USER MOD reduce.3.24.130724 H: found=0, std=0, add=776, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 774 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 82 ASN : amide:sc= -1.16 K(o=-2.9,f=-2.3) USER MOD Set 1.2: A 83 ASN : amide:sc= -1.76! K(o=-2.9!,f=-1.8) USER MOD Set 2.1: A 9 SER OG : rot 84:sc= 0.229 USER MOD Set 2.2: A 53 GLN : amide:sc= -0.955 K(o=-0.73,f=-2.5!) USER MOD Set 2.3: A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.1: A 43 THR OG1 : rot -36:sc= 2.06 USER MOD Set 3.2: A 47 THR OG1 : rot 32:sc= 1.02 USER MOD Single : A 5 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 TYR OH : rot 120:sc= 0 USER MOD Single : A 17 LYS NZ :NH3+ -165:sc= -0.0116 (180deg=-0.214) USER MOD Single : A 19 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 HIS : no HE2:sc= 1.18 K(o=1.2,f=-3.5!) USER MOD Single : A 27 THR OG1 : rot 71:sc= 0.713 USER MOD Single : A 28 GLN : amide:sc= -0.918 K(o=-0.92,f=-1.6) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 LYS NZ :NH3+ -165:sc= -0.0061 (180deg=-0.0759) USER MOD Single : A 41 GLN : amide:sc= 0 X(o=0,f=-0.015) USER MOD Single : A 42 ASN : amide:sc= -0.584 K(o=-0.58,f=-1.4) USER MOD Single : A 49 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 51 GLN : amide:sc= -1.27 K(o=-1.3,f=-3.9!) USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 HIS : no HD1:sc= -0.13 X(o=-0.13,f=-0.38) USER MOD Single : A 62 MET CE :methyl -128:sc= -0.889 (180deg=-4.2!) USER MOD Single : A 63 GLN : amide:sc= -0.344 K(o=-0.34,f=-0.88) USER MOD Single : A 68 THR OG1 : rot -121:sc= 0.499 USER MOD Single : A 71 SER OG : rot 180:sc= 0.741 USER MOD Single : A 73 LYS NZ :NH3+ -157:sc= -0.0764 (180deg=-0.399) USER MOD Single : A 74 SER OG : rot -67:sc= -0.322 USER MOD Single : A 75 HIS : no HD1:sc= -0.381 X(o=-0.38,f=-0.09) USER MOD Single : A 78 LYS NZ :NH3+ 142:sc= -0.0631 (180deg=-0.327) USER MOD Single : A 80 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 89 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0244) USER MOD Single : A 92 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 96 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 40 N ASN A 5 11.170 1.081 -6.402 1.00 60.31 N ATOM 41 CA ASN A 5 10.999 -0.238 -7.001 1.00 73.00 C ATOM 42 C ASN A 5 11.248 -0.189 -8.505 1.00 44.23 C ATOM 43 O ASN A 5 10.311 -0.224 -9.304 1.00 2.35 O ATOM 44 CB ASN A 5 9.591 -0.768 -6.723 1.00 74.15 C ATOM 45 CG ASN A 5 9.358 -1.050 -5.252 1.00 5.45 C ATOM 46 OD1 ASN A 5 8.604 -0.342 -4.584 1.00 73.13 O ATOM 47 ND2 ASN A 5 10.009 -2.087 -4.738 1.00 73.41 N ATOM 0 HA ASN A 5 11.729 -0.911 -6.552 1.00 73.00 H new ATOM 0 HB2 ASN A 5 8.857 -0.041 -7.071 1.00 74.15 H new ATOM 0 HB3 ASN A 5 9.431 -1.682 -7.295 1.00 74.15 H new ATOM 0 HD21 ASN A 5 9.894 -2.324 -3.753 1.00 73.41 H new ATOM 0 HD22 ASN A 5 10.624 -2.647 -5.329 1.00 73.41 H new ATOM 54 N THR A 6 12.519 -0.108 -8.887 1.00 25.14 N ATOM 55 CA THR A 6 12.893 -0.054 -10.294 1.00 43.41 C ATOM 56 C THR A 6 13.238 -1.440 -10.825 1.00 65.14 C ATOM 57 O THR A 6 14.186 -2.076 -10.362 1.00 2.24 O ATOM 58 CB THR A 6 14.094 0.884 -10.521 1.00 1.14 C ATOM 59 OG1 THR A 6 13.831 2.166 -9.939 1.00 23.10 O ATOM 60 CG2 THR A 6 14.383 1.045 -12.006 1.00 34.15 C ATOM 0 H THR A 6 13.307 -0.078 -8.240 1.00 25.14 H new ATOM 0 HA THR A 6 12.030 0.335 -10.835 1.00 43.41 H new ATOM 0 HB THR A 6 14.968 0.441 -10.044 1.00 1.14 H new ATOM 0 HG1 THR A 6 14.600 2.756 -10.086 1.00 23.10 H new ATOM 0 HG21 THR A 6 15.235 1.712 -12.141 1.00 34.15 H new ATOM 0 HG22 THR A 6 14.612 0.072 -12.440 1.00 34.15 H new ATOM 0 HG23 THR A 6 13.510 1.467 -12.503 1.00 34.15 H new ATOM 68 N LEU A 7 12.465 -1.904 -11.801 1.00 21.23 N ATOM 69 CA LEU A 7 12.690 -3.217 -12.396 1.00 52.35 C ATOM 70 C LEU A 7 14.035 -3.266 -13.113 1.00 64.30 C ATOM 71 O LEU A 7 14.403 -2.334 -13.828 1.00 44.04 O ATOM 72 CB LEU A 7 11.565 -3.553 -13.377 1.00 35.14 C ATOM 73 CG LEU A 7 10.357 -4.283 -12.787 1.00 61.13 C ATOM 74 CD1 LEU A 7 10.767 -5.645 -12.249 1.00 61.25 C ATOM 75 CD2 LEU A 7 9.711 -3.447 -11.692 1.00 22.53 C ATOM 0 H LEU A 7 11.677 -1.391 -12.197 1.00 21.23 H new ATOM 0 HA LEU A 7 12.699 -3.956 -11.594 1.00 52.35 H new ATOM 0 HB2 LEU A 7 11.217 -2.625 -13.832 1.00 35.14 H new ATOM 0 HB3 LEU A 7 11.979 -4.165 -14.178 1.00 35.14 H new ATOM 0 HG LEU A 7 9.625 -4.434 -13.580 1.00 61.13 H new ATOM 0 HD11 LEU A 7 9.895 -6.150 -11.833 1.00 61.25 H new ATOM 0 HD12 LEU A 7 11.182 -6.246 -13.058 1.00 61.25 H new ATOM 0 HD13 LEU A 7 11.518 -5.517 -11.469 1.00 61.25 H new ATOM 0 HD21 LEU A 7 8.853 -3.982 -11.284 1.00 22.53 H new ATOM 0 HD22 LEU A 7 10.436 -3.264 -10.899 1.00 22.53 H new ATOM 0 HD23 LEU A 7 9.380 -2.495 -12.108 1.00 22.53 H new ATOM 87 N ILE A 8 14.764 -4.360 -12.918 1.00 31.24 N ATOM 88 CA ILE A 8 16.067 -4.532 -13.548 1.00 32.41 C ATOM 89 C ILE A 8 16.250 -5.960 -14.050 1.00 60.45 C ATOM 90 O ILE A 8 15.619 -6.891 -13.550 1.00 70.20 O ATOM 91 CB ILE A 8 17.212 -4.191 -12.576 1.00 72.30 C ATOM 92 CG1 ILE A 8 17.001 -4.900 -11.236 1.00 50.14 C ATOM 93 CG2 ILE A 8 17.306 -2.686 -12.376 1.00 62.11 C ATOM 94 CD1 ILE A 8 18.284 -5.139 -10.471 1.00 15.33 C ATOM 0 H ILE A 8 14.474 -5.140 -12.329 1.00 31.24 H new ATOM 0 HA ILE A 8 16.102 -3.845 -14.393 1.00 32.41 H new ATOM 0 HB ILE A 8 18.151 -4.540 -13.006 1.00 72.30 H new ATOM 0 HG12 ILE A 8 16.326 -4.304 -10.621 1.00 50.14 H new ATOM 0 HG13 ILE A 8 16.510 -5.857 -11.414 1.00 50.14 H new ATOM 0 HG21 ILE A 8 18.120 -2.461 -11.687 1.00 62.11 H new ATOM 0 HG22 ILE A 8 17.498 -2.203 -13.334 1.00 62.11 H new ATOM 0 HG23 ILE A 8 16.368 -2.314 -11.964 1.00 62.11 H new ATOM 0 HD11 ILE A 8 18.059 -5.645 -9.532 1.00 15.33 H new ATOM 0 HD12 ILE A 8 18.953 -5.760 -11.067 1.00 15.33 H new ATOM 0 HD13 ILE A 8 18.766 -4.184 -10.262 1.00 15.33 H new ATOM 106 N SER A 9 17.119 -6.126 -15.042 1.00 45.12 N ATOM 107 CA SER A 9 17.385 -7.441 -15.614 1.00 40.44 C ATOM 108 C SER A 9 18.860 -7.805 -15.478 1.00 3.25 C ATOM 109 O SER A 9 19.741 -7.009 -15.803 1.00 40.33 O ATOM 110 CB SER A 9 16.975 -7.471 -17.088 1.00 61.01 C ATOM 111 OG SER A 9 17.486 -8.623 -17.736 1.00 33.43 O ATOM 0 H SER A 9 17.651 -5.366 -15.466 1.00 45.12 H new ATOM 0 HA SER A 9 16.796 -8.175 -15.064 1.00 40.44 H new ATOM 0 HB2 SER A 9 15.888 -7.458 -17.167 1.00 61.01 H new ATOM 0 HB3 SER A 9 17.342 -6.575 -17.589 1.00 61.01 H new ATOM 0 HG SER A 9 16.883 -9.380 -17.582 1.00 33.43 H new ATOM 117 N VAL A 10 19.122 -9.014 -14.993 1.00 22.53 N ATOM 118 CA VAL A 10 20.490 -9.486 -14.813 1.00 30.40 C ATOM 119 C VAL A 10 20.540 -11.008 -14.730 1.00 10.24 C ATOM 120 O VAL A 10 19.585 -11.647 -14.288 1.00 71.24 O ATOM 121 CB VAL A 10 21.126 -8.892 -13.542 1.00 62.33 C ATOM 122 CG1 VAL A 10 20.437 -9.431 -12.298 1.00 13.31 C ATOM 123 CG2 VAL A 10 22.618 -9.188 -13.506 1.00 31.35 C ATOM 0 H VAL A 10 18.405 -9.685 -14.717 1.00 22.53 H new ATOM 0 HA VAL A 10 21.057 -9.154 -15.683 1.00 30.40 H new ATOM 0 HB VAL A 10 20.993 -7.810 -13.561 1.00 62.33 H new ATOM 0 HG11 VAL A 10 20.900 -9.000 -11.410 1.00 13.31 H new ATOM 0 HG12 VAL A 10 19.381 -9.164 -12.322 1.00 13.31 H new ATOM 0 HG13 VAL A 10 20.536 -10.516 -12.269 1.00 13.31 H new ATOM 0 HG21 VAL A 10 23.052 -8.761 -12.602 1.00 31.35 H new ATOM 0 HG22 VAL A 10 22.775 -10.267 -13.510 1.00 31.35 H new ATOM 0 HG23 VAL A 10 23.097 -8.748 -14.381 1.00 31.35 H new ATOM 133 N ASP A 11 21.660 -11.582 -15.156 1.00 13.53 N ATOM 134 CA ASP A 11 21.836 -13.029 -15.128 1.00 13.11 C ATOM 135 C ASP A 11 22.730 -13.445 -13.964 1.00 62.34 C ATOM 136 O ASP A 11 23.136 -12.614 -13.152 1.00 22.11 O ATOM 137 CB ASP A 11 22.435 -13.517 -16.448 1.00 12.40 C ATOM 138 CG ASP A 11 21.897 -12.756 -17.644 1.00 2.31 C ATOM 139 OD1 ASP A 11 20.765 -13.055 -18.078 1.00 13.22 O ATOM 140 OD2 ASP A 11 22.608 -11.860 -18.146 1.00 25.54 O ATOM 0 H ASP A 11 22.460 -11.067 -15.525 1.00 13.53 H new ATOM 0 HA ASP A 11 20.856 -13.487 -14.992 1.00 13.11 H new ATOM 0 HB2 ASP A 11 23.519 -13.412 -16.412 1.00 12.40 H new ATOM 0 HB3 ASP A 11 22.221 -14.579 -16.570 1.00 12.40 H new ATOM 145 N TYR A 12 23.032 -14.737 -13.890 1.00 44.32 N ATOM 146 CA TYR A 12 23.876 -15.264 -12.824 1.00 72.22 C ATOM 147 C TYR A 12 24.893 -16.258 -13.376 1.00 23.12 C ATOM 148 O TYR A 12 24.743 -16.763 -14.488 1.00 20.33 O ATOM 149 CB TYR A 12 23.017 -15.938 -11.752 1.00 44.13 C ATOM 150 CG TYR A 12 22.390 -14.965 -10.779 1.00 73.45 C ATOM 151 CD1 TYR A 12 21.309 -14.177 -11.154 1.00 74.52 C ATOM 152 CD2 TYR A 12 22.878 -14.835 -9.485 1.00 34.31 C ATOM 153 CE1 TYR A 12 20.733 -13.287 -10.269 1.00 33.12 C ATOM 154 CE2 TYR A 12 22.307 -13.949 -8.592 1.00 41.43 C ATOM 155 CZ TYR A 12 21.235 -13.176 -8.989 1.00 62.41 C ATOM 156 OH TYR A 12 20.663 -12.292 -8.104 1.00 4.33 O ATOM 0 H TYR A 12 22.705 -15.438 -14.555 1.00 44.32 H new ATOM 0 HA TYR A 12 24.416 -14.430 -12.376 1.00 72.22 H new ATOM 0 HB2 TYR A 12 22.228 -16.512 -12.238 1.00 44.13 H new ATOM 0 HB3 TYR A 12 23.632 -16.647 -11.198 1.00 44.13 H new ATOM 0 HD1 TYR A 12 20.912 -14.262 -12.155 1.00 74.52 H new ATOM 0 HD2 TYR A 12 23.718 -15.437 -9.172 1.00 34.31 H new ATOM 0 HE1 TYR A 12 19.894 -12.681 -10.577 1.00 33.12 H new ATOM 0 HE2 TYR A 12 22.697 -13.862 -7.589 1.00 41.43 H new ATOM 0 HH TYR A 12 20.328 -12.781 -7.324 1.00 4.33 H new ATOM 166 N GLU A 13 25.929 -16.534 -12.589 1.00 14.44 N ATOM 167 CA GLU A 13 26.971 -17.467 -12.998 1.00 4.00 C ATOM 168 C GLU A 13 27.670 -18.069 -11.782 1.00 61.44 C ATOM 169 O GLU A 13 28.230 -17.349 -10.955 1.00 71.41 O ATOM 170 CB GLU A 13 27.995 -16.763 -13.891 1.00 50.12 C ATOM 171 CG GLU A 13 28.652 -17.683 -14.906 1.00 72.14 C ATOM 172 CD GLU A 13 29.384 -16.923 -15.995 1.00 50.31 C ATOM 173 OE1 GLU A 13 29.450 -15.679 -15.907 1.00 53.42 O ATOM 174 OE2 GLU A 13 29.891 -17.571 -16.934 1.00 53.13 O ATOM 0 H GLU A 13 26.068 -16.124 -11.665 1.00 14.44 H new ATOM 0 HA GLU A 13 26.501 -18.273 -13.562 1.00 4.00 H new ATOM 0 HB2 GLU A 13 27.503 -15.946 -14.419 1.00 50.12 H new ATOM 0 HB3 GLU A 13 28.767 -16.318 -13.263 1.00 50.12 H new ATOM 0 HG2 GLU A 13 29.353 -18.341 -14.393 1.00 72.14 H new ATOM 0 HG3 GLU A 13 27.892 -18.319 -15.360 1.00 72.14 H new ATOM 181 N ILE A 14 27.632 -19.394 -11.682 1.00 1.23 N ATOM 182 CA ILE A 14 28.261 -20.093 -10.568 1.00 64.13 C ATOM 183 C ILE A 14 29.233 -21.158 -11.066 1.00 52.25 C ATOM 184 O ILE A 14 29.040 -21.738 -12.135 1.00 42.13 O ATOM 185 CB ILE A 14 27.213 -20.757 -9.656 1.00 23.02 C ATOM 186 CG1 ILE A 14 26.111 -19.758 -9.298 1.00 74.44 C ATOM 187 CG2 ILE A 14 27.874 -21.298 -8.397 1.00 0.03 C ATOM 188 CD1 ILE A 14 26.605 -18.573 -8.499 1.00 33.11 C ATOM 0 H ILE A 14 27.173 -20.004 -12.358 1.00 1.23 H new ATOM 0 HA ILE A 14 28.808 -19.345 -9.994 1.00 64.13 H new ATOM 0 HB ILE A 14 26.761 -21.591 -10.193 1.00 23.02 H new ATOM 0 HG12 ILE A 14 25.646 -19.398 -10.216 1.00 74.44 H new ATOM 0 HG13 ILE A 14 25.337 -20.272 -8.729 1.00 74.44 H new ATOM 0 HG21 ILE A 14 27.121 -21.764 -7.762 1.00 0.03 H new ATOM 0 HG22 ILE A 14 28.627 -22.038 -8.670 1.00 0.03 H new ATOM 0 HG23 ILE A 14 28.349 -20.480 -7.855 1.00 0.03 H new ATOM 0 HD11 ILE A 14 25.770 -17.907 -8.281 1.00 33.11 H new ATOM 0 HD12 ILE A 14 27.044 -18.922 -7.564 1.00 33.11 H new ATOM 0 HD13 ILE A 14 27.358 -18.034 -9.075 1.00 33.11 H new ATOM 200 N PHE A 15 30.276 -21.411 -10.284 1.00 25.30 N ATOM 201 CA PHE A 15 31.278 -22.408 -10.645 1.00 4.52 C ATOM 202 C PHE A 15 31.493 -23.400 -9.506 1.00 60.31 C ATOM 