USER MOD reduce.3.24.130724 H: found=0, std=0, add=673, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 680 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 142 GLN : amide:sc= 1.19 K(o=1.2,f=-0.051) USER MOD Set 1.2: A 161 MET CE :methyl 178:sc= 0 (180deg=-0.00539) USER MOD Set 2.1: A 12 LYS NZ :NH3+ -173:sc= 1.86 (180deg=0.291) USER MOD Set 2.2: A 163 SER OG : rot 34:sc= 1.91 USER MOD Set 3.1: A 8 TYR OH : rot -96:sc= 1.87 USER MOD Set 3.2: A 82 LYS NZ :NH3+ 171:sc= 3.47 (180deg=1.63) USER MOD Set 3.3: A 94 TYR OH : rot 166:sc= 1.23 USER MOD Single : A 5 ASN : amide:sc= -0.115 X(o=-0.12,f=0) USER MOD Single : A 6 THR OG1 : rot 1:sc= 0.996 USER MOD Single : A 9 THR OG1 : rot 54:sc= 1.28 USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 43 TYR OH : rot 63:sc= 0.814 USER MOD Single : A 44 GLN : amide:sc= -0.293 K(o=-0.29,f=-4.3!) USER MOD Single : A 53 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 55 TYR OH : rot 180:sc= 0 USER MOD Single : A 78 GLN : amide:sc= 0.0627 K(o=0.063,f=-3.2!) USER MOD Single : A 80 THR OG1 : rot 13:sc= 2.08 USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 95 THR OG1 : rot -5:sc= 1.01 USER MOD Single : A 100 MET CE :methyl -165:sc= -0.0869 (180deg=-0.416) USER MOD Single : A 120 SER OG : rot 31:sc= 0.281 USER MOD Single : A 129 TYR OH : rot 180:sc= 0 USER MOD Single : A 132 THR OG1 : rot 4:sc= 1.04 USER MOD Single : A 137 THR OG1 : rot 180:sc= 0 USER MOD Single : A 141 TYR OH : rot -55:sc= 1.15 USER MOD Single : A 167 SER OG : rot -120:sc= 0.809 USER MOD Single : A 168 TYR OH : rot 180:sc= 0.939 USER MOD ----------------------------------------------------------------- ATOM 59 N ASN A 5 -13.662 -15.979 -4.573 1.00 0.00 N ATOM 60 CA ASN A 5 -13.716 -14.629 -4.030 1.00 0.00 C ATOM 61 C ASN A 5 -13.057 -14.681 -2.659 1.00 0.00 C ATOM 62 O ASN A 5 -13.169 -15.684 -1.954 1.00 0.00 O ATOM 63 CB ASN A 5 -15.168 -14.124 -3.917 1.00 0.00 C ATOM 64 CG ASN A 5 -15.594 -13.213 -5.064 1.00 0.00 C ATOM 65 OD1 ASN A 5 -16.195 -12.170 -4.841 1.00 0.00 O ATOM 66 ND2 ASN A 5 -15.310 -13.575 -6.305 1.00 0.00 N ATOM 0 HA ASN A 5 -13.198 -13.933 -4.690 1.00 0.00 H new ATOM 0 HB2 ASN A 5 -15.839 -14.982 -3.878 1.00 0.00 H new ATOM 0 HB3 ASN A 5 -15.284 -13.586 -2.976 1.00 0.00 H new ATOM 0 HD21 ASN A 5 -15.592 -12.983 -7.086 1.00 0.00 H new ATOM 0 HD22 ASN A 5 -14.809 -14.446 -6.480 1.00 0.00 H new ATOM 73 N THR A 6 -12.367 -13.618 -2.251 1.00 0.00 N ATOM 74 CA THR A 6 -11.808 -13.511 -0.907 1.00 0.00 C ATOM 75 C THR A 6 -11.705 -12.035 -0.556 1.00 0.00 C ATOM 76 O THR A 6 -11.051 -11.278 -1.274 1.00 0.00 O ATOM 77 CB THR A 6 -10.449 -14.236 -0.843 1.00 0.00 C ATOM 78 OG1 THR A 6 -10.684 -15.625 -0.926 1.00 0.00 O ATOM 79 CG2 THR A 6 -9.670 -14.004 0.458 1.00 0.00 C ATOM 0 H THR A 6 -12.180 -12.808 -2.842 1.00 0.00 H new ATOM 0 HA THR A 6 -12.450 -13.995 -0.171 1.00 0.00 H new ATOM 0 HB THR A 6 -9.855 -13.837 -1.665 1.00 0.00 H new ATOM 0 HG1 THR A 6 -11.646 -15.789 -1.012 1.00 0.00 H new ATOM 0 HG21 THR A 6 -8.727 -14.549 0.420 1.00 0.00 H new ATOM 0 HG22 THR A 6 -9.469 -12.939 0.577 1.00 0.00 H new ATOM 0 HG23 THR A 6 -10.260 -14.358 1.303 1.00 0.00 H new ATOM 87 N TRP A 7 -12.353 -11.642 0.545 1.00 0.00 N ATOM 88 CA TRP A 7 -12.215 -10.322 1.139 1.00 0.00 C ATOM 89 C TRP A 7 -10.945 -10.302 1.997 1.00 0.00 C ATOM 90 O TRP A 7 -10.436 -11.346 2.414 1.00 0.00 O ATOM 91 CB TRP A 7 -13.482 -10.014 1.961 1.00 0.00 C ATOM 92 CG TRP A 7 -13.476 -8.759 2.789 1.00 0.00 C ATOM 93 CD1 TRP A 7 -13.110 -8.687 4.090 1.00 0.00 C ATOM 94 CD2 TRP A 7 -13.843 -7.394 2.409 1.00 0.00 C ATOM 95 NE1 TRP A 7 -13.212 -7.385 4.535 1.00 0.00 N ATOM 96 CE2 TRP A 7 -13.646 -6.541 3.535 1.00 0.00 C ATOM 97 CE3 TRP A 7 -14.328 -6.784 1.230 1.00 0.00 C ATOM 98 CZ2 TRP A 7 -13.896 -5.161 3.491 1.00 0.00 C ATOM 99 CZ3 TRP A 7 -14.572 -5.399 1.167 1.00 0.00 C ATOM 100 CH2 TRP A 7 -14.356 -4.586 2.294 1.00 0.00 C ATOM 0 H TRP A 7 -12.998 -12.248 1.052 1.00 0.00 H new ATOM 0 HA TRP A 7 -12.117 -9.549 0.377 1.00 0.00 H new ATOM 0 HB2 TRP A 7 -14.326 -9.961 1.273 1.00 0.00 H new ATOM 0 HB3 TRP A 7 -13.666 -10.857 2.627 1.00 0.00 H new ATOM 0 HD1 TRP A 7 -12.786 -9.524 4.691 1.00 0.00 H new ATOM 0 HE1 TRP A 7 -12.994 -7.084 5.485 1.00 0.00 H new ATOM 0 HE3 TRP A 7 -14.516 -7.394 0.358 1.00 0.00 H new ATOM 0 HZ2 TRP A 7 -13.737 -4.548 4.366 1.00 0.00 H new ATOM 0 HZ3 TRP A 7 -14.927 -4.958 0.247 1.00 0.00 H new ATOM 0 HH2 TRP A 7 -14.543 -3.524 2.240 1.00 0.00 H new ATOM 111 N TYR A 8 -10.439 -9.106 2.279 1.00 0.00 N ATOM 112 CA TYR A 8 -9.360 -8.825 3.203 1.00 0.00 C ATOM 113 C TYR A 8 -9.609 -7.446 3.816 1.00 0.00 C ATOM 114 O TYR A 8 -10.334 -6.621 3.253 1.00 0.00 O ATOM 115 CB TYR A 8 -8.014 -8.886 2.459 1.00 0.00 C ATOM 116 CG TYR A 8 -7.881 -7.924 1.292 1.00 0.00 C ATOM 117 CD1 TYR A 8 -7.541 -6.578 1.530 1.00 0.00 C ATOM 118 CD2 TYR A 8 -8.104 -8.372 -0.026 1.00 0.00 C ATOM 119 CE1 TYR A 8 -7.418 -5.680 0.460 1.00 0.00 C ATOM 120 CE2 TYR A 8 -7.990 -7.477 -1.104 1.00 0.00 C ATOM 121 CZ TYR A 8 -7.653 -6.129 -0.856 1.00 0.00 C ATOM 122 OH TYR A 8 -7.560 -5.242 -1.878 1.00 0.00 O ATOM 0 H TYR A 8 -10.798 -8.259 1.838 1.00 0.00 H new ATOM 0 HA TYR A 8 -9.323 -9.565 4.002 1.00 0.00 H new ATOM 0 HB2 TYR A 8 -7.213 -8.683 3.170 1.00 0.00 H new ATOM 0 HB3 TYR A 8 -7.865 -9.901 2.092 1.00 0.00 H new ATOM 0 HD1 TYR A 8 -7.374 -6.236 2.541 1.00 0.00 H new ATOM 0 HD2 TYR A 8 -8.363 -9.405 -0.208 1.00 0.00 H new ATOM 0 HE1 TYR A 8 -7.145 -4.651 0.643 1.00 0.00 H new ATOM 0 HE2 TYR A 8 -8.159 -7.818 -2.115 1.00 0.00 H new ATOM 0 HH TYR A 8 -8.452 -4.901 -2.097 1.00 0.00 H new ATOM 132 N THR A 9 -8.974 -7.170 4.953 1.00 0.00 N ATOM 133 CA THR A 9 -8.990 -5.855 5.580 1.00 0.00 C ATOM 134 C THR A 9 -7.668 -5.653 6.319 1.00 0.00 C ATOM 135 O THR A 9 -6.932 -6.610 6.555 1.00 0.00 O ATOM 136 CB THR A 9 -10.254 -5.704 6.454 1.00 0.00 C ATOM 137 OG1 THR A 9 -10.376 -4.404 6.996 1.00 0.00 O ATOM 138 CG2 THR A 9 -10.328 -6.712 7.608 1.00 0.00 C ATOM 0 H THR A 9 -8.429 -7.861 5.468 1.00 0.00 H new ATOM 0 HA THR A 9 -9.059 -5.055 4.843 1.00 0.00 H new ATOM 0 HB THR A 9 -11.078 -5.902 5.768 1.00 0.00 H new ATOM 0 HG1 THR A 9 -10.324 -3.743 6.275 1.00 0.00 H new ATOM 0 HG21 THR A 9 -11.242 -6.546 8.178 1.00 0.00 H new ATOM 0 HG22 THR A 9 -10.330 -7.725 7.206 1.00 0.00 H new ATOM 0 HG23 THR A 9 -9.465 -6.582 8.261 1.00 0.00 H new ATOM 146 N GLY A 10 -7.321 -4.409 6.636 1.00 0.00 N ATOM 147 CA GLY A 10 -5.975 -4.064 7.042 1.00 0.00 C ATOM 148 C GLY A 10 -5.867 -2.577 7.314 1.00 0.00 C ATOM 149 O GLY A 10 -6.881 -1.910 7.530 1.00 0.00 O ATOM 0 H GLY A 10 -7.967 -3.619 6.617 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -5.704 -4.624 7.937 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -5.269 -4.349 6.262 1.00 0.00 H new ATOM 153 N ALA A 11 -4.640 -2.058 7.301 1.00 0.00 N ATOM 154 CA ALA A 11 -4.383 -0.636 7.485 1.00 0.00 C ATOM 155 C ALA A 11 -3.187 -0.224 6.637 1.00 0.00 C ATOM 156 O ALA A 11 -2.307 -1.053 6.390 1.00 0.00 O ATOM 157 CB ALA A 11 -4.126 -0.345 8.968 1.00 0.00 C ATOM 0 H ALA A 11 -3.797 -2.615 7.162 1.00 0.00 H new ATOM 0 HA ALA A 11 -5.251 -0.059 7.167 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -3.934 0.720 9.102 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -5.000 -0.632 9.552 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -3.261 -0.915 9.306 1.00 0.00 H new ATOM 163 N LYS A 12 -3.139 1.057 6.246 1.00 0.00 N ATOM 164 CA LYS A 12 -1.995 1.659 5.567 1.00 0.00 C ATOM 165 C LYS A 12 -1.619 2.975 6.247 1.00 0.00 C ATOM 166 O LYS A 12 -2.468 3.661 6.822 1.00 0.00 O ATOM 167 CB LYS A 12 -2.255 1.918 4.067 1.00 0.00 C ATOM 168 CG LYS A 12 -2.584 0.681 3.206 1.00 0.00 C ATOM 169 CD LYS A 12 -2.354 0.938 1.709 1.00 0.00 C ATOM 170 CE LYS A 12 -3.443 1.850 1.143 1.00 0.00 C ATOM 171 NZ LYS A 12 -2.997 2.597 -0.048 1.00 0.00 N ATOM 0 H LYS A 12 -3.908 1.710 6.397 1.00 0.00 H new ATOM 0 HA LYS A 12 -1.176 0.943 5.638 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -3.080 2.625 3.980 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -1.374 2.403 3.646 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -1.967 -0.158 3.528 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -3.623 0.393 3.368 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -1.376 1.395 1.560 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -2.349 -0.009 1.169 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -4.316 1.250 0.885 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -3.757 2.555 1.913 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -3.728 3.285 -0.320 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -2.112 3.099 0.168 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -2.836 1.934 -0.833 1.00 0.00 H new ATOM 185 N LEU A 13 -0.348 3.341 6.087 1.00 0.00 N ATOM 186 CA LEU A 13 0.235 4.653 6.331 1.00 0.00 C ATOM 187 C LEU A 13 0.684 5.179 4.963 1.00 0.00 C ATOM 188 O LEU A 13 1.018 4.373 4.091 1.00 0.00 O ATOM 189 CB LEU A 13 1.430 4.465 7.287 1.00 0.00 C ATOM 190 CG LEU A 13 2.119 5.765 7.748 1.00 0.00 C ATOM 191 CD1 LEU A 13 1.270 6.517 8.780 1.00 0.00 C ATOM 192 CD2 LEU A 13 3.482 5.437 8.372 1.00 0.00 C ATOM 0 H LEU A 13 0.351 2.675 5.758 1.00 0.00 H new ATOM 0 HA LEU A 13 -0.458 5.359 6.788 1.00 0.00 H new ATOM 0 HB2 LEU A 13 1.087 3.924 8.168 1.00 0.00 H new ATOM 0 HB3 LEU A 13 2.172 3.836 6.795 1.00 0.00 H new ATOM 0 HG LEU A 13 2.245 6.401 6.872 1.00 0.00 H new ATOM 0 HD11 LEU A 13 1.787 7.428 9.082 1.00 0.00 H new ATOM 0 HD12 LEU A 13 0.307 6.775 8.340 1.00 0.00 H new ATOM 0 HD13 LEU A 13 1.112 5.883 9.653 1.00 0.00 H new ATOM 0 HD21 LEU A 13 3.965 6.359 8.696 1.00 0.00 H new ATOM 0 HD22 LEU A 13 3.341 4.780 9.230 1.00 0.00 H new ATOM 0 HD23 LEU A 13 4.110 4.939 7.633 1.00 0.00 H new ATOM 204 N GLY A 14 0.722 6.499 4.760 1.00 0.00 N ATOM 205 CA GLY A 14 1.219 7.089 3.525 1.00 0.00 C ATOM 206 C GLY A 14 1.870 8.451 3.722 1.00 0.00 C ATOM 207 O GLY A 14 1.758 9.056 4.789 1.00 0.00 O ATOM 0 H GLY A 14 0.409 