USER MOD reduce.3.24.130724 H: found=0, std=0, add=786, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 785 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 57 SER OG : rot 180:sc= 0.194 USER MOD Set 1.2: A 58 LYS NZ :NH3+ 168:sc= 0.198 (180deg=0) USER MOD Set 2.1: A 51 LYS NZ :NH3+ -126:sc= 0.222 (180deg=-1.12) USER MOD Set 2.2: A 53 GLN : amide:sc= -2.05! K(o=-1.8!,f=-0.75) USER MOD Set 3.1: A 43 THR OG1 : rot -67:sc= 0.293 USER MOD Set 3.2: A 47 THR OG1 : rot 180:sc= 0 USER MOD Set 4.1: A 26 HIS : no HD1:sc= -0.22 K(o=-0.32,f=0.76) USER MOD Set 4.2: A 71 SER OG : rot 150:sc= -0.099 USER MOD Single : A 5 ASN : amide:sc= -0.142 K(o=-0.14,f=0.9) USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 180:sc= -0.151 USER MOD Single : A 12 TYR OH : rot 90:sc= -1.26 USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 GLN : amide:sc= -0.488 K(o=-0.49,f=-2.8!) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 THR OG1 : rot 180:sc= 0.0247 USER MOD Single : A 28 GLN : amide:sc= -1.85 K(o=-1.9,f=-1) USER MOD Single : A 32 LYS NZ :NH3+ -156:sc= -0.0778 (180deg=-0.731) USER MOD Single : A 33 LYS NZ :NH3+ -137:sc= -0.183 (180deg=-1.49!) USER MOD Single : A 41 GLN : amide:sc= 0 K(o=0,f=-0.65) USER MOD Single : A 42 ASN : amide:sc= -0.0449 K(o=-0.045,f=-2.2!) USER MOD Single : A 49 GLN : amide:sc= -1.32 K(o=-1.3,f=-2.1) USER MOD Single : A 62 MET CE :methyl -136:sc= -5.51! (180deg=-13.2!) USER MOD Single : A 63 GLN : amide:sc= -0.463 K(o=-0.46,f=-2.8!) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 THR OG1 : rot -50:sc= 1.03 USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 75 HIS : no HD1:sc= -0.13 X(o=-0.13,f=-0.00032) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 ASN : amide:sc= -0.983 X(o=-0.98,f=-0.82) USER MOD Single : A 82 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0429) USER MOD Single : A 83 ASN : amide:sc= 0 X(o=0,f=-0.047) USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) 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= -0.434 X(o=-0.43,f=-0.53) USER MOD Single : A 99 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0311) USER MOD ----------------------------------------------------------------- ATOM 40 N ASN A 5 5.783 -6.637 -9.510 1.00 32.21 N ATOM 41 CA ASN A 5 7.025 -7.369 -9.729 1.00 4.41 C ATOM 42 C ASN A 5 6.782 -8.612 -10.580 1.00 4.45 C ATOM 43 O ASN A 5 6.873 -9.739 -10.093 1.00 24.15 O ATOM 44 CB ASN A 5 7.650 -7.767 -8.390 1.00 74.21 C ATOM 45 CG ASN A 5 6.620 -8.284 -7.403 1.00 45.42 C ATOM 46 OD1 ASN A 5 6.119 -9.400 -7.540 1.00 13.54 O ATOM 47 ND2 ASN A 5 6.301 -7.471 -6.402 1.00 70.34 N ATOM 0 HA ASN A 5 7.714 -6.714 -10.263 1.00 4.41 H new ATOM 0 HB2 ASN A 5 8.405 -8.535 -8.558 1.00 74.21 H new ATOM 0 HB3 ASN A 5 8.161 -6.906 -7.960 1.00 74.21 H new ATOM 0 HD21 ASN A 5 5.615 -7.763 -5.706 1.00 70.34 H new ATOM 0 HD22 ASN A 5 6.742 -6.554 -6.329 1.00 70.34 H new ATOM 54 N THR A 6 6.473 -8.398 -11.855 1.00 31.22 N ATOM 55 CA THR A 6 6.216 -9.500 -12.774 1.00 2.14 C ATOM 56 C THR A 6 7.433 -9.783 -13.647 1.00 3.41 C ATOM 57 O THR A 6 7.466 -9.414 -14.822 1.00 23.32 O ATOM 58 CB THR A 6 5.006 -9.205 -13.680 1.00 32.44 C ATOM 59 OG1 THR A 6 3.958 -8.598 -12.915 1.00 70.44 O ATOM 60 CG2 THR A 6 4.493 -10.482 -14.329 1.00 54.30 C ATOM 0 H THR A 6 6.395 -7.472 -12.275 1.00 31.22 H new ATOM 0 HA THR A 6 5.998 -10.376 -12.164 1.00 2.14 H new ATOM 0 HB THR A 6 5.326 -8.520 -14.465 1.00 32.44 H new ATOM 0 HG1 THR A 6 3.193 -8.412 -13.498 1.00 70.44 H new ATOM 0 HG21 THR A 6 3.638 -10.249 -14.964 1.00 54.30 H new ATOM 0 HG22 THR A 6 5.284 -10.926 -14.933 1.00 54.30 H new ATOM 0 HG23 THR A 6 4.189 -11.187 -13.555 1.00 54.30 H new ATOM 68 N LEU A 7 8.432 -10.439 -13.067 1.00 1.32 N ATOM 69 CA LEU A 7 9.653 -10.772 -13.793 1.00 54.01 C ATOM 70 C LEU A 7 9.331 -11.506 -15.091 1.00 53.41 C ATOM 71 O LEU A 7 8.530 -12.441 -15.104 1.00 62.25 O ATOM 72 CB LEU A 7 10.569 -11.632 -12.922 1.00 24.14 C ATOM 73 CG LEU A 7 11.026 -11.005 -11.604 1.00 53.51 C ATOM 74 CD1 LEU A 7 11.926 -11.963 -10.840 1.00 1.20 C ATOM 75 CD2 LEU A 7 11.742 -9.687 -11.861 1.00 1.21 C ATOM 0 H LEU A 7 8.421 -10.751 -12.096 1.00 1.32 H new ATOM 0 HA LEU A 7 10.165 -9.842 -14.040 1.00 54.01 H new ATOM 0 HB2 LEU A 7 10.052 -12.565 -12.697 1.00 24.14 H new ATOM 0 HB3 LEU A 7 11.454 -11.890 -13.504 1.00 24.14 H new ATOM 0 HG LEU A 7 10.145 -10.804 -10.995 1.00 53.51 H new ATOM 0 HD11 LEU A 7 12.241 -11.499 -9.905 1.00 1.20 H new ATOM 0 HD12 LEU A 7 11.380 -12.881 -10.624 1.00 1.20 H new ATOM 0 HD13 LEU A 7 12.804 -12.197 -11.443 1.00 1.20 H new ATOM 0 HD21 LEU A 7 12.060 -9.255 -10.912 1.00 1.21 H new ATOM 0 HD22 LEU A 7 12.614 -9.864 -12.490 1.00 1.21 H new ATOM 0 HD23 LEU A 7 11.065 -8.997 -12.365 1.00 1.21 H new ATOM 87 N ILE A 8 9.961 -11.076 -16.179 1.00 73.12 N ATOM 88 CA ILE A 8 9.744 -11.695 -17.481 1.00 54.52 C ATOM 89 C ILE A 8 11.029 -11.717 -18.301 1.00 5.44 C ATOM 90 O ILE A 8 12.080 -11.273 -17.838 1.00 24.55 O ATOM 91 CB ILE A 8 8.652 -10.958 -18.279 1.00 40.55 C ATOM 92 CG1 ILE A 8 8.965 -9.462 -18.353 1.00 4.32 C ATOM 93 CG2 ILE A 8 7.287 -11.188 -17.648 1.00 23.01 C ATOM 94 CD1 ILE A 8 8.293 -8.760 -19.512 1.00 44.30 C ATOM 0 H ILE A 8 10.625 -10.302 -16.185 1.00 73.12 H new ATOM 0 HA ILE A 8 9.418 -12.718 -17.293 1.00 54.52 H new ATOM 0 HB ILE A 8 8.633 -11.357 -19.293 1.00 40.55 H new ATOM 0 HG12 ILE A 8 8.654 -8.988 -17.422 1.00 4.32 H new ATOM 0 HG13 ILE A 8 10.044 -9.328 -18.434 1.00 4.32 H new ATOM 0 HG21 ILE A 8 6.526 -10.661 -18.224 1.00 23.01 H new ATOM 0 HG22 ILE A 8 7.064 -12.255 -17.643 1.00 23.01 H new ATOM 0 HG23 ILE A 8 7.292 -10.814 -16.624 1.00 23.01 H new ATOM 0 HD11 ILE A 8 8.560 -7.703 -19.501 1.00 44.30 H new ATOM 0 HD12 ILE A 8 8.623 -9.208 -20.449 1.00 44.30 H new ATOM 0 HD13 ILE A 8 7.212 -8.862 -19.422 1.00 44.30 H new ATOM 106 N SER A 9 10.938 -12.234 -19.522 1.00 12.24 N ATOM 107 CA SER A 9 12.094 -12.316 -20.406 1.00 4.51 C ATOM 108 C SER A 9 11.667 -12.232 -21.868 1.00 62.11 C ATOM 109 O SER A 9 11.011 -13.135 -22.388 1.00 13.34 O ATOM 110 CB SER A 9 12.860 -13.617 -20.160 1.00 1.01 C ATOM 111 OG SER A 9 11.972 -14.689 -19.894 1.00 10.31 O ATOM 0 H SER A 9 10.075 -12.603 -19.922 1.00 12.24 H new ATOM 0 HA SER A 9 12.748 -11.472 -20.188 1.00 4.51 H new ATOM 0 HB2 SER A 9 13.470 -13.854 -21.032 1.00 1.01 H new ATOM 0 HB3 SER A 9 13.542 -13.488 -19.319 1.00 1.01 H new ATOM 0 HG SER A 9 12.486 -15.509 -19.742 1.00 10.31 H new ATOM 117 N VAL A 10 12.045 -11.141 -22.527 1.00 71.22 N ATOM 118 CA VAL A 10 11.703 -10.939 -23.930 1.00 13.41 C ATOM 119 C VAL A 10 12.880 -10.356 -24.704 1.00 54.40 C ATOM 120 O VAL A 10 13.455 -9.342 -24.308 1.00 50.33 O ATOM 121 CB VAL A 10 10.488 -10.003 -24.082 1.00 25.20 C ATOM 122 CG1 VAL A 10 10.756 -8.667 -23.406 1.00 52.13 C ATOM 123 CG2 VAL A 10 10.148 -9.808 -25.552 1.00 35.24 C ATOM 0 H VAL A 10 12.588 -10.384 -22.112 1.00 71.22 H new ATOM 0 HA VAL A 10 11.452 -11.918 -24.339 1.00 13.41 H new ATOM 0 HB VAL A 10 9.631 -10.465 -23.592 1.00 25.20 H new ATOM 0 HG11 VAL A 10 9.887 -8.019 -23.524 1.00 52.13 H new ATOM 0 HG12 VAL A 10 10.948 -8.828 -22.345 1.00 52.13 H new ATOM 0 HG13 VAL A 10 11.625 -8.195 -23.864 1.00 52.13 H new ATOM 0 HG21 VAL A 10 9.288 -9.145 -25.642 1.00 35.24 H new ATOM 0 HG22 VAL A 10 11.001 -9.367 -26.067 1.00 35.24 H new ATOM 0 HG23 VAL A 10 9.911 -10.772 -26.002 1.00 35.24 H new ATOM 133 N ASP A 11 13.232 -11.003 -25.809 1.00 41.33 N ATOM 134 CA ASP A 11 14.340 -10.548 -26.641 1.00 42.21 C ATOM 135 C ASP A 11 13.846 -10.127 -28.022 1.00 22.12 C ATOM 136 O ASP A 11 12.773 -10.541 -28.461 1.00 12.53 O ATOM 137 CB ASP A 11 15.391 -11.651 -26.776 1.00 50.10 C ATOM 138 CG ASP A 11 14.802 -12.953 -27.281 1.00 34.33 C ATOM 139 OD1 ASP A 11 14.033 -13.587 -26.528 1.00 22.40 O ATOM 140 OD2 ASP A 11 15.109 -13.339 -28.428 1.00 63.12 O ATOM 0 H ASP A 11 12.766 -11.844 -26.150 1.00 41.33 H new ATOM 0 HA ASP A 11 14.793 -9.682 -26.158 1.00 42.21 H new ATOM 0 HB2 ASP A 11 16.174 -11.321 -27.459 1.00 50.10 H new ATOM 0 HB3 ASP A 11 15.862 -11.820 -25.808 1.00 50.10 H new ATOM 145 N TYR A 12 14.636 -9.302 -28.701 1.00 34.33 N ATOM 146 CA TYR A 12 14.277 -8.823 -30.030 1.00 40.41 C ATOM 147 C TYR A 12 15.438 -8.066 -30.668 1.00 2.22 C ATOM 148 O TYR A 12 16.446 -7.791 -30.017 1.00 32.41 O ATOM 149 CB TYR A 12 13.045 -7.919 -29.954 1.00 43.10 C ATOM 150 CG TYR A 12 13.146 -6.846 -28.893 1.00 34.51 C ATOM 151 CD1 TYR A 12 14.086 -5.828 -28.993 1.00 34.23 C ATOM 152 CD2 TYR A 12 12.299 -6.851 -27.791 1.00 25.13 C ATOM 153 CE1 TYR A 12 14.181 -4.847 -28.025 1.00 42.01 C ATOM 154 CE2 TYR A 12 12.387 -5.873 -26.819 1.00 11.00 C ATOM 155 CZ TYR A 12 13.330 -4.873 -26.940 1.00 74.54 C ATOM 156 OH TYR A 12 13.421 -3.897 -25.975 1.00 53.01 O ATOM 0 H TYR A 12 15.528 -8.952 -28.353 1.00 34.33 H new ATOM 0 HA TYR A 12 14.046 -9.689 -30.650 1.00 40.41 H new ATOM 0 HB2 TYR A 12 12.891 -7.446 -30.924 1.00 43.10 H new ATOM 0 HB3 TYR A 12 12.166 -8.533 -29.756 1.00 43.10 H new ATOM 0 HD1 TYR A 12 14.754 -5.803 -29.842 1.00 34.23 H new ATOM 0 HD2 TYR A 12 11.560 -7.632 -27.693 1.00 25.13 H new ATOM 0 HE1 TYR A 12 14.918 -4.063 -28.117 1.00 42.01 H new ATOM 0 HE2 TYR A 12 11.721 -5.891 -25.969 1.00 11.00 H new ATOM 0 HH TYR A 12 12.835 -3.148 -26.211 1.00 53.01 H new ATOM 166 N GLU A 13 15.288 -7.731 -31.946 1.00 34.44 N ATOM 167 CA GLU A 13 16.323 -7.006 -32.672 1.00 24.40 C ATOM 168 C GLU A 13 15.763 -5.727 -33.287 1.00 32.21 C ATOM 169 O GLU A 13 15.309 -5.724 -34.432 1.00 0.44 O ATOM 170 CB GLU A 13 16.924 -7.891 -33.767 1.00 11.14 C ATOM 171 CG GLU A 13 15.883 -8.608 -34.610 1.00 15.44 C ATOM 172 CD GLU A 13 16.335 -8.817 -36.042 1.00 14.42 C ATOM 173 OE1 GLU A 13 17.268 -9.618 -36.258 1.00 11.13 O ATOM 174 OE2 GLU A 13 15.756 -8.179 -36.946 1.00 72.33 O ATOM 0 H GLU A 13 14.460 -7.950 -32.499 1.00 34.44 H new ATOM 0 HA GLU A 13 17.105 -6.735 -31.963 1.00 24.40 H new ATOM 0 HB2 GLU A 13 17.546 -7.277 -34.418 1.00 11.14 H new ATOM 0 HB3 GLU A 13 17.578 -8.631 -33.306 1.00 11.14 H new ATOM 0 HG2 GLU A 13 15.659 -9.575 -34.159 1.00 15.44 H new ATOM 0 HG3 GLU A 13 14.958 -8.032 -34.605 1.00 15.44 H new ATOM 181 N ILE A 14 15.798 -4.644 -32.518 1.00 55.14 N ATOM 182 CA ILE A 14 15.294 -3.359 -32.987 1.00 52.12 C ATOM 183 C ILE A 14 15.900 -2.990 -34.337 1.00 21.11 C ATOM 184 O ILE A 14 17.064 -3.285 -34.608 1.00 43.10 O ATOM 185 CB ILE A 14 15.593 -2.235 -31.978 1.00 44.30 C ATOM 186 CG1 ILE A 14 14.964 -2.557 -30.621 1.00 42.30 C ATOM 187 CG2 ILE A 14 15.081 -0.902 -32.503 1.00 1.34 C ATOM 188 CD1 ILE A 14 13.474 -2.808 -30.690 1.00 62.33 C ATOM 0 H ILE A 14 16.170 -4.631 -31.568 1.00 55.14 H new ATOM 0 HA ILE A 14 14.214 -3.463 -33.093 1.00 52.12 H new ATOM 0 HB ILE A 14 16.673 -2.161 -31.848 1.00 44.30 H new ATOM 0 HG12 ILE A 14 15.453 -3.436 -30.202 1.00 42.30 H new ATOM 0 HG13 ILE A 14 15.154 -1.730 -29.936 1.00 42.30 H new ATOM 0 HG21 ILE A 14 15.300 -0.117 -31.779 1.00 1.34 H new ATOM 0 HG22 ILE A 14 15.572 -0.670 -33.448 1.00 1.34 H new ATOM 0 HG23 ILE A 14 14.004 -0.962 -32.659 1.00 1.34 H new ATOM 0 HD11 ILE A 14 13.096 -3.030 -29.692 1.00 62.33 H new ATOM 0 HD12 ILE A 14 12.973 -1.921 -31.079 1.00 62.33 H new ATOM 0 HD13 ILE A 14 13.278 -3.654 -31.349 1.00 62.33 H new ATOM 200 N PHE A 15 15.103 -2.342 -35.180 1.00 4.42 N ATOM 201 CA PHE A 15 15.561 -1.931 -36.502 1.00 4.20 C ATOM 202 C PHE A 15 16.064 -0.490 -36.480 