203 O PHE A 15 31.067 -23.167 -8.376 1.00 2.23 O ATOM 204 CB PHE A 15 32.602 -21.726 -10.998 1.00 51.23 C ATOM 205 CG PHE A 15 32.549 -20.942 -12.279 1.00 24.33 C ATOM 206 CD1 PHE A 15 31.866 -19.739 -12.342 1.00 52.32 C ATOM 207 CD2 PHE A 15 33.184 -21.409 -13.418 1.00 71.05 C ATOM 208 CE1 PHE A 15 31.815 -19.016 -13.519 1.00 64.33 C ATOM 209 CE2 PHE A 15 33.137 -20.691 -14.598 1.00 43.35 C ATOM 210 CZ PHE A 15 32.453 -19.492 -14.649 1.00 32.25 C ATOM 0 H PHE A 15 30.450 -20.940 -9.396 1.00 25.30 H new ATOM 0 HA PHE A 15 30.914 -22.954 -11.515 1.00 4.52 H new ATOM 0 HB2 PHE A 15 32.886 -21.059 -10.184 1.00 51.23 H new ATOM 0 HB3 PHE A 15 33.382 -22.483 -11.077 1.00 51.23 H new ATOM 0 HD1 PHE A 15 31.368 -19.361 -11.461 1.00 52.32 H new ATOM 0 HD2 PHE A 15 33.722 -22.345 -13.384 1.00 71.05 H new ATOM 0 HE1 PHE A 15 31.277 -18.080 -13.556 1.00 64.33 H new ATOM 0 HE2 PHE A 15 33.635 -21.067 -15.480 1.00 43.35 H new ATOM 0 HZ PHE A 15 32.417 -18.928 -15.569 1.00 32.25 H new ATOM 220 N GLY A 16 32.157 -24.511 -9.814 1.00 13.41 N ATOM 221 CA GLY A 16 32.416 -25.523 -8.807 1.00 60.11 C ATOM 222 C GLY A 16 31.649 -26.805 -9.064 1.00 24.44 C ATOM 223 O GLY A 16 31.758 -27.399 -10.137 1.00 22.03 O ATOM 0 H GLY A 16 32.520 -24.727 -10.742 1.00 13.41 H new ATOM 0 HA2 GLY A 16 33.484 -25.741 -8.781 1.00 60.11 H new ATOM 0 HA3 GLY A 16 32.147 -25.132 -7.826 1.00 60.11 H new ATOM 227 N LYS A 17 30.872 -27.236 -8.075 1.00 65.05 N ATOM 228 CA LYS A 17 30.084 -28.457 -8.198 1.00 3.34 C ATOM 229 C LYS A 17 28.689 -28.152 -8.732 1.00 15.11 C ATOM 230 O LYS A 17 27.691 -28.655 -8.214 1.00 42.13 O ATOM 231 CB LYS A 17 29.981 -29.159 -6.842 1.00 31.20 C ATOM 232 CG LYS A 17 29.445 -30.578 -6.931 1.00 41.43 C ATOM 233 CD LYS A 17 30.566 -31.587 -7.117 1.00 1.52 C ATOM 234 CE LYS A 17 30.055 -33.015 -7.006 1.00 55.33 C ATOM 235 NZ LYS A 17 29.614 -33.341 -5.621 1.00 43.55 N ATOM 0 H LYS A 17 30.771 -26.758 -7.180 1.00 65.05 H new ATOM 0 HA LYS A 17 30.588 -29.116 -8.905 1.00 3.34 H new ATOM 0 HB2 LYS A 17 30.967 -29.180 -6.377 1.00 31.20 H new ATOM 0 HB3 LYS A 17 29.333 -28.575 -6.188 1.00 31.20 H new ATOM 0 HG2 LYS A 17 28.888 -30.815 -6.025 1.00 41.43 H new ATOM 0 HG3 LYS A 17 28.746 -30.652 -7.764 1.00 41.43 H new ATOM 0 HD2 LYS A 17 31.031 -31.441 -8.092 1.00 1.52 H new ATOM 0 HD3 LYS A 17 31.338 -31.417 -6.367 1.00 1.52 H new ATOM 0 HE2 LYS A 17 29.222 -33.157 -7.695 1.00 55.33 H new ATOM 0 HE3 LYS A 17 30.841 -33.707 -7.309 1.00 55.33 H new ATOM 0 HZ1 LYS A 17 29.515 -34.372 -5.522 1.00 43.55 H new ATOM 0 HZ2 LYS A 17 30.320 -32.994 -4.941 1.00 43.55 H new ATOM 0 HZ3 LYS A 17 28.698 -32.886 -5.432 1.00 43.55 H new ATOM 249 N VAL A 18 28.625 -27.326 -9.772 1.00 20.23 N ATOM 250 CA VAL A 18 27.352 -26.957 -10.378 1.00 15.31 C ATOM 251 C VAL A 18 27.216 -27.549 -11.776 1.00 71.10 C ATOM 252 O VAL A 18 26.550 -26.979 -12.640 1.00 20.12 O ATOM 253 CB VAL A 18 27.193 -25.427 -10.463 1.00 2.01 C ATOM 254 CG1 VAL A 18 26.936 -24.839 -9.084 1.00 24.13 C ATOM 255 CG2 VAL A 18 28.424 -24.799 -11.098 1.00 43.14 C ATOM 0 H VAL A 18 29.441 -26.900 -10.212 1.00 20.23 H new ATOM 0 HA VAL A 18 26.568 -27.362 -9.738 1.00 15.31 H new ATOM 0 HB VAL A 18 26.332 -25.203 -11.093 1.00 2.01 H new ATOM 0 HG11 VAL A 18 26.826 -23.757 -9.164 1.00 24.13 H new ATOM 0 HG12 VAL A 18 26.023 -25.267 -8.671 1.00 24.13 H new ATOM 0 HG13 VAL A 18 27.775 -25.071 -8.427 1.00 24.13 H new ATOM 0 HG21 VAL A 18 28.295 -23.718 -11.150 1.00 43.14 H new ATOM 0 HG22 VAL A 18 29.302 -25.031 -10.496 1.00 43.14 H new ATOM 0 HG23 VAL A 18 28.558 -25.198 -12.104 1.00 43.14 H new ATOM 265 N GLN A 19 27.852 -28.696 -11.991 1.00 35.53 N ATOM 266 CA GLN A 19 27.802 -29.366 -13.285 1.00 33.30 C ATOM 267 C GLN A 19 27.105 -30.718 -13.172 1.00 31.22 C ATOM 268 O GLN A 19 27.733 -31.766 -13.317 1.00 43.21 O ATOM 269 CB GLN A 19 29.214 -29.552 -13.841 1.00 63.24 C ATOM 270 CG GLN A 19 30.197 -30.119 -12.829 1.00 41.34 C ATOM 271 CD GLN A 19 31.430 -30.712 -13.482 1.00 71.22 C ATOM 272 OE1 GLN A 19 32.241 -29.996 -14.070 1.00 22.03 O ATOM 273 NE2 GLN A 19 31.577 -32.028 -13.383 1.00 25.15 N ATOM 0 H GLN A 19 28.408 -29.181 -11.286 1.00 35.53 H new ATOM 0 HA GLN A 19 27.229 -28.739 -13.968 1.00 33.30 H new ATOM 0 HB2 GLN A 19 29.171 -30.216 -14.704 1.00 63.24 H new ATOM 0 HB3 GLN A 19 29.585 -28.591 -14.196 1.00 63.24 H new ATOM 0 HG2 GLN A 19 30.499 -29.330 -12.140 1.00 41.34 H new ATOM 0 HG3 GLN A 19 29.700 -30.887 -12.236 1.00 41.34 H new ATOM 0 HE21 GLN A 19 30.880 -32.583 -12.886 1.00 25.15 H new ATOM 0 HE22 GLN A 19 32.387 -32.484 -13.804 1.00 25.15 H new ATOM 282 N GLY A 20 25.801 -30.687 -12.911 1.00 4.21 N ATOM 283 CA GLY A 20 25.041 -31.916 -12.782 1.00 71.11 C ATOM 284 C GLY A 20 24.607 -32.182 -11.354 1.00 73.34 C ATOM 285 O GLY A 20 25.068 -33.134 -10.725 1.00 23.05 O ATOM 0 H GLY A 20 25.258 -29.832 -12.787 1.00 4.21 H new ATOM 0 HA2 GLY A 20 24.160 -31.864 -13.422 1.00 71.11 H new ATOM 0 HA3 GLY A 20 25.644 -32.752 -13.137 1.00 71.11 H new ATOM 289 N VAL A 21 23.717 -31.338 -10.841 1.00 21.51 N ATOM 290 CA VAL A 21 23.221 -31.487 -9.478 1.00 52.20 C ATOM 291 C VAL A 21 21.756 -31.077 -9.379 1.00 53.11 C ATOM 292 O VAL A 21 21.174 -30.576 -10.341 1.00 53.34 O ATOM 293 CB VAL A 21 24.046 -30.646 -8.486 1.00 31.14 C ATOM 294 CG1 VAL A 21 25.493 -31.114 -8.463 1.00 71.22 C ATOM 295 CG2 VAL A 21 23.960 -29.169 -8.839 1.00 61.14 C ATOM 0 H VAL A 21 23.325 -30.545 -11.348 1.00 21.51 H new ATOM 0 HA VAL A 21 23.319 -32.541 -9.219 1.00 52.20 H new ATOM 0 HB VAL A 21 23.630 -30.782 -7.488 1.00 31.14 H new ATOM 0 HG11 VAL A 21 26.060 -30.508 -7.756 1.00 71.22 H new ATOM 0 HG12 VAL A 21 25.532 -32.160 -8.158 1.00 71.22 H new ATOM 0 HG13 VAL A 21 25.925 -31.010 -9.458 1.00 71.22 H new ATOM 0 HG21 VAL A 21 24.549 -28.590 -8.128 1.00 61.14 H new ATOM 0 HG22 VAL A 21 24.349 -29.012 -9.845 1.00 61.14 H new ATOM 0 HG23 VAL A 21 22.920 -28.845 -8.798 1.00 61.14 H new ATOM 305 N PHE A 22 21.164 -31.293 -8.209 1.00 4.33 N ATOM 306 CA PHE A 22 19.766 -30.946 -7.983 1.00 70.13 C ATOM 307 C PHE A 22 19.633 -29.499 -7.517 1.00 74.30 C ATOM 308 O PHE A 22 19.018 -29.221 -6.487 1.00 23.31 O ATOM 309 CB PHE A 22 19.146 -31.887 -6.948 1.00 11.31 C ATOM 310 CG PHE A 22 18.937 -33.284 -7.457 1.00 34.21 C ATOM 311 CD1 PHE A 22 17.815 -33.603 -8.205 1.00 14.53 C ATOM 312 CD2 PHE A 22 19.862 -34.280 -7.187 1.00 51.30 C ATOM 313 CE1 PHE A 22 17.619 -34.888 -8.675 1.00 1.50 C ATOM 314 CE2 PHE A 22 19.672 -35.566 -7.655 1.00 30.21 C ATOM 315 CZ PHE A 22 18.549 -35.871 -8.399 1.00 13.23 C ATOM 0 H PHE A 22 21.631 -31.707 -7.402 1.00 4.33 H new ATOM 0 HA PHE A 22 19.233 -31.055 -8.928 1.00 70.13 H new ATOM 0 HB2 PHE A 22 19.789 -31.922 -6.069 1.00 11.31 H new ATOM 0 HB3 PHE A 22 18.188 -31.479 -6.626 1.00 11.31 H new ATOM 0 HD1 PHE A 22 17.085 -32.838 -8.423 1.00 14.53 H new ATOM 0 HD2 PHE A 22 20.741 -34.048 -6.604 1.00 51.30 H new ATOM 0 HE1 PHE A 22 16.740 -35.123 -9.257 1.00 1.50 H new ATOM 0 HE2 PHE A 22 20.401 -36.333 -7.439 1.00 30.21 H new ATOM 0 HZ PHE A 22 18.398 -36.876 -8.764 1.00 13.23 H new ATOM 325 N PHE A 23 20.213 -28.581 -8.283 1.00 21.32 N ATOM 326 CA PHE A 23 20.161 -27.163 -7.948 1.00 41.14 C ATOM 327 C PHE A 23 19.026 -26.469 -8.696 1.00 31.23 C ATOM 328 O PHE A 23 18.377 -25.569 -8.163 1.00 41.41 O ATOM 329 CB PHE A 23 21.494 -26.489 -8.283 1.00 34.20 C ATOM 330 CG PHE A 23 21.493 -25.007 -8.041 1.00 2.21 C ATOM 331 CD1 PHE A 23 21.421 -24.502 -6.753 1.00 13.22 C ATOM 332 CD2 PHE A 23 21.565 -24.118 -9.102 1.00 32.42 C ATOM 333 CE1 PHE A 23 21.421 -23.138 -6.526 1.00 74.25 C ATOM 334 CE2 PHE A 23 21.565 -22.754 -8.882 1.00 5.13 C ATOM 335 CZ PHE A 23 21.492 -22.263 -7.593 1.00 20.24 C ATOM 0 H PHE A 23 20.724 -28.794 -9.140 1.00 21.32 H new ATOM 0 HA PHE A 23 19.975 -27.075 -6.878 1.00 41.14 H new ATOM 0 HB2 PHE A 23 22.283 -26.946 -7.686 1.00 34.20 H new ATOM 0 HB3 PHE A 23 21.735 -26.678 -9.329 1.00 34.20 H new ATOM 0 HD1 PHE A 23 21.364 -25.182 -5.916 1.00 13.22 H new ATOM 0 HD2 PHE A 23 21.622 -24.496 -10.112 1.00 32.42 H new ATOM 0 HE1 PHE A 23 21.366 -22.757 -5.517 1.00 74.25 H new ATOM 0 HE2 PHE A 23 21.622 -22.072 -9.717 1.00 5.13 H new ATOM 0 HZ PHE A 23 21.490 -21.197 -7.419 1.00 20.24 H new ATOM 345 N ARG A 24 18.793 -26.895 -9.933 1.00 33.02 N ATOM 346 CA ARG A 24 17.738 -26.314 -10.755 1.00 33.44 C ATOM 347 C ARG A 24 16.404 -26.323 -10.013 1.00 41.01 C ATOM 348 O ARG A 24 15.555 -25.458 -10.229 1.00 43.33 O ATOM 349 CB ARG A 24 17.606 -27.082 -12.071 1.00 64.41 C ATOM 350 CG ARG A 24 16.957 -28.448 -11.917 1.00 51.04 C ATOM 351 CD ARG A 24 16.953 -29.214 -13.231 1.00 21.10 C ATOM 352 NE ARG A 24 16.080 -30.384 -13.180 1.00 2.21 N ATOM 353 CZ ARG A 24 15.793 -31.134 -14.238 1.00 45.42 C ATOM 354 NH1 ARG A 24 16.308 -30.838 -15.424 1.00 2.54 N ATOM 355 NH2 ARG A 24 14.991 -32.183 -14.112 1.00 13.42 N ATOM 0 H ARG A 24 19.320 -27.640 -10.388 1.00 33.02 H new ATOM 0 HA ARG A 24 18.008 -25.280 -10.971 1.00 33.44 H new ATOM 0 HB2 ARG A 24 17.020 -26.487 -12.771 1.00 64.41 H new ATOM 0 HB3 ARG A 24 18.596 -27.207 -12.510 1.00 64.41 H new ATOM 0 HG2 ARG A 24 17.492 -29.023 -11.161 1.00 51.04 H new ATOM 0 HG3 ARG A 24 15.934 -28.328 -11.561 1.00 51.04 H new ATOM 0 HD2 ARG A 24 16.627 -28.554 -14.035 1.00 21.10 H new ATOM 0 HD3 ARG A 24 17.969 -29.530 -13.470 1.00 21.10 H new ATOM 0 HE ARG A 24 15.668 -30.639 -12.282 1.00 2.21 H new ATOM 0 HH11 ARG A 24 16.926 -30.033 -15.525 1.00 2.54 H new ATOM 0 HH12 ARG A 24 16.086 -31.416 -16.235 1.00 2.54 H new ATOM 0 HH21 ARG A 24 14.594 -32.415 -13.202 1.00 13.42 H new ATOM 0 HH22 ARG A 24 14.772 -32.758 -14.926 1.00 13.42 H new ATOM 369 N LYS A 25 16.226 -27.307 -9.138 1.00 50.11 N ATOM 370 CA LYS A 25 14.997 -27.429 -8.363 1.00 72.23 C ATOM 371 C LYS A 25 15.009 -26.478 -7.171 1.00 34.44 C ATOM 372 O LYS A 25 14.058 -25.726 -6.955 1.00 3.43 O ATOM 373 CB LYS A 25 14.816 -28.870 -7.879 1.00 41.41 C ATOM 374 CG LYS A 25 13.370 -29.241 -7.600 1.00 11.52 C ATOM 375 CD LYS A 25 13.271 -30.434 -6.665 1.00 70.40 C ATOM 376 CE LYS A 25 13.489 -31.744 -7.408 1.00 4.51 C ATOM 377 NZ LYS A 25 12.268 -32.175 -8.143 1.00 0.24 N ATOM 0 H LYS A 25 16.918 -28.032 -8.948 1.00 50.11 H new ATOM 0 HA LYS A 25 14.161 -27.162 -9.009 1.00 72.23 H new ATOM 0 HB2 LYS A 25 15.218 -29.550 -8.630 1.00 41.41 H new ATOM 0 HB3 LYS A 25 15.401 -29.016 -6.971 1.00 41.41 H new ATOM 0 HG2 LYS A 25 12.853 -28.388 -7.159 1.00 11.52 H new ATOM 0 HG3 LYS A 25 12.865 -29.470 -8.538 1.00 11.52 H new ATOM 0 HD2 LYS A 25 14.011 -30.337 -5.871 1.00 70.40 H new ATOM 0 HD3 LYS A 25 12.291 -30.444 -6.188 1.00 70.40 H new ATOM 0 HE2 LYS A 25 14.314 -31.630 -8.111 1.00 4.51 H new ATOM 0 HE3 LYS A 25 13.779 -32.520 -6.699 1.00 4.51 H new ATOM 0 HZ1 LYS A 25 12.458 -33.071 -8.636 1.00 0.24 H new ATOM 0 HZ2 LYS A 25 11.487 -32.309 -7.470 1.00 0.24 H new ATOM 0 HZ3 LYS A 25 12.006 -31.447 -8.838 1.00 0.24 H new ATOM 391 N HIS A 26 16.091 -26.517 -6.400 1.00 13.25 N ATOM 392 CA HIS A 26 16.227 -25.657 -5.229 1.00 54.45 C ATOM 393 C HIS A 26 16.082 -24.188 -5.615 1.00 54.44 C ATOM 394 O HIS A 26 15.684 -23.356 -4.799 1.00 1.04 O ATOM 395 CB HIS A 26 17.579 -25.888 -4.555 1.00 0.43 C ATOM 396 CG HIS A 26 17.595 -27.069 -3.634 1.00 62.14 C ATOM 397 ND1 HIS A 26 17.981 -28.331 -4.036 1.00 10.42 N ATOM 398 CD2 HIS A 26 17.272 -27.175 -2.324 1.00 72.33 C ATOM 399 CE1 HIS A 26 17.892 -29.162 -3.013 1.00 64.00 