USER MOD reduce.3.24.130724 H: found=0, std=0, add=786, rem=0, adj=15 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 26 HIS : no HD1:sc= -0.259 K(o=-1.2,f=-2.1) USER MOD Set 1.2: A 71 SER OG : rot 180:sc= -0.916 USER MOD Set 2.1: A 43 THR OG1 : rot -126:sc= 0.333 USER MOD Set 2.2: A 47 THR OG1 : rot -170:sc= 0.311 USER MOD Single : A 5 ASN : amide:sc= -0.0147 X(o=-0.015,f=-0.38) USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 180:sc= -0.497 USER MOD Single : A 12 TYR OH : rot 94:sc= -5.15! USER MOD Single : A 17 LYS NZ :NH3+ -154:sc= 0.513 (180deg=0.236) USER MOD Single : A 19 GLN : amide:sc= 0 X(o=0,f=-0.23) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 THR OG1 : rot -129:sc= 0.725 USER MOD Single : A 28 GLN : amide:sc= -1.86 K(o=-1.9,f=-4) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 GLN : amide:sc= -0.5 K(o=-0.5,f=-5.3!) USER MOD Single : A 42 ASN : amide:sc= 0.104 K(o=0.1,f=-1) USER MOD Single : A 49 GLN : amide:sc= -0.0692 K(o=-0.069,f=-2!) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 GLN : amide:sc= 0.518 K(o=0.52,f=-7.3!) 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 62 MET CE :methyl 176:sc= -5.96! (180deg=-6.32!) USER MOD Single : A 63 GLN : amide:sc= 0 X(o=0,f=-0.078) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 THR OG1 : rot -68:sc= 0.941 USER MOD Single : A 74 SER OG : rot 140:sc= 0 USER MOD Single : A 75 HIS : no HD1:sc= -0.0181 X(o=-0.018,f=-0.09) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 ASN : amide:sc= -0.831 K(o=-0.83,f=-2.9) USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 ASN : amide:sc= -0.0435 K(o=-0.043,f=-1.5!) USER MOD Single : A 85 LYS NZ :NH3+ 164:sc=-0.00585 (180deg=-0.142) 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 X(o=0,f=-0.32) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 40 N ASN A 5 5.391 -7.464 -9.411 1.00 10.43 N ATOM 41 CA ASN A 5 6.671 -8.144 -9.570 1.00 71.32 C ATOM 42 C ASN A 5 6.584 -9.220 -10.649 1.00 3.32 C ATOM 43 O ASN A 5 6.734 -10.410 -10.369 1.00 42.31 O ATOM 44 CB ASN A 5 7.108 -8.770 -8.244 1.00 61.12 C ATOM 45 CG ASN A 5 6.830 -7.866 -7.059 1.00 32.23 C ATOM 46 OD1 ASN A 5 6.955 -6.645 -7.152 1.00 71.02 O ATOM 47 ND2 ASN A 5 6.450 -8.464 -5.935 1.00 63.03 N ATOM 0 HA ASN A 5 7.411 -7.405 -9.877 1.00 71.32 H new ATOM 0 HB2 ASN A 5 6.588 -9.718 -8.104 1.00 61.12 H new ATOM 0 HB3 ASN A 5 8.174 -8.994 -8.285 1.00 61.12 H new ATOM 0 HD21 ASN A 5 6.249 -7.908 -5.104 1.00 63.03 H new ATOM 0 HD22 ASN A 5 6.359 -9.479 -5.903 1.00 63.03 H new ATOM 54 N THR A 6 6.342 -8.793 -11.884 1.00 50.14 N ATOM 55 CA THR A 6 6.235 -9.718 -13.005 1.00 71.14 C ATOM 56 C THR A 6 7.529 -9.760 -13.809 1.00 64.12 C ATOM 57 O THR A 6 7.700 -9.010 -14.771 1.00 53.40 O ATOM 58 CB THR A 6 5.074 -9.333 -13.942 1.00 63.54 C ATOM 59 OG1 THR A 6 3.963 -8.857 -13.176 1.00 31.05 O ATOM 60 CG2 THR A 6 4.642 -10.524 -14.785 1.00 43.34 C ATOM 0 H THR A 6 6.216 -7.812 -12.133 1.00 50.14 H new ATOM 0 HA THR A 6 6.041 -10.704 -12.583 1.00 71.14 H new ATOM 0 HB THR A 6 5.420 -8.543 -14.608 1.00 63.54 H new ATOM 0 HG1 THR A 6 3.230 -8.613 -13.779 1.00 31.05 H new ATOM 0 HG21 THR A 6 3.821 -10.229 -15.439 1.00 43.34 H new ATOM 0 HG22 THR A 6 5.482 -10.866 -15.389 1.00 43.34 H new ATOM 0 HG23 THR A 6 4.313 -11.332 -14.132 1.00 43.34 H new ATOM 68 N LEU A 7 8.439 -10.642 -13.410 1.00 44.15 N ATOM 69 CA LEU A 7 9.720 -10.783 -14.095 1.00 50.50 C ATOM 70 C LEU A 7 9.554 -11.534 -15.412 1.00 53.21 C ATOM 71 O LEU A 7 9.006 -12.636 -15.444 1.00 65.41 O ATOM 72 CB LEU A 7 10.721 -11.515 -13.200 1.00 4.40 C ATOM 