7.183 5.449 1.00 0.00 H new ATOM 0 HA2 GLY A 14 1.943 6.411 3.073 1.00 0.00 H new ATOM 0 HA3 GLY A 14 0.393 7.188 2.821 1.00 0.00 H new ATOM 211 N PHE A 15 2.538 8.922 2.664 1.00 0.00 N ATOM 212 CA PHE A 15 3.304 10.159 2.599 1.00 0.00 C ATOM 213 C PHE A 15 3.086 10.811 1.231 1.00 0.00 C ATOM 214 O PHE A 15 3.135 10.120 0.209 1.00 0.00 O ATOM 215 CB PHE A 15 4.789 9.852 2.829 1.00 0.00 C ATOM 216 CG PHE A 15 5.681 11.079 2.781 1.00 0.00 C ATOM 217 CD1 PHE A 15 5.614 12.035 3.812 1.00 0.00 C ATOM 218 CD2 PHE A 15 6.565 11.279 1.703 1.00 0.00 C ATOM 219 CE1 PHE A 15 6.422 13.185 3.767 1.00 0.00 C ATOM 220 CE2 PHE A 15 7.386 12.420 1.668 1.00 0.00 C ATOM 221 CZ PHE A 15 7.312 13.375 2.696 1.00 0.00 C ATOM 0 H PHE A 15 2.556 8.415 1.779 1.00 0.00 H new ATOM 0 HA PHE A 15 2.972 10.850 3.374 1.00 0.00 H new ATOM 0 HB2 PHE A 15 4.905 9.368 3.799 1.00 0.00 H new ATOM 0 HB3 PHE A 15 5.125 9.140 2.075 1.00 0.00 H new ATOM 0 HD1 PHE A 15 4.939 11.885 4.641 1.00 0.00 H new ATOM 0 HD2 PHE A 15 6.612 10.555 0.903 1.00 0.00 H new ATOM 0 HE1 PHE A 15 6.359 13.921 4.555 1.00 0.00 H new ATOM 0 HE2 PHE A 15 8.075 12.563 0.849 1.00 0.00 H new ATOM 0 HZ PHE A 15 7.938 14.254 2.663 1.00 0.00 H new ATOM 231 N SER A 16 2.884 12.134 1.223 1.00 0.00 N ATOM 232 CA SER A 16 2.586 12.929 0.039 1.00 0.00 C ATOM 233 C SER A 16 3.270 14.297 0.125 1.00 0.00 C ATOM 234 O SER A 16 2.623 15.298 0.467 1.00 0.00 O ATOM 235 CB SER A 16 1.073 13.132 -0.110 1.00 0.00 C ATOM 236 OG SER A 16 0.329 11.941 -0.225 1.00 0.00 O ATOM 0 H SER A 16 2.926 12.695 2.074 1.00 0.00 H new ATOM 0 HA SER A 16 2.963 12.389 -0.829 1.00 0.00 H new ATOM 0 HB2 SER A 16 0.708 13.691 0.752 1.00 0.00 H new ATOM 0 HB3 SER A 16 0.887 13.747 -0.990 1.00 0.00 H new ATOM 0 HG SER A 16 -0.623 12.157 -0.314 1.00 0.00 H new ATOM 509 N LEU A 35 0.737 13.485 4.553 1.00 0.00 N ATOM 510 CA LEU A 35 0.668 12.099 4.984 1.00 0.00 C ATOM 511 C LEU A 35 -0.745 11.547 4.806 1.00 0.00 C ATOM 512 O LEU A 35 -1.673 12.288 4.480 1.00 0.00 O ATOM 513 CB LEU A 35 1.206 11.966 6.428 1.00 0.00 C ATOM 514 CG LEU A 35 0.511 12.806 7.526 1.00 0.00 C ATOM 515 CD1 LEU A 35 -0.873 12.273 7.931 1.00 0.00 C ATOM 516 CD2 LEU A 35 1.403 12.824 8.775 1.00 0.00 C ATOM 0 HA LEU A 35 1.310 11.485 4.353 1.00 0.00 H new ATOM 0 HB2 LEU A 35 1.143 10.917 6.716 1.00 0.00 H new ATOM 0 HB3 LEU A 35 2.263 12.231 6.419 1.00 0.00 H new ATOM 0 HG LEU A 35 0.363 13.802 7.109 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -1.297 12.913 8.704 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -1.530 12.270 7.062 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -0.774 11.258 8.315 1.00 0.00 H new ATOM 0 HD21 LEU A 35 0.923 13.414 9.556 1.00 0.00 H new ATOM 0 HD22 LEU A 35 1.553 11.804 9.130 1.00 0.00 H new ATOM 0 HD23 LEU A 35 2.368 13.267 8.527 1.00 0.00 H new ATOM 528 N GLY A 36 -0.897 10.247 5.058 1.00 0.00 N ATOM 529 CA GLY A 36 -2.174 9.582 5.250 1.00 0.00 C ATOM 530 C GLY A 36 -1.999 8.468 6.279 1.00 0.00 C ATOM 531 O GLY A 36 -0.879 8.003 6.505 1.00 0.00 O ATOM 0 H GLY A 36 -0.103 9.611 5.136 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -2.924 10.296 5.591 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -2.531 9.171 4.306 1.00 0.00 H new ATOM 535 N ALA A 37 -3.101 8.041 6.892 1.00 0.00 N ATOM 536 CA ALA A 37 -3.183 6.942 7.841 1.00 0.00 C ATOM 537 C ALA A 37 -4.637 6.472 7.867 1.00 0.00 C ATOM 538 O ALA A 37 -5.533 7.265 8.177 1.00 0.00 O ATOM 539 CB ALA A 37 -2.750 7.414 9.236 1.00 0.00 C ATOM 0 H ALA A 37 -4.008 8.479 6.728 1.00 0.00 H new ATOM 0 HA ALA A 37 -2.522 6.127 7.546 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -2.816 6.583 9.938 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -1.722 7.774 9.195 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -3.404 8.221 9.567 1.00 0.00 H new ATOM 545 N GLY A 38 -4.877 5.193 7.562 1.00 0.00 N ATOM 546 CA GLY A 38 -6.238 4.699 7.441 1.00 0.00 C ATOM 547 C GLY A 38 -6.356 3.188 7.551 1.00 0.00 C ATOM 548 O GLY A 38 -5.369 2.457 7.423 1.00 0.00 O ATOM 0 H GLY A 38 -4.152 4.494 7.398 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -6.851 5.159 8.216 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -6.646 5.017 6.481 1.00 0.00 H new ATOM 552 N ALA A 39 -7.597 2.737 7.746 1.00 0.00 N ATOM 553 CA ALA A 39 -7.993 1.336 7.717 1.00 0.00 C ATOM 554 C ALA A 39 -8.510 1.017 6.315 1.00 0.00 C ATOM 555 O ALA A 39 -9.109 1.876 5.670 1.00 0.00 O ATOM 556 CB ALA A 39 -9.082 1.084 8.764 1.00 0.00 C ATOM 0 H ALA A 39 -8.379 3.364 7.935 1.00 0.00 H new ATOM 0 HA ALA A 39 -7.144 0.693 7.951 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -9.375 0.034 8.739 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -8.699 1.330 9.754 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -9.948 1.708 8.545 1.00 0.00 H new ATOM 562 N PHE A 40 -8.288 -0.210 5.841 1.00 0.00 N ATOM 563 CA PHE A 40 -8.557 -0.616 4.466 1.00 0.00 C ATOM 564 C PHE A 40 -9.366 -1.911 4.444 1.00 0.00 C ATOM 565 O PHE A 40 -9.321 -2.711 5.384 1.00 0.00 O ATOM 566 CB PHE A 40 -7.238 -0.701 3.671 1.00 0.00 C ATOM 567 CG PHE A 40 -6.699 0.669 3.282 1.00 0.00 C ATOM 568 CD1 PHE A 40 -6.085 1.491 4.246 1.00 0.00 C ATOM 569 CD2 PHE A 40 -6.900 1.169 1.981 1.00 0.00 C ATOM 570 CE1 PHE A 40 -5.741 2.817 3.937 1.00 0.00 C ATOM 571 CE2 PHE A 40 -6.550 2.495 1.667 1.00 0.00 C ATOM 572 CZ PHE A 40 -5.983 3.323 2.651 1.00 0.00 C ATOM 0 H PHE A 40 -7.909 -0.962 6.416 1.00 0.00 H new ATOM 0 HA PHE A 40 -9.170 0.136 3.969 1.00 0.00 H new ATOM 0 HB2 PHE A 40 -6.491 -1.225 4.268 1.00 0.00 H new ATOM 0 HB3 PHE A 40 -7.399 -1.293 2.770 1.00 0.00 H new ATOM 0 HD1 PHE A 40 -5.877 1.099 5.231 1.00 0.00 H new ATOM 0 HD2 PHE A 40 -7.325 0.531 1.220 1.00 0.00 H new ATOM 0 HE1 PHE A 40 -5.290 3.447 4.689 1.00 0.00 H new ATOM 0 HE2 PHE A 40 -6.717 2.876 0.670 1.00 0.00 H new ATOM 0 HZ PHE A 40 -5.734 4.348 2.417 1.00 0.00 H new ATOM 582 N GLY A 41 -10.109 -2.115 3.357 1.00 0.00 N ATOM 583 CA GLY A 41 -10.992 -3.248 3.133 1.00 0.00 C ATOM 584 C GLY A 41 -11.104 -3.461 1.632 1.00 0.00 C ATOM 585 O GLY A 41 -11.182 -2.494 0.878 1.00 0.00 O ATOM 0 H GLY A 41 -10.108 -1.461 2.574 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -10.597 -4.141 3.617 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -11.974 -3.058 3.566 1.00 0.00 H new ATOM 589 N GLY A 42 -11.057 -4.706 1.176 1.00 0.00 N ATOM 590 CA GLY A 42 -10.877 -5.005 -0.231 1.00 0.00 C ATOM 591 C GLY A 42 -11.156 -6.473 -0.488 1.00 0.00 C ATOM 592 O GLY A 42 -11.289 -7.248 0.456 1.00 0.00 O ATOM 0 H GLY A 42 -11.142 -5.530 1.771 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -11.546 -4.388 -0.831 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -9.859 -4.761 -0.536 1.00 0.00 H new ATOM 596 N TYR A 43 -11.299 -6.857 -1.755 1.00 0.00 N ATOM 597 CA TYR A 43 -11.423 -8.264 -2.113 1.00 0.00 C ATOM 598 C TYR A 43 -10.639 -8.571 -3.380 1.00 0.00 C ATOM 599 O TYR A 43 -10.198 -7.655 -4.074 1.00 0.00 O ATOM 600 CB TYR A 43 -12.902 -8.683 -2.215 1.00 0.00 C ATOM 601 CG TYR A 43 -13.678 -8.150 -3.406 1.00 0.00 C ATOM 602 CD1 TYR A 43 -14.152 -6.824 -3.411 1.00 0.00 C ATOM 603 CD2 TYR A 43 -13.981 -9.004 -4.485 1.00 0.00 C ATOM 604 CE1 TYR A 43 -14.919 -6.349 -4.490 1.00 0.00 C ATOM 605 CE2 TYR A 43 -14.740 -8.536 -5.570 1.00 0.00 C ATOM 606 CZ TYR A 43 -15.216 -7.206 -5.576 1.00 0.00 C ATOM 607 OH TYR A 43 -15.952 -6.759 -6.632 1.00 0.00 O ATOM 0 H TYR A 43 -11.332 -6.214 -2.546 1.00 0.00 H new ATOM 0 HA TYR A 43 -10.984 -8.864 -1.316 1.00 0.00 H new ATOM 0 HB2 TYR A 43 -12.947 -9.772 -2.239 1.00 0.00 H new ATOM 0 HB3 TYR A 43 -13.411 -8.363 -1.306 1.00 0.00 H new ATOM 0 HD1 TYR A 43 -13.926 -6.169 -2.583 1.00 0.00 H new ATOM 0 HD2 TYR A 43 -13.627 -10.024 -4.478 1.00 0.00 H new ATOM 0 HE1 TYR A 43 -15.281 -5.331 -4.490 1.00 0.00 H new ATOM 0 HE2 TYR A 43 -14.960 -9.192 -6.399 1.00 0.00 H new ATOM 0 HH TYR A 43 -15.472 -6.032 -7.081 1.00 0.00 H new ATOM 617 N GLN A 44 -10.478 -9.864 -3.661 1.00 0.00 N ATOM 618 CA GLN A 44 -10.072 -10.428 -4.938 1.00 0.00 C ATOM 619 C GLN A 44 -11.210 -11.307 -5.450 1.00 0.00 C ATOM 620 O GLN A 44 -11.931 -11.917 -4.653 1.00 0.00 O ATOM 621 CB GLN A 44 -8.805 -11.285 -4.762 1.00 0.00 C ATOM 622 CG GLN A 44 -7.501 -10.475 -4.769 1.00 0.00 C ATOM 623 CD GLN A 44 -7.200 -9.807 -6.114 1.00 0.00 C ATOM 624 OE1 GLN A 44 -6.962 -8.607 -6.169 1.00 0.00 O ATOM 625 NE2 GLN A 44 -7.196 -10.542 -7.219 1.00 0.00 N ATOM 0 H GLN A 44 -10.638 -10.585 -2.957 1.00 0.00 H new ATOM 0 HA GLN A 44 -9.855 -9.627 -5.645 1.00 0.00 H new ATOM 0 HB2 GLN A 44 -8.876 -11.833 -3.822 1.00 0.00 H new ATOM 0 HB3 GLN A 44 -8.765 -12.026 -5.560 1.00 0.00 H new ATOM 0 HG2 GLN A 44 -7.556 -9.708 -3.996 1.00 0.00 H new ATOM 0 HG3 GLN A 44 -6.673 -11.133 -4.507 1.00 0.00 H new ATOM 0 HE21 GLN A 44 -7.395 -11.541 -7.168 1.00 0.00 H new ATOM 0 HE22 GLN A 44 -6.994 -10.108 -8.120 1.00 0.00 H new ATOM 634 N VAL A 45 -11.300 -11.425 -6.775 1.00 0.00 N ATOM 635 CA VAL A 45 -12.069 -12.416 -7.504 1.00 0.00 C ATOM 636 C VAL A 45 -11.027 -13.229 -8.274 1.00 0.00 C ATOM 637 O VAL A 45 -10.612 -12.867 -9.377 1.00 0.00 O ATOM 638 CB VAL A 45 -13.215 -11.779 -8.329 1.00 0.00 C ATOM 639 CG1 VAL A 45 -12.838 -10.522 -9.127 1.00 0.00 C ATOM 640 CG2 VAL A 45 -13.868 -12.797 -9.278 1.00 0.00 C ATOM 0 H VAL A 45 -10.805 -10.789 -7.400 1.00 0.00 H new ATOM 0 HA VAL A 45 -12.635 -13.092 -6.863 1.00 0.00 H new ATOM 0 HB VAL A 45 -13.923 -11.457 -7.566 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -13.712 -10.158 -9.667 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -12.486 -9.749 -8.444 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -12.048 -10.765 -9.837 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -14.667 -12.311 -9.839 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -13.119 -13.180 -9.971 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -14.282 -13.622 -8.698 1.00 0.00 H new ATOM 699 N VAL A 49 -8.430 -10.095 -10.694 1.00 0.00 N ATOM 700 CA VAL A 49 -8.749 -8.704 -10.363 