C ATOM 400 NE2 HIS A 26 17.465 -28.486 -1.962 1.00 52.31 N ATOM 0 H HIS A 26 16.886 -27.134 -6.565 1.00 13.25 H new ATOM 0 HA HIS A 26 15.432 -25.911 -4.528 1.00 54.45 H new ATOM 0 HB2 HIS A 26 18.340 -26.026 -5.323 1.00 0.43 H new ATOM 0 HB3 HIS A 26 17.853 -24.995 -3.993 1.00 0.43 H new ATOM 0 HD1 HIS A 26 18.287 -28.583 -4.976 1.00 10.42 H new ATOM 0 HD2 HIS A 26 16.927 -26.377 -1.683 1.00 72.33 H new ATOM 0 HE1 HIS A 26 18.128 -30.216 -3.033 1.00 64.00 H new ATOM 408 N THR A 27 16.407 -23.874 -6.866 1.00 24.14 N ATOM 409 CA THR A 27 16.315 -22.506 -7.359 1.00 45.12 C ATOM 410 C THR A 27 14.864 -22.101 -7.590 1.00 21.00 C ATOM 411 O THR A 27 14.416 -21.063 -7.105 1.00 11.41 O ATOM 412 CB THR A 27 17.101 -22.328 -8.672 1.00 60.42 C ATOM 413 OG1 THR A 27 18.474 -22.682 -8.473 1.00 43.01 O ATOM 414 CG2 THR A 27 17.008 -20.893 -9.169 1.00 23.45 C ATOM 0 H THR A 27 16.736 -24.549 -7.556 1.00 24.14 H new ATOM 0 HA THR A 27 16.751 -21.864 -6.593 1.00 45.12 H new ATOM 0 HB THR A 27 16.663 -22.984 -9.424 1.00 60.42 H new ATOM 0 HG1 THR A 27 18.548 -23.652 -8.355 1.00 43.01 H new ATOM 0 HG21 THR A 27 17.571 -20.792 -10.097 1.00 23.45 H new ATOM 0 HG22 THR A 27 15.964 -20.637 -9.348 1.00 23.45 H new ATOM 0 HG23 THR A 27 17.423 -20.220 -8.418 1.00 23.45 H new ATOM 422 N GLN A 28 14.135 -22.928 -8.332 1.00 52.35 N ATOM 423 CA GLN A 28 12.733 -22.654 -8.627 1.00 22.22 C ATOM 424 C GLN A 28 11.943 -22.419 -7.344 1.00 3.24 C ATOM 425 O GLN A 28 11.260 -21.405 -7.201 1.00 20.30 O ATOM 426 CB GLN A 28 12.119 -23.815 -9.412 1.00 2.40 C ATOM 427 CG GLN A 28 10.613 -23.702 -9.586 1.00 22.23 C ATOM 428 CD GLN A 28 10.020 -24.889 -10.319 1.00 21.33 C ATOM 429 OE1 GLN A 28 9.747 -24.820 -11.517 1.00 71.14 O ATOM 430 NE2 GLN A 28 9.818 -25.988 -9.601 1.00 13.12 N ATOM 0 H GLN A 28 14.491 -23.793 -8.740 1.00 52.35 H new ATOM 0 HA GLN A 28 12.685 -21.749 -9.233 1.00 22.22 H new ATOM 0 HB2 GLN A 28 12.587 -23.866 -10.395 1.00 2.40 H new ATOM 0 HB3 GLN A 28 12.348 -24.750 -8.901 1.00 2.40 H new ATOM 0 HG2 GLN A 28 10.143 -23.613 -8.606 1.00 22.23 H new ATOM 0 HG3 GLN A 28 10.382 -22.789 -10.134 1.00 22.23 H new ATOM 0 HE21 GLN A 28 10.059 -26.001 -8.610 1.00 13.12 H new ATOM 0 HE22 GLN A 28 9.422 -26.819 -10.041 1.00 13.12 H new ATOM 439 N ALA A 29 12.042 -23.362 -6.413 1.00 32.05 N ATOM 440 CA ALA A 29 11.338 -23.256 -5.141 1.00 31.25 C ATOM 441 C ALA A 29 11.694 -21.959 -4.422 1.00 70.13 C ATOM 442 O ALA A 29 10.867 -21.383 -3.717 1.00 32.14 O ATOM 443 CB ALA A 29 11.658 -24.455 -4.259 1.00 55.33 C ATOM 0 H ALA A 29 12.603 -24.208 -6.516 1.00 32.05 H new ATOM 0 HA ALA A 29 10.268 -23.245 -5.347 1.00 31.25 H new ATOM 0 HB1 ALA A 29 11.126 -24.363 -3.312 1.00 55.33 H new ATOM 0 HB2 ALA A 29 11.347 -25.370 -4.762 1.00 55.33 H new ATOM 0 HB3 ALA A 29 12.731 -24.492 -4.070 1.00 55.33 H new ATOM 449 N GLU A 30 12.930 -21.506 -4.607 1.00 1.13 N ATOM 450 CA GLU A 30 13.395 -20.277 -3.974 1.00 53.01 C ATOM 451 C GLU A 30 12.835 -19.051 -4.690 1.00 62.13 C ATOM 452 O GLU A 30 12.465 -18.064 -4.057 1.00 5.51 O ATOM 453 CB GLU A 30 14.924 -20.226 -3.971 1.00 10.53 C ATOM 454 CG GLU A 30 15.505 -19.463 -2.792 1.00 13.21 C ATOM 455 CD GLU A 30 16.876 -19.969 -2.388 1.00 33.23 C ATOM 456 OE1 GLU A 30 17.875 -19.520 -2.986 1.00 40.04 O ATOM 457 OE2 GLU A 30 16.949 -20.815 -1.472 1.00 35.04 O ATOM 0 H GLU A 30 13.627 -21.971 -5.189 1.00 1.13 H new ATOM 0 HA GLU A 30 13.037 -20.270 -2.945 1.00 53.01 H new ATOM 0 HB2 GLU A 30 15.313 -21.244 -3.961 1.00 10.53 H new ATOM 0 HB3 GLU A 30 15.266 -19.763 -4.897 1.00 10.53 H new ATOM 0 HG2 GLU A 30 15.573 -18.405 -3.046 1.00 13.21 H new ATOM 0 HG3 GLU A 30 14.827 -19.544 -1.942 1.00 13.21 H new ATOM 464 N GLY A 31 12.777 -19.123 -6.017 1.00 22.02 N ATOM 465 CA GLY A 31 12.263 -18.013 -6.798 1.00 72.50 C ATOM 466 C GLY A 31 10.843 -17.644 -6.416 1.00 21.30 C ATOM 467 O GLY A 31 10.389 -16.531 -6.683 1.00 64.40 O ATOM 0 H GLY A 31 13.077 -19.930 -6.564 1.00 22.02 H new ATOM 0 HA2 GLY A 31 12.910 -17.146 -6.661 1.00 72.50 H new ATOM 0 HA3 GLY A 31 12.296 -18.271 -7.856 1.00 72.50 H new ATOM 471 N LYS A 32 10.138 -18.581 -5.790 1.00 41.33 N ATOM 472 CA LYS A 32 8.761 -18.350 -5.371 1.00 11.33 C ATOM 473 C LYS A 32 8.715 -17.631 -4.026 1.00 41.42 C ATOM 474 O LYS A 32 7.751 -16.930 -3.718 1.00 32.15 O ATOM 475 CB LYS A 32 8.005 -19.677 -5.277 1.00 61.10 C ATOM 476 CG LYS A 32 6.500 -19.531 -5.418 1.00 32.21 C ATOM 477 CD LYS A 32 5.847 -20.845 -5.811 1.00 74.44 C ATOM 478 CE LYS A 32 5.731 -21.788 -4.623 1.00 73.03 C ATOM 479 NZ LYS A 32 4.570 -21.446 -3.755 1.00 43.00 N ATOM 0 H LYS A 32 10.498 -19.508 -5.562 1.00 41.33 H new ATOM 0 HA LYS A 32 8.282 -17.718 -6.118 1.00 11.33 H new ATOM 0 HB2 LYS A 32 8.371 -20.350 -6.053 1.00 61.10 H new ATOM 0 HB3 LYS A 32 8.228 -20.145 -4.318 1.00 61.10 H new ATOM 0 HG2 LYS A 32 6.078 -19.181 -4.476 1.00 32.21 H new ATOM 0 HG3 LYS A 32 6.276 -18.773 -6.169 1.00 32.21 H new ATOM 0 HD2 LYS A 32 4.856 -20.651 -6.221 1.00 74.44 H new ATOM 0 HD3 LYS A 32 6.431 -21.321 -6.599 1.00 74.44 H new ATOM 0 HE2 LYS A 32 5.628 -22.812 -4.981 1.00 73.03 H new ATOM 0 HE3 LYS A 32 6.648 -21.747 -4.036 1.00 73.03 H new ATOM 0 HZ1 LYS A 32 4.525 -22.111 -2.957 1.00 43.00 H new ATOM 0 HZ2 LYS A 32 4.681 -20.478 -3.393 1.00 43.00 H new ATOM 0 HZ3 LYS A 32 3.692 -21.510 -4.309 1.00 43.00 H new ATOM 493 N LYS A 33 9.764 -17.807 -3.230 1.00 41.01 N ATOM 494 CA LYS A 33 9.846 -17.173 -1.920 1.00 32.15 C ATOM 495 C LYS A 33 9.731 -15.657 -2.040 1.00 44.25 C ATOM 496 O LYS A 33 8.746 -15.061 -1.602 1.00 63.30 O ATOM 497 CB LYS A 33 11.162 -17.543 -1.233 1.00 3.35 C ATOM 498 CG LYS A 33 11.129 -17.373 0.277 1.00 64.55 C ATOM 499 CD LYS A 33 12.485 -17.661 0.900 1.00 60.43 C ATOM 500 CE LYS A 33 13.480 -16.549 0.607 1.00 24.13 C ATOM 501 NZ LYS A 33 14.598 -16.532 1.591 1.00 23.40 N ATOM 0 H LYS A 33 10.570 -18.384 -3.470 1.00 41.01 H new ATOM 0 HA LYS A 33 9.014 -17.535 -1.316 1.00 32.15 H new ATOM 0 HB2 LYS A 33 11.406 -18.579 -1.468 1.00 3.35 H new ATOM 0 HB3 LYS A 33 11.962 -16.926 -1.642 1.00 3.35 H new ATOM 0 HG2 LYS A 33 10.823 -16.356 0.523 1.00 64.55 H new ATOM 0 HG3 LYS A 33 10.382 -18.043 0.703 1.00 64.55 H new ATOM 0 HD2 LYS A 33 12.374 -17.777 1.978 1.00 60.43 H new ATOM 0 HD3 LYS A 33 12.870 -18.606 0.516 1.00 60.43 H new ATOM 0 HE2 LYS A 33 13.882 -16.677 -0.398 1.00 24.13 H new ATOM 0 HE3 LYS A 33 12.966 -15.588 0.624 1.00 24.13 H new ATOM 0 HZ1 LYS A 33 15.108 -15.629 1.521 1.00 23.40 H new ATOM 0 HZ2 LYS A 33 14.216 -16.640 2.552 1.00 23.40 H new ATOM 0 HZ3 LYS A 33 15.251 -17.315 1.388 1.00 23.40 H new ATOM 515 N LEU A 34 10.743 -15.038 -2.639 1.00 2.25 N ATOM 516 CA LEU A 34 10.755 -13.590 -2.819 1.00 24.22 C ATOM 517 C LEU A 34 9.675 -13.155 -3.804 1.00 43.00 C ATOM 518 O LEU A 34 9.053 -12.107 -3.636 1.00 22.12 O ATOM 519 CB LEU A 34 12.128 -13.130 -3.313 1.00 11.52 C ATOM 520 CG LEU A 34 13.146 -12.771 -2.229 1.00 54.14 C ATOM 521 CD1 LEU A 34 12.623 -11.638 -1.360 1.00 51.10 C ATOM 522 CD2 LEU A 34 13.472 -13.990 -1.380 1.00 23.51 C ATOM 0 H LEU A 34 11.565 -15.516 -3.008 1.00 2.25 H new ATOM 0 HA LEU A 34 10.548 -13.126 -1.854 1.00 24.22 H new ATOM 0 HB2 LEU A 34 12.552 -13.919 -3.934 1.00 11.52 H new ATOM 0 HB3 LEU A 34 11.988 -12.260 -3.955 1.00 11.52 H new ATOM 0 HG LEU A 34 14.062 -12.435 -2.714 1.00 54.14 H new ATOM 0 HD11 LEU A 34 13.360 -11.396 -0.595 1.00 51.10 H new ATOM 0 HD12 LEU A 34 12.441 -10.759 -1.979 1.00 51.10 H new ATOM 0 HD13 LEU A 34 11.692 -11.945 -0.883 1.00 51.10 H new ATOM 0 HD21 LEU A 34 14.198 -13.716 -0.614 1.00 23.51 H new ATOM 0 HD22 LEU A 34 12.562 -14.356 -0.904 1.00 23.51 H new ATOM 0 HD23 LEU A 34 13.890 -14.773 -2.013 1.00 23.51 H new ATOM 534 N GLY A 35 9.457 -13.969 -4.832 1.00 75.03 N ATOM 535 CA GLY A 35 8.450 -13.652 -5.828 1.00 73.02 C ATOM 536 C GLY A 35 9.044 -13.030 -7.076 1.00 62.33 C ATOM 537 O GLY A 35 8.883 -11.834 -7.320 1.00 53.23 O ATOM 0 H GLY A 35 9.959 -14.842 -4.993 1.00 75.03 H new ATOM 0 HA2 GLY A 35 7.913 -14.561 -6.099 1.00 73.02 H new ATOM 0 HA3 GLY A 35 7.720 -12.967 -5.397 1.00 73.02 H new ATOM 541 N LEU A 36 9.735 -13.843 -7.868 1.00 43.42 N ATOM 542 CA LEU A 36 10.358 -13.365 -9.098 1.00 22.11 C ATOM 543 C LEU A 36 10.046 -14.297 -10.264 1.00 60.41 C ATOM 544 O LEU A 36 9.280 -15.250 -10.123 1.00 33.52 O ATOM 545 CB LEU A 36 11.872 -13.249 -8.914 1.00 43.11 C ATOM 546 CG LEU A 36 12.344 -12.294 -7.817 1.00 30.12 C ATOM 547 CD1 LEU A 36 13.863 -12.215 -7.794 1.00 74.52 C ATOM 548 CD2 LEU A 36 11.739 -10.912 -8.016 1.00 44.04 C ATOM 0 H LEU A 36 9.878 -14.835 -7.681 1.00 43.42 H new ATOM 0 HA LEU A 36 9.949 -12.380 -9.325 1.00 22.11 H new ATOM 0 HB2 LEU A 36 12.269 -14.241 -8.699 1.00 43.11 H new ATOM 0 HB3 LEU A 36 12.309 -12.929 -9.860 1.00 43.11 H new ATOM 0 HG LEU A 36 12.007 -12.681 -6.856 1.00 30.12 H new ATOM 0 HD11 LEU A 36 14.180 -11.531 -7.007 1.00 74.52 H new ATOM 0 HD12 LEU A 36 14.276 -13.205 -7.602 1.00 74.52 H new ATOM 0 HD13 LEU A 36 14.223 -11.852 -8.757 1.00 74.52 H new ATOM 0 HD21 LEU A 36 12.086 -10.246 -7.226 1.00 44.04 H new ATOM 0 HD22 LEU A 36 12.045 -10.517 -8.985 1.00 44.04 H new ATOM 0 HD23 LEU A 36 10.652 -10.982 -7.980 1.00 44.04 H new ATOM 560 N VAL A 37 10.647 -14.017 -11.416 1.00 74.03 N ATOM 561 CA VAL A 37 10.436 -14.832 -12.607 1.00 34.24 C ATOM 562 C VAL A 37 11.735 -15.019 -13.382 1.00 53.44 C ATOM 563 O VAL A 37 12.761 -14.430 -13.046 1.00 10.32 O ATOM 564 CB VAL A 37 9.380 -14.205 -13.537 1.00 5.32 C ATOM 565 CG1 VAL A 37 8.054 -14.047 -12.810 1.00 12.42 C ATOM 566 CG2 VAL A 37 9.869 -12.866 -14.069 1.00 71.03 C ATOM 0 H VAL A 37 11.284 -13.232 -11.550 1.00 74.03 H new ATOM 0 HA VAL A 37 10.077 -15.803 -12.266 1.00 34.24 H new ATOM 0 HB VAL A 37 9.224 -14.873 -14.384 1.00 5.32 H new ATOM 0 HG11 VAL A 37 7.321 -13.603 -13.483 1.00 12.42 H new ATOM 0 HG12 VAL A 37 7.700 -15.024 -12.482 1.00 12.42 H new ATOM 0 HG13 VAL A 37 8.189 -13.401 -11.943 1.00 12.42 H new ATOM 0 HG21 VAL A 37 9.111 -12.436 -14.724 1.00 71.03 H new ATOM 0 HG22 VAL A 37 10.054 -12.189 -13.235 1.00 71.03 H new ATOM 0 HG23 VAL A 37 10.793 -13.012 -14.629 1.00 71.03 H new ATOM 576 N GLY A 38 11.682 -15.843 -14.425 1.00 3.24 N ATOM 577 CA GLY A 38 12.861 -16.092 -15.233 1.00 24.20 C ATOM 578 C GLY A 38 12.936 -17.525 -15.723 1.00 52.54 C ATOM 579 O GLY A 38 11.928 -18.100 -16.134 1.00 50.11 O ATOM 0 H GLY A 38 10.844 -16.342 -14.724 1.00 3.24 H new ATOM 0 HA2 GLY A 38 12.860 -15.418 -16.090 1.00 24.20 H new ATOM 0 HA3 GLY A 38 13.753 -15.864 -14.649 1.00 24.20 H new ATOM 583 N TRP A 39 14.132 -18.101 -15.682 1.00 54.44 N ATOM 584 CA TRP A 39 14.334 -19.475 -16.128 1.00 55.31 C ATOM 585 C TRP A 39 15.758 -19.936 -15.841 1.00 30.42 C ATOM 586 O TRP A 39 16.716 -19.193 -16.051 1.00 43.22 O ATOM 587 CB TRP A 39 14.037 -19.596 -17.624 1.00 34.34 C ATOM 588 CG TRP A 39 15.045 -18.902 -18.488 1.00 22.02 C ATOM 589 CD1 TRP A 39 16.247 -19.399 -18.906 1.00 55.03 C ATOM 590 CD2 TRP A 39 14.941 -17.584 -19.037 1.00 73.12 C ATOM 591 NE1 TRP A 39 16.895 -18.469 -19.683 1.00 21.23 N ATOM 592 CE2 TRP A 39 16.115 -17.348 -19.779 1.00 54.40 C ATOM 593 CE3 TRP A 39 13.969 -16.582 -18.977 1.00 1.44 C ATOM 594 CZ2 TRP A 39 16.341 -16.150 -20.452 1.00 72.13 C ATOM 595 CZ3 TRP A 39 14.195 -15.393 -19.645 1.00 62.51 C ATOM 596 CH2 TRP A 39 15.373 -15.186 -20.376 1.00 12.03 C ATOM 0 H TRP A 39 14.976 -17.638 -15.345 1.00 54.44 H new ATOM 0 HA