1.00 72.23 C ATOM 203 O PHE A 15 16.224 0.107 -35.417 1.00 10.03 O ATOM 204 CB PHE A 15 14.431 -2.073 -37.524 1.00 22.44 C ATOM 205 CG PHE A 15 13.637 -3.338 -37.366 1.00 34.22 C ATOM 206 CD1 PHE A 15 14.268 -4.537 -37.077 1.00 32.21 C ATOM 207 CD2 PHE A 15 12.258 -3.328 -37.507 1.00 62.00 C ATOM 208 CE1 PHE A 15 13.540 -5.703 -36.931 1.00 15.24 C ATOM 209 CE2 PHE A 15 11.525 -4.490 -37.362 1.00 33.35 C ATOM 210 CZ PHE A 15 12.166 -5.679 -37.074 1.00 62.42 C ATOM 0 H PHE A 15 14.137 -2.090 -34.971 1.00 4.42 H new ATOM 0 HA PHE A 15 16.387 -2.581 -36.791 1.00 4.20 H new ATOM 0 HB2 PHE A 15 13.760 -1.219 -37.434 1.00 22.44 H new ATOM 0 HB3 PHE A 15 14.854 -2.042 -38.528 1.00 22.44 H new ATOM 0 HD1 PHE A 15 15.342 -4.561 -36.964 1.00 32.21 H new ATOM 0 HD2 PHE A 15 11.751 -2.401 -37.733 1.00 62.00 H new ATOM 0 HE1 PHE A 15 14.044 -6.631 -36.706 1.00 15.24 H new ATOM 0 HE2 PHE A 15 10.451 -4.469 -37.474 1.00 33.35 H new ATOM 0 HZ PHE A 15 11.594 -6.588 -36.961 1.00 62.42 H new ATOM 220 N GLY A 16 16.311 0.062 -37.664 1.00 63.03 N ATOM 221 CA GLY A 16 16.794 1.427 -37.760 1.00 13.43 C ATOM 222 C GLY A 16 18.170 1.513 -38.389 1.00 1.43 C ATOM 223 O GLY A 16 18.670 0.535 -38.944 1.00 21.43 O ATOM 0 H GLY A 16 16.185 -0.412 -38.558 1.00 63.03 H new ATOM 0 HA2 GLY A 16 16.091 2.017 -38.349 1.00 13.43 H new ATOM 0 HA3 GLY A 16 16.825 1.869 -36.764 1.00 13.43 H new ATOM 227 N LYS A 17 18.785 2.688 -38.304 1.00 41.24 N ATOM 228 CA LYS A 17 20.112 2.900 -38.870 1.00 2.01 C ATOM 229 C LYS A 17 21.192 2.720 -37.807 1.00 55.41 C ATOM 230 O LYS A 17 22.265 3.316 -37.892 1.00 4.54 O ATOM 231 CB LYS A 17 20.211 4.300 -39.481 1.00 62.41 C ATOM 232 CG LYS A 17 19.975 5.418 -38.481 1.00 52.10 C ATOM 233 CD LYS A 17 20.683 6.696 -38.897 1.00 3.55 C ATOM 234 CE LYS A 17 22.121 6.724 -38.400 1.00 34.04 C ATOM 235 NZ LYS A 17 22.761 8.049 -38.628 1.00 21.23 N ATOM 0 H LYS A 17 18.385 3.508 -37.848 1.00 41.24 H new ATOM 0 HA LYS A 17 20.269 2.157 -39.652 1.00 2.01 H new ATOM 0 HB2 LYS A 17 21.198 4.424 -39.926 1.00 62.41 H new ATOM 0 HB3 LYS A 17 19.484 4.387 -40.289 1.00 62.41 H new ATOM 0 HG2 LYS A 17 18.905 5.607 -38.390 1.00 52.10 H new ATOM 0 HG3 LYS A 17 20.329 5.109 -37.498 1.00 52.10 H new ATOM 0 HD2 LYS A 17 20.671 6.783 -39.983 1.00 3.55 H new ATOM 0 HD3 LYS A 17 20.144 7.557 -38.502 1.00 3.55 H new ATOM 0 HE2 LYS A 17 22.142 6.489 -37.336 1.00 34.04 H new ATOM 0 HE3 LYS A 17 22.696 5.950 -38.909 1.00 34.04 H new ATOM 0 HZ1 LYS A 17 23.739 8.027 -38.276 1.00 21.23 H new ATOM 0 HZ2 LYS A 17 22.764 8.263 -39.646 1.00 21.23 H new ATOM 0 HZ3 LYS A 17 22.227 8.784 -38.122 1.00 21.23 H new ATOM 249 N VAL A 18 20.900 1.894 -36.808 1.00 12.15 N ATOM 250 CA VAL A 18 21.847 1.634 -35.730 1.00 35.04 C ATOM 251 C VAL A 18 23.172 1.115 -36.276 1.00 0.24 C ATOM 252 O VAL A 18 24.214 1.253 -35.635 1.00 70.24 O ATOM 253 CB VAL A 18 21.284 0.613 -34.723 1.00 11.23 C ATOM 254 CG1 VAL A 18 20.080 1.190 -33.993 1.00 45.20 C ATOM 255 CG2 VAL A 18 20.919 -0.684 -35.428 1.00 35.22 C ATOM 0 H VAL A 18 20.015 1.393 -36.722 1.00 12.15 H new ATOM 0 HA VAL A 18 22.014 2.583 -35.220 1.00 35.04 H new ATOM 0 HB VAL A 18 22.055 0.394 -33.985 1.00 11.23 H new ATOM 0 HG11 VAL A 18 19.696 0.454 -33.286 1.00 45.20 H new ATOM 0 HG12 VAL A 18 20.378 2.090 -33.455 1.00 45.20 H new ATOM 0 HG13 VAL A 18 19.302 1.440 -34.715 1.00 45.20 H new ATOM 0 HG21 VAL A 18 20.523 -1.394 -34.702 1.00 35.22 H new ATOM 0 HG22 VAL A 18 20.165 -0.485 -36.189 1.00 35.22 H new ATOM 0 HG23 VAL A 18 21.807 -1.105 -35.899 1.00 35.22 H new ATOM 265 N GLN A 19 23.124 0.519 -37.463 1.00 1.24 N ATOM 266 CA GLN A 19 24.322 -0.021 -38.095 1.00 1.52 C ATOM 267 C GLN A 19 25.396 1.054 -38.233 1.00 31.34 C ATOM 268 O GLN A 19 26.588 0.752 -38.281 1.00 75.13 O ATOM 269 CB GLN A 19 23.983 -0.598 -39.470 1.00 34.42 C ATOM 270 CG GLN A 19 23.327 0.404 -40.406 1.00 31.01 C ATOM 271 CD GLN A 19 24.333 1.148 -41.261 1.00 42.33 C ATOM 272 OE1 GLN A 19 25.498 0.760 -41.349 1.00 44.01 O ATOM 273 NE2 GLN A 19 23.888 2.225 -41.898 1.00 74.12 N ATOM 0 H GLN A 19 22.269 0.398 -38.006 1.00 1.24 H new ATOM 0 HA GLN A 19 24.710 -0.818 -37.460 1.00 1.52 H new ATOM 0 HB2 GLN A 19 24.896 -0.971 -39.933 1.00 34.42 H new ATOM 0 HB3 GLN A 19 23.318 -1.452 -39.342 1.00 34.42 H new ATOM 0 HG2 GLN A 19 22.621 -0.117 -41.053 1.00 31.01 H new ATOM 0 HG3 GLN A 19 22.753 1.121 -39.820 1.00 31.01 H new ATOM 0 HE21 GLN A 19 22.914 2.511 -41.797 1.00 74.12 H new ATOM 0 HE22 GLN A 19 24.520 2.766 -42.488 1.00 74.12 H new ATOM 282 N GLY A 20 24.965 2.310 -38.295 1.00 52.15 N ATOM 283 CA GLY A 20 25.902 3.410 -38.428 1.00 10.13 C ATOM 284 C GLY A 20 25.939 4.291 -37.195 1.00 4.31 C ATOM 285 O GLY A 20 25.382 5.389 -37.190 1.00 73.21 O ATOM 0 H GLY A 20 23.984 2.585 -38.255 1.00 52.15 H new ATOM 0 HA2 GLY A 20 26.899 3.013 -38.617 1.00 10.13 H new ATOM 0 HA3 GLY A 20 25.629 4.013 -39.294 1.00 10.13 H new ATOM 289 N VAL A 21 26.597 3.810 -36.145 1.00 24.10 N ATOM 290 CA VAL A 21 26.705 4.561 -34.900 1.00 50.10 C ATOM 291 C VAL A 21 27.598 3.838 -33.898 1.00 12.55 C ATOM 292 O VAL A 21 27.629 2.609 -33.852 1.00 25.51 O ATOM 293 CB VAL A 21 25.322 4.794 -34.264 1.00 13.40 C ATOM 294 CG1 VAL A 21 24.702 3.474 -33.833 1.00 24.30 C ATOM 295 CG2 VAL A 21 25.432 5.751 -33.086 1.00 71.31 C ATOM 0 H VAL A 21 27.064 2.903 -36.132 1.00 24.10 H new ATOM 0 HA VAL A 21 27.149 5.525 -35.149 1.00 50.10 H new ATOM 0 HB VAL A 21 24.670 5.247 -35.011 1.00 13.40 H new ATOM 0 HG11 VAL A 21 23.725 3.660 -33.386 1.00 24.30 H new ATOM 0 HG12 VAL A 21 24.586 2.826 -34.701 1.00 24.30 H new ATOM 0 HG13 VAL A 21 25.349 2.989 -33.102 1.00 24.30 H new ATOM 0 HG21 VAL A 21 24.446 5.904 -32.649 1.00 71.31 H new ATOM 0 HG22 VAL A 21 26.100 5.329 -32.335 1.00 71.31 H new ATOM 0 HG23 VAL A 21 25.829 6.706 -33.429 1.00 71.31 H new ATOM 305 N PHE A 22 28.322 4.611 -33.095 1.00 23.24 N ATOM 306 CA PHE A 22 29.217 4.044 -32.092 1.00 11.51 C ATOM 307 C PHE A 22 28.729 4.367 -30.683 1.00 14.42 C ATOM 308 O PHE A 22 29.460 4.943 -29.877 1.00 11.40 O ATOM 309 CB PHE A 22 30.638 4.578 -32.286 1.00 71.22 C ATOM 310 CG PHE A 22 31.416 3.842 -33.340 1.00 35.04 C ATOM 311 CD1 PHE A 22 31.271 4.166 -34.679 1.00 41.11 C ATOM 312 CD2 PHE A 22 32.291 2.827 -32.991 1.00 23.34 C ATOM 313 CE1 PHE A 22 31.985 3.490 -35.650 1.00 71.04 C ATOM 314 CE2 PHE A 22 33.008 2.147 -33.958 1.00 2.34 C ATOM 315 CZ PHE A 22 32.855 2.480 -35.289 1.00 45.32 C ATOM 0 H PHE A 22 28.307 5.631 -33.119 1.00 23.24 H new ATOM 0 HA PHE A 22 29.222 2.961 -32.217 1.00 11.51 H new ATOM 0 HB2 PHE A 22 30.588 5.633 -32.553 1.00 71.22 H new ATOM 0 HB3 PHE A 22 31.174 4.514 -31.339 1.00 71.22 H new ATOM 0 HD1 PHE A 22 30.593 4.955 -34.967 1.00 41.11 H new ATOM 0 HD2 PHE A 22 32.415 2.563 -31.951 1.00 23.34 H new ATOM 0 HE1 PHE A 22 31.863 3.751 -36.691 1.00 71.04 H new ATOM 0 HE2 PHE A 22 33.687 1.357 -33.673 1.00 2.34 H new ATOM 0 HZ PHE A 22 33.415 1.952 -36.047 1.00 45.32 H new ATOM 325 N PHE A 23 27.487 3.993 -30.393 1.00 70.30 N ATOM 326 CA PHE A 23 26.899 4.243 -29.082 1.00 41.33 C ATOM 327 C PHE A 23 26.325 2.960 -28.489 1.00 71.14 C ATOM 328 O PHE A 23 25.230 2.531 -28.853 1.00 15.40 O ATOM 329 CB PHE A 23 25.803 5.306 -29.186 1.00 73.52 C ATOM 330 CG PHE A 23 26.302 6.706 -28.973 1.00 24.32 C ATOM 331 CD1 PHE A 23 26.984 7.373 -29.978 1.00 20.11 C ATOM 332 CD2 PHE A 23 26.090 7.355 -27.767 1.00 41.04 C ATOM 333 CE1 PHE A 23 27.446 8.661 -29.784 1.00 14.04 C ATOM 334 CE2 PHE A 23 26.549 8.643 -27.567 1.00 40.55 C ATOM 335 CZ PHE A 23 27.227 9.298 -28.577 1.00 72.45 C ATOM 0 H PHE A 23 26.868 3.516 -31.048 1.00 70.30 H new ATOM 0 HA PHE A 23 27.686 4.606 -28.422 1.00 41.33 H new ATOM 0 HB2 PHE A 23 25.337 5.241 -30.169 1.00 73.52 H new ATOM 0 HB3 PHE A 23 25.028 5.090 -28.451 1.00 73.52 H new ATOM 0 HD1 PHE A 23 27.156 6.881 -30.924 1.00 20.11 H new ATOM 0 HD2 PHE A 23 25.560 6.848 -26.974 1.00 41.04 H new ATOM 0 HE1 PHE A 23 27.978 9.169 -30.575 1.00 14.04 H new ATOM 0 HE2 PHE A 23 26.378 9.137 -26.622 1.00 40.55 H new ATOM 0 HZ PHE A 23 27.585 10.305 -28.424 1.00 72.45 H new ATOM 345 N ARG A 24 27.073 2.351 -27.575 1.00 40.20 N ATOM 346 CA ARG A 24 26.640 1.116 -26.933 1.00 2.13 C ATOM 347 C ARG A 24 26.405 1.333 -25.441 1.00 20.33 C ATOM 348 O ARG A 24 25.621 0.619 -24.815 1.00 13.45 O ATOM 349 CB ARG A 24 27.682 0.016 -27.141 1.00 62.41 C ATOM 350 CG ARG A 24 27.981 -0.271 -28.604 1.00 33.54 C ATOM 351 CD ARG A 24 28.702 -1.599 -28.775 1.00 22.13 C ATOM 352 NE ARG A 24 30.120 -1.499 -28.440 1.00 42.42 N ATOM 353 CZ ARG A 24 30.984 -2.495 -28.596 1.00 25.32 C ATOM 354 NH1 ARG A 24 30.577 -3.661 -29.079 1.00 22.04 N ATOM 355 NH2 ARG A 24 32.259 -2.327 -28.269 1.00 3.24 N ATOM 0 H ARG A 24 27.982 2.693 -27.262 1.00 40.20 H new ATOM 0 HA ARG A 24 25.700 0.808 -27.391 1.00 2.13 H new ATOM 0 HB2 ARG A 24 28.606 0.303 -26.640 1.00 62.41 H new ATOM 0 HB3 ARG A 24 27.332 -0.899 -26.664 1.00 62.41 H new ATOM 0 HG2 ARG A 24 27.050 -0.286 -29.171 1.00 33.54 H new ATOM 0 HG3 ARG A 24 28.592 0.532 -29.016 1.00 33.54 H new ATOM 0 HD2 ARG A 24 28.232 -2.351 -28.141 1.00 22.13 H new ATOM 0 HD3 ARG A 24 28.596 -1.939 -29.805 1.00 22.13 H new ATOM 0 HE ARG A 24 30.466 -0.615 -28.066 1.00 42.42 H new ATOM 0 HH11 ARG A 24 29.598 -3.795 -29.332 1.00 22.04 H new ATOM 0 HH12 ARG A 24 31.243 -4.424 -29.198 1.00 22.04 H new ATOM 0 HH21 ARG A 24 32.576 -1.432 -27.897 1.00 3.24 H new ATOM 0 HH22 ARG A 24 32.922 -3.093 -28.389 1.00 3.24 H new ATOM 369 N LYS A 25 27.090 2.322 -24.877 1.00 20.55 N ATOM 370 CA LYS A 25 26.956 2.634 -23.459 1.00 23.14 C ATOM 371 C LYS A 25 25.598 3.262 -23.166 1.00 34.04 C ATOM 372 O LYS A 25 25.074 3.145 -22.057 1.00 23.30 O ATOM 373 CB LYS A 25 28.074 3.581 -23.016 1.00 50.13 C ATOM 374 CG LYS A 25 28.486 3.400 -21.566 1.00 25.12 C ATOM 375 CD LYS A 25 29.432 4.500 -21.113 1.00 54.22 C ATOM 376 CE LYS A 25 30.856 4.236 -21.576 1.00 4.35 C ATOM 377 NZ LYS A 25 31.671 5.483 -21.601 1.00 70.44 N ATOM 0 H LYS A 25 27.744 2.921 -25.381 1.00 20.55 H new ATOM 0 HA LYS A 25 27.034 1.702 -22.899 1.00 23.14 H new ATOM 0 HB2 LYS A 25 28.944 3.426 -23.654 1.00 50.13 H new ATOM 0 HB3 LYS A 25 27.748 4.610 -23.166 1.00 50.13 H new ATOM 0 HG2 LYS A 25 27.599 3.398 -20.932 1.00 25.12 H new ATOM 0 HG3 LYS A 25 28.968 2.430 -21.442 1.00 25.12 H new ATOM 0 HD2 LYS A 25 29.092 5.458 -21.506 1.00 54.22 H new ATOM 0 HD3 LYS A 25 29.410 4.576 -20.026 1.00 54.22 H new ATOM 0 HE2 LYS A 25 31.325 3.509 -20.913 1.00 4.35 H new ATOM 0 HE3 LYS A 25 30.838 3.794 -22.572 1.00 4.35 H new ATOM 0 HZ1 LYS A 25 32.635 5.261 -21.922 1.00 70.44 H new ATOM 0 HZ2 LYS A 25 31.238 6.168 -22.253 1.00 70.44 H new ATOM 0 HZ3 LYS A 25 31.710 5.892 -20.645 1.00 70.44 H new ATOM 391 N HIS A 26 25.030 3.928 -24.166 1.00 62.25 N ATOM 392 CA HIS A 26 23.731 4.573 -24.016 1.00 75.31 C ATOM 393 C HIS A 26 22.607 3.541 -24.037 1.00 14.12 C ATOM 394 O HIS A 26 21.533 3.765 -23.477 1.00 55.44 O ATOM 395 CB HIS A 26 23.516 5.600 -25.128 1.00 11.44 C ATOM 396 CG HIS A 26 22.488 6.637 -24.794 1.00 51.41 C ATOM 397 ND1 HIS A 26 22.682 7.608 -23.834 1.00 40.23 N ATOM 398 CD2 HIS A 26 21.251 6.853 -25.300 1.00 62.14 C ATOM 399 CE1 HIS A 26 21.609 8.375 -23.763 1.00 74.13 C ATOM 400 NE2 HIS A 26 20.726 7.938 -24.643 1.00 74.01 N ATOM 0 H HIS A 26 25.449 4.035 -25.090 1.00 62.25 H new ATOM 0 HA HIS A 26 23.715 5.083 -23.053 1.00 75.31 H new ATOM 0 HB2 HIS A 26 24.463 6.095 -25.343 1.00 11.44 H new ATOM 0 HB3 HIS A 26 23.214 5.081 -26.038 1.00 11.44 H new ATOM 0 HD2 HIS A 26 20.767 6.279 -26.076 1.00 62.14 H new ATOM 0 HE1 HIS A 26 21.476 9.216 -23.099 1.00 74.13 H new ATOM 0 HE2 HIS A 26 19.804 8.341 -24.808 1.00 74.01 H new ATOM 408 N THR A 27 22.860 2.409 -24.686 1.00 44.24 N ATOM 409 CA THR A 27 21.870 1.344 -24.782 1.00 1.21 C ATOM 410 C THR A 27 21.637 0.687 -23.426 1.00 64.35 C ATOM 411 O THR A 27 20.504 0.367 -23.069 1.00 22.42 O ATOM 412 CB THR A 27 22.300 0.267 -25.795 1.00 73.25 C ATOM 413 OG1 THR A 27 23.173 0.838 -26.777 1.00 33.55 O ATOM 414 CG2 THR A 27 21.088 -0.344 -26.482 1.00 75.30 C ATOM 0 H THR A 27 23.744 2.206 -25.154 1.00 44.24 H new ATOM 0 HA THR A 27 20.943 1.804 -25.124 1.00 1.21 H new ATOM 0 HB THR A 27 22.827 -0.519 -25.254 1.00 73.25 H new ATOM 0 HG1 THR A 27 23.443 0.146 -27.416 1.00 33.55 H new ATOM 0 HG21 THR A 27 21.416 -1.102 -27.193 1.00 75.30 H new ATOM 0 HG22 THR A 27 20.440 -0.803 -25.736 1.00 75.30 H new ATOM 0 HG23 THR A 27 20.538 0.435 -27.010 1.00 75.30 H new ATOM 422 N GLN A 28 22.717 0.489 -22.677 1.00 31.12 N ATOM 423 CA GLN A 28 22.629 -0.131 -21.360 1.00 33.01 C ATOM 424 C GLN A 28 22.190 0.883 -20.309 1.00 3.51 C ATOM 425 O GLN A 28 21.617 0.520 -19.282 1.00 63.14 O ATOM 426 CB GLN A 28 23.976 -0.739 -20.968 1.00 24.11 C ATOM 427 CG GLN A 28 25.123 0.259 -20.987 1.00 12.14 C ATOM 428 CD GLN A 28 26.176 -0.042 -19.939 1.00 20.22 C ATOM 429 OE1 GLN A 28 26.634 0.852 -19.227 1.00 51.31 O ATOM 430 NE2 GLN A 28 26.567 -1.307 -19.838 1.00 75.41 N ATOM 0 H GLN A 28 23.662 0.749 -22.959 1.00 31.12 H new ATOM 0 HA GLN A 28 21.882 -0.923 -21.409 1.00 33.01 H new ATOM 0 HB2 GLN A 28 23.895 -1.168 -19.969 1.00 24.11 H new ATOM 0 HB3 GLN A 28 24.207 -1.558 -21.649 1.00 24.11 H new ATOM 0 HG2 GLN A 28 25.586 0.255 -21.974 1.00 12.14 H new ATOM 0 HG3 GLN A 28 24.729 1.262 -20.823 1.00 12.14 H new ATOM 0 HE21 GLN A 28 26.161 -2.017 -20.448 1.00 75.41 H new ATOM 0 HE22 GLN A 28 27.273 -1.569 -19.150 1.00 75.41 H new ATOM 439 N ALA A 29 22.464 2.157 -20.573 1.00 30.04 N ATOM 440 CA ALA A 29 22.096 3.224 -19.650 1.00 43.13 C ATOM 441 C ALA A 29 20.601 3.201 -19.353 1.00 11.45 C ATOM 442 O ALA A 29 20.189 3.244 -18.194 1.00 23.23 O ATOM 443 CB ALA A 29 22.503 4.576 -20.218 1.00 71.11 C ATOM 0 H ALA A 29 22.939 2.475 -21.418 1.00 30.04 H new ATOM 0 HA ALA A 29 22.628 3.061 -18.713 1.00 43.13 H new ATOM 0 HB1 ALA A 29 22.222 5.364 -19.519 1.00 71.11 H new ATOM 0 HB2 ALA A 29 23.582 4.596 -20.373 1.00 71.11 H new ATOM 0 HB3 ALA A 29 21.997 4.738 -21.170 1.00 71.11 H new ATOM 449 N GLU A 30 19.793 3.135 -20.406 1.00 42.04 N ATOM 450 CA GLU A 30 18.343 3.108 -20.256 1.00 40.50 C ATOM 451 C GLU A 30 17.910 1.955 -19.356 1.00 64.40 C ATOM 452 O GLU A 30 16.910 2.048 -18.646 1.00 2.21 O ATOM 453 CB GLU A 30 17.668 2.983 -21.624 1.00 5.53 C ATOM 454 CG GLU A 30 17.328 4.321 -22.259 1.00 14.12 C ATOM 455 CD GLU A 30 16.453 5.183 -21.369 1.00 52.14 C ATOM 456 OE1 GLU A 30 15.440 4.667 -20.853 1.00 11.01 O ATOM 457 OE2 GLU A 30 16.782 6.374 -21.190 1.00 1.42 O ATOM 0 H GLU A 30 20.118 3.099 -21.372 1.00 42.04 H new ATOM 0 HA GLU A 30 18.035 4.044 -19.791 1.00 40.50 H new ATOM 0 HB2 GLU A 30 18.325 2.428 -22.294 1.00 5.53 H new ATOM 0 HB3 GLU A 30 16.754 2.398 -21.517 1.00 5.53 H new ATOM 0 HG2 GLU A 30 18.250 4.857 -22.485 1.00 14.12 H new ATOM 0 HG3 GLU A 30 16.819 4.150 -23.207 1.00 14.12 H new ATOM 464 N GLY A 31 18.672 0.865 -19.392 1.00 43.44 N ATOM 465 CA GLY A 31 18.352 -0.291 -18.577 1.00 30.51 C ATOM 466 C GLY A 31 18.682 -0.078 -17.113 1.00 31.21 C ATOM 467 O GLY A 31 18.078 -0.696 -16.236 1.00 20.22 O ATOM 0 H GLY A 31 19.505 0.763 -19.972 1.00 43.44 H new ATOM 0 HA2 GLY A 31 17.291 -0.520 -18.677 1.00 30.51 H new ATOM 0 HA3 GLY A 31 18.901 -1.156 -18.948 1.00 30.51 H new ATOM 471 N LYS A 32 19.645 0.798 -16.847 1.00 14.13 N ATOM 472 CA LYS A 32 20.055 1.092 -15.479 1.00 25.11 C ATOM 473 C LYS A 32 19.086 2.066 -14.817 1.00 44.51 C ATOM 474 O LYS A 32 18.710 1.893 -13.658 1.00 34.21 O ATOM 475 CB LYS A 32 21.471 1.674 -15.464 1.00 13.04 C ATOM 476 CG LYS A 32 22.501 0.785 -16.138 1.00 42.44 C ATOM 477 CD LYS A 32 23.888 0.996 -15.554 1.00 12.14 C ATOM 478 CE LYS A 32 24.136 0.081 -14.364 1.00 51.12 C ATOM 479 NZ LYS A 32 23.728 0.717 -13.081 1.00 33.31 N ATOM 0 H LYS A 32 20.156 1.317 -17.561 1.00 14.13 H new ATOM 0 HA LYS A 32 20.046 0.159 -14.915 1.00 25.11 H new ATOM 0 HB2 LYS A 32 21.461 2.645 -15.960 1.00 13.04 H new ATOM 0 HB3 LYS A 32 21.773 1.847 -14.431 1.00 13.04 H new ATOM 0 HG2 LYS A 32 22.212 -0.260 -16.023 1.00 42.44 H new ATOM 0 HG3 LYS A 32 22.520 0.995 -17.207 1.00 42.44 H new ATOM 0 HD2 LYS A 32 24.639 0.809 -16.321 1.00 12.14 H new ATOM 0 HD3 LYS A 32 24.000 2.035 -15.245 1.00 12.14 H new ATOM 0 HE2 LYS A 32 23.584 -0.849 -14.500 1.00 51.12 H new ATOM 0 HE3 LYS A 32 25.194 -0.179 -14.320 1.00 51.12 H new ATOM 0 HZ1 LYS A 32 24.255 0.284 -12.296 1.00 33.31 H new ATOM 0 HZ2 LYS A 32 23.935 1.735 -13.117 1.00 33.31 H new ATOM 0 HZ3 LYS A 32 22.708 0.576 -12.933 1.00 33.31 H new ATOM 493 N LYS A 33 18.685 3.091 -15.561 1.00 50.42 N ATOM 494 CA LYS A 33 17.757 4.093 -15.049 1.00 24.25 C ATOM 495 C LYS A 33 16.514 3.433 -14.462 1.00 75.43 C ATOM 496 O LYS A 33 15.919 3.940 -13.510 1.00 25.32 O ATOM 497 CB LYS A 33 17.356 5.063 -16.162 1.00 10.34 C ATOM 498 CG LYS A 33 16.452 6.189 -15.690 1.00 40.22 C ATOM 499 CD LYS A 33 17.209 7.190 -14.833 1.00 34.01 C ATOM 500 CE LYS A 33 17.895 8.247 -15.685 1.00 15.25 C ATOM 501 NZ LYS A 33 19.255 7.818 -16.112 1.00 51.11 N ATOM 0 H LYS A 33 18.988 3.250 -16.522 1.00 50.42 H new ATOM 0 HA LYS A 33 18.260 4.648 -14.257 1.00 24.25 H new ATOM 0 HB2 LYS A 33 18.257 5.491 -16.601 1.00 10.34 H new ATOM 0 HB3 LYS A 33 16.849 4.508 -16.951 1.00 10.34 H new ATOM 0 HG2 LYS A 33 16.023 6.698 -16.553 1.00 40.22 H new ATOM 0 HG3 LYS A 33 15.621 5.775 -15.119 1.00 40.22 H new ATOM 0 HD2 LYS A 33 16.520 7.671 -14.139 1.00 34.01 H new ATOM 0 HD3 LYS A 33 17.953 6.667 -14.232 1.00 34.01 H new ATOM 0 HE2 LYS A 33 17.287 8.455 -16.565 1.00 15.25 H new ATOM 0 HE3 LYS A 33 17.968 9.177 -15.121 1.00 15.25 H new ATOM 0 HZ1 LYS A 33 19.918 8.613 -16.011 1.00 51.11 H new ATOM 0 HZ2 LYS A 33 19.572 7.026 -15.518 1.00 51.11 H new ATOM 0 HZ3 LYS A 33 19.227 7.515 -17.107 1.00 51.11 H new ATOM 515 N LEU A 34 16.125 2.299 -15.036 1.00 23.14 N ATOM 516 CA LEU A 34 14.952 1.568 -14.569 1.00 24.15 C ATOM 517 C LEU A 34 15.347 0.488 -13.566 1.00 2.32 C ATOM 518 O LEU A 34 14.967 0.543 -12.397 1.00 52.22 O ATOM 519 CB LEU A 34 14.216 0.937 -15.751 1.00 61.44 C ATOM 520 CG LEU A 34 13.276 1.860 -16.527 1.00 44.13 C ATOM 521 CD1 LEU A 34 12.852 1.213 -17.836 1.00 63.44 C ATOM 522 CD2 LEU A 34 12.059 2.212 -15.685 1.00 73.21 C ATOM 0 H LEU A 34 16.605 1.866 -15.825 1.00 23.14 H new ATOM 0 HA LEU A 34 14.288 2.275 -14.071 1.00 24.15 H new ATOM 0 HB2 LEU A 34 14.957 0.540 -16.445 1.00 61.44 H new ATOM 0 HB3 LEU A 34 13.638 0.089 -15.383 1.00 61.44 H new ATOM 0 HG LEU A 34 13.812 2.781 -16.758 1.00 44.13 H new ATOM 0 HD11 LEU A 34 12.183 1.885 -18.374 1.00 63.44 H new ATOM 0 HD12 LEU A 34 13.733 1.013 -18.445 1.00 63.44 H new ATOM 0 HD13 LEU A 34 12.335 0.276 -17.628 1.00 63.44 H new ATOM 0 HD21 LEU A 34 11.401 2.870 -16.253 1.00 73.21 H new ATOM 0 HD22 LEU A 34 11.522 1.300 -15.422 1.00 73.21 H new ATOM 0 HD23 LEU A 34 12.380 2.719 -14.775 1.00 73.21 H new ATOM 534 N GLY A 35 16.115 -0.492 -14.031 1.00 60.43 N ATOM 535 CA GLY A 35 16.551 -1.570 -13.162 1.00 14.31 C ATOM 536 C GLY A 35 16.413 -2.932 -13.813 1.00 44.40 C ATOM 537 O GLY A 35 16.035 -3.905 -13.160 1.00 21.11 O ATOM 0 H GLY A 35 16.443 -0.559 -14.994 1.00 60.43 H new ATOM 0 HA2 GLY A 35 17.592 -1.408 -12.882 1.00 14.31 H new ATOM 0 HA3 GLY A 35 15.967 -1.550 -12.242 1.00 14.31 H new ATOM 541 N LEU A 36 16.719 -3.002 -15.104 1.00 4.12 N ATOM 542 CA LEU A 36 16.627 -4.255 -15.845 1.00 32.11 C ATOM 543 C LEU A 36 18.012 -4.758 -16.240 1.00 53.30 C ATOM 544 O LEU A 36 19.016 -4.082 -16.016 1.00 22.11 O ATOM 545 CB LEU A 36 15.764 -4.069 -17.094 1.00 73.10 C ATOM 546 CG LEU A 36 14.401 -3.410 -16.876 1.00 60.43 C ATOM 547 CD1 LEU A 36 13.602 -3.396 -18.170 1.00 45.55 C ATOM 548 CD2 LEU A 36 13.630 -4.131 -15.780 1.00 13.52 C ATOM 0 H LEU A 36 17.033 -2.206 -15.659 1.00 4.12 H new ATOM 0 HA LEU A 36 16.163 -4.998 -15.197 1.00 32.11 H new ATOM 0 HB2 LEU A 36 16.324 -3.470 -17.812 1.00 73.10 H new ATOM 0 HB3 LEU A 36 15.604 -5.046 -17.550 1.00 73.10 H new ATOM 0 HG LEU A 36 14.563 -2.379 -16.562 1.00 60.43 H new ATOM 0 HD11 LEU A 36 12.635 -2.923 -17.996 1.00 45.55 H new ATOM 0 HD12 LEU A 36 14.148 -2.836 -18.929 1.00 45.55 H new ATOM 0 HD13 LEU A 36 13.449 -4.419 -18.514 1.00 45.55 H new ATOM 0 HD21 LEU A 36 12.663 -3.649 -15.638 1.00 13.52 H new ATOM 0 HD22 LEU A 36 13.478 -5.172 -16.066 1.00 13.52 H new ATOM 0 HD23 LEU A 36 14.196 -4.090 -14.849 1.00 13.52 H new ATOM 560 N VAL A 37 18.057 -5.947 -16.831 1.00 65.34 N ATOM 561 CA VAL A 37 19.319 -6.539 -17.261 1.00 74.33 C ATOM 562 C VAL A 37 19.150 -7.302 -18.570 1.00 74.14 C ATOM 563 O VAL A 37 18.045 -7.405 -19.103 1.00 45.32 O ATOM 564 CB VAL A 37 19.883 -7.494 -16.193 1.00 24.12 C ATOM 565 CG1 VAL A 37 20.072 -6.765 -14.871 1.00 71.31 C ATOM 566 CG2 VAL A 37 18.972 -8.700 -16.021 1.00 11.21 C ATOM 0 H VAL A 37 17.235 -6.520 -17.023 1.00 65.34 H new ATOM 0 HA VAL A 37 20.020 -5.717 -17.410 1.00 74.33 H new ATOM 0 HB VAL A 37 20.858 -7.849 -16.527 1.00 24.12 H new ATOM 0 HG11 VAL A 37 20.471 -7.456 -14.128 1.00 71.31 H new ATOM 0 HG12 VAL A 37 20.768 -5.937 -15.008 1.00 71.31 H new ATOM 0 HG13 VAL A 37 19.112 -6.379 -14.528 1.00 71.31 H new ATOM 0 HG21 VAL A 37 19.387 -9.364 -15.262 1.00 11.21 H new ATOM 0 HG22 VAL A 37 17.982 -8.367 -15.710 1.00 11.21 H new ATOM 0 HG23 VAL A 37 18.894 -9.235 -16.968 1.00 11.21 H new ATOM 576 N GLY A 38 20.253 -7.837 -19.084 1.00 42.13 N ATOM 577 CA GLY A 38 20.206 -8.584 -20.327 1.00 70.33 C ATOM 578 C GLY A 38 21.505 -8.502 -21.103 1.00 44.44 C ATOM 579 O GLY A 38 22.552 -8.935 -20.622 1.00 61.40 O ATOM 0 H GLY A 38 21.179 -7.766 -18.661 1.00 42.13 H new ATOM 0 HA2 GLY A 38 19.981 -9.628 -20.111 1.00 70.33 H new ATOM 0 HA3 GLY A 38 19.393 -8.204 -20.945 1.00 70.33 H new ATOM 583 N TRP A 39 21.439 -7.945 -22.307 1.00 71.14 N ATOM 584 CA TRP A 39 22.620 -7.809 -23.152 1.00 52.15 C ATOM 585 C TRP A 39 22.305 -6.989 -24.399 1.00 25.10 C ATOM 586 O TRP A 39 21.158 -6.930 -24.842 1.00 65.23 O ATOM 587 CB TRP A 39 23.147 -9.188 -23.553 1.00 42.43 C ATOM 588 CG TRP A 39 22.215 -9.942 -24.452 1.00 35.13 C ATOM 589 CD1 TRP A 39 22.032 -9.749 -25.791 1.00 74.12 C ATOM 590 CD2 TRP A 39 21.336 -11.008 -24.074 1.00 64.24 C ATOM 591 NE1 TRP A 39 21.093 -10.631 -26.269 1.00 54.14 N ATOM 592 CE2 TRP A 39 20.652 -11.415 -25.236 1.00 55.33 C ATOM 593 CE3 TRP A 39 21.064 -11.660 -22.869 1.00 34.31 C ATOM 594 CZ2 TRP A 39 19.712 -12.442 -25.225 1.00 31.11 C ATOM 595 CZ3 TRP A 39 20.131 -12.679 -22.859 1.00 75.53 C ATOM 596 CH2 TRP A 39 19.464 -13.063 -24.031 1.00 3.01 C ATOM 0 H TRP A 39 20.581 -7.580 -22.720 1.00 71.14 H new ATOM 0 HA TRP A 39 23.387 -7.287 -22.580 1.00 52.15 H new ATOM 0 HB2 TRP A 39 24.108 -9.070 -24.054 1.00 42.43 H new ATOM 0 HB3 TRP A 39 23.327 -9.776 -22.653 1.00 42.43 H new ATOM 0 HD1 TRP A 39 22.549 -9.012 -26.387 1.00 74.12 H new ATOM 0 HE1 TRP A 39 20.776 -10.692 -27.236 1.00 54.14 H new ATOM 0 