1.00 0.00 C ATOM 701 C VAL A 49 -9.447 -8.657 -9.005 1.00 0.00 C ATOM 702 O VAL A 49 -9.857 -9.689 -8.470 1.00 0.00 O ATOM 703 CB VAL A 49 -9.571 -8.006 -11.475 1.00 0.00 C ATOM 704 CG1 VAL A 49 -8.814 -7.955 -12.810 1.00 0.00 C ATOM 705 CG2 VAL A 49 -10.959 -8.628 -11.690 1.00 0.00 C ATOM 0 HA VAL A 49 -7.819 -8.139 -10.297 1.00 0.00 H new ATOM 0 HB VAL A 49 -9.720 -6.988 -11.114 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -9.430 -7.457 -13.559 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -7.883 -7.403 -12.680 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -8.591 -8.969 -13.141 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -11.480 -8.091 -12.482 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -10.849 -9.675 -11.973 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -11.535 -8.561 -10.767 1.00 0.00 H new ATOM 715 N GLY A 50 -9.556 -7.462 -8.429 1.00 0.00 N ATOM 716 CA GLY A 50 -10.149 -7.256 -7.123 1.00 0.00 C ATOM 717 C GLY A 50 -10.471 -5.786 -6.903 1.00 0.00 C ATOM 718 O GLY A 50 -10.538 -5.009 -7.855 1.00 0.00 O ATOM 0 H GLY A 50 -9.228 -6.602 -8.868 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -11.059 -7.850 -7.034 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -9.465 -7.603 -6.349 1.00 0.00 H new ATOM 722 N PHE A 51 -10.652 -5.406 -5.639 1.00 0.00 N ATOM 723 CA PHE A 51 -10.808 -4.031 -5.193 1.00 0.00 C ATOM 724 C PHE A 51 -10.019 -3.813 -3.901 1.00 0.00 C ATOM 725 O PHE A 51 -9.737 -4.761 -3.156 1.00 0.00 O ATOM 726 CB PHE A 51 -12.293 -3.696 -4.975 1.00 0.00 C ATOM 727 CG PHE A 51 -13.116 -3.468 -6.233 1.00 0.00 C ATOM 728 CD1 PHE A 51 -13.534 -4.554 -7.026 1.00 0.00 C ATOM 729 CD2 PHE A 51 -13.485 -2.161 -6.606 1.00 0.00 C ATOM 730 CE1 PHE A 51 -14.296 -4.336 -8.186 1.00 0.00 C ATOM 731 CE2 PHE A 51 -14.255 -1.941 -7.762 1.00 0.00 C ATOM 732 CZ PHE A 51 -14.658 -3.029 -8.555 1.00 0.00 C ATOM 0 H PHE A 51 -10.695 -6.077 -4.872 1.00 0.00 H new ATOM 0 HA PHE A 51 -10.419 -3.367 -5.965 1.00 0.00 H new ATOM 0 HB2 PHE A 51 -12.749 -4.508 -4.409 1.00 0.00 H new ATOM 0 HB3 PHE A 51 -12.356 -2.801 -4.356 1.00 0.00 H new ATOM 0 HD1 PHE A 51 -13.267 -5.561 -6.741 1.00 0.00 H new ATOM 0 HD2 PHE A 51 -13.175 -1.322 -6.000 1.00 0.00 H new ATOM 0 HE1 PHE A 51 -14.604 -5.173 -8.795 1.00 0.00 H new ATOM 0 HE2 PHE A 51 -14.537 -0.936 -8.040 1.00 0.00 H new ATOM 0 HZ PHE A 51 -15.245 -2.861 -9.446 1.00 0.00 H new ATOM 742 N GLU A 52 -9.713 -2.542 -3.636 1.00 0.00 N ATOM 743 CA GLU A 52 -9.163 -1.996 -2.407 1.00 0.00 C ATOM 744 C GLU A 52 -9.875 -0.666 -2.155 1.00 0.00 C ATOM 745 O GLU A 52 -9.790 0.257 -2.973 1.00 0.00 O ATOM 746 CB GLU A 52 -7.639 -1.805 -2.530 1.00 0.00 C ATOM 747 CG GLU A 52 -7.063 -1.081 -1.297 1.00 0.00 C ATOM 748 CD GLU A 52 -5.534 -1.096 -1.188 1.00 0.00 C ATOM 749 OE1 GLU A 52 -4.838 -1.564 -2.120 1.00 0.00 O ATOM 750 OE2 GLU A 52 -5.036 -0.717 -0.100 1.00 0.00 O ATOM 0 H GLU A 52 -9.857 -1.814 -4.336 1.00 0.00 H new ATOM 0 HA GLU A 52 -9.323 -2.676 -1.570 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -7.157 -2.776 -2.642 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -7.414 -1.231 -3.429 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -7.400 -0.045 -1.313 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -7.480 -1.538 -0.399 1.00 0.00 H new ATOM 757 N MET A 53 -10.552 -0.566 -1.013 1.00 0.00 N ATOM 758 CA MET A 53 -11.124 0.652 -0.469 1.00 0.00 C ATOM 759 C MET A 53 -10.462 0.917 0.887 1.00 0.00 C ATOM 760 O MET A 53 -9.840 0.024 1.471 1.00 0.00 O ATOM 761 CB MET A 53 -12.649 0.511 -0.295 1.00 0.00 C ATOM 762 CG MET A 53 -13.428 0.104 -1.553 1.00 0.00 C ATOM 763 SD MET A 53 -13.490 -1.678 -1.899 1.00 0.00 S ATOM 764 CE MET A 53 -14.752 -1.678 -3.197 1.00 0.00 C ATOM 0 H MET A 53 -10.722 -1.376 -0.416 1.00 0.00 H new ATOM 0 HA MET A 53 -10.945 1.482 -1.152 1.00 0.00 H new ATOM 0 HB2 MET A 53 -12.840 -0.228 0.483 1.00 0.00 H new ATOM 0 HB3 MET A 53 -13.045 1.461 0.063 1.00 0.00 H new ATOM 0 HG2 MET A 53 -14.449 0.473 -1.461 1.00 0.00 H new ATOM 0 HG3 MET A 53 -12.984 0.607 -2.412 1.00 0.00 H new ATOM 0 HE1 MET A 53 -14.925 -2.699 -3.536 1.00 0.00 H new ATOM 0 HE2 MET A 53 -15.680 -1.265 -2.802 1.00 0.00 H new ATOM 0 HE3 MET A 53 -14.412 -1.070 -4.035 1.00 0.00 H new ATOM 774 N GLY A 54 -10.628 2.123 1.425 1.00 0.00 N ATOM 775 CA GLY A 54 -10.158 2.438 2.762 1.00 0.00 C ATOM 776 C GLY A 54 -10.749 3.730 3.280 1.00 0.00 C ATOM 777 O GLY A 54 -11.447 4.430 2.551 1.00 0.00 O ATOM 0 H GLY A 54 -11.088 2.899 0.948 1.00 0.00 H new ATOM 0 HA2 GLY A 54 -10.417 1.624 3.439 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -9.071 2.513 2.756 1.00 0.00 H new ATOM 781 N TYR A 55 -10.470 4.008 4.552 1.00 0.00 N ATOM 782 CA TYR A 55 -10.942 5.146 5.313 1.00 0.00 C ATOM 783 C TYR A 55 -9.734 5.699 6.061 1.00 0.00 C ATOM 784 O TYR A 55 -9.176 5.011 6.919 1.00 0.00 O ATOM 785 CB TYR A 55 -12.048 4.711 6.289 1.00 0.00 C ATOM 786 CG TYR A 55 -13.330 4.243 5.623 1.00 0.00 C ATOM 787 CD1 TYR A 55 -13.440 2.923 5.143 1.00 0.00 C ATOM 788 CD2 TYR A 55 -14.413 5.131 5.480 1.00 0.00 C ATOM 789 CE1 TYR A 55 -14.613 2.497 4.493 1.00 0.00 C ATOM 790 CE2 TYR A 55 -15.591 4.713 4.836 1.00 0.00 C ATOM 791 CZ TYR A 55 -15.693 3.397 4.333 1.00 0.00 C ATOM 792 OH TYR A 55 -16.834 3.006 3.699 1.00 0.00 O ATOM 0 H TYR A 55 -9.868 3.400 5.108 1.00 0.00 H new ATOM 0 HA TYR A 55 -11.373 5.909 4.665 1.00 0.00 H new ATOM 0 HB2 TYR A 55 -11.665 3.906 6.916 1.00 0.00 H new ATOM 0 HB3 TYR A 55 -12.281 5.546 6.949 1.00 0.00 H new ATOM 0 HD1 TYR A 55 -12.619 2.234 5.275 1.00 0.00 H new ATOM 0 HD2 TYR A 55 -14.339 6.137 5.866 1.00 0.00 H new ATOM 0 HE1 TYR A 55 -14.689 1.487 4.118 1.00 0.00 H new ATOM 0 HE2 TYR A 55 -16.418 5.399 4.726 1.00 0.00 H new ATOM 0 HH TYR A 55 -17.470 3.751 3.681 1.00 0.00 H new ATOM 1108 N GLY A 76 -10.540 10.858 5.033 1.00 0.00 N ATOM 1109 CA GLY A 76 -10.842 10.570 3.642 1.00 0.00 C ATOM 1110 C GLY A 76 -11.330 9.139 3.467 1.00 0.00 C ATOM 1111 O GLY A 76 -11.349 8.365 4.423 1.00 0.00 O ATOM 0 HA2 GLY A 76 -11.603 11.263 3.282 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -9.952 10.730 3.034 1.00 0.00 H new ATOM 1115 N VAL A 77 -11.723 8.791 2.242 1.00 0.00 N ATOM 1116 CA VAL A 77 -12.151 7.460 1.840 1.00 0.00 C ATOM 1117 C VAL A 77 -11.526 7.194 0.470 1.00 0.00 C ATOM 1118 O VAL A 77 -11.722 7.982 -0.459 1.00 0.00 O ATOM 1119 CB VAL A 77 -13.695 7.332 1.809 1.00 0.00 C ATOM 1120 CG1 VAL A 77 -14.141 5.874 1.630 1.00 0.00 C ATOM 1121 CG2 VAL A 77 -14.374 7.899 3.067 1.00 0.00 C ATOM 0 H VAL A 77 -11.751 9.461 1.473 1.00 0.00 H new ATOM 0 HA VAL A 77 -11.819 6.715 2.563 1.00 0.00 H new ATOM 0 HB VAL A 77 -14.010 7.925 0.950 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -15.230 5.826 1.613 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -13.746 5.485 0.691 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -13.764 5.274 2.458 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -15.454 7.779 2.983 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -14.017 7.363 3.946 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -14.133 8.958 3.165 1.00 0.00 H new ATOM 1131 N GLN A 78 -10.760 6.109 0.343 1.00 0.00 N ATOM 1132 CA GLN A 78 -10.242 5.623 -0.929 1.00 0.00 C ATOM 1133 C GLN A 78 -11.195 4.550 -1.453 1.00 0.00 C ATOM 1134 O GLN A 78 -11.728 3.763 -0.668 1.00 0.00 O ATOM 1135 CB GLN A 78 -8.837 5.015 -0.768 1.00 0.00 C ATOM 1136 CG GLN A 78 -7.783 5.981 -0.197 1.00 0.00 C ATOM 1137 CD GLN A 78 -7.735 6.055 1.334 1.00 0.00 C ATOM 1138 OE1 GLN A 78 -8.486 5.393 2.041 1.00 0.00 O ATOM 1139 NE2 GLN A 78 -6.800 6.834 1.859 1.00 0.00 N ATOM 0 H GLN A 78 -10.479 5.536 1.138 1.00 0.00 H new ATOM 0 HA GLN A 78 -10.169 6.459 -1.624 1.00 0.00 H new ATOM 0 HB2 GLN A 78 -8.905 4.145 -0.115 1.00 0.00 H new ATOM 0 HB3 GLN A 78 -8.496 4.659 -1.740 1.00 0.00 H new ATOM 0 HG2 GLN A 78 -6.801 5.681 -0.562 1.00 0.00 H new ATOM 0 HG3 GLN A 78 -7.977 6.980 -0.588 1.00 0.00 H new ATOM 0 HE21 GLN A 78 -6.187 7.376 1.250 1.00 0.00 H new ATOM 0 HE22 GLN A 78 -6.694 6.892 2.872 1.00 0.00 H new ATOM 1148 N LEU A 79 -11.370 4.481 -2.775 1.00 0.00 N ATOM 1149 CA LEU A 79 -12.185 3.470 -3.429 1.00 0.00 C ATOM 1150 C LEU A 79 -11.554 3.128 -4.778 1.00 0.00 C ATOM 1151 O LEU A 79 -11.583 3.938 -5.703 1.00 0.00 O ATOM 1152 CB LEU A 79 -13.662 3.913 -3.538 1.00 0.00 C ATOM 1153 CG LEU A 79 -13.980 5.315 -4.125 1.00 0.00 C ATOM 1154 CD1 LEU A 79 -15.416 5.319 -4.666 1.00 0.00 C ATOM 1155 CD2 LEU A 79 -13.868 6.455 -3.095 1.00 0.00 C ATOM 0 H LEU A 79 -10.940 5.139 -3.426 1.00 0.00 H new ATOM 0 HA LEU A 79 -12.207 2.562 -2.826 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -14.184 3.174 -4.146 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -14.095 3.867 -2.539 1.00 0.00 H new ATOM 0 HG LEU A 79 -13.240 5.495 -4.905 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -15.646 6.301 -5.080 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -15.513 4.564 -5.447 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -16.110 5.095 -3.856 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -14.104 7.404 -3.576 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -14.568 6.278 -2.279 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -12.852 6.491 -2.701 1.00 0.00 H new ATOM 1167 N THR A 80 -10.953 1.938 -4.892 1.00 0.00 N ATOM 1168 CA THR A 80 -10.205 1.534 -6.077 1.00 0.00 C ATOM 1169 C THR A 80 -10.495 0.079 -6.462 1.00 0.00 C ATOM 1170 O THR A 80 -10.655 -0.778 -5.594 1.00 0.00 O ATOM 1171 CB THR A 80 -8.695 1.804 -5.876 1.00 0.00 C ATOM 1172 OG1 THR A 80 -8.146 1.317 -4.656 1.00 0.00 O ATOM 1173 CG2 THR A 80 -8.380 3.302 -5.894 1.00 0.00 C ATOM 0 H THR A 80 -10.975 1.229 -4.159 1.00 0.00 H new ATOM 0 HA THR A 80 -10.539 2.140 -6.919 1.00 0.00 H new ATOM 0 HB THR A 80 -8.246 1.265 -6.710 1.00 0.00 H new ATOM 0 HG1 THR A 80 -8.786 0.711 -4.228 1.00 0.00 H new ATOM 0 HG21 THR A 80 -7.310 3.451 -5.750 1.00 0.00 H new ATOM 0 HG22 THR A 80 -8.679 3.725 -6.853 1.00 0.00 H new