TRP A 39 13.646 -20.115 -15.575 1.00 55.31 H new ATOM 0 HB2 TRP A 39 14.001 -20.651 -17.896 1.00 34.34 H new ATOM 0 HB3 TRP A 39 13.049 -19.181 -17.826 1.00 34.34 H new ATOM 0 HD1 TRP A 39 16.631 -20.378 -18.662 1.00 55.03 H new ATOM 0 HE1 TRP A 39 17.809 -18.594 -20.118 1.00 21.23 H new ATOM 0 HE3 TRP A 39 13.057 -16.734 -18.419 1.00 1.44 H new ATOM 0 HZ2 TRP A 39 17.249 -15.987 -21.014 1.00 72.13 H new ATOM 0 HZ3 TRP A 39 13.452 -14.611 -19.603 1.00 62.51 H new ATOM 0 HH2 TRP A 39 15.519 -14.247 -20.889 1.00 12.03 H new ATOM 607 N VAL A 40 15.891 -21.168 -15.359 1.00 74.21 N ATOM 608 CA VAL A 40 17.199 -21.729 -15.044 1.00 70.24 C ATOM 609 C VAL A 40 17.640 -22.727 -16.110 1.00 12.15 C ATOM 610 O VAL A 40 16.883 -23.621 -16.487 1.00 53.43 O ATOM 611 CB VAL A 40 17.194 -22.429 -13.672 1.00 44.41 C ATOM 612 CG1 VAL A 40 18.605 -22.839 -13.277 1.00 12.10 C ATOM 613 CG2 VAL A 40 16.578 -21.524 -12.616 1.00 33.32 C ATOM 0 H VAL A 40 15.108 -21.796 -15.178 1.00 74.21 H new ATOM 0 HA VAL A 40 17.902 -20.897 -15.016 1.00 70.24 H new ATOM 0 HB VAL A 40 16.586 -23.331 -13.745 1.00 44.41 H new ATOM 0 HG11 VAL A 40 18.582 -23.332 -12.305 1.00 12.10 H new ATOM 0 HG12 VAL A 40 19.007 -23.525 -14.023 1.00 12.10 H new ATOM 0 HG13 VAL A 40 19.239 -21.954 -13.220 1.00 12.10 H new ATOM 0 HG21 VAL A 40 16.582 -22.034 -11.653 1.00 33.32 H new ATOM 0 HG22 VAL A 40 17.158 -20.604 -12.542 1.00 33.32 H new ATOM 0 HG23 VAL A 40 15.552 -21.285 -12.895 1.00 33.32 H new ATOM 623 N GLN A 41 18.869 -22.568 -16.589 1.00 41.41 N ATOM 624 CA GLN A 41 19.411 -23.455 -17.612 1.00 34.15 C ATOM 625 C GLN A 41 20.825 -23.900 -17.253 1.00 53.40 C ATOM 626 O GLN A 41 21.532 -23.215 -16.515 1.00 64.42 O ATOM 627 CB GLN A 41 19.412 -22.758 -18.973 1.00 41.01 C ATOM 628 CG GLN A 41 19.308 -23.717 -20.148 1.00 33.22 C ATOM 629 CD GLN A 41 19.986 -23.188 -21.396 1.00 3.33 C ATOM 630 OE1 GLN A 41 19.847 -22.014 -21.741 1.00 63.04 O ATOM 631 NE2 GLN A 41 20.726 -24.053 -22.080 1.00 1.52 N ATOM 0 H GLN A 41 19.508 -21.834 -16.286 1.00 41.41 H new ATOM 0 HA GLN A 41 18.775 -24.338 -17.665 1.00 34.15 H new ATOM 0 HB2 GLN A 41 18.579 -22.056 -19.013 1.00 41.01 H new ATOM 0 HB3 GLN A 41 20.327 -22.173 -19.072 1.00 41.01 H new ATOM 0 HG2 GLN A 41 19.756 -24.672 -19.873 1.00 33.22 H new ATOM 0 HG3 GLN A 41 18.257 -23.908 -20.364 1.00 33.22 H new ATOM 0 HE21 GLN A 41 20.813 -25.017 -21.757 1.00 1.52 H new ATOM 0 HE22 GLN A 41 21.207 -23.754 -22.928 1.00 1.52 H new ATOM 640 N ASN A 42 21.230 -25.050 -17.780 1.00 74.54 N ATOM 641 CA ASN A 42 22.559 -25.587 -17.515 1.00 5.00 C ATOM 642 C ASN A 42 23.406 -25.597 -18.785 1.00 14.55 C ATOM 643 O ASN A 42 22.914 -25.907 -19.870 1.00 53.41 O ATOM 644 CB ASN A 42 22.457 -27.004 -16.947 1.00 15.24 C ATOM 645 CG ASN A 42 23.816 -27.614 -16.664 1.00 11.51 C ATOM 646 OD1 ASN A 42 24.503 -28.075 -17.575 1.00 22.20 O ATOM 647 ND2 ASN A 42 24.210 -27.618 -15.396 1.00 0.12 N ATOM 0 H ASN A 42 20.656 -25.629 -18.394 1.00 74.54 H new ATOM 0 HA ASN A 42 23.043 -24.942 -16.781 1.00 5.00 H new ATOM 0 HB2 ASN A 42 21.873 -26.982 -16.027 1.00 15.24 H new ATOM 0 HB3 ASN A 42 21.918 -27.637 -17.652 1.00 15.24 H new ATOM 0 HD21 ASN A 42 25.116 -28.014 -15.145 1.00 0.12 H new ATOM 0 HD22 ASN A 42 23.607 -27.225 -14.673 1.00 0.12 H new ATOM 654 N THR A 43 24.682 -25.255 -18.641 1.00 24.11 N ATOM 655 CA THR A 43 25.597 -25.224 -19.775 1.00 3.41 C ATOM 656 C THR A 43 26.266 -26.578 -19.980 1.00 31.23 C ATOM 657 O THR A 43 26.598 -27.269 -19.016 1.00 60.14 O ATOM 658 CB THR A 43 26.686 -24.150 -19.589 1.00 53.50 C ATOM 659 OG1 THR A 43 27.560 -24.519 -18.517 1.00 43.30 O ATOM 660 CG2 THR A 43 26.063 -22.793 -19.298 1.00 13.34 C ATOM 0 H THR A 43 25.105 -24.996 -17.750 1.00 24.11 H new ATOM 0 HA THR A 43 25.001 -24.979 -20.654 1.00 3.41 H new ATOM 0 HB THR A 43 27.257 -24.079 -20.515 1.00 53.50 H new ATOM 0 HG1 THR A 43 27.044 -24.965 -17.813 1.00 43.30 H new ATOM 0 HG21 THR A 43 26.851 -22.051 -19.170 1.00 13.34 H new ATOM 0 HG22 THR A 43 25.421 -22.502 -20.129 1.00 13.34 H new ATOM 0 HG23 THR A 43 25.470 -22.853 -18.385 1.00 13.34 H new ATOM 668 N ASP A 44 26.461 -26.952 -21.239 1.00 42.24 N ATOM 669 CA ASP A 44 27.092 -28.224 -21.571 1.00 5.04 C ATOM 670 C ASP A 44 28.496 -28.304 -20.979 1.00 22.43 C ATOM 671 O ASP A 44 29.009 -29.393 -20.717 1.00 14.33 O ATOM 672 CB ASP A 44 27.154 -28.408 -23.088 1.00 11.43 C ATOM 673 CG ASP A 44 25.814 -28.802 -23.678 1.00 24.21 C ATOM 674 OD1 ASP A 44 25.010 -29.429 -22.957 1.00 3.32 O ATOM 675 OD2 ASP A 44 25.570 -28.485 -24.861 1.00 65.32 O ATOM 0 H ASP A 44 26.191 -26.392 -22.048 1.00 42.24 H new ATOM 0 HA ASP A 44 26.489 -29.023 -21.141 1.00 5.04 H new ATOM 0 HB2 ASP A 44 27.493 -27.481 -23.550 1.00 11.43 H new ATOM 0 HB3 ASP A 44 27.893 -29.173 -23.329 1.00 11.43 H new ATOM 680 N ARG A 45 29.113 -27.145 -20.772 1.00 31.42 N ATOM 681 CA ARG A 45 30.458 -27.085 -20.213 1.00 42.12 C ATOM 682 C ARG A 45 30.473 -27.594 -18.775 1.00 0.33 C ATOM 683 O ARG A 45 31.325 -28.397 -18.398 1.00 62.24 O ATOM 684 CB ARG A 45 30.990 -25.652 -20.264 1.00 44.40 C ATOM 685 CG ARG A 45 31.226 -25.139 -21.675 1.00 70.04 C ATOM 686 CD ARG A 45 32.488 -25.733 -22.281 1.00 22.35 C ATOM 687 NE ARG A 45 33.673 -24.940 -21.964 1.00 32.22 N ATOM 688 CZ ARG A 45 33.971 -23.792 -22.563 1.00 34.52 C ATOM 689 NH1 ARG A 45 33.174 -23.306 -23.505 1.00 20.25 N ATOM 690 NH2 ARG A 45 35.067 -23.128 -22.219 1.00 71.55 N ATOM 0 H ARG A 45 28.703 -26.235 -20.983 1.00 31.42 H new ATOM 0 HA ARG A 45 31.103 -27.727 -20.813 1.00 42.12 H new ATOM 0 HB2 ARG A 45 30.283 -24.993 -19.761 1.00 44.40 H new ATOM 0 HB3 ARG A 45 31.925 -25.601 -19.707 1.00 44.40 H new ATOM 0 HG2 ARG A 45 30.369 -25.387 -22.301 1.00 70.04 H new ATOM 0 HG3 ARG A 45 31.306 -24.052 -21.659 1.00 70.04 H new ATOM 0 HD2 ARG A 45 32.623 -26.750 -21.913 1.00 22.35 H new ATOM 0 HD3 ARG A 45 32.374 -25.798 -23.363 1.00 22.35 H new ATOM 0 HE ARG A 45 34.306 -25.286 -21.243 1.00 32.22 H new ATOM 0 HH11 ARG A 45 32.330 -23.814 -23.771 1.00 20.25 H new ATOM 0 HH12 ARG A 45 33.405 -22.425 -23.963 1.00 20.25 H new ATOM 0 HH21 ARG A 45 35.682 -23.499 -21.494 1.00 71.55 H new ATOM 0 HH22 ARG A 45 35.295 -22.247 -22.679 1.00 71.55 H new ATOM 704 N GLY A 46 29.523 -27.119 -17.974 1.00 42.14 N ATOM 705 CA GLY A 46 29.446 -27.536 -16.587 1.00 15.04 C ATOM 706 C GLY A 46 28.834 -26.473 -15.695 1.00 64.21 C ATOM 707 O GLY A 46 28.228 -26.785 -14.670 1.00 13.12 O ATOM 0 H GLY A 46 28.806 -26.453 -18.262 1.00 42.14 H new ATOM 0 HA2 GLY A 46 28.854 -28.449 -16.518 1.00 15.04 H new ATOM 0 HA3 GLY A 46 30.446 -27.776 -16.227 1.00 15.04 H new ATOM 711 N THR A 47 28.995 -25.212 -16.084 1.00 61.25 N ATOM 712 CA THR A 47 28.457 -24.099 -15.312 1.00 64.41 C ATOM 713 C THR A 47 26.940 -24.024 -15.439 1.00 62.14 C ATOM 714 O THR A 47 26.331 -24.793 -16.183 1.00 54.10 O ATOM 715 CB THR A 47 29.066 -22.758 -15.761 1.00 41.44 C ATOM 716 OG1 THR A 47 29.315 -22.780 -17.171 1.00 62.44 O ATOM 717 CG2 THR A 47 30.362 -22.475 -15.017 1.00 2.02 C ATOM 0 H THR A 47 29.494 -24.936 -16.930 1.00 61.25 H new ATOM 0 HA THR A 47 28.723 -24.279 -14.270 1.00 64.41 H new ATOM 0 HB THR A 47 28.353 -21.966 -15.530 1.00 41.44 H new ATOM 0 HG1 THR A 47 28.648 -23.346 -17.612 1.00 62.44 H new ATOM 0 HG21 THR A 47 30.773 -21.522 -15.351 1.00 2.02 H new ATOM 0 HG22 THR A 47 30.164 -22.429 -13.946 1.00 2.02 H new ATOM 0 HG23 THR A 47 31.079 -23.271 -15.220 1.00 2.02 H new ATOM 725 N VAL A 48 26.335 -23.092 -14.710 1.00 22.34 N ATOM 726 CA VAL A 48 24.888 -22.915 -14.743 1.00 23.35 C ATOM 727 C VAL A 48 24.518 -21.459 -15.002 1.00 25.31 C ATOM 728 O VAL A 48 24.449 -20.652 -14.075 1.00 74.53 O ATOM 729 CB VAL A 48 24.237 -23.372 -13.424 1.00 11.24 C ATOM 730 CG1 VAL A 48 22.732 -23.154 -13.468 1.00 2.04 C ATOM 731 CG2 VAL A 48 24.565 -24.831 -13.145 1.00 53.00 C ATOM 0 H VAL A 48 26.825 -22.448 -14.089 1.00 22.34 H new ATOM 0 HA VAL A 48 24.512 -23.533 -15.559 1.00 23.35 H new ATOM 0 HB VAL A 48 24.644 -22.771 -12.611 1.00 11.24 H new ATOM 0 HG11 VAL A 48 22.289 -23.483 -12.528 1.00 2.04 H new ATOM 0 HG12 VAL A 48 22.522 -22.095 -13.617 1.00 2.04 H new ATOM 0 HG13 VAL A 48 22.305 -23.728 -14.290 1.00 2.04 H new ATOM 0 HG21 VAL A 48 24.097 -25.137 -12.209 1.00 53.00 H new ATOM 0 HG22 VAL A 48 24.188 -25.451 -13.959 1.00 53.00 H new ATOM 0 HG23 VAL A 48 25.645 -24.953 -13.067 1.00 53.00 H new ATOM 741 N GLN A 49 24.282 -21.131 -16.268 1.00 43.00 N ATOM 742 CA GLN A 49 23.920 -19.771 -16.649 1.00 75.12 C ATOM 743 C GLN A 49 22.407 -19.628 -16.780 1.00 12.42 C ATOM 744 O GLN A 49 21.803 -20.146 -17.718 1.00 33.02 O ATOM 745 CB GLN A 49 24.596 -19.391 -17.968 1.00 14.14 C ATOM 746 CG GLN A 49 26.114 -19.370 -17.889 1.00 74.00 C ATOM 747 CD GLN A 49 26.748 -18.625 -19.047 1.00 73.53 C ATOM 748 OE1 GLN A 49 26.700 -19.078 -20.192 1.00 1.34 O ATOM 749 NE2 GLN A 49 27.346 -17.477 -18.756 1.00 44.52 N ATOM 0 H GLN A 49 24.335 -21.788 -17.047 1.00 43.00 H new ATOM 0 HA GLN A 49 24.265 -19.097 -15.865 1.00 75.12 H new ATOM 0 HB2 GLN A 49 24.290 -20.097 -18.740 1.00 14.14 H new ATOM 0 HB3 GLN A 49 24.243 -18.407 -18.278 1.00 14.14 H new ATOM 0 HG2 GLN A 49 26.419 -18.904 -16.952 1.00 74.00 H new ATOM 0 HG3 GLN A 49 26.487 -20.394 -17.873 1.00 74.00 H new ATOM 0 HE21 GLN A 49 27.362 -17.140 -17.793 1.00 44.52 H new ATOM 0 HE22 GLN A 49 27.790 -16.932 -19.495 1.00 44.52 H new ATOM 758 N GLY A 50 21.800 -18.920 -15.831 1.00 61.15 N ATOM 759 CA GLY A 50 20.363 -18.722 -15.859 1.00 12.40 C ATOM 760 C GLY A 50 19.982 -17.280 -16.130 1.00 13.34 C ATOM 761 O GLY A 50 20.594 -16.617 -16.966 1.00 53.43 O ATOM 0 H GLY A 50 22.278 -18.481 -15.044 1.00 61.15 H new ATOM 0 HA2 GLY A 50 19.926 -19.361 -16.627 1.00 12.40 H new ATOM 0 HA3 GLY A 50 19.938 -19.034 -14.905 1.00 12.40 H new ATOM 765 N GLN A 51 18.967 -16.794 -15.421 1.00 61.53 N ATOM 766 CA GLN A 51 18.504 -15.422 -15.592 1.00 22.32 C ATOM 767 C GLN A 51 17.466 -15.063 -14.534 1.00 52.33 C ATOM 768 O GLN A 51 16.546 -15.836 -14.263 1.00 64.45 O ATOM 769 CB GLN A 51 17.913 -15.231 -16.990 1.00 22.23 C ATOM 770 CG GLN A 51 17.635 -13.778 -17.339 1.00 70.22 C ATOM 771 CD GLN A 51 17.680 -13.518 -18.832 1.00 21.00 C ATOM 772 OE1 GLN A 51 18.372 -14.215 -19.575 1.00 31.13 O ATOM 773 NE2 GLN A 51 16.940 -12.510 -19.280 1.00 64.42 N ATOM 0 H GLN A 51 18.450 -17.330 -14.724 1.00 61.53 H new ATOM 0 HA GLN A 51 19.361 -14.758 -15.474 1.00 22.32 H new ATOM 0 HB2 GLN A 51 18.600 -15.648 -17.726 1.00 22.23 H new ATOM 0 HB3 GLN A 51 16.985 -15.798 -17.064 1.00 22.23 H new ATOM 0 HG2 GLN A 51 16.655 -13.497 -16.954 1.00 70.22 H new ATOM 0 HG3 GLN A 51 18.367 -13.142 -16.841 1.00 70.22 H new ATOM 0 HE21 GLN A 51 16.382 -11.958 -18.629 1.00 64.42 H new ATOM 0 HE22 GLN A 51 16.930 -12.288 -20.275 1.00 64.42 H new ATOM 782 N LEU A 52 17.618 -13.885 -13.939 1.00 44.01 N ATOM 783 CA LEU A 52 16.694 -13.422 -12.910 1.00 73.20 C ATOM 784 C LEU A 52 16.108 -12.062 -13.276 1.00 74.42 C ATOM 785 O LEU A 52 16.841 -11.120 -13.575 1.00 21.45 O ATOM 786 CB LEU A 52 17.405 -13.336 -11.559 1.00 21.54 C ATOM 787 CG LEU A 52 16.529 -12.968 -10.361 1.00 12.20 C ATOM 788 CD1 LEU A 52 15.545 -14.086 -10.055 1.00 75.14 C ATOM 789 CD2 LEU A 52 17.390 -12.665 -9.143 1.00 53.03 C ATOM 0 H LEU A 52 18.373 -13.233 -14.152 1.00 44.01 H new ATOM 0 HA LEU A 52 15.878 -14.142 -12.839 1.00 73.20 H new ATOM 0 HB2 LEU A 52 17.876 -14.298 -11.357 1.00 