USER MOD reduce.3.24.130724 H: found=0, std=0, add=644, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 544 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 HIS : no HD1:sc= -0.917 K(o=-0.92,f=-0.14) USER MOD Set 1.2: A 190 CYS SG : rot 180:sc= 0 USER MOD Single : A 159 TYR OH : rot 180:sc= 0 USER MOD Single : A 164 TYR OH : rot 180:sc= 0 USER MOD Single : A 167 LYS NZ :NH3+ -131:sc= -1.26 (180deg=-3.6!) USER MOD Single : A 170 LYS NZ :NH3+ -157:sc= -3.1! (180deg=-3.39!) USER MOD Single : A 175 THR OG1 : rot 180:sc= 0 USER MOD Single : A 176 THR OG1 : rot -35:sc= -0.53 USER MOD Single : A 177 TYR OH : rot 180:sc= 0 USER MOD Single : A 181 ASN : amide:sc= -0.588 K(o=-0.59,f=0) USER MOD Single : A 185 CYS SG : rot -4:sc= -0.324 USER MOD Single : A 188 HIS : no HE2:sc= -16.4! C(o=-16!,f=-19!) USER MOD Single : A 189 ASN : amide:sc= 0 K(o=0,f=-0.77) USER MOD Single : A 196 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0501) USER MOD Single : A 213 SER OG : rot 180:sc= 0 USER MOD Single : A 232 LYS NZ :NH3+ -155:sc= -0.302 (180deg=-0.855) USER MOD Single : A 233 SER OG : rot 107:sc= 1.33 USER MOD Single : A 235 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 238 THR OG1 : rot 180:sc= 0.0529 USER MOD Single : A 240 GLN : amide:sc= -2.46 K(o=-2.5,f=-3.3!) USER MOD Single : A 243 LYS NZ :NH3+ 138:sc= -0.387 (180deg=-0.7) USER MOD Single : A 244 SER OG : rot 180:sc= 0 USER MOD Single : B 473 SER OG : rot 180:sc= 0 USER MOD Single : B 478 LYS NZ :NH3+ 163:sc= 0 (180deg=-0.36) USER MOD ----------------------------------------------------------------- ATOM 36 N TYR A 159 -5.053 -2.361 -4.128 1.00 4.32 N ATOM 37 CA TYR A 159 -4.553 -3.654 -3.694 1.00 3.20 C ATOM 38 C TYR A 159 -3.598 -4.248 -4.731 1.00 65.23 C ATOM 39 O TYR A 159 -3.421 -3.687 -5.811 1.00 72.33 O ATOM 40 CB TYR A 159 -5.779 -4.560 -3.568 1.00 41.23 C ATOM 41 CG TYR A 159 -6.717 -4.507 -4.776 1.00 32.41 C ATOM 42 CD1 TYR A 159 -7.458 -3.371 -5.025 1.00 14.44 C ATOM 43 CD2 TYR A 159 -6.822 -5.598 -5.616 1.00 12.24 C ATOM 44 CE1 TYR A 159 -8.342 -3.321 -6.162 1.00 21.12 C ATOM 45 CE2 TYR A 159 -7.705 -5.548 -6.753 1.00 23.32 C ATOM 46 CZ TYR A 159 -8.422 -4.413 -6.969 1.00 50.32 C ATOM 47 OH TYR A 159 -9.256 -4.367 -8.042 1.00 53.14 O ATOM 0 HA TYR A 159 -4.006 -3.559 -2.756 1.00 3.20 H new ATOM 0 HB2 TYR A 159 -5.446 -5.588 -3.424 1.00 41.23 H new ATOM 0 HB3 TYR A 159 -6.337 -4.278 -2.675 1.00 41.23 H new ATOM 0 HD1 TYR A 159 -7.376 -2.518 -4.367 1.00 14.44 H new ATOM 0 HD2 TYR A 159 -6.242 -6.488 -5.421 1.00 12.24 H new ATOM 0 HE1 TYR A 159 -8.927 -2.437 -6.369 1.00 21.12 H new ATOM 0 HE2 TYR A 159 -7.796 -6.393 -7.419 1.00 23.32 H new ATOM 0 HH TYR A 159 -9.210 -5.216 -8.529 1.00 53.14 H new ATOM 56 N ALA A 160 -3.008 -5.377 -4.366 1.00 51.34 N ATOM 57 CA ALA A 160 -2.075 -6.054 -5.251 1.00 43.44 C ATOM 58 C ALA A 160 -2.733 -7.317 -5.808 1.00 32.13 C ATOM 59 O ALA A 160 -3.601 -7.905 -5.164 1.00 50.21 O ATOM 60 CB ALA A 160 -0.780 -6.356 -4.495 1.00 42.42 C ATOM 0 H ALA A 160 -3.158 -5.840 -3.470 1.00 51.34 H new ATOM 0 HA ALA A 160 -1.817 -5.416 -6.096 1.00 43.44 H new ATOM 0 HB1 ALA A 160 -0.081 -6.864 -5.159 1.00 42.42 H new ATOM 0 HB2 ALA A 160 -0.337 -5.423 -4.146 1.00 42.42 H new ATOM 0 HB3 ALA A 160 -0.998 -6.996 -3.640 1.00 42.42 H new ATOM 66 N ILE A 161 -2.295 -7.699 -6.999 1.00 42.31 N ATOM 67 CA ILE A 161 -2.830 -8.882 -7.649 1.00 14.14 C ATOM 68 C ILE A 161 -1.675 -9.744 -8.162 1.00 21.12 C ATOM 69 O ILE A 161 -0.729 -9.231 -8.755 1.00 72.22 O ATOM 70 CB ILE A 161 -3.833 -8.489 -8.736 1.00 70.41 C ATOM 71 CG1 ILE A 161 -4.835 -9.616 -8.992 1.00 35.53 C ATOM 72 CG2 ILE A 161 -3.113 -8.060 -10.017 1.00 61.10 C ATOM 73 CD1 ILE A 161 -4.216 -10.713 -9.861 1.00 33.11 C ATOM 0 H ILE A 161 -1.575 -7.209 -7.530 1.00 42.31 H new ATOM 0 HA ILE A 161 -3.388 -9.488 -6.936 1.00 14.14 H new ATOM 0 HB ILE A 161 -4.401 -7.629 -8.382 1.00 70.41 H new ATOM 0 HG12 ILE A 161 -5.161 -10.040 -8.042 1.00 35.53 H new ATOM 0 HG13 ILE A 161 -5.721 -9.215 -9.483 1.00 35.53 H new ATOM 0 HG21 ILE A 161 -3.848 -7.786 -10.773 1.00 61.10 H new ATOM 0 HG22 ILE A 161 -2.473 -7.203 -9.805 1.00 61.10 H new ATOM 0 HG23 ILE A 161 -2.504 -8.885 -10.386 1.00 61.10 H new ATOM 0 HD11 ILE A 161 -4.949 -11.502 -10.028 1.00 33.11 H new ATOM 0 HD12 ILE A 161 -3.913 -10.291 -10.819 1.00 33.11 H new ATOM 0 HD13 ILE A 161 -3.344 -11.129 -9.356 1.00 33.11 H new ATOM 84 N VAL A 162 -1.791 -11.040 -7.913 1.00 73.54 N ATOM 85 CA VAL A 162 -0.768 -11.980 -8.342 1.00 44.14 C ATOM 86 C VAL A 162 -1.102 -12.486 -9.745 1.00 15.22 C ATOM 87 O VAL A 162 -2.145 -13.107 -9.953 1.00 71.25 O ATOM 88 CB VAL A 162 -0.629 -13.106 -7.316 1.00 72.00 C ATOM 89 CG1 VAL A 162 -0.266 -14.426 -7.998 1.00 35.53 C ATOM 90 CG2 VAL A 162 0.397 -12.745 -6.240 1.00 0.11 C ATOM 0 H VAL A 162 -2.578 -11.462 -7.420 1.00 73.54 H new ATOM 0 HA VAL A 162 0.203 -11.488 -8.398 1.00 44.14 H new ATOM 0 HB VAL A 162 -1.595 -13.235 -6.827 1.00 72.00 H new ATOM 0 HG11 VAL A 162 -0.173 -15.210 -7.247 1.00 35.53 H new ATOM 0 HG12 VAL A 162 -1.047 -14.695 -8.709 1.00 35.53 H new ATOM 0 HG13 VAL A 162 0.681 -14.315 -8.525 1.00 35.53 H new ATOM 0 HG21 VAL A 162 0.476 -13.563 -5.524 1.00 0.11 H new ATOM 0 HG22 VAL A 162 1.368 -12.575 -6.705 1.00 0.11 H new ATOM 0 HG23 VAL A 162 0.079 -11.839 -5.723 1.00 0.11 H new ATOM 100 N LEU A 163 -0.201 -12.203 -10.674 1.00 41.21 N ATOM 101 CA LEU A 163 -0.387 -12.623 -12.052 1.00 51.31 C ATOM 102 C LEU A 163 0.329 -13.955 -12.276 1.00 73.34 C ATOM 103 O LEU A 163 0.063 -14.651 -13.255 1.00 43.00 O ATOM 104 CB LEU A 163 0.054 -11.517 -13.013 1.00 61.42 C ATOM 105 CG LEU A 163 -0.064 -10.085 -12.487 1.00 74.30 C ATOM 106 CD1 LEU A 163 0.716 -9.111 -13.373 1.00 12.21 C ATOM 107 CD2 LEU A 163 -1.530 -9.676 -12.337 1.00 43.33 C ATOM 0 H LEU A 163 0.661 -11.687 -10.499 1.00 41.21 H new ATOM 0 HA LEU A 163 -1.444 -12.791 -12.260 1.00 51.31 H new ATOM 0 HB2 LEU A 163 1.093 -11.697 -13.290 1.00 61.42 H new ATOM 0 HB3 LEU A 163 -0.538 -11.598 -13.925 1.00 61.42 H new ATOM 0 HG LEU A 163 0.384 -10.046 -11.494 1.00 74.30 H new ATOM 0 HD11 LEU A 163 0.616 -8.100 -12.978 1.00 12.21 H new ATOM 0 HD12 LEU A 163 1.769 -9.394 -13.385 1.00 12.21 H new ATOM 0 HD13 LEU A 163 0.319 -9.145 -14.388 1.00 12.21 H new ATOM 0 HD21 LEU A 163 -1.586 -8.654 -11.962 1.00 43.33 H new ATOM 0 HD22 LEU A 163 -2.025 -9.734 -13.306 1.00 43.33 H new ATOM 0 HD23 LEU A 163 -2.025 -10.348 -11.636 1.00 43.33 H new ATOM 118 N TYR A 164 1.227 -14.271 -11.353 1.00 54.20 N ATOM 119 CA TYR A 164 1.985 -15.508 -11.439 1.00 23.42 C ATOM 120 C TYR A 164 2.325 -16.039 -10.044 1.00 75.15 C ATOM 121 O TYR A 164 2.354 -15.280 -9.077 1.00 53.24 O ATOM 122 CB TYR A 164 3.283 -15.158 -12.169 1.00 13.23 C ATOM 123 CG TYR A 164 3.127 -14.060 -13.223 1.00 33.41 C ATOM 124 CD1 TYR A 164 2.615 -14.366 -14.468 1.00 22.30 C ATOM 125 CD2 TYR A 164 3.498 -12.764 -12.929 1.00 14.33 C ATOM 126 CE1 TYR A 164 2.469 -13.332 -15.460 1.00 32.14 C ATOM 127 CE2 TYR A 164 3.351 -11.731 -13.921 1.00 42.43 C ATOM 128 CZ TYR A 164 2.844 -12.065 -15.138 1.00 24.13 C ATOM 129 OH TYR A 164 2.705 -11.089 -16.074 1.00 22.32 O ATOM 0 H TYR A 164 1.446 -13.692 -10.543 1.00 54.20 H new ATOM 0 HA TYR A 164 1.410 -16.276 -11.956 1.00 23.42 H new ATOM 0 HB2 TYR A 164 4.026 -14.842 -11.437 1.00 13.23 H new ATOM 0 HB3 TYR A 164 3.671 -16.056 -12.649 1.00 13.23 H new ATOM 0 HD1 TYR A 164 2.324 -15.380 -14.698 1.00 22.30 H new ATOM 0 HD2 TYR A 164 3.899 -12.525 -11.955 1.00 14.33 H new ATOM 0 HE1 TYR A 164 2.070 -13.558 -16.438 1.00 32.14 H new ATOM 0 HE2 TYR A 164 3.637 -10.713 -13.703 1.00 42.43 H new ATOM 0 HH TYR A 164 3.012 -10.235 -15.704 1.00 22.32 H new ATOM 138 N ASP A 165 2.574 -17.339 -9.986 1.00 72.34 N ATOM 139 CA ASP A 165 2.911 -17.980 -8.727 1.00 62.22 C ATOM 140 C ASP A 165 4.426 -17.920 -8.519 1.00 31.21 C ATOM 141 O ASP A 165 5.186 -17.830 -9.482 1.00 10.23 O ATOM 142 CB ASP A 165 2.493 -19.452 -8.729 1.00 53.21 C ATOM 143 CG ASP A 165 3.053 -20.283 -9.885 1.00 52.14 C ATOM 144 OD1 ASP A 165 4.239 -20.175 -10.232 1.00 55.01 O ATOM 145 OD2 ASP A 165 2.207 -21.078 -10.445 1.00 51.21 O ATOM 0 H ASP A 165 2.549 -17.965 -10.791 1.00 72.34 H new ATOM 0 HA ASP A 165 2.383 -17.456 -7.930 1.00 62.22 H new ATOM 0 HB2 ASP A 165 2.809 -19.905 -7.789 1.00 53.21 H new ATOM 0 HB3 ASP A 165 1.405 -19.505 -8.758 1.00 53.21 H new ATOM 150 N PHE A 166 4.821 -17.974 -7.255 1.00 12.04 N ATOM 151 CA PHE A 166 6.231 -17.927 -6.908 1.00 2.55 C ATOM 152 C PHE A 166 6.488 -18.611 -5.564 1.00 10.21 C ATOM 153 O PHE A 166 5.785 -18.351 -4.588 1.00 64.54 O ATOM 154 CB PHE A 166 6.615 -16.450 -6.797 1.00 53.50 C ATOM 155 CG PHE A 166 7.947 -16.205 -6.088 1.00 62.45 C ATOM 156 CD1 PHE A 166 8.972 -17.087 -6.241 1.00 15.55 C ATOM 157 CD2 PHE A 166 8.108 -15.106 -5.303 1.00 70.33 C ATOM 158 CE1 PHE A 166 10.209 -16.860 -5.582 1.00 53.21 C ATOM 159 CE2 PHE A 166 9.345 -14.880 -4.643 1.00 1.42 C ATOM 160 CZ PHE A 166 10.370 -15.761 -4.797 1.00 5.41 C ATOM 0 H PHE A 166 4.188 -18.050 -6.458 1.00 12.04 H new ATOM 0 HA PHE A 166 6.818 -18.444 -7.667 1.00 2.55 H new ATOM 0 HB2 PHE A 166 6.664 -16.022 -7.798 1.00 53.50 H new ATOM 0 HB3 PHE A 166 5.827 -15.920 -6.262 1.00 53.50 H new ATOM 0 HD1 PHE A 166 8.844 -17.960 -6.864 1.00 15.55 H new ATOM 0 HD2 PHE A 166 7.295 -14.405 -5.182 1.00 70.33 H new ATOM 0 HE1 PHE A 166 11.022 -17.560 -5.704 1.00 53.21 H new ATOM 0 HE2 PHE