -3.194 12.518 1.00 0.00 C ATOM 759 C ILE A 223 -2.022 -2.519 13.732 1.00 0.00 C ATOM 760 O ILE A 223 -0.833 -2.199 13.728 1.00 0.00 O ATOM 761 CB ILE A 223 -1.943 -4.540 12.272 1.00 0.00 C ATOM 762 CG1 ILE A 223 -2.274 -5.076 10.876 1.00 0.00 C ATOM 763 CG2 ILE A 223 -2.331 -5.549 13.343 1.00 0.00 C ATOM 764 CD1 ILE A 223 -3.748 -5.322 10.643 1.00 0.00 C ATOM 0 H ILE A 223 -1.726 -2.437 10.796 1.00 0.00 H new ATOM 0 HA ILE A 223 -3.710 -3.373 12.715 1.00 0.00 H new ATOM 0 HB ILE A 223 -0.866 -4.378 12.328 1.00 0.00 H new ATOM 0 HG12 ILE A 223 -1.913 -4.367 10.131 1.00 0.00 H new ATOM 0 HG13 ILE A 223 -1.732 -6.008 10.718 1.00 0.00 H new ATOM 0 HG21 ILE A 223 -1.821 -6.494 13.155 1.00 0.00 H new ATOM 0 HG22 ILE A 223 -2.041 -5.169 14.323 1.00 0.00 H new ATOM 0 HG23 ILE A 223 -3.409 -5.708 13.320 1.00 0.00 H new ATOM 0 HD11 ILE A 223 -3.898 -5.700 9.632 1.00 0.00 H new ATOM 0 HD12 ILE A 223 -4.113 -6.055 11.363 1.00 0.00 H new ATOM 0 HD13 ILE A 223 -4.297 -4.388 10.766 1.00 0.00 H new ATOM 776 N SER A 224 -2.825 -2.307 14.769 1.00 0.00 N ATOM 777 CA SER A 224 -2.346 -1.676 15.994 1.00 0.00 C ATOM 778 C SER A 224 -3.024 -2.279 17.218 1.00 0.00 C ATOM 779 O SER A 224 -4.185 -2.684 17.160 1.00 0.00 O ATOM 780 CB SER A 224 -2.594 -0.167 15.949 1.00 0.00 C ATOM 781 OG SER A 224 -1.819 0.448 14.935 1.00 0.00 O ATOM 0 H SER A 224 -3.812 -2.563 14.786 1.00 0.00 H new ATOM 0 HA SER A 224 -1.274 -1.857 16.069 1.00 0.00 H new ATOM 0 HB2 SER A 224 -3.652 0.025 15.769 1.00 0.00 H new ATOM 0 HB3 SER A 224 -2.349 0.274 16.915 1.00 0.00 H new ATOM 0 HG SER A 224 -2.295 0.392 14.080 1.00 0.00 H new ATOM 815 N LYS A 228 -5.739 -5.489 15.638 1.00 0.00 N ATOM 816 CA LYS A 228 -6.989 -4.892 15.180 1.00 0.00 C ATOM 817 C LYS A 228 -6.755 -4.009 13.959 1.00 0.00 C ATOM 818 O LYS A 228 -5.748 -3.306 13.873 1.00 0.00 O ATOM 819 CB LYS A 228 -7.630 -4.072 16.302 1.00 0.00 C ATOM 820 CG LYS A 228 -7.974 -4.890 17.538 1.00 0.00 C ATOM 821 CD LYS A 228 -9.037 -5.936 17.239 1.00 0.00 C ATOM 822 CE LYS A 228 -9.386 -6.746 18.477 1.00 0.00 C ATOM 823 NZ LYS A 228 -8.203 -7.469 19.020 1.00 0.00 N ATOM 0 HA LYS A 228 -7.665 -5.699 14.898 1.00 0.00 H new ATOM 0 HB2 LYS A 228 -6.951 -3.269 16.586 1.00 0.00 H new ATOM 0 HB3 LYS A 228 -8.538 -3.603 15.924 1.00 0.00 H new ATOM 0 HG2 LYS A 228 -7.075 -5.380 17.912 1.00 0.00 H new ATOM 0 HG3 LYS A 228 -8.327 -4.227 18.327 1.00 0.00 H new ATOM 0 HD2 LYS A 228 -9.934 -5.447 16.859 1.00 0.00 H new ATOM 0 HD3 LYS A 228 -8.681 -6.604 16.454 1.00 0.00 H new ATOM 0 HE2 LYS A 228 -9.789 -6.083 19.243 1.00 0.00 H new ATOM 0 HE3 LYS A 228 -10.169 -7.464 18.232 1.00 0.00 H new ATOM 0 HZ1 LYS A 228 -8.517 -8.173 19.718 1.00 0.00 H new ATOM 0 HZ2 LYS A 228 -7.703 -7.949 18.244 1.00 0.00 H new ATOM 0 HZ3 LYS A 228 -7.561 -6.790 19.478 1.00 0.00 H new ATOM 837 N GLU A 229 -7.693 -4.050 13.018 1.00 0.00 N ATOM 838 CA GLU A 229 -7.591 -3.255 11.799 1.00 0.00 C ATOM 839 C GLU A 229 -8.381 -1.957 11.918 1.00 0.00 C ATOM 840 O GLU A 229 -9.589 -1.973 12.159 1.00 0.00 O ATOM 841 CB GLU A 229 -8.103 -4.052 10.597 1.00 0.00 C ATOM 842 CG GLU A 229 -7.042 -4.909 9.934 1.00 0.00 C ATOM 843 CD GLU A 229 -7.622 -5.853 8.900 1.00 0.00 C ATOM 844 OE1 GLU A 229 -8.234 -5.364 7.928 1.00 0.00 O ATOM 845 OE2 GLU A 229 -7.470 -7.082 9.067 1.00 0.00 O ATOM 0 H GLU A 229 -8.533 -4.626 13.076 1.00 0.00 H new ATOM 0 HA GLU A 229 -6.539 -3.011 11.653 1.00 0.00 H new ATOM 0 HB2 GLU A 229 -8.924 -4.692 10.920 1.00 0.00 H new ATOM 0 HB3 GLU A 229 -8.510 -3.359 9.860 1.00 0.00 H new ATOM 0 HG2 GLU A 229 -6.303 -4.264 9.459 1.00 0.00 H new ATOM 0 HG3 GLU A 229 -6.518 -5.487 10.695 1.00 0.00 H new ATOM 852 N THR A 230 -7.692 -0.834 11.748 1.00 0.00 N ATOM 853 CA THR A 230 -8.336 0.471 11.815 1.00 0.00 C ATOM 854 C THR A 230 -7.863 1.354 10.670 1.00 0.00 C ATOM 855 O THR A 230 -6.676 1.384 10.354 1.00 0.00 O ATOM 856 CB THR A 230 -8.065 1.180 13.156 1.00 0.00 C ATOM 857 OG1 THR A 230 -8.611 2.504 13.131 1.00 0.00 O ATOM 858 CG2 THR A 230 -6.576 1.247 13.447 1.00 0.00 C ATOM 0 H THR A 230 -6.689 -0.802 11.563 1.00 0.00 H new ATOM 0 HA THR A 230 -9.410 0.304 11.732 1.00 0.00 H new ATOM 0 HB THR A 230 -8.546 0.603 13.946 1.00 0.00 H new ATOM 0 HG1 THR A 230 -8.436 2.946 13.988 1.00 0.00 H new ATOM 0 HG21 THR A 230 -6.414 1.752 14.399 1.00 0.00 H new ATOM 0 HG22 THR A 230 -6.169 0.237 13.498 1.00 0.00 H new ATOM 0 HG23 THR A 230 -6.075 1.800 12.653 1.00 0.00 H new ATOM 866 N LEU A 231 -8.795 2.063 10.046 1.00 0.00 N ATOM 867 CA LEU A 231 -8.460 2.933 8.926 1.00 0.00 C ATOM 868 C LEU A 231 -7.832 4.239 9.416 1.00 0.00 C ATOM 869 O LEU A 231 -8.511 5.076 10.011 1.00 0.00 O ATOM 870 CB LEU A 231 -9.708 3.230 8.092 1.00 0.00 C ATOM 871 CG LEU A 231 -9.446 3.549 6.619 1.00 0.00 C ATOM 872 CD1 LEU A 231 -10.744 3.529 5.832 1.00 0.00 C ATOM 873 CD2 LEU A 231 -8.763 4.896 6.479 1.00 0.00 C ATOM 0 H LEU A 231 -9.784 2.053 10.295 1.00 0.00 H new ATOM 0 HA LEU A 231 -7.731 2.416 8.302 1.00 0.00 H new ATOM 0 HB2 LEU A 231 -10.376 2.370 8.148 1.00 0.00 H new ATOM 0 HB3 LEU A 231 -10.234 4.072 8.542 1.00 0.00 H new ATOM 0 HG LEU A 231 -8.784 2.783 6.214 1.00 0.00 H new ATOM 0 HD11 LEU A 231 -10.539 3.758 4.786 1.00 0.00 H new ATOM 0 HD12 LEU A 231 -11.198 2.541 5.905 1.00 0.00 H new ATOM 0 HD13 LEU A 231 -11.428 4.274 6.239 1.00 0.00 H new ATOM 0 HD21 LEU A 231 -8.585 5.106 5.424 1.00 0.00 H new ATOM 0 HD22 LEU A 231 -9.401 5.673 6.901 1.00 0.00 H new ATOM 0 HD23 LEU A 231 -7.812 4.879 7.011 1.00 0.00 H new ATOM 885 N PRO A 232 -6.522 4.425 9.170 1.00 0.00 N ATOM 886 CA PRO A 232 -5.802 5.634 9.585 1.00 0.00 C ATOM 887 C PRO A 232 -6.109 6.827 8.688 1.00 0.00 C ATOM 888 O PRO A 232 -6.629 6.666 7.584 1.00 0.00 O ATOM 889 CB PRO A 232 -4.336 5.226 9.444 1.00 0.00 C ATOM 890 CG PRO A 232 -4.337 4.214 8.351 1.00 0.00 C ATOM 891 CD PRO A 232 -5.639 3.472 8.470 1.00 0.00 C ATOM 0 HA PRO A 232 -6.080 5.955 10.589 1.00 0.00 H new ATOM 0 HB2 PRO A 232 -3.708 6.081 9.194 1.00 0.00 H new ATOM 0 HB3 PRO A 232 -3.949 4.807 10.373 1.00 0.00 