21.54 H new ATOM 0 HB3 LEU A 52 18.205 -12.600 -11.638 1.00 21.54 H new ATOM 0 HG LEU A 52 15.962 -12.072 -10.613 1.00 12.20 H new ATOM 0 HD11 LEU A 52 14.930 -13.806 -9.200 1.00 75.14 H new ATOM 0 HD12 LEU A 52 14.906 -14.255 -10.921 1.00 75.14 H new ATOM 0 HD13 LEU A 52 16.093 -15.000 -9.824 1.00 75.14 H new ATOM 0 HD21 LEU A 52 16.749 -12.405 -8.300 1.00 53.03 H new ATOM 0 HD22 LEU A 52 17.984 -13.543 -8.890 1.00 53.03 H new ATOM 0 HD23 LEU A 52 18.054 -11.830 -9.365 1.00 53.03 H new ATOM 801 N GLN A 53 14.782 -11.968 -13.249 1.00 21.40 N ATOM 802 CA GLN A 53 14.098 -10.723 -13.577 1.00 23.03 C ATOM 803 C GLN A 53 13.233 -10.254 -12.412 1.00 22.05 C ATOM 804 O GLN A 53 12.401 -11.003 -11.902 1.00 60.32 O ATOM 805 CB GLN A 53 13.236 -10.904 -14.827 1.00 51.11 C ATOM 806 CG GLN A 53 12.879 -9.596 -15.514 1.00 55.22 C ATOM 807 CD GLN A 53 13.919 -9.167 -16.530 1.00 11.21 C ATOM 808 OE1 GLN A 53 15.043 -9.671 -16.535 1.00 55.54 O ATOM 809 NE2 GLN A 53 13.550 -8.231 -17.397 1.00 74.51 N ATOM 0 H GLN A 53 14.161 -12.739 -13.003 1.00 21.40 H new ATOM 0 HA GLN A 53 14.854 -9.963 -13.773 1.00 23.03 H new ATOM 0 HB2 GLN A 53 13.765 -11.543 -15.534 1.00 51.11 H new ATOM 0 HB3 GLN A 53 12.318 -11.423 -14.553 1.00 51.11 H new ATOM 0 HG2 GLN A 53 11.914 -9.702 -16.010 1.00 55.22 H new ATOM 0 HG3 GLN A 53 12.767 -8.814 -14.763 1.00 55.22 H new ATOM 0 HE21 GLN A 53 12.608 -7.841 -17.356 1.00 74.51 H new ATOM 0 HE22 GLN A 53 14.208 -7.902 -18.103 1.00 74.51 H new ATOM 818 N GLY A 54 13.436 -9.008 -11.994 1.00 24.13 N ATOM 819 CA GLY A 54 12.668 -8.461 -10.891 1.00 51.10 C ATOM 820 C GLY A 54 13.178 -7.105 -10.445 1.00 50.25 C ATOM 821 O GLY A 54 14.138 -6.567 -10.998 1.00 12.33 O ATOM 0 H GLY A 54 14.119 -8.368 -12.400 1.00 24.13 H new ATOM 0 HA2 GLY A 54 11.623 -8.373 -11.189 1.00 51.10 H new ATOM 0 HA3 GLY A 54 12.703 -9.153 -10.050 1.00 51.10 H new ATOM 825 N PRO A 55 12.526 -6.530 -9.424 1.00 5.42 N ATOM 826 CA PRO A 55 12.902 -5.220 -8.883 1.00 13.14 C ATOM 827 C PRO A 55 14.233 -5.259 -8.140 1.00 33.43 C ATOM 828 O PRO A 55 14.570 -6.259 -7.504 1.00 41.24 O ATOM 829 CB PRO A 55 11.760 -4.895 -7.917 1.00 14.13 C ATOM 830 CG PRO A 55 11.211 -6.222 -7.518 1.00 41.45 C ATOM 831 CD PRO A 55 11.374 -7.114 -8.718 1.00 13.21 C ATOM 0 HA PRO A 55 13.038 -4.478 -9.670 1.00 13.14 H new ATOM 0 HB2 PRO A 55 12.120 -4.339 -7.051 1.00 14.13 H new ATOM 0 HB3 PRO A 55 10.999 -4.280 -8.397 1.00 14.13 H new ATOM 0 HG2 PRO A 55 11.746 -6.623 -6.658 1.00 41.45 H new ATOM 0 HG3 PRO A 55 10.162 -6.141 -7.231 1.00 41.45 H new ATOM 0 HD2 PRO A 55 11.563 -8.148 -8.428 1.00 13.21 H new ATOM 0 HD3 PRO A 55 10.480 -7.116 -9.341 1.00 13.21 H new ATOM 839 N ILE A 56 14.984 -4.167 -8.223 1.00 43.24 N ATOM 840 CA ILE A 56 16.278 -4.077 -7.557 1.00 73.13 C ATOM 841 C ILE A 56 16.148 -4.359 -6.064 1.00 71.44 C ATOM 842 O ILE A 56 17.101 -4.796 -5.420 1.00 4.45 O ATOM 843 CB ILE A 56 16.916 -2.689 -7.752 1.00 62.33 C ATOM 844 CG1 ILE A 56 18.333 -2.670 -7.175 1.00 63.24 C ATOM 845 CG2 ILE A 56 16.058 -1.615 -7.100 1.00 65.22 C ATOM 846 CD1 ILE A 56 19.144 -1.466 -7.603 1.00 35.51 C ATOM 0 H ILE A 56 14.719 -3.332 -8.745 1.00 43.24 H new ATOM 0 HA ILE A 56 16.921 -4.830 -8.012 1.00 73.13 H new ATOM 0 HB ILE A 56 16.976 -2.479 -8.820 1.00 62.33 H new ATOM 0 HG12 ILE A 56 18.274 -2.690 -6.087 1.00 63.24 H new ATOM 0 HG13 ILE A 56 18.854 -3.577 -7.482 1.00 63.24 H new ATOM 0 HG21 ILE A 56 16.522 -0.640 -7.246 1.00 65.22 H new ATOM 0 HG22 ILE A 56 15.067 -1.617 -7.553 1.00 65.22 H new ATOM 0 HG23 ILE A 56 15.970 -1.818 -6.033 1.00 65.22 H new ATOM 0 HD11 ILE A 56 20.137 -1.519 -7.157 1.00 35.51 H new ATOM 0 HD12 ILE A 56 19.235 -1.456 -8.689 1.00 35.51 H new ATOM 0 HD13 ILE A 56 18.645 -0.555 -7.272 1.00 35.51 H new ATOM 858 N SER A 57 14.961 -4.109 -5.521 1.00 72.24 N ATOM 859 CA SER A 57 14.706 -4.335 -4.103 1.00 41.54 C ATOM 860 C SER A 57 14.693 -5.826 -3.784 1.00 61.31 C ATOM 861 O SER A 57 14.978 -6.235 -2.658 1.00 74.11 O ATOM 862 CB SER A 57 13.374 -3.703 -3.696 1.00 55.32 C ATOM 863 OG SER A 57 13.431 -2.290 -3.785 1.00 0.55 O ATOM 0 H SER A 57 14.161 -3.750 -6.041 1.00 72.24 H new ATOM 0 HA SER A 57 15.511 -3.867 -3.535 1.00 41.54 H new ATOM 0 HB2 SER A 57 12.578 -4.079 -4.339 1.00 55.32 H new ATOM 0 HB3 SER A 57 13.125 -3.996 -2.676 1.00 55.32 H new ATOM 0 HG SER A 57 12.567 -1.910 -3.521 1.00 0.55 H new ATOM 869 N LYS A 58 14.361 -6.636 -4.784 1.00 13.12 N ATOM 870 CA LYS A 58 14.311 -8.083 -4.613 1.00 31.11 C ATOM 871 C LYS A 58 15.558 -8.743 -5.193 1.00 1.32 C ATOM 872 O LYS A 58 15.956 -9.826 -4.764 1.00 72.15 O ATOM 873 CB LYS A 58 13.060 -8.654 -5.285 1.00 10.04 C ATOM 874 CG LYS A 58 11.774 -8.341 -4.540 1.00 75.50 C ATOM 875 CD LYS A 58 11.600 -9.238 -3.325 1.00 44.23 C ATOM 876 CE LYS A 58 10.637 -8.630 -2.317 1.00 24.20 C ATOM 877 NZ LYS A 58 9.238 -8.614 -2.826 1.00 61.42 N ATOM 0 H LYS A 58 14.122 -6.314 -5.722 1.00 13.12 H new ATOM 0 HA LYS A 58 14.272 -8.296 -3.545 1.00 31.11 H new ATOM 0 HB2 LYS A 58 12.989 -8.258 -6.298 1.00 10.04 H new ATOM 0 HB3 LYS A 58 13.166 -9.735 -5.372 1.00 10.04 H new ATOM 0 HG2 LYS A 58 11.780 -7.298 -4.225 1.00 75.50 H new ATOM 0 HG3 LYS A 58 10.924 -8.467 -5.211 1.00 75.50 H new ATOM 0 HD2 LYS A 58 11.230 -10.213 -3.641 1.00 44.23 H new ATOM 0 HD3 LYS A 58 12.568 -9.403 -2.852 1.00 44.23 H new ATOM 0 HE2 LYS A 58 10.679 -9.197 -1.387 1.00 24.20 H new ATOM 0 HE3 LYS A 58 10.950 -7.612 -2.084 1.00 24.20 H new ATOM 0 HZ1 LYS A 58 8.613 -8.192 -2.110 1.00 61.42 H new ATOM 0 HZ2 LYS A 58 9.193 -8.052 -3.700 1.00 61.42 H new ATOM 0 HZ3 LYS A 58 8.930 -9.587 -3.025 1.00 61.42 H new ATOM 891 N VAL A 59 16.172 -8.081 -6.169 1.00 22.51 N ATOM 892 CA VAL A 59 17.376 -8.602 -6.806 1.00 31.54 C ATOM 893 C VAL A 59 18.612 -8.315 -5.962 1.00 25.25 C ATOM 894 O VAL A 59 19.539 -9.124 -5.904 1.00 11.10 O ATOM 895 CB VAL A 59 17.574 -8.000 -8.209 1.00 44.40 C ATOM 896 CG1 VAL A 59 18.814 -8.583 -8.871 1.00 15.03 C ATOM 897 CG2 VAL A 59 16.341 -8.233 -9.068 1.00 70.42 C ATOM 0 H VAL A 59 15.856 -7.183 -6.536 1.00 22.51 H new ATOM 0 HA VAL A 59 17.245 -9.680 -6.897 1.00 31.54 H new ATOM 0 HB VAL A 59 17.718 -6.925 -8.106 1.00 44.40 H new ATOM 0 HG11 VAL A 59 18.937 -8.145 -9.862 1.00 15.03 H new ATOM 0 HG12 VAL A 59 19.691 -8.358 -8.263 1.00 15.03 H new ATOM 0 HG13 VAL A 59 18.704 -9.663 -8.963 1.00 15.03 H new ATOM 0 HG21 VAL A 59 16.499 -7.801 -10.056 1.00 70.42 H new ATOM 0 HG22 VAL A 59 16.162 -9.304 -9.165 1.00 70.42 H new ATOM 0 HG23 VAL A 59 15.477 -7.762 -8.600 1.00 70.42 H new ATOM 907 N ARG A 60 18.620 -7.158 -5.307 1.00 72.33 N ATOM 908 CA ARG A 60 19.743 -6.763 -4.466 1.00 62.51 C ATOM 909 C ARG A 60 19.885 -7.703 -3.272 1.00 50.02 C ATOM 910 O ARG A 60 20.976 -7.870 -2.726 1.00 41.12 O ATOM 911 CB ARG A 60 19.562 -5.325 -3.978 1.00 75.11 C ATOM 912 CG ARG A 60 20.794 -4.753 -3.296 1.00 74.11 C ATOM 913 CD ARG A 60 21.800 -4.232 -4.310 1.00 10.31 C ATOM 914 NE ARG A 60 23.150 -4.164 -3.756 1.00 54.51 N ATOM 915 CZ ARG A 60 24.214 -3.789 -4.457 1.00 53.44 C ATOM 916 NH1 ARG A 60 24.085 -3.449 -5.733 1.00 24.53 N ATOM 917 NH2 ARG A 60 25.409 -3.752 -3.883 1.00 2.22 N ATOM 0 H ARG A 60 17.861 -6.478 -5.343 1.00 72.33 H new ATOM 0 HA ARG A 60 20.652 -6.824 -5.065 1.00 62.51 H new ATOM 0 HB2 ARG A 60 19.300 -4.693 -4.826 1.00 75.11 H new ATOM 0 HB3 ARG A 60 18.723 -5.289 -3.283 1.00 75.11 H new ATOM 0 HG2 ARG A 60 20.499 -3.945 -2.627 1.00 74.11 H new ATOM 0 HG3 ARG A 60 21.261 -5.522 -2.681 1.00 74.11 H new ATOM 0 HD2 ARG A 60 21.800 -4.880 -5.187 1.00 10.31 H new ATOM 0 HD3 ARG A 60 21.496 -3.241 -4.646 1.00 10.31 H new ATOM 0 HE ARG A 60 23.283 -4.418 -2.777 1.00 54.51 H new ATOM 0 HH11 ARG A 60 23.167 -3.475 -6.178 1.00 24.53 H new ATOM 0 HH12 ARG A 60 24.903 -3.161 -6.269 1.00 24.53 H new ATOM 0 HH21 ARG A 60 25.512 -4.012 -2.902 1.00 2.22 H new ATOM 0 HH22 ARG A 60 26.225 -3.464 -4.423 1.00 2.22 H new ATOM 931 N HIS A 61 18.775 -8.314 -2.871 1.00 74.14 N ATOM 932 CA HIS A 61 18.775 -9.237 -1.742 1.00 31.01 C ATOM 933 C HIS A 61 18.978 -10.674 -2.214 1.00 53.53 C ATOM 934 O HIS A 61 19.778 -11.417 -1.646 1.00 54.54 O ATOM 935 CB HIS A 61 17.464 -9.124 -0.963 1.00 71.14 C ATOM 936 CG HIS A 61 17.425 -7.961 -0.021 1.00 2.21 C ATOM 937 ND1 HIS A 61 18.529 -7.522 0.679 1.00 64.20 N ATOM 938 CD2 HIS A 61 16.407 -7.143 0.334 1.00 1.44 C ATOM 939 CE1 HIS A 61 18.192 -6.486 1.425 1.00 12.23 C ATOM 940 NE2 HIS A 61 16.909 -6.235 1.234 1.00 2.21 N ATOM 0 H HIS A 61 17.864 -8.187 -3.311 1.00 74.14 H new ATOM 0 HA HIS A 61 19.603 -8.969 -1.086 1.00 31.01 H new ATOM 0 HB2 HIS A 61 16.638 -9.037 -1.669 1.00 71.14 H new ATOM 0 HB3 HIS A 61 17.306 -10.043 -0.399 1.00 71.14 H new ATOM 0 HD2 HIS A 61 15.389 -7.195 -0.024 1.00 1.44 H new ATOM 0 HE1 HIS A 61 18.853 -5.937 2.080 1.00 12.23 H new ATOM 0 HE2 HIS A 61 16.378 -5.488 1.682 1.00 2.21 H new ATOM 948 N MET A 62 18.247 -11.057 -3.256 1.00 63.41 N ATOM 949 CA MET A 62 18.348 -12.405 -3.804 1.00 50.05 C ATOM 950 C MET A 62 19.790 -12.734 -4.176 1.00 23.41 C ATOM 951 O MET A 62 20.262 -13.846 -3.940 1.00 60.44 O ATOM 952 CB MET A 62 17.447 -12.547 -5.033 1.00 24.30 C ATOM 953 CG MET A 62 16.024 -12.961 -4.698 1.00 74.01 C ATOM 954 SD MET A 62 15.903 -14.687 -4.191 1.00 31.11 S ATOM 955 CE MET A 62 14.479 -15.220 -5.138 1.00 42.42 C ATOM 0 H MET A 62 17.579 -10.454 -3.737 1.00 63.41 H new ATOM 0 HA MET A 62 18.020 -13.108 -3.038 1.00 50.05 H new ATOM 0 HB2 MET A 62 17.424 -11.598 -5.568 1.00 24.30 H new ATOM 0 HB3 MET A 62 17.882 -13.284 -5.709 1.00 24.30 H new ATOM 0 HG2 MET A 62 15.643 -12.324 -3.899 1.00 74.01 H new ATOM 0 HG3 MET A 62 15.388 -12.796 -5.568 1.00 74.01 H new ATOM 0 HE1 MET A 62 13.757 -15.695 -4.474 1.00 42.42 H new ATOM 0 HE2 MET A 62 14.017 -14.357 -5.618 1.00 42.42 H new ATOM 0 HE3 MET A 62 14.795 -15.933 -5.900 1.00 42.42 H new ATOM 965 N GLN A 63 20.484 -11.761 -4.757 1.00 61.23 N ATOM 966 CA GLN A 63 21.872 -11.950 -5.162 1.00 2.22 C ATOM 967 C GLN A 63 22.755 -12.251 -3.955 1.00 34.21 C ATOM 968 O GLN A 63 23.796 -12.894 -4.082 1.00 31.55 O ATOM 969 CB GLN A 63 22.388 -10.706 -5.887 1.00 54.33 C ATOM 970 CG GLN A 63 22.608 -9.514 -4.970 1.00 14.31 C ATOM 971 CD GLN A 63 22.881 -8.233 -5.733 1.00 1.41 C ATOM 972 OE1 GLN A 63 22.166 -7.894 -6.677 1.00 4.03 O ATOM 973 NE2 GLN A 63 23.920 -7.512 -5.327 1.00 40.02 N ATOM 0 H GLN A 63 20.108 -10.834 -4.958 1.00 61.23 H new ATOM 0 HA GLN A 63 21.913 -12.801 -5.841 1.00 2.22 H new ATOM 0 HB2 GLN A 63 23.327 -10.949 -6.385 1.00 54.33 H new ATOM 0 HB3 GLN A 63 21.677 -10.429 -6.665 1.00 54.33 H new ATOM 0 HG2 GLN A 63 21.728 -9.377 -4.341 1.00 14.31 H new ATOM 0 HG3 GLN A 63 23.446 -9.722 -4.305 1.00 14.31 H new ATOM 0 HE21 GLN A 63 24.486 -7.831 -4.540 1.00 40.02 H new ATOM 0 HE22 GLN A 63 24.152 -6.640 -5.802 1.00 40.02 H new ATOM 982 N GLU A 64 22.331 -11.782 -2.786 1.00 14.42 N ATOM 983 CA GLU A 64 23.084 -12.001 -1.557 1.00 1.43 C ATOM 984 C GLU A 64 22.550 -13.213 -0.800 1.00 31.22 C ATOM 985 O GLU A 64 22.684 -13.305 0.420 1.00 4.14 O ATOM 986 CB GLU A 64 23.019 -10.759 -0.664 1.00 61.43 C ATOM 987 CG GLU A 64 23.570 -9.506 -1.324 1.00 21.24 C ATOM 988 CD GLU A 64 23.660 -8.334 -0.366 1.00 33.24 C ATOM 989 OE1 GLU A 64 24.337 -8.468 0.675 1.00 72.11 O ATOM 990 OE2 GLU A 64 23.052 -7.283 -0.657 1.00 43.43 O ATOM 0 H GLU A 64 21.470 -11.248 -2.664 1.00 14.42 H new ATOM 0 HA GLU A 64 24.123 -12.192 -1.827 1.00 