A 166 9.472 -14.008 -4.018 1.00 1.42 H new ATOM 0 HZ PHE A 166 11.311 -15.588 -4.296 1.00 5.41 H new ATOM 169 N LYS A 167 7.496 -19.470 -5.556 1.00 14.45 N ATOM 170 CA LYS A 167 7.855 -20.192 -4.348 1.00 22.33 C ATOM 171 C LYS A 167 8.595 -19.250 -3.396 1.00 24.45 C ATOM 172 O LYS A 167 9.589 -18.634 -3.776 1.00 62.21 O ATOM 173 CB LYS A 167 8.640 -21.459 -4.693 1.00 52.24 C ATOM 174 CG LYS A 167 7.765 -22.456 -5.456 1.00 50.44 C ATOM 175 CD LYS A 167 8.349 -23.868 -5.380 1.00 52.32 C ATOM 176 CE LYS A 167 8.127 -24.479 -3.996 1.00 62.12 C ATOM 177 NZ LYS A 167 9.255 -24.148 -3.096 1.00 22.03 N ATOM 0 H LYS A 167 8.076 -19.682 -6.368 1.00 14.45 H new ATOM 0 HA LYS A 167 6.959 -20.532 -3.828 1.00 22.33 H new ATOM 0 HB2 LYS A 167 9.511 -21.199 -5.295 1.00 52.24 H new ATOM 0 HB3 LYS A 167 9.011 -21.921 -3.778 1.00 52.24 H new ATOM 0 HG2 LYS A 167 6.757 -22.453 -5.041 1.00 50.44 H new ATOM 0 HG3 LYS A 167 7.682 -22.149 -6.498 1.00 50.44 H new ATOM 0 HD2 LYS A 167 7.885 -24.499 -6.138 1.00 52.32 H new ATOM 0 HD3 LYS A 167 9.416 -23.836 -5.601 1.00 52.32 H new ATOM 0 HE2 LYS A 167 7.195 -24.106 -3.573 1.00 62.12 H new ATOM 0 HE3 LYS A 167 8.028 -25.561 -4.081 1.00 62.12 H new ATOM 0 HZ1 LYS A 167 9.588 -25.013 -2.625 1.00 22.03 H new ATOM 0 HZ2 LYS A 167 10.032 -23.735 -3.650 1.00 22.03 H new ATOM 0 HZ3 LYS A 167 8.938 -23.464 -2.380 1.00 22.03 H new ATOM 186 N ALA A 168 8.081 -19.168 -2.177 1.00 33.03 N ATOM 187 CA ALA A 168 8.680 -18.312 -1.169 1.00 42.35 C ATOM 188 C ALA A 168 9.242 -19.178 -0.039 1.00 11.30 C ATOM 189 O ALA A 168 8.572 -20.092 0.440 1.00 53.43 O ATOM 190 CB ALA A 168 7.641 -17.305 -0.670 1.00 61.22 C ATOM 0 H ALA A 168 7.256 -19.681 -1.866 1.00 33.03 H new ATOM 0 HA ALA A 168 9.508 -17.743 -1.592 1.00 42.35 H new ATOM 0 HB1 ALA A 168 8.091 -16.663 0.087 1.00 61.22 H new ATOM 0 HB2 ALA A 168 7.295 -16.695 -1.505 1.00 61.22 H new ATOM 0 HB3 ALA A 168 6.796 -17.839 -0.236 1.00 61.22 H new ATOM 196 N GLU A 169 10.467 -18.860 0.354 1.00 14.23 N ATOM 197 CA GLU A 169 11.127 -19.598 1.418 1.00 44.31 C ATOM 198 C GLU A 169 11.834 -18.633 2.372 1.00 61.24 C ATOM 199 O GLU A 169 12.593 -19.060 3.241 1.00 41.23 O ATOM 200 CB GLU A 169 12.108 -20.623 0.847 1.00 63.04 C ATOM 201 CG GLU A 169 12.898 -20.034 -0.323 1.00 51.34 C ATOM 202 CD GLU A 169 14.022 -20.977 -0.757 1.00 5.10 C ATOM 203 OE1 GLU A 169 14.426 -20.962 -1.929 1.00 62.01 O ATOM 204 OE2 GLU A 169 14.478 -21.745 0.174 1.00 1.10 O ATOM 0 H GLU A 169 11.020 -18.101 -0.045 1.00 14.23 H new ATOM 0 HA GLU A 169 10.370 -20.144 1.980 1.00 44.31 H new ATOM 0 HB2 GLU A 169 12.796 -20.948 1.628 1.00 63.04 H new ATOM 0 HB3 GLU A 169 11.563 -21.507 0.514 1.00 63.04 H new ATOM 0 HG2 GLU A 169 12.228 -19.851 -1.163 1.00 51.34 H new ATOM 0 HG3 GLU A 169 13.318 -19.071 -0.034 1.00 51.34 H new ATOM 210 N LYS A 170 11.560 -17.351 2.179 1.00 21.10 N ATOM 211 CA LYS A 170 12.160 -16.323 3.012 1.00 53.01 C ATOM 212 C LYS A 170 11.415 -16.254 4.346 1.00 22.14 C ATOM 213 O LYS A 170 10.515 -17.054 4.601 1.00 3.32 O ATOM 214 CB LYS A 170 12.210 -14.990 2.265 1.00 14.43 C ATOM 215 CG LYS A 170 12.339 -15.210 0.756 1.00 74.23 C ATOM 216 CD LYS A 170 11.017 -14.917 0.043 1.00 41.25 C ATOM 217 CE LYS A 170 10.999 -15.538 -1.355 1.00 12.13 C ATOM 218 NZ LYS A 170 9.734 -15.210 -2.051 1.00 41.11 N ATOM 0 H LYS A 170 10.930 -17.001 1.457 1.00 21.10 H new ATOM 0 HA LYS A 170 13.196 -16.573 3.239 1.00 53.01 H new ATOM 0 HB2 LYS A 170 11.307 -14.417 2.476 1.00 14.43 H new ATOM 0 HB3 LYS A 170 13.054 -14.400 2.623 1.00 14.43 H new ATOM 0 HG2 LYS A 170 13.122 -14.565 0.357 1.00 74.23 H new ATOM 0 HG3 LYS A 170 12.642 -16.239 0.560 1.00 74.23 H new ATOM 0 HD2 LYS A 170 10.188 -15.311 0.631 1.00 41.25 H new ATOM 0 HD3 LYS A 170 10.871 -13.839 -0.032 1.00 41.25 H new ATOM 0 HE2 LYS A 170 11.846 -15.170 -1.934 1.00 12.13 H new ATOM 0 HE3 LYS A 170 11.110 -16.620 -1.280 1.00 12.13 H new ATOM 0 HZ1 LYS A 170 9.553 -15.916 -2.793 1.00 41.11 H new ATOM 0 HZ2 LYS A 170 8.950 -15.217 -1.368 1.00 41.11 H new ATOM 0 HZ3 LYS A 170 9.809 -14.266 -2.482 1.00 41.11 H new ATOM 227 N ALA A 171 11.816 -15.290 5.161 1.00 25.22 N ATOM 228 CA ALA A 171 11.196 -15.105 6.464 1.00 73.33 C ATOM 229 C ALA A 171 9.744 -14.666 6.274 1.00 11.04 C ATOM 230 O ALA A 171 8.920 -14.829 7.174 1.00 13.11 O ATOM 231 CB ALA A 171 12.010 -14.097 7.277 1.00 2.33 C ATOM 0 H ALA A 171 12.562 -14.629 4.946 1.00 25.22 H new ATOM 0 HA ALA A 171 11.186 -16.041 7.022 1.00 73.33 H new ATOM 0 HB1 ALA A 171 11.546 -13.958 8.253 1.00 2.33 H new ATOM 0 HB2 ALA A 171 13.026 -14.470 7.408 1.00 2.33 H new ATOM 0 HB3 ALA A 171 12.039 -13.143 6.750 1.00 2.33 H new ATOM 237 N ASP A 172 9.472 -14.117 5.099 1.00 70.43 N ATOM 238 CA ASP A 172 8.133 -13.653 4.781 1.00 51.13 C ATOM 239 C ASP A 172 7.556 -14.509 3.652 1.00 52.33 C ATOM 240 O ASP A 172 6.536 -14.158 3.061 1.00 54.11 O ATOM 241 CB ASP A 172 8.153 -12.197 4.308 1.00 34.31 C ATOM 242 CG ASP A 172 9.432 -11.769 3.586 1.00 65.44 C ATOM 243 OD1 ASP A 172 9.820 -10.592 3.619 1.00 2.11 O ATOM 244 OD2 ASP A 172 10.048 -12.715 2.961 1.00 63.02 O ATOM 0 H ASP A 172 10.157 -13.983 4.355 1.00 70.43 H new ATOM 0 HA ASP A 172 7.526 -13.731 5.683 1.00 51.13 H new ATOM 0 HB2 ASP A 172 7.306 -12.036 3.641 1.00 34.31 H new ATOM 0 HB3 ASP A 172 8.007 -11.548 5.172 1.00 34.31 H new ATOM 249 N GLU A 173 8.235 -15.615 3.385 1.00 54.41 N ATOM 250 CA GLU A 173 7.803 -16.524 2.337 1.00 12.34 C ATOM 251 C GLU A 173 6.276 -16.528 2.234 1.00 12.10 C ATOM 252 O GLU A 173 5.590 -16.982 3.148 1.00 11.21 O ATOM 253 CB GLU A 173 8.339 -17.936 2.580 1.00 41.13 C ATOM 254 CG GLU A 173 8.118 -18.364 4.032 1.00 32.34 C ATOM 255 CD GLU A 173 8.958 -19.596 4.376 1.00 50.33 C ATOM 256 OE1 GLU A 173 8.403 -20.659 4.686 1.00 5.10 O ATOM 257 OE2 GLU A 173 10.235 -19.419 4.309 1.00 73.30 O ATOM 0 H GLU A 173 9.081 -15.902 3.876 1.00 54.41 H new ATOM 0 HA GLU A 173 8.211 -16.174 1.389 1.00 12.34 H new ATOM 0 HB2 GLU A 173 7.842 -18.638 1.911 1.00 41.13 H new ATOM 0 HB3 GLU A 173 9.403 -17.970 2.345 1.00 41.13 H new ATOM 0 HG2 GLU A 173 8.379 -17.543 4.700 1.00 32.34 H new ATOM 0 HG3 GLU A 173 7.062 -18.583 4.193 1.00 32.34 H new ATOM 263 N LEU A 174 5.790 -16.016 1.112 1.00 45.10 N ATOM 264 CA LEU A 174 4.357 -15.954 0.878 1.00 51.23 C ATOM 265 C LEU A 174 4.015 -16.758 -0.377 1.00 74.51 C ATOM 266 O LEU A 174 4.176 -16.270 -1.495 1.00 40.51 O ATOM 267 CB LEU A 174 3.885 -14.499 0.824 1.00 23.35 C ATOM 268 CG LEU A 174 2.401 -14.265 1.115 1.00 42.13 C ATOM 269 CD1 LEU A 174 1.541 -14.630 -0.097 1.00 50.52 C ATOM 270 CD2 LEU A 174 1.964 -15.016 2.374 1.00 5.13 C ATOM 0 H LEU A 174 6.363 -15.641 0.356 1.00 45.10 H new ATOM 0 HA LEU A 174 3.815 -16.410 1.707 1.00 51.23 H new ATOM 0 HB2 LEU A 174 4.471 -13.921 1.539 1.00 23.35 H new ATOM 0 HB3 LEU A 174 4.108 -14.102 -0.166 1.00 23.35 H new ATOM 0 HG LEU A 174 2.254 -13.202 1.307 1.00 42.13 H new ATOM 0 HD11 LEU A 174 0.491 -14.455 0.136 1.00 50.52 H new ATOM 0 HD12 LEU A 174 1.832 -14.014 -0.948 1.00 50.52 H new ATOM 0 HD13 LEU A 174 1.687 -15.682 -0.343 1.00 50.52 H new ATOM 0 HD21 LEU A 174 0.905 -14.833 2.558 1.00 5.13 H new ATOM 0 HD22 LEU A 174 2.128 -16.085 2.236 1.00 5.13 H new ATOM 0 HD23 LEU A 174 2.546 -14.667 3.227 1.00 5.13 H new ATOM 281 N THR A 175 3.550 -17.978 -0.152 1.00 1.13 N ATOM 282 CA THR A 175 3.183 -18.855 -1.252 1.00 62.03 C ATOM 283 C THR A 175 1.788 -18.505 -1.771 1.00 5.45 C ATOM 284 O THR A 175 0.845 -18.376 -0.990 1.00 70.43 O ATOM 285 CB THR A 175 3.307 -20.300 -0.765 1.00 4.12 C ATOM 286 OG1 THR A 175 3.152 -21.079 -1.949 1.00 25.41 O ATOM 287 CG2 THR A 175 2.130 -20.723 0.117 1.00 75.12 C ATOM 0 H THR A 175 3.419 -18.380 0.776 1.00 1.13 H new ATOM 0 HA THR A 175 3.852 -18.725 -2.102 1.00 62.03 H new ATOM 0 HB THR A 175 4.237 -20.418 -0.210 1.00 4.12 H new ATOM 0 HG1 THR A 175 3.221 -22.031 -1.726 1.00 25.41 H new ATOM 0 HG21 THR A 175 2.267 -21.756 0.436 1.00 75.12 H new ATOM 0 HG22 THR A 175 2.081 -20.076 0.993 1.00 75.12 H new ATOM 0 HG23 THR A 175 1.202 -20.638 -0.449 1.00 75.12 H new ATOM 295 N THR A 176 1.698 -18.361 -3.085 1.00 64.54 N ATOM 296 CA THR A 176 0.433 -18.029 -3.717 1.00 33.22 C ATOM 297 C THR A 176 0.422 -18.507 -5.170 1.00 22.13 C ATOM 298 O THR A 176 1.476 -18.672 -5.782 1.00 4.04 O ATOM 299 CB THR A 176 0.213 -16.522 -3.571 1.00 21.34 C ATOM 300 OG1 THR A 176 0.304 -16.292 -2.168 1.00 31.42 O ATOM 301 CG2 THR A 176 -1.215 -16.102 -3.925 1.00 52.41 C ATOM 0 H THR A 176 2.481 -18.468 -3.729 1.00 64.54 H new ATOM 0 HA THR A 176 -0.398 -18.542 -3.233 1.00 33.22 H new ATOM 0 HB THR A 176 0.917 -15.989 -4.210 1.00 21.34 H new ATOM 0 HG1 THR A 176 -0.077 -17.055 -1.686 1.00 31.42 H new ATOM 0 HG21 THR A 176 -1.317 -15.024 -3.805 1.00 52.41 H new ATOM 0 HG22 THR A 176 -1.428 -16.374 -4.959 1.00 52.41 H new ATOM 0 HG23 THR A 176 -1.918 -16.609 -3.264 1.00 52.41 H new ATOM 309 N TYR A 177 -0.783 -18.717 -5.681 1.00 65.12 N ATOM 310 CA TYR A 177 -0.946 -19.174 -7.051 1.00 42.52 C ATOM 311 C TYR A 177 -1.146 -17.992 -8.002 1.00 50.45 C ATOM 312 O TYR A 177 -1.388 -16.869 -7.561 1.00 43.42 O ATOM 313 CB TYR A 177 -2.207 -20.038 -7.060 1.00 33.24 C ATOM 314 CG TYR A 177 -1.975 -21.483 -6.613 1.00 31.02 C ATOM 315 CD1 TYR A 177 -1.233 -22.338 -7.401 1.00 55.31 C ATOM 316 CD2 TYR A 177 -2.508 -21.931 -5.421 1.00 41.22 C ATOM 317 CE1 TYR A 177 -1.013 -23.698 -6.981 1.00 0.33 C ATOM 318 CE2 TYR A 177 -2.288 -23.290 -5.000 