HE3 TRP A 39 21.574 -11.373 -21.961 1.00 34.31 H new ATOM 0 HZ2 TRP A 39 19.197 -12.738 -26.127 1.00 31.11 H new ATOM 0 HZ3 TRP A 39 19.912 -13.189 -21.932 1.00 75.53 H new ATOM 0 HH2 TRP A 39 18.741 -13.864 -23.991 1.00 3.01 H new ATOM 607 N VAL A 40 23.331 -6.357 -24.961 1.00 22.41 N ATOM 608 CA VAL A 40 23.164 -5.542 -26.158 1.00 11.22 C ATOM 609 C VAL A 40 24.366 -5.674 -27.086 1.00 23.33 C ATOM 610 O VAL A 40 25.511 -5.704 -26.634 1.00 15.44 O ATOM 611 CB VAL A 40 22.966 -4.056 -25.802 1.00 35.54 C ATOM 612 CG1 VAL A 40 24.236 -3.478 -25.197 1.00 34.04 C ATOM 613 CG2 VAL A 40 22.543 -3.266 -27.031 1.00 32.12 C ATOM 0 H VAL A 40 24.287 -6.394 -24.606 1.00 22.41 H new ATOM 0 HA VAL A 40 22.273 -5.909 -26.668 1.00 11.22 H new ATOM 0 HB VAL A 40 22.172 -3.981 -25.059 1.00 35.54 H new ATOM 0 HG11 VAL A 40 24.077 -2.428 -24.952 1.00 34.04 H new ATOM 0 HG12 VAL A 40 24.490 -4.028 -24.291 1.00 34.04 H new ATOM 0 HG13 VAL A 40 25.052 -3.564 -25.914 1.00 34.04 H new ATOM 0 HG21 VAL A 40 22.408 -2.219 -26.761 1.00 32.12 H new ATOM 0 HG22 VAL A 40 23.313 -3.347 -27.798 1.00 32.12 H new ATOM 0 HG23 VAL A 40 21.605 -3.666 -27.415 1.00 32.12 H new ATOM 623 N GLN A 41 24.098 -5.754 -28.385 1.00 42.40 N ATOM 624 CA GLN A 41 25.159 -5.883 -29.377 1.00 21.31 C ATOM 625 C GLN A 41 24.684 -5.413 -30.747 1.00 54.44 C ATOM 626 O GLN A 41 23.487 -5.409 -31.032 1.00 52.31 O ATOM 627 CB GLN A 41 25.634 -7.335 -29.460 1.00 2.03 C ATOM 628 CG GLN A 41 27.105 -7.474 -29.818 1.00 31.41 C ATOM 629 CD GLN A 41 27.452 -8.858 -30.330 1.00 61.23 C ATOM 630 OE1 GLN A 41 26.701 -9.813 -30.131 1.00 72.20 O ATOM 631 NE2 GLN A 41 28.596 -8.974 -30.995 1.00 52.12 N ATOM 0 H GLN A 41 23.156 -5.732 -28.775 1.00 42.40 H new ATOM 0 HA GLN A 41 25.991 -5.252 -29.065 1.00 21.31 H new ATOM 0 HB2 GLN A 41 25.454 -7.823 -28.502 1.00 2.03 H new ATOM 0 HB3 GLN A 41 25.036 -7.862 -30.203 1.00 2.03 H new ATOM 0 HG2 GLN A 41 27.362 -6.735 -30.577 1.00 31.41 H new ATOM 0 HG3 GLN A 41 27.711 -7.253 -28.940 1.00 31.41 H new ATOM 0 HE21 GLN A 41 29.188 -8.156 -31.137 1.00 52.12 H new ATOM 0 HE22 GLN A 41 28.882 -9.881 -31.364 1.00 52.12 H new ATOM 640 N ASN A 42 25.630 -5.016 -31.592 1.00 54.24 N ATOM 641 CA ASN A 42 25.307 -4.542 -32.933 1.00 52.14 C ATOM 642 C ASN A 42 25.719 -5.566 -33.986 1.00 72.32 C ATOM 643 O ASN A 42 26.895 -5.676 -34.336 1.00 55.01 O ATOM 644 CB ASN A 42 26.002 -3.206 -33.206 1.00 33.32 C ATOM 645 CG ASN A 42 25.237 -2.348 -34.195 1.00 62.02 C ATOM 646 OD1 ASN A 42 24.093 -2.646 -34.538 1.00 11.13 O ATOM 647 ND2 ASN A 42 25.868 -1.276 -34.660 1.00 5.04 N ATOM 0 H ASN A 42 26.626 -5.013 -31.372 1.00 54.24 H new ATOM 0 HA ASN A 42 24.228 -4.401 -32.991 1.00 52.14 H new ATOM 0 HB2 ASN A 42 26.117 -2.661 -32.269 1.00 33.32 H new ATOM 0 HB3 ASN A 42 27.005 -3.393 -33.591 1.00 33.32 H new ATOM 0 HD21 ASN A 42 25.404 -0.661 -35.329 1.00 5.04 H new ATOM 0 HD22 ASN A 42 26.816 -1.067 -34.348 1.00 5.04 H new ATOM 654 N THR A 43 24.742 -6.316 -34.489 1.00 44.52 N ATOM 655 CA THR A 43 25.003 -7.331 -35.501 1.00 75.33 C ATOM 656 C THR A 43 25.491 -6.701 -36.800 1.00 54.45 C ATOM 657 O THR A 43 25.567 -5.477 -36.917 1.00 62.54 O ATOM 658 CB THR A 43 23.744 -8.170 -35.792 1.00 55.33 C ATOM 659 OG1 THR A 43 22.781 -7.380 -36.500 1.00 5.42 O ATOM 660 CG2 THR A 43 23.129 -8.690 -34.501 1.00 44.33 C ATOM 0 H THR A 43 23.764 -6.239 -34.211 1.00 44.52 H new ATOM 0 HA THR A 43 25.781 -7.982 -35.102 1.00 75.33 H new ATOM 0 HB THR A 43 24.037 -9.022 -36.406 1.00 55.33 H new ATOM 0 HG1 THR A 43 22.448 -6.668 -35.915 1.00 5.42 H new ATOM 0 HG21 THR A 43 22.242 -9.279 -34.732 1.00 44.33 H new ATOM 0 HG22 THR A 43 23.854 -9.315 -33.979 1.00 44.33 H new ATOM 0 HG23 THR A 43 22.851 -7.849 -33.866 1.00 44.33 H new ATOM 668 N ASP A 44 25.819 -7.542 -37.774 1.00 60.43 N ATOM 669 CA ASP A 44 26.298 -7.067 -39.067 1.00 4.32 C ATOM 670 C ASP A 44 25.133 -6.810 -40.018 1.00 23.14 C ATOM 671 O ASP A 44 25.225 -5.973 -40.916 1.00 30.14 O ATOM 672 CB ASP A 44 27.261 -8.083 -39.683 1.00 4.30 C ATOM 673 CG ASP A 44 27.707 -7.687 -41.077 1.00 54.30 C ATOM 674 OD1 ASP A 44 28.127 -6.525 -41.258 1.00 41.34 O ATOM 675 OD2 ASP A 44 27.635 -8.539 -41.987 1.00 24.24 O ATOM 0 H ASP A 44 25.762 -8.557 -37.693 1.00 60.43 H new ATOM 0 HA ASP A 44 26.827 -6.127 -38.907 1.00 4.32 H new ATOM 0 HB2 ASP A 44 28.135 -8.186 -39.041 1.00 4.30 H new ATOM 0 HB3 ASP A 44 26.778 -9.059 -39.723 1.00 4.30 H new ATOM 680 N ARG A 45 24.039 -7.537 -39.814 1.00 42.42 N ATOM 681 CA ARG A 45 22.857 -7.389 -40.655 1.00 21.34 C ATOM 682 C ARG A 45 22.402 -5.934 -40.702 1.00 15.32 C ATOM 683 O ARG A 45 22.196 -5.371 -41.777 1.00 25.35 O ATOM 684 CB ARG A 45 21.722 -8.273 -40.135 1.00 21.52 C ATOM 685 CG ARG A 45 20.474 -8.236 -41.002 1.00 45.31 C ATOM 686 CD ARG A 45 20.720 -8.876 -42.359 1.00 40.25 C ATOM 687 NE ARG A 45 19.565 -8.745 -43.243 1.00 52.24 N ATOM 688 CZ ARG A 45 19.512 -9.263 -44.465 1.00 72.51 C ATOM 689 NH1 ARG A 45 20.543 -9.945 -44.945 1.00 41.31 N ATOM 690 NH2 ARG A 45 18.425 -9.102 -45.209 1.00 42.33 N ATOM 0 H ARG A 45 23.947 -8.234 -39.075 1.00 42.42 H new ATOM 0 HA ARG A 45 23.119 -7.702 -41.666 1.00 21.34 H new ATOM 0 HB2 ARG A 45 22.076 -9.302 -40.067 1.00 21.52 H new ATOM 0 HB3 ARG A 45 21.461 -7.958 -39.125 1.00 21.52 H new ATOM 0 HG2 ARG A 45 19.662 -8.757 -40.495 1.00 45.31 H new ATOM 0 HG3 ARG A 45 20.155 -7.203 -41.138 1.00 45.31 H new ATOM 0 HD2 ARG A 45 21.589 -8.412 -42.826 1.00 40.25 H new ATOM 0 HD3 ARG A 45 20.956 -9.932 -42.225 1.00 40.25 H new ATOM 0 HE ARG A 45 18.754 -8.227 -42.903 1.00 52.24 H new ATOM 0 HH11 ARG A 45 21.379 -10.073 -44.375 1.00 41.31 H new ATOM 0 HH12 ARG A 45 20.500 -10.342 -45.884 1.00 41.31 H new ATOM 0 HH21 ARG A 45 17.629 -8.580 -44.843 1.00 42.33 H new ATOM 0 HH22 ARG A 45 18.386 -9.500 -46.147 1.00 42.33 H new ATOM 704 N GLY A 46 22.245 -5.330 -39.528 1.00 14.43 N ATOM 705 CA GLY A 46 21.814 -3.946 -39.457 1.00 52.44 C ATOM 706 C GLY A 46 20.754 -3.721 -38.397 1.00 21.41 C ATOM 707 O GLY A 46 19.805 -2.965 -38.606 1.00 71.11 O ATOM 0 H GLY A 46 22.409 -5.775 -38.625 1.00 14.43 H new ATOM 0 HA2 GLY A 46 22.675 -3.311 -39.246 1.00 52.44 H new ATOM 0 HA3 GLY A 46 21.423 -3.640 -40.428 1.00 52.44 H new ATOM 711 N THR A 47 20.914 -4.382 -37.254 1.00 53.40 N ATOM 712 CA THR A 47 19.962 -4.253 -36.158 1.00 31.11 C ATOM 713 C THR A 47 20.644 -4.462 -34.810 1.00 54.54 C ATOM 714 O THR A 47 21.686 -5.111 -34.725 1.00 1.35 O ATOM 715 CB THR A 47 18.806 -5.261 -36.297 1.00 33.42 C ATOM 716 OG1 THR A 47 19.324 -6.594 -36.373 1.00 42.03 O ATOM 717 CG2 THR A 47 17.974 -4.964 -37.535 1.00 51.41 C ATOM 0 H THR A 47 21.694 -5.012 -37.064 1.00 53.40 H new ATOM 0 HA THR A 47 19.560 -3.241 -36.206 1.00 31.11 H new ATOM 0 HB THR A 47 18.167 -5.169 -35.419 1.00 33.42 H new ATOM 0 HG1 THR A 47 18.582 -7.229 -36.459 1.00 42.03 H new ATOM 0 HG21 THR A 47 17.164 -5.689 -37.612 1.00 51.41 H new ATOM 0 HG22 THR A 47 17.556 -3.960 -37.460 1.00 51.41 H new ATOM 0 HG23 THR A 47 18.605 -5.030 -38.422 1.00 51.41 H new ATOM 725 N VAL A 48 20.048 -3.907 -33.759 1.00 62.31 N ATOM 726 CA VAL A 48 20.597 -4.034 -32.414 1.00 65.25 C ATOM 727 C VAL A 48 20.010 -5.242 -31.693 1.00 10.44 C ATOM 728 O VAL A 48 18.811 -5.290 -31.419 1.00 1.00 O ATOM 729 CB VAL A 48 20.330 -2.769 -31.577 1.00 62.24 C ATOM 730 CG1 VAL A 48 21.050 -2.852 -30.240 1.00 12.02 C ATOM 731 CG2 VAL A 48 20.753 -1.525 -32.343 1.00 51.24 C ATOM 0 H VAL A 48 19.185 -3.365 -33.813 1.00 62.31 H new ATOM 0 HA VAL A 48 21.673 -4.168 -32.522 1.00 65.25 H new ATOM 0 HB VAL A 48 19.260 -2.702 -31.383 1.00 62.24 H new ATOM 0 HG11 VAL A 48 20.850 -1.950 -29.662 1.00 12.02 H new ATOM 0 HG12 VAL A 48 20.694 -3.722 -29.689 1.00 12.02 H new ATOM 0 HG13 VAL A 48 22.123 -2.944 -30.410 1.00 12.02 H new ATOM 0 HG21 VAL A 48 20.557 -0.640 -31.737 1.00 51.24 H new ATOM 0 HG22 VAL A 48 21.818 -1.582 -32.569 1.00 51.24 H new ATOM 0 HG23 VAL A 48 20.187 -1.460 -33.273 1.00 51.24 H new ATOM 741 N GLN A 49 20.863 -6.214 -31.387 1.00 11.14 N ATOM 742 CA GLN A 49 20.428 -7.422 -30.696 1.00 75.11 C ATOM 743 C GLN A 49 20.435 -7.218 -29.185 1.00 14.13 C ATOM 744 O GLN A 49 21.492 -7.074 -28.573 1.00 21.34 O ATOM 745 CB GLN A 49 21.329 -8.600 -31.068 1.00 24.43 C ATOM 746 CG GLN A 49 20.848 -9.375 -32.284 1.00 31.34 C ATOM 747 CD GLN A 49 21.671 -10.621 -32.545 1.00 33.51 C ATOM 748 OE1 GLN A 49 22.807 -10.737 -32.085 1.00 10.14 O ATOM 749 NE2 GLN A 49 21.100 -11.563 -33.287 1.00 61.12 N ATOM 0 H GLN A 49 21.859 -6.189 -31.607 1.00 11.14 H new ATOM 0 HA GLN A 49 19.407 -7.641 -31.009 1.00 75.11 H new ATOM 0 HB2 GLN A 49 22.336 -8.230 -31.259 1.00 24.43 H new ATOM 0 HB3 GLN A 49 21.395 -9.279 -30.218 1.00 24.43 H new ATOM 0 HG2 GLN A 49 19.805 -9.657 -32.141 1.00 31.34 H new ATOM 0 HG3 GLN A 49 20.887 -8.728 -33.161 1.00 31.34 H new ATOM 0 HE21 GLN A 49 20.156 -11.425 -33.648 1.00 61.12 H new ATOM 0 HE22 GLN A 49 21.605 -12.424 -33.496 1.00 61.12 H new ATOM 758 N GLY A 50 19.246 -7.206 -28.588 1.00 43.43 N ATOM 759 CA GLY A 50 19.138 -7.018 -27.153 1.00 43.34 C ATOM 760 C GLY A 50 17.795 -7.462 -26.610 1.00 20.32 C ATOM 761 O GLY A 50 16.822 -7.579 -27.356 1.00 24.13 O ATOM 0 H GLY A 50 18.356 -7.323 -29.073 1.00 43.43 H new ATOM 0 HA2 GLY A 50 19.930 -7.577 -26.656 1.00 43.34 H new ATOM 0 HA3 GLY A 50 19.293 -5.966 -26.915 1.00 43.34 H new ATOM 765 N LYS A 51 17.740 -7.713 -25.306 1.00 73.02 N ATOM 766 CA LYS A 51 16.506 -8.148 -24.662 1.00 22.11 C ATOM 767 C LYS A 51 16.216 -7.311 -23.420 1.00 43.13 C ATOM 768 O LYS A 51 17.025 -6.471 -23.022 1.00 60.34 O ATOM 769 CB LYS A 51 16.599 -9.628 -24.282 1.00 4.30 C ATOM 770 CG LYS A 51 17.660 -9.921 -23.236 1.00 25.25 C ATOM 771 CD LYS A 51 17.042 -10.178 -21.871 1.00 43.14 C ATOM 772 CE LYS A 51 16.731 -11.653 -21.669 1.00 50.02 C ATOM 773 NZ LYS A 51 15.509 -11.854 -20.842 1.00 2.42 N ATOM 0 H LYS A 51 18.536 -7.623 -24.674 1.00 73.02 H new ATOM 0 HA LYS A 51 15.689 -8.011 -25.370 1.00 22.11 H new ATOM 0 HB2 LYS A 51 15.630 -9.960 -23.908 1.00 4.30 H new ATOM 0 HB3 LYS A 51 16.812 -10.212 -25.177 1.00 4.30 H new ATOM 0 HG2 LYS A 51 18.243 -10.790 -23.542 1.00 25.25 H new ATOM 0 HG3 LYS A 51 18.350 -9.080 -23.171 1.00 25.25 H new ATOM 0 HD2 LYS A 51 17.725 -9.839 -21.092 1.00 43.14 H new ATOM 0 HD3 LYS A 51 16.127 -9.595 -21.769 1.00 43.14 H new ATOM 0 HE2 LYS A 51 16.596 -12.132 -22.639 1.00 50.02 H new ATOM 0 HE3 LYS A 51 17.579 -12.140 -21.188 1.00 50.02 H new ATOM 0 HZ1 LYS A 51 15.732 -12.476 -20.039 1.00 2.42 H new ATOM 0 HZ2 LYS A 51 15.175 -10.935 -20.487 1.00 2.42 H new ATOM 0 HZ3 LYS A 51 14.765 -12.292 -21.422 1.00 2.42 H new ATOM 787 N LEU A 52 15.059 -7.545 -22.811 1.00 62.43 N ATOM 788 CA LEU A 52 14.663 -6.814 -21.613 1.00 2.40 C ATOM 789 C LEU A 52 14.325 -7.773 -20.476 1.00 53.42 C ATOM 790 O LEU A 52 13.188 -8.227 -20.353 1.00 55.33 O ATOM 791 CB LEU A 52 13.461 -5.916 -21.913 1.00 64.24 C ATOM 792 CG LEU A 52 13.670 -4.855 -22.995 1.00 34.25 C ATOM 793 CD1 LEU A 52 12.377 -4.097 -23.254 1.00 42.21 C ATOM 794 CD2 LEU A 52 14.781 -3.896 -22.594 1.00 24.51 C ATOM 0 H LEU A 52 14.378 -8.236 -23.127 1.00 62.43 H new ATOM 0 HA LEU A 52 15.503 -6.193 -21.302 1.00 2.40 H new ATOM 0 HB2 LEU A 52 12.625 -6.549 -22.210 1.00 64.24 H new ATOM 0 HB3 LEU A 52 13.169 -5.413 -20.991 1.00 64.24 H new ATOM 0 HG LEU A 52 13.965 -5.356 -23.917 1.00 34.25 H new ATOM 0 HD11 LEU A 52 12.544 -3.346 -24.026 1.00 