1.43 H new ATOM 0 HB2 GLU A 64 21.983 -10.582 -0.376 1.00 61.43 H new ATOM 0 HB3 GLU A 64 23.576 -10.951 0.253 1.00 61.43 H new ATOM 0 HG2 GLU A 64 24.560 -9.718 -1.727 1.00 21.24 H new ATOM 0 HG3 GLU A 64 22.934 -9.234 -2.166 1.00 21.24 H new ATOM 997 N TRP A 65 21.944 -14.140 -1.533 1.00 32.25 N ATOM 998 CA TRP A 65 21.388 -15.347 -0.931 1.00 24.21 C ATOM 999 C TRP A 65 21.936 -16.596 -1.612 1.00 60.51 C ATOM 1000 O TRP A 65 22.315 -17.562 -0.948 1.00 20.20 O ATOM 1001 CB TRP A 65 19.862 -15.330 -1.020 1.00 75.34 C ATOM 1002 CG TRP A 65 19.220 -16.561 -0.455 1.00 13.12 C ATOM 1003 CD1 TRP A 65 19.157 -17.794 -1.038 1.00 34.20 C ATOM 1004 CD2 TRP A 65 18.549 -16.676 0.805 1.00 53.32 C ATOM 1005 NE1 TRP A 65 18.487 -18.669 -0.217 1.00 12.12 N ATOM 1006 CE2 TRP A 65 18.104 -18.008 0.920 1.00 4.52 C ATOM 1007 CE3 TRP A 65 18.282 -15.784 1.847 1.00 32.11 C ATOM 1008 CZ2 TRP A 65 17.408 -18.465 2.035 1.00 32.53 C ATOM 1009 CZ3 TRP A 65 17.590 -16.240 2.953 1.00 21.11 C ATOM 1010 CH2 TRP A 65 17.160 -17.571 3.041 1.00 42.12 C ATOM 0 H TRP A 65 21.825 -14.079 -2.544 1.00 32.25 H new ATOM 0 HA TRP A 65 21.683 -15.369 0.118 1.00 24.21 H new ATOM 0 HB2 TRP A 65 19.484 -14.456 -0.490 1.00 75.34 H new ATOM 0 HB3 TRP A 65 19.567 -15.222 -2.064 1.00 75.34 H new ATOM 0 HD1 TRP A 65 19.573 -18.045 -2.003 1.00 34.20 H new ATOM 0 HE1 TRP A 65 18.304 -19.652 -0.421 1.00 12.12 H new ATOM 0 HE3 TRP A 65 18.610 -14.757 1.789 1.00 32.11 H new ATOM 0 HZ2 TRP A 65 17.075 -19.490 2.104 1.00 32.53 H new ATOM 0 HZ3 TRP A 65 17.377 -15.559 3.764 1.00 21.11 H new ATOM 0 HH2 TRP A 65 16.623 -17.897 3.919 1.00 42.12 H new ATOM 1021 N LEU A 66 21.975 -16.572 -2.940 1.00 25.04 N ATOM 1022 CA LEU A 66 22.478 -17.704 -3.711 1.00 53.31 C ATOM 1023 C LEU A 66 24.001 -17.765 -3.660 1.00 10.43 C ATOM 1024 O LEU A 66 24.600 -18.801 -3.945 1.00 33.23 O ATOM 1025 CB LEU A 66 22.009 -17.604 -5.164 1.00 33.43 C ATOM 1026 CG LEU A 66 20.556 -18.000 -5.428 1.00 73.54 C ATOM 1027 CD1 LEU A 66 20.283 -19.406 -4.915 1.00 4.34 C ATOM 1028 CD2 LEU A 66 19.605 -17.002 -4.785 1.00 11.31 C ATOM 0 H LEU A 66 21.665 -15.782 -3.505 1.00 25.04 H new ATOM 0 HA LEU A 66 22.082 -18.618 -3.269 1.00 53.31 H new ATOM 0 HB2 LEU A 66 22.152 -16.577 -5.501 1.00 33.43 H new ATOM 0 HB3 LEU A 66 22.654 -18.234 -5.777 1.00 33.43 H new ATOM 0 HG LEU A 66 20.388 -17.990 -6.505 1.00 73.54 H new ATOM 0 HD11 LEU A 66 19.244 -19.670 -5.112 1.00 4.34 H new ATOM 0 HD12 LEU A 66 20.939 -20.113 -5.423 1.00 4.34 H new ATOM 0 HD13 LEU A 66 20.470 -19.444 -3.842 1.00 4.34 H new ATOM 0 HD21 LEU A 66 18.576 -17.300 -4.984 1.00 11.31 H new ATOM 0 HD22 LEU A 66 19.775 -16.979 -3.709 1.00 11.31 H new ATOM 0 HD23 LEU A 66 19.782 -16.010 -5.201 1.00 11.31 H new ATOM 1040 N GLU A 67 24.621 -16.647 -3.292 1.00 72.44 N ATOM 1041 CA GLU A 67 26.074 -16.575 -3.202 1.00 64.44 C ATOM 1042 C GLU A 67 26.550 -16.912 -1.792 1.00 15.33 C ATOM 1043 O GLU A 67 27.709 -17.270 -1.583 1.00 42.10 O ATOM 1044 CB GLU A 67 26.564 -15.181 -3.598 1.00 54.41 C ATOM 1045 CG GLU A 67 26.286 -14.118 -2.548 1.00 41.34 C ATOM 1046 CD GLU A 67 26.682 -12.728 -3.007 1.00 13.51 C ATOM 1047 OE1 GLU A 67 26.789 -12.514 -4.233 1.00 32.54 O ATOM 1048 OE2 GLU A 67 26.884 -11.852 -2.139 1.00 70.41 O ATOM 0 H GLU A 67 24.140 -15.780 -3.052 1.00 72.44 H new ATOM 0 HA GLU A 67 26.491 -17.308 -3.892 1.00 64.44 H new ATOM 0 HB2 GLU A 67 27.637 -15.222 -3.786 1.00 54.41 H new ATOM 0 HB3 GLU A 67 26.087 -14.889 -4.534 1.00 54.41 H new ATOM 0 HG2 GLU A 67 25.225 -14.126 -2.300 1.00 41.34 H new ATOM 0 HG3 GLU A 67 26.829 -14.364 -1.635 1.00 41.34 H new ATOM 1055 N THR A 68 25.645 -16.793 -0.825 1.00 32.22 N ATOM 1056 CA THR A 68 25.970 -17.082 0.566 1.00 22.30 C ATOM 1057 C THR A 68 25.503 -18.478 0.961 1.00 20.53 C ATOM 1058 O THR A 68 26.316 -19.375 1.185 1.00 63.31 O ATOM 1059 CB THR A 68 25.334 -16.052 1.518 1.00 51.22 C ATOM 1060 OG1 THR A 68 23.938 -15.916 1.230 1.00 12.11 O ATOM 1061 CG2 THR A 68 26.018 -14.699 1.387 1.00 70.44 C ATOM 0 H THR A 68 24.681 -16.498 -0.980 1.00 32.22 H new ATOM 0 HA THR A 68 27.055 -17.026 0.655 1.00 22.30 H new ATOM 0 HB THR A 68 25.461 -16.408 2.540 1.00 51.22 H new ATOM 0 HG1 THR A 68 23.743 -14.986 0.989 1.00 12.11 H new ATOM 0 HG21 THR A 68 25.552 -13.988 2.069 1.00 70.44 H new ATOM 0 HG22 THR A 68 27.075 -14.800 1.635 1.00 70.44 H new ATOM 0 HG23 THR A 68 25.918 -14.339 0.363 1.00 70.44 H new ATOM 1069 N ARG A 69 24.189 -18.656 1.045 1.00 54.01 N ATOM 1070 CA ARG A 69 23.613 -19.944 1.414 1.00 45.12 C ATOM 1071 C ARG A 69 24.178 -21.061 0.541 1.00 31.23 C ATOM 1072 O ARG A 69 24.999 -21.859 0.991 1.00 30.41 O ATOM 1073 CB ARG A 69 22.090 -19.902 1.285 1.00 53.24 C ATOM 1074 CG ARG A 69 21.395 -19.256 2.472 1.00 5.34 C ATOM 1075 CD ARG A 69 21.695 -17.767 2.551 1.00 50.14 C ATOM 1076 NE ARG A 69 20.936 -17.111 3.612 1.00 3.02 N ATOM 1077 CZ ARG A 69 21.178 -17.289 4.906 1.00 31.31 C ATOM 1078 NH1 ARG A 69 22.153 -18.099 5.296 1.00 12.34 N ATOM 1079 NH2 ARG A 69 20.444 -16.657 5.813 1.00 51.13 N ATOM 0 H ARG A 69 23.502 -17.924 0.862 1.00 54.01 H new ATOM 0 HA ARG A 69 23.876 -20.148 2.452 1.00 45.12 H new ATOM 0 HB2 ARG A 69 21.826 -19.356 0.379 1.00 53.24 H new ATOM 0 HB3 ARG A 69 21.716 -20.919 1.165 1.00 53.24 H new ATOM 0 HG2 ARG A 69 20.319 -19.408 2.391 1.00 5.34 H new ATOM 0 HG3 ARG A 69 21.717 -19.743 3.393 1.00 5.34 H new ATOM 0 HD2 ARG A 69 22.761 -17.621 2.725 1.00 50.14 H new ATOM 0 HD3 ARG A 69 21.461 -17.299 1.595 1.00 50.14 H new ATOM 0 HE ARG A 69 20.179 -16.482 3.345 1.00 3.02 H new ATOM 0 HH11 ARG A 69 22.719 -18.587 4.602 1.00 12.34 H new ATOM 0 HH12 ARG A 69 22.337 -18.234 6.290 1.00 12.34 H new ATOM 0 HH21 ARG A 69 19.693 -16.034 5.517 1.00 51.13 H new ATOM 0 HH22 ARG A 69 20.631 -16.795 6.806 1.00 51.13 H new ATOM 1093 N GLY A 70 23.731 -21.112 -0.710 1.00 13.41 N ATOM 1094 CA GLY A 70 24.201 -22.135 -1.625 1.00 41.22 C ATOM 1095 C GLY A 70 23.821 -23.532 -1.178 1.00 33.31 C ATOM 1096 O GLY A 70 22.673 -23.783 -0.810 1.00 0.42 O ATOM 0 H GLY A 70 23.051 -20.463 -1.106 1.00 13.41 H new ATOM 0 HA2 GLY A 70 23.788 -21.949 -2.616 1.00 41.22 H new ATOM 0 HA3 GLY A 70 25.285 -22.068 -1.714 1.00 41.22 H new ATOM 1100 N SER A 71 24.786 -24.446 -1.211 1.00 14.21 N ATOM 1101 CA SER A 71 24.544 -25.827 -0.811 1.00 25.21 C ATOM 1102 C SER A 71 25.820 -26.656 -0.924 1.00 63.10 C ATOM 1103 O SER A 71 26.769 -26.291 -1.619 1.00 74.23 O ATOM 1104 CB SER A 71 23.443 -26.445 -1.674 1.00 31.40 C ATOM 1105 OG SER A 71 23.988 -27.317 -2.649 1.00 50.25 O ATOM 0 H SER A 71 25.742 -24.255 -1.511 1.00 14.21 H new ATOM 0 HA SER A 71 24.222 -25.827 0.230 1.00 25.21 H new ATOM 0 HB2 SER A 71 22.745 -26.993 -1.041 1.00 31.40 H new ATOM 0 HB3 SER A 71 22.875 -25.655 -2.165 1.00 31.40 H new ATOM 0 HG SER A 71 23.264 -27.700 -3.187 1.00 50.25 H new ATOM 1111 N PRO A 72 25.846 -27.800 -0.224 1.00 13.12 N ATOM 1112 CA PRO A 72 26.998 -28.706 -0.229 1.00 3.41 C ATOM 1113 C PRO A 72 27.178 -29.408 -1.570 1.00 75.42 C ATOM 1114 O PRO A 72 28.257 -29.914 -1.879 1.00 33.43 O ATOM 1115 CB PRO A 72 26.657 -29.720 0.865 1.00 32.40 C ATOM 1116 CG PRO A 72 25.169 -29.706 0.944 1.00 61.33 C ATOM 1117 CD PRO A 72 24.751 -28.297 0.626 1.00 20.23 C ATOM 0 HA PRO A 72 27.935 -28.175 -0.059 1.00 3.41 H new ATOM 0 HB2 PRO A 72 27.031 -30.713 0.615 1.00 32.40 H new ATOM 0 HB3 PRO A 72 27.107 -29.441 1.818 1.00 32.40 H new ATOM 0 HG2 PRO A 72 24.734 -30.411 0.236 1.00 61.33 H new ATOM 0 HG3 PRO A 72 24.828 -30.000 1.937 1.00 61.33 H new ATOM 0 HD2 PRO A 72 23.794 -28.270 0.105 1.00 20.23 H new ATOM 0 HD3 PRO A 72 24.640 -27.697 1.529 1.00 20.23 H new ATOM 1125 N LYS A 73 26.113 -29.436 -2.365 1.00 43.13 N ATOM 1126 CA LYS A 73 26.153 -30.075 -3.675 1.00 54.03 C ATOM 1127 C LYS A 73 26.448 -29.055 -4.770 1.00 2.52 C ATOM 1128 O LYS A 73 26.973 -29.400 -5.828 1.00 62.02 O ATOM 1129 CB LYS A 73 24.824 -30.777 -3.963 1.00 54.12 C ATOM 1130 CG LYS A 73 24.398 -31.745 -2.873 1.00 3.03 C ATOM 1131 CD LYS A 73 25.318 -32.953 -2.810 1.00 33.11 C ATOM 1132 CE LYS A 73 24.888 -34.032 -3.792 1.00 60.10 C ATOM 1133 NZ LYS A 73 23.588 -34.648 -3.406 1.00 4.02 N ATOM 0 H LYS A 73 25.212 -29.023 -2.125 1.00 43.13 H new ATOM 0 HA LYS A 73 26.954 -30.814 -3.666 1.00 54.03 H new ATOM 0 HB2 LYS A 73 24.046 -30.025 -4.093 1.00 54.12 H new ATOM 0 HB3 LYS A 73 24.905 -31.318 -4.906 1.00 54.12 H new ATOM 0 HG2 LYS A 73 24.400 -31.234 -1.910 1.00 3.03 H new ATOM 0 HG3 LYS A 73 23.375 -32.074 -3.057 1.00 3.03 H new ATOM 0 HD2 LYS A 73 26.340 -32.645 -3.030 1.00 33.11 H new ATOM 0 HD3 LYS A 73 25.318 -33.359 -1.798 1.00 33.11 H new ATOM 0 HE2 LYS A 73 24.804 -33.602 -4.790 1.00 60.10 H new ATOM 0 HE3 LYS A 73 25.655 -34.805 -3.842 1.00 60.10 H new ATOM 0 HZ1 LYS A 73 23.513 -35.594 -3.830 1.00 4.02 H new ATOM 0 HZ2 LYS A 73 23.536 -34.728 -2.370 1.00 4.02 H new ATOM 0 HZ3 LYS A 73 22.807 -34.052 -3.747 1.00 4.02 H new ATOM 1147 N SER A 74 26.109 -27.796 -4.507 1.00 60.50 N ATOM 1148 CA SER A 74 26.336 -26.726 -5.471 1.00 62.20 C ATOM 1149 C SER A 74 27.349 -25.719 -4.936 1.00 2.14 C ATOM 1150 O SER A 74 27.020 -24.556 -4.700 1.00 45.31 O ATOM 1151 CB SER A 74 25.020 -26.018 -5.798 1.00 61.24 C ATOM 1152 OG SER A 74 25.242 -24.879 -6.611 1.00 63.04 O ATOM 0 H SER A 74 25.676 -27.493 -3.634 1.00 60.50 H new ATOM 0 HA SER A 74 26.738 -27.170 -6.382 1.00 62.20 H new ATOM 0 HB2 SER A 74 24.349 -26.708 -6.309 1.00 61.24 H new ATOM 0 HB3 SER A 74 24.525 -25.718 -4.874 1.00 61.24 H new ATOM 0 HG SER A 74 25.739 -24.205 -6.101 1.00 63.04 H new ATOM 1158 N HIS A 75 28.583 -26.174 -4.745 1.00 65.45 N ATOM 1159 CA HIS A 75 29.646 -25.314 -4.238 1.00 43.33 C ATOM 1160 C HIS A 75 29.751 -24.036 -5.065 1.00 3.53 C ATOM 1161 O HIS A 75 29.673 -24.071 -6.293 1.00 62.31 O ATOM 1162 CB HIS A 75 30.983 -26.056 -4.253 1.00 40.22 C ATOM 1163 CG HIS A 75 31.144 -27.023 -3.121 1.00 73.33 C ATOM 1164 ND1 HIS A 75 32.254 -27.047 -2.303 1.00 74.34 N ATOM 1165 CD2 HIS A 75 30.326 -28.004 -2.672 1.00 12.32 C ATOM 1166 CE1 HIS A 75 32.112 -28.002 -1.401 1.00 3.30 C ATOM 1167 NE2 HIS A 75 30.951 -28.597 -1.602 1.00 55.14 N ATOM 0 H HIS A 75 28.872 -27.134 -4.934 1.00 65.45 H new ATOM 0 HA HIS A 75 29.401 -25.043 -3.211 1.00 43.33 H new ATOM 0 HB2 HIS A 75 31.080 -26.594 -5.196 1.00 40.22 H new ATOM 0 HB3 HIS A 75 31.794 -25.328 -4.216 1.00 40.22 H new ATOM 0 HD2 HIS A 75 29.362 -28.271 -3.079 1.00 12.32 H new ATOM 0 HE1 HIS A 75 32.825 -28.253 -0.630 1.00 3.30 H new ATOM 0 HE2 HIS A 75 30.578 -29.371 -1.052 1.00 55.14 H new ATOM 1175 N ILE A 76 29.928 -22.909 -4.383 1.00 14.21 N ATOM 1176 CA ILE A 76 30.043 -21.620 -5.055 1.00 23.35 C ATOM 1177 C ILE A 76 31.503 -21.200 -5.190 1.00 31.03 C ATOM 1178 O ILE A 76 32.004 -20.398 -4.402 1.00 1.41 O ATOM 1179 CB ILE A 76 29.272 -20.521 -4.300 1.00 61.14 C ATOM 1180 CG1 ILE A 76 27.793 -20.895 -4.182 1.00 41.13 C ATOM 1181 CG2 ILE A 76 29.431 -19.183 -5.007 1.00 1.04 C ATOM 1182 CD1 ILE A 76 27.065 -20.142 -3.091 1.00 52.11 C ATOM 0 H ILE A 76 29.995 -22.862 -3.366 1.00 14.21 H new ATOM 0 HA ILE A 76 29.608 -21.741 -6.047 1.00 23.35 H new ATOM 0 HB ILE A 76 29.686 -20.431 -3.296 1.00 61.14 H new ATOM 0 HG12 ILE A 76 27.301 -20.703 -5.135 1.00 41.13 H new ATOM 0 HG13 ILE A 76 27.711 -21.965 -3.991 1.00 41.13 H new ATOM 0 HG21 ILE A 76 28.881 -18.416 -4.462 1.00 1.04 H new ATOM 0 HG22 ILE A 76 30.487 -18.915 -5.045 1.00 1.04 H new ATOM 0 HG23 ILE A 76 