ATOM 0 HG23 THR A 80 -8.927 3.798 -5.092 1.00 0.00 H new ATOM 1181 N ALA A 81 -10.523 -0.200 -7.769 1.00 0.00 N ATOM 1182 CA ALA A 81 -10.421 -1.542 -8.330 1.00 0.00 C ATOM 1183 C ALA A 81 -8.931 -1.874 -8.445 1.00 0.00 C ATOM 1184 O ALA A 81 -8.115 -0.960 -8.585 1.00 0.00 O ATOM 1185 CB ALA A 81 -11.081 -1.571 -9.712 1.00 0.00 C ATOM 0 H ALA A 81 -10.620 0.524 -8.481 1.00 0.00 H new ATOM 0 HA ALA A 81 -10.925 -2.273 -7.698 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -11.004 -2.574 -10.131 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -12.132 -1.296 -9.619 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -10.577 -0.864 -10.371 1.00 0.00 H new ATOM 1191 N LYS A 82 -8.568 -3.160 -8.390 1.00 0.00 N ATOM 1192 CA LYS A 82 -7.181 -3.599 -8.271 1.00 0.00 C ATOM 1193 C LYS A 82 -6.865 -4.759 -9.213 1.00 0.00 C ATOM 1194 O LYS A 82 -7.750 -5.528 -9.597 1.00 0.00 O ATOM 1195 CB LYS A 82 -6.852 -3.905 -6.793 1.00 0.00 C ATOM 1196 CG LYS A 82 -6.927 -5.393 -6.390 1.00 0.00 C ATOM 1197 CD LYS A 82 -6.904 -5.602 -4.866 1.00 0.00 C ATOM 1198 CE LYS A 82 -5.760 -6.507 -4.368 1.00 0.00 C ATOM 1199 NZ LYS A 82 -5.093 -5.942 -3.174 1.00 0.00 N ATOM 0 H LYS A 82 -9.237 -3.929 -8.427 1.00 0.00 H new ATOM 0 HA LYS A 82 -6.526 -2.788 -8.590 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -5.848 -3.539 -6.579 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -7.538 -3.341 -6.162 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -7.839 -5.829 -6.798 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -6.090 -5.928 -6.838 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -6.822 -4.630 -4.379 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -7.855 -6.034 -4.556 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -6.155 -7.495 -4.131 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -5.028 -6.639 -5.165 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -4.436 -6.644 -2.779 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -4.566 -5.087 -3.443 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -5.808 -5.697 -2.460 1.00 0.00 H new ATOM 1213 N LEU A 83 -5.575 -4.894 -9.515 1.00 0.00 N ATOM 1214 CA LEU A 83 -4.949 -5.935 -10.309 1.00 0.00 C ATOM 1215 C LEU A 83 -3.627 -6.254 -9.613 1.00 0.00 C ATOM 1216 O LEU A 83 -2.897 -5.343 -9.221 1.00 0.00 O ATOM 1217 CB LEU A 83 -4.723 -5.388 -11.733 1.00 0.00 C ATOM 1218 CG LEU A 83 -3.789 -6.221 -12.636 1.00 0.00 C ATOM 1219 CD1 LEU A 83 -4.324 -7.631 -12.910 1.00 0.00 C ATOM 1220 CD2 LEU A 83 -3.597 -5.493 -13.973 1.00 0.00 C ATOM 0 H LEU A 83 -4.888 -4.218 -9.180 1.00 0.00 H new ATOM 0 HA LEU A 83 -5.556 -6.837 -10.392 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -5.691 -5.302 -12.226 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -4.315 -4.380 -11.654 1.00 0.00 H new ATOM 0 HG LEU A 83 -2.843 -6.329 -12.105 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -3.624 -8.168 -13.550 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -4.438 -8.167 -11.967 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -5.291 -7.563 -13.408 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -2.938 -6.078 -14.614 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -4.563 -5.370 -14.462 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -3.153 -4.514 -13.794 1.00 0.00 H new ATOM 1232 N GLY A 84 -3.290 -7.534 -9.484 1.00 0.00 N ATOM 1233 CA GLY A 84 -1.953 -7.947 -9.112 1.00 0.00 C ATOM 1234 C GLY A 84 -1.725 -9.370 -9.588 1.00 0.00 C ATOM 1235 O GLY A 84 -2.698 -10.085 -9.838 1.00 0.00 O ATOM 0 H GLY A 84 -3.938 -8.307 -9.635 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -1.215 -7.279 -9.556 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -1.828 -7.887 -8.031 1.00 0.00 H new ATOM 1239 N TYR A 85 -0.454 -9.755 -9.729 1.00 0.00 N ATOM 1240 CA TYR A 85 -0.069 -11.122 -10.062 1.00 0.00 C ATOM 1241 C TYR A 85 1.224 -11.493 -9.329 1.00 0.00 C ATOM 1242 O TYR A 85 2.124 -10.647 -9.252 1.00 0.00 O ATOM 1243 CB TYR A 85 0.098 -11.291 -11.585 1.00 0.00 C ATOM 1244 CG TYR A 85 -1.135 -11.874 -12.250 1.00 0.00 C ATOM 1245 CD1 TYR A 85 -1.277 -13.272 -12.338 1.00 0.00 C ATOM 1246 CD2 TYR A 85 -2.174 -11.033 -12.695 1.00 0.00 C ATOM 1247 CE1 TYR A 85 -2.476 -13.832 -12.809 1.00 0.00 C ATOM 1248 CE2 TYR A 85 -3.375 -11.585 -13.175 1.00 0.00 C ATOM 1249 CZ TYR A 85 -3.535 -12.989 -13.212 1.00 0.00 C ATOM 1250 OH TYR A 85 -4.735 -13.535 -13.541 1.00 0.00 O ATOM 0 H TYR A 85 0.338 -9.122 -9.614 1.00 0.00 H new ATOM 0 HA TYR A 85 -0.862 -11.796 -9.738 1.00 0.00 H new ATOM 0 HB2 TYR A 85 0.322 -10.322 -12.031 1.00 0.00 H new ATOM 0 HB3 TYR A 85 0.952 -11.938 -11.783 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -0.462 -13.916 -12.043 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -2.048 -9.961 -12.667 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -2.588 -14.905 -12.863 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -4.172 -10.939 -13.514 1.00 0.00 H new ATOM 0 HH TYR A 85 -5.359 -12.824 -13.796 1.00 0.00 H new ATOM 1260 N PRO A 86 1.349 -12.745 -8.839 1.00 0.00 N ATOM 1261 CA PRO A 86 2.549 -13.232 -8.177 1.00 0.00 C ATOM 1262 C PRO A 86 3.703 -13.325 -9.170 1.00 0.00 C ATOM 1263 O PRO A 86 3.506 -13.713 -10.324 1.00 0.00 O ATOM 1264 CB PRO A 86 2.191 -14.601 -7.589 1.00 0.00 C ATOM 1265 CG PRO A 86 1.041 -15.080 -8.468 1.00 0.00 C ATOM 1266 CD PRO A 86 0.324 -13.781 -8.822 1.00 0.00 C ATOM 0 HA PRO A 86 2.879 -12.556 -7.388 1.00 0.00 H new ATOM 0 HB2 PRO A 86 3.037 -15.287 -7.627 1.00 0.00 H new ATOM 0 HB3 PRO A 86 1.891 -14.522 -6.544 1.00 0.00 H new ATOM 0 HG2 PRO A 86 1.400 -15.599 -9.357 1.00 0.00 H new ATOM 0 HG3 PRO A 86 0.387 -15.772 -7.937 1.00 0.00 H new ATOM 0 HD2 PRO A 86 -0.167 -13.859 -9.792 1.00 0.00 H new ATOM 0 HD3 PRO A 86 -0.450 -13.551 -8.090 1.00 0.00 H new ATOM 1274 N ILE A 87 4.919 -13.045 -8.691 1.00 0.00 N ATOM 1275 CA ILE A 87 6.156 -13.345 -9.422 1.00 0.00 C ATOM 1276 C ILE A 87 6.971 -14.437 -8.719 1.00 0.00 C ATOM 1277 O ILE A 87 7.991 -14.897 -9.231 1.00 0.00 O ATOM 1278 CB ILE A 87 6.951 -12.060 -9.748 1.00 0.00 C ATOM 1279 CG1 ILE A 87 7.400 -11.212 -8.536 1.00 0.00 C ATOM 1280 CG2 ILE A 87 6.112 -11.175 -10.689 1.00 0.00 C ATOM 1281 CD1 ILE A 87 8.513 -11.851 -7.697 1.00 0.00 C ATOM 0 H ILE A 87 5.074 -12.604 -7.785 1.00 0.00 H new ATOM 0 HA ILE A 87 5.892 -13.766 -10.392 1.00 0.00 H new ATOM 0 HB ILE A 87 7.874 -12.411 -10.209 1.00 0.00 H new ATOM 0 HG12 ILE A 87 7.743 -10.241 -8.894 1.00 0.00 H new ATOM 0 HG13 ILE A 87 6.537 -11.030 -7.895 1.00 0.00 H new ATOM 0 HG21 ILE A 87 6.666 -10.266 -10.924 1.00 0.00 H new ATOM 0 HG22 ILE A 87 5.902 -11.720 -11.609 1.00 0.00 H new ATOM 0 HG23 ILE A 87 5.174 -10.912 -10.201 1.00 0.00 H new ATOM 0 HD11 ILE A 87 8.768 -11.191 -6.868 1.00 0.00 H new ATOM 0 HD12 ILE A 87 8.170 -12.809 -7.306 1.00 0.00 H new ATOM 0 HD13 ILE A 87 9.394 -12.008 -8.320 1.00 0.00 H new ATOM 1331 N LEU A 91 5.615 -12.827 -3.299 1.00 0.00 N ATOM 1332 CA LEU A 91 5.090 -11.492 -3.569 1.00 0.00 C ATOM 1333 C LEU A 91 4.431 -11.388 -4.947 1.00 0.00 C ATOM 1334 O LEU A 91 4.785 -12.098 -5.896 1.00 0.00 O ATOM 1335 CB LEU A 91 6.204 -10.439 -3.380 1.00 0.00 C ATOM 1336 CG LEU A 91 7.229 -10.345 -4.536 1.00 0.00 C ATOM 1337 CD1 LEU A 91 6.874 -9.227 -5.532 1.00 0.00 C ATOM 1338 CD2 LEU A 91 8.638 -10.060 -4.005 1.00 0.00 C ATOM 0 HA LEU A 91 4.298 -11.291 -2.847 1.00 0.00 H new ATOM 0 HB2 LEU A 91 5.739 -9.462 -3.248 1.00 0.00 H new ATOM 0 HB3 LEU A 91 6.741 -10.663 -2.458 1.00 0.00 H new ATOM 0 HG LEU A 91 7.199 -11.310 -5.042 1.00 0.00 H new ATOM 0 HD11 LEU A 91 7.620 -9.197 -6.326 1.00 0.00 H new ATOM 0 HD12 LEU A 91 5.892 -9.422 -5.963 1.00 0.00 H new ATOM 0 HD13 LEU A 91 6.858 -8.269 -5.013 1.00 0.00 H new ATOM 0 HD21 LEU A 91 9.336 -9.999 -4.840 1.00 0.00 H new ATOM 0 HD22 LEU A 91 8.638 -9.115 -3.463 1.00 0.00 H new ATOM 0 HD23 LEU A 91 8.943 -10.863 -3.334 1.00 0.00 H new ATOM 1350 N ASP A 92 3.530 -10.409 -5.034 1.00 0.00 N ATOM 1351 CA ASP A 92 2.782 -9.961 -6.193 1.00 0.00 C ATOM 1352 C ASP A 92 3.280 -8.578 -6.593 1.00 0.00 C ATOM 1353 O ASP A 92 3.587 -7.745 -5.736 1.00 0.00 O ATOM 1354 CB ASP A 92 1.277 -9.866 -5.862 1.00 0.00 C ATOM 1355 CG ASP A 92 0.501 -11.170 -6.059 1.00 0.00 C ATOM 1356 OD1 ASP A 92 0.890 -12.189 -5.450 1.00 0.00 O ATOM 1357 OD2 ASP A 92 -0.487 -11.128 -6.826 1.00 0.00 O ATOM 0 H ASP A 92 3.287 -9.860 -4.209 1.00 0.00 H new ATOM 0 HA ASP A 92 2.925 -10.675 -7.004 1.00 0.00 H new ATOM 0 HB2 ASP A 92 1.165 -9.544 -4.827 1.00 0.00 H new ATOM 0 HB3 ASP A 92 0.829 -9.093 -6.486 1.00 0.00 H new ATOM 1362 N ILE A 93 3.262 -8.308 -7.899 1.00 0.00 N ATOM 1363 CA ILE A 93 3.353 -6.952 -8.431 1.00 0.00 C ATOM 1364 C ILE A 93 1.902 -6.480 -8.544 1.00 0.00 C ATOM 1365 O ILE A 93 1.029 -7.260 -8.935 1.00 0.00 O ATOM 1366 CB ILE A 93 4.120 -6.934 -9.774 1.00 0.00 C ATOM 1367 CG1 ILE A 93 5.577 -7.405 -9.541 1.00 0.00 C ATOM 1368 CG2 ILE A 93 4.097 -5.523 -10.395 1.00 0.00 C ATOM 1369 CD1 ILE A 93 6.433 -7.478 -10.811 1.00 0.00 C ATOM 0 H ILE A 93 3.184 -9.027 -8.618 1.00 0.00 H new ATOM 0 HA ILE A 93 3.923 -6.278 -7.792 1.00 0.00 H new ATOM 0 HB ILE A 93 3.632 -7.614 -10.473 1.00 0.00 H new ATOM 0 HG12 ILE A 93 6.056 -6.727 -8.834 1.00 0.00 H new ATOM 0 HG13 ILE A 93 5.557 -8.390 -9.075 1.00 0.00 H new ATOM 0 HG21 ILE A 93 4.642 -5.532 -11.339 1.00 0.00 H new ATOM 0 HG22 ILE A 93 3.065 -5.221 -10.575 1.00 0.00 H new ATOM 0 HG23 ILE A 93 4.568 -4.817 -9.711 1.00 0.00 H new ATOM 0 HD11 ILE A 93 7.437 -7.816 -10.554 1.00 0.00 H new ATOM 0 HD12 ILE A 93 5.982 -8.179 -11.514 1.00 0.00 H new ATOM 0 HD13 ILE A 93 6.489 -6.491 -11.269 1.00 0.00 H new ATOM 1381 N TYR A 94 1.649 -5.225 -8.156 1.00 0.00 N ATOM 1382 CA TYR A 94 0.331 -4.731 -7.776 1.00 0.00 C ATOM 1383 C TYR A 94 0.029 -3.377 -8.424 1.00 0.00 C ATOM 1384 O TYR A 94 0.931 -2.557 -8.617 1.00 0.00 O ATOM 1385 CB TYR A 94 0.320 -4.615 -6.240 1.00 0.00 C ATOM 1386 CG TYR A 94 -0.993 -4.166 -5.634 1.00 0.00 C ATOM 1387 CD1 TYR A 94 -2.177 -4.800 -6.037 1.00 0.00 C ATOM 1388 CD2 TYR A 94 -1.042 -3.136 -4.669 1.00 0.00 C ATOM 1389 CE1 TYR A 94 -3.402 -4.405 -5.494 1.00 0.00 C ATOM 1390 CE2 TYR A 94 -2.275 -2.758 -4.099 1.00 0.00 C ATOM 1391 CZ TYR A 94 -3.462 -3.408 -4.499 1.00 0.00 C ATOM 1392 OH TYR A 94 -4.664 -3.151 -3.905 1.00 0.00 O ATOM 0 H TYR A 94 2.376 -4.512 -8.098 1.00 0.00 H new ATOM 0 HA TYR A 94 -0.442 -5.417 -8.122 1.00 0.00 H new ATOM 0 HB2 TYR A 94 0.584 -5.584 -5.817 1.00 0.00 H new ATOM 0 HB3 TYR A 94 1.098 -3.914 -5.940 1.00 0.00 H new ATOM 0 HD1 TYR A 94 -2.142 -5.594 -6.768 1.00 0.00 H new ATOM 0 HD2 TYR A 94 -0.133 -2.637 -4.367 1.00 0.00 H new ATOM 0 HE1 TYR A 94 -4.314 -4.869 -5.840 1.00 0.00 H new ATOM 0 HE2 TYR A 94 -2.311 -1.973 -3.358 1.00 0.00 H new ATOM 0 HH TYR A 94 -4.522 -2.614 -3.098 1.00 0.00 H new ATOM 1402 N THR A 95 -1.239 -3.099 -8.749 1.00 0.00 N ATOM 1403 CA THR A 95 -1.729 -1.788 -9.175 1.00 0.00 C ATOM 1404 C THR A 95 -3.227 -1.678 -8.864 1.00 0.00 C ATOM 1405 O THR A 95 -3.951 -2.675 -8.870 1.00 0.00 O ATOM 1406 CB THR A 95 -1.403 -1.588 -10.670 1.00 0.00 C ATOM 1407 OG1 THR A 95 0.000 -1.502 -10.823 1.00 0.00 O ATOM 1408 CG2 THR A 95 -1.990 -0.314 -11.292 1.00 0.00 C ATOM 0 H THR A 95 -1.974 -3.805 -8.721 1.00 0.00 H new ATOM 0 HA THR A 95 -1.233 -0.987 -8.627 1.00 0.00 H new ATOM 0 HB THR A 95 -1.850 -2.441 -11.180 1.00 0.00 H new ATOM 0 HG1 THR A 95 0.426 -1.505 -9.940 1.00 0.00 H new ATOM 0 HG21 THR A 95 -1.708 -0.259 -12.344 1.00 0.00 H new ATOM 0 HG22 THR A 95 -3.077 -0.335 -11.208 1.00 0.00 H new ATOM 0 HG23 THR A 95 -1.603 0.559 -10.767 1.00 0.00 H new ATOM 1416 N ARG A 96 -3.708 -0.458 -8.598 1.00 0.00 N ATOM 1417 CA ARG A 96 -5.114 -0.165 -8.347 1.00 0.00 C ATOM 1418 C ARG A 96 -5.464 1.231 -8.861 1.00 0.00 C ATOM 1419 O ARG A 96 -4.586 2.094 -8.920 1.00 0.00 O ATOM 1420 CB ARG A 96 -5.407 -0.329 -6.844 1.00 0.00 C ATOM 1421 CG ARG A 96 -4.724 0.740 -5.980 1.00 0.00 C ATOM 1422 CD ARG A 96 -4.844 0.393 -4.496 1.00 0.00 C ATOM 1423 NE ARG A 96 -4.254 1.448 -3.667 1.00 0.00 N ATOM 1424 CZ ARG A 96 -4.769 2.649 -3.399 1.00 0.00 C ATOM 1425 NH1 ARG A 96 -6.043 2.948 -3.660 1.00 0.00 N ATOM 1426 NH2 ARG A 96 -3.950 3.552 -2.864 1.00 0.00 N ATOM 0 H ARG A 96 -3.112 0.369 -8.551 1.00 0.00 H new ATOM 0 HA ARG A 96 -5.746 -0.868 -8.889 1.00 0.00 H new ATOM 0 HB2 ARG A 96 -6.484 -0.285 -6.682 1.00 0.00 H new ATOM 0 HB3 ARG A 96 -5.076 -1.316 -6.520 1.00 0.00 H new ATOM 0 HG2 ARG A 96 -3.673 0.820 -6.256 1.00 0.00 H new ATOM 0 HG3 ARG A 96 -5.178 1.713 -6.169 1.00 0.00 H new ATOM 0 HD2 ARG A 96 -5.893 0.261 -4.232 1.00 0.00 H new ATOM 0 HD3 ARG A 96 -4.343 -0.555 -4.298 1.00 0.00 H new ATOM 0 HE ARG A 96 -3.348 1.240 -3.248 1.00 0.00 H new ATOM 0 HH11 ARG A 96 -6.656 2.248 -4.077 1.00 0.00 H new ATOM 0 HH12 ARG A 96 -6.404 3.877 -3.442 1.00 0.00 H new ATOM 0 HH21 ARG A 96 -2.977 3.311 -2.677 1.00 0.00 H new ATOM 0 HH22 ARG A 96 -4.296 4.485 -2.641 1.00 0.00 H new ATOM 1440 N LEU A 97 -6.737 1.462 -9.198 1.00 0.00 N ATOM 1441 CA LEU A 97 -7.245 2.740 -9.697 1.00 0.00 C ATOM 1442 C LEU A 97 -8.726 2.923 -9.367 1.00 0.00 C ATOM 1443 O LEU A 97 -9.443 1.944 -9.163 1.00 0.00 O ATOM 1444 CB LEU A 97 -6.978 2.895 -11.210 1.00 0.00 C ATOM 1445 CG LEU A 97 -7.907 2.118 -12.173 1.00 0.00 C ATOM 1446 CD1 LEU A 97 -7.550 2.497 -13.616 1.00 0.00 C ATOM 1447 CD2 LEU A 97 -7.815 0.592 -12.028 1.00 0.00 C ATOM 0 H LEU A 97 -7.460 0.746 -9.129 1.00 0.00 H new ATOM 0 HA LEU A 97 -6.700 3.533 -9.184 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -7.043 3.954 -11.458 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -5.952 2.584 -11.406 1.00 0.00 H new ATOM 0 HG LEU A 97 -8.929 2.398 -11.917 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -8.198 1.956 -14.305 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -7.687 3.569 -13.755 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -6.511 2.236 -13.814 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -8.495 0.118 -12.736 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -6.795 0.268 -12.232 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -8.090 0.306 -11.013 1.00 0.00 H new ATOM 1459 N GLY A 98 -9.185 4.176 -9.320 1.00 0.00 N ATOM 1460 CA GLY A 98 -10.547 4.548 -8.961 1.00 0.00 C ATOM 1461 C GLY A 98 -10.566 5.993 -8.474 1.00 0.00 C ATOM 1462 O GLY A 98 -10.183 6.883 -9.234 1.00 0.00 O ATOM 0 H GLY A 98 -8.598 4.981 -9.538 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -11.206 4.434 -9.822 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -10.923 3.885 -8.182 1.00 0.00 H new ATOM 1466 N GLY A 99 -10.981 6.237 -7.225 1.00 0.00 N ATOM 1467 CA GLY A 99 -11.092 7.579 -6.663 1.00 0.00 C ATOM 1468 C GLY A 99 -10.756 7.649 -5.177 1.00 0.00 C ATOM 1469 O GLY A 99 -10.594 6.631 -4.498 1.00 0.00 O ATOM 0 H GLY A 99 -11.250 5.499 -6.574 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -10.427 8.248 -7.209 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -12.108 7.944 -6.815 1.00 0.00 H new ATOM 1473 N MET A 100 -10.648 8.884 -4.682 1.00 0.00 N ATOM 1474 CA MET A 100 -10.359 9.216 -3.298 1.00 0.00 C ATOM 1475 C MET A 100 -11.119 10.496 -2.958 1.00 0.00 C ATOM 1476 O MET A 100 -10.986 11.500 -3.658 1.00 0.00 O ATOM 1477 CB MET A 100 -8.837 9.361 -3.128 1.00 0.00 C ATOM 1478 CG MET A 100 -8.379 9.700 -1.702 1.00 0.00 C ATOM 1479 SD MET A 100 -8.612 11.403 -1.115 1.00 0.00 S ATOM 1480 CE MET A 100 -7.702 12.362 -2.355 1.00 0.00 C ATOM 0 H MET A 100 -10.766 9.712 -5.266 1.00 0.00 H new ATOM 0 HA MET A 100 -10.684 8.435 -2.610 1.00 0.00 H new ATOM 0 HB2 MET A 100 -8.361 8.430 -3.436 1.00 0.00 H new ATOM 0 HB3 MET A 100 -8.482 10.140 -3.803 1.00 0.00 H new ATOM 0 HG2 MET A 100 -8.904 9.035 -1.016 1.00 0.00 H new ATOM 0 HG3 MET A 100 -7.318 9.463 -1.627 1.00 0.00 H new ATOM 0 HE1 MET A 100 -7.536 13.373 -1.983 1.00 0.00 H new ATOM 0 HE2 MET A 100 -6.742 11.885 -2.551 1.00 0.00 H new ATOM 0 HE3 MET A 100 -8.281 12.406 -3.278 1.00 0.00 H new ATOM 1490 N VAL A 101 -11.909 10.460 -1.884 1.00 0.00 N ATOM 1491 CA VAL A 101 -12.585 11.628 -1.328 1.00 0.00 C ATOM 1492 C VAL A 101 -11.903 11.972 -0.002 1.00 0.00 C ATOM 1493 O VAL A 101 -11.491 11.077 0.732 1.00 0.00 O ATOM 1494 CB VAL A 101 -14.112 11.384 -1.261 1.00 0.00 C ATOM 1495 CG1 VAL A 101 -14.498 10.156 -0.427 1.00 0.00 C ATOM 1496 CG2 VAL A 101 -14.895 12.599 -0.744 1.00 0.00 C ATOM 0 H VAL A 101 -12.099 9.601 -1.368 1.00 0.00 H new ATOM 0 HA VAL A 101 -12.492 12.509 -1.963 1.00 0.00 H new ATOM 0 HB VAL A 101 -14.391 11.200 -2.299 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -15.582 10.045 -0.423 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -14.044 9.265 -0.860 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -14.143 10.284 0.595 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -15.959 12.363 -0.721 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -14.557 12.849 0.262 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -14.726 13.449 -1.405 1.00 0.00 H new ATOM 1506 N PHE A 102 -11.756 13.263 0.294 1.00 0.00 N ATOM 1507 CA PHE A 102 -10.994 13.796 1.419 1.00 0.00 C ATOM 1508 C PHE A 102 -11.791 14.946 2.039 1.00 0.00 C ATOM 1509 O PHE A 102 -12.470 15.680 1.316 1.00 0.00 O ATOM 1510 CB PHE A 102 -9.597 14.230 0.918 1.00 0.00 C ATOM 1511 CG PHE A 102 -9.011 15.459 1.588 1.00 0.00 C ATOM 1512 CD1 PHE A 102 -8.596 15.409 2.932 1.00 0.00 C ATOM 1513 CD2 PHE A 102 -8.941 16.677 0.884 1.00 0.00 C ATOM 1514 CE1 PHE A 102 -8.183 16.583 3.581 1.00 0.00 C ATOM 1515 CE2 PHE A 102 -8.522 17.850 1.531 1.00 0.00 C ATOM 1516 CZ PHE A 102 -8.156 17.804 2.885 1.00 0.00 C ATOM 0 H PHE A 102 -12.184 13.997 -0.270 1.00 0.00 H new ATOM 0 HA PHE A 102 -10.837 13.046 2.194 1.00 0.00 H new ATOM 0 HB2 PHE A 102 -8.906 13.398 1.058 1.00 0.00 H new ATOM 0 HB3 PHE A 102 -9.658 14.417 -0.154 1.00 0.00 H new ATOM 0 HD1 PHE A 102 -8.595 14.469 3.463 1.00 0.00 H new ATOM 0 HD2 PHE A 102 -9.212 16.709 -0.161 1.00 0.00 H new ATOM 0 HE1 PHE A 102 -7.885 16.548 4.618 1.00 0.00 H new ATOM 0 HE2 PHE A 102 -8.481 18.784 0.989 1.00 0.00 H new ATOM 0 HZ PHE A 102 -7.853 18.708 3.393 1.00 0.00 H new ATOM 1526 N ARG A 103 -11.688 15.115 3.366 1.00 0.00 N ATOM 1527 CA ARG A 103 -12.275 16.227 4.104 1.00 0.00 C ATOM 1528 C ARG A 103 -11.315 16.688 5.207 1.00 0.00 C ATOM 1529 O ARG A 103 -10.599 15.887 5.818 1.00 0.00 O ATOM 1530 CB ARG A 103 -13.628 15.792 4.695 1.00 0.00 C ATOM 1531 CG ARG A 103 -14.526 16.977 5.096 1.00 0.00 C ATOM 1532 CD ARG A 103 -15.669 16.540 6.025 1.00 0.00 C ATOM 1533 NE ARG A 103 -15.177 16.207 7.377 1.00 0.00 N ATOM 1534 CZ ARG A 103 -14.932 17.049 8.390 1.00 0.00 C ATOM 1535 NH1 ARG A 103 -15.219 18.343 8.290 1.00 0.00 N ATOM 1536 NH2 ARG A 103 -14.388 16.568 9.505 1.00 0.00 N ATOM 0 H ARG A 103 -11.180 14.463 3.964 1.00 0.00 H new ATOM 0 HA ARG A 103 -12.444 17.067 3.430 1.00 0.00 H new ATOM 0 HB2 ARG A 103 -14.154 15.177 3.965 1.00 0.00 H new ATOM 0 HB3 ARG A 103 -13.450 15.167 5.570 1.00 0.00 H new ATOM 0 HG2 ARG A 103 -13.924 17.737 5.594 1.00 0.00 H new ATOM 0 HG3 ARG A 103 -14.942 17.437 4.200 1.00 0.00 H new ATOM 0 HD2 ARG A 103 -16.408 17.338 6.093 1.00 0.00 H new ATOM 0 HD3 ARG A 103 -16.174 15.674 5.598 1.00 0.00 H new ATOM 0 HE ARG A 103 -15.003 15.219 7.561 1.00 0.00 H new ATOM 0 HH11 ARG A 103 -15.632 18.709 7.432 1.00 0.00 H new ATOM 0 HH12 ARG A 103 -15.026 18.970 9.071 1.00 0.00 H new ATOM 0 HH21 ARG A 103 -14.166 15.575 9.577 1.00 0.00 H new ATOM 0 HH22 ARG A 103 -14.193 17.192 10.288 1.00 0.00 H new ATOM 1779 N SER A 120 -11.082 13.525 -5.898 1.00 0.00 N ATOM 1780 CA SER A 120 -10.279 13.253 -7.078 1.00 0.00 C ATOM 1781 C SER A 120 -10.366 11.786 -7.533 1.00 0.00 C ATOM 1782 O SER A 120 -10.598 10.891 -6.712 1.00 0.00 O ATOM 1783 CB SER A 120 -8.822 13.583 -6.722 1.00 0.00 C ATOM 1784 OG SER A 120 -8.727 14.876 -6.148 1.00 0.00 O ATOM 0 HA SER A 120 -10.653 13.860 -7.902 1.00 0.00 H new ATOM 0 HB2 SER A 120 -8.436 12.840 -6.024 1.00 0.00 H new ATOM 0 HB3 SER A 120 -8.203 13.531 -7.618 1.00 0.00 