1.00 14.12 C ATOM 319 CZ TYR A 177 -1.552 -24.106 -5.801 1.00 20.40 C ATOM 320 OH TYR A 177 -1.346 -25.391 -5.403 1.00 52.55 O ATOM 0 H TYR A 177 -1.655 -18.579 -5.171 1.00 65.12 H new ATOM 0 HA TYR A 177 -0.063 -19.720 -7.381 1.00 42.52 H new ATOM 0 HB2 TYR A 177 -2.952 -19.582 -6.408 1.00 33.24 H new ATOM 0 HB3 TYR A 177 -2.625 -20.043 -8.067 1.00 33.24 H new ATOM 0 HD1 TYR A 177 -0.817 -21.987 -8.334 1.00 55.31 H new ATOM 0 HD2 TYR A 177 -3.090 -21.262 -4.804 1.00 41.22 H new ATOM 0 HE1 TYR A 177 -0.434 -24.378 -7.589 1.00 0.33 H new ATOM 0 HE2 TYR A 177 -2.698 -23.653 -4.069 1.00 14.12 H new ATOM 0 HH TYR A 177 -1.788 -25.541 -4.541 1.00 52.55 H new ATOM 329 N VAL A 178 -1.036 -18.284 -9.290 1.00 3.11 N ATOM 330 CA VAL A 178 -1.202 -17.259 -10.307 1.00 73.42 C ATOM 331 C VAL A 178 -2.615 -16.682 -10.217 1.00 63.12 C ATOM 332 O VAL A 178 -3.518 -17.321 -9.680 1.00 1.20 O ATOM 333 CB VAL A 178 -0.877 -17.835 -11.687 1.00 21.43 C ATOM 334 CG1 VAL A 178 0.349 -18.748 -11.626 1.00 43.04 C ATOM 335 CG2 VAL A 178 -2.084 -18.576 -12.268 1.00 75.52 C ATOM 0 H VAL A 178 -0.834 -19.216 -9.653 1.00 3.11 H new ATOM 0 HA VAL A 178 -0.505 -16.438 -10.140 1.00 73.42 H new ATOM 0 HB VAL A 178 -0.641 -17.003 -12.351 1.00 21.43 H new ATOM 0 HG11 VAL A 178 0.558 -19.144 -12.620 1.00 43.04 H new ATOM 0 HG12 VAL A 178 1.209 -18.179 -11.274 1.00 43.04 H new ATOM 0 HG13 VAL A 178 0.155 -19.573 -10.941 1.00 43.04 H new ATOM 0 HG21 VAL A 178 -1.828 -18.976 -13.249 1.00 75.52 H new ATOM 0 HG22 VAL A 178 -2.363 -19.394 -11.604 1.00 75.52 H new ATOM 0 HG23 VAL A 178 -2.922 -17.886 -12.365 1.00 75.52 H new ATOM 345 N GLY A 179 -2.762 -15.479 -10.752 1.00 5.54 N ATOM 346 CA GLY A 179 -4.051 -14.807 -10.739 1.00 43.01 C ATOM 347 C GLY A 179 -4.675 -14.844 -9.343 1.00 60.52 C ATOM 348 O GLY A 179 -5.790 -15.334 -9.170 1.00 43.41 O ATOM 0 H GLY A 179 -2.011 -14.952 -11.197 1.00 5.54 H new ATOM 0 HA2 GLY A 179 -3.929 -13.772 -11.059 1.00 43.01 H new ATOM 0 HA3 GLY A 179 -4.721 -15.285 -11.454 1.00 43.01 H new ATOM 352 N GLU A 180 -3.929 -14.320 -8.382 1.00 30.10 N ATOM 353 CA GLU A 180 -4.394 -14.288 -7.006 1.00 3.04 C ATOM 354 C GLU A 180 -4.596 -12.842 -6.548 1.00 1.11 C ATOM 355 O GLU A 180 -4.292 -11.905 -7.285 1.00 63.11 O ATOM 356 CB GLU A 180 -3.425 -15.026 -6.080 1.00 51.44 C ATOM 357 CG GLU A 180 -4.029 -16.343 -5.591 1.00 5.11 C ATOM 358 CD GLU A 180 -5.415 -16.118 -4.982 1.00 44.53 C ATOM 359 OE1 GLU A 180 -5.585 -15.221 -4.142 1.00 13.40 O ATOM 360 OE2 GLU A 180 -6.335 -16.912 -5.412 1.00 32.55 O ATOM 0 H GLU A 180 -3.005 -13.914 -8.529 1.00 30.10 H new ATOM 0 HA GLU A 180 -5.354 -14.803 -6.956 1.00 3.04 H new ATOM 0 HB2 GLU A 180 -2.492 -15.224 -6.607 1.00 51.44 H new ATOM 0 HB3 GLU A 180 -3.181 -14.395 -5.226 1.00 51.44 H new ATOM 0 HG2 GLU A 180 -4.103 -17.044 -6.422 1.00 5.11 H new ATOM 0 HG3 GLU A 180 -3.371 -16.796 -4.849 1.00 5.11 H new ATOM 366 N ASN A 181 -5.110 -12.706 -5.334 1.00 41.55 N ATOM 367 CA ASN A 181 -5.355 -11.389 -4.769 1.00 70.41 C ATOM 368 C ASN A 181 -4.526 -11.223 -3.494 1.00 75.12 C ATOM 369 O ASN A 181 -4.540 -12.090 -2.622 1.00 24.24 O ATOM 370 CB ASN A 181 -6.830 -11.216 -4.400 1.00 44.54 C ATOM 371 CG ASN A 181 -7.739 -11.668 -5.545 1.00 45.43 C ATOM 372 OD1 ASN A 181 -8.684 -12.416 -5.362 1.00 54.13 O ATOM 373 ND2 ASN A 181 -7.401 -11.170 -6.731 1.00 31.34 N ATOM 0 H ASN A 181 -5.363 -13.485 -4.726 1.00 41.55 H new ATOM 0 HA ASN A 181 -5.079 -10.644 -5.516 1.00 70.41 H new ATOM 0 HB2 ASN A 181 -7.054 -11.794 -3.503 1.00 44.54 H new ATOM 0 HB3 ASN A 181 -7.029 -10.171 -4.164 1.00 44.54 H new ATOM 0 HD21 ASN A 181 -7.946 -11.410 -7.559 1.00 31.34 H new ATOM 0 HD22 ASN A 181 -6.596 -10.548 -6.813 1.00 31.34 H new ATOM 379 N LEU A 182 -3.822 -10.103 -3.426 1.00 41.41 N ATOM 380 CA LEU A 182 -2.988 -9.811 -2.273 1.00 70.14 C ATOM 381 C LEU A 182 -3.005 -8.305 -2.003 1.00 55.04 C ATOM 382 O LEU A 182 -2.848 -7.505 -2.925 1.00 63.23 O ATOM 383 CB LEU A 182 -1.583 -10.386 -2.468 1.00 72.20 C ATOM 384 CG LEU A 182 -0.734 -9.724 -3.554 1.00 50.44 C ATOM 385 CD1 LEU A 182 0.748 -10.060 -3.373 1.00 62.40 C ATOM 386 CD2 LEU A 182 -1.238 -10.097 -4.950 1.00 4.14 C ATOM 0 H LEU A 182 -3.812 -9.386 -4.152 1.00 41.41 H new ATOM 0 HA LEU A 182 -3.386 -10.298 -1.383 1.00 70.14 H new ATOM 0 HB2 LEU A 182 -1.048 -10.314 -1.521 1.00 72.20 H new ATOM 0 HB3 LEU A 182 -1.675 -11.447 -2.702 1.00 72.20 H new ATOM 0 HG LEU A 182 -0.835 -8.643 -3.453 1.00 50.44 H new ATOM 0 HD11 LEU A 182 1.329 -9.577 -4.158 1.00 62.40 H new ATOM 0 HD12 LEU A 182 1.086 -9.703 -2.400 1.00 62.40 H new ATOM 0 HD13 LEU A 182 0.886 -11.140 -3.432 1.00 62.40 H new ATOM 0 HD21 LEU A 182 -0.616 -9.613 -5.703 1.00 4.14 H new ATOM 0 HD22 LEU A 182 -1.187 -11.178 -5.078 1.00 4.14 H new ATOM 0 HD23 LEU A 182 -2.270 -9.766 -5.065 1.00 4.14 H new ATOM 397 N PHE A 183 -3.196 -7.965 -0.738 1.00 44.43 N ATOM 398 CA PHE A 183 -3.235 -6.568 -0.336 1.00 72.31 C ATOM 399 C PHE A 183 -1.904 -6.139 0.283 1.00 3.21 C ATOM 400 O PHE A 183 -1.579 -6.535 1.402 1.00 31.04 O ATOM 401 CB PHE A 183 -4.340 -6.436 0.715 1.00 74.04 C ATOM 402 CG PHE A 183 -5.697 -6.980 0.262 1.00 45.24 C ATOM 403 CD1 PHE A 183 -6.568 -6.169 -0.396 1.00 53.42 C ATOM 404 CD2 PHE A 183 -6.031 -8.272 0.519 1.00 74.12 C ATOM 405 CE1 PHE A 183 -7.827 -6.672 -0.816 1.00 21.44 C ATOM 406 CE2 PHE A 183 -7.290 -8.776 0.098 1.00 1.14 C ATOM 407 CZ PHE A 183 -8.163 -7.966 -0.560 1.00 42.34 C ATOM 0 H PHE A 183 -3.326 -8.632 0.023 1.00 44.43 H new ATOM 0 HA PHE A 183 -3.422 -5.936 -1.204 1.00 72.31 H new ATOM 0 HB2 PHE A 183 -4.032 -6.962 1.619 1.00 74.04 H new ATOM 0 HB3 PHE A 183 -4.452 -5.385 0.980 1.00 74.04 H new ATOM 0 HD1 PHE A 183 -6.302 -5.142 -0.599 1.00 53.42 H new ATOM 0 HD2 PHE A 183 -5.339 -8.915 1.043 1.00 74.12 H new ATOM 0 HE1 PHE A 183 -8.519 -6.028 -1.339 1.00 21.44 H new ATOM 0 HE2 PHE A 183 -7.555 -9.803 0.300 1.00 1.14 H new ATOM 0 HZ PHE A 183 -9.121 -8.349 -0.879 1.00 42.34 H new ATOM 416 N ILE A 184 -1.169 -5.335 -0.470 1.00 43.51 N ATOM 417 CA ILE A 184 0.119 -4.847 -0.009 1.00 44.15 C ATOM 418 C ILE A 184 -0.096 -3.837 1.120 1.00 22.30 C ATOM 419 O ILE A 184 -1.198 -3.317 1.291 1.00 30.13 O ATOM 420 CB ILE A 184 0.933 -4.293 -1.180 1.00 70.14 C ATOM 421 CG1 ILE A 184 1.669 -5.415 -1.916 1.00 31.50 C ATOM 422 CG2 ILE A 184 1.889 -3.193 -0.713 1.00 1.02 C ATOM 423 CD1 ILE A 184 2.219 -4.924 -3.256 1.00 34.31 C ATOM 0 H ILE A 184 -1.441 -5.009 -1.397 1.00 43.51 H new ATOM 0 HA ILE A 184 0.710 -5.666 0.402 1.00 44.15 H new ATOM 0 HB ILE A 184 0.242 -3.839 -1.890 1.00 70.14 H new ATOM 0 HG12 ILE A 184 2.486 -5.785 -1.297 1.00 31.50 H new ATOM 0 HG13 ILE A 184 0.991 -6.252 -2.082 1.00 31.50 H new ATOM 0 HG21 ILE A 184 2.455 -2.817 -1.565 1.00 1.02 H new ATOM 0 HG22 ILE A 184 1.317 -2.378 -0.269 1.00 1.02 H new ATOM 0 HG23 ILE A 184 2.577 -3.599 0.029 1.00 1.02 H new ATOM 0 HD11 ILE A 184 2.737 -5.741 -3.758 1.00 34.31 H new ATOM 0 HD12 ILE A 184 1.397 -4.577 -3.882 1.00 34.31 H new ATOM 0 HD13 ILE A 184 2.916 -4.103 -3.085 1.00 34.31 H new ATOM 434 N CYS A 185 0.973 -3.591 1.864 1.00 31.23 N ATOM 435 CA CYS A 185 0.914 -2.654 2.972 1.00 12.42 C ATOM 436 C CYS A 185 2.329 -2.140 3.242 1.00 22.13 C ATOM 437 O CYS A 185 2.524 -0.953 3.504 1.00 31.23 O ATOM 438 CB CYS A 185 0.289 -3.288 4.217 1.00 42.12 C ATOM 439 SG CYS A 185 0.928 -4.988 4.439 1.00 20.43 S ATOM 0 H CYS A 185 1.885 -4.025 1.721 1.00 31.23 H new ATOM 0 HA CYS A 185 0.268 -1.816 2.709 1.00 12.42 H new ATOM 0 HB2 CYS A 185 0.519 -2.686 5.096 1.00 42.12 H new ATOM 0 HB3 CYS A 185 -0.796 -3.308 4.119 1.00 42.12 H new ATOM 0 HG CYS A 185 1.700 -5.296 3.439 1.00 20.43 H new ATOM 444 N ALA A 186 3.282 -3.058 3.169 1.00 23.25 N ATOM 445 CA ALA A 186 4.674 -2.712 3.403 1.00 24.12 C ATOM 446 C ALA A 186 5.455 -2.848 2.095 1.00 54.22 C ATOM 447 O ALA A 186 5.089 -3.642 1.228 1.00 44.22 O ATOM 448 CB ALA A 186 5.240 -3.597 4.515 1.00 33.34 C ATOM 0 H ALA A 186 3.118 -4.041 2.951 1.00 23.25 H new ATOM 0 HA ALA A 186 4.762 -1.677 3.734 1.00 24.12 H new ATOM 0 HB1 ALA A 186 6.284 -3.338 4.691 1.00 33.34 H new ATOM 0 HB2 ALA A 186 4.669 -3.442 5.430 1.00 33.34 H new ATOM 0 HB3 ALA A 186 5.171 -4.643 4.218 1.00 33.34 H new ATOM 454 N HIS A 187 6.516 -2.062 1.992 1.00 14.44 N ATOM 455 CA HIS A 187 7.352 -2.084 0.803 1.00 63.41 C ATOM 456 C HIS A 187 8.810 -1.846 1.198 1.00 72.45 C ATOM 457 O HIS A 187 9.089 -1.153 2.175 1.00 74.22 O ATOM 458 CB HIS A 187 6.847 -1.080 -0.234 1.00 13.52 C ATOM 459 CG HIS A 187 7.574 0.244 -0.212 1.00 42.31 C ATOM 460 ND1 HIS A 187 8.713 0.486 -0.959 1.00 43.34 N ATOM 461 CD2 HIS A 187 7.310 1.394 0.473 1.00 11.20 C ATOM 462 CE1 HIS A 187 9.110 1.729 -0.725 1.00 42.23 C ATOM 463 NE2 HIS A 187 8.240 2.289 0.163 1.00 5.12 N ATOM 0 H HIS A 187 6.817 -1.405 2.712 1.00 14.44 H new ATOM 0 HA HIS A 187 7.295 -3.065 0.331 1.00 63.41 H new ATOM 0 HB2 HIS A 187 6.943 -1.519 -1.227 1.00 13.52 H new ATOM 0 HB3 HIS A 187 5.785 -0.902 -0.066 1.00 13.52 H new ATOM 0 HD2 HIS A 187 6.485 1.550 1.152 1.00 11.20 H new ATOM 0 HE1 HIS A 187 9.971 2.213 -1.161 1.00 42.23 H new ATOM 0 HE2 HIS A 187 8.295 3.240 0.529 1.00 5.12 H new ATOM 471 N HIS A 188 9.705 -2.435 0.416 1.00 30.52 N ATOM 472 CA HIS A 188 11.129 -2.297 0.672 1.00 22.15 C ATOM 473 C HIS A 188 11.907 -2.525 -0.626 1.00 65.33 C ATOM 474 O HIS A 188 11.529 -3.365 -1.441 1.00 12.41 O ATOM 475 CB HIS A 188 11.571 -3.230 1.801 1.00 54.23 C ATOM 476 CG HIS