29.040 -19.259 -6.021 1.00 1.04 H new ATOM 0 HD11 ILE A 76 26.022 -20.457 -3.065 1.00 52.11 H new ATOM 0 HD12 ILE A 76 27.532 -20.353 -2.129 1.00 52.11 H new ATOM 0 HD13 ILE A 76 27.115 -19.072 -3.292 1.00 52.11 H new ATOM 1194 N ASP A 77 32.179 -21.746 -6.194 1.00 43.03 N ATOM 1195 CA ASP A 77 33.581 -21.426 -6.435 1.00 44.34 C ATOM 1196 C ASP A 77 33.735 -19.986 -6.914 1.00 43.54 C ATOM 1197 O ASP A 77 34.656 -19.279 -6.505 1.00 44.51 O ATOM 1198 CB ASP A 77 34.176 -22.386 -7.467 1.00 52.31 C ATOM 1199 CG ASP A 77 35.692 -22.367 -7.469 1.00 52.15 C ATOM 1200 OD1 ASP A 77 36.273 -21.395 -6.944 1.00 24.10 O ATOM 1201 OD2 ASP A 77 36.297 -23.324 -7.998 1.00 15.34 O ATOM 0 H ASP A 77 31.779 -22.412 -6.854 1.00 43.03 H new ATOM 0 HA ASP A 77 34.120 -21.537 -5.494 1.00 44.34 H new ATOM 0 HB2 ASP A 77 33.829 -23.398 -7.260 1.00 52.31 H new ATOM 0 HB3 ASP A 77 33.811 -22.120 -8.459 1.00 52.31 H new ATOM 1206 N LYS A 78 32.828 -19.557 -7.785 1.00 53.11 N ATOM 1207 CA LYS A 78 32.861 -18.201 -8.321 1.00 21.22 C ATOM 1208 C LYS A 78 31.449 -17.669 -8.543 1.00 10.02 C ATOM 1209 O LYS A 78 30.739 -18.121 -9.441 1.00 3.02 O ATOM 1210 CB LYS A 78 33.642 -18.170 -9.637 1.00 0.24 C ATOM 1211 CG LYS A 78 35.142 -18.323 -9.457 1.00 45.11 C ATOM 1212 CD LYS A 78 35.760 -17.079 -8.839 1.00 71.53 C ATOM 1213 CE LYS A 78 37.251 -17.259 -8.598 1.00 11.41 C ATOM 1214 NZ LYS A 78 37.966 -17.683 -9.833 1.00 73.53 N ATOM 0 H LYS A 78 32.060 -20.130 -8.135 1.00 53.11 H new ATOM 0 HA LYS A 78 33.361 -17.561 -7.593 1.00 21.22 H new ATOM 0 HB2 LYS A 78 33.279 -18.968 -10.284 1.00 0.24 H new ATOM 0 HB3 LYS A 78 33.440 -17.229 -10.148 1.00 0.24 H new ATOM 0 HG2 LYS A 78 35.347 -19.186 -8.823 1.00 45.11 H new ATOM 0 HG3 LYS A 78 35.607 -18.520 -10.423 1.00 45.11 H new ATOM 0 HD2 LYS A 78 35.597 -16.225 -9.497 1.00 71.53 H new ATOM 0 HD3 LYS A 78 35.262 -16.854 -7.896 1.00 71.53 H new ATOM 0 HE2 LYS A 78 37.676 -16.323 -8.236 1.00 11.41 H new ATOM 0 HE3 LYS A 78 37.405 -18.002 -7.816 1.00 11.41 H new ATOM 0 HZ1 LYS A 78 38.893 -17.213 -9.876 1.00 73.53 H new ATOM 0 HZ2 LYS A 78 38.101 -18.714 -9.820 1.00 73.53 H new ATOM 0 HZ3 LYS A 78 37.405 -17.418 -10.667 1.00 73.53 H new ATOM 1228 N ALA A 79 31.048 -16.705 -7.720 1.00 25.43 N ATOM 1229 CA ALA A 79 29.723 -16.110 -7.829 1.00 13.50 C ATOM 1230 C ALA A 79 29.802 -14.694 -8.392 1.00 34.44 C ATOM 1231 O ALA A 79 30.337 -13.791 -7.751 1.00 14.31 O ATOM 1232 CB ALA A 79 29.034 -16.103 -6.472 1.00 52.44 C ATOM 0 H ALA A 79 31.623 -16.320 -6.970 1.00 25.43 H new ATOM 0 HA ALA A 79 29.135 -16.715 -8.519 1.00 13.50 H new ATOM 0 HB1 ALA A 79 28.045 -15.656 -6.569 1.00 52.44 H new ATOM 0 HB2 ALA A 79 28.936 -17.126 -6.109 1.00 52.44 H new ATOM 0 HB3 ALA A 79 29.627 -15.523 -5.766 1.00 52.44 H new ATOM 1238 N ASN A 80 29.266 -14.510 -9.594 1.00 14.23 N ATOM 1239 CA ASN A 80 29.277 -13.204 -10.243 1.00 52.02 C ATOM 1240 C ASN A 80 27.928 -12.907 -10.891 1.00 71.23 C ATOM 1241 O ASN A 80 27.085 -13.794 -11.030 1.00 1.11 O ATOM 1242 CB ASN A 80 30.385 -13.144 -11.296 1.00 63.42 C ATOM 1243 CG ASN A 80 31.748 -12.880 -10.686 1.00 64.44 C ATOM 1244 OD1 ASN A 80 32.182 -11.733 -10.581 1.00 14.15 O ATOM 1245 ND2 ASN A 80 32.432 -13.945 -10.282 1.00 53.20 N ATOM 0 H ASN A 80 28.819 -15.248 -10.138 1.00 14.23 H new ATOM 0 HA ASN A 80 29.468 -12.449 -9.481 1.00 52.02 H new ATOM 0 HB2 ASN A 80 30.412 -14.085 -11.845 1.00 63.42 H new ATOM 0 HB3 ASN A 80 30.155 -12.360 -12.018 1.00 63.42 H new ATOM 0 HD21 ASN A 80 33.356 -13.830 -9.865 1.00 53.20 H new ATOM 0 HD22 ASN A 80 32.033 -14.878 -10.389 1.00 53.20 H new ATOM 1252 N PHE A 81 27.731 -11.654 -11.287 1.00 72.02 N ATOM 1253 CA PHE A 81 26.484 -11.239 -11.921 1.00 24.54 C ATOM 1254 C PHE A 81 26.748 -10.635 -13.297 1.00 4.05 C ATOM 1255 O PHE A 81 27.855 -10.182 -13.585 1.00 62.22 O ATOM 1256 CB PHE A 81 25.751 -10.227 -11.038 1.00 44.23 C ATOM 1257 CG PHE A 81 26.628 -9.105 -10.558 1.00 34.41 C ATOM 1258 CD1 PHE A 81 26.803 -7.967 -11.328 1.00 64.34 C ATOM 1259 CD2 PHE A 81 27.275 -9.189 -9.336 1.00 31.02 C ATOM 1260 CE1 PHE A 81 27.610 -6.934 -10.889 1.00 72.40 C ATOM 1261 CE2 PHE A 81 28.082 -8.159 -8.891 1.00 22.01 C ATOM 1262 CZ PHE A 81 28.249 -7.030 -9.668 1.00 51.23 C ATOM 0 H PHE A 81 28.418 -10.908 -11.180 1.00 72.02 H new ATOM 0 HA PHE A 81 25.857 -12.122 -12.046 1.00 24.54 H new ATOM 0 HB2 PHE A 81 24.913 -9.809 -11.596 1.00 44.23 H new ATOM 0 HB3 PHE A 81 25.333 -10.745 -10.175 1.00 44.23 H new ATOM 0 HD1 PHE A 81 26.303 -7.886 -12.282 1.00 64.34 H new ATOM 0 HD2 PHE A 81 27.147 -10.070 -8.724 1.00 31.02 H new ATOM 0 HE1 PHE A 81 27.741 -6.053 -11.500 1.00 72.40 H new ATOM 0 HE2 PHE A 81 28.581 -8.237 -7.937 1.00 22.01 H new ATOM 0 HZ PHE A 81 28.878 -6.223 -9.322 1.00 51.23 H new ATOM 1272 N ASN A 82 25.723 -10.633 -14.142 1.00 12.52 N ATOM 1273 CA ASN A 82 25.843 -10.085 -15.488 1.00 63.12 C ATOM 1274 C ASN A 82 25.651 -8.572 -15.479 1.00 41.33 C ATOM 1275 O ASN A 82 25.375 -7.977 -14.438 1.00 71.14 O ATOM 1276 CB ASN A 82 24.818 -10.735 -16.419 1.00 72.32 C ATOM 1277 CG ASN A 82 25.300 -10.801 -17.855 1.00 45.34 C ATOM 1278 OD1 ASN A 82 24.674 -10.246 -18.758 1.00 73.54 O ATOM 1279 ND2 ASN A 82 26.420 -11.481 -18.073 1.00 2.24 N ATOM 0 H ASN A 82 24.800 -11.005 -13.919 1.00 12.52 H new ATOM 0 HA ASN A 82 26.846 -10.304 -15.854 1.00 63.12 H new ATOM 0 HB2 ASN A 82 24.598 -11.743 -16.066 1.00 72.32 H new ATOM 0 HB3 ASN A 82 23.885 -10.172 -16.377 1.00 72.32 H new ATOM 0 HD21 ASN A 82 26.794 -11.559 -19.019 1.00 2.24 H new ATOM 0 HD22 ASN A 82 26.907 -11.925 -17.294 1.00 2.24 H new ATOM 1286 N ASN A 83 25.799 -7.955 -16.647 1.00 72.04 N ATOM 1287 CA ASN A 83 25.641 -6.511 -16.775 1.00 5.35 C ATOM 1288 C ASN A 83 24.189 -6.100 -16.552 1.00 21.01 C ATOM 1289 O ASN A 83 23.402 -6.032 -17.495 1.00 70.12 O ATOM 1290 CB ASN A 83 26.109 -6.045 -18.155 1.00 71.41 C ATOM 1291 CG ASN A 83 25.518 -6.878 -19.276 1.00 64.35 C ATOM 1292 OD1 ASN A 83 24.479 -6.534 -19.839 1.00 71.21 O ATOM 1293 ND2 ASN A 83 26.181 -7.981 -19.606 1.00 50.12 N ATOM 0 H ASN A 83 26.028 -8.433 -17.519 1.00 72.04 H new ATOM 0 HA ASN A 83 26.256 -6.035 -16.011 1.00 5.35 H new ATOM 0 HB2 ASN A 83 25.831 -5.001 -18.297 1.00 71.41 H new ATOM 0 HB3 ASN A 83 27.197 -6.095 -18.203 1.00 71.41 H new ATOM 0 HD21 ASN A 83 25.832 -8.581 -20.353 1.00 50.12 H new ATOM 0 HD22 ASN A 83 27.039 -8.228 -19.112 1.00 50.12 H new ATOM 1300 N GLU A 84 23.843 -5.827 -15.298 1.00 14.11 N ATOM 1301 CA GLU A 84 22.485 -5.423 -14.952 1.00 32.11 C ATOM 1302 C GLU A 84 22.026 -4.256 -15.821 1.00 41.14 C ATOM 1303 O GLU A 84 22.774 -3.305 -16.050 1.00 22.11 O ATOM 1304 CB GLU A 84 22.405 -5.035 -13.474 1.00 44.41 C ATOM 1305 CG GLU A 84 21.008 -4.648 -13.021 1.00 35.44 C ATOM 1306 CD GLU A 84 21.019 -3.640 -11.889 1.00 4.54 C ATOM 1307 OE1 GLU A 84 21.184 -4.058 -10.723 1.00 60.24 O ATOM 1308 OE2 GLU A 84 20.864 -2.432 -12.167 1.00 71.42 O ATOM 0 H GLU A 84 24.483 -5.878 -14.506 1.00 14.11 H new ATOM 0 HA GLU A 84 21.824 -6.271 -15.134 1.00 32.11 H new ATOM 0 HB2 GLU A 84 22.756 -5.871 -12.868 1.00 44.41 H new ATOM 0 HB3 GLU A 84 23.082 -4.201 -13.289 1.00 44.41 H new ATOM 0 HG2 GLU A 84 20.458 -4.233 -13.866 1.00 35.44 H new ATOM 0 HG3 GLU A 84 20.473 -5.542 -12.701 1.00 35.44 H new ATOM 1315 N LYS A 85 20.791 -4.335 -16.304 1.00 71.45 N ATOM 1316 CA LYS A 85 20.230 -3.287 -17.148 1.00 71.14 C ATOM 1317 C LYS A 85 18.777 -3.009 -16.777 1.00 12.11 C ATOM 1318 O LYS A 85 17.993 -3.933 -16.559 1.00 64.32 O ATOM 1319 CB LYS A 85 20.323 -3.686 -18.623 1.00 21.22 C ATOM 1320 CG LYS A 85 19.714 -5.044 -18.925 1.00 31.41 C ATOM 1321 CD LYS A 85 19.604 -5.286 -20.421 1.00 62.01 C ATOM 1322 CE LYS A 85 18.928 -6.615 -20.723 1.00 3.20 C ATOM 1323 NZ LYS A 85 17.444 -6.502 -20.692 1.00 12.34 N ATOM 0 H LYS A 85 20.159 -5.115 -16.125 1.00 71.45 H new ATOM 0 HA LYS A 85 20.809 -2.377 -16.987 1.00 71.14 H new ATOM 0 HB2 LYS A 85 19.822 -2.930 -19.228 1.00 21.22 H new ATOM 0 HB3 LYS A 85 21.371 -3.692 -18.924 1.00 21.22 H new ATOM 0 HG2 LYS A 85 20.324 -5.826 -18.473 1.00 31.41 H new ATOM 0 HG3 LYS A 85 18.725 -5.109 -18.471 1.00 31.41 H new ATOM 0 HD2 LYS A 85 19.038 -4.476 -20.881 1.00 62.01 H new ATOM 0 HD3 LYS A 85 20.599 -5.273 -20.867 1.00 62.01 H new ATOM 0 HE2 LYS A 85 19.245 -6.969 -21.704 1.00 3.20 H new ATOM 0 HE3 LYS A 85 19.251 -7.360 -19.996 1.00 3.20 H new ATOM 0 HZ1 LYS A 85 17.021 -7.428 -20.903 1.00 12.34 H new ATOM 0 HZ2 LYS A 85 17.139 -6.189 -19.748 1.00 12.34 H new ATOM 0 HZ3 LYS A 85 17.134 -5.810 -21.403 1.00 12.34 H new ATOM 1337 N VAL A 86 18.423 -1.730 -16.708 1.00 11.53 N ATOM 1338 CA VAL A 86 17.063 -1.330 -16.365 1.00 41.13 C ATOM 1339 C VAL A 86 16.117 -1.534 -17.543 1.00 62.23 C ATOM 1340 O VAL A 86 16.541 -1.539 -18.699 1.00 45.23 O ATOM 1341 CB VAL A 86 17.006 0.145 -15.925 1.00 34.24 C ATOM 1342 CG1 VAL A 86 15.654 0.465 -15.305 1.00 20.34 C ATOM 1343 CG2 VAL A 86 18.134 0.454 -14.953 1.00 1.44 C ATOM 0 H VAL A 86 19.059 -0.953 -16.885 1.00 11.53 H new ATOM 0 HA VAL A 86 16.747 -1.962 -15.535 1.00 41.13 H new ATOM 0 HB VAL A 86 17.133 0.775 -16.806 1.00 34.24 H new ATOM 0 HG11 VAL A 86 15.632 1.511 -15.000 1.00 20.34 H new ATOM 0 HG12 VAL A 86 14.866 0.283 -16.036 1.00 20.34 H new ATOM 0 HG13 VAL A 86 15.494 -0.170 -14.434 1.00 20.34 H new ATOM 0 HG21 VAL A 86 18.079 1.500 -14.652 1.00 1.44 H new ATOM 0 HG22 VAL A 86 18.040 -0.182 -14.073 1.00 1.44 H new ATOM 0 HG23 VAL A 86 19.093 0.265 -15.436 1.00 1.44 H new ATOM 1353 N ILE A 87 14.834 -1.702 -17.242 1.00 60.43 N ATOM 1354 CA ILE A 87 13.828 -1.905 -18.277 1.00 35.52 C ATOM 1355 C ILE A 87 12.432 -1.574 -17.759 1.00 1.12 C ATOM 1356 O ILE A 87 12.230 -1.395 -16.557 1.00 3.40 O ATOM 1357 CB ILE A 87 13.839 -3.355 -18.796 1.00 72.24 C ATOM 1358 CG1 ILE A 87 14.201 -4.322 -17.667 1.00 43.02 C ATOM 1359 CG2 ILE A 87 14.815 -3.495 -19.955 1.00 23.14 C ATOM 1360 CD1 ILE A 87 13.299 -4.205 -16.459 1.00 33.31 C ATOM 0 H ILE A 87 14.467 -1.702 -16.290 1.00 60.43 H new ATOM 0 HA ILE A 87 14.079 -1.232 -19.097 1.00 35.52 H new ATOM 0 HB ILE A 87 12.841 -3.604 -19.155 1.00 72.24 H new ATOM 0 HG12 ILE A 87 14.157 -5.343 -18.046 1.00 43.02 H new ATOM 0 HG13 ILE A 87 15.231 -4.140 -17.360 1.00 43.02 H new ATOM 0 HG21 ILE A 87 14.812 -4.525 -20.311 1.00 23.14 H new ATOM 0 HG22 ILE A 87 14.516 -2.830 -20.765 1.00 23.14 H new ATOM 0 HG23 ILE A 87 15.818 -3.230 -19.620 1.00 23.14 H new ATOM 0 HD11 ILE A 87 13.614 -4.920 -15.699 1.00 33.31 H new ATOM 0 HD12 ILE A 87 13.361 -3.195 -16.055 1.00 33.31 H new ATOM 0 HD13 ILE A 87 12.270 -4.416 -16.751 1.00 33.31 H new ATOM 1372 N LEU A 88 11.471 -1.495 -18.673 1.00 22.44 N ATOM 1373 CA LEU A 88 10.093 -1.187 -18.309 1.00 35.34 C ATOM 1374 C LEU A 88 9.601 -2.115 -17.202 1.00 70.34 C ATOM 1375 O LEU A 88 9.450 -1.703 -16.052 1.00 40.12 O ATOM 1376 CB LEU A 88 9.182 -1.307 -19.532 1.00 43.32 C ATOM 1377 CG LEU A 88 9.145 -0.094 -20.462 1.00 45.33 C ATOM 1378 CD1 LEU A 88 10.332 -0.114 -21.414 1.00 32.24 C ATOM 1379 CD2 LEU A 88 7.837 -0.057 -21.239 1.00 4.30 C ATOM 0 H LEU A 88 11.621 -1.640 -19.671 1.00 22.44 H new ATOM 0 HA LEU A 88 10.062 -0.162 -17.939 1.00 35.34 H new ATOM 0 HB2 LEU A 88 9.497 -2.175 -20.111 1.00 43.32 H new ATOM 0 HB3 LEU A 88 8.168 -1.506 -19.187 1.00 43.32 H new ATOM 0 HG LEU A 88 9.209 0.808 -19.853 1.00 45.33 H new ATOM 0 HD11 LEU A 88 10.289 0.757 -22.068 1.00 32.24 H new ATOM 0 HD12 LEU A 88 