73 CG LEU A 7 10.987 -10.883 -11.833 1.00 53.10 C ATOM 74 CD1 LEU A 7 11.699 -11.868 -10.919 1.00 15.02 C ATOM 75 CD2 LEU A 7 11.803 -9.607 -11.984 1.00 71.43 C ATOM 0 H LEU A 7 8.314 -11.270 -12.616 1.00 44.15 H new ATOM 0 HA LEU A 7 10.099 -9.785 -14.313 1.00 50.50 H new ATOM 0 HB2 LEU A 7 10.362 -12.532 -13.044 1.00 4.40 H new ATOM 0 HB3 LEU A 7 11.668 -11.590 -13.734 1.00 4.40 H new ATOM 0 HG LEU A 7 10.029 -10.626 -11.381 1.00 53.10 H new ATOM 0 HD11 LEU A 7 11.880 -11.401 -9.951 1.00 15.02 H new ATOM 0 HD12 LEU A 7 11.078 -12.754 -10.784 1.00 15.02 H new ATOM 0 HD13 LEU A 7 12.650 -12.157 -11.366 1.00 15.02 H new ATOM 0 HD21 LEU A 7 11.982 -9.171 -11.001 1.00 71.43 H new ATOM 0 HD22 LEU A 7 12.757 -9.839 -12.458 1.00 71.43 H new ATOM 0 HD23 LEU A 7 11.255 -8.896 -12.602 1.00 71.43 H new ATOM 87 N ILE A 8 10.031 -10.931 -16.496 1.00 1.35 N ATOM 88 CA ILE A 8 9.938 -11.544 -17.814 1.00 62.53 C ATOM 89 C ILE A 8 11.238 -11.374 -18.593 1.00 23.12 C ATOM 90 O ILE A 8 12.213 -10.823 -18.081 1.00 54.40 O ATOM 91 CB ILE A 8 8.780 -10.945 -18.634 1.00 30.32 C ATOM 92 CG1 ILE A 8 8.957 -9.432 -18.777 1.00 61.43 C ATOM 93 CG2 ILE A 8 7.445 -11.268 -17.979 1.00 23.03 C ATOM 94 CD1 ILE A 8 8.277 -8.858 -20.000 1.00 44.24 C ATOM 0 H ILE A 8 10.486 -10.018 -16.487 1.00 1.35 H new ATOM 0 HA ILE A 8 9.749 -12.606 -17.655 1.00 62.53 H new ATOM 0 HB ILE A 8 8.791 -11.389 -19.629 1.00 30.32 H new ATOM 0 HG12 ILE A 8 8.561 -8.942 -17.887 1.00 61.43 H new ATOM 0 HG13 ILE A 8 10.021 -9.201 -18.821 1.00 61.43 H new ATOM 0 HG21 ILE A 8 6.636 -10.838 -18.570 1.00 23.03 H new ATOM 0 HG22 ILE A 8 7.319 -12.349 -17.924 1.00 23.03 H new ATOM 0 HG23 ILE A 8 7.422 -10.848 -16.973 1.00 23.03 H new ATOM 0 HD11 ILE A 8 8.444 -7.782 -20.038 1.00 44.24 H new ATOM 0 HD12 ILE A 8 8.690 -9.321 -20.897 1.00 44.24 H new ATOM 0 HD13 ILE A 8 7.207 -9.058 -19.949 1.00 44.24 H new ATOM 106 N SER A 9 11.245 -11.850 -19.834 1.00 1.30 N ATOM 107 CA SER A 9 12.426 -11.752 -20.684 1.00 2.14 C ATOM 108 C SER A 9 12.037 -11.762 -22.159 1.00 33.34 C ATOM 109 O SER A 9 11.670 -12.801 -22.709 1.00 12.24 O ATOM 110 CB SER A 9 13.388 -12.905 -20.390 1.00 43.23 C ATOM 111 OG SER A 9 12.682 -14.083 -20.044 1.00 34.13 O ATOM 0 H SER A 9 10.446 -12.307 -20.273 1.00 1.30 H new ATOM 0 HA SER A 9 12.924 -10.807 -20.465 1.00 2.14 H new ATOM 0 HB2 SER A 9 14.011 -13.094 -21.264 1.00 43.23 H new ATOM 0 HB3 SER A 9 14.057 -12.626 -19.576 1.00 43.23 H new ATOM 0 HG SER A 9 13.319 -14.805 -19.862 1.00 34.13 H new ATOM 117 N VAL A 10 12.119 -10.598 -22.794 1.00 43.32 N ATOM 118 CA VAL A 10 11.777 -10.471 -24.206 1.00 31.22 C ATOM 119 C VAL A 10 12.969 -9.977 -25.018 1.00 55.31 C ATOM 120 O VAL A 10 13.600 -8.979 -24.669 1.00 72.01 O ATOM 121 CB VAL A 10 10.593 -9.507 -24.412 1.00 65.21 C ATOM 122 CG1 VAL A 10 10.936 -8.121 -23.887 1.00 34.33 C ATOM 123 CG2 VAL A 10 10.205 -9.448 -25.882 1.00 33.34 C ATOM 0 H VAL A 10 12.419 -9.729 -22.353 1.00 43.32 H new ATOM 0 HA VAL A 10 11.492 -11.464 -24.553 1.00 31.22 H new ATOM 0 HB VAL A 10 9.739 -9.882 -23.848 1.00 65.21 H new ATOM 0 HG11 VAL A 10 10.088 -7.454 -24.041 1.00 34.33 H new ATOM 0 HG12 VAL A 10 11.162 -8.181 -22.822 1.00 34.33 H new ATOM 0 HG13 VAL A 10 11.804 -7.734 -24.421 1.00 34.33 H new ATOM 0 HG21 VAL A 10 9.367 -8.763 -26.010 1.00 33.34 H new ATOM 0 HG22 VAL A 10 11.054 -9.097 -26.469 1.00 33.34 H new ATOM 0 HG23 VAL A 10 9.916 -10.442 -26.222 1.00 33.34 H new ATOM 133 N ASP A 11 13.271 -10.681 -26.103 1.00 55.24 N ATOM 134 CA ASP A 11 14.386 -10.313 -26.968 1.00 1.25 C ATOM 135 C ASP A 11 13.889 -9.886 -28.345 1.00 74.31 C ATOM 136 O ASP A 11 12.910 -10.429 -28.858 1.00 54.02 O ATOM 137 CB ASP A 11 15.361 -11.483 -27.104 1.00 22.24 C ATOM 138 CG ASP A 11 14.655 -12.824 -27.140 1.00 72.14 C ATOM 139 OD1 ASP A 11 14.302 -13.278 -28.249 1.00 22.22 O ATOM 140 OD2 ASP A 11 14.454 -13.419 -26.061 1.00 34.13 O ATOM 0 H ASP A 11 12.759 -11.510 -26.405 1.00 55.24 H new ATOM 0 HA ASP A 11 14.904 -9.469 -26.512 1.00 1.25 H new ATOM 0 HB2 ASP A 11 15.947 -11.360 -28.015 1.00 22.24 H new ATOM 0 HB3 ASP A 11 16.062 -11.467 -26.269 1.00 22.24 H new ATOM 145 N TYR A 12 14.568 -8.911 -28.938 1.00 63.20 N ATOM 146 CA TYR A 12 14.193 -8.409 -30.255 1.00 23.24 C ATOM 147 C TYR A 12 15.366 -7.696 -30.920 1.00 3.41 C ATOM 148 O TYR A 12 16.388 -7.435 -30.286 1.00 21.22 O ATOM 149 CB TYR A 12 13.001 -7.458 -30.140 1.00 43.53 C ATOM 150 CG TYR A 12 13.164 -6.411 -29.061 1.00 54.23 C ATOM 151 CD1 TYR A 12 14.151 -5.437 -29.154 1.00 15.03 C ATOM 152 CD2 TYR A 12 12.331 -6.396 -27.949 1.00 50.12 C ATOM 153 CE1 TYR A 12 14.303 -4.479 -28.170 1.00 41.01 C ATOM 154 CE2 TYR A 12 12.475 -5.441 -26.962 1.00 3.14 C ATOM 155 CZ TYR A 12 13.463 -4.485 -27.076 1.00 52.24 C ATOM 156 OH TYR A 12 13.611 -3.533 -26.094 1.00 13.31 O ATOM 0 H TYR A 12 15.381 -8.452 -28.528 1.00 63.20 H new ATOM 0 HA TYR A 12 13.911 -9.260 -30.875 1.00 23.24 H new ATOM 0 HB2 TYR A 12 12.850 -6.960 -31.098 1.00 43.53 H new ATOM 0 HB3 TYR A 12 12.101 -8.039 -29.938 1.00 43.53 H new ATOM 0 HD1 TYR A 12 14.810 -5.429 -30.010 1.00 15.03 H new ATOM 0 HD2 TYR A 12 11.558 -7.144 -27.855 1.00 50.12 H new ATOM 0 HE1 TYR A 12 15.076 -3.729 -28.257 1.00 41.01 H new ATOM 0 HE2 TYR A 12 11.817 -5.443 -26.105 1.00 3.14 H new ATOM 0 HH TYR A 12 13.011 -2.780 -26.276 1.00 13.31 H new ATOM 166 N GLU A 13 15.209 -7.382 -32.202 1.00 64.02 N ATOM 167 CA GLU A 13 16.255 -6.699 -32.954 1.00 43.52 C ATOM 168 C GLU A 13 15.746 -5.372 -33.511 1.00 64.13 C ATOM 169 O GLU A 13 15.273 -5.304 -34.646 1.00 64.31 O ATOM 170 CB GLU A 13 16.756 -7.585 -34.096 1.00 73.51 C ATOM 171 CG GLU A 13 15.639 -8.240 -34.893 1.00 5.14 C ATOM 172 CD GLU A 13 16.158 -9.221 -35.926 1.00 51.01 C ATOM 173 OE1 GLU A 13 17.085 -8.856 -36.679 1.00 21.13 O ATOM 174 OE2 GLU A 13 15.636 -10.354 -35.982 1.00 30.23 O ATOM 0 H GLU A 13 14.368 -7.589 -32.741 1.00 64.02 H new ATOM 0 HA GLU A 13 17.082 -6.495 -32.273 1.00 43.52 H new ATOM 0 HB2 GLU A 13 17.367 -6.984 -34.769 1.00 73.51 H new ATOM 0 HB3 GLU A 13 17.402 -8.361 -33.686 1.00 73.51 H new ATOM 0 HG2 GLU A 13 14.966 -8.759 -34.210 1.00 5.14 H new ATOM 0 HG3 GLU A 13 15.053 -7.468 -35.392 1.00 5.14 H new ATOM 181 N ILE A 14 15.847 -4.321 -32.705 1.00 32.03 N ATOM 182 CA ILE A 14 15.398 -2.997 -33.117 1.00 13.04 C ATOM 183 C ILE A 14 16.003 -2.604 -34.460 1.00 60.40 C ATOM 184 O ILE A 14 17.152 -2.933 -34.755 1.00 5.41 O ATOM 185 CB ILE A 14 15.762 -1.928 -32.070 1.00 4.22 C ATOM 186 CG1 ILE A 14 15.118 -2.261 -30.723 1.00 21.14 C ATOM 187 CG2 ILE A 14 15.326 -0.550 -32.546 1.00 31.25 C ATOM 188 CD1 ILE A 14 13.612 -2.384 -30.787 1.00 52.31 C ATOM 0 H ILE A 14 16.236 -4.360 -31.763 1.00 32.03 H new ATOM 0 HA ILE A 14 14.313 -3.047 -33.211 1.00 13.04 H new ATOM 0 HB ILE A 14 16.844 -1.921 -31.941 1.00 4.22 H new ATOM 0 HG12 ILE A 14 15.535 -3.197 -30.351 1.00 21.14 H new ATOM 0 HG13 ILE A 14 15.381 -1.487 -30.002 1.00 21.14 H new ATOM 0 HG21 ILE A 14 15.590 0.195 -31.795 1.00 31.25 H new ATOM 0 HG22 ILE A 14 15.828 -0.313 -33.484 1.00 31.25 H new ATOM 0 HG23 ILE A 14 14.247 -0.543 -32.700 1.00 31.25 H new ATOM 0 HD11 ILE A 14 13.224 -2.621 -29.796 1.00 