H new ATOM 0 HG SER A 120 -9.555 15.082 -5.666 1.00 0.00 H new ATOM 1790 N PRO A 121 -10.075 11.503 -8.818 1.00 0.00 N ATOM 1791 CA PRO A 121 -9.689 10.162 -9.231 1.00 0.00 C ATOM 1792 C PRO A 121 -8.341 9.821 -8.574 1.00 0.00 C ATOM 1793 O PRO A 121 -7.595 10.718 -8.170 1.00 0.00 O ATOM 1794 CB PRO A 121 -9.600 10.216 -10.757 1.00 0.00 C ATOM 1795 CG PRO A 121 -9.197 11.664 -11.031 1.00 0.00 C ATOM 1796 CD PRO A 121 -9.899 12.443 -9.918 1.00 0.00 C ATOM 0 HA PRO A 121 -10.394 9.388 -8.929 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -8.862 9.513 -11.143 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -10.552 9.967 -11.225 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -8.116 11.794 -10.992 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -9.523 11.992 -12.018 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -9.303 13.301 -9.606 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -10.860 12.829 -10.258 1.00 0.00 H new ATOM 1804 N VAL A 122 -8.006 8.532 -8.473 1.00 0.00 N ATOM 1805 CA VAL A 122 -6.759 8.097 -7.856 1.00 0.00 C ATOM 1806 C VAL A 122 -6.274 6.811 -8.527 1.00 0.00 C ATOM 1807 O VAL A 122 -7.070 6.045 -9.076 1.00 0.00 O ATOM 1808 CB VAL A 122 -6.967 7.965 -6.322 1.00 0.00 C ATOM 1809 CG1 VAL A 122 -7.494 6.592 -5.880 1.00 0.00 C ATOM 1810 CG2 VAL A 122 -5.682 8.272 -5.544 1.00 0.00 C ATOM 0 H VAL A 122 -8.590 7.769 -8.815 1.00 0.00 H new ATOM 0 HA VAL A 122 -5.969 8.834 -8.003 1.00 0.00 H new ATOM 0 HB VAL A 122 -7.732 8.706 -6.088 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -7.613 6.579 -4.797 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -8.458 6.403 -6.353 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -6.786 5.818 -6.176 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -5.870 8.168 -4.475 1.00 0.00 H new ATOM 0 HG22 VAL A 122 -4.900 7.575 -5.844 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -5.361 9.291 -5.759 1.00 0.00 H new ATOM 1820 N PHE A 123 -4.970 6.550 -8.425 1.00 0.00 N ATOM 1821 CA PHE A 123 -4.352 5.266 -8.712 1.00 0.00 C ATOM 1822 C PHE A 123 -3.165 5.078 -7.772 1.00 0.00 C ATOM 1823 O PHE A 123 -2.717 6.046 -7.152 1.00 0.00 O ATOM 1824 CB PHE A 123 -3.935 5.176 -10.191 1.00 0.00 C ATOM 1825 CG PHE A 123 -2.761 6.054 -10.595 1.00 0.00 C ATOM 1826 CD1 PHE A 123 -2.968 7.403 -10.945 1.00 0.00 C ATOM 1827 CD2 PHE A 123 -1.457 5.518 -10.635 1.00 0.00 C ATOM 1828 CE1 PHE A 123 -1.881 8.208 -11.333 1.00 0.00 C ATOM 1829 CE2 PHE A 123 -0.371 6.323 -11.023 1.00 0.00 C ATOM 1830 CZ PHE A 123 -0.583 7.668 -11.376 1.00 0.00 C ATOM 0 H PHE A 123 -4.296 7.256 -8.129 1.00 0.00 H new ATOM 0 HA PHE A 123 -5.067 4.461 -8.543 1.00 0.00 H new ATOM 0 HB2 PHE A 123 -3.686 4.139 -10.418 1.00 0.00 H new ATOM 0 HB3 PHE A 123 -4.793 5.440 -10.809 1.00 0.00 H new ATOM 0 HD1 PHE A 123 -3.964 7.820 -10.915 1.00 0.00 H new ATOM 0 HD2 PHE A 123 -1.292 4.485 -10.367 1.00 0.00 H new ATOM 0 HE1 PHE A 123 -2.044 9.242 -11.598 1.00 0.00 H new ATOM 0 HE2 PHE A 123 0.626 5.908 -11.050 1.00 0.00 H new ATOM 0 HZ PHE A 123 0.250 8.285 -11.680 1.00 0.00 H new ATOM 1840 N ALA A 124 -2.658 3.849 -7.666 1.00 0.00 N ATOM 1841 CA ALA A 124 -1.335 3.563 -7.126 1.00 0.00 C ATOM 1842 C ALA A 124 -0.863 2.214 -7.676 1.00 0.00 C ATOM 1843 O ALA A 124 -1.689 1.410 -8.116 1.00 0.00 O ATOM 1844 CB ALA A 124 -1.385 3.536 -5.592 1.00 0.00 C ATOM 0 H ALA A 124 -3.165 3.014 -7.958 1.00 0.00 H new ATOM 0 HA ALA A 124 -0.634 4.342 -7.425 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -0.391 3.321 -5.199 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -1.720 4.505 -5.222 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -2.079 2.762 -5.264 1.00 0.00 H new ATOM 1850 N GLY A 125 0.439 1.928 -7.605 1.00 0.00 N ATOM 1851 CA GLY A 125 0.973 0.605 -7.906 1.00 0.00 C ATOM 1852 C GLY A 125 2.313 0.360 -7.228 1.00 0.00 C ATOM 1853 O GLY A 125 2.931 1.293 -6.718 1.00 0.00 O ATOM 0 H GLY A 125 1.149 2.609 -7.337 1.00 0.00 H new ATOM 0 HA2 GLY A 125 0.260 -0.155 -7.585 1.00 0.00 H new ATOM 0 HA3 GLY A 125 1.088 0.498 -8.985 1.00 0.00 H new ATOM 1857 N GLY A 126 2.743 -0.901 -7.197 1.00 0.00 N ATOM 1858 CA GLY A 126 3.917 -1.352 -6.469 1.00 0.00 C ATOM 1859 C GLY A 126 3.830 -2.859 -6.260 1.00 0.00 C ATOM 1860 O GLY A 126 3.782 -3.599 -7.243 1.00 0.00 O ATOM 0 H GLY A 126 2.267 -1.654 -7.693 1.00 0.00 H new ATOM 0 HA2 GLY A 126 4.822 -1.101 -7.023 1.00 0.00 H new ATOM 0 HA3 GLY A 126 3.981 -0.843 -5.507 1.00 0.00 H new ATOM 1864 N VAL A 127 3.793 -3.315 -5.003 1.00 0.00 N ATOM 1865 CA VAL A 127 3.803 -4.737 -4.657 1.00 0.00 C ATOM 1866 C VAL A 127 2.829 -5.042 -3.516 1.00 0.00 C ATOM 1867 O VAL A 127 2.507 -4.167 -2.708 1.00 0.00 O ATOM 1868 CB VAL A 127 5.234 -5.213 -4.300 1.00 0.00 C ATOM 1869 CG1 VAL A 127 6.162 -5.212 -5.525 1.00 0.00 C ATOM 1870 CG2 VAL A 127 5.882 -4.389 -3.172 1.00 0.00 C ATOM 0 H VAL A 127 3.755 -2.699 -4.191 1.00 0.00 H new ATOM 0 HA VAL A 127 3.470 -5.290 -5.535 1.00 0.00 H new ATOM 0 HB VAL A 127 5.111 -6.235 -3.942 1.00 0.00 H new ATOM 0 HG11 VAL A 127 7.155 -5.552 -5.230 1.00 0.00 H new ATOM 0 HG12 VAL A 127 5.761 -5.881 -6.286 1.00 0.00 H new ATOM 0 HG13 VAL A 127 6.230 -4.202 -5.929 1.00 0.00 H new ATOM 0 HG21 VAL A 127 6.882 -4.772 -2.970 1.00 0.00 H new ATOM 0 HG22 VAL A 127 5.949 -3.345 -3.477 1.00 0.00 H new ATOM 0 HG23 VAL A 127 5.275 -4.466 -2.270 1.00 0.00 H new ATOM 1880 N GLU A 128 2.427 -6.312 -3.422 1.00 0.00 N ATOM 1881 CA GLU A 128 1.728 -6.918 -2.293 1.00 0.00 C ATOM 1882 C GLU A 128 2.511 -8.197 -1.959 1.00 0.00 C ATOM 1883 O GLU A 128 3.055 -8.832 -2.857 1.00 0.00 O ATOM 1884 CB GLU A 128 0.238 -7.103 -2.653 1.00 0.00 C ATOM 1885 CG GLU A 128 -0.626 -7.689 -1.519 1.00 0.00 C ATOM 1886 CD GLU A 128 -2.006 -7.015 -1.397 1.00 0.00 C ATOM 1887 OE1 GLU A 128 -2.814 -7.069 -2.356 1.00 0.00 O ATOM 1888 OE2 GLU A 128 -2.266 -6.414 -0.328 1.00 0.00 O ATOM 0 H GLU A 128 2.591 -6.980 -4.175 1.00 0.00 H new ATOM 0 HA GLU A 128 1.701 -6.305 -1.392 1.00 0.00 H new ATOM 0 HB2 GLU A 128 -0.175 -6.137 -2.945 1.00 0.00 H new ATOM 0 HB3 GLU A 128 0.166 -7.757 -3.522 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -0.764 -8.756 -1.691 1.00 0.00 H new ATOM 0 HG3 GLU A 128 -0.093 -7.585 -0.574 1.00 0.00 H new ATOM 1895 N TYR A 129 2.666 -8.533 -0.678 1.00 0.00 N ATOM 1896 CA TYR A 129 3.714 -9.423 -0.184 1.00 0.00 C ATOM 1897 C TYR A 129 3.132 -10.314 0.913 1.00 0.00 C ATOM 1898 O TYR A 129 2.553 -9.794 1.867 1.00 0.00 O ATOM 1899 CB TYR A 129 4.866 -8.545 0.351 1.00 0.00 C ATOM 1900 CG TYR A 129 6.254 -9.131 0.186 1.00 0.00 C ATOM 1901 CD1 TYR A 129 6.554 -10.405 0.702 1.00 0.00 C ATOM 1902 CD2 TYR A 129 7.248 -8.407 -0.506 1.00 0.00 C ATOM 1903 CE1 TYR A 129 7.802 -10.992 0.456 1.00 0.00 C ATOM 1904 CE2 TYR A 129 8.512 -8.981 -0.732 1.00 0.00 C ATOM 1905 CZ TYR A 129 8.775 -10.297 -0.292 1.00 0.00 C ATOM 1906 OH TYR A 129 9.925 -10.924 -0.658 1.00 0.00 O ATOM 0 H TYR A 129 2.053 -8.186 0.060 1.00 0.00 H new ATOM 0 HA TYR A 129 4.097 -10.070 -0.973 1.00 0.00 H new ATOM 0 HB2 TYR A 129 4.833 -7.581 -0.157 1.00 0.00 H new ATOM 0 HB3 TYR A 129 4.694 -8.353 1.410 1.00 0.00 H new ATOM 0 HD1 TYR A 129 5.819 -10.933 1.291 1.00 0.00 H new ATOM 0 HD2 TYR A 129 7.038 -7.410 -0.863 1.00 0.00 H new ATOM 0 HE1 TYR A 129 8.019 -11.978 0.840 1.00 0.00 H new ATOM 0 HE2 TYR A 129 9.280 -8.417 -1.241 1.00 0.00 H new ATOM 0 HH TYR A 129 10.487 -10.305 -1.169 1.00 0.00 H new ATOM 1916 N ALA A 130 3.264 -11.640 0.801 1.00 0.00 N ATOM 1917 CA ALA A 130 2.742 -12.556 1.812 1.00 0.00 C ATOM 1918 C ALA A 130 3.625 -12.512 3.065 1.00 0.00 C ATOM 1919 O ALA A 130 4.849 -12.476 2.956 1.00 0.00 O ATOM 1920 CB ALA A 130 2.702 -13.975 1.236 1.00 0.00 C ATOM 0 H ALA A 130 3.729 -12.100 0.018 1.00 0.00 H new ATOM 0 HA ALA A 130 1.732 -12.255 2.091 1.00 0.00 H new ATOM 0 HB1 ALA A 130 2.313 -14.662 1.988 1.00 0.00 H new ATOM 0 HB2 ALA A 130 2.056 -13.993 0.358 1.00 0.00 H new ATOM 0 HB3 ALA A 130 3.709 -14.281 0.952 1.00 0.00 H new ATOM 1926 N ILE A 131 3.013 -12.559 4.256 1.00 0.00 N ATOM 1927 CA ILE A 131 3.732 -12.583 5.536 1.00 0.00 C ATOM 1928 C ILE A 131 3.440 -13.894 6.276 1.00 0.00 C ATOM 1929 O ILE A 131 4.301 -14.427 6.975 1.00 0.00 O ATOM 1930 CB ILE A 131 3.368 -11.321 6.358 1.00 0.00 C ATOM 1931 CG1 ILE A 131 3.800 -10.009 5.660 1.00 0.00 C ATOM 1932 CG2 ILE A 131 3.926 -11.360 7.794 1.00 0.00 C ATOM 1933 CD1 ILE A 131 5.311 -9.830 5.452 1.00 0.00 C ATOM 0 H ILE A 131 1.998 -12.582 4.359 1.00 0.00 H new ATOM 0 HA ILE A 131 4.809 -12.555 5.370 1.00 0.00 H new ATOM 0 HB ILE A 131 2.280 -11.331 6.420 1.00 0.00 H new ATOM 0 HG12 ILE A 131 3.310 -9.958 4.688 1.00 0.00 H new ATOM 0 HG13 ILE A 131 3.431 -9.168 6.247 1.00 0.00 H new ATOM 0 HG21 ILE A 131 3.639 -10.450 8.321 1.00 0.00 H new ATOM 0 HG22 ILE A 131 3.521 -12.226 8.318 1.00 0.00 H new ATOM 0 HG23 ILE A 131 5.013 -11.432 7.760 1.00 0.00 H new ATOM 0 HD11 ILE A 131 5.500 -8.878 4.955 1.00 0.00 H new ATOM 0 HD12 ILE A 131 5.815 -9.841 6.418 1.00 0.00 H new ATOM 0 HD13 ILE A 131 5.692 -10.643 4.834 1.00 0.00 H new ATOM 1945 N THR A 132 2.234 -14.442 6.140 1.00 0.00 N ATOM 1946 CA THR A 132 1.794 -15.753 6.618 1.00 0.00 C ATOM 1947 C THR A 132 0.520 -16.040 5.798 1.00 0.00 C ATOM 1948 O THR A 132 -0.087 -15.081 5.319 1.00 0.00 O ATOM 1949 CB THR A 132 1.564 -15.639 8.146 1.00 0.00 C ATOM 1950 OG1 THR A 132 2.813 -15.489 8.789 1.00 0.00 O ATOM 1951 CG2 THR A 132 0.855 -16.796 8.858 1.00 0.00 C ATOM 0 H THR A 132 1.484 -13.946 5.658 1.00 0.00 H new ATOM 0 HA THR A 132 2.499 -16.573 6.484 1.00 0.00 H new ATOM 0 HB THR A 132 0.891 -14.785 8.224 1.00 0.00 H new ATOM 0 HG1 THR A 132 3.523 -15.430 8.116 1.00 0.00 H new ATOM 0 HG21 THR A 132 0.768 -16.570 9.921 1.00 0.00 H new ATOM 0 HG22 THR A 132 -0.140 -16.930 8.433 1.00 0.00 H new ATOM 0 HG23 THR A 132 1.432 -17.712 8.728 1.00 0.00 H new ATOM 1959 N PRO A 133 0.057 -17.290 5.611 1.00 0.00 N ATOM 1960 CA PRO A 133 -1.103 -17.589 4.760 1.00 0.00 C ATOM 1961 C PRO A 133 -2.429 -16.892 5.129 1.00 0.00 C ATOM 