H new ATOM 0 HG2 PRO A 232 -4.250 4.694 7.376 1.00 0.00 H new ATOM 0 HG3 PRO A 232 -3.491 3.534 8.449 1.00 0.00 H new ATOM 0 HD2 PRO A 232 -6.037 3.202 7.492 1.00 0.00 H new ATOM 0 HD3 PRO A 232 -5.522 2.546 9.033 1.00 0.00 H new ATOM 899 N ASN A 233 -5.787 8.026 9.168 1.00 0.00 N ATOM 900 CA ASN A 233 -6.025 9.247 8.405 1.00 0.00 C ATOM 901 C ASN A 233 -5.473 9.117 6.990 1.00 0.00 C ATOM 902 O ASN A 233 -4.263 9.188 6.776 1.00 0.00 O ATOM 903 CB ASN A 233 -5.383 10.446 9.109 1.00 0.00 C ATOM 904 CG ASN A 233 -5.965 10.688 10.488 1.00 0.00 C ATOM 905 OD1 ASN A 233 -7.243 10.369 10.660 1.00 0.00 O flip ATOM 906 ND2 ASN A 233 -5.273 11.160 11.391 1.00 0.00 N flip ATOM 0 H ASN A 233 -5.361 8.177 10.082 1.00 0.00 H new ATOM 0 HA ASN A 233 -7.102 9.406 8.343 1.00 0.00 H new ATOM 0 HB2 ASN A 233 -4.309 10.281 9.195 1.00 0.00 H new ATOM 0 HB3 ASN A 233 -5.520 11.338 8.498 1.00 0.00 H new ATOM 0 HD21 ASN A 233 -4.295 11.391 11.216 1.00 0.00 H new ATOM 0 HD22 ASN A 233 -5.678 11.320 12.313 1.00 0.00 H new ATOM 913 N SER A 234 -6.369 8.924 6.026 1.00 0.00 N ATOM 914 CA SER A 234 -5.974 8.772 4.631 1.00 0.00 C ATOM 915 C SER A 234 -6.440 9.956 3.790 1.00 0.00 C ATOM 916 O SER A 234 -7.397 10.646 4.142 1.00 0.00 O ATOM 917 CB SER A 234 -6.549 7.474 4.062 1.00 0.00 C ATOM 918 OG SER A 234 -6.274 7.358 2.678 1.00 0.00 O ATOM 0 H SER A 234 -7.375 8.869 6.187 1.00 0.00 H new ATOM 0 HA SER A 234 -4.885 8.736 4.593 1.00 0.00 H new ATOM 0 HB2 SER A 234 -6.125 6.622 4.593 1.00 0.00 H new ATOM 0 HB3 SER A 234 -7.626 7.448 4.225 1.00 0.00 H new ATOM 0 HG SER A 234 -6.651 6.519 2.339 1.00 0.00 H new ATOM 924 N HIS A 235 -5.752 10.182 2.674 1.00 0.00 N ATOM 925 CA HIS A 235 -6.087 11.274 1.768 1.00 0.00 C ATOM 926 C HIS A 235 -5.905 10.841 0.317 1.00 0.00 C ATOM 927 O HIS A 235 -5.305 9.802 0.043 1.00 0.00 O ATOM 928 CB HIS A 235 -5.216 12.498 2.061 1.00 0.00 C ATOM 929 CG HIS A 235 -5.428 13.073 3.427 1.00 0.00 C ATOM 930 ND1 HIS A 235 -4.552 12.871 4.473 1.00 0.00 N ATOM 931 CD2 HIS A 235 -6.422 13.851 3.916 1.00 0.00 C ATOM 932 CE1 HIS A 235 -5.000 13.500 5.547 1.00 0.00 C ATOM 933 NE2 HIS A 235 -6.132 14.102 5.234 1.00 0.00 N ATOM 0 H HIS A 235 -4.955 9.619 2.375 1.00 0.00 H new ATOM 0 HA HIS A 235 -7.132 11.540 1.926 1.00 0.00 H new ATOM 0 HB2 HIS A 235 -4.167 12.222 1.951 1.00 0.00 H new ATOM 0 HB3 HIS A 235 -5.423 13.267 1.316 1.00 0.00 H new ATOM 0 HD2 HIS A 235 -7.283 14.208 3.371 1.00 0.00 H new ATOM 0 HE1 HIS A 235 -4.521 13.518 6.515 1.00 0.00 H new ATOM 0 HE2 HIS A 235 -6.700 14.663 5.869 1.00 0.00 H new ATOM 942 N VAL A 236 -6.424 11.640 -0.609 1.00 0.00 N ATOM 943 CA VAL A 236 -6.315 11.330 -2.031 1.00 0.00 C ATOM 944 C VAL A 236 -5.618 12.453 -2.792 1.00 0.00 C ATOM 945 O VAL A 236 -5.948 13.628 -2.628 1.00 0.00 O ATOM 946 CB VAL A 236 -7.700 11.080 -2.659 1.00 0.00 C ATOM 947 CG1 VAL A 236 -8.289 9.773 -2.148 1.00 0.00 C ATOM 948 CG2 VAL A 236 -8.638 12.244 -2.375 1.00 0.00 C ATOM 0 H VAL A 236 -6.923 12.505 -0.402 1.00 0.00 H new ATOM 0 HA VAL A 236 -5.718 10.421 -2.109 1.00 0.00 H new ATOM 0 HB VAL A 236 -7.578 11.001 -3.739 1.00 0.00 H new ATOM 0 HG11 VAL A 236 -9.267 9.613 -2.602 1.00 0.00 H new ATOM 0 HG12 VAL A 236 -7.627 8.948 -2.411 1.00 0.00 H new ATOM 0 HG13 VAL A 236 -8.395 9.821 -1.064 1.00 0.00 H new ATOM 0 HG21 VAL A 236 -9.610 12.047 -2.827 1.00 0.00 H new ATOM 0 HG22 VAL A 236 -8.756 12.362 -1.298 1.00 0.00 H new ATOM 0 HG23 VAL A 236 -8.221 13.159 -2.796 1.00 0.00 H new ATOM 958 N VAL A 237 -4.649 12.082 -3.625 1.00 0.00 N ATOM 959 CA VAL A 237 -3.905 13.055 -4.417 1.00 0.00 C ATOM 960 C VAL A 237 -3.621 12.522 -5.818 1.00 0.00 C ATOM 961 O VAL A 237 -3.968 11.385 -6.142 1.00 0.00 O ATOM 962 CB VAL A 237 -2.571 13.434 -3.742 1.00 0.00 C ATOM 963 CG1 VAL A 237 -2.824 14.170 -2.436 1.00 0.00 C ATOM 964 CG2 VAL A 237 -1.715 12.200 -3.508 1.00 0.00 C ATOM 0 H VAL A 237 -4.361 11.114 -3.768 1.00 0.00 H new ATOM 0 HA VAL A 237 -4.530 13.945 -4.489 1.00 0.00 H new ATOM 0 HB VAL A 237 -2.027 14.101 -4.411 1.00 0.00 H new ATOM 0 HG11 VAL A 237 -1.871 14.429 -1.974 1.00 0.00 H new ATOM 0 HG12 VAL A 237 -3.390 15.080 -2.635 1.00 0.00 H new ATOM 0 HG13 VAL A 237 -3.392 13.529 -1.761 1.00 0.00 H new ATOM 0 HG21 VAL A 237 -0.779 12.491 -3.031 1.00 0.00 H new ATOM 0 HG22 VAL A 237 -2.250 11.503 -2.862 1.00 0.00 H new ATOM 0 HG23 VAL A 237 -1.501 11.719 -4.463 1.00 0.00 H new ATOM 974 N GLY A 238 -2.990 13.352 -6.644 1.00 0.00 N ATOM 975 CA GLY A 238 -2.671 12.948 -8.001 1.00 0.00 C ATOM 976 C GLY A 238 -3.345 13.820 -9.041 1.00 0.00 C ATOM 977 O GLY A 238 -4.295 14.541 -8.734 1.00 0.00 O ATOM 0 H GLY A 238 -2.694 14.297 -6.397 1.00 0.00 H new ATOM 0 HA2 GLY A 238 -1.591 12.987 -8.144 1.00 0.00 H new ATOM 0 HA3 GLY A 238 -2.975 11.912 -8.149 1.00 0.00 H new ATOM 981 N GLU A 239 -2.856 13.753 -10.274 1.00 0.00 N ATOM 982 CA GLU A 239 -3.418 14.543 -11.365 1.00 0.00 C ATOM 983 C GLU A 239 -4.643 13.854 -11.960 1.00 0.00 C ATOM 984 O GLU A 239 -5.317 14.408 -12.829 1.00 0.00 O ATOM 985 CB GLU A 239 -2.367 14.769 -12.453 1.00 0.00 C ATOM 986 CG GLU A 239 -1.127 15.496 -11.959 1.00 0.00 C ATOM 987 CD GLU A 239 -0.097 15.701 -13.053 1.00 0.00 C ATOM 988 OE1 GLU A 239 0.766 14.816 -13.230 1.00 0.00 O ATOM 989 OE2 GLU A 239 -0.152 16.749 -13.731 1.00 0.00 O ATOM 0 H GLU A 239 -2.071 13.160 -10.544 1.00 0.00 H new ATOM 0 HA GLU A 239 -3.726 15.508 -10.961 1.00 0.00 H new ATOM 0 HB2 GLU A 239 -2.072 13.805 -12.867 1.00 0.00 H new ATOM 0 HB3 GLU A 239 -2.814 15.342 -13.265 1.00 0.00 H new ATOM 0 HG2 GLU A 239 -1.416 16.465 -11.551 1.00 0.00 H new ATOM 0 HG3 GLU A 239 -0.678 14.928 -11.144 1.00 0.00 H new ATOM 996 N ASN A 240 -4.923 12.645 -11.485 1.00 0.00 N ATOM 997 CA ASN A 240 -6.066 11.877 -11.968 1.00 0.00 C ATOM 998 C ASN A 240 -6.779 11.185 -10.813 1.00 0.00 C ATOM 999 O ASN A 240 -7.624 10.314 -11.026 1.00 0.00 O ATOM 1000 CB ASN A 240 -5.612 10.837 -12.994 1.00 0.00 C ATOM 1001 CG ASN A 240 -4.866 11.459 -14.158 1.00 0.00 C ATOM 1002 OD1 ASN A 240 -3.644 11.603 -14.122 1.00 0.00 