A 188 10.985 -4.619 1.715 1.00 13.23 C ATOM 477 ND1 HIS A 188 11.749 -5.765 1.852 1.00 13.11 N ATOM 478 CD2 HIS A 188 9.702 -5.034 1.507 1.00 2.14 C ATOM 479 CE1 HIS A 188 10.951 -6.816 1.728 1.00 11.21 C ATOM 480 NE2 HIS A 188 9.683 -6.360 1.514 1.00 61.11 N ATOM 0 H HIS A 188 9.471 -3.008 -0.394 1.00 30.52 H new ATOM 0 HA HIS A 188 11.345 -1.284 1.012 1.00 22.15 H new ATOM 0 HB2 HIS A 188 12.658 -3.304 1.792 1.00 54.23 H new ATOM 0 HB3 HIS A 188 11.290 -2.787 2.756 1.00 54.23 H new ATOM 0 HD1 HIS A 188 12.755 -5.796 2.020 1.00 13.11 H new ATOM 0 HD2 HIS A 188 8.846 -4.391 1.361 1.00 2.14 H new ATOM 0 HE1 HIS A 188 11.252 -7.852 1.786 1.00 11.21 H new ATOM 487 N ASN A 189 12.980 -1.762 -0.776 1.00 22.21 N ATOM 488 CA ASN A 189 13.814 -1.870 -1.960 1.00 42.55 C ATOM 489 C ASN A 189 12.959 -1.630 -3.205 1.00 73.31 C ATOM 490 O ASN A 189 13.356 -1.989 -4.313 1.00 15.05 O ATOM 491 CB ASN A 189 14.434 -3.264 -2.073 1.00 23.44 C ATOM 492 CG ASN A 189 15.669 -3.390 -1.178 1.00 1.43 C ATOM 493 OD1 ASN A 189 15.815 -2.707 -0.177 1.00 15.21 O ATOM 494 ND2 ASN A 189 16.547 -4.298 -1.594 1.00 65.02 N ATOM 0 H ASN A 189 13.290 -1.067 -0.097 1.00 22.21 H new ATOM 0 HA ASN A 189 14.609 -1.128 -1.881 1.00 42.55 H new ATOM 0 HB2 ASN A 189 13.698 -4.017 -1.791 1.00 23.44 H new ATOM 0 HB3 ASN A 189 14.710 -3.460 -3.109 1.00 23.44 H new ATOM 0 HD21 ASN A 189 17.405 -4.457 -1.066 1.00 65.02 H new ATOM 0 HD22 ASN A 189 16.362 -4.835 -2.441 1.00 65.02 H new ATOM 500 N CYS A 190 11.802 -1.026 -2.983 1.00 23.42 N ATOM 501 CA CYS A 190 10.887 -0.735 -4.072 1.00 14.01 C ATOM 502 C CYS A 190 10.825 -1.959 -4.988 1.00 52.14 C ATOM 503 O CYS A 190 10.550 -1.833 -6.180 1.00 34.21 O ATOM 504 CB CYS A 190 11.298 0.527 -4.834 1.00 0.11 C ATOM 505 SG CYS A 190 11.957 1.774 -3.669 1.00 42.24 S ATOM 0 H CYS A 190 11.477 -0.730 -2.063 1.00 23.42 H new ATOM 0 HA CYS A 190 9.894 -0.532 -3.671 1.00 14.01 H new ATOM 0 HB2 CYS A 190 12.052 0.281 -5.581 1.00 0.11 H new ATOM 0 HB3 CYS A 190 10.440 0.934 -5.369 1.00 0.11 H new ATOM 0 HG CYS A 190 12.305 2.840 -4.326 1.00 42.24 H new ATOM 510 N GLU A 191 11.086 -3.115 -4.396 1.00 40.41 N ATOM 511 CA GLU A 191 11.064 -4.361 -5.144 1.00 23.44 C ATOM 512 C GLU A 191 10.269 -5.423 -4.381 1.00 63.12 C ATOM 513 O GLU A 191 9.512 -6.185 -4.978 1.00 35.24 O ATOM 514 CB GLU A 191 12.483 -4.846 -5.441 1.00 34.10 C ATOM 515 CG GLU A 191 12.488 -6.329 -5.818 1.00 22.35 C ATOM 516 CD GLU A 191 13.908 -6.816 -6.113 1.00 71.42 C ATOM 517 OE1 GLU A 191 14.536 -7.454 -5.255 1.00 33.31 O ATOM 518 OE2 GLU A 191 14.356 -6.510 -7.284 1.00 64.32 O ATOM 0 H GLU A 191 11.314 -3.215 -3.407 1.00 40.41 H new ATOM 0 HA GLU A 191 10.570 -4.182 -6.099 1.00 23.44 H new ATOM 0 HB2 GLU A 191 12.909 -4.259 -6.255 1.00 34.10 H new ATOM 0 HB3 GLU A 191 13.116 -4.687 -4.568 1.00 34.10 H new ATOM 0 HG2 GLU A 191 12.060 -6.916 -5.005 1.00 22.35 H new ATOM 0 HG3 GLU A 191 11.857 -6.488 -6.692 1.00 22.35 H new ATOM 524 N TRP A 192 10.471 -5.441 -3.071 1.00 0.52 N ATOM 525 CA TRP A 192 9.783 -6.397 -2.221 1.00 62.34 C ATOM 526 C TRP A 192 8.661 -5.658 -1.488 1.00 14.41 C ATOM 527 O TRP A 192 8.898 -4.625 -0.864 1.00 3.23 O ATOM 528 CB TRP A 192 10.763 -7.088 -1.270 1.00 33.12 C ATOM 529 CG TRP A 192 11.686 -8.099 -1.954 1.00 15.52 C ATOM 530 CD1 TRP A 192 12.971 -7.941 -2.298 1.00 50.44 C ATOM 531 CD2 TRP A 192 11.339 -9.438 -2.366 1.00 42.04 C ATOM 532 NE1 TRP A 192 13.476 -9.076 -2.900 1.00 63.14 N ATOM 533 CE2 TRP A 192 12.453 -10.015 -2.941 1.00 71.10 C ATOM 534 CE3 TRP A 192 10.126 -10.138 -2.255 1.00 32.31 C ATOM 535 CZ2 TRP A 192 12.463 -11.318 -3.452 1.00 71.40 C ATOM 536 CZ3 TRP A 192 10.153 -11.440 -2.770 1.00 22.14 C ATOM 537 CH2 TRP A 192 11.265 -12.036 -3.352 1.00 10.50 C ATOM 0 H TRP A 192 11.101 -4.809 -2.578 1.00 0.52 H new ATOM 0 HA TRP A 192 9.342 -7.196 -2.818 1.00 62.34 H new ATOM 0 HB2 TRP A 192 11.372 -6.330 -0.779 1.00 33.12 H new ATOM 0 HB3 TRP A 192 10.198 -7.597 -0.490 1.00 33.12 H new ATOM 0 HD1 TRP A 192 13.540 -7.039 -2.126 1.00 50.44 H new ATOM 0 HE1 TRP A 192 14.426 -9.202 -3.250 1.00 63.14 H new ATOM 0 HE3 TRP A 192 9.243 -9.706 -1.808 1.00 32.31 H new ATOM 0 HZ2 TRP A 192 13.347 -11.747 -3.900 1.00 71.40 H new ATOM 0 HZ3 TRP A 192 9.245 -12.022 -2.711 1.00 22.14 H new ATOM 0 HH2 TRP A 192 11.206 -13.048 -3.725 1.00 10.50 H new ATOM 547 N PHE A 193 7.464 -6.215 -1.591 1.00 12.02 N ATOM 548 CA PHE A 193 6.304 -5.621 -0.947 1.00 72.42 C ATOM 549 C PHE A 193 5.606 -6.634 -0.036 1.00 4.40 C ATOM 550 O PHE A 193 5.279 -7.738 -0.466 1.00 31.22 O ATOM 551 CB PHE A 193 5.340 -5.203 -2.059 1.00 51.22 C ATOM 552 CG PHE A 193 5.960 -4.271 -3.102 1.00 74.41 C ATOM 553 CD1 PHE A 193 6.958 -3.419 -2.745 1.00 61.03 C ATOM 554 CD2 PHE A 193 5.514 -4.295 -4.386 1.00 32.42 C ATOM 555 CE1 PHE A 193 7.534 -2.554 -3.712 1.00 15.55 C ATOM 556 CE2 PHE A 193 6.089 -3.431 -5.355 1.00 3.11 C ATOM 557 CZ PHE A 193 7.087 -2.579 -4.997 1.00 53.52 C ATOM 0 H PHE A 193 7.272 -7.071 -2.111 1.00 12.02 H new ATOM 0 HA PHE A 193 6.611 -4.773 -0.335 1.00 72.42 H new ATOM 0 HB2 PHE A 193 4.970 -6.097 -2.560 1.00 51.22 H new ATOM 0 HB3 PHE A 193 4.478 -4.708 -1.612 1.00 51.22 H new ATOM 0 HD1 PHE A 193 7.313 -3.400 -1.725 1.00 61.03 H new ATOM 0 HD2 PHE A 193 4.722 -4.972 -4.669 1.00 32.42 H new ATOM 0 HE1 PHE A 193 8.326 -1.877 -3.428 1.00 15.55 H new ATOM 0 HE2 PHE A 193 5.734 -3.450 -6.375 1.00 3.11 H new ATOM 0 HZ PHE A 193 7.525 -1.922 -5.733 1.00 53.52 H new ATOM 566 N ILE A 194 5.397 -6.219 1.204 1.00 4.24 N ATOM 567 CA ILE A 194 4.743 -7.075 2.180 1.00 22.03 C ATOM 568 C ILE A 194 3.225 -6.923 2.049 1.00 62.14 C ATOM 569 O ILE A 194 2.663 -5.905 2.450 1.00 62.04 O ATOM 570 CB ILE A 194 5.271 -6.785 3.587 1.00 34.20 C ATOM 571 CG1 ILE A 194 6.460 -7.688 3.922 1.00 74.04 C ATOM 572 CG2 ILE A 194 4.154 -6.901 4.626 1.00 40.23 C ATOM 573 CD1 ILE A 194 7.663 -7.361 3.033 1.00 22.34 C ATOM 0 H ILE A 194 5.669 -5.301 1.556 1.00 4.24 H new ATOM 0 HA ILE A 194 4.977 -8.122 1.986 1.00 22.03 H new ATOM 0 HB ILE A 194 5.630 -5.756 3.613 1.00 34.20 H new ATOM 0 HG12 ILE A 194 6.733 -7.563 4.970 1.00 74.04 H new ATOM 0 HG13 ILE A 194 6.177 -8.732 3.789 1.00 74.04 H new ATOM 0 HG21 ILE A 194 4.556 -6.690 5.617 1.00 40.23 H new ATOM 0 HG22 ILE A 194 3.366 -6.185 4.394 1.00 40.23 H new ATOM 0 HG23 ILE A 194 3.744 -7.911 4.608 1.00 40.23 H new ATOM 0 HD11 ILE A 194 8.495 -8.016 3.291 1.00 22.34 H new ATOM 0 HD12 ILE A 194 7.394 -7.510 1.987 1.00 22.34 H new ATOM 0 HD13 ILE A 194 7.958 -6.323 3.187 1.00 22.34 H new ATOM 584 N ALA A 195 2.607 -7.950 1.486 1.00 21.23 N ATOM 585 CA ALA A 195 1.166 -7.943 1.298 1.00 15.11 C ATOM 586 C ALA A 195 0.553 -9.135 2.038 1.00 43.31 C ATOM 587 O ALA A 195 1.259 -10.075 2.400 1.00 51.24 O ATOM 588 CB ALA A 195 0.846 -7.960 -0.198 1.00 73.14 C ATOM 0 H ALA A 195 3.077 -8.792 1.154 1.00 21.23 H new ATOM 0 HA ALA A 195 0.730 -7.035 1.715 1.00 15.11 H new ATOM 0 HB1 ALA A 195 -0.235 -7.955 -0.339 1.00 73.14 H new ATOM 0 HB2 ALA A 195 1.278 -7.079 -0.673 1.00 73.14 H new ATOM 0 HB3 ALA A 195 1.266 -8.858 -0.650 1.00 73.14 H new ATOM 594 N LYS A 196 -0.754 -9.054 2.243 1.00 73.33 N ATOM 595 CA LYS A 196 -1.469 -10.114 2.934 1.00 72.44 C ATOM 596 C LYS A 196 -2.426 -10.798 1.956 1.00 24.22 C ATOM 597 O LYS A 196 -2.992 -10.149 1.078 1.00 44.12 O ATOM 598 CB LYS A 196 -2.154 -9.568 4.187 1.00 2.43 C ATOM 599 CG LYS A 196 -3.589 -10.090 4.300 1.00 54.10 C ATOM 600 CD LYS A 196 -4.314 -9.453 5.486 1.00 42.14 C ATOM 601 CE LYS A 196 -3.750 -9.966 6.813 1.00 31.44 C ATOM 602 NZ LYS A 196 -4.231 -11.339 7.082 1.00 33.50 N ATOM 0 H LYS A 196 -1.336 -8.272 1.943 1.00 73.33 H new ATOM 0 HA LYS A 196 -0.775 -10.877 3.286 1.00 72.44 H new ATOM 0 HB2 LYS A 196 -1.587 -9.858 5.071 1.00 2.43 H new ATOM 0 HB3 LYS A 196 -2.161 -8.478 4.156 1.00 2.43 H new ATOM 0 HG2 LYS A 196 -4.131 -9.874 3.380 1.00 54.10 H new ATOM 0 HG3 LYS A 196 -3.577 -11.174 4.416 1.00 54.10 H new ATOM 0 HD2 LYS A 196 -4.213 -8.369 5.439 1.00 42.14 H new ATOM 0 HD3 LYS A 196 -5.379 -9.677 5.429 1.00 42.14 H new ATOM 0 HE2 LYS A 196 -2.661 -9.955 6.781 1.00 31.44 H new ATOM 0 HE3 LYS A 196 -4.051 -9.303 7.624 1.00 31.44 H new ATOM 0 HZ1 LYS A 196 -3.968 -11.616 8.049 1.00 33.50 H new ATOM 0 HZ2 LYS A 196 -5.266 -11.370 6.983 1.00 33.50 H new ATOM 0 HZ3 LYS A 196 -3.798 -11.998 6.403 1.00 33.50 H new ATOM 611 N PRO A 197 -2.583 -12.136 2.147 1.00 11.11 N ATOM 612 CA PRO A 197 -3.464 -12.915 1.293 1.00 45.31 C ATOM 613 C PRO A 197 -4.932 -12.658 1.638 1.00 41.22 C ATOM 614 O PRO A 197 -5.233 -11.991 2.627 1.00 31.32 O ATOM 615 CB PRO A 197 -3.046 -14.360 1.511 1.00 21.10 C ATOM 616 CG PRO A 197 -2.269 -14.376 2.817 1.00 65.51 C ATOM 617 CD PRO A 197 -1.931 -12.938 3.177 1.00 73.45 C ATOM 0 HA PRO A 197 -3.378 -12.644 0.241 1.00 45.31 H new ATOM 0 HB2 PRO A 197 -3.916 -15.014 1.566 1.00 21.10 H new ATOM 0 HB3 PRO A 197 -2.430 -14.717 0.686 1.00 21.10 H new ATOM 0 HG2 PRO A 197 -2.861 -14.838 3.607 1.00 65.51 H new ATOM 0 HG3 PRO A 197 -1.359 -14.967 2.713 1.00 65.51 H new ATOM 0 HD2 PRO A 197 -2.299 -12.682 4.171 1.00 73.45 H new ATOM 0 HD3 PRO A 197 -0.853 -12.774 3.184 1.00 73.45 H new ATOM 692 N GLY A 203 -0.158 -14.331 6.740 1.00 20.35 N ATOM 693 CA GLY A 203 -0.013 -12.973 6.247 1.00 15.22 C ATOM 694 C GLY A 203 0.075 -11.975 7.403 1.00 20.25 C ATOM 695 O GLY A 203 -0.220 -12.319 8.547 1.00 44.14 O ATOM 0 HA2 GLY A 203 0.883 -12.900 5.630 1.00 15.22 H new