1962 O PRO A 133 -3.403 -17.046 4.392 1.00 0.00 O ATOM 1963 CB PRO A 133 -1.230 -19.120 4.731 1.00 0.00 C ATOM 1964 CG PRO A 133 -0.345 -19.602 5.878 1.00 0.00 C ATOM 1965 CD PRO A 133 0.737 -18.531 5.943 1.00 0.00 C ATOM 0 HA PRO A 133 -0.914 -17.168 3.773 1.00 0.00 H new ATOM 0 HB2 PRO A 133 -2.264 -19.435 4.869 1.00 0.00 H new ATOM 0 HB3 PRO A 133 -0.898 -19.527 3.776 1.00 0.00 H new ATOM 0 HG2 PRO A 133 -0.899 -19.674 6.814 1.00 0.00 H new ATOM 0 HG3 PRO A 133 0.074 -20.588 5.679 1.00 0.00 H new ATOM 0 HD2 PRO A 133 1.185 -18.482 6.935 1.00 0.00 H new ATOM 0 HD3 PRO A 133 1.543 -18.740 5.239 1.00 0.00 H new ATOM 1973 N GLU A 134 -2.492 -16.106 6.209 1.00 0.00 N ATOM 1974 CA GLU A 134 -3.638 -15.298 6.619 1.00 0.00 C ATOM 1975 C GLU A 134 -3.388 -13.778 6.538 1.00 0.00 C ATOM 1976 O GLU A 134 -4.351 -13.022 6.666 1.00 0.00 O ATOM 1977 CB GLU A 134 -4.055 -15.730 8.035 1.00 0.00 C ATOM 1978 CG GLU A 134 -3.001 -15.395 9.106 1.00 0.00 C ATOM 1979 CD GLU A 134 -3.302 -16.103 10.428 1.00 0.00 C ATOM 1980 OE1 GLU A 134 -4.298 -15.706 11.080 1.00 0.00 O ATOM 1981 OE2 GLU A 134 -2.537 -17.031 10.767 1.00 0.00 O ATOM 0 H GLU A 134 -1.704 -16.014 6.851 1.00 0.00 H new ATOM 0 HA GLU A 134 -4.449 -15.480 5.914 1.00 0.00 H new ATOM 0 HB2 GLU A 134 -4.995 -15.243 8.295 1.00 0.00 H new ATOM 0 HB3 GLU A 134 -4.241 -16.804 8.040 1.00 0.00 H new ATOM 0 HG2 GLU A 134 -2.013 -15.689 8.751 1.00 0.00 H new ATOM 0 HG3 GLU A 134 -2.974 -14.317 9.267 1.00 0.00 H new ATOM 1988 N ILE A 135 -2.145 -13.310 6.317 1.00 0.00 N ATOM 1989 CA ILE A 135 -1.793 -11.887 6.403 1.00 0.00 C ATOM 1990 C ILE A 135 -0.667 -11.516 5.423 1.00 0.00 C ATOM 1991 O ILE A 135 0.221 -12.320 5.124 1.00 0.00 O ATOM 1992 CB ILE A 135 -1.479 -11.496 7.874 1.00 0.00 C ATOM 1993 CG1 ILE A 135 -1.160 -9.988 8.013 1.00 0.00 C ATOM 1994 CG2 ILE A 135 -0.368 -12.368 8.487 1.00 0.00 C ATOM 1995 CD1 ILE A 135 -1.153 -9.462 9.453 1.00 0.00 C ATOM 0 H ILE A 135 -1.358 -13.912 6.074 1.00 0.00 H new ATOM 0 HA ILE A 135 -2.654 -11.296 6.092 1.00 0.00 H new ATOM 0 HB ILE A 135 -2.386 -11.691 8.447 1.00 0.00 H new ATOM 0 HG12 ILE A 135 -0.185 -9.795 7.566 1.00 0.00 H new ATOM 0 HG13 ILE A 135 -1.892 -9.422 7.438 1.00 0.00 H new ATOM 0 HG21 ILE A 135 -0.186 -12.055 9.515 1.00 0.00 H new ATOM 0 HG22 ILE A 135 -0.677 -13.413 8.475 1.00 0.00 H new ATOM 0 HG23 ILE A 135 0.547 -12.254 7.905 1.00 0.00 H new ATOM 0 HD11 ILE A 135 -0.920 -8.397 9.450 1.00 0.00 H new ATOM 0 HD12 ILE A 135 -2.134 -9.618 9.902 1.00 0.00 H new ATOM 0 HD13 ILE A 135 -0.400 -9.997 10.032 1.00 0.00 H new ATOM 2007 N ALA A 136 -0.688 -10.270 4.941 1.00 0.00 N ATOM 2008 CA ALA A 136 0.191 -9.757 3.912 1.00 0.00 C ATOM 2009 C ALA A 136 0.592 -8.334 4.289 1.00 0.00 C ATOM 2010 O ALA A 136 -0.003 -7.734 5.188 1.00 0.00 O ATOM 2011 CB ALA A 136 -0.561 -9.794 2.572 1.00 0.00 C ATOM 0 H ALA A 136 -1.349 -9.570 5.278 1.00 0.00 H new ATOM 0 HA ALA A 136 1.095 -10.358 3.818 1.00 0.00 H new ATOM 0 HB1 ALA A 136 0.085 -9.411 1.782 1.00 0.00 H new ATOM 0 HB2 ALA A 136 -0.845 -10.821 2.343 1.00 0.00 H new ATOM 0 HB3 ALA A 136 -1.457 -9.176 2.640 1.00 0.00 H new ATOM 2017 N THR A 137 1.559 -7.784 3.564 1.00 0.00 N ATOM 2018 CA THR A 137 1.846 -6.360 3.500 1.00 0.00 C ATOM 2019 C THR A 137 1.695 -5.904 2.053 1.00 0.00 C ATOM 2020 O THR A 137 1.744 -6.720 1.135 1.00 0.00 O ATOM 2021 CB THR A 137 3.247 -6.035 4.053 1.00 0.00 C ATOM 2022 OG1 THR A 137 4.207 -6.949 3.568 1.00 0.00 O ATOM 2023 CG2 THR A 137 3.274 -6.052 5.581 1.00 0.00 C ATOM 0 H THR A 137 2.187 -8.340 2.984 1.00 0.00 H new ATOM 0 HA THR A 137 1.140 -5.819 4.130 1.00 0.00 H new ATOM 0 HB THR A 137 3.491 -5.030 3.709 1.00 0.00 H new ATOM 0 HG1 THR A 137 5.088 -6.721 3.931 1.00 0.00 H new ATOM 0 HG21 THR A 137 4.280 -5.818 5.930 1.00 0.00 H new ATOM 0 HG22 THR A 137 2.575 -5.310 5.966 1.00 0.00 H new ATOM 0 HG23 THR A 137 2.987 -7.041 5.939 1.00 0.00 H new ATOM 2031 N ARG A 138 1.517 -4.603 1.822 1.00 0.00 N ATOM 2032 CA ARG A 138 1.681 -4.032 0.488 1.00 0.00 C ATOM 2033 C ARG A 138 2.344 -2.672 0.581 1.00 0.00 C ATOM 2034 O ARG A 138 2.324 -2.051 1.645 1.00 0.00 O ATOM 2035 CB ARG A 138 0.354 -3.997 -0.290 1.00 0.00 C ATOM 2036 CG ARG A 138 -0.819 -3.314 0.418 1.00 0.00 C ATOM 2037 CD ARG A 138 -1.977 -3.198 -0.582 1.00 0.00 C ATOM 2038 NE ARG A 138 -3.230 -2.790 0.059 1.00 0.00 N ATOM 2039 CZ ARG A 138 -4.003 -3.504 0.883 1.00 0.00 C ATOM 2040 NH1 ARG A 138 -3.796 -4.799 1.108 1.00 0.00 N ATOM 2041 NH2 ARG A 138 -5.009 -2.873 1.479 1.00 0.00 N ATOM 0 H ARG A 138 1.260 -3.927 2.541 1.00 0.00 H new ATOM 0 HA ARG A 138 2.341 -4.681 -0.088 1.00 0.00 H new ATOM 0 HB2 ARG A 138 0.525 -3.490 -1.239 1.00 0.00 H new ATOM 0 HB3 ARG A 138 0.065 -5.022 -0.524 1.00 0.00 H new ATOM 0 HG2 ARG A 138 -1.126 -3.891 1.290 1.00 0.00 H new ATOM 0 HG3 ARG A 138 -0.525 -2.327 0.776 1.00 0.00 H new ATOM 0 HD2 ARG A 138 -1.715 -2.475 -1.355 1.00 0.00 H new ATOM 0 HD3 ARG A 138 -2.122 -4.157 -1.079 1.00 0.00 H new ATOM 0 HE ARG A 138 -3.552 -1.845 -0.149 1.00 0.00 H new ATOM 0 HH11 ARG A 138 -3.025 -5.280 0.644 1.00 0.00 H new ATOM 0 HH12 ARG A 138 -4.408 -5.310 1.744 1.00 0.00 H new ATOM 0 HH21 ARG A 138 -5.167 -1.881 1.300 1.00 0.00 H new ATOM 0 HH22 ARG A 138 -5.624 -3.380 2.116 1.00 0.00 H new ATOM 2055 N LEU A 139 2.931 -2.240 -0.537 1.00 0.00 N ATOM 2056 CA LEU A 139 3.634 -0.978 -0.705 1.00 0.00 C ATOM 2057 C LEU A 139 3.269 -0.489 -2.100 1.00 0.00 C ATOM 2058 O LEU A 139 3.518 -1.210 -3.071 1.00 0.00 O ATOM 2059 CB LEU A 139 5.166 -1.143 -0.592 1.00 0.00 C ATOM 2060 CG LEU A 139 5.680 -1.737 0.737 1.00 0.00 C ATOM 2061 CD1 LEU A 139 5.892 -3.257 0.650 1.00 0.00 C ATOM 2062 CD2 LEU A 139 7.006 -1.080 1.146 1.00 0.00 C ATOM 0 H LEU A 139 2.925 -2.795 -1.393 1.00 0.00 H new ATOM 0 HA LEU A 139 3.345 -0.276 0.077 1.00 0.00 H new ATOM 0 HB2 LEU A 139 5.505 -1.780 -1.409 1.00 0.00 H new ATOM 0 HB3 LEU A 139 5.629 -0.167 -0.736 1.00 0.00 H new ATOM 0 HG LEU A 139 4.913 -1.535 1.484 1.00 0.00 H new ATOM 0 HD11 LEU A 139 6.254 -3.629 1.608 1.00 0.00 H new ATOM 0 HD12 LEU A 139 4.947 -3.743 0.405 1.00 0.00 H new ATOM 0 HD13 LEU A 139 6.625 -3.478 -0.125 1.00 0.00 H new ATOM 0 HD21 LEU A 139 7.352 -1.512 2.085 1.00 0.00 H new ATOM 0 HD22 LEU A 139 7.752 -1.253 0.370 1.00 0.00 H new ATOM 0 HD23 LEU A 139 6.857 -0.008 1.273 1.00 0.00 H new ATOM 2074 N GLU A 140 2.651 0.689 -2.217 1.00 0.00 N ATOM 2075 CA GLU A 140 2.240 1.217 -3.510 1.00 0.00 C ATOM 2076 C GLU A 140 2.391 2.739 -3.576 1.00 0.00 C ATOM 2077 O GLU A 140 2.430 3.433 -2.563 1.00 0.00 O ATOM 2078 CB GLU A 140 0.851 0.685 -3.930 1.00 0.00 C ATOM 2079 CG GLU A 140 -0.169 0.316 -2.837 1.00 0.00 C ATOM 2080 CD GLU A 140 -0.757 1.501 -2.073 1.00 0.00 C ATOM 2081 OE1 GLU A 140 -0.185 1.939 -1.050 1.00 0.00 O ATOM 2082 OE2 GLU A 140 -1.885 1.932 -2.418 1.00 0.00 O ATOM 0 H GLU A 140 2.426 1.293 -1.426 1.00 0.00 H new ATOM 0 HA GLU A 140 2.925 0.837 -4.268 1.00 0.00 H new ATOM 0 HB2 GLU A 140 0.390 1.438 -4.570 1.00 0.00 H new ATOM 0 HB3 GLU A 140 1.010 -0.201 -4.544 1.00 0.00 H new ATOM 0 HG2 GLU A 140 -0.985 -0.241 -3.297 1.00 0.00 H new ATOM 0 HG3 GLU A 140 0.312 -0.354 -2.124 1.00 0.00 H new ATOM 2089 N TYR A 141 2.538 3.241 -4.802 1.00 0.00 N ATOM 2090 CA TYR A 141 3.112 4.534 -5.138 1.00 0.00 C ATOM 2091 C TYR A 141 2.341 5.157 -6.302 1.00 0.00 C ATOM 2092 O TYR A 141 1.780 4.434 -7.130 1.00 0.00 O ATOM 2093 CB TYR A 141 4.573 4.257 -5.526 1.00 0.00 C ATOM 2094 CG TYR A 141 5.412 5.446 -5.950 1.00 0.00 C ATOM 2095 CD1 TYR A 141 5.777 6.412 -4.999 1.00 0.00 C ATOM 2096 CD2 TYR A 141 5.903 5.539 -7.267 1.00 0.00 C ATOM 2097 CE1 TYR A 141 6.656 7.452 -5.339 1.00 0.00 C ATOM 2098 CE2 TYR A 141 6.788 6.574 -7.617 1.00 0.00 C ATOM 2099 CZ TYR A 141 7.184 7.523 -6.648 1.00 0.00 C ATOM 2100 OH TYR A 141 8.091 8.485 -6.968 1.00 0.00 O ATOM 0 H TYR A 141 2.242 2.724 -5.630 1.00 0.00 H new ATOM 0 HA TYR A 141 3.057 5.237 -4.307 1.00 0.00 H new ATOM 0 HB2 TYR A 141 5.064 3.782 -4.677 1.00 0.00 H new ATOM 0 HB3 TYR A 141 4.575 3.533 -6.341 1.00 0.00 H new ATOM 0 HD1 TYR A 141 5.378 6.354 -3.997 1.00 0.00 H new ATOM 0 HD2 TYR A 141 5.599 4.815 -8.008 1.00 0.00 H new ATOM 0 HE1 TYR A 141 6.928 8.195 -4.604 1.00 0.00 H new ATOM 0 HE2 TYR A 141 7.165 6.644 -8.627 1.00 0.00 H new ATOM 0 HH TYR A 141 7.723 9.367 -6.751 1.00 0.00 H new ATOM 2110 N GLN A 142 2.336 6.492 -6.377 1.00 0.00 N ATOM 2111 CA GLN A 142 1.679 7.270 -7.419 1.00 0.00 C ATOM 2112 C GLN A 142 2.550 8.490 -7.720 1.00 0.00 C ATOM 2113 O GLN A 142 2.711 9.360 -6.863 1.00 0.00 O ATOM 2114 CB GLN A 142 0.288 7.688 -6.923 1.00 0.00 C ATOM 2115 CG GLN A 142 -0.516 8.517 -7.938 1.00 0.00 C ATOM 2116 CD GLN A 142 -1.581 9.359 -7.242 1.00 0.00 C ATOM 2117 OE1 GLN A 142 -1.531 10.582 -7.245 1.00 0.00 O ATOM 2118 NE2 GLN A 142 -2.552 8.718 -6.612 1.00 0.00 N ATOM 0 H GLN A 142 2.808 7.076 -5.687 1.00 0.00 H new ATOM 0 HA GLN A 142 1.555 6.688 -8.332 1.00 0.00 H new ATOM 0 HB2 GLN A 142 -0.280 6.793 -6.670 1.00 0.00 H new ATOM 0 HB3 GLN A 142 0.399 8.265 -6.005 1.00 0.00 H new ATOM 0 HG2 GLN A 142 0.158 9.167 -8.496 1.00 0.00 H new ATOM 0 HG3 GLN A 142 -0.989 7.852 -8.661 1.00 0.00 H new ATOM 0 HE21 GLN A 142 -2.579 7.698 -6.619 1.00 0.00 H new ATOM 0 HE22 GLN A 142 -3.274 9.243 -6.119 1.00 0.00 H new ATOM 2127 N PHE A 143 3.088 8.558 -8.941 1.00 0.00 N ATOM 2128 CA PHE A 143 3.929 9.645 -9.429 1.00 0.00 C ATOM 2129 C PHE A 143 3.153 10.494 -10.437 1.00 0.00 C ATOM 2130 O PHE A 143 2.266 9.992 -11.128 1.00 0.00 O ATOM 2131 CB PHE A 143 5.188 9.030 -10.065 1.00 0.00 C ATOM 2132 CG PHE A 143 6.138 10.011 -10.730 1.00 0.00 C ATOM 2133 CD1 PHE A 143 7.136 10.657 -9.975 1.00 0.00 C ATOM 2134 CD2 PHE A 143 6.028 10.279 -12.110 1.00 0.00 C ATOM 2135 CE1 PHE A 143 8.010 11.569 -10.594 1.00 0.00 C ATOM 2136 CE2 PHE A 143 6.900 11.193 -12.727 1.00 0.00 C ATOM 2137 CZ PHE A 143 7.891 11.840 -11.968 1.00 0.00 C ATOM 0 H PHE A 143 2.942 7.829 -9.639 1.00 0.00 H new ATOM 0 HA PHE A 143 4.224 10.300 -8.609 1.00 0.00 H new ATOM 0 HB2 PHE