O ATOM 1003 ND2 ASN A 240 -5.599 11.833 -15.200 1.00 0.00 N ATOM 0 H ASN A 240 -4.374 12.175 -10.765 1.00 0.00 H new ATOM 0 HA ASN A 240 -6.762 12.568 -12.444 1.00 0.00 H new ATOM 0 HB2 ASN A 240 -4.970 10.104 -12.505 1.00 0.00 H new ATOM 0 HB3 ASN A 240 -6.482 10.298 -13.370 1.00 0.00 H new ATOM 0 HD21 ASN A 240 -5.152 12.258 -16.012 1.00 0.00 H new ATOM 0 HD22 ASN A 240 -6.610 11.695 -15.188 1.00 0.00 H new ATOM 1010 N ARG A 241 -6.437 11.581 -9.590 1.00 0.00 N ATOM 1011 CA ARG A 241 -7.038 10.995 -8.397 1.00 0.00 C ATOM 1012 C ARG A 241 -6.865 9.479 -8.404 1.00 0.00 C ATOM 1013 O ARG A 241 -7.809 8.736 -8.671 1.00 0.00 O ATOM 1014 CB ARG A 241 -8.522 11.356 -8.309 1.00 0.00 C ATOM 1015 CG ARG A 241 -8.782 12.852 -8.256 1.00 0.00 C ATOM 1016 CD ARG A 241 -10.266 13.158 -8.140 1.00 0.00 C ATOM 1017 NE ARG A 241 -10.847 12.596 -6.923 1.00 0.00 N ATOM 1018 CZ ARG A 241 -12.081 12.860 -6.504 1.00 0.00 C ATOM 1019 NH1 ARG A 241 -12.861 13.675 -7.200 1.00 0.00 N ATOM 1020 NH2 ARG A 241 -12.536 12.308 -5.388 1.00 0.00 N ATOM 0 H ARG A 241 -5.746 12.306 -9.400 1.00 0.00 H new ATOM 0 HA ARG A 241 -6.530 11.402 -7.523 1.00 0.00 H new ATOM 0 HB2 ARG A 241 -9.041 10.936 -9.170 1.00 0.00 H new ATOM 0 HB3 ARG A 241 -8.949 10.890 -7.421 1.00 0.00 H new ATOM 0 HG2 ARG A 241 -8.253 13.284 -7.406 1.00 0.00 H new ATOM 0 HG3 ARG A 241 -8.382 13.324 -9.154 1.00 0.00 H new ATOM 0 HD2 ARG A 241 -10.415 14.238 -8.148 1.00 0.00 H new ATOM 0 HD3 ARG A 241 -10.788 12.758 -9.009 1.00 0.00 H new ATOM 0 HE ARG A 241 -10.273 11.965 -6.363 1.00 0.00 H new ATOM 0 HH11 ARG A 241 -12.515 14.102 -8.060 1.00 0.00 H new ATOM 0 HH12 ARG A 241 -13.807 13.876 -6.876 1.00 0.00 H new ATOM 0 HH21 ARG A 241 -11.939 11.680 -4.850 1.00 0.00 H new ATOM 0 HH22 ARG A 241 -13.483 12.511 -5.068 1.00 0.00 H new ATOM 1034 N ASN A 242 -5.647 9.031 -8.116 1.00 0.00 N ATOM 1035 CA ASN A 242 -5.341 7.606 -8.095 1.00 0.00 C ATOM 1036 C ASN A 242 -4.298 7.290 -7.032 1.00 0.00 C ATOM 1037 O ASN A 242 -3.760 6.184 -6.984 1.00 0.00 O ATOM 1038 CB ASN A 242 -4.835 7.155 -9.468 1.00 0.00 C ATOM 1039 CG ASN A 242 -3.442 7.671 -9.781 1.00 0.00 C ATOM 1040 OD1 ASN A 242 -3.127 8.870 -9.304 1.00 0.00 O flip ATOM 1041 ND2 ASN A 242 -2.658 6.998 -10.451 1.00 0.00 N flip ATOM 0 H ASN A 242 -4.856 9.635 -7.894 1.00 0.00 H new ATOM 0 HA ASN A 242 -6.256 7.066 -7.853 1.00 0.00 H new ATOM 0 HB2 ASN A 242 -4.832 6.066 -9.509 1.00 0.00 H new ATOM 0 HB3 ASN A 242 -5.527 7.501 -10.236 1.00 0.00 H new ATOM 0 HD21 ASN A 242 -2.940 6.081 -10.798 1.00 0.00 H new ATOM 0 HD22 ASN A 242 -1.726 7.357 -10.659 1.00 0.00 H new ATOM 1048 N ILE A 243 -4.019 8.269 -6.178 1.00 0.00 N ATOM 1049 CA ILE A 243 -3.033 8.099 -5.118 1.00 0.00 C ATOM 1050 C ILE A 243 -3.688 8.172 -3.742 1.00 0.00 C ATOM 1051 O ILE A 243 -4.754 8.765 -3.584 1.00 0.00 O ATOM 1052 CB ILE A 243 -1.933 9.171 -5.212 1.00 0.00 C ATOM 1053 CG1 ILE A 243 -1.575 9.427 -6.681 1.00 0.00 C ATOM 1054 CG2 ILE A 243 -0.709 8.749 -4.409 1.00 0.00 C ATOM 1055 CD1 ILE A 243 -0.258 10.148 -6.883 1.00 0.00 C ATOM 0 H ILE A 243 -4.462 9.188 -6.199 1.00 0.00 H new ATOM 0 HA ILE A 243 -2.586 7.114 -5.248 1.00 0.00 H new ATOM 0 HB ILE A 243 -2.305 10.102 -4.785 1.00 0.00 H new ATOM 0 HG12 ILE A 243 -1.538 8.472 -7.206 1.00 0.00 H new ATOM 0 HG13 ILE A 243 -2.371 10.013 -7.141 1.00 0.00 H new ATOM 0 HG21 ILE A 243 0.060 9.518 -4.486 1.00 0.00 H new ATOM 0 HG22 ILE A 243 -0.987 8.618 -3.363 1.00 0.00 H new ATOM 0 HG23 ILE A 243 -0.322 7.809 -4.802 1.00 0.00 H new ATOM 0 HD11 ILE A 243 -0.080 10.289 -7.949 1.00 0.00 H new ATOM 0 HD12 ILE A 243 -0.295 11.119 -6.389 1.00 0.00 H new ATOM 0 HD13 ILE A 243 0.551 9.555 -6.456 1.00 0.00 H new ATOM 1067 N ILE A 244 -3.043 7.565 -2.751 1.00 0.00 N ATOM 1068 CA ILE A 244 -3.563 7.561 -1.388 1.00 0.00 C ATOM 1069 C ILE A 244 -2.449 7.794 -0.373 1.00 0.00 C ATOM 1070 O ILE A 244 -1.627 6.910 -0.126 1.00 0.00 O ATOM 1071 CB ILE A 244 -4.270 6.231 -1.057 1.00 0.00 C ATOM 1072 CG1 ILE A 244 -5.411 5.973 -2.046 1.00 0.00 C ATOM 1073 CG2 ILE A 244 -4.792 6.250 0.373 1.00 0.00 C ATOM 1074 CD1 ILE A 244 -6.157 4.679 -1.795 1.00 0.00 C ATOM 0 H ILE A 244 -2.159 7.069 -2.866 1.00 0.00 H new ATOM 0 HA ILE A 244 -4.286 8.374 -1.326 1.00 0.00 H new ATOM 0 HB ILE A 244 -3.548 5.420 -1.148 1.00 0.00 H new ATOM 0 HG12 ILE A 244 -6.116 6.803 -1.998 1.00 0.00 H new ATOM 0 HG13 ILE A 244 -5.006 5.957 -3.058 1.00 0.00 H new ATOM 0 HG21 ILE A 244 -5.288 5.305 0.592 1.00 0.00 H new ATOM 0 HG22 ILE A 244 -3.959 6.391 1.062 1.00 0.00 H new ATOM 0 HG23 ILE A 244 -5.502 7.068 0.490 1.00 0.00 H new ATOM 0 HD11 ILE A 244 -6.949 4.566 -2.535 1.00 0.00 H new ATOM 0 HD12 ILE A 244 -5.466 3.840 -1.873 1.00 0.00 H new ATOM 0 HD13 ILE A 244 -6.593 4.698 -0.796 1.00 0.00 H new ATOM 1086 N GLU A 245 -2.424 8.987 0.215 1.00 0.00 N ATOM 1087 CA GLU A 245 -1.413 9.326 1.209 1.00 0.00 C ATOM 1088 C GLU A 245 -1.926 9.023 2.610 1.00 0.00 C ATOM 1089 O GLU A 245 -2.793 9.726 3.131 1.00 0.00 O ATOM 1090 CB GLU A 245 -1.023 10.801 1.102 1.00 0.00 C ATOM 1091 CG GLU A 245 0.016 11.235 2.122 1.00 0.00 C ATOM 1092 CD GLU A 245 0.374 12.703 2.004 1.00 0.00 C ATOM 1093 OE1 GLU A 245 -0.289 13.531 2.662 1.00 0.00 O ATOM 1094 OE2 GLU A 245 1.319 13.025 1.252 1.00 0.00 O ATOM 0 H GLU A 245 -3.092 9.733 0.020 1.00 0.00 H new ATOM 0 HA GLU A 245 -0.529 8.718 1.017 1.00 0.00 H new ATOM 0 HB2 GLU A 245 -0.638 10.994 0.101 1.00 0.00 H new ATOM 0 HB3 GLU A 245 -1.916 11.413 1.224 1.00 0.00 H new ATOM 0 HG2 GLU A 245 -0.361 11.037 3.125 1.00 0.00 H new ATOM 0 HG3 GLU A 245 0.917 10.634 1.995 1.00 0.00 H new ATOM 1101 N VAL A 246 -1.386 7.973 3.218 1.00 0.00 N ATOM 1102 CA VAL A 246 -1.796 7.575 4.557 1.00 0.00 C ATOM 1103 C VAL A 246 -0.816 8.070 5.611 1.00 0.00 C ATOM 1104 O VAL A 246 0.388 7.833 5.515 1.00 0.00 O ATOM 1105 CB VAL A 246 -1.914 6.045 4.682 1.00 0.00 C ATOM 1106 CG1 VAL A 246 -2.241 5.649 6.113 1.00 0.00 C ATOM 1107 CG2 VAL A 246 -2.960 5.502 3.724 1.00 0.00 C ATOM 0 H VAL A 246 -0.664 7.383 2.804 1.00 0.00 H new ATOM 