52.31 H new ATOM 0 HD12 ILE A 14 13.184 -1.441 -31.128 1.00 52.31 H new ATOM 0 HD13 ILE A 14 13.341 -3.178 -31.483 1.00 52.31 H new ATOM 200 N PHE A 15 15.222 -1.898 -35.271 1.00 22.21 N ATOM 201 CA PHE A 15 15.681 -1.459 -36.584 1.00 23.34 C ATOM 202 C PHE A 15 16.220 -0.033 -36.522 1.00 62.04 C ATOM 203 O PHE A 15 16.366 0.541 -35.444 1.00 41.54 O ATOM 204 CB PHE A 15 14.541 -1.542 -37.600 1.00 72.43 C ATOM 205 CG PHE A 15 13.756 -2.820 -37.517 1.00 72.23 C ATOM 206 CD1 PHE A 15 14.403 -4.045 -37.480 1.00 53.02 C ATOM 207 CD2 PHE A 15 12.371 -2.797 -37.476 1.00 1.30 C ATOM 208 CE1 PHE A 15 13.683 -5.222 -37.405 1.00 34.23 C ATOM 209 CE2 PHE A 15 11.646 -3.971 -37.400 1.00 54.20 C ATOM 210 CZ PHE A 15 12.302 -5.185 -37.363 1.00 65.13 C ATOM 0 H PHE A 15 14.268 -1.618 -35.042 1.00 22.21 H new ATOM 0 HA PHE A 15 16.488 -2.120 -36.900 1.00 23.34 H new ATOM 0 HB2 PHE A 15 13.866 -0.700 -37.447 1.00 72.43 H new ATOM 0 HB3 PHE A 15 14.952 -1.442 -38.605 1.00 72.43 H new ATOM 0 HD1 PHE A 15 15.482 -4.080 -37.510 1.00 53.02 H new ATOM 0 HD2 PHE A 15 11.852 -1.850 -37.504 1.00 1.30 H new ATOM 0 HE1 PHE A 15 14.199 -6.170 -37.379 1.00 34.23 H new ATOM 0 HE2 PHE A 15 10.567 -3.939 -37.370 1.00 54.20 H new ATOM 0 HZ PHE A 15 11.738 -6.104 -37.301 1.00 65.13 H new ATOM 220 N GLY A 16 16.515 0.533 -37.689 1.00 70.42 N ATOM 221 CA GLY A 16 17.035 1.886 -37.747 1.00 42.10 C ATOM 222 C GLY A 16 18.493 1.930 -38.161 1.00 74.05 C ATOM 223 O GLY A 16 19.145 0.892 -38.278 1.00 14.14 O ATOM 0 H GLY A 16 16.403 0.078 -38.595 1.00 70.42 H new ATOM 0 HA2 GLY A 16 16.443 2.470 -38.452 1.00 42.10 H new ATOM 0 HA3 GLY A 16 16.924 2.357 -36.770 1.00 42.10 H new ATOM 227 N LYS A 17 19.006 3.135 -38.387 1.00 71.41 N ATOM 228 CA LYS A 17 20.395 3.311 -38.792 1.00 5.13 C ATOM 229 C LYS A 17 21.334 3.148 -37.600 1.00 60.24 C ATOM 230 O LYS A 17 21.989 4.101 -37.178 1.00 35.13 O ATOM 231 CB LYS A 17 20.593 4.691 -39.424 1.00 74.55 C ATOM 232 CG LYS A 17 20.107 5.835 -38.552 1.00 32.00 C ATOM 233 CD LYS A 17 20.884 7.112 -38.824 1.00 54.20 C ATOM 234 CE LYS A 17 22.317 7.009 -38.327 1.00 4.11 C ATOM 235 NZ LYS A 17 22.905 8.349 -38.047 1.00 61.53 N ATOM 0 H LYS A 17 18.480 4.004 -38.296 1.00 71.41 H new ATOM 0 HA LYS A 17 20.632 2.543 -39.528 1.00 5.13 H new ATOM 0 HB2 LYS A 17 21.652 4.834 -39.639 1.00 74.55 H new ATOM 0 HB3 LYS A 17 20.066 4.723 -40.378 1.00 74.55 H new ATOM 0 HG2 LYS A 17 19.046 6.008 -38.734 1.00 32.00 H new ATOM 0 HG3 LYS A 17 20.210 5.562 -37.502 1.00 32.00 H new ATOM 0 HD2 LYS A 17 20.883 7.319 -39.894 1.00 54.20 H new ATOM 0 HD3 LYS A 17 20.388 7.952 -38.337 1.00 54.20 H new ATOM 0 HE2 LYS A 17 22.344 6.404 -37.421 1.00 4.11 H new ATOM 0 HE3 LYS A 17 22.924 6.495 -39.072 1.00 4.11 H new ATOM 0 HZ1 LYS A 17 23.939 8.301 -38.143 1.00 61.53 H new ATOM 0 HZ2 LYS A 17 22.526 9.042 -38.723 1.00 61.53 H new ATOM 0 HZ3 LYS A 17 22.660 8.640 -37.079 1.00 61.53 H new ATOM 249 N VAL A 18 21.396 1.933 -37.064 1.00 10.23 N ATOM 250 CA VAL A 18 22.257 1.645 -35.923 1.00 34.43 C ATOM 251 C VAL A 18 23.570 1.013 -36.371 1.00 32.12 C ATOM 252 O VAL A 18 24.101 0.124 -35.705 1.00 54.23 O ATOM 253 CB VAL A 18 21.563 0.704 -34.920 1.00 73.51 C ATOM 254 CG1 VAL A 18 20.351 1.383 -34.301 1.00 74.41 C ATOM 255 CG2 VAL A 18 21.166 -0.599 -35.599 1.00 52.52 C ATOM 0 H VAL A 18 20.861 1.133 -37.401 1.00 10.23 H new ATOM 0 HA VAL A 18 22.464 2.597 -35.434 1.00 34.43 H new ATOM 0 HB VAL A 18 22.266 0.471 -34.121 1.00 73.51 H new ATOM 0 HG11 VAL A 18 19.874 0.703 -33.595 1.00 74.41 H new ATOM 0 HG12 VAL A 18 20.667 2.286 -33.778 1.00 