42.21 H new ATOM 0 HD12 LEU A 52 11.607 -4.794 -23.585 1.00 42.21 H new ATOM 0 HD13 LEU A 52 12.052 -3.607 -22.336 1.00 42.21 H new ATOM 0 HD21 LEU A 52 14.916 -3.148 -23.375 1.00 24.51 H new ATOM 0 HD22 LEU A 52 14.515 -3.401 -21.660 1.00 24.51 H new ATOM 0 HD23 LEU A 52 15.709 -4.451 -22.459 1.00 24.51 H new ATOM 806 N GLN A 53 15.319 -8.074 -19.647 1.00 70.24 N ATOM 807 CA GLN A 53 15.125 -8.978 -18.520 1.00 23.03 C ATOM 808 C GLN A 53 14.732 -8.206 -17.265 1.00 23.05 C ATOM 809 O GLN A 53 15.426 -7.278 -16.852 1.00 4.13 O ATOM 810 CB GLN A 53 16.400 -9.783 -18.260 1.00 34.24 C ATOM 811 CG GLN A 53 16.189 -10.975 -17.340 1.00 70.42 C ATOM 812 CD GLN A 53 17.129 -12.124 -17.649 1.00 3.31 C ATOM 813 OE1 GLN A 53 16.762 -13.073 -18.341 1.00 72.33 O ATOM 814 NE2 GLN A 53 18.351 -12.043 -17.136 1.00 4.23 N ATOM 0 H GLN A 53 16.266 -7.705 -19.734 1.00 70.24 H new ATOM 0 HA GLN A 53 14.316 -9.664 -18.771 1.00 23.03 H new ATOM 0 HB2 GLN A 53 16.798 -10.135 -19.212 1.00 34.24 H new ATOM 0 HB3 GLN A 53 17.152 -9.126 -17.823 1.00 34.24 H new ATOM 0 HG2 GLN A 53 16.333 -10.661 -16.306 1.00 70.42 H new ATOM 0 HG3 GLN A 53 15.159 -11.320 -17.428 1.00 70.42 H new ATOM 0 HE21 GLN A 53 18.613 -11.238 -16.568 1.00 4.23 H new ATOM 0 HE22 GLN A 53 19.028 -12.786 -17.310 1.00 4.23 H new ATOM 823 N GLY A 54 13.613 -8.596 -16.662 1.00 23.25 N ATOM 824 CA GLY A 54 13.147 -7.930 -15.460 1.00 0.33 C ATOM 825 C GLY A 54 11.634 -7.876 -15.376 1.00 65.20 C ATOM 826 O GLY A 54 10.925 -8.499 -16.167 1.00 3.41 O ATOM 0 H GLY A 54 13.021 -9.361 -16.985 1.00 23.25 H new ATOM 0 HA2 GLY A 54 13.538 -8.450 -14.585 1.00 0.33 H new ATOM 0 HA3 GLY A 54 13.546 -6.916 -15.432 1.00 0.33 H new ATOM 830 N PRO A 55 11.119 -7.119 -14.397 1.00 15.42 N ATOM 831 CA PRO A 55 9.675 -6.969 -14.189 1.00 22.35 C ATOM 832 C PRO A 55 9.010 -6.161 -15.298 1.00 20.53 C ATOM 833 O PRO A 55 9.605 -5.231 -15.842 1.00 53.05 O ATOM 834 CB PRO A 55 9.585 -6.223 -12.855 1.00 55.23 C ATOM 835 CG PRO A 55 10.874 -5.484 -12.746 1.00 72.32 C ATOM 836 CD PRO A 55 11.904 -6.349 -13.418 1.00 24.13 C ATOM 0 HA PRO A 55 9.161 -7.930 -14.191 1.00 22.35 H new ATOM 0 HB2 PRO A 55 8.735 -5.541 -12.840 1.00 55.23 H new ATOM 0 HB3 PRO A 55 9.454 -6.915 -12.023 1.00 55.23 H new ATOM 0 HG2 PRO A 55 10.807 -4.509 -13.229 1.00 72.32 H new ATOM 0 HG3 PRO A 55 11.135 -5.305 -11.703 1.00 72.32 H new ATOM 0 HD2 PRO A 55 12.676 -5.751 -13.903 1.00 24.13 H new ATOM 0 HD3 PRO A 55 12.408 -7.001 -12.705 1.00 24.13 H new ATOM 844 N ILE A 56 7.774 -6.523 -15.627 1.00 3.54 N ATOM 845 CA ILE A 56 7.029 -5.830 -16.670 1.00 13.52 C ATOM 846 C ILE A 56 6.868 -4.349 -16.340 1.00 22.40 C ATOM 847 O ILE A 56 6.774 -3.510 -17.235 1.00 43.04 O ATOM 848 CB ILE A 56 5.635 -6.452 -16.874 1.00 61.41 C ATOM 849 CG1 ILE A 56 5.763 -7.930 -17.249 1.00 70.30 C ATOM 850 CG2 ILE A 56 4.867 -5.693 -17.946 1.00 24.02 C ATOM 851 CD1 ILE A 56 4.498 -8.725 -17.014 1.00 34.12 C ATOM 0 H ILE A 56 7.268 -7.292 -15.186 1.00 3.54 H new ATOM 0 HA ILE A 56 7.604 -5.935 -17.590 1.00 13.52 H new ATOM 0 HB ILE A 56 5.081 -6.380 -15.938 1.00 61.41 H new ATOM 0 HG12 ILE A 56 6.041 -8.007 -18.300 1.00 70.30 H new ATOM 0 HG13 ILE A 56 6.574 -8.374 -16.672 1.00 70.30 H new ATOM 0 HG21 ILE A 56 3.884 -6.145 -18.078 1.00 24.02 H new ATOM 0 HG22 ILE A 56 4.750 -4.653 -17.642 1.00 24.02 H new ATOM 0 HG23 ILE A 56 5.416 -5.737 -18.887 1.00 24.02 H new ATOM 0 HD11 ILE A 56 4.662 -9.763 -17.302 1.00 34.12 H new ATOM 0 HD12 ILE A 56 4.230 -8.679 -15.958 1.00 34.12 H new ATOM 0 HD13 ILE A 56 3.689 -8.306 -17.612 1.00 34.12 H new ATOM 863 N SER A 57 6.839 -4.036 -15.049 1.00 24.35 N ATOM 864 CA SER A 57 6.688 -2.657 -14.600 1.00 25.15 C ATOM 865 C SER A 57 7.716 -1.752 -15.272 1.00 11.53 C ATOM 866 O SER A 57 7.466 -0.566 -15.493 1.00 25.32 O ATOM 867 CB SER A 57 6.836 -2.574 -13.079 1.00 63.41 C ATOM 868 OG SER A 57 7.340 -1.310 -12.684 1.00 31.34 O ATOM 0 H SER A 57 6.918 -4.719 -14.295 1.00 24.35 H new ATOM 0 HA SER A 57 5.691 -2.317 -14.880 1.00 25.15 H new ATOM 0 HB2 SER A 57 5.869 -2.747 -12.606 1.00 63.41 H new ATOM 0 HB3 SER A 57 7.506 -3.361 -12.732 1.00 63.41 H new ATOM 0 HG SER A 57 7.424 -1.282 -11.708 1.00 31.34 H new ATOM 874 N LYS A 58 8.873 -2.318 -15.595 1.00 24.52 N ATOM 875 CA LYS A 58 9.940 -1.565 -16.243 1.00 63.20 C ATOM 876 C LYS A 58 9.999 -1.879 -17.735 1.00 22.04 C ATOM 877 O LYS A 58 10.245 -0.995 -18.556 1.00 35.41 O ATOM 878 CB LYS A 58 11.287 -1.884 -15.590 1.00 62.43 C ATOM 879 CG LYS A 58 11.558 -1.081 -14.330 1.00 71.01 C ATOM 880 CD LYS A 58 10.830 -1.663 -13.130 1.00 71.53 C ATOM 881 CE LYS A 58 10.936 -0.752 -11.917 1.00 41.14 C ATOM 882 NZ LYS A 58 9.945 0.358 -11.969 1.00 50.34 N ATOM 0 H LYS A 58 9.096 -3.297 -15.418 1.00 24.52 H new ATOM 0 HA LYS A 58 9.727 -0.503 -16.121 1.00 63.20 H new ATOM 0 HB2 LYS A 58 11.321 -2.946 -15.348 1.00 62.43 H new ATOM 0 HB3 LYS A 58 12.084 -1.695 -16.309 1.00 62.43 H new ATOM 0 HG2 LYS A 58 12.630 -1.063 -14.133 1.00 71.01 H new ATOM 0 HG3 LYS A 58 11.244 -0.048 -14.481 1.00 71.01 H new ATOM 0 HD2 LYS A 58 9.780 -1.817 -13.380 1.00 71.53 H new ATOM 0 HD3 LYS A 58 11.247 -2.641 -12.889 1.00 71.53 H new ATOM 0 HE2 LYS A 58 10.780 -1.336 -11.010 1.00 41.14 H new ATOM 0 HE3 LYS A 58 11.943 -0.338 -11.861 1.00 41.14 H new ATOM 0 HZ1 LYS A 58 9.907 0.833 -11.045 1.00 50.34 H new ATOM 0 HZ2 LYS A 58 10.229 1.043 -12.699 1.00 50.34 H new ATOM 0 HZ3 LYS A 58 9.006 -0.025 -12.200 1.00 50.34 H new ATOM 896 N VAL A 59 9.771 -3.143 -18.078 1.00 42.34 N ATOM 897 CA VAL A 59 9.796 -3.572 -19.471 1.00 72.34 C ATOM 898 C VAL A 59 8.852 -2.731 -20.323 1.00 1.51 C ATOM 899 O VAL A 59 9.135 -2.448 -21.487 1.00 63.22 O ATOM 900 CB VAL A 59 9.407 -5.056 -19.608 1.00 31.40 C ATOM 901 CG1 VAL A 59 9.490 -5.499 -21.061 1.00 10.21 C ATOM 902 CG2 VAL A 59 10.294 -5.923 -18.727 1.00 2.53 C ATOM 0 H VAL A 59 9.567 -3.887 -17.411 1.00 42.34 H new ATOM 0 HA VAL A 59 10.818 -3.437 -19.825 1.00 72.34 H new ATOM 0 HB VAL A 59 8.376 -5.175 -19.275 1.00 31.40 H new ATOM 0 HG11 VAL A 59 9.212 -6.550 -21.137 1.00 10.21 H new ATOM 0 HG12 VAL A 59 8.809 -4.898 -21.664 1.00 10.21 H new ATOM 0 HG13 VAL A 59 10.509 -5.366 -21.424 1.00 10.21 H new ATOM 0 HG21 VAL A 59 10.005 -6.968 -18.836 1.00 2.53 H new ATOM 0 HG22 VAL A 59 11.335 -5.801 -19.027 1.00 2.53 H new ATOM 0 HG23 VAL A 59 10.178 -5.622 -17.686 1.00 2.53 H new ATOM 912 N ARG A 60 7.729 -2.332 -19.734 1.00 43.00 N ATOM 913 CA ARG A 60 6.743 -1.522 -20.439 1.00 33.51 C ATOM 914 C ARG A 60 7.336 -0.177 -20.849 1.00 35.55 C ATOM 915 O ARG A 60 6.873 0.451 -21.800 1.00 13.24 O ATOM 916 CB ARG A 60 5.510 -1.302 -19.560 1.00 24.24 C ATOM 917 CG ARG A 60 4.711 -2.569 -19.302 1.00 64.32 C ATOM 918 CD ARG A 60 3.832 -2.924 -20.491 1.00 21.51 C ATOM 919 NE ARG A 60 2.527 -2.274 -20.420 1.00 14.31 N ATOM 920 CZ ARG A 60 1.535 -2.699 -19.646 1.00 35.13 C ATOM 921 NH1 ARG A 60 1.699 -3.769 -18.880 1.00 74.23 N ATOM 922 NH2 ARG A 60 0.375 -2.053 -19.636 1.00 24.23 N ATOM 0 H ARG A 60 7.480 -2.557 -18.771 1.00 43.00 H new ATOM 0 HA ARG A 60 6.447 -2.058 -21.341 1.00 33.51 H new ATOM 0 HB2 ARG A 60 5.825 -0.881 -18.605 1.00 24.24 H new ATOM 0 HB3 ARG A 60 4.863 -0.565 -20.035 1.00 24.24 H new ATOM 0 HG2 ARG A 60 5.392 -3.394 -19.092 1.00 64.32 H new ATOM 0 HG3 ARG A 60 4.090 -2.435 -18.416 1.00 64.32 H new ATOM 0 HD2 ARG A 60 4.334 -2.630 -21.413 1.00 21.51 H new ATOM 0 HD3 ARG A 60 3.697 -4.005 -20.532 1.00 21.51 H new ATOM 0 HE ARG A 60 2.368 -1.448 -20.997 1.00 14.31 H new ATOM 0 HH11 ARG A 60 2.589 -4.268 -18.884 1.00 74.23 H new ATOM 0 HH12 ARG A 60 0.935 -4.093 -18.286 1.00 74.23 H new ATOM 0 HH21 ARG A 60 0.245 -1.229 -20.223 1.00 24.23 H new ATOM 0 HH22 ARG A 60 -0.386 -2.381 -19.041 1.00 24.23 H new ATOM 936 N GLU A 61 8.362 0.257 -20.123 1.00 75.13 N ATOM 937 CA GLU A 61 9.016 1.528 -20.411 1.00 71.22 C ATOM 938 C GLU A 61 10.126 1.347 -21.442 1.00 63.32 C ATOM 939 O GLU A 61 10.322 2.193 -22.314 1.00 20.11 O ATOM 940 CB GLU A 61 9.590 2.133 -19.129 1.00 12.45 C ATOM 941 CG GLU A 61 8.634 2.078 -17.949 1.00 22.45 C ATOM 942 CD GLU A 61 8.740 3.297 -17.054 1.00 1.31 C ATOM 943 OE1 GLU A 61 8.925 4.411 -17.589 1.00 71.51 O ATOM 944 OE2 GLU A 61 8.638 3.139 -15.820 1.00 5.15 O ATOM 0 H GLU A 61 8.757 -0.252 -19.333 1.00 75.13 H new ATOM 0 HA GLU A 61 8.269 2.207 -20.822 1.00 71.22 H new ATOM 0 HB2 GLU A 61 10.507 1.606 -18.867 1.00 12.45 H new ATOM 0 HB3 GLU A 61 9.862 3.172 -19.317 1.00 12.45 H new ATOM 0 HG2 GLU A 61 7.612 1.991 -18.318 1.00 22.45 H new ATOM 0 HG3 GLU A 61 8.838 1.182 -17.362 1.00 22.45 H new ATOM 951 N MET A 62 10.850 0.237 -21.335 1.00 2.42 N ATOM 952 CA MET A 62 11.941 -0.055 -22.258 1.00 34.52 C ATOM 953 C MET A 62 11.410 -0.296 -23.667 1.00 73.44 C ATOM 954 O MET A 62 12.011 0.139 -24.649 1.00 11.42 O ATOM 955 CB MET A 62 12.727 -1.278 -21.781 1.00 11.05 C ATOM 956 CG MET A 62 13.672 -0.981 -20.628 1.00 2.51 C ATOM 957 SD MET A 62 15.046 0.082 -21.113 1.00 11.12 S ATOM 958 CE MET A 62 14.432 1.684 -20.599 1.00 1.40 C ATOM 0 H MET A 62 10.701 -0.474 -20.619 1.00 2.42 H new ATOM 0 HA MET A 62 12.605 0.809 -22.281 1.00 34.52 H new ATOM 0 HB2 MET A 62 12.025 -2.054 -21.474 1.00 11.05 H new ATOM 0 HB3 MET A 62 13.301 -1.679 -22.616 1.00 11.05 H new ATOM 0 HG2 MET A 62 13.116 -0.504 -19.821 1.00 2.51 H new ATOM 0 HG3 MET A 62 14.064 -1.919 -20.234 1.00 2.51 H new ATOM 0 HE1 MET A 62 14.632 2.418 -21.380 1.00 1.40 H new ATOM 0 HE2 MET A 62 13.358 1.623 -20.424 1.00 1.40 H new ATOM 0 HE3 MET A 62 14.932 1.988 -19.680 1.00 1.40 H new ATOM 968 N GLN A 63 10.281 -0.993 -23.759 1.00 43.50 N ATOM 969 CA GLN A 63 9.671 -1.291 -25.049 1.00 63.43 C ATOM 970 C GLN A 63 9.380 -0.010 -25.824 1.00 25.22 C ATOM 971 O GLN A 63 9.306 -0.018 -27.053 1.00 31.13 O ATOM 972 CB GLN A 63 8.380 -2.088 -24.854 1.00 50.14 C ATOM 973 CG GLN A 63 7.343 -1.368 -24.008 1.00 53.42 C ATOM 974 CD GLN A 63 5.929 -1.834 -24.295 1.00 62.22 C ATOM 975 OE1 GLN A 63 5.351 -2.607 -23.530 1.00 52.43 O ATOM 976 NE2 GLN A 63 5.364 -1.367 -25.402 1.00 44.43 N ATOM 0 H GLN A 63 9.771 -1.361 -22.956 1.00 43.50 H new ATOM 0 HA GLN A 63 10.376 -1.890 -25.626 1.00 63.43 H new ATOM 0 HB2 GLN A 63 7.949 -2.311 -25.830 1.00 50.14 H new ATOM 0 HB3 GLN A 63 8.619 -3.043 -24.386 1.00 50.14 H new ATOM 0 HG2 GLN A 63 7.567 -1.527 -22.953 1.00 53.42 H new ATOM 0 HG3 GLN A 63 7.412 -0.296 -24.190 1.00 53.42 H new ATOM 0 HE21 GLN A 63 5.880 -0.728 -26.007 1.00 44.43 H new ATOM 0 HE22 GLN A 63 4.414 -1.647 -25.647 1.00 44.43 H new ATOM 985 N LYS A 64 9.216 1.090 -25.097 1.00 45.13 N ATOM 986 CA LYS A 64 8.935 2.380 -25.715 1.00 15.41 C ATOM 987 C LYS A 64 10.193 3.240 -25.777 1.00 53.50 C ATOM 988 O LYS A 64 10.341 4.076 -26.669 1.00 21.12 O ATOM 989 CB LYS A 64 7.841 3.114 -24.936 1.00 35.13 C ATOM 990 CG LYS A 64 6.437 2.819 -25.434 1.00 75.24 C ATOM 991 CD LYS A 64 5.394 3.100 -24.365 1.00 43.42 C ATOM 992 CE LYS A 64 5.128 4.591 -24.226 1.00 12.35 C ATOM 993 NZ LYS A 64 3.990 5.034 -25.079 1.00 23.23 N ATOM 0 H LYS A 64 9.273 1.114 -24.079 1.00 45.13 H new ATOM 0 HA LYS A 64 8.590 2.199 -26.733 1.00 15.41 H new ATOM 0 HB2 LYS A 64 7.909 2.839 -23.884 1.00 35.13 H new ATOM 0 HB3 LYS A 64 8.021 4.187 -24.997 1.00 35.13 H new ATOM 0 HG2 LYS A 64 6.228 3.425 -26.315 1.00 75.24 H new ATOM 0 HG3 LYS A 64 6.371 1.775 -25.742 1.00 75.24 H new ATOM 0 HD2 LYS A 64 4.466 2.585 -24.616 1.00 43.42 H new ATOM 0 HD3 LYS A 64 5.733 