0 HA VAL A 246 -2.772 8.029 4.725 1.00 0.00 H new ATOM 0 HB VAL A 246 -0.952 5.608 4.415 1.00 0.00 H new ATOM 0 HG11 VAL A 246 -2.320 4.564 6.181 1.00 0.00 H new ATOM 0 HG12 VAL A 246 -1.450 5.997 6.777 1.00 0.00 H new ATOM 0 HG13 VAL A 246 -3.188 6.101 6.408 1.00 0.00 H new ATOM 0 HG21 VAL A 246 -3.025 4.419 3.831 1.00 0.00 H new ATOM 0 HG22 VAL A 246 -3.928 5.948 3.952 1.00 0.00 H new ATOM 0 HG23 VAL A 246 -2.679 5.749 2.700 1.00 0.00 H new ATOM 1117 N GLU A 247 -1.339 8.760 6.618 1.00 0.00 N ATOM 1118 CA GLU A 247 -0.512 9.262 7.703 1.00 0.00 C ATOM 1119 C GLU A 247 -0.120 8.108 8.617 1.00 0.00 C ATOM 1120 O GLU A 247 -0.772 7.063 8.610 1.00 0.00 O ATOM 1121 CB GLU A 247 -1.261 10.336 8.497 1.00 0.00 C ATOM 1122 CG GLU A 247 -1.661 11.542 7.663 1.00 0.00 C ATOM 1123 CD GLU A 247 -2.274 12.651 8.495 1.00 0.00 C ATOM 1124 OE1 GLU A 247 -1.510 13.397 9.144 1.00 0.00 O ATOM 1125 OE2 GLU A 247 -3.516 12.774 8.499 1.00 0.00 O ATOM 0 H GLU A 247 -2.331 8.983 6.704 1.00 0.00 H new ATOM 0 HA GLU A 247 0.388 9.713 7.285 1.00 0.00 H new ATOM 0 HB2 GLU A 247 -2.156 9.894 8.934 1.00 0.00 H new ATOM 0 HB3 GLU A 247 -0.633 10.669 9.324 1.00 0.00 H new ATOM 0 HG2 GLU A 247 -0.783 11.926 7.143 1.00 0.00 H new ATOM 0 HG3 GLU A 247 -2.373 11.230 6.899 1.00 0.00 H new ATOM 1132 N THR A 248 0.943 8.292 9.393 1.00 0.00 N ATOM 1133 CA THR A 248 1.412 7.252 10.301 1.00 0.00 C ATOM 1134 C THR A 248 1.954 6.050 9.529 1.00 0.00 C ATOM 1135 O THR A 248 1.332 5.579 8.575 1.00 0.00 O ATOM 1136 CB THR A 248 0.287 6.790 11.259 1.00 0.00 C ATOM 1137 OG1 THR A 248 0.298 7.588 12.449 1.00 0.00 O ATOM 1138 CG2 THR A 248 0.430 5.319 11.625 1.00 0.00 C ATOM 0 H THR A 248 1.495 9.150 9.411 1.00 0.00 H new ATOM 0 HA THR A 248 2.219 7.684 10.893 1.00 0.00 H new ATOM 0 HB THR A 248 -0.663 6.917 10.740 1.00 0.00 H new ATOM 0 HG1 THR A 248 -0.418 7.291 13.049 1.00 0.00 H new ATOM 0 HG21 THR A 248 -0.377 5.031 12.299 1.00 0.00 H new ATOM 0 HG22 THR A 248 0.381 4.713 10.721 1.00 0.00 H new ATOM 0 HG23 THR A 248 1.389 5.158 12.118 1.00 0.00 H new ATOM 1146 N VAL A 249 3.116 5.559 9.947 1.00 0.00 N ATOM 1147 CA VAL A 249 3.740 4.412 9.297 1.00 0.00 C ATOM 1148 C VAL A 249 3.527 3.141 10.114 1.00 0.00 C ATOM 1149 O VAL A 249 3.762 3.124 11.323 1.00 0.00 O ATOM 1150 CB VAL A 249 5.252 4.633 9.095 1.00 0.00 C ATOM 1151 CG1 VAL A 249 5.858 3.495 8.289 1.00 0.00 C ATOM 1152 CG2 VAL A 249 5.509 5.970 8.414 1.00 0.00 C ATOM 0 H VAL A 249 3.645 5.937 10.733 1.00 0.00 H new ATOM 0 HA VAL A 249 3.266 4.301 8.322 1.00 0.00 H new ATOM 0 HB VAL A 249 5.730 4.649 10.074 1.00 0.00 H new ATOM 0 HG11 VAL A 249 6.926 3.670 8.158 1.00 0.00 H new ATOM 0 HG12 VAL A 249 5.707 2.554 8.818 1.00 0.00 H new ATOM 0 HG13 VAL A 249 5.376 3.444 7.313 1.00 0.00 H new ATOM 0 HG21 VAL A 249 6.582 6.109 8.279 1.00 0.00 H new ATOM 0 HG22 VAL A 249 5.016 5.984 7.442 1.00 0.00 H new ATOM 0 HG23 VAL A 249 5.113 6.775 9.033 1.00 0.00 H new ATOM 1162 N ALA A 250 3.083 2.081 9.448 1.00 0.00 N ATOM 1163 CA ALA A 250 2.835 0.808 10.115 1.00 0.00 C ATOM 1164 C ALA A 250 3.652 -0.315 9.485 1.00 0.00 C ATOM 1165 O ALA A 250 4.181 -0.169 8.383 1.00 0.00 O ATOM 1166 CB ALA A 250 1.352 0.471 10.073 1.00 0.00 C ATOM 0 H ALA A 250 2.887 2.078 8.447 1.00 0.00 H new ATOM 0 HA ALA A 250 3.146 0.906 11.155 1.00 0.00 H new ATOM 0 HB1 ALA A 250 1.181 -0.482 10.574 1.00 0.00 H new ATOM 0 HB2 ALA A 250 0.787 1.254 10.579 1.00 0.00 H new ATOM 0 HB3 ALA A 250 1.024 0.399 9.036 1.00 0.00 H new ATOM 1172 N LYS A 251 3.750 -1.436 10.194 1.00 0.00 N ATOM 1173 CA LYS A 251 4.501 -2.589 9.708 1.00 0.00 C ATOM 1174 C LYS A 251 3.616 -3.500 8.865 1.00 0.00 C ATOM 1175 O LYS A 251 4.105 -4.233 8.006 1.00 0.00 O ATOM 1176 CB LYS A 251 5.082 -3.374 10.884 1.00 0.00 C ATOM 1177 CG LYS A 251 4.025 -3.937 11.820 1.00 0.00 C ATOM 1178 CD LYS A 251 4.652 -4.695 12.977 1.00 0.00 C ATOM 1179 CE LYS A 251 3.597 -5.292 13.892 1.00 0.00 C ATOM 1180 NZ LYS A 251 2.719 -6.257 13.174 1.00 0.00 N ATOM 0 H LYS A 251 3.318 -1.570 11.108 1.00 0.00 H new ATOM 0 HA LYS A 251 5.315 -2.223 9.082 1.00 0.00 H new ATOM 0 HB2 LYS A 251 5.688 -4.194 10.499 1.00 0.00 H new ATOM 0 HB3 LYS A 251 5.748 -2.724 11.451 1.00 0.00 H new ATOM 0 HG2 LYS A 251 3.410 -3.124 12.207 1.00 0.00 H new ATOM 0 HG3 LYS A 251 3.363 -4.601 11.265 1.00 0.00 H new ATOM 0 HD2 LYS A 251 5.290 -5.489 12.589 1.00 0.00 H new ATOM 0 HD3 LYS A 251 5.292 -4.023 13.549 1.00 0.00 H new ATOM 0 HE2 LYS A 251 4.084 -5.796 14.727 1.00 0.00 H new ATOM 0 HE3 LYS A 251 2.988 -4.492 14.314 1.00 0.00 H new ATOM 0 HZ1 LYS A 251 2.189 -6.825 13.865 1.00 0.00 H new ATOM 0 HZ2 LYS A 251 2.052 -5.736 12.569 1.00 0.00 H new ATOM 0 HZ3 LYS A 251 3.302 -6.885 12.585 1.00 0.00 H new ATOM 1194 N GLU A 252 2.313 -3.455 9.120 1.00 0.00 N ATOM 1195 CA GLU A 252 1.360 -4.275 8.381 1.00 0.00 C ATOM 1196 C GLU A 252 0.208 -3.428 7.849 1.00 0.00 C ATOM 1197 O GLU A 252 -0.478 -2.744 8.609 1.00 0.00 O ATOM 1198 CB GLU A 252 0.816 -5.392 9.271 1.00 0.00 C ATOM 1199 CG GLU A 252 1.014 -6.782 8.690 1.00 0.00 C ATOM 1200 CD GLU A 252 0.323 -7.858 9.503 1.00 0.00 C ATOM 1201 OE1 GLU A 252 -0.862 -8.142 9.228 1.00 0.00 O ATOM 1202 OE2 GLU A 252 0.968 -8.418 10.416 1.00 0.00 O ATOM 0 H GLU A 252 1.892 -2.859 9.833 1.00 0.00 H new ATOM 0 HA GLU A 252 1.884 -4.717 7.534 1.00 0.00 H new ATOM 0 HB2 GLU A 252 1.305 -5.341 10.244 1.00 0.00 H new ATOM 0 HB3 GLU A 252 -0.248 -5.226 9.439 1.00 0.00 H new ATOM 0 HG2 GLU A 252 0.633 -6.802 7.669 1.00 0.00 H new ATOM 0 HG3 GLU A 252 2.080 -7.001 8.637 1.00 0.00 H new ATOM 1209 N TRP A 253 0.007 -3.483 6.538 1.00 0.00 N ATOM 1210 CA TRP A 253 -1.060 -2.730 5.889 1.00 0.00 C ATOM 1211 C TRP A 253 -2.075 -3.674 5.253 1.00 0.00 C ATOM 1212 O TRP A 253 -1.710 -4.570 4.493 1.00 0.00 O ATOM 1213 CB TRP A 253 -0.482 -1.798 4.822 1.00 0.00 C ATOM 1214 CG TRP A 253 0.386 -0.712 5.379 1.00 0.00 C ATOM 1215 CD1 TRP A 253 1.750 -0.694 5.429 1.00 0.00 C ATOM 1216 CD2 TRP A 253 -0.054 0.519 5.964 1.00 0.00 C ATOM 1217 NE1 TRP A 253 2.185 0.474 6.008 1.00 