74.41 H new ATOM 0 HG13 VAL A 18 19.642 1.648 -35.086 1.00 74.41 H new ATOM 0 HG21 VAL A 18 20.677 -1.252 -34.876 1.00 52.52 H new ATOM 0 HG22 VAL A 18 20.480 -0.388 -36.419 1.00 52.52 H new ATOM 0 HG23 VAL A 18 22.056 -1.092 -35.989 1.00 52.52 H new ATOM 265 N GLN A 19 24.088 1.479 -37.503 1.00 23.44 N ATOM 266 CA GLN A 19 25.340 0.958 -38.040 1.00 1.54 C ATOM 267 C GLN A 19 26.508 1.871 -37.680 1.00 12.14 C ATOM 268 O GLN A 19 26.490 3.065 -37.977 1.00 23.32 O ATOM 269 CB GLN A 19 25.244 0.808 -39.559 1.00 4.21 C ATOM 270 CG GLN A 19 24.058 -0.026 -40.014 1.00 54.42 C ATOM 271 CD GLN A 19 23.859 0.013 -41.517 1.00 4.03 C ATOM 272 OE1 GLN A 19 24.824 0.060 -42.281 1.00 30.33 O ATOM 273 NE2 GLN A 19 22.604 -0.006 -41.949 1.00 61.51 N ATOM 0 H GLN A 19 23.661 2.215 -38.065 1.00 23.44 H new ATOM 0 HA GLN A 19 25.518 -0.021 -37.596 1.00 1.54 H new ATOM 0 HB2 GLN A 19 25.176 1.798 -40.010 1.00 4.21 H new ATOM 0 HB3 GLN A 19 26.162 0.352 -39.929 1.00 4.21 H new ATOM 0 HG2 GLN A 19 24.202 -1.059 -39.697 1.00 54.42 H new ATOM 0 HG3 GLN A 19 23.155 0.335 -39.522 1.00 54.42 H new ATOM 0 HE21 GLN A 19 21.835 -0.045 -41.280 1.00 61.51 H new ATOM 0 HE22 GLN A 19 22.409 0.019 -42.950 1.00 61.51 H new ATOM 282 N GLY A 20 27.522 1.300 -37.037 1.00 4.52 N ATOM 283 CA GLY A 20 28.684 2.078 -36.646 1.00 61.53 C ATOM 284 C GLY A 20 28.319 3.280 -35.798 1.00 23.51 C ATOM 285 O GLY A 20 28.744 4.400 -36.080 1.00 64.10 O ATOM 0 H GLY A 20 27.560 0.314 -36.780 1.00 4.52 H new ATOM 0 HA2 GLY A 20 29.373 1.442 -36.091 1.00 61.53 H new ATOM 0 HA3 GLY A 20 29.210 2.414 -37.540 1.00 61.53 H new ATOM 289 N VAL A 21 27.527 3.048 -34.756 1.00 24.14 N ATOM 290 CA VAL A 21 27.105 4.121 -33.863 1.00 75.34 C ATOM 291 C VAL A 21 27.087 3.654 -32.412 1.00 71.12 C ATOM 292 O VAL A 21 26.842 2.481 -32.129 1.00 62.10 O ATOM 293 CB VAL A 21 25.706 4.645 -34.240 1.00 31.04 C ATOM 294 CG1 VAL A 21 24.658 3.560 -34.044 1.00 63.42 C ATOM 295 CG2 VAL A 21 25.363 5.881 -33.422 1.00 43.43 C ATOM 0 H VAL A 21 27.165 2.127 -34.509 1.00 24.14 H new ATOM 0 HA VAL A 21 27.830 4.928 -33.972 1.00 75.34 H new ATOM 0 HB VAL A 21 25.713 4.924 -35.294 1.00 31.04 H new ATOM 0 HG11 VAL A 21 23.677 3.949 -34.315 1.00 63.42 H new ATOM 0 HG12 VAL A 21 24.897 2.705 -34.676 1.00 63.42 H new ATOM 0 HG13 VAL A 21 24.648 3.248 -33.000 1.00 63.42 H new ATOM 0 HG21 VAL A 21 24.372 6.238 -33.701 1.00 43.43 H new ATOM 0 HG22 VAL A 21 25.373 5.630 -32.361 1.00 43.43 H new ATOM 0 HG23 VAL A 21 26.098 6.662 -33.617 1.00 43.43 H new ATOM 305 N PHE A 22 27.348 4.580 -31.495 1.00 74.24 N ATOM 306 CA PHE A 22 27.362 4.263 -30.072 1.00 3.41 C ATOM 307 C PHE A 22 25.942 4.125 -29.531 1.00 23.01 C ATOM 308 O PHE A 22 25.487 4.945 -28.733 1.00 23.43 O ATOM 309 CB PHE A 22 28.113 5.347 -29.295 1.00 31.23 C ATOM 310 CG PHE A 22 29.607 5.241 -29.410 1.00 33.14 C ATOM 311 CD1 PHE A 22 30.317 4.368 -28.601 1.00 11.41 C ATOM 312 CD2 PHE A 22 30.301 6.014 -30.326 1.00 52.41 C ATOM 313 CE1 PHE A 22 31.692 4.268 -28.704 1.00 54.23 C ATOM 314 CE2 PHE A 22 31.675 5.918 -30.434 1.00 43.22 C ATOM 315 CZ PHE A 22 32.372 5.045 -29.622 1.00 33.04 C ATOM 0 H PHE A 22 27.553 5.555 -31.712 1.00 74.24 H new ATOM 0 HA PHE A 22 27.875 3.310 -29.942 1.00 3.41 H new ATOM 0 HB2 PHE A 22 27.797 6.326 -29.656 1.00 31.23 H new ATOM 0 HB3 PHE A 22 27.833 5.289 -28.243 1.00 31.23 H new ATOM 0 HD1 PHE A 22 29.790 3.759 -27.882 1.00 11.41 H new ATOM 0 HD2 PHE A 22 29.762 6.700 -30.963 1.00 52.41 H new ATOM 0 HE1 PHE A 22 32.234 3.584 -28.068 1.00 54.23 H new ATOM 0 HE2 PHE A 22 32.204 6.526 -31.153 1.00 43.22 H