ATOM 0 HA3 GLY A 203 -0.860 -12.722 5.609 1.00 15.22 H new ATOM 699 N PRO A 204 0.491 -10.728 7.057 1.00 42.02 N ATOM 700 CA PRO A 204 0.820 -10.405 5.679 1.00 45.44 C ATOM 701 C PRO A 204 2.170 -11.005 5.283 1.00 51.53 C ATOM 702 O PRO A 204 3.123 -10.967 6.060 1.00 11.01 O ATOM 703 CB PRO A 204 0.803 -8.886 5.617 1.00 35.44 C ATOM 704 CG PRO A 204 0.924 -8.409 7.055 1.00 54.55 C ATOM 705 CD PRO A 204 0.661 -9.597 7.965 1.00 34.24 C ATOM 0 HA PRO A 204 0.111 -10.827 4.967 1.00 45.44 H new ATOM 0 HB2 PRO A 204 1.627 -8.511 5.010 1.00 35.44 H new ATOM 0 HB3 PRO A 204 -0.119 -8.524 5.162 1.00 35.44 H new ATOM 0 HG2 PRO A 204 1.918 -8.000 7.239 1.00 54.55 H new ATOM 0 HG3 PRO A 204 0.209 -7.611 7.254 1.00 54.55 H new ATOM 0 HD2 PRO A 204 1.491 -9.762 8.652 1.00 34.24 H new ATOM 0 HD3 PRO A 204 -0.230 -9.440 8.574 1.00 34.24 H new ATOM 710 N GLY A 205 2.211 -11.543 4.073 1.00 35.14 N ATOM 711 CA GLY A 205 3.429 -12.150 3.563 1.00 4.12 C ATOM 712 C GLY A 205 4.170 -11.190 2.629 1.00 33.21 C ATOM 713 O GLY A 205 3.727 -10.064 2.413 1.00 14.32 O ATOM 0 H GLY A 205 1.420 -11.571 3.430 1.00 35.14 H new ATOM 0 HA2 GLY A 205 4.077 -12.427 4.394 1.00 4.12 H new ATOM 0 HA3 GLY A 205 3.186 -13.068 3.028 1.00 4.12 H new ATOM 717 N LEU A 206 5.285 -11.673 2.100 1.00 20.22 N ATOM 718 CA LEU A 206 6.091 -10.873 1.194 1.00 42.51 C ATOM 719 C LEU A 206 5.674 -11.168 -0.248 1.00 61.10 C ATOM 720 O LEU A 206 5.260 -12.283 -0.562 1.00 53.50 O ATOM 721 CB LEU A 206 7.580 -11.097 1.463 1.00 34.22 C ATOM 722 CG LEU A 206 8.528 -10.764 0.308 1.00 21.42 C ATOM 723 CD1 LEU A 206 9.376 -9.533 0.633 1.00 1.40 C ATOM 724 CD2 LEU A 206 9.390 -11.974 -0.060 1.00 2.31 C ATOM 0 H LEU A 206 5.649 -12.608 2.282 1.00 20.22 H new ATOM 0 HA LEU A 206 5.917 -9.811 1.365 1.00 42.51 H new ATOM 0 HB2 LEU A 206 7.867 -10.497 2.327 1.00 34.22 H new ATOM 0 HB3 LEU A 206 7.726 -12.142 1.737 1.00 34.22 H new ATOM 0 HG LEU A 206 7.927 -10.519 -0.568 1.00 21.42 H new ATOM 0 HD11 LEU A 206 10.041 -9.318 -0.204 1.00 1.40 H new ATOM 0 HD12 LEU A 206 8.724 -8.677 0.807 1.00 1.40 H new ATOM 0 HD13 LEU A 206 9.969 -9.725 1.527 1.00 1.40 H new ATOM 0 HD21 LEU A 206 10.054 -11.711 -0.883 1.00 2.31 H new ATOM 0 HD22 LEU A 206 9.983 -12.274 0.804 1.00 2.31 H new ATOM 0 HD23 LEU A 206 8.747 -12.800 -0.363 1.00 2.31 H new ATOM 735 N VAL A 207 5.798 -10.150 -1.086 1.00 52.14 N ATOM 736 CA VAL A 207 5.440 -10.286 -2.487 1.00 54.32 C ATOM 737 C VAL A 207 6.213 -9.252 -3.310 1.00 61.52 C ATOM 738 O VAL A 207 6.120 -8.053 -3.052 1.00 23.02 O ATOM 739 CB VAL A 207 3.924 -10.169 -2.654 1.00 62.44 C ATOM 740 CG1 VAL A 207 3.253 -11.540 -2.538 1.00 41.33 C ATOM 741 CG2 VAL A 207 3.335 -9.183 -1.642 1.00 74.54 C ATOM 0 H VAL A 207 6.142 -9.227 -0.821 1.00 52.14 H new ATOM 0 HA VAL A 207 5.720 -11.272 -2.858 1.00 54.32 H new ATOM 0 HB VAL A 207 3.726 -9.782 -3.653 1.00 62.44 H new ATOM 0 HG11 VAL A 207 2.176 -11.429 -2.660 1.00 41.33 H new ATOM 0 HG12 VAL A 207 3.640 -12.201 -3.313 1.00 41.33 H new ATOM 0 HG13 VAL A 207 3.465 -11.967 -1.558 1.00 41.33 H new ATOM 0 HG21 VAL A 207 2.256 -9.119 -1.782 1.00 74.54 H new ATOM 0 HG22 VAL A 207 3.549 -9.528 -0.631 1.00 74.54 H new ATOM 0 HG23 VAL A 207 3.780 -8.199 -1.791 1.00 74.54 H new ATOM 751 N PRO A 208 6.979 -9.768 -4.309 1.00 22.54 N ATOM 752 CA PRO A 208 7.766 -8.903 -5.171 1.00 63.41 C ATOM 753 C PRO A 208 6.876 -8.177 -6.180 1.00 71.00 C ATOM 754 O PRO A 208 5.676 -8.436 -6.254 1.00 2.40 O ATOM 755 CB PRO A 208 8.783 -9.824 -5.828 1.00 45.20 C ATOM 756 CG PRO A 208 8.233 -11.232 -5.670 1.00 42.22 C ATOM 757 CD PRO A 208 7.113 -11.183 -4.643 1.00 53.44 C ATOM 0 HA PRO A 208 8.267 -8.105 -4.623 1.00 63.41 H new ATOM 0 HB2 PRO A 208 8.916 -9.572 -6.880 1.00 45.20 H new ATOM 0 HB3 PRO A 208 9.759 -9.730 -5.352 1.00 45.20 H new ATOM 0 HG2 PRO A 208 7.860 -11.605 -6.624 1.00 42.22 H new ATOM 0 HG3 PRO A 208 9.019 -11.914 -5.346 1.00 42.22 H new ATOM 0 HD2 PRO A 208 6.185 -11.584 -5.050 1.00 53.44 H new ATOM 0 HD3 PRO A 208 7.357 -11.777 -3.762 1.00 53.44 H new ATOM 762 N VAL A 209 7.499 -7.283 -6.934 1.00 43.40 N ATOM 763 CA VAL A 209 6.778 -6.516 -7.936 1.00 35.31 C ATOM 764 C VAL A 209 6.882 -7.228 -9.287 1.00 2.44 C ATOM 765 O VAL A 209 6.302 -6.781 -10.275 1.00 44.50 O ATOM 766 CB VAL A 209 7.303 -5.080 -7.976 1.00 62.02 C ATOM 767 CG1 VAL A 209 8.163 -4.778 -6.747 1.00 43.45 C ATOM 768 CG2 VAL A 209 8.079 -4.815 -9.267 1.00 75.10 C ATOM 0 H VAL A 209 8.495 -7.073 -6.871 1.00 43.40 H new ATOM 0 HA VAL A 209 5.720 -6.453 -7.680 1.00 35.31 H new ATOM 0 HB VAL A 209 6.445 -4.408 -7.959 1.00 62.02 H new ATOM 0 HG11 VAL A 209 8.524 -3.751 -6.799 1.00 43.45 H new ATOM 0 HG12 VAL A 209 7.566 -4.907 -5.844 1.00 43.45 H new ATOM 0 HG13 VAL A 209 9.012 -5.460 -6.721 1.00 43.45 H new ATOM 0 HG21 VAL A 209 8.441 -3.787 -9.269 1.00 75.10 H new ATOM 0 HG22 VAL A 209 8.926 -5.498 -9.329 1.00 75.10 H new ATOM 0 HG23 VAL A 209 7.424 -4.971 -10.124 1.00 75.10 H new ATOM 778 N GLY A 210 7.626 -8.325 -9.286 1.00 1.43 N ATOM 779 CA GLY A 210 7.813 -9.102 -10.500 1.00 22.14 C ATOM 780 C GLY A 210 6.865 -10.303 -10.533 1.00 1.44 C ATOM 781 O GLY A 210 6.909 -11.108 -11.462 1.00 1.41 O ATOM 0 H GLY A 210 8.106 -8.694 -8.465 1.00 1.43 H new ATOM 0 HA2 GLY A 210 7.637 -8.471 -11.371 1.00 22.14 H new ATOM 0 HA3 GLY A 210 8.845 -9.447 -10.560 1.00 22.14 H new ATOM 785 N PHE A 211 6.028 -10.385 -9.508 1.00 54.15 N ATOM 786 CA PHE A 211 5.071 -11.473 -9.409 1.00 62.23 C ATOM 787 C PHE A 211 3.707 -10.962 -8.942 1.00 72.33 C ATOM 788 O PHE A 211 2.828 -11.752 -8.599 1.00 54.14 O ATOM 789 CB PHE A 211 5.618 -12.455 -8.371 1.00 31.33 C ATOM 790 CG PHE A 211 6.549 -13.521 -8.951 1.00 34.03 C ATOM 791 CD1 PHE A 211 6.029 -14.610 -9.580 1.00 10.04 C ATOM 792 CD2 PHE A 211 7.896 -13.381 -8.839 1.00 53.12 C ATOM 793 CE1 PHE A 211 6.892 -15.599 -10.120 1.00 51.24 C ATOM 794 CE2 PHE A 211 8.761 -14.370 -9.378 1.00 13.31 C ATOM 795 CZ PHE A 211 8.241 -15.458 -10.007 1.00 0.31 C ATOM 0 H PHE A 211 5.993 -9.715 -8.739 1.00 54.15 H new ATOM 0 HA PHE A 211 4.938 -11.943 -10.384 1.00 62.23 H new ATOM 0 HB2 PHE A 211 6.156 -11.896 -7.605 1.00 31.33 H new ATOM 0 HB3 PHE A 211 4.781 -12.948 -7.877 1.00 31.33 H new ATOM 0 HD1 PHE A 211 4.958 -14.722 -9.668 1.00 10.04 H new ATOM 0 HD2 PHE A 211 8.309 -12.517 -8.340 1.00 53.12 H new ATOM 0 HE1 PHE A 211 6.479 -16.462 -10.620 1.00 51.24 H new ATOM 0 HE2 PHE A 211 9.831 -14.258 -9.288 1.00 13.31 H new ATOM 0 HZ PHE A 211 8.899 -16.210 -10.417 1.00 0.31 H new ATOM 804 N VAL A 212 3.572 -9.645 -8.943 1.00 54.33 N ATOM 805 CA VAL A 212 2.329 -9.019 -8.525 1.00 63.21 C ATOM 806 C VAL A 212 2.185 -7.664 -9.221 1.00 62.24 C ATOM 807 O VAL A 212 3.173 -7.086 -9.672 1.00 73.33 O ATOM 808 CB VAL A 212 2.284 -8.915 -6.999 1.00 1.22 C ATOM 809 CG1 VAL A 212 2.690 -10.239 -6.347 1.00 4.42 C ATOM 810 CG2 VAL A 212 3.164 -7.767 -6.501 1.00 2.45 C ATOM 0 H VAL A 212 4.303 -8.993 -9.227 1.00 54.33 H new ATOM 0 HA VAL A 212 1.476 -9.629 -8.822 1.00 63.21 H new ATOM 0 HB VAL A 212 1.256 -8.699 -6.709 1.00 1.22 H new ATOM 0 HG11 VAL A 212 2.650 -10.138 -5.262 1.00 4.42 H new ATOM 0 HG12 VAL A 212 2.005 -11.026 -6.664 1.00 4.42 H new ATOM 0 HG13 VAL A 212 3.705 -10.498 -6.650 1.00 4.42 H new ATOM 0 HG21 VAL A 212 3.114 -7.715 -5.413 1.00 2.45 H new ATOM 0 HG22 VAL A 212 4.195 -7.939 -6.809 1.00 2.45 H new ATOM 0 HG23 VAL A 212 2.811 -6.827 -6.925 1.00 2.45 H new ATOM 820 N SER A 213 0.947 -7.197 -9.286 1.00 44.33 N ATOM 821 CA SER A 213 0.662 -5.920 -9.918 1.00 74.34 C ATOM 822 C SER A 213 -0.296 -5.106 -9.047 1.00 34.44 C ATOM 823 O SER A 213 -1.142 -5.670 -8.355 1.00 13.33 O ATOM 824 CB SER A 213 0.070 -6.118 -11.315 1.00 72.41 C ATOM 825 OG SER A 213 -0.689 -4.990 -11.739 1.00 42.42 O ATOM 0 H SER A 213 0.130 -7.680 -8.912 1.00 44.33 H new ATOM 0 HA SER A 213 1.599 -5.374 -10.023 1.00 74.34 H new ATOM 0 HB2 SER A 213 0.875 -6.301 -12.027 1.00 72.41 H new ATOM 0 HB3 SER A 213 -0.565 -7.004 -11.317 1.00 72.41 H new ATOM 0 HG SER A 213 -1.048 -5.156 -12.636 1.00 42.42 H new ATOM 830 N ILE A 214 -0.133 -3.793 -9.109 1.00 72.45 N ATOM 831 CA ILE A 214 -0.973 -2.896 -8.334 1.00 71.43 C ATOM 832 C ILE A 214 -2.249 -2.593 -9.121 1.00 53.40 C ATOM 833 O ILE A 214 -2.190 -2.278 -10.309 1.00 22.54 O ATOM 834 CB ILE A 214 -0.189 -1.646 -7.928 1.00 41.21 C ATOM 835 CG1 ILE A 214 1.108 -2.021 -7.209 1.00 22.44 C ATOM 836 CG2 ILE A 214 -1.057 -0.703 -7.091 1.00 61.54 C ATOM 837 CD1 ILE A 214 0.825 -2.507 -5.786 1.00 24.23 C ATOM 0 H ILE A 214 0.569 -3.328 -9.685 1.00 72.45 H new ATOM 0 HA ILE A 214 -1.278 -3.370 -7.401 1.00 71.43 H new ATOM 0 HB ILE A 214 0.090 -1.108 -8.834 1.00 41.21 H new ATOM 0 HG12 ILE A 214 1.625 -2.801 -7.768 1.00 22.44 H new ATOM 0 HG13 ILE A 214 1.773 -1.158 -7.177 1.00 22.44 H new ATOM 0 HG21 ILE A 214 -0.476 0.177 -6.815 1.00 61.54 H new ATOM 0 HG22 ILE A 214 -1.927 -0.397 -7.672 1.00 61.54 H new ATOM 0 HG23 ILE A 214 -1.387 -1.217 -6.188 1.00 61.54 H new ATOM 0 HD11 ILE A 214 1.764 -2.767 -5.297 1.00 24.23 H new ATOM 0 HD12 ILE A 214 0.330 -1.716 -5.223 1.00 24.23 H new ATOM 0 HD13 ILE A 214 0.180 -3.385 -5.823 1.00 24.23 H new ATOM 848 N ILE A 215 -3.372 -2.699 -8.427 1.00 10.14 N ATOM 849 CA ILE A 215 -4.662 -2.440 -9.047 1.00 65.31 C ATOM 850 C ILE A 215 -5.612 -1.845 -8.005 1.00 42.44 C ATOM 851 O ILE A 215 -5.611 -2.261 -6.848 1.00 31.02 O ATOM 852 CB ILE A 215 -5.199 -3.707 -9.715 1.00 61.35 C ATOM 853 CG1 ILE A 