0.00 N ATOM 1218 CE2 TRP A 253 1.097 1.235 6.346 1.00 0.00 C ATOM 1219 CE3 TRP A 253 -1.309 1.085 6.202 1.00 0.00 C ATOM 1220 CZ2 TRP A 253 1.027 2.487 6.950 1.00 0.00 C ATOM 1221 CZ3 TRP A 253 -1.376 2.328 6.803 1.00 0.00 C ATOM 1222 CH2 TRP A 253 -0.214 3.017 7.171 1.00 0.00 C ATOM 0 H TRP A 253 0.572 -4.044 5.900 1.00 0.00 H new ATOM 0 HA TRP A 253 -1.564 -2.133 6.649 1.00 0.00 H new ATOM 0 HB2 TRP A 253 0.099 -2.388 4.113 1.00 0.00 H new ATOM 0 HB3 TRP A 253 -1.302 -1.346 4.264 1.00 0.00 H new ATOM 0 HD1 TRP A 253 2.393 -1.482 5.067 1.00 0.00 H new ATOM 0 HE1 TRP A 253 3.160 0.732 6.161 1.00 0.00 H new ATOM 0 HE3 TRP A 253 -2.211 0.561 5.921 1.00 0.00 H new ATOM 0 HZ2 TRP A 253 1.922 3.021 7.234 1.00 0.00 H new ATOM 0 HZ3 TRP A 253 -2.341 2.775 6.992 1.00 0.00 H new ATOM 0 HH2 TRP A 253 -0.300 3.987 7.639 1.00 0.00 H new ATOM 1233 N ARG A 254 -3.348 -3.470 5.568 1.00 0.00 N ATOM 1234 CA ARG A 254 -4.409 -4.310 5.022 1.00 0.00 C ATOM 1235 C ARG A 254 -5.319 -3.504 4.102 1.00 0.00 C ATOM 1236 O ARG A 254 -6.139 -2.712 4.564 1.00 0.00 O ATOM 1237 CB ARG A 254 -5.229 -4.933 6.152 1.00 0.00 C ATOM 1238 CG ARG A 254 -6.209 -5.995 5.680 1.00 0.00 C ATOM 1239 CD ARG A 254 -5.488 -7.231 5.167 1.00 0.00 C ATOM 1240 NE ARG A 254 -4.630 -7.826 6.188 1.00 0.00 N ATOM 1241 CZ ARG A 254 -4.350 -9.125 6.252 1.00 0.00 C ATOM 1242 NH1 ARG A 254 -4.861 -9.961 5.359 1.00 0.00 N ATOM 1243 NH2 ARG A 254 -3.559 -9.588 7.210 1.00 0.00 N ATOM 0 H ARG A 254 -3.671 -2.734 6.196 1.00 0.00 H new ATOM 0 HA ARG A 254 -3.945 -5.106 4.440 1.00 0.00 H new ATOM 0 HB2 ARG A 254 -4.550 -5.376 6.881 1.00 0.00 H new ATOM 0 HB3 ARG A 254 -5.780 -4.146 6.667 1.00 0.00 H new ATOM 0 HG2 ARG A 254 -6.869 -6.273 6.501 1.00 0.00 H new ATOM 0 HG3 ARG A 254 -6.838 -5.585 4.890 1.00 0.00 H new ATOM 0 HD2 ARG A 254 -6.221 -7.967 4.835 1.00 0.00 H new ATOM 0 HD3 ARG A 254 -4.887 -6.965 4.298 1.00 0.00 H new ATOM 0 HE ARG A 254 -4.222 -7.211 6.892 1.00 0.00 H new ATOM 0 HH11 ARG A 254 -5.470 -9.609 4.621 1.00 0.00 H new ATOM 0 HH12 ARG A 254 -4.645 -10.957 5.410 1.00 0.00 H new ATOM 0 HH21 ARG A 254 -3.164 -8.948 7.899 1.00 0.00 H new ATOM 0 HH22 ARG A 254 -3.345 -10.584 7.258 1.00 0.00 H new ATOM 1257 N ILE A 255 -5.170 -3.715 2.797 1.00 0.00 N ATOM 1258 CA ILE A 255 -5.981 -3.005 1.815 1.00 0.00 C ATOM 1259 C ILE A 255 -7.259 -3.779 1.516 1.00 0.00 C ATOM 1260 O ILE A 255 -7.212 -4.873 0.958 1.00 0.00 O ATOM 1261 CB ILE A 255 -5.200 -2.785 0.503 1.00 0.00 C ATOM 1262 CG1 ILE A 255 -3.904 -2.019 0.782 1.00 0.00 C ATOM 1263 CG2 ILE A 255 -6.059 -2.039 -0.508 1.00 0.00 C ATOM 1264 CD1 ILE A 255 -3.007 -1.878 -0.430 1.00 0.00 C ATOM 0 H ILE A 255 -4.498 -4.369 2.397 1.00 0.00 H new ATOM 0 HA ILE A 255 -6.236 -2.034 2.240 1.00 0.00 H new ATOM 0 HB ILE A 255 -4.943 -3.757 0.081 1.00 0.00 H new ATOM 0 HG12 ILE A 255 -4.153 -1.026 1.156 1.00 0.00 H new ATOM 0 HG13 ILE A 255 -3.354 -2.529 1.573 1.00 0.00 H new ATOM 0 HG21 ILE A 255 -5.493 -1.892 -1.428 1.00 0.00 H new ATOM 0 HG22 ILE A 255 -6.956 -2.620 -0.723 1.00 0.00 H new ATOM 0 HG23 ILE A 255 -6.344 -1.070 -0.098 1.00 0.00 H new ATOM 0 HD11 ILE A 255 -2.109 -1.325 -0.156 1.00 0.00 H new ATOM 0 HD12 ILE A 255 -2.727 -2.867 -0.793 1.00 0.00 H new ATOM 0 HD13 ILE A 255 -3.538 -1.341 -1.215 1.00 0.00 H new ATOM 1276 N ARG A 256 -8.400 -3.205 1.881 1.00 0.00 N ATOM 1277 CA ARG A 256 -9.683 -3.860 1.659 1.00 0.00 C ATOM 1278 C ARG A 256 -10.679 -2.933 0.969 1.00 0.00 C ATOM 1279 O ARG A 256 -10.717 -1.732 1.237 1.00 0.00 O ATOM 1280 CB ARG A 256 -10.260 -4.345 2.992 1.00 0.00 C ATOM 1281 CG ARG A 256 -11.587 -5.073 2.854 1.00 0.00 C ATOM 1282 CD ARG A 256 -12.145 -5.474 4.210 1.00 0.00 C ATOM 1283 NE ARG A 256 -13.434 -6.150 4.093 1.00 0.00 N ATOM 1284 CZ ARG A 256 -14.176 -6.513 5.135 1.00 0.00 C ATOM 1285 NH1 ARG A 256 -13.758 -6.264 6.369 1.00 0.00 N ATOM 1286 NH2 ARG A 256 -15.336 -7.125 4.945 1.00 0.00 N ATOM 0 H ARG A 256 -8.463 -2.291 2.330 1.00 0.00 H new ATOM 0 HA ARG A 256 -9.511 -4.713 1.002 1.00 0.00 H new ATOM 0 HB2 ARG A 256 -9.539 -5.009 3.470 1.00 0.00 H new ATOM 0 HB3 ARG A 256 -10.392 -3.489 3.654 1.00 0.00 H new ATOM 0 HG2 ARG A 256 -12.303 -4.432 2.340 1.00 0.00 H new ATOM 0 HG3 ARG A 256 -11.454 -5.962 2.237 1.00 0.00 H new ATOM 0 HD2 ARG A 256 -11.436 -6.131 4.714 1.00 0.00 H new ATOM 0 HD3 ARG A 256 -12.256 -4.587 4.833 1.00 0.00 H new ATOM 0 HE ARG A 256 -13.786 -6.356 3.158 1.00 0.00 H new ATOM 0 HH11 ARG A 256 -12.866 -5.793 6.520 1.00 0.00 H new ATOM 0 HH12 ARG A 256 -14.329 -6.543 7.167 1.00 0.00 H new ATOM 0 HH21 ARG A 256 -15.661 -7.319 3.998 1.00 0.00 H new ATOM 0 HH22 ARG A 256 -15.903 -7.403 5.746 1.00 0.00 H new ATOM 1300 N LEU A 257 -11.480 -3.509 0.079 1.00 0.00 N ATOM 1301 CA LEU A 257 -12.492 -2.758 -0.654 1.00 0.00 C ATOM 1302 C LEU A 257 -13.491 -3.709 -1.300 1.00 0.00 C ATOM 1303 O LEU A 257 -13.128 -4.518 -2.156 1.00 0.00 O ATOM 1304 CB LEU A 257 -11.848 -1.876 -1.724 1.00 0.00 C ATOM 1305 CG LEU A 257 -12.836 -1.102 -2.601 1.00 0.00 C ATOM 1306 CD1 LEU A 257 -13.398 0.091 -1.843 1.00 0.00 C ATOM 1307 CD2 LEU A 257 -12.166 -0.649 -3.888 1.00 0.00 C ATOM 0 H LEU A 257 -11.447 -4.502 -0.153 1.00 0.00 H new ATOM 0 HA LEU A 257 -13.016 -2.116 0.054 1.00 0.00 H new ATOM 0 HB2 LEU A 257 -11.183 -1.164 -1.235 1.00 0.00 H new ATOM 0 HB3 LEU A 257 -11.228 -2.502 -2.366 1.00 0.00 H new ATOM 0 HG LEU A 257 -13.661 -1.766 -2.859 1.00 0.00 H new ATOM 0 HD11 LEU A 257 -14.098 0.630 -2.481 1.00 0.00 H new ATOM 0 HD12 LEU A 257 -13.915 -0.257 -0.949 1.00 0.00 H new ATOM 0 HD13 LEU A 257 -12.584 0.756 -1.555 1.00 0.00 H new ATOM 0 HD21 LEU A 257 -12.884 -0.101 -4.498 1.00 0.00 H new ATOM 0 HD22 LEU A 257 -11.322 -0.001 -3.650 1.00 0.00 H new ATOM 0 HD23 LEU A 257 -11.811 -1.520 -4.439 1.00 0.00 H new ATOM 1319 N GLY A 258 -14.749 -3.609 -0.888 1.00 0.00 N ATOM 1320 CA GLY A 258 -15.776 -4.473 -1.438 1.00 0.00 C ATOM 1321 C GLY A 258 -15.615 -5.911 -0.986 1.00 0.00 C ATOM 1322 O GLY A 258 -15.751 -6.216 0.198 1.00 0.00 O ATOM 0 H GLY A 258 -15.076 -2.947 -0.185 1.00 0.00 H new ATOM 0 HA2 GLY A 258 -16.757 -4.106 -1.136 1.00 0.00 H new ATOM 0 HA3 GLY A 258 -15.741 -4.430 -2.527 1.00 0.00 H new ATOM 1326 N ASP A 259 -15.326 -6.797 -1.934 1.00 0.00 N ATOM 1327 CA ASP A 259 -15.144 -8.212 -1.631 1.00 0.00 C ATOM 1328 C ASP A 259 -13.741 -8.676 -2.012 1.00 0.00 C ATOM 1329 O ASP A 259 -13.511 -9.865 -2.237 1.00 0.00 O ATOM 1330 CB ASP A 259 -16.190 -9.051 -2.370 1.00 0.00 C ATOM 1331 CG ASP A 259 -16.105 -8.885 -3.874 1.00 0.00 C ATOM 1332 OD1 ASP A 259 -16.780 -7.982 -4.411 1.00 0.00 O ATOM 1333 OD2 ASP A 259 -15.365 -9.660 -4.517 1.00 0.00 O ATOM 0 H ASP A 259 -15.213 -6.560 -2.919 1.00 0.00 H new ATOM 0 HA ASP A 259 -15.271 -8.347 -0.557 1.00 0.00 H new ATOM 0 HB2 ASP A 259 -16.055 -10.102 -2.115 1.00 0.00 H new ATOM 0 HB3 ASP A 259 -17.186 -8.766 -2.031 1.00 0.00 H new ATOM 1338 N LYS A 260 -12.803 -7.734 -2.077 1.00 0.00 N ATOM 1339 CA LYS A 260 -11.426 -8.052 -2.440 1.00 0.00 C ATOM 1340 C LYS A 260 -10.439 -7.411 -1.464 1.00 0.00 C ATOM 1341 O LYS A 260 -10.598 -6.253 -1.077 1.00 0.00 O ATOM 1342 CB LYS A 260 -11.142 -7.577 -3.866 1.00 0.00 C ATOM 1343 CG LYS A 260 -9.903 -8.201 -4.486 1.00 0.00 C ATOM 1344 CD LYS A 260 -9.812 -7.893 -5.973 1.00 0.00 C ATOM 1345 CE LYS A 260 -10.923 -8.577 -6.754 1.00 0.00 C ATOM 1346 NZ LYS A 260 -10.848 -8.274 -8.210 1.00 0.00 N ATOM 0 H LYS A 260 -12.972 -6.747 -1.883 1.00 0.00 H new ATOM 0 HA LYS A 260 -11.298 -9.133 -2.389 1.00 0.00 H new ATOM 0 HB2 LYS A 260 -12.004 -7.804 -4.493 1.00 0.00 H new ATOM 0 HB3 LYS A 260 -11.028 -6.493 -3.862 1.00 0.00 H new ATOM 0 HG2 LYS A 260 -9.013 -7.827 -3.980 1.00 0.00 H new ATOM 0 HG3 LYS A 260 -9.924 -9.281 -4.337 1.00 0.00 H new ATOM 0 HD2 LYS A 260 -9.869 -6.815 -6.126 1.00 0.00 H new ATOM 0 HD3 LYS A 260 -8.844 -8.219 -6.354 1.00 0.00 H new ATOM 0 HE2 LYS A 260 -10.861 -9.655 -6.604 1.00 0.00 H new ATOM 0 HE3 LYS A 260 -11.890 -8.256 -6.366 1.00 0.00 H new ATOM 0 HZ1 LYS A 260 -11.335 -9.021 -8.746 1.00 0.00 H new ATOM 0 HZ2 LYS A 260 -11.305 -7.359 -8.398 1.00 0.00 H new ATOM 0 HZ3 LYS A 260 -9.852 -8.230 -8.505 1.00 0.00 H new ATOM 1360 N VAL A 261 -9.419 -8.172 -1.073 1.00 0.00 N ATOM 1361 CA VAL A 261 -8.407 -7.681 -0.142 1.00 0.00 C ATOM 1362 C VAL A 261 -7.001 -8.019 -0.625 1.00 0.00 C ATOM 1363 O VAL A 261 -6.780 -9.053 -1.255 1.00 0.00 O ATOM 1364 CB VAL A 261 -8.592 -8.270 1.273 1.00 0.00 C ATOM 1365 CG1 VAL A 261 -8.161 -9.727 1.312 1.00 0.00 C ATOM 1366 CG2 VAL A 261 -7.806 -7.464 2.294 1.00 0.00 C ATOM 0 H VAL A 261 -9.272 -9.131 -1.387 1.00 0.00 H new ATOM 0 HA VAL A 261 -8.533 -6.599 -0.098 1.00 0.00 H new ATOM 0 HB VAL A 261 -9.651 -8.216 1.525 1.00 0.00 H new ATOM 0 HG11 VAL A 261 -8.300 -10.121 2.319 1.00 0.00 H new ATOM 0 HG12 VAL A 261 -8.764 -10.304 0.610 1.00 0.00 H new ATOM 0 HG13 VAL A 261 -7.110 -9.803 1.035 1.00 0.00 H new ATOM 0 HG21 VAL A 261 -7.949 -7.894 3.285 1.00 0.00 H new ATOM 0 HG22 VAL A 261 -6.747 -7.486 2.038 1.00 0.00 H new ATOM 0 HG23 VAL A 261 -8.158 -6.432 2.292 1.00 0.00 H new ATOM 1376 N VAL A 262 -6.056 -7.136 -0.329 1.00 0.00 N ATOM 1377 CA VAL A 262 -4.670 -7.345 -0.712 1.00 0.00 C ATOM 1378 C VAL A 262 -3.754 -7.160 0.495 1.00 0.00 C ATOM 1379 O VAL A 262 -3.748 -6.101 1.124 1.00 0.00 O ATOM 1380 CB VAL A 262 -4.236 -6.380 -1.833 1.00 0.00 C ATOM 1381 CG1 VAL A 262 -2.772 -6.593 -2.190 1.00 0.00 C ATOM 1382 CG2 VAL A 262 -5.121 -6.552 -3.057 1.00 0.00 C ATOM 0 H VAL A 262 -6.227 -6.267 0.177 1.00 0.00 H new ATOM 0 HA VAL A 262 -4.587 -8.365 -1.087 1.00 0.00 H new ATOM 0 HB VAL A 262 -4.350 -5.359 -1.470 1.00 0.00 H new ATOM 0 HG11 VAL A 262 -2.487 -5.902 -2.983 1.00 0.00 H new ATOM 0 HG12 VAL A 262 -2.153 -6.412 -1.311 1.00 0.00 H new ATOM 0 HG13 VAL A 262 -2.626 -7.618 -2.532 1.00 0.00 H new ATOM 0 HG21 VAL A 262 -4.800 -5.863 -3.838 1.00 0.00 H new ATOM 0 HG22 VAL A 262 -5.042 -7.576 -3.422 1.00 0.00 H new ATOM 0 HG23 VAL A 262 -6.156 -6.341 -2.790 1.00 0.00 H new ATOM 1392 N GLY A 263 -2.982 -8.195 0.814 1.00 0.00 N ATOM 1393 CA GLY A 263 -2.086 -8.127 1.954 1.00 0.00 C ATOM 1394 C GLY A 263 -0.765 -7.456 1.638 1.00 0.00 C ATOM 1395 O GLY A 263 0.053 -7.996 0.895 1.00 0.00 O ATOM 0 H GLY A 263 -2.961 -9.078 0.304 1.00 0.00 H new ATOM 0 HA2 GLY A 263 -2.577 -7.584 2.762 1.00 0.00 H new ATOM 0 HA3 GLY A 263 -1.895 -9.136 2.318 1.00 0.00 H new ATOM 1399 N VAL A 264 -0.558 -6.272 2.206 1.00 0.00 N ATOM 1400 CA VAL A 264 0.675 -5.525 1.996 1.00 0.00 C ATOM 1401 C VAL A 264 1.392 -5.299 3.322 1.00 0.00 C ATOM 1402 O VAL A 264 0.873 -4.620 4.204 1.00 0.00 O ATOM 1403 CB VAL A 264 0.403 -4.159 1.337 1.00 0.00 C ATOM 1404 CG1 VAL A 264 1.705 -3.411 1.092 1.00 0.00 C ATOM 1405 CG2 VAL A 264 -0.368 -4.340 0.040 1.00 0.00 C ATOM 0 H VAL A 264 -1.231 -5.809 2.817 1.00 0.00 H new ATOM 0 HA VAL A 264 1.302 -6.118 1.330 1.00 0.00 H new ATOM 0 HB VAL A 264 -0.206 -3.563 2.017 1.00 0.00 H new ATOM 0 HG11 VAL A 264 1.490 -2.449 0.626 1.00 0.00 H new ATOM 0 HG12 VAL A 264 2.215 -3.248 2.041 1.00 0.00 H new ATOM 0 HG13 VAL A 264 2.344 -3.999 0.433 1.00 0.00 H new ATOM 0 HG21 VAL A 264 -0.552 -3.366 -0.413 1.00 0.00 H new ATOM 0 HG22 VAL A 264 0.214 -4.955 -0.646 1.00 0.00 H new ATOM 0 HG23 VAL A 264 -1.320 -4.829 0.248 1.00 0.00 H new ATOM 1415 N ARG A 265 2.585 -5.863 3.456 1.00 0.00 N ATOM 1416 CA ARG A 265 3.354 -5.722 4.685 1.00 0.00 C ATOM 1417 C ARG A 265 4.594 -4.862 4.465 1.00 0.00 C ATOM 1418 O ARG A 265 5.359 -5.084 3.527 1.00 0.00 O ATOM 1419 CB ARG A 265 3.760 -7.100 5.214 1.00 0.00 C ATOM 1420 CG ARG A 265 4.303 -7.076 6.631 1.00 0.00 C ATOM 1421 CD ARG A 265 4.881 -8.424 7.028 1.00 0.00 C ATOM 1422 NE ARG A 265 5.448 -8.404 8.373 1.00 0.00 N ATOM 1423 CZ ARG A 265 6.034 -9.453 8.945 1.00 0.00 C ATOM 1424 NH1 ARG A 265 6.129 -10.602 8.288 1.00 0.00 N ATOM 1425 NH2 ARG A 265 6.523 -9.353 10.172 1.00 0.00 N ATOM 0 H ARG A 265 3.040 -6.420 2.732 1.00 0.00 H new ATOM 0 HA ARG A 265 2.723 -5.225 5.422 1.00 0.00 H new ATOM 0 HB2 ARG A 265 2.895 -7.762 5.177 1.00 0.00 H new ATOM 0 HB3 ARG A 265 4.515 -7.525 