2.699 -23.410 1.00 43.42 H new ATOM 0 HE2 LYS A 64 4.913 4.826 -23.183 1.00 12.35 H new ATOM 0 HE3 LYS A 64 6.025 5.147 -24.500 1.00 12.35 H new ATOM 0 HZ1 LYS A 64 3.841 6.056 -24.956 1.00 23.23 H new ATOM 0 HZ2 LYS A 64 4.205 4.833 -26.077 1.00 23.23 H new ATOM 0 HZ3 LYS A 64 3.128 4.522 -24.801 1.00 23.23 H new ATOM 1007 N TRP A 65 11.095 3.029 -24.826 1.00 44.31 N ATOM 1008 CA TRP A 65 12.342 3.785 -24.774 1.00 71.14 C ATOM 1009 C TRP A 65 13.287 3.353 -25.890 1.00 21.31 C ATOM 1010 O TRP A 65 14.179 4.104 -26.288 1.00 34.14 O ATOM 1011 CB TRP A 65 13.019 3.600 -23.415 1.00 75.52 C ATOM 1012 CG TRP A 65 12.715 4.701 -22.445 1.00 51.24 C ATOM 1013 CD1 TRP A 65 11.957 4.611 -21.313 1.00 74.42 C ATOM 1014 CD2 TRP A 65 13.162 6.059 -22.524 1.00 13.22 C ATOM 1015 NE1 TRP A 65 11.905 5.831 -20.683 1.00 71.41 N ATOM 1016 CE2 TRP A 65 12.637 6.736 -21.405 1.00 71.42 C ATOM 1017 CE3 TRP A 65 13.956 6.769 -23.429 1.00 15.04 C ATOM 1018 CZ2 TRP A 65 12.880 8.086 -21.171 1.00 4.32 C ATOM 1019 CZ3 TRP A 65 14.196 8.110 -23.195 1.00 30.43 C ATOM 1020 CH2 TRP A 65 13.661 8.757 -22.073 1.00 72.30 C ATOM 0 H TRP A 65 10.987 2.341 -24.080 1.00 44.31 H new ATOM 0 HA TRP A 65 12.104 4.840 -24.912 1.00 71.14 H new ATOM 0 HB2 TRP A 65 12.702 2.650 -22.986 1.00 75.52 H new ATOM 0 HB3 TRP A 65 14.098 3.541 -23.560 1.00 75.52 H new ATOM 0 HD1 TRP A 65 11.470 3.713 -20.964 1.00 74.42 H new ATOM 0 HE1 TRP A 65 11.403 6.030 -19.818 1.00 71.41 H new ATOM 0 HE3 TRP A 65 14.374 6.279 -24.296 1.00 15.04 H new ATOM 0 HZ2 TRP A 65 12.467 8.587 -20.308 1.00 4.32 H new ATOM 0 HZ3 TRP A 65 14.806 8.669 -23.889 1.00 30.43 H new ATOM 0 HH2 TRP A 65 13.869 9.805 -21.917 1.00 72.30 H new ATOM 1031 N LEU A 66 13.087 2.139 -26.391 1.00 64.14 N ATOM 1032 CA LEU A 66 13.923 1.607 -27.463 1.00 33.24 C ATOM 1033 C LEU A 66 13.194 1.664 -28.801 1.00 73.02 C ATOM 1034 O LEU A 66 13.820 1.644 -29.860 1.00 55.54 O ATOM 1035 CB LEU A 66 14.329 0.165 -27.151 1.00 54.21 C ATOM 1036 CG LEU A 66 15.512 -0.008 -26.199 1.00 3.03 C ATOM 1037 CD1 LEU A 66 15.540 -1.419 -25.632 1.00 74.03 C ATOM 1038 CD2 LEU A 66 16.820 0.309 -26.910 1.00 32.40 C ATOM 0 H LEU A 66 12.354 1.505 -26.073 1.00 64.14 H new ATOM 0 HA LEU A 66 14.819 2.224 -27.532 1.00 33.24 H new ATOM 0 HB2 LEU A 66 13.468 -0.350 -26.725 1.00 54.21 H new ATOM 0 HB3 LEU A 66 14.568 -0.335 -28.090 1.00 54.21 H new ATOM 0 HG LEU A 66 15.392 0.691 -25.372 1.00 3.03 H new ATOM 0 HD11 LEU A 66 16.389 -1.523 -24.957 1.00 74.03 H new ATOM 0 HD12 LEU A 66 14.616 -1.610 -25.086 1.00 74.03 H new ATOM 0 HD13 LEU A 66 15.635 -2.137 -26.447 1.00 74.03 H new ATOM 0 HD21 LEU A 66 17.651 0.180 -26.217 1.00 32.40 H new ATOM 0 HD22 LEU A 66 16.946 -0.365 -27.757 1.00 32.40 H new ATOM 0 HD23 LEU A 66 16.800 1.339 -27.266 1.00 32.40 H new ATOM 1050 N GLU A 67 11.867 1.737 -28.744 1.00 65.33 N ATOM 1051 CA GLU A 67 11.054 1.798 -29.953 1.00 0.30 C ATOM 1052 C GLU A 67 10.916 3.237 -30.443 1.00 63.23 C ATOM 1053 O GLU A 67 11.298 3.561 -31.568 1.00 42.33 O ATOM 1054 CB GLU A 67 9.669 1.202 -29.693 1.00 62.43 C ATOM 1055 CG GLU A 67 8.690 1.417 -30.835 1.00 70.31 C ATOM 1056 CD GLU A 67 7.334 0.793 -30.566 1.00 63.23 C ATOM 1057 OE1 GLU A 67 6.736 1.106 -29.516 1.00 33.32 O ATOM 1058 OE2 GLU A 67 6.872 -0.008 -31.406 1.00 22.15 O ATOM 0 H GLU A 67 11.333 1.755 -27.875 1.00 65.33 H new ATOM 0 HA GLU A 67 11.554 1.215 -30.726 1.00 0.30 H new ATOM 0 HB2 GLU A 67 9.771 0.132 -29.510 1.00 62.43 H new ATOM 0 HB3 GLU A 67 9.258 1.643 -28.785 1.00 62.43 H new ATOM 0 HG2 GLU A 67 8.566 2.486 -31.006 1.00 70.31 H new ATOM 0 HG3 GLU A 67 9.106 0.994 -31.750 1.00 70.31 H new ATOM 1065 N THR A 68 10.367 4.097 -29.591 1.00 31.51 N ATOM 1066 CA THR A 68 10.177 5.499 -29.936 1.00 55.55 C ATOM 1067 C THR A 68 11.427 6.316 -29.630 1.00 32.12 C ATOM 1068 O THR A 68 11.882 7.106 -30.457 1.00 11.12 O ATOM 1069 CB THR A 68 8.981 6.108 -29.178 1.00 64.44 C ATOM 1070 OG1 THR A 68 9.296 6.233 -27.787 1.00 44.43 O ATOM 1071 CG2 THR A 68 7.739 5.246 -29.346 1.00 60.14 C ATOM 0 H THR A 68 10.046 3.846 -28.656 1.00 31.51 H new ATOM 0 HA THR A 68 9.976 5.535 -31.007 1.00 55.55 H new ATOM 0 HB THR A 68 8.779 7.095 -29.595 1.00 64.44 H new ATOM 0 HG1 THR A 68 9.645 5.380 -27.453 1.00 44.43 H new ATOM 0 HG21 THR A 68 6.908 5.695 -28.802 1.00 60.14 H new ATOM 0 HG22 THR A 68 7.485 5.176 -30.404 1.00 60.14 H new ATOM 0 HG23 THR A 68 7.933 4.248 -28.952 1.00 60.14 H new ATOM 1079 N ARG A 69 11.978 6.119 -28.437 1.00 3.33 N ATOM 1080 CA ARG A 69 13.177 6.838 -28.021 1.00 55.30 C ATOM 1081 C ARG A 69 14.434 6.053 -28.382 1.00 2.32 C ATOM 1082 O ARG A 69 14.362 4.885 -28.761 1.00 51.22 O ATOM 1083 CB ARG A 69 13.142 7.102 -26.515 1.00 11.44 C ATOM 1084 CG ARG A 69 11.925 7.893 -26.063 1.00 32.23 C ATOM 1085 CD ARG A 69 12.108 9.383 -26.302 1.00 40.23 C ATOM 1086 NE ARG A 69 11.742 9.768 -27.663 1.00 32.03 N ATOM 1087 CZ ARG A 69 11.832 11.010 -28.125 1.00 4.13 C ATOM 1088 NH1 ARG A 69 12.275 11.982 -27.340 1.00 3.34 N ATOM 1089 NH2 ARG A 69 11.480 11.282 -29.375 1.00 30.41 N ATOM 0 H ARG A 69 11.614 5.468 -27.741 1.00 3.33 H new ATOM 0 HA ARG A 69 13.201 7.791 -28.549 1.00 55.30 H new ATOM 0 HB2 ARG A 69 13.162 6.149 -25.987 1.00 11.44 H new ATOM 0 HB3 ARG A 69 14.044 7.644 -26.229 1.00 11.44 H new ATOM 0 HG2 ARG A 69 11.043 7.543 -26.599 1.00 32.23 H new ATOM 0 HG3 ARG A 69 11.746 7.713 -25.003 1.00 32.23 H new ATOM 0 HD2 ARG A 69 11.499 9.942 -25.591 1.00 40.23 H new ATOM 0 HD3 ARG A 69 13.147 9.655 -26.115 1.00 40.23 H new ATOM 0 HE ARG A 69 11.398 9.043 -28.293 1.00 32.03 H new ATOM 0 HH11 ARG A 69 12.548 11.777 -26.379 1.00 3.34 H new ATOM 0 HH12 ARG A 69 12.343 12.935 -27.697 1.00 3.34 H new ATOM 0 HH21 ARG A 69 11.140 10.537 -29.983 1.00 30.41 H new ATOM 0 HH22 ARG A 69 11.550 12.236 -29.728 1.00 30.41 H new ATOM 1103 N GLY A 70 15.587 6.704 -28.261 1.00 43.52 N ATOM 1104 CA GLY A 70 16.844 6.052 -28.579 1.00 2.41 C ATOM 1105 C GLY A 70 18.037 6.968 -28.388 1.00 10.11 C ATOM 1106 O GLY A 70 17.930 8.013 -27.746 1.00 35.11 O ATOM 0 H GLY A 70 15.673 7.671 -27.948 1.00 43.52 H new ATOM 0 HA2 GLY A 70 16.962 5.171 -27.949 1.00 2.41 H new ATOM 0 HA3 GLY A 70 16.818 5.704 -29.612 1.00 2.41 H new ATOM 1110 N SER A 71 19.178 6.575 -28.945 1.00 51.33 N ATOM 1111 CA SER A 71 20.398 7.366 -28.828 1.00 73.24 C ATOM 1112 C SER A 71 20.314 8.624 -29.688 1.00 22.33 C ATOM 1113 O SER A 71 19.492 8.731 -30.598 1.00 2.30 O ATOM 1114 CB SER A 71 21.612 6.532 -29.241 1.00 44.31 C ATOM 1115 OG SER A 71 22.345 6.102 -28.107 1.00 11.11 O ATOM 0 H SER A 71 19.283 5.714 -29.482 1.00 51.33 H new ATOM 0 HA SER A 71 20.509 7.666 -27.786 1.00 73.24 H new ATOM 0 HB2 SER A 71 21.284 5.666 -29.816 1.00 44.31 H new ATOM 0 HB3 SER A 71 22.257 7.121 -29.893 1.00 44.31 H new ATOM 0 HG SER A 71 22.777 5.245 -28.303 1.00 11.11 H new ATOM 1121 N PRO A 72 21.186 9.600 -29.393 1.00 32.33 N ATOM 1122 CA PRO A 72 21.232 10.868 -30.126 1.00 51.11 C ATOM 1123 C PRO A 72 21.755 10.697 -31.548 1.00 71.22 C ATOM 1124 O PRO A 72 21.358 11.425 -32.457 1.00 13.43 O ATOM 1125 CB PRO A 72 22.198 11.721 -29.300 1.00 24.50 C ATOM 1126 CG PRO A 72 23.064 10.735 -28.594 1.00 63.12 C ATOM 1127 CD PRO A 72 22.194 9.540 -28.321 1.00 33.22 C ATOM 0 HA PRO A 72 20.242 11.309 -30.239 1.00 51.11 H new ATOM 0 HB2 PRO A 72 22.787 12.381 -29.937 1.00 24.50 H new ATOM 0 HB3 PRO A 72 21.662 12.355 -28.593 1.00 24.50 H new ATOM 0 HG2 PRO A 72 23.923 10.461 -29.207 1.00 63.12 H new ATOM 0 HG3 PRO A 72 23.455 11.153 -27.666 1.00 63.12 H new ATOM 0 HD2 PRO A 72 22.764 8.612 -28.357 1.00 33.22 H new ATOM 0 HD3 PRO A 72 21.735 9.594 -27.334 1.00 33.22 H new ATOM 1135 N GLU A 73 22.647 9.729 -31.733 1.00 44.02 N ATOM 1136 CA GLU A 73 23.224 9.464 -33.046 1.00 22.52 C ATOM 1137 C GLU A 73 22.345 8.503 -33.842 1.00 43.53 C ATOM 1138 O GLU A 73 21.832 8.852 -34.905 1.00 60.15 O ATOM 1139 CB GLU A 73 24.632 8.882 -32.901 1.00 1.04 C ATOM 1140 CG GLU A 73 25.697 9.929 -32.622 1.00 3.14 C ATOM 1141 CD GLU A 73 25.791 10.973 -33.718 1.00 32.41 C ATOM 1142 OE1 GLU A 73 25.760 10.588 -34.906 1.00 2.41 O ATOM 1143 OE2 GLU A 73 25.895 12.172 -33.388 1.00 52.44 O ATOM 0 H GLU A 73 22.986 9.116 -30.991 1.00 44.02 H new ATOM 0 HA GLU A 73 23.283 10.409 -33.586 1.00 22.52 H new ATOM 0 HB2 GLU A 73 24.632 8.151 -32.093 1.00 1.04 H new ATOM 0 HB3 GLU A 73 24.891 8.347 -33.815 1.00 1.04 H new ATOM 0 HG2 GLU A 73 25.478 10.421 -31.675 1.00 3.14 H new ATOM 0 HG3 GLU A 73 26.663 9.438 -32.510 1.00 3.14 H new ATOM 1150 N SER A 74 22.177 7.293 -33.320 1.00 21.20 N ATOM 1151 CA SER A 74 21.364 6.280 -33.984 1.00 3.24 C ATOM 1152 C SER A 74 19.909 6.728 -34.078 1.00 31.12 C ATOM 1153 O SER A 74 19.427 7.492 -33.241 1.00 33.33 O ATOM 1154 CB SER A 74 21.453 4.951 -33.231 1.00 42.02 C ATOM 1155 OG SER A 74 20.469 4.874 -32.215 1.00 20.35 O ATOM 0 H SER A 74 22.593 6.990 -32.439 1.00 21.20 H new ATOM 0 HA SER A 74 21.750 6.144 -34.994 1.00 3.24 H new ATOM 0 HB2 SER A 74 21.324 4.124 -33.930 1.00 42.02 H new ATOM 0 HB3 SER A 74 22.444 4.845 -32.790 1.00 42.02 H new ATOM 0 HG SER A 74 20.546 4.015 -31.750 1.00 20.35 H new ATOM 1161 N HIS A 75 19.214 6.247 -35.103 1.00 75.25 N ATOM 1162 CA HIS A 75 17.812 6.596 -35.308 1.00 43.33 C ATOM 1163 C HIS A 75 16.963 5.344 -35.502 1.00 73.12 C ATOM 1164 O HIS A 75 17.371 4.405 -36.187 1.00 1.43 O ATOM 1165 CB HIS A 75 17.666 7.518 -36.519 1.00 44.23 C ATOM 1166 CG HIS A 75 17.900 8.963 -36.203 1.00 42.54 C ATOM 1167 ND1 HIS A 75 18.608 9.810 -37.030 1.00 63.44 N ATOM 1168 CD2 HIS A 75 17.513 9.712 -35.144 1.00 63.10 C ATOM 1169 CE1 HIS A 75 18.649 11.016 -36.493 1.00 35.45 C ATOM 1170 NE2 HIS A 75 17.991 10.983 -35.347 1.00 51.25 N ATOM 0 H HIS A 75 19.598 5.614 -35.805 1.00 75.25 H new ATOM 0 HA HIS A 75 17.460 7.118 -34.418 1.00 43.33 H new ATOM 0 HB2 HIS A 75 18.369 7.205 -37.291 1.00 44.23 H new ATOM 0 HB3 HIS A 75 16.665 7.403 -36.934 1.00 44.23 H new ATOM 0 HD2 HIS A 75 16.935 9.373 -34.297 1.00 63.10 H new ATOM 0 HE1 HIS A 75 19.137 11.881 -36.918 1.00 35.45 H new ATOM 0 HE2 HIS A 75 17.860 11.773 -34.716 1.00 51.25 H new ATOM 1178 N ILE A 76 15.781 5.337 -34.895 1.00 71.21 N ATOM 1179 CA ILE A 76 14.875 4.200 -35.002 1.00 13.13 C ATOM 1180 C ILE A 76 13.648 4.551 -35.837 1.00 43.21 C ATOM 1181 O ILE A 76 12.896 5.466 -35.500 1.00 61.21 O ATOM 1182 CB ILE A 76 14.415 3.714 -33.614 1.00 41.43 C ATOM 1183 CG1 ILE A 76 15.621 3.292 -32.772 1.00 51.14 C ATOM 1184 CG2 ILE A 76 13.431 2.563 -33.756 1.00 22.45 C ATOM 1185 CD1 ILE A 76 15.461 3.587 -31.297 1.00 42.25 C ATOM 0 H ILE A 76 15.428 6.105 -34.324 1.00 71.21 H new ATOM 0 HA ILE A 76 15.429 3.400 -35.493 1.00 13.13 H new ATOM 0 HB ILE A 76 13.911 4.536 -33.105 1.00 41.43 H new ATOM 0 HG12 ILE A 76 15.790 2.223 -32.904 1.00 51.14 H new ATOM 0 HG13 ILE A 76 16.509 3.804 -33.142 1.00 51.14 H new ATOM 0 HG21 ILE A 76 13.115 2.230 -32.767 1.00 22.45 H new ATOM 0 HG22 ILE A 76 12.561 2.896 -34.322 1.00 22.45 H new ATOM 0 HG23 ILE A 76 13.911 1.737 -34.281 1.00 22.45 H new ATOM 0 HD11 ILE A 76 16.353 3.262 -30.762 1.00 42.25 H new ATOM 0 HD12 ILE A 76 15.322 4.659 -31.153 1.00 42.25 H new ATOM 0 HD13 ILE A 76 14.592 3.054 -30.911 1.00 42.25 H new ATOM 1197 N ASP A 77 13.452 3.817 -36.927 1.00 11.51 N ATOM 1198 CA ASP A 77 12.315 4.049 -37.810 1.00 34.02 C ATOM 1199 C ASP A 77 11.185 3.069 -37.509 1.00 13.23 C ATOM 1200 O ASP A 77 10.015 3.357 -37.762 1.00 73.11 O ATOM 1201 