new ATOM 0 HZ PHE A 22 33.446 4.970 -29.704 1.00 33.04 H new ATOM 325 N PHE A 23 25.247 3.082 -29.972 1.00 14.02 N ATOM 326 CA PHE A 23 23.878 2.836 -29.534 1.00 34.11 C ATOM 327 C PHE A 23 23.857 1.997 -28.259 1.00 52.23 C ATOM 328 O PHE A 23 23.106 2.285 -27.327 1.00 23.43 O ATOM 329 CB PHE A 23 23.086 2.129 -30.636 1.00 64.32 C ATOM 330 CG PHE A 23 21.693 1.749 -30.224 1.00 53.45 C ATOM 331 CD1 PHE A 23 21.440 0.521 -29.635 1.00 2.43 C ATOM 332 CD2 PHE A 23 20.635 2.621 -30.428 1.00 32.22 C ATOM 333 CE1 PHE A 23 20.159 0.169 -29.254 1.00 52.33 C ATOM 334 CE2 PHE A 23 19.351 2.275 -30.049 1.00 65.52 C ATOM 335 CZ PHE A 23 19.113 1.047 -29.463 1.00 20.21 C ATOM 0 H PHE A 23 25.609 2.394 -30.632 1.00 14.02 H new ATOM 0 HA PHE A 23 23.413 3.799 -29.322 1.00 34.11 H new ATOM 0 HB2 PHE A 23 23.033 2.780 -31.509 1.00 64.32 H new ATOM 0 HB3 PHE A 23 23.624 1.231 -30.940 1.00 64.32 H new ATOM 0 HD1 PHE A 23 22.254 -0.170 -29.472 1.00 2.43 H new ATOM 0 HD2 PHE A 23 20.816 3.581 -30.888 1.00 32.22 H new ATOM 0 HE1 PHE A 23 19.976 -0.791 -28.794 1.00 52.33 H new ATOM 0 HE2 PHE A 23 18.535 2.964 -30.211 1.00 65.52 H new ATOM 0 HZ PHE A 23 18.111 0.774 -29.169 1.00 20.21 H new ATOM 345 N ARG A 24 24.686 0.959 -28.228 1.00 32.03 N ATOM 346 CA ARG A 24 24.762 0.077 -27.069 1.00 71.04 C ATOM 347 C ARG A 24 25.174 0.853 -25.822 1.00 21.44 C ATOM 348 O ARG A 24 24.852 0.462 -24.699 1.00 60.34 O ATOM 349 CB ARG A 24 25.755 -1.057 -27.329 1.00 43.14 C ATOM 350 CG ARG A 24 27.162 -0.574 -27.642 1.00 63.21 C ATOM 351 CD ARG A 24 27.888 -1.537 -28.569 1.00 4.14 C ATOM 352 NE ARG A 24 29.069 -0.927 -29.175 1.00 73.34 N ATOM 353 CZ ARG A 24 29.939 -1.596 -29.923 1.00 61.23 C ATOM 354 NH1 ARG A 24 29.762 -2.890 -30.156 1.00 1.53 N ATOM 355 NH2 ARG A 24 30.989 -0.971 -30.441 1.00 71.30 N ATOM 0 H ARG A 24 25.314 0.708 -28.991 1.00 32.03 H new ATOM 0 HA ARG A 24 23.772 -0.348 -26.901 1.00 71.04 H new ATOM 0 HB2 ARG A 24 25.789 -1.707 -26.454 1.00 43.14 H new ATOM 0 HB3 ARG A 24 25.394 -1.661 -28.161 1.00 43.14 H new ATOM 0 HG2 ARG A 24 27.115 0.412 -28.104 1.00 63.21 H new ATOM 0 HG3 ARG A 24 27.725 -0.465 -26.715 1.00 63.21 H new ATOM 0 HD2 ARG A 24 28.185 -2.424 -28.010 1.00 4.14 H new ATOM 0 HD3 ARG A 24 27.207 -1.867 -29.354 1.00 4.14 H new ATOM 0 HE ARG A 24 29.234 0.067 -29.015 1.00 73.34 H new ATOM 0 HH11 ARG A 24 28.956 -3.374 -29.760 1.00 1.53 H new ATOM 0 HH12 ARG A 24 30.432 -3.401 -30.731 1.00 1.53 H new ATOM 0 HH21 ARG A 24 31.128 0.024 -30.265 1.00 71.30 H new ATOM 0 HH22 ARG A 24 31.657 -1.486 -31.015 1.00 71.30 H new ATOM 369 N LYS A 25 25.889 1.954 -26.025 1.00 60.13 N ATOM 370 CA LYS A 25 26.345 2.786 -24.918 1.00 65.03 C ATOM 371 C LYS A 25 25.162 3.373 -24.155 1.00 25.11 C ATOM 372 O LYS A 25 25.254 3.636 -22.955 1.00 51.45 O ATOM 373 CB LYS A 25 27.242 3.913 -25.436 1.00 54.23 C ATOM 374 CG LYS A 25 27.999 4.641 -24.339 1.00 64.43 C ATOM 375 CD LYS A 25 29.226 5.351 -24.886 1.00 2.41 C ATOM 376 CE LYS A 25 28.844 6.581 -25.695 1.00 75.14 C ATOM 377 NZ LYS A 25 30.039 7.269 -26.258 1.00 34.31 N ATOM 0 H LYS A 25 26.166 2.291 -26.947 1.00 60.13 H new ATOM 0 HA LYS A 25 26.918 2.158 -24.236 1.00 65.03 H new ATOM 0 HB2 LYS A 25 27.958 3.499 -26.146 1.00 54.23 H new ATOM 0 HB3 LYS A 25 26.630 4.631 -25.982 1.00 54.23 H new ATOM 0 HG2 LYS A 25 27.341 5.366 -23.861 1.00 64.43 H new ATOM 0 HG3 LYS A 25 28.301 3.930 -23.570 1.00 64.43 H new ATOM 0 HD2 LYS A 25 29.876 5.644 -24.061 1.00 2.41 H new ATOM 0 HD3 LYS A 25 29.796 4.665 -25.512 1.00 2.41 H new ATOM 0 HE2 LYS A 25 28.177 6.289 -26.506 1.00 75.14 H new