4.553 1.00 0.00 H new ATOM 0 HG2 ARG A 265 5.074 -6.310 6.714 1.00 0.00 H new ATOM 0 HG3 ARG A 265 3.506 -6.802 7.323 1.00 0.00 H new ATOM 0 HD2 ARG A 265 4.100 -9.182 6.976 1.00 0.00 H new ATOM 0 HD3 ARG A 265 5.653 -8.711 6.314 1.00 0.00 H new ATOM 0 HE ARG A 265 5.392 -7.536 8.905 1.00 0.00 H new ATOM 0 HH11 ARG A 265 5.753 -10.682 7.343 1.00 0.00 H new ATOM 0 HH12 ARG A 265 6.578 -11.405 8.728 1.00 0.00 H new ATOM 0 HH21 ARG A 265 6.451 -8.471 10.680 1.00 0.00 H new ATOM 0 HH22 ARG A 265 6.972 -10.158 10.609 1.00 0.00 H new ATOM 1439 N ASN A 266 4.783 -3.876 5.337 1.00 0.00 N ATOM 1440 CA ASN A 266 5.929 -2.980 5.248 1.00 0.00 C ATOM 1441 C ASN A 266 7.069 -3.466 6.137 1.00 0.00 C ATOM 1442 O ASN A 266 6.962 -3.442 7.364 1.00 0.00 O ATOM 1443 CB ASN A 266 5.521 -1.561 5.654 1.00 0.00 C ATOM 1444 CG ASN A 266 6.688 -0.593 5.645 1.00 0.00 C ATOM 1445 OD1 ASN A 266 6.628 0.411 6.511 1.00 0.00 O flip ATOM 1446 ND2 ASN A 266 7.632 -0.746 4.870 1.00 0.00 N flip ATOM 0 H ASN A 266 4.154 -3.678 6.115 1.00 0.00 H new ATOM 0 HA ASN A 266 6.276 -2.972 4.215 1.00 0.00 H new ATOM 0 HB2 ASN A 266 4.749 -1.200 4.974 1.00 0.00 H new ATOM 0 HB3 ASN A 266 5.081 -1.585 6.651 1.00 0.00 H new ATOM 0 HD21 ASN A 266 7.636 -1.533 4.221 1.00 0.00 H new ATOM 0 HD22 ASN A 266 8.410 -0.086 4.877 1.00 0.00 H new ATOM 1453 N ASN A 267 8.158 -3.908 5.515 1.00 0.00 N ATOM 1454 CA ASN A 267 9.313 -4.395 6.260 1.00 0.00 C ATOM 1455 C ASN A 267 10.416 -3.344 6.296 1.00 0.00 C ATOM 1456 O ASN A 267 11.385 -3.422 5.542 1.00 0.00 O ATOM 1457 CB ASN A 267 9.845 -5.681 5.624 1.00 0.00 C ATOM 1458 CG ASN A 267 8.809 -6.788 5.603 1.00 0.00 C ATOM 1459 OD1 ASN A 267 8.711 -7.580 6.541 1.00 0.00 O ATOM 1460 ND2 ASN A 267 8.029 -6.849 4.530 1.00 0.00 N ATOM 0 H ASN A 267 8.264 -3.939 4.501 1.00 0.00 H new ATOM 0 HA ASN A 267 8.997 -4.602 7.282 1.00 0.00 H new ATOM 0 HB2 ASN A 267 10.169 -5.472 4.605 1.00 0.00 H new ATOM 0 HB3 ASN A 267 10.723 -6.019 6.175 1.00 0.00 H new ATOM 0 HD21 ASN A 267 7.314 -7.573 4.460 1.00 0.00 H new ATOM 0 HD22 ASN A 267 8.145 -6.172 3.776 1.00 0.00 H new ATOM 1556 N PRO B 23 -11.522 -13.068 -0.593 1.00 0.00 N ATOM 1557 CA PRO B 23 -10.173 -12.899 -1.140 1.00 0.00 C ATOM 1558 C PRO B 23 -9.097 -13.468 -0.220 1.00 0.00 C ATOM 1559 O PRO B 23 -8.573 -14.553 -0.468 1.00 0.00 O ATOM 1560 CB PRO B 23 -10.027 -11.381 -1.274 1.00 0.00 C ATOM 1561 CG PRO B 23 -10.967 -10.820 -0.263 1.00 0.00 C ATOM 1562 CD PRO B 23 -12.118 -11.784 -0.179 1.00 0.00 C ATOM 0 HA PRO B 23 -10.046 -13.433 -2.082 1.00 0.00 H new ATOM 0 HB2 PRO B 23 -9.002 -11.063 -1.081 1.00 0.00 H new ATOM 0 HB3 PRO B 23 -10.281 -11.046 -2.280 1.00 0.00 H new ATOM 0 HG2 PRO B 23 -10.478 -10.712 0.705 1.00 0.00 H new ATOM 0 HG3 PRO B 23 -11.310 -9.829 -0.559 1.00 0.00 H new ATOM 0 HD2 PRO B 23 -12.524 -11.837 0.831 1.00 0.00 H new ATOM 0 HD3 PRO B 23 -12.936 -11.491 -0.837 1.00 0.00 H new ATOM 1570 N GLU B 24 -8.783 -12.733 0.849 1.00 0.00 N ATOM 1571 CA GLU B 24 -7.768 -13.156 1.808 1.00 0.00 C ATOM 1572 C GLU B 24 -6.412 -13.330 1.126 1.00 0.00 C ATOM 1573 O GLU B 24 -6.264 -14.164 0.235 1.00 0.00 O ATOM 1574 CB GLU B 24 -8.184 -14.459 2.488 1.00 0.00 C ATOM 1575 CG GLU B 24 -9.253 -14.271 3.552 1.00 0.00 C ATOM 1576 CD GLU B 24 -9.814 -15.586 4.055 1.00 0.00 C ATOM 1577 OE1 GLU B 24 -10.797 -16.077 3.462 1.00 0.00 O ATOM 1578 OE2 GLU B 24 -9.271 -16.125 5.042 1.00 0.00 O ATOM 0 H GLU B 24 -9.221 -11.839 1.070 1.00 0.00 H new ATOM 0 HA GLU B 24 -7.675 -12.377 2.565 1.00 0.00 H new ATOM 0 HB2 GLU B 24 -8.552 -15.153 1.732 1.00 0.00 H new ATOM 0 HB3 GLU B 24 -7.307 -14.919 2.943 1.00 0.00 H new ATOM 0 HG2 GLU B 24 -8.832 -13.716 4.390 1.00 0.00 H new ATOM 0 HG3 GLU B 24 -10.064 -13.667 3.144 1.00 0.00 H new ATOM 1585 N PRO B 25 -5.394 -12.559 1.548 1.00 0.00 N ATOM 1586 CA PRO B 25 -4.066 -12.640 0.959 1.00 0.00 C ATOM 1587 C PRO B 25 -3.318 -13.872 1.449 1.00 0.00 C ATOM 1588 O PRO B 25 -2.918 -13.949 2.608 1.00 0.00 O ATOM 1589 CB PRO B 25 -3.362 -11.354 1.414 1.00 0.00 C ATOM 1590 CG PRO B 25 -4.320 -10.641 2.324 1.00 0.00 C ATOM 1591 CD PRO B 25 -5.440 -11.592 2.646 1.00 0.00 C ATOM 0 HA PRO B 25 -4.106 -12.729 -0.127 1.00 0.00 H new ATOM 0 HB2 PRO B 25 -2.432 -11.584 1.934 1.00 0.00 H new ATOM 0 HB3 PRO B 25 -3.103 -10.730 0.558 1.00 0.00 H new ATOM 0 HG2 PRO B 25 -3.815 -10.322 3.236 1.00 0.00 H new ATOM 0 HG3 PRO B 25 -4.707 -9.743 1.843 1.00 0.00 H new ATOM 0 HD2 PRO B 25 -5.292 -12.074 3.612 1.00 0.00 H new ATOM 0 HD3 PRO B 25 -6.401 -11.080 2.690 1.00 0.00 H new ATOM 1599 N ASP B 26 -3.155 -14.839 0.558 1.00 0.00 N ATOM 1600 CA ASP B 26 -2.471 -16.083 0.888 1.00 0.00 C ATOM 1601 C ASP B 26 -0.963 -15.879 1.023 1.00 0.00 C ATOM 1602 O ASP B 26 -0.259 -16.746 1.541 1.00 0.00 O ATOM 1603 CB ASP B 26 -2.757 -17.135 -0.184 1.00 0.00 C ATOM 1604 CG ASP B 26 -4.226 -17.507 -0.252 1.00 0.00 C ATOM 1605 OD1 ASP B 26 -4.971 -16.845 -1.005 1.00 0.00 O ATOM 1606 OD2 ASP B 26 -4.631 -18.460 0.446 1.00 0.00 O ATOM 0 H ASP B 26 -3.489 -14.786 -0.404 1.00 0.00 H new ATOM 0 HA ASP B 26 -2.850 -16.426 1.851 1.00 0.00 H new ATOM 0 HB2 ASP B 26 -2.435 -16.757 -1.155 1.00 0.00 H new ATOM 0 HB3 ASP B 26 -2.168 -18.029 0.022 1.00 0.00 H new ATOM 1611 N TRP B 27 -0.474 -14.733 0.554 1.00 0.00 N ATOM 1612 CA TRP B 27 0.956 -14.427 0.613 1.00 0.00 C ATOM 1613 C TRP B 27 1.764 -15.481 -0.137 1.00 0.00 C ATOM 1614 O TRP B 27 2.994 -15.492 -0.072 1.00 0.00 O ATOM 1615 CB TRP B 27 1.440 -14.350 2.062 1.00 0.00 C ATOM 1616 CG TRP B 27 0.816 -13.246 2.856 1.00 0.00 C ATOM 1617 CD1 TRP B 27 -0.299 -13.332 3.632 1.00 0.00 C ATOM 1618 CD2 TRP B 27 1.274 -11.894 2.958 1.00 0.00 C ATOM 1619 NE1 TRP B 27 -0.565 -12.116 4.217 1.00 0.00 N ATOM 1620 CE2 TRP B 27 0.388 -11.216 3.818 1.00 0.00 C ATOM 1621 CE3 TRP B 27 2.348 -11.190 2.406 1.00 0.00 C ATOM 1622 CZ2 TRP B 27 0.548 -9.868 4.140 1.00 0.00 C ATOM 1623 CZ3 TRP B 27 2.504 -9.853 2.725 1.00 0.00 C ATOM 1624 CH2 TRP B 27 1.608 -9.206 3.586 1.00 0.00 C ATOM 0 H TRP B 27 -1.044 -14.002 0.130 1.00 0.00 H new