CB ASP A 77 12.742 3.919 -39.272 1.00 45.45 C ATOM 1202 CG ASP A 77 11.698 4.457 -40.231 1.00 4.50 C ATOM 1203 OD1 ASP A 77 11.596 5.695 -40.362 1.00 35.10 O ATOM 1204 OD2 ASP A 77 10.983 3.641 -40.849 1.00 44.15 O ATOM 0 H ASP A 77 14.066 3.057 -37.220 1.00 11.51 H new ATOM 0 HA ASP A 77 11.951 5.061 -37.635 1.00 34.02 H new ATOM 0 HB2 ASP A 77 13.679 4.454 -39.423 1.00 45.45 H new ATOM 0 HB3 ASP A 77 12.934 2.870 -39.499 1.00 45.45 H new ATOM 1209 N LYS A 78 11.542 1.910 -36.968 1.00 25.35 N ATOM 1210 CA LYS A 78 10.560 0.886 -36.631 1.00 51.22 C ATOM 1211 C LYS A 78 11.163 -0.162 -35.701 1.00 54.12 C ATOM 1212 O LYS A 78 12.356 -0.453 -35.770 1.00 23.13 O ATOM 1213 CB LYS A 78 10.037 0.215 -37.903 1.00 61.50 C ATOM 1214 CG LYS A 78 11.131 -0.156 -38.889 1.00 42.44 C ATOM 1215 CD LYS A 78 10.680 -1.255 -39.836 1.00 21.31 C ATOM 1216 CE LYS A 78 11.839 -1.788 -40.664 1.00 63.20 C ATOM 1217 NZ LYS A 78 11.528 -3.114 -41.265 1.00 72.45 N ATOM 0 H LYS A 78 12.506 1.656 -36.753 1.00 25.35 H new ATOM 0 HA LYS A 78 9.731 1.369 -36.115 1.00 51.22 H new ATOM 0 HB2 LYS A 78 9.486 -0.685 -37.629 1.00 61.50 H new ATOM 0 HB3 LYS A 78 9.330 0.885 -38.393 1.00 61.50 H new ATOM 0 HG2 LYS A 78 11.418 0.725 -39.463 1.00 42.44 H new ATOM 0 HG3 LYS A 78 12.016 -0.484 -38.345 1.00 42.44 H new ATOM 0 HD2 LYS A 78 10.235 -2.069 -39.264 1.00 21.31 H new ATOM 0 HD3 LYS A 78 9.905 -0.870 -40.499 1.00 21.31 H new ATOM 0 HE2 LYS A 78 12.077 -1.077 -41.456 1.00 63.20 H new ATOM 0 HE3 LYS A 78 12.725 -1.873 -40.035 1.00 63.20 H new ATOM 0 HZ1 LYS A 78 12.343 -3.443 -41.821 1.00 72.45 H new ATOM 0 HZ2 LYS A 78 11.326 -3.799 -40.509 1.00 72.45 H new ATOM 0 HZ3 LYS A 78 10.698 -3.028 -41.885 1.00 72.45 H new ATOM 1231 N ALA A 79 10.329 -0.726 -34.834 1.00 32.14 N ATOM 1232 CA ALA A 79 10.779 -1.744 -33.893 1.00 21.23 C ATOM 1233 C ALA A 79 9.725 -2.831 -33.714 1.00 34.14 C ATOM 1234 O ALA A 79 8.653 -2.774 -34.315 1.00 12.14 O ATOM 1235 CB ALA A 79 11.120 -1.110 -32.552 1.00 75.31 C ATOM 0 H ALA A 79 9.338 -0.495 -34.764 1.00 32.14 H new ATOM 0 HA ALA A 79 11.676 -2.209 -34.301 1.00 21.23 H new ATOM 0 HB1 ALA A 79 11.455 -1.882 -31.859 1.00 75.31 H new ATOM 0 HB2 ALA A 79 11.914 -0.376 -32.688 1.00 75.31 H new ATOM 0 HB3 ALA A 79 10.236 -0.617 -32.147 1.00 75.31 H new ATOM 1241 N ASN A 80 10.037 -3.821 -32.884 1.00 31.04 N ATOM 1242 CA ASN A 80 9.116 -4.922 -32.627 1.00 32.24 C ATOM 1243 C ASN A 80 9.524 -5.692 -31.374 1.00 63.14 C ATOM 1244 O ASN A 80 10.528 -5.374 -30.737 1.00 2.23 O ATOM 1245 CB ASN A 80 9.071 -5.868 -33.828 1.00 60.15 C ATOM 1246 CG ASN A 80 7.993 -5.487 -34.824 1.00 53.13 C ATOM 1247 OD1 ASN A 80 8.267 -5.288 -36.008 1.00 4.13 O ATOM 1248 ND2 ASN A 80 6.757 -5.383 -34.348 1.00 25.42 N ATOM 0 H ASN A 80 10.920 -3.883 -32.378 1.00 31.04 H new ATOM 0 HA ASN A 80 8.123 -4.502 -32.467 1.00 32.24 H new ATOM 0 HB2 ASN A 80 10.040 -5.864 -34.327 1.00 60.15 H new ATOM 0 HB3 ASN A 80 8.896 -6.886 -33.479 1.00 60.15 H new ATOM 0 HD21 ASN A 80 5.990 -5.129 -34.971 1.00 25.42 H new ATOM 0 HD22 ASN A 80 6.575 -5.557 -33.360 1.00 25.42 H new ATOM 1255 N PHE A 81 8.739 -6.707 -31.028 1.00 65.12 N ATOM 1256 CA PHE A 81 9.019 -7.523 -29.852 1.00 53.22 C ATOM 1257 C PHE A 81 8.609 -8.974 -30.087 1.00 13.22 C ATOM 1258 O PHE A 81 7.652 -9.252 -30.810 1.00 40.23 O ATOM 1259 CB PHE A 81 8.284 -6.964 -28.632 1.00 31.42 C ATOM 1260 CG PHE A 81 6.821 -6.725 -28.871 1.00 15.21 C ATOM 1261 CD1 PHE A 81 5.936 -7.788 -28.959 1.00 64.03 C ATOM 1262 CD2 PHE A 81 6.329 -5.437 -29.007 1.00 10.41 C ATOM 1263 CE1 PHE A 81 4.590 -7.570 -29.180 1.00 75.21 C ATOM 1264 CE2 PHE A 81 4.983 -5.213 -29.227 1.00 50.44 C ATOM 1265 CZ PHE A 81 4.112 -6.281 -29.313 1.00 40.01 C ATOM 0 H PHE A 81 7.904 -6.984 -31.545 1.00 65.12 H new ATOM 0 HA PHE A 81 10.093 -7.493 -29.666 1.00 53.22 H new ATOM 0 HB2 PHE A 81 8.399 -7.658 -27.799 1.00 31.42 H new ATOM 0 HB3 PHE A 81 8.753 -6.027 -28.333 1.00 31.42 H new ATOM 0 HD1 PHE A 81 6.303 -8.798 -28.854 1.00 64.03 H new ATOM 0 HD2 PHE A 81 7.005 -4.598 -28.940 1.00 10.41 H new ATOM 0 HE1 PHE A 81 3.911 -8.407 -29.249 1.00 75.21 H new ATOM 0 HE2 PHE A 81 4.613 -4.204 -29.332 1.00 50.44 H new ATOM 0 HZ PHE A 81 3.060 -6.109 -29.484 1.00 40.01 H new ATOM 1275 N LYS A 82 9.340 -9.896 -29.470 1.00 50.02 N ATOM 1276 CA LYS A 82 9.054 -11.319 -29.610 1.00 1.13 C ATOM 1277 C LYS A 82 8.099 -11.791 -28.519 1.00 35.43 C ATOM 1278 O LYS A 82 7.615 -10.994 -27.716 1.00 63.22 O ATOM 1279 CB LYS A 82 10.351 -12.129 -29.552 1.00 4.20 C ATOM 1280 CG LYS A 82 11.314 -11.817 -30.685 1.00 32.20 C ATOM 1281 CD LYS A 82 11.097 -12.742 -31.871 1.00 55.42 C ATOM 1282 CE LYS A 82 12.004 -12.377 -33.036 1.00 1.51 C ATOM 1283 NZ LYS A 82 11.582 -11.108 -33.692 1.00 11.25 N ATOM 0 H LYS A 82 10.135 -9.683 -28.868 1.00 50.02 H new ATOM 0 HA LYS A 82 8.578 -11.475 -30.578 1.00 1.13 H new ATOM 0 HB2 LYS A 82 10.848 -11.937 -28.601 1.00 4.20 H new ATOM 0 HB3 LYS A 82 10.108 -13.191 -29.575 1.00 4.20 H new ATOM 0 HG2 LYS A 82 11.183 -10.782 -31.001 1.00 32.20 H new ATOM 0 HG3 LYS A 82 12.340 -11.914 -30.329 1.00 32.20 H new ATOM 0 HD2 LYS A 82 11.287 -13.772 -31.570 1.00 55.42 H new ATOM 0 HD3 LYS A 82 10.056 -12.690 -32.189 1.00 55.42 H new ATOM 0 HE2 LYS A 82 13.030 -12.278 -32.680 1.00 1.51 H new ATOM 0 HE3 LYS A 82 11.997 -13.184 -33.768 1.00 1.51 H new ATOM 0 HZ1 LYS A 82 12.149 -10.955 -34.550 1.00 11.25 H new ATOM 0 HZ2 LYS A 82 10.576 -11.168 -33.948 1.00 11.25 H new ATOM 0 HZ3 LYS A 82 11.726 -10.314 -33.036 1.00 11.25 H new ATOM 1297 N ASN A 83 7.832 -13.093 -28.495 1.00 73.32 N ATOM 1298 CA ASN A 83 6.934 -13.672 -27.502 1.00 4.34 C ATOM 1299 C ASN A 83 7.604 -13.729 -26.132 1.00 30.11 C ATOM 1300 O ASN A 83 8.355 -14.658 -25.836 1.00 42.33 O ATOM 1301 CB ASN A 83 6.503 -15.076 -27.930 1.00 13.32 C ATOM 1302 CG ASN A 83 5.549 -15.715 -26.939 1.00 54.41 C ATOM 1303 OD1 ASN A 83 5.971 -16.401 -26.008 1.00 74.14 O ATOM 1304 ND2 ASN A 83 4.255 -15.491 -27.136 1.00 15.02 N ATOM 0 H ASN A 83 8.225 -13.767 -29.152 1.00 73.32 H new ATOM 0 HA ASN A 83 6.052 -13.035 -27.430 1.00 4.34 H new ATOM 0 HB2 ASN A 83 6.025 -15.024 -28.908 1.00 13.32 H new ATOM 0 HB3 ASN A 83 7.385 -15.707 -28.039 1.00 13.32 H new ATOM 0 HD21 ASN A 83 3.565 -15.894 -26.502 1.00 15.02 H new ATOM 0 HD22 ASN A 83 3.951 -14.916 -27.921 1.00 15.02 H new ATOM 1311 N GLU A 84 7.325 -12.730 -25.300 1.00 71.04 N ATOM 1312 CA GLU A 84 7.901 -12.667 -23.962 1.00 74.42 C ATOM 1313 C GLU A 84 7.673 -13.976 -23.210 1.00 42.43 C ATOM 1314 O GLU A 84 6.911 -14.836 -23.653 1.00 45.41 O ATOM 1315 CB GLU A 84 7.295 -11.503 -23.176 1.00 52.32 C ATOM 1316 CG GLU A 84 5.843 -11.721 -22.787 1.00 35.54 C ATOM 1317 CD GLU A 84 4.908 -11.693 -23.980 1.00 54.31 C ATOM 1318 OE1 GLU A 84 4.678 -10.593 -24.527 1.00 23.42 O ATOM 1319 OE2 GLU A 84 4.405 -12.768 -24.367 1.00 63.31 O ATOM 0 H GLU A 84 6.704 -11.954 -25.529 1.00 71.04 H new ATOM 0 HA GLU A 84 8.975 -12.508 -24.063 1.00 74.42 H new ATOM 0 HB2 GLU A 84 7.884 -11.340 -22.273 1.00 52.32 H new ATOM 0 HB3 GLU A 84 7.370 -10.594 -23.773 1.00 52.32 H new ATOM 0 HG2 GLU A 84 5.747 -12.680 -22.278 1.00 35.54 H new ATOM 0 HG3 GLU A 84 5.542 -10.951 -22.076 1.00 35.54 H new ATOM 1326 N LYS A 85 8.340 -14.119 -22.070 1.00 70.40 N ATOM 1327 CA LYS A 85 8.212 -15.321 -21.254 1.00 72.24 C ATOM 1328 C LYS A 85 8.215 -14.974 -19.769 1.00 54.42 C ATOM 1329 O LYS A 85 9.180 -14.409 -19.255 1.00 42.13 O ATOM 1330 CB LYS A 85 9.351 -16.296 -21.563 1.00 54.21 C ATOM 1331 CG LYS A 85 9.160 -17.670 -20.944 1.00 51.34 C ATOM 1332 CD LYS A 85 8.238 -18.537 -21.786 1.00 25.14 C ATOM 1333 CE LYS A 85 8.216 -19.974 -21.287 1.00 1.34 C ATOM 1334 NZ LYS A 85 7.223 -20.802 -22.025 1.00 14.23 N ATOM 0 H LYS A 85 8.975 -13.417 -21.690 1.00 70.40 H new ATOM 0 HA LYS A 85 7.261 -15.794 -21.496 1.00 72.24 H new ATOM 0 HB2 LYS A 85 9.443 -16.403 -22.644 1.00 54.21 H new ATOM 0 HB3 LYS A 85 10.289 -15.872 -21.204 1.00 54.21 H new ATOM 0 HG2 LYS A 85 10.128 -18.161 -20.839 1.00 51.34 H new ATOM 0 HG3 LYS A 85 8.746 -17.564 -19.941 1.00 51.34 H new ATOM 0 HD2 LYS A 85 7.228 -18.127 -21.762 1.00 25.14 H new ATOM 0 HD3 LYS A 85 8.566 -18.516 -22.825 1.00 25.14 H new ATOM 0 HE2 LYS A 85 9.208 -20.412 -21.398 1.00 1.34 H new ATOM 0 HE3 LYS A 85 7.979 -19.985 -20.223 1.00 1.34 H new ATOM 0 HZ1 LYS A 85 7.239 -21.774 -21.656 1.00 14.23 H new ATOM 0 HZ2 LYS A 85 6.273 -20.399 -21.899 1.00 14.23 H new ATOM 0 HZ3 LYS A 85 7.463 -20.812 -23.037 1.00 14.23 H new ATOM 1348 N VAL A 86 7.128 -15.316 -19.084 1.00 2.01 N ATOM 1349 CA VAL A 86 7.007 -15.042 -17.657 1.00 32.51 C ATOM 1350 C VAL A 86 7.902 -15.969 -16.842 1.00 33.14 C ATOM 1351 O VAL A 86 7.677 -17.179 -16.791 1.00 2.33 O ATOM 1352 CB VAL A 86 5.552 -15.199 -17.177 1.00 75.32 C ATOM 1353 CG1 VAL A 86 5.445 -14.906 -15.688 1.00 64.44 C ATOM 1354 CG2 VAL A 86 4.627 -14.292 -17.975 1.00 4.52 C ATOM 0 H VAL A 86 6.319 -15.783 -19.494 1.00 2.01 H new ATOM 0 HA VAL A 86 7.323 -14.010 -17.505 1.00 32.51 H new ATOM 0 HB VAL A 86 5.243 -16.231 -17.342 1.00 75.32 H new ATOM 0 HG11 VAL A 86 4.410 -15.022 -15.368 1.00 64.44 H new ATOM 0 HG12 VAL A 86 6.076 -15.601 -15.134 1.00 64.44 H new ATOM 0 HG13 VAL A 86 5.772 -13.885 -15.494 1.00 64.44 H new ATOM 0 HG21 VAL A 86 3.603 -14.416 -17.623 1.00 4.52 H new ATOM 0 HG22 VAL A 86 4.933 -13.254 -17.844 1.00 4.52 H new ATOM 0 HG23 VAL A 86 4.681 -14.555 -19.031 1.00 4.52 H new ATOM 1364 N ILE A 87 8.916 -15.394 -16.205 1.00 10.51 N ATOM 1365 CA ILE A 87 9.844 -16.168 -15.390 1.00 41.13 C ATOM 1366 C ILE A 87 9.693 -15.828 -13.912 1.00 4.45 C ATOM 1367 O ILE A 87 8.887 -14.974 -13.538 1.00 63.15 O ATOM 1368 CB ILE A 87 11.304 -15.925 -15.815 1.00 43.33 C ATOM 1369 CG1 ILE A 87 11.581 -14.424 -15.931 1.00 64.43 C ATOM 1370 CG2 ILE A 87 11.596 -16.626 -17.133 1.00 61.23 C ATOM 1371 CD1 ILE A 87 13.004 -14.102 -16.332 1.00 10.11 C ATOM 0 H ILE A 87 9.116 -14.394 -16.238 1.00 10.51 H new ATOM 0 HA ILE A 87 9.599 -17.219 -15.545 1.00 41.13 H new ATOM 0 HB ILE A 87 11.963 -16.340 -15.052 1.00 43.33 H new ATOM 0 HG12 ILE A 87 10.899 -13.992 -16.664 1.00 64.43 H new ATOM 0 HG13 ILE A 87 11.365 -13.948 -14.975 1.00 64.43 H new ATOM 0 HG21 ILE A 87 12.632 -16.445 -17.420 1.00 61.23 H new ATOM 0 HG22 ILE A 87 11.433 -17.698 -17.019 1.00 61.23 H new ATOM 0 HG23 ILE A 87 10.932 -16.239 -17.906 1.00 61.23 H new ATOM 0 HD11 ILE A 87 13.129 -13.021 -16.395 1.00 10.11 H new ATOM 0 HD12 ILE A 87 13.692 -14.504 -15.588 1.00 10.11 H new ATOM 0 HD13 ILE A 87 13.218 -14.549 -17.303 1.00 10.11 H new ATOM 1383 N LEU A 88 10.475 -16.499 -13.073 1.00 42.21 N ATOM 1384 CA LEU A 88 10.431 -16.267 -11.634 1.00 12.44 C ATOM 1385 C LEU A 88 11.684 -15.538 -11.161 1.00 5.43 C ATOM 1386 O LEU A 88 11.658 -14.816 -10.163 1.00 75.05 O ATOM 1387 CB LEU A 88 10.287 -17.594 -10.887 1.00 71.02 C ATOM 1388 CG LEU A 88 8.864 -18.136 -10.749 1.00 54.42 C ATOM 1389 CD1 LEU A 88 8.418 -18.802 -12.042 1.00 2.41 C ATOM 1390 CD2 LEU A 88 8.775 -19.112 -9.586 1.00 21.52 C ATOM 0 H LEU A 88 11.147 -17.208 -13.365 1.00 42.21 H new ATOM 0 HA LEU A 88 9.565 -15.640 -11.419 1.00 12.44 H new ATOM 0 HB2 LEU A 88 10.892 -18.343 -11.398 1.00 71.02 H new ATOM 0 HB3 LEU A 88 10.707 -17.473 -9.888 1.00 71.02 H new ATOM 0 HG LEU A 88 8.196 -17.299 -10.546 1.00 54.42 H new ATOM 0 HD11 LEU A 88 7.403 -19.182 -11.924 1.00 2.41 H new ATOM 0 HD12 LEU A 88 8.442 -18.074 -12.853 1.00 