A 143 5.735 8.490 -9.293 1.00 0.00 H new ATOM 0 HB3 PHE A 143 4.876 8.296 -10.807 1.00 0.00 H new ATOM 0 HD1 PHE A 143 7.230 10.452 -8.919 1.00 0.00 H new ATOM 0 HD2 PHE A 143 5.270 9.780 -12.696 1.00 0.00 H new ATOM 0 HE1 PHE A 143 8.774 12.062 -10.012 1.00 0.00 H new ATOM 0 HE2 PHE A 143 6.809 11.398 -13.783 1.00 0.00 H new ATOM 0 HZ PHE A 143 8.560 12.544 -12.440 1.00 0.00 H new ATOM 2372 N GLY A 160 6.750 10.984 -6.168 1.00 0.00 N ATOM 2373 CA GLY A 160 5.312 10.848 -6.011 1.00 0.00 C ATOM 2374 C GLY A 160 4.889 10.575 -4.568 1.00 0.00 C ATOM 2375 O GLY A 160 5.721 10.521 -3.658 1.00 0.00 O ATOM 0 HA2 GLY A 160 4.827 11.760 -6.359 1.00 0.00 H new ATOM 0 HA3 GLY A 160 4.958 10.036 -6.647 1.00 0.00 H new ATOM 2379 N MET A 161 3.582 10.405 -4.352 1.00 0.00 N ATOM 2380 CA MET A 161 3.055 9.964 -3.062 1.00 0.00 C ATOM 2381 C MET A 161 3.191 8.444 -2.940 1.00 0.00 C ATOM 2382 O MET A 161 3.215 7.734 -3.949 1.00 0.00 O ATOM 2383 CB MET A 161 1.602 10.425 -2.860 1.00 0.00 C ATOM 2384 CG MET A 161 0.604 9.840 -3.864 1.00 0.00 C ATOM 2385 SD MET A 161 -1.139 10.217 -3.530 1.00 0.00 S ATOM 2386 CE MET A 161 -1.183 11.978 -3.951 1.00 0.00 C ATOM 0 H MET A 161 2.867 10.568 -5.061 1.00 0.00 H new ATOM 0 HA MET A 161 3.641 10.427 -2.268 1.00 0.00 H new ATOM 0 HB2 MET A 161 1.285 10.155 -1.853 1.00 0.00 H new ATOM 0 HB3 MET A 161 1.567 11.513 -2.924 1.00 0.00 H new ATOM 0 HG2 MET A 161 0.855 10.209 -4.858 1.00 0.00 H new ATOM 0 HG3 MET A 161 0.727 8.757 -3.886 1.00 0.00 H new ATOM 0 HE1 MET A 161 -2.199 12.355 -3.833 1.00 0.00 H new ATOM 0 HE2 MET A 161 -0.513 12.527 -3.290 1.00 0.00 H new ATOM 0 HE3 MET A 161 -0.864 12.113 -4.984 1.00 0.00 H new ATOM 2396 N LEU A 162 3.246 7.943 -1.703 1.00 0.00 N ATOM 2397 CA LEU A 162 3.455 6.532 -1.388 1.00 0.00 C ATOM 2398 C LEU A 162 2.549 6.134 -0.227 1.00 0.00 C ATOM 2399 O LEU A 162 2.319 6.949 0.668 1.00 0.00 O ATOM 2400 CB LEU A 162 4.943 6.331 -1.030 1.00 0.00 C ATOM 2401 CG LEU A 162 5.346 4.854 -0.806 1.00 0.00 C ATOM 2402 CD1 LEU A 162 6.703 4.554 -1.458 1.00 0.00 C ATOM 2403 CD2 LEU A 162 5.438 4.507 0.688 1.00 0.00 C ATOM 0 H LEU A 162 3.143 8.526 -0.872 1.00 0.00 H new ATOM 0 HA LEU A 162 3.206 5.901 -2.241 1.00 0.00 H new ATOM 0 HB2 LEU A 162 5.557 6.747 -1.829 1.00 0.00 H new ATOM 0 HB3 LEU A 162 5.168 6.899 -0.127 1.00 0.00 H new ATOM 0 HG LEU A 162 4.567 4.246 -1.265 1.00 0.00 H new ATOM 0 HD11 LEU A 162 6.966 3.510 -1.288 1.00 0.00 H new ATOM 0 HD12 LEU A 162 6.641 4.742 -2.530 1.00 0.00 H new ATOM 0 HD13 LEU A 162 7.467 5.196 -1.020 1.00 0.00 H new ATOM 0 HD21 LEU A 162 5.723 3.461 0.802 1.00 0.00 H new ATOM 0 HD22 LEU A 162 6.186 5.141 1.163 1.00 0.00 H new ATOM 0 HD23 LEU A 162 4.470 4.672 1.160 1.00 0.00 H new ATOM 2415 N SER A 163 2.116 4.871 -0.187 1.00 0.00 N ATOM 2416 CA SER A 163 1.611 4.239 1.020 1.00 0.00 C ATOM 2417 C SER A 163 2.150 2.816 1.175 1.00 0.00 C ATOM 2418 O SER A 163 2.656 2.210 0.229 1.00 0.00 O ATOM 2419 CB SER A 163 0.077 4.328 1.104 1.00 0.00 C ATOM 2420 OG SER A 163 -0.609 4.059 -0.106 1.00 0.00 O ATOM 0 H SER A 163 2.109 4.259 -1.003 1.00 0.00 H new ATOM 0 HA SER A 163 1.988 4.795 1.878 1.00 0.00 H new ATOM 0 HB2 SER A 163 -0.271 3.628 1.864 1.00 0.00 H new ATOM 0 HB3 SER A 163 -0.195 5.328 1.443 1.00 0.00 H new ATOM 0 HG SER A 163 -0.120 3.380 -0.615 1.00 0.00 H new ATOM 2426 N LEU A 164 2.062 2.299 2.404 1.00 0.00 N ATOM 2427 CA LEU A 164 2.409 0.934 2.764 1.00 0.00 C ATOM 2428 C LEU A 164 1.531 0.477 3.926 1.00 0.00 C ATOM 2429 O LEU A 164 1.083 1.309 4.717 1.00 0.00 O ATOM 2430 CB LEU A 164 3.909 0.787 3.085 1.00 0.00 C ATOM 2431 CG LEU A 164 4.433 1.395 4.407 1.00 0.00 C ATOM 2432 CD1 LEU A 164 5.893 0.962 4.599 1.00 0.00 C ATOM 2433 CD2 LEU A 164 4.373 2.928 4.457 1.00 0.00 C ATOM 0 H LEU A 164 1.734 2.846 3.200 1.00 0.00 H new ATOM 0 HA LEU A 164 2.220 0.288 1.907 1.00 0.00 H new ATOM 0 HB2 LEU A 164 4.146 -0.277 3.090 1.00 0.00 H new ATOM 0 HB3 LEU A 164 4.471 1.235 2.266 1.00 0.00 H new ATOM 0 HG LEU A 164 3.781 1.027 5.200 1.00 0.00 H new ATOM 0 HD11 LEU A 164 6.278 1.383 5.528 1.00 0.00 H new ATOM 0 HD12 LEU A 164 5.947 -0.126 4.644 1.00 0.00 H new ATOM 0 HD13 LEU A 164 6.492 1.321 3.762 1.00 0.00 H new ATOM 0 HD21 LEU A 164 4.758 3.276 5.416 1.00 0.00 H new ATOM 0 HD22 LEU A 164 4.978 3.342 3.651 1.00 0.00 H new ATOM 0 HD23 LEU A 164 3.340 3.256 4.340 1.00 0.00 H new ATOM 2445 N GLY A 165 1.268 -0.830 4.019 1.00 0.00 N ATOM 2446 CA GLY A 165 0.313 -1.368 4.977 1.00 0.00 C ATOM 2447 C GLY A 165 0.408 -2.867 5.202 1.00 0.00 C ATOM 2448 O GLY A 165 1.166 -3.548 4.513 1.00 0.00 O ATOM 0 H GLY A 165 1.712 -1.537 3.433 1.00 0.00 H new ATOM 0 HA2 GLY A 165 0.455 -0.862 5.932 1.00 0.00 H new ATOM 0 HA3 GLY A 165 -0.695 -1.130 4.636 1.00 0.00 H new ATOM 2452 N VAL A 166 -0.404 -3.349 6.152 1.00 0.00 N ATOM 2453 CA VAL A 166 -0.652 -4.759 6.485 1.00 0.00 C ATOM 2454 C VAL A 166 -2.084 -5.126 6.067 1.00 0.00 C ATOM 2455 O VAL A 166 -2.946 -4.240 6.060 1.00 0.00 O ATOM 2456 CB VAL A 166 -0.450 -5.011 7.998 1.00 0.00 C ATOM 2457 CG1 VAL A 166 1.035 -4.972 8.381 1.00 0.00 C ATOM 2458 CG2 VAL A 166 -1.227 -4.029 8.896 1.00 0.00 C ATOM 0 H VAL A 166 -0.942 -2.721 6.749 1.00 0.00 H new ATOM 0 HA VAL A 166 0.059 -5.385 5.946 1.00 0.00 H new ATOM 0 HB VAL A 166 -0.853 -6.009 8.174 1.00 0.00 H new ATOM 0 HG11 VAL A 166 1.140 -5.153 9.451 1.00 0.00 H new ATOM 0 HG12 VAL A 166 1.574 -5.742 7.828 1.00 0.00 H new ATOM 0 HG13 VAL A 166 1.448 -3.994 8.136 1.00 0.00 H new ATOM 0 HG21 VAL A 166 -1.038 -4.266 9.943 1.00 0.00 H new ATOM 0 HG22 VAL A 166 -0.900 -3.010 8.689 1.00 0.00 H new ATOM 0 HG23 VAL A 166 -2.294 -4.116 8.692 1.00 0.00 H new ATOM 2468 N SER A 167 -2.360 -6.405 5.743 1.00 0.00 N ATOM 2469 CA SER A 167 -3.639 -6.815 5.176 1.00 0.00 C ATOM 2470 C SER A 167 -3.926 -8.261 5.580 1.00 0.00 C ATOM 2471 O SER A 167 -3.197 -9.156 5.168 1.00 0.00 O ATOM 2472 CB SER A 167 -3.536 -6.641 3.655 1.00 0.00 C ATOM 2473 OG SER A 167 -4.807 -6.583 3.035 1.00 0.00 O ATOM 0 H SER A 167 -1.699 -7.172 5.870 1.00 0.00 H new ATOM 0 HA SER A 167 -4.468 -6.211 5.546 1.00 0.00 H new ATOM 0 HB2 SER A 167 -2.983 -5.728 3.432 1.00 0.00 H new ATOM 0 HB3 SER A 167 -2.966 -7.469 3.234 1.00 0.00 H new ATOM 0 HG SER A 167 -4.889 -7.315 2.388 1.00 0.00 H new ATOM 2479 N TYR A 168 -4.955 -8.490 6.397 1.00 0.00 N ATOM 2480 CA TYR A 168 -5.398 -9.794 6.880 1.00 0.00 C ATOM 2481 C TYR A 168 -6.544 -10.302 5.992 1.00 0.00 C ATOM 2482 O TYR A 168 -7.392 -9.507 5.575 1.00 0.00 O ATOM 2483 CB TYR A 168 -5.852 -9.631 8.340 1.00 0.00 C ATOM 2484 CG TYR A 168 -6.035 -10.939 9.083 1.00 0.00 C ATOM 2485 CD1 TYR A 168 -7.263 -11.622 9.033 1.00 0.00 C ATOM 2486 CD2 TYR A 168 -4.963 -11.483 9.814 1.00 0.00 C ATOM 2487 CE1 TYR A 168 -7.406 -12.869 9.668 1.00 0.00 C ATOM 2488 CE2 TYR A 168 -5.100 -12.725 10.457 1.00 0.00 C ATOM 2489 CZ TYR A 168 -6.319 -13.436 10.369 1.00 0.00 C ATOM 2490 OH TYR A 168 -6.443 -14.666 10.941 1.00 0.00 O ATOM 0 H TYR A 168 -5.531 -7.729 6.757 1.00 0.00 H new ATOM 0 HA TYR A 168 -4.591 -10.526 6.836 1.00 0.00 H new ATOM 0 HB2 TYR A 168 -5.119 -9.024 8.871 1.00 0.00 H new ATOM 0 HB3 TYR A 168 -6.793 -9.082 8.357 1.00 0.00 H new ATOM 0 HD1 TYR A 168 -8.099 -11.188 8.505 1.00 0.00 H new ATOM 0 HD2 TYR A 168 -4.030 -10.943 9.881 1.00 0.00 H new ATOM 0 HE1 TYR A 168 -8.349 -13.394 9.619 1.00 0.00 H new ATOM 0 HE2 TYR A 168 -4.274 -13.136 11.018 1.00 0.00 H new ATOM 0 HH TYR A 168 -5.602 -14.908 11.383 1.00 0.00 H new ATOM 2500 N ARG A 169 -6.603 -11.610 5.709 1.00 0.00 N ATOM 2501 CA ARG A 169 -7.601 -12.178 4.792 1.00 0.00 C ATOM 2502 C ARG A 169 -8.872 -12.580 5.540 1.00 0.00 C ATOM 2503 O ARG A 169 -8.830 -12.928 6.718 1.00 0.00 O ATOM 2504 CB ARG A 169 -7.060 -13.441 4.103 1.00 0.00 C ATOM 2505 CG ARG A 169 -5.804 -13.220 3.247 1.00 0.00 C ATOM 2506 CD ARG A 169 -5.554 -14.399 2.292 1.00 0.00 C ATOM 2507 NE ARG A 169 -5.405 -15.690 2.991 1.00 0.00 N ATOM 2508 CZ ARG A 169 -6.299 -16.684 3.111 1.00 0.00 C ATOM 2509 NH1 ARG A 169 -7.530 -16.593 2.616 1.00 0.00 N ATOM 2510 NH2 ARG A 169 -5.932 -17.788 3.749 1.00 0.00 N ATOM 0 H ARG A 169 -5.965 -12.300 6.106 1.00 0.00 H new ATOM 0 HA ARG A 169 -7.822 -11.405 4.056 1.00 0.00 H new ATOM 0 HB2 ARG A 169 -6.836 -14.186 4.866 1.00 0.00 H new ATOM 0 HB3 ARG A 169 -7.845 -13.857 3.471 1.00 0.00 H new ATOM 0 HG2 ARG A 169 -5.913 -12.301 2.671 1.00 0.00 H new ATOM 0 HG3 ARG A 169 -4.939 -13.088 3.897 1.00 0.00 H new ATOM 0 HD2 ARG A 169 -6.382 -14.469 1.586 1.00 0.00 H new ATOM 0 HD3 ARG A 169 -4.654 -14.202 1.710 1.00 0.00 H new ATOM 0 HE ARG A 169 -4.504 -15.848 3.442 1.00 0.00 H new ATOM 0 HH11 ARG A 169 -7.821 -15.747 2.126 1.00 0.00 H new ATOM 0 HH12 ARG A 169 -8.183 -17.369 2.726 1.00 0.00 H new ATOM 0 HH21 ARG A 169 -4.991 -17.866 4.134 1.00 0.00 H new ATOM 0 HH22 ARG A 169 -6.591 -18.559 3.855 1.00 0.00 H new ATOM 2524 N PHE A 170 -10.004 -12.624 4.832 1.00 0.00 N ATOM 2525 CA PHE A 170 -11.208 -13.262 5.338 1.00 0.00 C ATOM 2526 C PHE A 170 -10.970 -14.775 5.358 1.00 0.00 C ATOM 2527 O PHE A 170 -10.842 -15.405 4.301 1.00 0.00 O ATOM 2528 CB PHE A 170 -12.388 -12.881 4.433 1.00 0.00 C ATOM 2529 CG PHE A 170 -13.739 -13.396 4.890 1.00 0.00 C ATOM 2530 CD1 PHE A 170 -14.540 -12.616 5.746 1.00 0.00 C ATOM 2531 CD2 PHE A 170 -14.207 -14.649 4.448 1.00 0.00 C ATOM 2532 CE1 PHE A 170 -15.799 -13.086 6.158 1.00 0.00 C ATOM 2533 CE2 PHE A 170 -15.464 -15.121 4.864 1.00 0.00 C ATOM 2534 CZ PHE A 170 -16.261 -14.339 5.718 1.00 0.00 C ATOM 0 H PHE A 170 -10.105 -12.220 3.901 1.00 0.00 H new ATOM 0 HA PHE A 170 -11.443 -12.933 6.350 1.00 0.00 H new ATOM 0 HB2 PHE A 170 -12.435 -11.794 4.362 1.00 0.00 H new ATOM 0 HB3 PHE A 170 -12.193 -13.258 3.429 1.00 0.00 H new ATOM 0 HD1 PHE A 170 -14.186 -11.654 6.087 1.00 0.00 H new ATOM 0 HD2 PHE A 170 -13.598 -15.249 3.788 1.00 0.00 H new ATOM 0 HE1 PHE A 170 -16.412 -12.484 6.813 1.00 0.00 H new ATOM 0 HE2 PHE A 170 -15.817 -16.084 4.528 1.00 0.00 H new ATOM 0 HZ PHE A 170 -17.228 -14.700 6.036 1.00 0.00 H new