ATOM 0 HA TRP B 27 1.105 -13.457 0.139 1.00 0.00 H new ATOM 0 HB2 TRP B 27 1.232 -15.300 2.554 1.00 0.00 H new ATOM 0 HB3 TRP B 27 2.522 -14.219 2.066 1.00 0.00 H new ATOM 0 HD1 TRP B 27 -0.889 -14.226 3.769 1.00 0.00 H new ATOM 0 HE1 TRP B 27 -1.344 -11.917 4.845 1.00 0.00 H new ATOM 0 HE3 TRP B 27 3.044 -11.681 1.742 1.00 0.00 H new ATOM 0 HZ2 TRP B 27 -0.141 -9.366 4.803 1.00 0.00 H new ATOM 0 HZ3 TRP B 27 3.330 -9.299 2.304 1.00 0.00 H new ATOM 0 HH2 TRP B 27 1.758 -8.162 3.817 1.00 0.00 H new ATOM 1635 N SER B 28 1.061 -16.368 -0.840 1.00 0.00 N ATOM 1636 CA SER B 28 1.706 -17.434 -1.606 1.00 0.00 C ATOM 1637 C SER B 28 2.921 -16.901 -2.356 1.00 0.00 C ATOM 1638 O SER B 28 4.052 -17.316 -2.100 1.00 0.00 O ATOM 1639 CB SER B 28 0.714 -18.056 -2.590 1.00 0.00 C ATOM 1640 OG SER B 28 0.183 -17.080 -3.469 1.00 0.00 O ATOM 0 H SER B 28 0.042 -16.369 -0.895 1.00 0.00 H new ATOM 0 HA SER B 28 2.040 -18.201 -0.907 1.00 0.00 H new ATOM 0 HB2 SER B 28 1.211 -18.836 -3.166 1.00 0.00 H new ATOM 0 HB3 SER B 28 -0.097 -18.533 -2.040 1.00 0.00 H new ATOM 0 HG SER B 28 -0.447 -17.505 -4.088 1.00 0.00 H new ATOM 1646 N ASN B 29 2.682 -15.982 -3.284 1.00 0.00 N ATOM 1647 CA ASN B 29 3.759 -15.382 -4.059 1.00 0.00 C ATOM 1648 C ASN B 29 4.028 -13.962 -3.581 1.00 0.00 C ATOM 1649 O ASN B 29 3.588 -12.998 -4.203 1.00 0.00 O ATOM 1650 CB ASN B 29 3.415 -15.364 -5.549 1.00 0.00 C ATOM 1651 CG ASN B 29 3.388 -16.747 -6.162 1.00 0.00 C ATOM 1652 OD1 ASN B 29 4.051 -17.667 -5.684 1.00 0.00 O ATOM 1653 ND2 ASN B 29 2.623 -16.898 -7.236 1.00 0.00 N ATOM 0 H ASN B 29 1.751 -15.637 -3.518 1.00 0.00 H new ATOM 0 HA ASN B 29 4.654 -15.987 -3.913 1.00 0.00 H new ATOM 0 HB2 ASN B 29 2.442 -14.892 -5.687 1.00 0.00 H new ATOM 0 HB3 ASN B 29 4.145 -14.751 -6.078 1.00 0.00 H new ATOM 0 HD21 ASN B 29 2.568 -17.805 -7.699 1.00 0.00 H new ATOM 0 HD22 ASN B 29 2.090 -16.107 -7.598 1.00 0.00 H new ATOM 1660 N THR B 30 4.740 -13.839 -2.466 1.00 0.00 N ATOM 1661 CA THR B 30 5.060 -12.529 -1.918 1.00 0.00 C ATOM 1662 C THR B 30 5.715 -11.655 -2.981 1.00 0.00 C ATOM 1663 O THR B 30 6.916 -11.760 -3.235 1.00 0.00 O ATOM 1664 CB THR B 30 5.997 -12.640 -0.700 1.00 0.00 C ATOM 1665 OG1 THR B 30 5.421 -13.505 0.286 1.00 0.00 O ATOM 1666 CG2 THR B 30 6.258 -11.272 -0.087 1.00 0.00 C ATOM 0 H THR B 30 5.104 -14.626 -1.928 1.00 0.00 H new ATOM 0 HA THR B 30 4.124 -12.073 -1.594 1.00 0.00 H new ATOM 0 HB THR B 30 6.946 -13.055 -1.040 1.00 0.00 H new ATOM 0 HG1 THR B 30 6.024 -13.571 1.056 1.00 0.00 H new ATOM 0 HG21 THR B 30 6.922 -11.378 0.771 1.00 0.00 H new ATOM 0 HG22 THR B 30 6.725 -10.624 -0.829 1.00 0.00 H new ATOM 0 HG23 THR B 30 5.315 -10.832 0.237 1.00 0.00 H new ATOM 1674 N VAL B 31 4.915 -10.798 -3.605 1.00 0.00 N ATOM 1675 CA VAL B 31 5.401 -9.915 -4.653 1.00 0.00 C ATOM 1676 C VAL B 31 5.518 -8.480 -4.146 1.00 0.00 C ATOM 1677 O VAL B 31 4.517 -7.853 -3.812 1.00 0.00 O ATOM 1678 CB VAL B 31 4.478 -9.958 -5.888 1.00 0.00 C ATOM 1679 CG1 VAL B 31 4.519 -8.644 -6.655 1.00 0.00 C ATOM 1680 CG2 VAL B 31 4.871 -11.119 -6.790 1.00 0.00 C ATOM 0 H VAL B 31 3.921 -10.698 -3.400 1.00 0.00 H new ATOM 0 HA VAL B 31 6.390 -10.267 -4.945 1.00 0.00 H new ATOM 0 HB VAL B 31 3.454 -10.107 -5.545 1.00 0.00 H new ATOM 0 HG11 VAL B 31 3.858 -8.707 -7.519 1.00 0.00 H new ATOM 0 HG12 VAL B 31 4.191 -7.833 -6.005 1.00 0.00 H new ATOM 0 HG13 VAL B 31 5.538 -8.450 -6.991 1.00 0.00 H new ATOM 0 HG21 VAL B 31 4.214 -11.142 -7.660 1.00 0.00 H new ATOM 0 HG22 VAL B 31 5.903 -10.992 -7.118 1.00 0.00 H new ATOM 0 HG23 VAL B 31 4.778 -12.055 -6.240 1.00 0.00 H new ATOM 1690 N PRO B 32 6.747 -7.945 -4.078 1.00 0.00 N ATOM 1691 CA PRO B 32 6.996 -6.577 -3.608 1.00 0.00 C ATOM 1692 C PRO B 32 6.132 -5.540 -4.308 1.00 0.00 C ATOM 1693 O PRO B 32 5.470 -5.827 -5.304 1.00 0.00 O ATOM 1694 CB PRO B 32 8.466 -6.359 -3.945 1.00 0.00 C ATOM 1695 CG PRO B 32 9.044 -7.720 -3.858 1.00 0.00 C ATOM 1696 CD PRO B 32 8.002 -8.629 -4.438 1.00 0.00 C ATOM 0 HA PRO B 32 6.757 -6.464 -2.551 1.00 0.00 H new ATOM 0 HB2 PRO B 32 8.591 -5.932 -4.940 1.00 0.00 H new ATOM 0 HB3 PRO B 32 8.942 -5.675 -3.243 1.00 0.00 H new ATOM 0 HG2 PRO B 32 9.979 -7.787 -4.415 1.00 0.00 H new ATOM 0 HG3 PRO B 32 9.268 -7.987 -2.825 1.00 0.00 H new ATOM 0 HD2 PRO B 32 8.111 -8.735 -5.517 1.00 0.00 H new ATOM 0 HD3 PRO B 32 8.055 -9.631 -4.012 1.00 0.00 H new ATOM 1704 N VAL B 33 6.155 -4.328 -3.772 1.00 0.00 N ATOM 1705 CA VAL B 33 5.381 -3.229 -4.326 1.00 0.00 C ATOM 1706 C VAL B 33 6.305 -2.188 -4.946 1.00 0.00 C ATOM 1707 O VAL B 33 5.857 -1.163 -5.452 1.00 0.00 O ATOM 1708 CB VAL B 33 4.512 -2.561 -3.243 1.00 0.00 C ATOM 1709 CG1 VAL B 33 3.405 -1.737 -3.875 1.00 0.00 C ATOM 1710 CG2 VAL B 33 3.934 -3.603 -2.301 1.00 0.00 C ATOM 0 H VAL B 33 6.705 -4.081 -2.949 1.00 0.00 H new ATOM 0 HA VAL B 33 4.727 -3.639 -5.096 1.00 0.00 H new ATOM 0 HB VAL B 33 5.146 -1.891 -2.663 1.00 0.00 H new ATOM 0 HG11 VAL B 33 2.804 -1.274 -3.092 1.00 0.00 H new ATOM 0 HG12 VAL B 33 3.842 -0.961 -4.503 1.00 0.00 H new ATOM 0 HG13 VAL B 33 2.773 -2.383 -4.484 1.00 0.00 H new ATOM 0 HG21 VAL B 33 3.324 -3.110 -1.544 1.00 0.00 H new ATOM 0 HG22 VAL B 33 3.317 -4.302 -2.866 1.00 0.00 H new ATOM 0 HG23 VAL B 33 4.746 -4.145 -1.816 1.00 0.00 H new ATOM 1720 N ASN B 34 7.603 -2.466 -4.905 1.00 0.00 N ATOM 1721 CA ASN B 34 8.599 -1.557 -5.462 1.00 0.00 C ATOM 1722 C ASN B 34 9.595 -2.312 -6.337 1.00 0.00 C ATOM 1723 O ASN B 34 10.518 -2.952 -5.833 1.00 0.00 O ATOM 1724 CB ASN B 34 9.339 -0.829 -4.339 1.00 0.00 C ATOM 1725 CG ASN B 34 8.429 0.093 -3.549 1.00 0.00 C ATOM 1726 OD1 ASN B 34 7.456 0.692 -4.227 1.00 0.00 O flip ATOM 1727 ND2 ASN B 34 8.602 0.271 -2.343 1.00 0.00 N flip ATOM 0 H ASN B 34 7.991 -3.314 -4.492 1.00 0.00 H new ATOM 0 HA ASN B 34 8.081 -0.825 -6.081 1.00 0.00 H new ATOM 0 HB2 ASN B 34 9.783 -1.562 -3.665 1.00 0.00 H new ATOM 0 HB3 ASN B 34 10.159 -0.249 -4.764 1.00 0.00 H new ATOM 0 HD21 ASN B 34 9.362 -0.209 -1.860 1.00 0.00 H new ATOM 0 HD22 ASN B 34 7.986 0.898 -1.826 1.00 0.00 H new