2.41 H new ATOM 0 HD13 LEU A 88 9.089 -19.628 -12.276 1.00 2.41 H new ATOM 0 HD21 LEU A 88 7.755 -19.487 -9.503 1.00 21.52 H new ATOM 0 HD22 LEU A 88 9.456 -19.946 -9.758 1.00 21.52 H new ATOM 0 HD23 LEU A 88 9.050 -18.603 -8.662 1.00 21.52 H new ATOM 1402 N LYS A 89 12.782 -15.729 -11.884 1.00 63.03 N ATOM 1403 CA LYS A 89 14.046 -15.088 -11.542 1.00 42.42 C ATOM 1404 C LYS A 89 14.842 -14.749 -12.799 1.00 0.14 C ATOM 1405 O LYS A 89 14.629 -15.339 -13.859 1.00 1.03 O ATOM 1406 CB LYS A 89 14.874 -15.998 -10.632 1.00 15.34 C ATOM 1407 CG LYS A 89 14.223 -16.264 -9.285 1.00 5.11 C ATOM 1408 CD LYS A 89 14.981 -17.321 -8.499 1.00 72.44 C ATOM 1409 CE LYS A 89 16.251 -16.755 -7.884 1.00 21.15 C ATOM 1410 NZ LYS A 89 16.938 -17.751 -7.016 1.00 25.03 N ATOM 0 H LYS A 89 12.822 -16.324 -12.712 1.00 63.03 H new ATOM 0 HA LYS A 89 13.823 -14.161 -11.013 1.00 42.42 H new ATOM 0 HB2 LYS A 89 15.043 -16.948 -11.139 1.00 15.34 H new ATOM 0 HB3 LYS A 89 15.852 -15.544 -10.471 1.00 15.34 H new ATOM 0 HG2 LYS A 89 14.184 -15.339 -8.709 1.00 5.11 H new ATOM 0 HG3 LYS A 89 13.194 -16.589 -9.435 1.00 5.11 H new ATOM 0 HD2 LYS A 89 14.341 -17.719 -7.712 1.00 72.44 H new ATOM 0 HD3 LYS A 89 15.233 -18.153 -9.156 1.00 72.44 H new ATOM 0 HE2 LYS A 89 16.928 -16.436 -8.677 1.00 21.15 H new ATOM 0 HE3 LYS A 89 16.007 -15.869 -7.298 1.00 21.15 H new ATOM 0 HZ1 LYS A 89 17.799 -17.327 -6.616 1.00 25.03 H new ATOM 0 HZ2 LYS A 89 16.302 -18.037 -6.245 1.00 25.03 H new ATOM 0 HZ3 LYS A 89 17.194 -18.586 -7.581 1.00 25.03 H new ATOM 1424 N LEU A 90 15.760 -13.797 -12.673 1.00 40.11 N ATOM 1425 CA LEU A 90 16.590 -13.381 -13.799 1.00 15.33 C ATOM 1426 C LEU A 90 17.916 -14.133 -13.805 1.00 4.13 C ATOM 1427 O LEU A 90 18.252 -14.828 -12.845 1.00 50.43 O ATOM 1428 CB LEU A 90 16.845 -11.874 -13.740 1.00 12.33 C ATOM 1429 CG LEU A 90 15.655 -11.007 -13.326 1.00 72.02 C ATOM 1430 CD1 LEU A 90 16.011 -9.531 -13.421 1.00 34.51 C ATOM 1431 CD2 LEU A 90 14.441 -11.321 -14.189 1.00 30.25 C ATOM 0 H LEU A 90 15.949 -13.299 -11.803 1.00 40.11 H new ATOM 0 HA LEU A 90 16.056 -13.617 -14.719 1.00 15.33 H new ATOM 0 HB2 LEU A 90 17.662 -11.691 -13.042 1.00 12.33 H new ATOM 0 HB3 LEU A 90 17.185 -11.545 -14.722 1.00 12.33 H new ATOM 0 HG LEU A 90 15.408 -11.234 -12.289 1.00 72.02 H new ATOM 0 HD11 LEU A 90 15.152 -8.930 -13.123 1.00 34.51 H new ATOM 0 HD12 LEU A 90 16.851 -9.316 -12.761 1.00 34.51 H new ATOM 0 HD13 LEU A 90 16.285 -9.288 -14.448 1.00 34.51 H new ATOM 0 HD21 LEU A 90 13.604 -10.695 -13.881 1.00 30.25 H new ATOM 0 HD22 LEU A 90 14.677 -11.123 -15.235 1.00 30.25 H new ATOM 0 HD23 LEU A 90 14.172 -12.371 -14.071 1.00 30.25 H new ATOM 1443 N ASP A 91 18.668 -13.988 -14.891 1.00 13.24 N ATOM 1444 CA ASP A 91 19.960 -14.651 -15.020 1.00 42.34 C ATOM 1445 C ASP A 91 21.082 -13.629 -15.179 1.00 14.22 C ATOM 1446 O ASP A 91 22.119 -13.918 -15.777 1.00 14.35 O ATOM 1447 CB ASP A 91 19.950 -15.605 -16.216 1.00 2.22 C ATOM 1448 CG ASP A 91 20.905 -16.769 -16.035 1.00 53.25 C ATOM 1449 OD1 ASP A 91 21.087 -17.213 -14.883 1.00 3.42 O ATOM 1450 OD2 ASP A 91 21.470 -17.235 -17.047 1.00 73.40 O ATOM 0 H ASP A 91 18.405 -13.417 -15.694 1.00 13.24 H new ATOM 0 HA ASP A 91 20.140 -15.223 -14.110 1.00 42.34 H new ATOM 0 HB2 ASP A 91 18.940 -15.987 -16.364 1.00 2.22 H new ATOM 0 HB3 ASP A 91 20.218 -15.055 -17.118 1.00 2.22 H new ATOM 1455 N TYR A 92 20.866 -12.434 -14.641 1.00 1.34 N ATOM 1456 CA TYR A 92 21.857 -11.367 -14.725 1.00 61.43 C ATOM 1457 C TYR A 92 21.721 -10.402 -13.551 1.00 74.55 C ATOM 1458 O TYR A 92 20.636 -10.234 -12.994 1.00 71.25 O ATOM 1459 CB TYR A 92 21.708 -10.608 -16.044 1.00 41.34 C ATOM 1460 CG TYR A 92 22.576 -11.151 -17.157 1.00 51.42 C ATOM 1461 CD1 TYR A 92 23.962 -11.124 -17.061 1.00 14.43 C ATOM 1462 CD2 TYR A 92 22.010 -11.692 -18.305 1.00 53.20 C ATOM 1463 CE1 TYR A 92 24.758 -11.618 -18.075 1.00 41.24 C ATOM 1464 CE2 TYR A 92 22.798 -12.190 -19.324 1.00 44.31 C ATOM 1465 CZ TYR A 92 24.172 -12.150 -19.205 1.00 30.02 C ATOM 1466 OH TYR A 92 24.962 -12.645 -20.217 1.00 51.32 O ATOM 0 H TYR A 92 20.014 -12.179 -14.142 1.00 1.34 H new ATOM 0 HA TYR A 92 22.847 -11.821 -14.684 1.00 61.43 H new ATOM 0 HB2 TYR A 92 20.665 -10.644 -16.358 1.00 41.34 H new ATOM 0 HB3 TYR A 92 21.956 -9.559 -15.880 1.00 41.34 H new ATOM 0 HD1 TYR A 92 24.425 -10.709 -16.178 1.00 14.43 H new ATOM 0 HD2 TYR A 92 20.935 -11.724 -18.402 1.00 53.20 H new ATOM 0 HE1 TYR A 92 25.834 -11.588 -17.984 1.00 41.24 H new ATOM 0 HE2 TYR A 92 22.341 -12.608 -20.209 1.00 44.31 H new ATOM 0 HH TYR A 92 24.394 -12.984 -20.940 1.00 51.32 H new ATOM 1476 N SER A 93 22.830 -9.770 -13.182 1.00 31.45 N ATOM 1477 CA SER A 93 22.837 -8.824 -12.072 1.00 74.02 C ATOM 1478 C SER A 93 22.870 -7.387 -12.584 1.00 63.20 C ATOM 1479 O SER A 93 22.408 -6.466 -11.911 1.00 51.21 O ATOM 1480 CB SER A 93 24.039 -9.081 -11.162 1.00 31.52 C ATOM 1481 OG SER A 93 23.742 -10.073 -10.194 1.00 4.25 O ATOM 0 H SER A 93 23.735 -9.896 -13.635 1.00 31.45 H new ATOM 0 HA SER A 93 21.921 -8.967 -11.499 1.00 74.02 H new ATOM 0 HB2 SER A 93 24.892 -9.397 -11.762 1.00 31.52 H new ATOM 0 HB3 SER A 93 24.326 -8.155 -10.663 1.00 31.52 H new ATOM 0 HG SER A 93 24.527 -10.221 -9.626 1.00 4.25 H new ATOM 1487 N ASP A 94 23.421 -7.204 -13.779 1.00 21.50 N ATOM 1488 CA ASP A 94 23.515 -5.881 -14.383 1.00 42.42 C ATOM 1489 C ASP A 94 23.564 -5.980 -15.905 1.00 3.13 C ATOM 1490 O ASP A 94 23.923 -7.020 -16.458 1.00 53.31 O ATOM 1491 CB ASP A 94 24.755 -5.148 -13.867 1.00 53.03 C ATOM 1492 CG ASP A 94 24.563 -4.602 -12.466 1.00 22.21 C ATOM 1493 OD1 ASP A 94 23.471 -4.067 -12.182 1.00 62.41 O ATOM 1494 OD2 ASP A 94 25.506 -4.709 -11.653 1.00 74.12 O ATOM 0 H ASP A 94 23.809 -7.956 -14.348 1.00 21.50 H new ATOM 0 HA ASP A 94 22.626 -5.317 -14.102 1.00 42.42 H new ATOM 0 HB2 ASP A 94 25.606 -5.829 -13.875 1.00 53.03 H new ATOM 0 HB3 ASP A 94 24.997 -4.328 -14.543 1.00 53.03 H new ATOM 1499 N PHE A 95 23.201 -4.892 -16.576 1.00 12.14 N ATOM 1500 CA PHE A 95 23.201 -4.857 -18.033 1.00 44.05 C ATOM 1501 C PHE A 95 24.625 -4.765 -18.575 1.00 0.52 C ATOM 1502 O PHE A 95 25.353 -3.818 -18.276 1.00 73.11 O ATOM 1503 CB PHE A 95 22.374 -3.672 -18.537 1.00 24.03 C ATOM 1504 CG PHE A 95 21.692 -3.932 -19.849 1.00 40.43 C ATOM 1505 CD1 PHE A 95 22.421 -4.335 -20.956 1.00 41.54 C ATOM 1506 CD2 PHE A 95 20.321 -3.772 -19.976 1.00 45.01 C ATOM 1507 CE1 PHE A 95 21.796 -4.575 -22.166 1.00 2.42 C ATOM 1508 CE2 PHE A 95 19.691 -4.011 -21.183 1.00 2.04 C ATOM 1509 CZ PHE A 95 20.429 -4.412 -22.279 1.00 45.51 C ATOM 0 H PHE A 95 22.903 -4.023 -16.133 1.00 12.14 H new ATOM 0 HA PHE A 95 22.753 -5.783 -18.393 1.00 44.05 H new ATOM 0 HB2 PHE A 95 21.622 -3.420 -17.789 1.00 24.03 H new ATOM 0 HB3 PHE A 95 23.024 -2.803 -18.640 1.00 24.03 H new ATOM 0 HD1 PHE A 95 23.490 -4.463 -20.873 1.00 41.54 H new ATOM 0 HD2 PHE A 95 19.739 -3.457 -19.123 1.00 45.01 H new ATOM 0 HE1 PHE A 95 22.376 -4.889 -23.021 1.00 2.42 H new ATOM 0 HE2 PHE A 95 18.622 -3.884 -21.269 1.00 2.04 H new ATOM 0 HZ PHE A 95 19.938 -4.598 -23.223 1.00 45.51 H new ATOM 1519 N GLN A 96 25.014 -5.755 -19.372 1.00 2.54 N ATOM 1520 CA GLN A 96 26.351 -5.786 -19.953 1.00 52.35 C ATOM 1521 C GLN A 96 26.306 -5.439 -21.438 1.00 64.20 C ATOM 1522 O GLN A 96 25.241 -5.449 -22.056 1.00 2.42 O ATOM 1523 CB GLN A 96 26.983 -7.165 -19.758 1.00 50.22 C ATOM 1524 CG GLN A 96 28.500 -7.131 -19.660 1.00 54.42 C ATOM 1525 CD GLN A 96 28.993 -6.212 -18.560 1.00 13.04 C ATOM 1526 OE1 GLN A 96 29.421 -5.087 -18.819 1.00 65.34 O ATOM 1527 NE2 GLN A 96 28.934 -6.687 -17.321 1.00 21.10 N ATOM 0 H GLN A 96 24.423 -6.545 -19.630 1.00 2.54 H new ATOM 0 HA GLN A 96 26.960 -5.040 -19.442 1.00 52.35 H new ATOM 0 HB2 GLN A 96 26.579 -7.616 -18.852 1.00 50.22 H new ATOM 0 HB3 GLN A 96 26.695 -7.808 -20.590 1.00 50.22 H new ATOM 0 HG2 GLN A 96 28.871 -8.140 -19.479 1.00 54.42 H new ATOM 0 HG3 GLN A 96 28.915 -6.805 -20.614 1.00 54.42 H new ATOM 0 HE21 GLN A 96 28.572 -7.625 -17.151 1.00 21.10 H new ATOM 0 HE22 GLN A 96 29.251 -6.113 -16.539 1.00 21.10 H new ATOM 1536 N ILE A 97 27.469 -5.134 -22.004 1.00 40.41 N ATOM 1537 CA ILE A 97 27.562 -4.785 -23.416 1.00 42.13 C ATOM 1538 C ILE A 97 28.442 -5.776 -24.170 1.00 43.14 C ATOM 1539 O ILE A 97 29.669 -5.722 -24.087 1.00 3.23 O ATOM 1540 CB ILE A 97 28.126 -3.365 -23.610 1.00 12.35 C ATOM 1541 CG1 ILE A 97 27.389 -2.373 -22.707 1.00 51.11 C ATOM 1542 CG2 ILE A 97 28.016 -2.945 -25.068 1.00 32.03 C ATOM 1543 CD1 ILE A 97 27.899 -0.954 -22.826 1.00 11.32 C ATOM 0 H ILE A 97 28.359 -5.122 -21.507 1.00 40.41 H new ATOM 0 HA ILE A 97 26.549 -4.823 -23.817 1.00 42.13 H new ATOM 0 HB ILE A 97 29.180 -3.368 -23.332 1.00 12.35 H new ATOM 0 HG12 ILE A 97 26.327 -2.391 -22.952 1.00 51.11 H new ATOM 0 HG13 ILE A 97 27.482 -2.698 -21.671 1.00 51.11 H new ATOM 0 HG21 ILE A 97 28.419 -1.939 -25.188 1.00 32.03 H new ATOM 0 HG22 ILE A 97 28.581 -3.639 -25.690 1.00 32.03 H new ATOM 0 HG23 ILE A 97 26.969 -2.955 -25.372 1.00 32.03 H new ATOM 0 HD11 ILE A 97 27.331 -0.306 -22.158 1.00 11.32 H new ATOM 0 HD12 ILE A 97 28.954 -0.922 -22.552 1.00 11.32 H new ATOM 0 HD13 ILE A 97 27.780 -0.610 -23.853 1.00 11.32 H new ATOM 1555 N VAL A 98 27.807 -6.680 -24.909 1.00 20.41 N ATOM 1556 CA VAL A 98 28.532 -7.682 -25.681 1.00 72.51 C ATOM 1557 C VAL A 98 29.465 -7.027 -26.693 1.00 23.31 C ATOM 1558 O VAL A 98 29.137 -5.996 -27.280 1.00 64.12 O ATOM 1559 CB VAL A 98 27.566 -8.624 -26.425 1.00 23.42 C ATOM 1560 CG1 VAL A 98 28.330 -9.770 -27.072 1.00 50.41 C ATOM 1561 CG2 VAL A 98 26.501 -9.152 -25.476 1.00 20.13 C ATOM 0 H VAL A 98 26.792 -6.739 -24.989 1.00 20.41 H new ATOM 0 HA VAL A 98 29.121 -8.263 -24.971 1.00 72.51 H new ATOM 0 HB VAL A 98 27.070 -8.058 -27.214 1.00 23.42 H new ATOM 0 HG11 VAL A 98 27.631 -10.425 -27.593 1.00 50.41 H new ATOM 0 HG12 VAL A 98 29.052 -9.370 -27.784 1.00 50.41 H new ATOM 0 HG13 VAL A 98 28.855 -10.337 -26.303 1.00 50.41 H new ATOM 0 HG21 VAL A 98 25.827 -9.816 -26.018 1.00 20.13 H new ATOM 0 HG22 VAL A 98 26.977 -9.702 -24.665 1.00 20.13 H new ATOM 0 HG23 VAL A 98 25.934 -8.317 -25.064 1.00 20.13 H new ATOM 1571 N LYS A 99 30.631 -7.633 -26.893 1.00 11.12 N ATOM 1572 CA LYS A 99 31.613 -7.111 -27.835 1.00 43.32 C ATOM 1573 C LYS A 99 31.126 -7.267 -29.272 1.00 32.40 C ATOM 1574 O LYS A 99 31.652 -6.636 -30.189 1.00 1.13 O ATOM 1575 CB LYS A 99 32.953 -7.830 -27.658 1.00 75.05 C ATOM 1576 CG LYS A 99 32.884 -9.321 -27.942 1.00 3.34 C ATOM 1577 CD LYS A 99 34.260 -9.962 -27.886 1.00 25.50 C ATOM 1578 CE LYS A 99 34.249 -11.359 -28.489 1.00 0.13 C ATOM 1579 NZ LYS A 99 33.298 -12.260 -27.782 1.00 32.45 N ATOM 0 H LYS A 99 30.918 -8.487 -26.415 1.00 11.12 H new ATOM 0 HA LYS A 99 31.748 -6.049 -27.629 1.00 43.32 H new ATOM 0 HB2 LYS A 99 33.690 -7.376 -28.320 1.00 75.05 H new ATOM 0 HB3 LYS A 99 33.305 -7.679 -26.638 1.00 75.05 H new ATOM 0 HG2 LYS A 99 32.228 -9.801 -27.216 1.00 3.34 H new ATOM 0 HG3 LYS A 99 32.445 -9.485 -28.926 1.00 3.34 H new ATOM 0 HD2 LYS A 99 34.975 -9.339 -28.423 1.00 25.50 H new ATOM 0 HD3 LYS A 99 34.596 -10.014 -26.851 1.00 25.50 H new ATOM 0 HE2 LYS A 99 33.976 -11.298 -29.543 1.00 0.13 H new ATOM 0 HE3 LYS A 99 35.252 -11.782 -28.444 1.00 0.13 H new ATOM 0 HZ1 LYS A 99 33.417 -13.233 -28.131 1.00 32.45 H new ATOM 0 HZ2 LYS A 99 33.489 -12.233 -26.760 1.00 32.45 H new ATOM 0 HZ3 LYS A 99 32.323 -11.945 -27.961 1.00 32.45 H new