11.259 -0.091 -20.841 1.00 32.24 H new ATOM 0 HD13 LEU A 88 10.300 -1.022 -22.016 1.00 32.24 H new ATOM 0 HD21 LEU A 88 7.828 0.813 -21.896 1.00 4.30 H new ATOM 0 HD22 LEU A 88 7.743 -0.964 -21.837 1.00 4.30 H new ATOM 0 HD23 LEU A 88 7.001 0.006 -20.542 1.00 4.30 H new ATOM 1391 N LYS A 89 9.355 -3.372 -17.557 1.00 54.24 N ATOM 1392 CA LYS A 89 8.884 -4.361 -16.595 1.00 54.12 C ATOM 1393 C LYS A 89 9.400 -5.752 -16.948 1.00 75.24 C ATOM 1394 O LYS A 89 10.176 -5.917 -17.890 1.00 3.10 O ATOM 1395 CB LYS A 89 7.354 -4.369 -16.549 1.00 31.23 C ATOM 1396 CG LYS A 89 6.705 -4.502 -17.915 1.00 55.13 C ATOM 1397 CD LYS A 89 5.189 -4.546 -17.811 1.00 3.12 C ATOM 1398 CE LYS A 89 4.531 -4.373 -19.171 1.00 45.52 C ATOM 1399 NZ LYS A 89 4.936 -5.443 -20.124 1.00 24.34 N ATOM 0 H LYS A 89 9.474 -3.730 -18.505 1.00 54.24 H new ATOM 0 HA LYS A 89 9.270 -4.088 -15.613 1.00 54.12 H new ATOM 0 HB2 LYS A 89 7.022 -5.193 -15.917 1.00 31.23 H new ATOM 0 HB3 LYS A 89 7.008 -3.448 -16.080 1.00 31.23 H new ATOM 0 HG2 LYS A 89 7.003 -3.663 -18.544 1.00 55.13 H new ATOM 0 HG3 LYS A 89 7.064 -5.409 -18.402 1.00 55.13 H new ATOM 0 HD2 LYS A 89 4.881 -5.496 -17.375 1.00 3.12 H new ATOM 0 HD3 LYS A 89 4.847 -3.760 -17.138 1.00 3.12 H new ATOM 0 HE2 LYS A 89 3.447 -4.382 -19.054 1.00 45.52 H new ATOM 0 HE3 LYS A 89 4.799 -3.400 -19.583 1.00 45.52 H new ATOM 0 HZ1 LYS A 89 4.378 -5.359 -20.998 1.00 24.34 H new ATOM 0 HZ2 LYS A 89 5.947 -5.344 -20.348 1.00 24.34 H new ATOM 0 HZ3 LYS A 89 4.766 -6.374 -19.693 1.00 24.34 H new ATOM 1413 N LEU A 90 8.962 -6.751 -16.189 1.00 3.40 N ATOM 1414 CA LEU A 90 9.379 -8.129 -16.423 1.00 12.01 C ATOM 1415 C LEU A 90 9.050 -8.563 -17.848 1.00 3.31 C ATOM 1416 O LEU A 90 8.380 -7.842 -18.588 1.00 23.11 O ATOM 1417 CB LEU A 90 8.698 -9.065 -15.423 1.00 31.01 C ATOM 1418 CG LEU A 90 8.825 -8.679 -13.949 1.00 31.33 C ATOM 1419 CD1 LEU A 90 7.822 -9.452 -13.107 1.00 14.05 C ATOM 1420 CD2 LEU A 90 10.242 -8.926 -13.453 1.00 63.20 C ATOM 0 H LEU A 90 8.318 -6.632 -15.407 1.00 3.40 H new ATOM 0 HA LEU A 90 10.459 -8.184 -16.286 1.00 12.01 H new ATOM 0 HB2 LEU A 90 7.639 -9.122 -15.673 1.00 31.01 H new ATOM 0 HB3 LEU A 90 9.111 -10.065 -15.553 1.00 31.01 H new ATOM 0 HG LEU A 90 8.608 -7.615 -13.852 1.00 31.33 H new ATOM 0 HD11 LEU A 90 7.927 -9.164 -12.061 1.00 14.05 H new ATOM 0 HD12 LEU A 90 6.811 -9.225 -13.446 1.00 14.05 H new ATOM 0 HD13 LEU A 90 8.008 -10.521 -13.210 1.00 14.05 H new ATOM 0 HD21 LEU A 90 10.314 -8.646 -12.402 1.00 63.20 H new ATOM 0 HD22 LEU A 90 10.488 -9.982 -13.564 1.00 63.20 H new ATOM 0 HD23 LEU A 90 10.941 -8.327 -14.037 1.00 63.20 H new ATOM 1432 N ASP A 91 9.524 -9.745 -18.225 1.00 5.01 N ATOM 1433 CA ASP A 91 9.278 -10.277 -19.560 1.00 45.13 C ATOM 1434 C ASP A 91 8.389 -11.515 -19.497 1.00 3.21 C ATOM 1435 O ASP A 91 7.680 -11.832 -20.452 1.00 12.40 O ATOM 1436 CB ASP A 91 10.601 -10.618 -20.248 1.00 62.41 C ATOM 1437 CG ASP A 91 10.497 -10.570 -21.760 1.00 31.52 C ATOM 1438 OD1 ASP A 91 10.604 -9.463 -22.327 1.00 34.14 O ATOM 1439 OD2 ASP A 91 10.308 -11.640 -22.376 1.00 72.31 O ATOM 0 H ASP A 91 10.081 -10.353 -17.625 1.00 5.01 H new ATOM 0 HA ASP A 91 8.763 -9.511 -20.140 1.00 45.13 H new ATOM 0 HB2 ASP A 91 11.370 -9.919 -19.917 1.00 62.41 H new ATOM 0 HB3 ASP A 91 10.921 -11.613 -19.940 1.00 62.41 H new ATOM 1444 N TYR A 92 8.434 -12.211 -18.367 1.00 33.33 N ATOM 1445 CA TYR A 92 7.635 -13.417 -18.180 1.00 0.21 C ATOM 1446 C TYR A 92 6.728 -13.286 -16.960 1.00 41.21 C ATOM 1447 O TYR A 92 6.917 -12.402 -16.124 1.00 72.03 O ATOM 1448 CB TYR A 92 8.544 -14.637 -18.025 1.00 20.23 C ATOM 1449 CG TYR A 92 8.926 -15.279 -19.339 1.00 52.14 C ATOM 1450 CD1 TYR A 92 7.957 -15.795 -20.191 1.00 13.13 C ATOM 1451 CD2 TYR A 92 10.256 -15.368 -19.731 1.00 21.33 C ATOM 1452 CE1 TYR A 92 8.301 -16.383 -21.392 1.00 42.34 C ATOM 1453 CE2 TYR A 92 10.610 -15.953 -20.931 1.00 72.13 C ATOM 1454 CZ TYR A 92 9.629 -16.459 -21.758 1.00 71.34 C ATOM 1455 OH TYR A 92 9.976 -17.043 -22.955 1.00 40.23 O ATOM 0 H TYR A 92 9.015 -11.961 -17.567 1.00 33.33 H new ATOM 0 HA TYR A 92 7.009 -13.548 -19.063 1.00 0.21 H new ATOM 0 HB2 TYR A 92 9.451 -14.339 -17.499 1.00 20.23 H new ATOM 0 HB3 TYR A 92 8.042 -15.377 -17.401 1.00 20.23 H new ATOM 0 HD1 TYR A 92 6.916 -15.735 -19.909 1.00 13.13 H new ATOM 0 HD2 TYR A 92 11.027 -14.973 -19.086 1.00 21.33 H new ATOM 0 HE1 TYR A 92 7.535 -16.781 -22.041 1.00 42.34 H new ATOM 0 HE2 TYR A 92 11.649 -16.014 -21.220 1.00 72.13 H new ATOM 0 HH TYR A 92 10.950 -17.015 -23.063 1.00 40.23 H new ATOM 1465 N SER A 93 5.743 -14.173 -16.865 1.00 71.14 N ATOM 1466 CA SER A 93 4.804 -14.156 -15.750 1.00 74.12 C ATOM 1467 C SER A 93 5.220 -15.154 -14.674 1.00 2.12 C ATOM 1468 O SER A 93 4.965 -14.947 -13.487 1.00 51.44 O ATOM 1469 CB SER A 93 3.391 -14.478 -16.241 1.00 32.31 C ATOM 1470 OG SER A 93 3.150 -13.904 -17.514 1.00 32.31 O ATOM 0 H SER A 93 5.575 -14.913 -17.547 1.00 71.14 H new ATOM 0 HA SER A 93 4.812 -13.156 -15.316 1.00 74.12 H new ATOM 0 HB2 SER A 93 3.259 -15.559 -16.295 1.00 32.31 H new ATOM 0 HB3 SER A 93 2.660 -14.103 -15.525 1.00 32.31 H new ATOM 0 HG SER A 93 2.241 -14.126 -17.806 1.00 32.31 H new ATOM 1476 N ASP A 94 5.863 -16.237 -15.097 1.00 14.10 N ATOM 1477 CA ASP A 94 6.316 -17.268 -14.171 1.00 4.45 C ATOM 1478 C ASP A 94 7.752 -17.682 -14.479 1.00 73.13 C ATOM 1479 O ASP A 94 8.385 -17.139 -15.385 1.00 13.12 O ATOM 1480 CB ASP A 94 5.395 -18.486 -14.239 1.00 34.24 C ATOM 1481 CG ASP A 94 3.934 -18.118 -14.066 1.00 41.34 C ATOM 1482 OD1 ASP A 94 3.624 -17.338 -13.142 1.00 13.34 O ATOM 1483 OD2 ASP A 94 3.102 -18.609 -14.857 1.00 13.31 O ATOM 0 H ASP A 94 6.082 -16.423 -16.076 1.00 14.10 H new ATOM 0 HA ASP A 94 6.284 -16.855 -13.163 1.00 4.45 H new ATOM 0 HB2 ASP A 94 5.529 -18.986 -15.198 1.00 34.24 H new ATOM 0 HB3 ASP A 94 5.681 -19.198 -13.465 1.00 34.24 H new ATOM 1488 N PHE A 95 8.260 -18.647 -13.720 1.00 32.11 N ATOM 1489 CA PHE A 95 9.621 -19.133 -13.911 1.00 24.21 C ATOM 1490 C PHE A 95 9.639 -20.650 -14.077 1.00 1.13 C ATOM 1491 O PHE A 95 9.231 -21.387 -13.179 1.00 43.14 O ATOM 1492 CB PHE A 95 10.501 -18.728 -12.726 1.00 60.03 C ATOM 1493 CG PHE A 95 9.866 -18.991 -11.391 1.00 1.43 C ATOM 1494 CD1 PHE A 95 9.009 -18.062 -10.822 1.00 23.13 C ATOM 1495 CD2 PHE A 95 10.125 -20.166 -10.704 1.00 45.14 C ATOM 1496 CE1 PHE A 95 8.424 -18.301 -9.592 1.00 44.05 C ATOM 1497 CE2 PHE A 95 9.543 -20.410 -9.475 1.00 21.50 C ATOM 1498 CZ PHE A 95 8.691 -19.477 -8.919 1.00 34.11 C ATOM 0 H PHE A 95 7.749 -19.108 -12.967 1.00 32.11 H new ATOM 0 HA PHE A 95 10.017 -18.681 -14.820 1.00 24.21 H new ATOM 0 HB2 PHE A 95 11.445 -19.269 -12.783 1.00 60.03 H new ATOM 0 HB3 PHE A 95 10.737 -17.667 -12.805 1.00 60.03 H new ATOM 0 HD1 PHE A 95 8.796 -17.141 -11.345 1.00 23.13 H new ATOM 0 HD2 PHE A 95 10.790 -20.900 -11.134 1.00 45.14 H new ATOM 0 HE1 PHE A 95 7.759 -17.569 -9.158 1.00 44.05 H new ATOM 0 HE2 PHE A 95 9.754 -21.330 -8.950 1.00 21.50 H new ATOM 0 HZ PHE A 95 8.234 -19.666 -7.959 1.00 34.11 H new ATOM 1508 N GLN A 96 10.114 -21.108 -15.231 1.00 11.53 N ATOM 1509 CA GLN A 96 10.184 -22.536 -15.515 1.00 15.02 C ATOM 1510 C GLN A 96 11.625 -23.031 -15.467 1.00 44.23 C ATOM 1511 O GLN A 96 12.558 -22.284 -15.766 1.00 70.32 O ATOM 1512 CB GLN A 96 9.574 -22.835 -16.886 1.00 21.04 C ATOM 1513 CG GLN A 96 8.926 -24.207 -16.977 1.00 31.10 C ATOM 1514 CD GLN A 96 8.925 -24.759 -18.389 1.00 31.11 C ATOM 1515 OE1 GLN A 96 7.916 -24.694 -19.092 1.00 64.15 O ATOM 1516 NE2 GLN A 96 10.058 -25.307 -18.811 1.00 43.25 N ATOM 0 H GLN A 96 10.456 -20.511 -15.984 1.00 11.53 H new ATOM 0 HA GLN A 96 9.614 -23.062 -14.749 1.00 15.02 H new ATOM 0 HB2 GLN A 96 8.828 -22.074 -17.116 1.00 21.04 H new ATOM 0 HB3 GLN A 96 10.352 -22.759 -17.645 1.00 21.04 H new ATOM 0 HG2 GLN A 96 9.455 -24.899 -16.321 1.00 31.10 H new ATOM 0 HG3 GLN A 96 7.900 -24.145 -16.614 1.00 31.10 H new ATOM 0 HE21 GLN A 96 10.870 -25.339 -18.194 1.00 43.25 H new ATOM 0 HE22 GLN A 96 10.117 -25.696 -19.752 1.00 43.25 H new ATOM 1525 N ILE A 97 11.800 -24.293 -15.090 1.00 5.42 N ATOM 1526 CA ILE A 97 13.129 -24.887 -15.004 1.00 52.51 C ATOM 1527 C ILE A 97 13.525 -25.540 -16.324 1.00 32.55 C ATOM 1528 O ILE A 97 13.215 -26.706 -16.569 1.00 31.54 O ATOM 1529 CB ILE A 97 13.204 -25.937 -13.880 1.00 64.04 C ATOM 1530 CG1 ILE A 97 12.833 -25.306 -12.537 1.00 33.21 C ATOM 1531 CG2 ILE A 97 14.597 -26.547 -13.818 1.00 52.13 C ATOM 1532 CD1 ILE A 97 12.761 -26.302 -11.401 1.00 21.41 C ATOM 0 H ILE A 97 11.039 -24.924 -14.839 1.00 5.42 H new ATOM 0 HA ILE A 97 13.824 -24.078 -14.780 1.00 52.51 H new ATOM 0 HB ILE A 97 12.489 -26.731 -14.096 1.00 64.04 H new ATOM 0 HG12 ILE A 97 13.566 -24.538 -12.290 1.00 33.21 H new ATOM 0 HG13 ILE A 97 11.869 -24.807 -12.633 1.00 33.21 H new ATOM 0 HG21 ILE A 97 14.635 -27.287 -13.019 1.00 52.13 H new ATOM 0 HG22 ILE A 97 14.826 -27.028 -14.769 1.00 52.13 H new ATOM 0 HG23 ILE A 97 15.329 -25.763 -13.622 1.00 52.13 H new ATOM 0 HD11 ILE A 97 12.493 -25.785 -10.480 1.00 21.41 H new ATOM 0 HD12 ILE A 97 12.007 -27.056 -11.626 1.00 21.41 H new ATOM 0 HD13 ILE A 97 13.731 -26.784 -11.278 1.00 21.41 H new ATOM 1544 N VAL A 98 14.213 -24.782 -17.171 1.00 5.15 N ATOM 1545 CA VAL A 98 14.655 -25.288 -18.465 1.00 22.15 C ATOM 1546 C VAL A 98 15.477 -26.562 -18.305 1.00 21.12 C ATOM 1547 O VAL A 98 16.476 -26.584 -17.586 1.00 4.22 O ATOM 1548 CB VAL A 98 15.494 -24.240 -19.220 1.00 70.54 C ATOM 1549 CG1 VAL A 98 15.814 -24.726 -20.626 1.00 51.41 C ATOM 1550 CG2 VAL A 98 14.767 -22.905 -19.261 1.00 12.10 C ATOM 0 H VAL A 98 14.477 -23.815 -16.984 1.00 5.15 H new ATOM 0 HA VAL A 98 13.757 -25.509 -19.043 1.00 22.15 H new ATOM 0 HB VAL A 98 16.434 -24.099 -18.687 1.00 70.54 H new ATOM 0 HG11 VAL A 98 16.407 -23.973 -21.145 1.00 51.41 H new ATOM 0 HG12 VAL A 98 16.378 -25.657 -20.570 1.00 51.41 H new ATOM 0 HG13 VAL A 98 14.886 -24.897 -21.172 1.00 51.41 H new ATOM 0 HG21 VAL A 98 15.374 -22.176 -19.798 1.00 12.10 H new ATOM 0 HG22 VAL A 98 13.811 -23.027 -19.770 1.00 12.10 H new ATOM 0 HG23 VAL A 98 14.594 -22.554 -18.244 1.00 12.10 H new ATOM 1560 N LYS A 99 15.050 -27.624 -18.980 1.00 43.45 N ATOM 1561 CA LYS A 99 15.747 -28.903 -18.916 1.00 52.13 C ATOM 1562 C LYS A 99 17.162 -28.780 -19.471 1.00 64.20 C ATOM 1563 O LYS A 99 17.958 -29.715 -19.380 1.00 25.11 O ATOM 1564 CB LYS A 99 14.973 -29.968 -19.696 1.00 33.10 C ATOM 1565 CG LYS A 99 13.516 -30.087 -19.282 1.00 2.23 C ATOM 1566 CD LYS A 99 13.376 -30.747 -17.921 1.00 33.44 C ATOM 1567 CE LYS A 99 11.969 -30.585 -17.365 1.00 3.23 C ATOM 1568 NZ LYS A 99 10.959 -31.300 -18.193 1.00 43.32 N ATOM 0 H LYS A 99 14.224 -27.624 -19.578 1.00 43.45 H new ATOM 0 HA LYS A 99 15.811 -29.202 -17.870 1.00 52.13 H new ATOM 0 HB2 LYS A 99 15.022 -29.734 -20.760 1.00 33.10 H new ATOM 0 HB3 LYS A 99 15.461 -30.933 -19.559 1.00 33.10 H new ATOM 0 HG2 LYS A 99 13.062 -29.096 -19.255 1.00 2.23 H new ATOM 0 HG3 LYS A 99 12.971 -30.667 -20.027 1.00 2.23 H new ATOM 0 HD2 LYS A 99 13.616 -31.807 -18.003 1.00 33.44 H new ATOM 0 HD3 LYS A 99 14.095 -30.310 -17.228 1.00 33.44 H new ATOM 0 HE2 LYS A 99 11.936 -30.965 -16.344 1.00 3.23 H new ATOM 0 HE3 LYS A 99 11.717 -29.526 -17.319 1.00 3.23 H new ATOM 0 HZ1 LYS A 99 10.014 -31.165 -17.781 1.00 43.32 H new ATOM 0 HZ2 LYS A 99 10.972 -30.920 -19.161 1.00 43.32 H new ATOM 0 HZ3 LYS A 99 11.185 -32.315 -18.216 1.00 43.32 H new