215 -5.365 -4.837 -8.697 1.00 61.05 C ATOM 854 CG2 ILE A 215 -4.313 -4.122 -10.893 1.00 22.35 C ATOM 855 CD1 ILE A 215 -6.298 -5.925 -9.233 1.00 61.35 C ATOM 0 H ILE A 215 -3.417 -2.960 -7.442 1.00 10.14 H new ATOM 0 HA ILE A 215 -4.561 -1.705 -9.845 1.00 65.31 H new ATOM 0 HB ILE A 215 -6.189 -3.488 -10.116 1.00 61.35 H new ATOM 0 HG12 ILE A 215 -4.391 -5.269 -8.466 1.00 61.05 H new ATOM 0 HG13 ILE A 215 -5.765 -4.436 -7.766 1.00 61.05 H new ATOM 0 HG21 ILE A 215 -4.716 -5.025 -11.351 1.00 22.35 H new ATOM 0 HG22 ILE A 215 -4.290 -3.320 -11.631 1.00 22.35 H new ATOM 0 HG23 ILE A 215 -3.301 -4.316 -10.537 1.00 22.35 H new ATOM 0 HD11 ILE A 215 -6.399 -6.716 -8.490 1.00 61.35 H new ATOM 0 HD12 ILE A 215 -7.278 -5.495 -9.440 1.00 61.35 H new ATOM 0 HD13 ILE A 215 -5.883 -6.340 -10.151 1.00 61.35 H new ATOM 991 N ASP A 226 3.412 4.307 -12.036 1.00 71.13 N ATOM 992 CA ASP A 226 4.184 3.096 -11.810 1.00 22.15 C ATOM 993 C ASP A 226 4.072 2.693 -10.339 1.00 63.51 C ATOM 994 O ASP A 226 3.785 3.528 -9.482 1.00 0.31 O ATOM 995 CB ASP A 226 5.664 3.319 -12.128 1.00 33.55 C ATOM 996 CG ASP A 226 6.024 3.244 -13.614 1.00 62.34 C ATOM 997 OD1 ASP A 226 5.925 4.238 -14.346 1.00 4.42 O ATOM 998 OD2 ASP A 226 6.427 2.087 -14.019 1.00 63.34 O ATOM 0 HA ASP A 226 3.789 2.317 -12.462 1.00 22.15 H new ATOM 0 HB2 ASP A 226 5.959 4.297 -11.747 1.00 33.55 H new ATOM 0 HB3 ASP A 226 6.252 2.576 -11.589 1.00 33.55 H new ATOM 1003 N VAL A 227 4.305 1.413 -10.090 1.00 64.02 N ATOM 1004 CA VAL A 227 4.235 0.888 -8.736 1.00 53.20 C ATOM 1005 C VAL A 227 5.085 1.762 -7.811 1.00 71.30 C ATOM 1006 O VAL A 227 4.683 2.054 -6.686 1.00 44.51 O ATOM 1007 CB VAL A 227 4.654 -0.583 -8.722 1.00 52.24 C ATOM 1008 CG1 VAL A 227 5.876 -0.814 -9.615 1.00 4.44 C ATOM 1009 CG2 VAL A 227 4.920 -1.064 -7.294 1.00 3.23 C ATOM 0 H VAL A 227 4.543 0.723 -10.803 1.00 64.02 H new ATOM 0 HA VAL A 227 3.211 0.922 -8.365 1.00 53.20 H new ATOM 0 HB VAL A 227 3.829 -1.170 -9.125 1.00 52.24 H new ATOM 0 HG11 VAL A 227 6.153 -1.868 -9.587 1.00 4.44 H new ATOM 0 HG12 VAL A 227 5.637 -0.529 -10.640 1.00 4.44 H new ATOM 0 HG13 VAL A 227 6.709 -0.210 -9.255 1.00 4.44 H new ATOM 0 HG21 VAL A 227 5.216 -2.113 -7.313 1.00 3.23 H new ATOM 0 HG22 VAL A 227 5.720 -0.469 -6.853 1.00 3.23 H new ATOM 0 HG23 VAL A 227 4.014 -0.953 -6.698 1.00 3.23 H new ATOM 1019 N ILE A 228 6.245 2.152 -8.319 1.00 5.41 N ATOM 1020 CA ILE A 228 7.155 2.986 -7.553 1.00 24.34 C ATOM 1021 C ILE A 228 6.563 4.390 -7.418 1.00 52.41 C ATOM 1022 O ILE A 228 6.632 4.998 -6.352 1.00 61.33 O ATOM 1023 CB ILE A 228 8.553 2.963 -8.172 1.00 74.02 C ATOM 1024 CG1 ILE A 228 9.095 1.535 -8.251 1.00 71.14 C ATOM 1025 CG2 ILE A 228 9.503 3.895 -7.418 1.00 10.53 C ATOM 1026 CD1 ILE A 228 8.926 0.961 -9.660 1.00 31.12 C ATOM 0 H ILE A 228 6.575 1.906 -9.252 1.00 5.41 H new ATOM 0 HA ILE A 228 7.274 2.593 -6.543 1.00 24.34 H new ATOM 0 HB ILE A 228 8.479 3.336 -9.193 1.00 74.02 H new ATOM 0 HG12 ILE A 228 10.150 1.527 -7.975 1.00 71.14 H new ATOM 0 HG13 ILE A 228 8.573 0.904 -7.532 1.00 71.14 H new ATOM 0 HG21 ILE A 228 10.490 3.859 -7.879 1.00 10.53 H new ATOM 0 HG22 ILE A 228 9.120 4.915 -7.458 1.00 10.53 H new ATOM 0 HG23 ILE A 228 9.577 3.576 -6.378 1.00 10.53 H new ATOM 0 HD11 ILE A 228 9.319 -0.055 -9.689 1.00 31.12 H new ATOM 0 HD12 ILE A 228 7.868 0.948 -9.923 1.00 31.12 H new ATOM 0 HD13 ILE A 228 9.470 1.581 -10.373 1.00 31.12 H new ATOM 1037 N GLU A 229 5.996 4.865 -8.517 1.00 31.01 N ATOM 1038 CA GLU A 229 5.392 6.187 -8.537 1.00 62.33 C ATOM 1039 C GLU A 229 4.126 6.205 -7.680 1.00 3.04 C ATOM 1040 O GLU A 229 3.664 7.269 -7.270 1.00 44.31 O ATOM 1041 CB GLU A 229 5.092 6.632 -9.969 1.00 43.32 C ATOM 1042 CG GLU A 229 6.383 6.964 -10.722 1.00 30.35 C ATOM 1043 CD GLU A 229 6.181 8.162 -11.652 1.00 52.52 C ATOM 1044 OE1 GLU A 229 6.146 7.994 -12.881 1.00 45.23 O ATOM 1045 OE2 GLU A 229 6.059 9.300 -11.057 1.00 32.43 O ATOM 0 H GLU A 229 5.942 4.358 -9.400 1.00 31.01 H new ATOM 0 HA GLU A 229 6.103 6.896 -8.114 1.00 62.33 H new ATOM 0 HB2 GLU A 229 4.553 5.843 -10.494 1.00 43.32 H new ATOM 0 HB3 GLU A 229 4.441 7.506 -9.953 1.00 43.32 H new ATOM 0 HG2 GLU A 229 7.178 7.182 -10.009 1.00 30.35 H new ATOM 0 HG3 GLU A 229 6.703 6.098 -11.302 1.00 30.35 H new ATOM 1051 N ASP A 230 3.598 5.014 -7.435 1.00 12.11 N ATOM 1052 CA ASP A 230 2.392 4.880 -6.634 1.00 53.14 C ATOM 1053 C ASP A 230 2.777 4.754 -5.159 1.00 63.11 C ATOM 1054 O ASP A 230 1.937 4.929 -4.277 1.00 54.41 O ATOM 1055 CB ASP A 230 1.608 3.626 -7.027 1.00 41.31 C ATOM 1056 CG ASP A 230 0.612 3.819 -8.173 1.00 23.43 C ATOM 1057 OD1 ASP A 230 -0.086 4.842 -8.247 1.00 75.52 O ATOM 1058 OD2 ASP A 230 0.567 2.851 -9.024 1.00 51.21 O ATOM 0 H ASP A 230 3.983 4.133 -7.777 1.00 12.11 H new ATOM 0 HA ASP A 230 1.773 5.761 -6.804 1.00 53.14 H new ATOM 0 HB2 ASP A 230 2.316 2.846 -7.308 1.00 41.31 H new ATOM 0 HB3 ASP A 230 1.067 3.265 -6.152 1.00 41.31 H new ATOM 1063 N ILE A 231 4.048 4.452 -4.935 1.00 0.45 N ATOM 1064 CA ILE A 231 4.554 4.302 -3.582 1.00 22.31 C ATOM 1065 C ILE A 231 4.608 5.674 -2.906 1.00 31.14 C ATOM 1066 O ILE A 231 3.837 5.948 -1.987 1.00 11.33 O ATOM 1067 CB ILE A 231 5.896 3.568 -3.590 1.00 20.42 C ATOM 1068 CG1 ILE A 231 5.691 2.053 -3.660 1.00 60.31 C ATOM 1069 CG2 ILE A 231 6.751 3.975 -2.389 1.00 43.45 C ATOM 1070 CD1 ILE A 231 6.785 1.390 -4.500 1.00 14.41 C ATOM 0 H ILE A 231 4.742 4.307 -5.668 1.00 0.45 H new ATOM 0 HA ILE A 231 3.881 3.681 -2.991 1.00 22.31 H new ATOM 0 HB ILE A 231 6.441 3.862 -4.487 1.00 20.42 H new ATOM 0 HG12 ILE A 231 5.697 1.635 -2.653 1.00 60.31 H new ATOM 0 HG13 ILE A 231 4.714 1.834 -4.091 1.00 60.31 H new ATOM 0 HG21 ILE A 231 7.699 3.439 -2.419 1.00 43.45 H new ATOM 0 HG22 ILE A 231 6.940 5.048 -2.424 1.00 43.45 H new ATOM 0 HG23 ILE A 231 6.224 3.729 -1.467 1.00 43.45 H new ATOM 0 HD11 ILE A 231 6.616 0.314 -4.534 1.00 14.41 H new ATOM 0 HD12 ILE A 231 6.761 1.793 -5.512 1.00 14.41 H new ATOM 0 HD13 ILE A 231 7.759 1.590 -4.053 1.00 14.41 H new ATOM 1081 N LYS A 232 5.525 6.499 -3.387 1.00 40.54 N ATOM 1082 CA LYS A 232 5.689 7.835 -2.841 1.00 52.13 C ATOM 1083 C LYS A 232 4.362 8.589 -2.941 1.00 42.41 C ATOM 1084 O LYS A 232 4.107 9.509 -2.165 1.00 0.34 O ATOM 1085 CB LYS A 232 6.857 8.553 -3.523 1.00 22.45 C ATOM 1086 CG LYS A 232 6.435 9.118 -4.880 1.00 75.12 C ATOM 1087 CD LYS A 232 6.405 8.020 -5.946 1.00 4.52 C ATOM 1088 CE LYS A 232 7.758 7.316 -6.047 1.00 55.24 C ATOM 1089 NZ LYS A 232 8.862 8.299 -5.964 1.00 52.02 N ATOM 0 H LYS A 232 6.163 6.268 -4.149 1.00 40.54 H new ATOM 0 HA LYS A 232 5.949 7.785 -1.784 1.00 52.13 H new ATOM 0 HB2 LYS A 232 7.215 9.360 -2.884 1.00 22.45 H new ATOM 0 HB3 LYS A 232 7.687 7.859 -3.656 1.00 22.45 H new ATOM 0 HG2 LYS A 232 5.449 9.576 -4.797 1.00 75.12 H new ATOM 0 HG3 LYS A 232 7.127 9.904 -5.182 1.00 75.12 H new ATOM 0 HD2 LYS A 232 5.630 7.293 -5.702 1.00 4.52 H new ATOM 0 HD3 LYS A 232 6.144 8.453 -6.912 1.00 4.52 H new ATOM 0 HE2 LYS A 232 7.854 6.584 -5.245 1.00 55.24 H new ATOM 0 HE3 LYS A 232 7.820 6.769 -6.988 1.00 55.24 H new ATOM 0 HZ1 LYS A 232 9.705 7.916 -6.438 1.00 52.02 H new ATOM 0 HZ2 LYS A 232 8.575 9.183 -6.430 1.00 52.02 H new ATOM 0 HZ3 LYS A 232 9.083 8.490 -4.966 1.00 52.02 H new ATOM 1098 N SER A 233 3.552 8.172 -3.903 1.00 55.12 N ATOM 1099 CA SER A 233 2.257 8.797 -4.115 1.00 70.30 C ATOM 1100 C SER A 233 1.502 8.897 -2.788 1.00 62.31 C ATOM 1101 O SER A 233 1.088 9.983 -2.385 1.00 71.41 O ATOM 1102 CB SER A 233 1.430 8.017 -5.138 1.00 35.40 C ATOM 1103 OG SER A 233 1.619 8.509 -6.463 1.00 23.54 O ATOM 0 H SER A 233 3.767 7.409 -4.545 1.00 55.12 H new ATOM 0 HA SER A 233 2.421 9.800 -4.510 1.00 70.30 H new ATOM 0 HB2 SER A 233 1.706 6.963 -5.100 1.00 35.40 H new ATOM 0 HB3 SER A 233 0.374 8.080 -4.875 1.00 35.40 H new ATOM 0 HG SER A 233 2.162 7.873 -6.974 1.00 23.54 H new ATOM 1108 N VAL A 234 1.345 7.749 -2.145 1.00 71.44 N ATOM 1109 CA VAL A 234 0.647 7.693 -0.872 1.00 4.10 C ATOM 1110 C VAL A 234 1.662 7.804 0.267 1.00 42.44 C ATOM 1111 O VAL A 234 1.416 7.322 1.372 1.00 53.20 O ATOM 1112 CB VAL A 234 -0.202 6.422 -0.795 1.00 53.42 C ATOM 1113 CG1 VAL A 234 -0.878 6.133 -2.137 1.00 44.22 C ATOM 1114 CG2 VAL A 234 0.639 5.230 -0.336 1.00 24.23 C ATOM 0 H VAL A 234 1.689 6.850 -2.482 1.00 71.44 H new ATOM 0 HA VAL A 234 -0.041 8.533 -0.777 1.00 4.10 H new ATOM 0 HB VAL A 234 -0.985 6.585 -0.054 1.00 53.42 H new ATOM 0 HG11 VAL A 234 -1.475 5.225 -2.055 1.00 44.22 H new ATOM 0 HG12 VAL A 234 -1.524 6.969 -2.407 1.00 44.22 H new ATOM 0 HG13 VAL A 234 -0.117 5.999 -2.906 1.00 44.22 H new ATOM 0 HG21 VAL A 234 0.013 4.339 -0.289 1.00 24.23 H new ATOM 0 HG22 VAL A 234 1.452 5.065 -1.043 1.00 24.23 H new ATOM 0 HG23 VAL A 234 1.052 5.435 0.652 1.00 24.23 H new ATOM 1124 N ASN A 235 2.782 8.442 -0.041 1.00 22.44 N ATOM 1125 CA ASN A 235 3.836 8.622 0.943 1.00 63.31 C ATOM 1126 C ASN A 235 3.981 7.341 1.768 1.00 44.54 C ATOM 1127 O ASN A 235 4.260 7.398 2.965 1.00 75.52 O ATOM 1128 CB ASN A 235 3.504 9.766 1.903 1.00 52.54 C ATOM 1129 CG ASN A 235 3.477 11.108 1.166 1.00 31.04 C ATOM 1130 OD1 ASN A 235 4.500 11.698 0.859 1.00 22.32 O ATOM 1131 ND2 ASN A 235 2.252 11.555 0.901 1.00 64.43 N ATOM 0 H ASN A 235 2.982 8.841 -0.958 1.00 22.44 H new ATOM 0 HA ASN A 235 4.758 8.854 0.410 1.00 63.31 H new ATOM 0 HB2 ASN A 235 2.536 9.584 2.371 1.00 52.54 H new ATOM 0 HB3 ASN A 235 4.243 9.801 2.703 1.00 52.54 H new ATOM 0 HD21 