ATOM 0 HE3 LYS A 25 28.291 7.274 -25.062 1.00 75.14 H new ATOM 0 HZ1 LYS A 25 29.736 8.102 -26.802 1.00 34.31 H new ATOM 0 HZ2 LYS A 25 30.663 7.571 -25.483 1.00 34.31 H new ATOM 0 HZ3 LYS A 25 30.553 6.616 -26.883 1.00 34.31 H new ATOM 391 N HIS A 26 24.052 3.574 -24.857 1.00 51.11 N ATOM 392 CA HIS A 26 22.850 4.128 -24.244 1.00 73.13 C ATOM 393 C HIS A 26 21.917 3.015 -23.776 1.00 12.32 C ATOM 394 O HIS A 26 21.198 3.168 -22.787 1.00 60.44 O ATOM 395 CB HIS A 26 22.121 5.038 -25.233 1.00 53.11 C ATOM 396 CG HIS A 26 22.824 6.337 -25.482 1.00 71.24 C ATOM 397 ND1 HIS A 26 24.091 6.415 -26.022 1.00 14.33 N ATOM 398 CD2 HIS A 26 22.430 7.613 -25.264 1.00 54.15 C ATOM 399 CE1 HIS A 26 24.446 7.684 -26.123 1.00 73.31 C ATOM 400 NE2 HIS A 26 23.455 8.431 -25.671 1.00 1.13 N ATOM 0 H HIS A 26 23.960 3.362 -25.850 1.00 51.11 H new ATOM 0 HA HIS A 26 23.151 4.715 -23.376 1.00 73.13 H new ATOM 0 HB2 HIS A 26 22.003 4.511 -26.180 1.00 53.11 H new ATOM 0 HB3 HIS A 26 21.119 5.243 -24.855 1.00 53.11 H new ATOM 0 HD2 HIS A 26 21.485 7.929 -24.847 1.00 54.15 H new ATOM 0 HE1 HIS A 26 25.386 8.048 -26.509 1.00 73.31 H new ATOM 0 HE2 HIS A 26 23.452 9.450 -25.631 1.00 1.13 H new ATOM 408 N THR A 27 21.932 1.896 -24.492 1.00 61.53 N ATOM 409 CA THR A 27 21.087 0.758 -24.151 1.00 53.45 C ATOM 410 C THR A 27 21.452 0.192 -22.784 1.00 60.02 C ATOM 411 O THR A 27 20.585 -0.267 -22.041 1.00 71.14 O ATOM 412 CB THR A 27 21.198 -0.360 -25.205 1.00 24.35 C ATOM 413 OG1 THR A 27 21.209 0.205 -26.520 1.00 73.32 O ATOM 414 CG2 THR A 27 20.042 -1.341 -25.077 1.00 43.31 C ATOM 0 H THR A 27 22.521 1.753 -25.313 1.00 61.53 H new ATOM 0 HA THR A 27 20.060 1.123 -24.127 1.00 53.45 H new ATOM 0 HB THR A 27 22.130 -0.898 -25.035 1.00 24.35 H new ATOM 0 HG1 THR A 27 20.538 -0.245 -27.075 1.00 73.32 H new ATOM 0 HG21 THR A 27 20.142 -2.121 -25.831 1.00 43.31 H new ATOM 0 HG22 THR A 27 20.056 -1.792 -24.085 1.00 43.31 H new ATOM 0 HG23 THR A 27 19.099 -0.814 -25.223 1.00 43.31 H new ATOM 422 N GLN A 28 22.740 0.228 -22.459 1.00 1.44 N ATOM 423 CA GLN A 28 23.219 -0.282 -21.179 1.00 51.14 C ATOM 424 C GLN A 28 22.872 0.678 -20.046 1.00 72.21 C ATOM 425 O GLN A 28 22.685 0.262 -18.903 1.00 52.01 O ATOM 426 CB GLN A 28 24.731 -0.505 -21.229 1.00 64.23 C ATOM 427 CG GLN A 28 25.536 0.784 -21.275 1.00 15.01 C ATOM 428 CD GLN A 28 25.823 1.342 -19.895 1.00 33.22 C ATOM 429 OE1 GLN A 28 25.407 2.452 -19.563 1.00 4.43 O ATOM 430 NE2 GLN A 28 26.537 0.572 -19.082 1.00 13.12 N ATOM 0 H GLN A 28 23.470 0.605 -23.063 1.00 1.44 H new ATOM 0 HA GLN A 28 22.724 -1.234 -20.988 1.00 51.14 H new ATOM 0 HB2 GLN A 28 25.034 -1.081 -20.355 1.00 64.23 H new ATOM 0 HB3 GLN A 28 24.972 -1.106 -22.106 1.00 64.23 H new ATOM 0 HG2 GLN A 28 26.478 0.601 -21.792 1.00 15.01 H new ATOM 0 HG3 GLN A 28 24.992 1.527 -21.857 1.00 15.01 H new ATOM 0 HE21 GLN A 28 26.861 -0.342 -19.399 1.00 13.12 H new ATOM 0 HE22 GLN A 28 26.761 0.894 -18.140 1.00 13.12 H new ATOM 439 N ALA A 29 22.788 1.964 -20.371 1.00 72.31 N ATOM 440 CA ALA A 29 22.462 2.982 -19.381 1.00 14.23 C ATOM 441 C ALA A 29 21.054 2.781 -18.829 1.00 41.15 C ATOM 442 O ALA A 29 20.844 2.805 -17.617 1.00 53.24 O ATOM 443 CB ALA A 29 22.600 4.371 -19.987 1.00 33.03 C ATOM 0 H ALA A 29 22.941 2.325 -21.313 1.00 72.31 H new ATOM 0 HA ALA A 29 23.165 2.887 -18.554 1.00 14.23 H new ATOM 0 HB1 ALA A 29 22.353 5.122 -19.236 1.00 33.03 H new ATOM 0 HB2 ALA A 29 23.625 4.520 -20.326 1.00 33.03 H new ATOM 0 HB3 ALA A 29 21.920 4.468 -20.834 1.00 33.03 H new ATOM 449 N GLU A 30 20.094 2.584 -19.728 1.00 22.42 N ATOM 