ASN A 235 2.127 12.442 0.413 1.00 64.43 H new ATOM 0 HD22 ASN A 235 1.438 11.011 1.186 1.00 64.43 H new ATOM 1137 N LEU A 236 3.786 6.216 1.095 1.00 41.23 N ATOM 1138 CA LEU A 236 3.893 4.924 1.751 1.00 43.22 C ATOM 1139 C LEU A 236 5.342 4.697 2.189 1.00 1.25 C ATOM 1140 O LEU A 236 6.248 4.674 1.360 1.00 54.33 O ATOM 1141 CB LEU A 236 3.343 3.819 0.848 1.00 74.03 C ATOM 1142 CG LEU A 236 3.747 2.389 1.215 1.00 52.34 C ATOM 1143 CD1 LEU A 236 2.670 1.715 2.067 1.00 50.51 C ATOM 1144 CD2 LEU A 236 4.081 1.575 -0.037 1.00 1.53 C ATOM 0 H LEU A 236 3.555 6.173 0.103 1.00 41.23 H new ATOM 0 HA LEU A 236 3.281 4.902 2.652 1.00 43.22 H new ATOM 0 HB2 LEU A 236 2.255 3.881 0.854 1.00 74.03 H new ATOM 0 HB3 LEU A 236 3.668 4.016 -0.173 1.00 74.03 H new ATOM 0 HG LEU A 236 4.652 2.435 1.820 1.00 52.34 H new ATOM 0 HD11 LEU A 236 2.983 0.700 2.313 1.00 50.51 H new ATOM 0 HD12 LEU A 236 2.525 2.283 2.986 1.00 50.51 H new ATOM 0 HD13 LEU A 236 1.734 1.681 1.510 1.00 50.51 H new ATOM 0 HD21 LEU A 236 4.365 0.563 0.252 1.00 1.53 H new ATOM 0 HD22 LEU A 236 3.208 1.535 -0.689 1.00 1.53 H new ATOM 0 HD23 LEU A 236 4.908 2.046 -0.567 1.00 1.53 H new ATOM 1155 N PRO A 237 5.517 4.530 3.527 1.00 25.13 N ATOM 1156 CA PRO A 237 6.839 4.306 4.086 1.00 74.50 C ATOM 1157 C PRO A 237 7.316 2.878 3.810 1.00 74.13 C ATOM 1158 O PRO A 237 6.562 2.057 3.290 1.00 32.04 O ATOM 1159 CB PRO A 237 6.697 4.607 5.569 1.00 44.20 C ATOM 1160 CG PRO A 237 5.208 4.538 5.867 1.00 52.51 C ATOM 1161 CD PRO A 237 4.466 4.551 4.541 1.00 35.00 C ATOM 0 HA PRO A 237 7.599 4.944 3.635 1.00 74.50 H new ATOM 0 HB2 PRO A 237 7.249 3.884 6.169 1.00 44.20 H new ATOM 0 HB3 PRO A 237 7.098 5.592 5.808 1.00 44.20 H new ATOM 0 HG2 PRO A 237 4.972 3.633 6.427 1.00 52.51 H new ATOM 0 HG3 PRO A 237 4.903 5.383 6.484 1.00 52.51 H new ATOM 0 HD2 PRO A 237 3.808 3.687 4.447 1.00 35.00 H new ATOM 0 HD3 PRO A 237 3.841 5.439 4.446 1.00 35.00 H new ATOM 1166 N THR A 238 8.566 2.625 4.171 1.00 2.11 N ATOM 1167 CA THR A 238 9.152 1.311 3.968 1.00 2.03 C ATOM 1168 C THR A 238 8.509 0.290 4.909 1.00 31.54 C ATOM 1169 O THR A 238 7.516 0.589 5.571 1.00 40.11 O ATOM 1170 CB THR A 238 10.666 1.436 4.151 1.00 32.11 C ATOM 1171 OG1 THR A 238 10.963 2.753 3.696 1.00 40.14 O ATOM 1172 CG2 THR A 238 11.446 0.527 3.199 1.00 44.15 C ATOM 0 H THR A 238 9.189 3.308 4.603 1.00 2.11 H new ATOM 0 HA THR A 238 8.961 0.943 2.960 1.00 2.03 H new ATOM 0 HB THR A 238 10.929 1.195 5.181 1.00 32.11 H new ATOM 0 HG1 THR A 238 11.925 2.919 3.781 1.00 40.14 H new ATOM 0 HG21 THR A 238 12.515 0.654 3.369 1.00 44.15 H new ATOM 0 HG22 THR A 238 11.170 -0.512 3.380 1.00 44.15 H new ATOM 0 HG23 THR A 238 11.209 0.791 2.168 1.00 44.15 H new ATOM 1180 N VAL A 239 9.100 -0.895 4.937 1.00 72.51 N ATOM 1181 CA VAL A 239 8.597 -1.963 5.786 1.00 53.30 C ATOM 1182 C VAL A 239 9.139 -1.779 7.204 1.00 34.31 C ATOM 1183 O VAL A 239 8.452 -2.081 8.178 1.00 62.31 O ATOM 1184 CB VAL A 239 8.952 -3.322 5.181 1.00 75.52 C ATOM 1185 CG1 VAL A 239 10.463 -3.560 5.216 1.00 23.45 C ATOM 1186 CG2 VAL A 239 8.202 -4.452 5.891 1.00 4.53 C ATOM 0 H VAL A 239 9.922 -1.140 4.386 1.00 72.51 H new ATOM 0 HA VAL A 239 7.509 -1.924 5.847 1.00 53.30 H new ATOM 0 HB VAL A 239 8.638 -3.316 4.137 1.00 75.52 H new ATOM 0 HG11 VAL A 239 10.688 -4.533 4.780 1.00 23.45 H new ATOM 0 HG12 VAL A 239 10.967 -2.781 4.645 1.00 23.45 H new ATOM 0 HG13 VAL A 239 10.811 -3.536 6.249 1.00 23.45 H new ATOM 0 HG21 VAL A 239 8.473 -5.407 5.441 1.00 4.53 H new ATOM 0 HG22 VAL A 239 8.470 -4.459 6.947 1.00 4.53 H new ATOM 0 HG23 VAL A 239 7.128 -4.295 5.791 1.00 4.53 H new ATOM 1196 N GLN A 240 10.366 -1.285 7.275 1.00 21.31 N ATOM 1197 CA GLN A 240 11.009 -1.057 8.558 1.00 23.40 C ATOM 1198 C GLN A 240 10.615 0.312 9.114 1.00 21.13 C ATOM 1199 O GLN A 240 10.734 0.558 10.314 1.00 35.34 O ATOM 1200 CB GLN A 240 12.529 -1.185 8.441 1.00 41.21 C ATOM 1201 CG GLN A 240 12.915 -2.053 7.242 1.00 61.41 C ATOM 1202 CD GLN A 240 13.238 -1.191 6.020 1.00 64.20 C ATOM 1203 OE1 GLN A 240 13.563 -0.020 6.125 1.00 42.53 O ATOM 1204 NE2 GLN A 240 13.129 -1.832 4.861 1.00 20.51 N ATOM 0 H GLN A 240 10.933 -1.036 6.464 1.00 21.31 H new ATOM 0 HA GLN A 240 10.666 -1.822 9.254 1.00 23.40 H new ATOM 0 HB2 GLN A 240 12.974 -0.195 8.336 1.00 41.21 H new ATOM 0 HB3 GLN A 240 12.932 -1.621 9.355 1.00 41.21 H new ATOM 0 HG2 GLN A 240 13.779 -2.667 7.497 1.00 61.41 H new ATOM 0 HG3 GLN A 240 12.098 -2.735 7.005 1.00 61.41 H new ATOM 0 HE21 GLN A 240 12.852 -2.814 4.845 1.00 20.51 H new ATOM 0 HE22 GLN A 240 13.322 -1.342 3.987 1.00 20.51 H new ATOM 1211 N GLU A 241 10.153 1.169 8.216 1.00 13.14 N ATOM 1212 CA GLU A 241 9.740 2.508 8.600 1.00 44.53 C ATOM 1213 C GLU A 241 8.333 2.478 9.199 1.00 4.44 C ATOM 1214 O GLU A 241 8.036 3.222 10.134 1.00 14.11 O ATOM 1215 CB GLU A 241 9.808 3.467 7.410 1.00 62.44 C ATOM 1216 CG GLU A 241 11.233 3.988 7.208 1.00 50.51 C ATOM 1217 CD GLU A 241 11.600 5.013 8.284 1.00 22.23 C ATOM 1218 OE1 GLU A 241 10.723 5.744 8.769 1.00 33.43 O ATOM 1219 OE2 GLU A 241 12.846 5.034 8.616 1.00 30.31 O ATOM 0 H GLU A 241 10.055 0.962 7.222 1.00 13.14 H new ATOM 0 HA GLU A 241 10.430 2.875 9.360 1.00 44.53 H new ATOM 0 HB2 GLU A 241 9.472 2.957 6.507 1.00 62.44 H new ATOM 0 HB3 GLU A 241 9.130 4.305 7.574 1.00 62.44 H new ATOM 0 HG2 GLU A 241 11.936 3.156 7.239 1.00 50.51 H new ATOM 0 HG3 GLU A 241 11.321 4.443 6.222 1.00 50.51 H new ATOM 1225 N TRP A 242 7.504 1.610 8.638 1.00 64.00 N ATOM 1226 CA TRP A 242 6.134 1.474 9.106 1.00 53.30 C ATOM 1227 C TRP A 242 6.137 0.524 10.306 1.00 42.53 C ATOM 1228 O TRP A 242 5.676 0.885 11.388 1.00 65.13 O ATOM 1229 CB TRP A 242 5.214 1.007 7.977 1.00 41.23 C ATOM 1230 CG TRP A 242 3.963 0.269 8.459 1.00 55.21 C ATOM 1231 CD1 TRP A 242 3.220 0.526 9.543 1.00 44.55 C ATOM 1232 CD2 TRP A 242 3.334 -0.864 7.823 1.00 53.43 C ATOM 1233 NE1 TRP A 242 2.163 -0.354 9.654 1.00 41.04 N ATOM 1234 CE2 TRP A 242 2.235 -1.227 8.573 1.00 5.51 C ATOM 1235 CE3 TRP A 242 3.683 -1.558 6.651 1.00 34.52 C ATOM 1236 CZ2 TRP A 242 1.395 -2.294 8.236 1.00 30.33 C ATOM 1237 CZ3 TRP A 242 2.834 -2.623 6.328 1.00 22.32 C ATOM 1238 CH2 TRP A 242 1.723 -3.002 7.073 1.00 63.01 C ATOM 0 H TRP A 242 7.754 0.994 7.864 1.00 64.00 H new ATOM 0 HA TRP A 242 5.737 2.438 9.425 1.00 53.30 H new ATOM 0 HB2 TRP A 242 4.909 1.873 7.389 1.00 41.23 H new ATOM 0 HB3 TRP A 242 5.776 0.352 7.311 1.00 41.23 H new ATOM 0 HD1 TRP A 242 3.423 1.323 10.243 1.00 44.55 H new ATOM 0 HE1 TRP A 242 1.459 -0.363 10.392 1.00 41.04 H new ATOM 0 HE3 TRP A 242 4.538 -1.291 6.048 1.00 34.52 H new ATOM 0 HZ2 TRP A 242 0.540 -2.557 8.840 1.00 30.33 H new ATOM 0 HZ3 TRP A 242 3.058 -3.191 5.437 1.00 22.32 H new ATOM 0 HH2 TRP A 242 1.116 -3.838 6.757 1.00 63.01 H new ATOM 1248 N LYS A 243 6.660 -0.670 10.074 1.00 45.14 N ATOM 1249 CA LYS A 243 6.730 -1.674 11.123 1.00 11.14 C ATOM 1250 C LYS A 243 7.530 -1.118 12.302 1.00 52.02 C ATOM 1251 O LYS A 243 7.452 -1.644 13.411 1.00 64.12 O ATOM 1252 CB LYS A 243 7.280 -2.989 10.569 1.00 64.24 C ATOM 1253 CG LYS A 243 6.422 -3.500 9.411 1.00 21.53 C ATOM 1254 CD LYS A 243 6.957 -4.830 8.877 1.00 53.24 C ATOM 1255 CE LYS A 243 7.288 -5.788 10.023 1.00 34.11 C ATOM 1256 NZ LYS A 243 6.124 -5.939 10.924 1.00 20.23 N ATOM 0 H LYS A 243 7.040 -0.966 9.175 1.00 45.14 H new ATOM 0 HA LYS A 243 5.733 -1.906 11.497 1.00 11.14 H new ATOM 0 HB2 LYS A 243 8.305 -2.844 10.229 1.00 64.24 H new ATOM 0 HB3 LYS A 243 7.310 -3.737 11.361 1.00 64.24 H new ATOM 0 HG2 LYS A 243 5.392 -3.626 9.745 1.00 21.53 H new ATOM 0 HG3 LYS A 243 6.409 -2.761 8.610 1.00 21.53 H new ATOM 0 HD2 LYS A 243 6.217 -5.286 8.219 1.00 53.24 H new ATOM 0 HD3 LYS A 243 7.850 -4.652 8.277 1.00 53.24 H new ATOM 0 HE2 LYS A 243 7.573 -6.760 9.621 1.00 34.11 H new ATOM 0 HE3 LYS A 243 8.143 -5.412 10.584 1.00 34.11 H new ATOM 0 HZ1 LYS A 243 6.020 -6.938 11.192 1.00 20.23 H new ATOM 0 HZ2 LYS A 243 6.270 -5.365 11.779 1.00 20.23 H new ATOM 0 HZ3 LYS A 243 5.263 -5.620 10.435 1.00 20.23 H new ATOM 1265 N SER A 244 8.281 -0.064 12.022 1.00 41.23 N ATOM 1266 CA SER A 244 9.095 0.569 13.047 1.00 33.31 C ATOM 1267 C SER A 244 8.335 0.599 14.374 1.00 45.50 C ATOM 1268 O SER A 244 8.820 0.089 15.383 1.00 61.21 O ATOM 1269 CB SER A 244 9.498 1.985 12.633 1.00 54.12 C ATOM 1270 OG SER A 244 10.683 2.418 13.295 1.00 61.01 O ATOM 0 H SER A 244 8.344 0.368 11.100 1.00 41.23 H new ATOM 0 HA SER A 244 10.006 -0.017 13.171 1.00 33.31 H new ATOM 0 HB2 SER A 244 9.653 2.017 11.555 1.00 54.12 H new ATOM 0 HB3 SER A 244 8.684 2.674 12.859 1.00 54.12 H new ATOM 0 HG SER A 244 10.908 3.326 13.002 1.00 61.01 H new ATOM 1577 N PHE B 470 10.205 -9.084 8.466 1.00 45.34 N ATOM 1578 CA PHE B 470 9.564 -9.014 7.165 1.00 32.12 C ATOM 1579 C PHE B 470 10.592 -8.762 6.059 1.00 23.43 C ATOM 1580 O PHE B 470 10.230 -8.601 4.895 1.00 10.21 O ATOM 1581 CB PHE B 470 8.585 -7.839 7.210 1.00 24.23 C ATOM 1582 CG PHE B 470 7.183 -8.215 7.696 1.00 72.24 C ATOM 1583 CD1 PHE B 470 7.009 -9.306 8.489 1.00 30.10 C ATOM 1584 CD2 PHE B 470 6.113 -7.460 7.334 1.00 14.54 C ATOM 1585 CE1 PHE B 470 5.708 -9.655 8.939 1.00 22.41 C ATOM 1586 CE2 PHE B 470 4.812 -7.809 7.784 1.00 12.14 C ATOM 1587 CZ PHE B 470 4.637 -8.900 8.577 1.00 50.21 C ATOM 0 HA PHE B 470 9.060 -9.956 6.949 1.00 32.12 H new ATOM 0 HB2 PHE B 470 8.990 -7.067 7.864 1.00 24.23 H new ATOM 0 HB3 PHE B 470 8.509 -7.405 6.213 1.00 24.23 H new ATOM 0 HD1 PHE B 470 7.859 -9.907 8.776 1.00 30.10 H new ATOM 0 HD2 PHE B 470 6.252 -6.594 6.704 1.00 14.54 H new ATOM 0 HE1 PHE B 470 5.569 -10.521 9.569 1.00 22.41 H new ATOM 0 HE2 PHE B 470 3.962 -7.208 7.497 1.00 12.14 H new ATOM 0 HZ PHE B 470 3.648 -9.166 8.919 1.00 50.21 H new ATOM 1596 N ILE B 471 11.853 -8.737 6.463 1.00 45.22 N ATOM 1597 CA ILE B 471 12.937 -8.508 5.523 1.00 12.11 C ATOM 1598 C ILE B 471 13.119 -9.751 4.649 1.00 4.12 C ATOM 1599 O ILE B 471 12.960 -10.875 5.122 1.00 23.35 O ATOM 1600 CB ILE B 471 14.207 -8.083 6.261 1.00 52.21 C ATOM 1601 CG1 ILE B 471 14.336 -6.558 6.297 1.00 72.44 C ATOM 1602 CG2 ILE B 471 15.444 -8.748 5.654 1.00 14.41 C ATOM 1603 CD1 ILE B 471 12.974 -5.897 6.520 1.00 24.30 C ATOM 0 H ILE B 471 12.149 -8.872 7.430 1.00 45.22 H new ATOM 0 HA ILE B 471 12.694 -7.681 4.856 1.00 12.11 H new ATOM 0 HB ILE B 471 14.132 -8.425 7.293 1.00 52.21 H new ATOM 0 HG12 ILE B 471 15.020 -6.266 7.094 1.00 72.44 H new ATOM 0 HG13 ILE B 471 14.767 -6.204 5.361 1.00 72.44 H new ATOM 0 HG21 ILE B 471 16.333 -8.428 6.198 1.00 14.41 H new ATOM 0 HG22 ILE B 471 15.346 -9.831 5.724 1.00 14.41 H new ATOM 0 HG23 ILE B 471 15.536 -8.459 4.607 1.00 14.41 H new ATOM 0 HD11 ILE B 471 13.094 -4.814 6.541 1.00 24.30 H new ATOM 0 HD12 ILE B 471 12.299 -6.171 5.709 1.00 24.30 H new ATOM 0 HD13 ILE B 471 12.557 -6.234 7.469 1.00 24.30 H new ATOM 1614 N PRO B 472 13.460 -9.501 3.357 1.00 3.20 N ATOM 1615 CA PRO B 472 13.667 -10.586 2.413 1.00 4.11 C ATOM 1616 C PRO B 472 15.004 -11.286 2.667 1.00 12.04 C ATOM 1617 O PRO B 472 15.936 -10.680 3.194 1.00 34.41 O ATOM 1618 CB PRO B 472 13.587 -9.936 1.042 1.00 44.44 C ATOM 1619 CG PRO B 472 13.804 -8.449 1.273 1.00 55.51 C ATOM 1620 CD PRO B 472 13.658 -8.182 2.762 1.00 62.13 C ATOM 0 HA PRO B 472 12.921 -11.375 2.508 1.00 4.11 H new ATOM 0 HB2 PRO B 472 14.345 -10.342 0.372 1.00 44.44 H new ATOM 0 HB3 PRO B 472 12.619 -10.122 0.577 1.00 44.44 H new ATOM 0 HG2 PRO B 472 14.793 -8.149 0.927 1.00 55.51 H new ATOM 0 HG3 PRO B 472 13.078 -7.865 0.708 1.00 55.51 H new ATOM 0 HD2 PRO B 472 14.545 -7.694 3.166 1.00 62.13 H new ATOM 0 HD3 PRO B 472 12.813 -7.525 2.966 1.00 62.13 H new ATOM 1625 N SER B 473 15.054 -12.552 2.281 1.00 32.41 N ATOM 1626 CA SER B 473 16.262 -13.342 2.460 1.00 2.45 C ATOM 1627 C SER B 473 17.135 -13.252 1.207 1.00 20.42 C ATOM 1628 O SER B 473 18.256 -12.750 1.262 1.00 33.12 O ATOM 1629 CB SER B 473 15.924 -14.802 2.769 1.00 54.20 C ATOM 1630 OG SER B 473 15.990 -15.081 4.164 1.00 63.31 O ATOM 0 H SER B 473 14.278 -13.051 1.845 1.00 32.41 H new ATOM 0 HA SER B 473 16.813 -12.938 3.309 1.00 2.45 H new ATOM 0 HB2 SER B 473 14.923 -15.028 2.401 1.00 54.20 H new ATOM 0 HB3 SER B 473 16.615 -15.455 2.236 1.00 54.20 H new ATOM 0 HG SER B 473 15.766 -16.022 4.320 1.00 63.31 H new ATOM 1635 N ARG B 474 16.588 -13.748 0.107 1.00 35.10 N ATOM 1636 CA ARG B 474 17.304 -13.731 -1.158 1.00 4.14 C ATOM 1637 C ARG B 474 16.949 -12.471 -1.951 1.00 64.41 C ATOM 1638 O ARG B 474 16.056 -11.720 -1.564 1.00 4.11 O ATOM 1639 CB ARG B 474 16.967 -14.965 -1.998 1.00 13.11 C ATOM 1640 CG ARG B 474 16.317 -16.052 -1.139 1.00 71.14 C ATOM 1641 CD ARG B 474 16.478 -17.429 -1.786 1.00 63.11 C ATOM 1642 NE ARG B 474 16.675 -18.458 -0.740 1.00 34.52 N ATOM 1643 CZ ARG B 474 17.793 -18.573 0.008 1.00 53.30 C ATOM 1644 NH1 ARG B 474 18.825 -17.721 -0.167 1.00 33.42 N ATOM 1645 NH2 ARG B 474 17.861 -19.531 0.914 1.00 51.02 N ATOM 0 H ARG B 474 15.658 -14.164 0.065 1.00 35.10 H new ATOM 0 HA ARG B 474 18.371 -13.737 -0.936 1.00 4.14 H new ATOM 0 HB2 ARG B 474 16.293 -14.685 -2.808 1.00 13.11 H new ATOM 0 HB3 ARG B 474 17.875 -15.355 -2.459 1.00 13.11 H new ATOM 0 HG2 ARG B 474 16.770 -16.057 -0.147 1.00 71.14 H new ATOM 0 HG3 ARG B 474 15.258 -15.830 -1.005 1.00 71.14 H new ATOM 0 HD2 ARG B 474 15.596 -17.666 -2.380 1.00 63.11 H new ATOM 0 HD3 ARG B 474 17.329 -17.423 -2.467 1.00 63.11 H new ATOM 0 HE ARG B 474 15.919 -19.122 -0.574 1.00 34.52 H new ATOM 0 HH11 ARG B 474 18.764 -16.983 -0.869 1.00 33.42 H new ATOM 0 HH12 ARG B 474 19.666 -17.815 0.402 1.00 33.42 H new ATOM 0 HH21 ARG B 474 17.076 -20.170 1.040 1.00 51.02 H new ATOM 0 HH22 ARG B 474 18.698 -19.632 1.488 1.00 51.02 H new ATOM 1655 N PRO B 475 17.688 -12.273 -3.075 1.00 41.32 N ATOM 1656 CA PRO B 475 17.462 -11.117 -3.926 1.00 23.52 C ATOM 1657 C PRO B 475 16.186 -11.286 -4.753 1.00 31.04 C ATOM 1658 O PRO B 475 15.401 -12.201 -4.509 1.00 44.10 O ATOM 1659 CB PRO B 475 18.714 -11.006 -4.781 1.00 35.35 C ATOM 1660 CG PRO B 475 19.390 -12.366 -4.708 1.00 51.32 C ATOM 1661 CD PRO B 475 18.756 -13.141 -3.565 1.00 23.13 C ATOM 0 HA PRO B 475 17.302 -10.201 -3.357 1.00 23.52 H new ATOM 0 HB2 PRO B 475 18.463 -10.749 -5.810 1.00 35.35 H new ATOM 0 HB3 PRO B 475 19.373 -10.222 -4.409 1.00 35.35 H new ATOM 0 HG2 PRO B 475 19.268 -12.904 -5.648 1.00 51.32 H new ATOM 0 HG3 PRO B 475 20.461 -12.251 -4.543 1.00 51.32 H new ATOM 0 HD2 PRO B 475 18.363 -14.099 -3.906 1.00 23.13 H new ATOM 0 HD3 PRO B 475 19.483 -13.356 -2.781 1.00 23.13 H new ATOM 1666 N ALA B 476 16.019 -10.390 -5.715 1.00 25.44 N ATOM 1667 CA ALA B 476 14.851 -10.429 -6.579 1.00 44.14 C ATOM 1668 C ALA B 476 14.851 -11.739 -7.370 1.00 44.20 C ATOM 1669 O ALA B 476 15.881 -12.142 -7.908 1.00 33.05 O ATOM 1670 CB ALA B 476 14.847 -9.198 -7.488 1.00 61.34 C ATOM 0 H ALA B 476 16.673 -9.633 -5.915 1.00 25.44 H new ATOM 0 HA ALA B 476 13.935 -10.401 -5.989 1.00 44.14 H new ATOM 0 HB1 ALA B 476 13.971 -9.227 -8.136 1.00 61.34 H new ATOM 0 HB2 ALA B 476 14.817 -8.295 -6.878 1.00 61.34 H new ATOM 0 HB3 ALA B 476 15.750 -9.194 -8.098 1.00 61.34 H new ATOM 1676 N PRO B 477 13.654 -12.382 -7.416 1.00 34.40 N ATOM 1677 CA PRO B 477 13.507 -13.637 -8.133 1.00 22.54 C ATOM 1678 C PRO B 477 13.480 -13.406 -9.645 1.00 12.00 C ATOM 1679 O PRO B 477 13.888 -12.348 -10.122 1.00 30.11 O ATOM 1680 CB PRO B 477 12.218 -14.245 -7.602 1.00 42.34 C ATOM 1681 CG PRO B 477 11.454 -13.101 -6.955 1.00 44.45 C ATOM 1682 CD PRO B 477 12.414 -11.933 -6.790 1.00 63.42 C ATOM 0 HA PRO B 477 14.347 -14.313 -7.973 1.00 22.54 H new ATOM 0 HB2 PRO B 477 11.638 -14.696 -8.407 1.00 42.34 H new ATOM 0 HB3 PRO B 477 12.427 -15.034 -6.879 1.00 42.34 H new ATOM 0 HG2 PRO B 477 10.604 -12.812 -7.573 1.00 44.45 H new ATOM 0 HG3 PRO B 477 11.055 -13.407 -5.988 1.00 44.45 H new ATOM 0 HD2 PRO B 477 12.030 -11.034 -7.272 1.00 63.42 H new ATOM 0 HD3 PRO B 477 12.566 -11.691 -5.738 1.00 63.42 H new ATOM 1687 N LYS B 478 12.995 -14.412 -10.356 1.00 13.04 N ATOM 1688 CA LYS B 478 12.909 -14.332 -11.805 1.00 10.53 C ATOM 1689 C LYS B 478 11.548 -14.863 -12.261 1.00 31.30 C ATOM 1690 O LYS B 478 11.401 -16.056 -12.526 1.00 51.32 O ATOM 1691 CB LYS B 478 14.097 -15.046 -12.453 1.00 3.30 C ATOM 1692 CG LYS B 478 15.405 -14.684 -11.746 1.00 32.13 C ATOM 1693 CD LYS B 478 15.663 -15.616 -10.561 1.00 24.55 C ATOM 1694 CE LYS B 478 17.140 -15.600 -10.162 1.00 31.31 C ATOM 1695 NZ LYS B 478 17.665 -14.217 -10.176 1.00 44.34 N ATOM 0 H LYS B 478 12.657 -15.288 -9.956 1.00 13.04 H new ATOM 0 HA LYS B 478 12.973 -13.295 -12.134 1.00 10.53 H new ATOM 0 HB2 LYS B 478 13.944 -16.124 -12.413 1.00 3.30 H new ATOM 0 HB3 LYS B 478 14.160 -14.772 -13.506 1.00 3.30 H new ATOM 0 HG2 LYS B 478 16.234 -14.748 -12.451 1.00 32.13 H new ATOM 0 HG3 LYS B 478 15.361 -13.652 -11.399 1.00 32.13 H new ATOM 0 HD2 LYS B 478 15.050 -15.310 -9.713 1.00 24.55 H new ATOM 0 HD3 LYS B 478 15.364 -16.631 -10.821 1.00 24.55 H new ATOM 0 HE2 LYS B 478 17.259 -16.030 -9.168 1.00 31.31 H new ATOM 0 HE3 LYS B 478 17.715 -16.221 -10.849 1.00 31.31 H new ATOM 0 HZ1 LYS B 478 18.555 -14.178 -9.640 1.00 44.34 H new ATOM 0 HZ2 LYS B 478 17.839 -13.922 -11.158 1.00 44.34 H new ATOM 0 HZ3 LYS B 478 16.970 -13.578 -9.740 1.00 44.34 H new ATOM 1704 N PRO B 479 10.563 -13.930 -12.341 1.00 51.25 N ATOM 1705 CA PRO B 479 9.220 -14.293 -12.761 1.00 42.51 C ATOM 1706 C PRO B 479 9.164 -14.531 -14.271 1.00 11.12 C ATOM 1707 O PRO B 479 10.080 -14.152 -14.998 1.00 54.32 O ATOM 1708 CB PRO B 479 8.342 -13.137 -12.310 1.00 64.21 C ATOM 1709 CG PRO B 479 9.282 -11.967 -12.070 1.00 14.04 C ATOM 1710 CD PRO B 479 10.702 -12.508 -12.036 1.00 24.33 C ATOM 0 HA PRO B 479 8.880 -15.230 -12.321 1.00 42.51 H new ATOM 0 HB2 PRO B 479 7.599 -12.892 -13.069 1.00 64.21 H new ATOM 0 HB3 PRO B 479 7.797 -13.392 -11.401 1.00 64.21 H new ATOM 0 HG2 PRO B 479 9.176 -11.224 -12.860 1.00 14.04 H new ATOM 0 HG3 PRO B 479 9.040 -11.470 -11.130 1.00 14.04 H new ATOM 0 HD2 PRO B 479 11.335 -12.006 -12.768 1.00 24.33 H new ATOM 0 HD3 PRO B 479 11.161 -12.355 -11.059 1.00 24.33 H new ATOM 1715 N PRO B 480 8.049 -15.176 -14.709 1.00 54.20 N ATOM 1716 CA PRO B 480 7.860 -15.470 -16.120 1.00 43.34 C ATOM 1717 C PRO B 480 7.479 -14.208 -16.897 1.00 34.23 C ATOM 1718 O PRO B 480 8.349 -13.497 -17.399 1.00 21.05 O ATOM 1719 CB PRO B 480 6.782 -16.540 -16.158 1.00 41.20 C ATOM 1720 CG PRO B 480 6.080 -16.472 -14.811 1.00 54.04 C ATOM 1721 CD PRO B 480 6.943 -15.640 -13.877 1.00 14.41 C ATOM 0 HA PRO B 480 8.771 -15.825 -16.602 1.00 43.34 H new ATOM 0 HB2 PRO B 480 6.081 -16.360 -16.973 1.00 41.20 H new ATOM 0 HB3 PRO B 480 7.216 -17.526 -16.323 1.00 41.20 H new ATOM 0 HG2 PRO B 480 5.092 -16.024 -14.918 1.00 54.04 H new ATOM 0 HG3 PRO B 480 5.934 -17.473 -14.406 1.00 54.04 H new ATOM 0 HD2 PRO B 480 6.383 -14.803 -13.461 1.00 14.41 H new ATOM 0 HD3 PRO B 480 7.302 -16.233 -13.036 1.00 14.41 H new