450 CA GLU A 30 18.706 2.380 -19.330 1.00 4.05 C ATOM 451 C GLU A 30 18.595 1.259 -18.300 1.00 14.21 C ATOM 452 O GLU A 30 17.894 1.390 -17.297 1.00 51.22 O ATOM 453 CB GLU A 30 17.845 2.053 -20.551 1.00 13.20 C ATOM 454 CG GLU A 30 17.937 3.092 -21.656 1.00 71.44 C ATOM 455 CD GLU A 30 17.902 4.512 -21.127 1.00 2.02 C ATOM 456 OE1 GLU A 30 16.802 4.985 -20.772 1.00 3.33 O ATOM 457 OE2 GLU A 30 18.974 5.150 -21.068 1.00 12.23 O ATOM 0 H GLU A 30 20.252 2.561 -20.735 1.00 22.42 H new ATOM 0 HA GLU A 30 18.345 3.303 -18.877 1.00 4.05 H new ATOM 0 HB2 GLU A 30 18.147 1.084 -20.949 1.00 13.20 H new ATOM 0 HB3 GLU A 30 16.805 1.959 -20.237 1.00 13.20 H new ATOM 0 HG2 GLU A 30 18.859 2.940 -22.216 1.00 71.44 H new ATOM 0 HG3 GLU A 30 17.112 2.948 -22.354 1.00 71.44 H new ATOM 464 N GLY A 31 19.291 0.156 -18.557 1.00 30.04 N ATOM 465 CA GLY A 31 19.256 -0.972 -17.644 1.00 63.24 C ATOM 466 C GLY A 31 19.638 -0.586 -16.229 1.00 50.53 C ATOM 467 O GLY A 31 19.246 -1.248 -15.269 1.00 34.51 O ATOM 0 H GLY A 31 19.878 0.023 -19.380 1.00 30.04 H new ATOM 0 HA2 GLY A 31 18.255 -1.402 -17.642 1.00 63.24 H new ATOM 0 HA3 GLY A 31 19.935 -1.746 -18.002 1.00 63.24 H new ATOM 471 N LYS A 32 20.407 0.490 -16.099 1.00 22.14 N ATOM 472 CA LYS A 32 20.843 0.965 -14.791 1.00 25.21 C ATOM 473 C LYS A 32 19.832 1.943 -14.202 1.00 32.31 C ATOM 474 O LYS A 32 19.671 2.027 -12.984 1.00 54.32 O ATOM 475 CB LYS A 32 22.214 1.637 -14.901 1.00 20.23 C ATOM 476 CG LYS A 32 23.279 0.749 -15.522 1.00 14.32 C ATOM 477 CD LYS A 32 23.894 -0.186 -14.494 1.00 72.14 C ATOM 478 CE LYS A 32 24.992 0.504 -13.699 1.00 73.34 C ATOM 479 NZ LYS A 32 25.129 -0.068 -12.331 1.00 70.54 N ATOM 0 H LYS A 32 20.741 1.050 -16.884 1.00 22.14 H new ATOM 0 HA LYS A 32 20.919 0.104 -14.127 1.00 25.21 H new ATOM 0 HB2 LYS A 32 22.118 2.545 -15.496 1.00 20.23 H new ATOM 0 HB3 LYS A 32 22.541 1.941 -13.907 1.00 20.23 H new ATOM 0 HG2 LYS A 32 22.840 0.164 -16.331 1.00 14.32 H new ATOM 0 HG3 LYS A 32 24.059 1.369 -15.964 1.00 14.32 H new ATOM 0 HD2 LYS A 32 23.119 -0.541 -13.814 1.00 72.14 H new ATOM 0 HD3 LYS A 32 24.303 -1.062 -14.997 1.00 72.14 H new ATOM 0 HE2 LYS A 32 25.939 0.408 -14.229 1.00 73.34 H new ATOM 0 HE3 LYS A 32 24.773 1.569 -13.627 1.00 73.34 H new ATOM 0 HZ1 LYS A 32 25.887 0.429 -11.821 1.00 70.54 H new ATOM 0 HZ2 LYS A 32 24.233 0.046 -11.816 1.00 70.54 H new ATOM 0 HZ3 LYS A 32 25.363 -1.079 -12.399 1.00 70.54 H new ATOM 493 N LYS A 33 19.151 2.679 -15.073 1.00 40.15 N ATOM 494 CA LYS A 33 18.152 3.649 -14.641 1.00 4.52 C ATOM 495 C LYS A 33 16.976 2.954 -13.962 1.00 43.25 C ATOM 496 O LYS A 33 16.584 3.317 -12.853 1.00 35.02 O ATOM 497 CB LYS A 33 17.655 4.468 -15.835 1.00 24.52 C ATOM 498 CG LYS A 33 16.703 5.586 -15.451 1.00 54.51 C ATOM 499 CD LYS A 33 17.450 6.871 -15.133 1.00 30.31 C ATOM 500 CE LYS A 33 17.894 6.911 -13.679 1.00 3.32 C ATOM 501 NZ LYS A 33 18.032 8.308 -13.180 1.00 34.44 N ATOM 0 H LYS A 33 19.273 2.622 -16.084 1.00 40.15 H new ATOM 0 HA LYS A 33 18.621 4.318 -13.920 1.00 4.52 H new ATOM 0 HB2 LYS A 33 18.513 4.895 -16.354 1.00 24.52 H new ATOM 0 HB3 LYS A 33 17.155 3.802 -16.539 1.00 24.52 H new ATOM 0 HG2 LYS A 33 16.002 5.764 -16.266 1.00 54.51 H new ATOM 0 HG3 LYS A 33 16.115 5.283 -14.585 1.00 54.51 H new ATOM 0 HD2 LYS A 33 18.321 6.958 -15.783 1.00 30.31 H new ATOM 0 HD3 LYS A 33 16.809 7.727 -15.343 1.00 30.31 H new ATOM 0 HE2 LYS A 33 17.171 6.375 -13.064 1.00 3.32 H new ATOM 0 HE3 LYS A 33 18.847 6.392 -13.576 1.00 3.32 H new ATOM 0 HZ1 LYS A 33 18.336 8.293 -12.186 1.00 34.44 H new ATOM 0 HZ2 LYS A 33 18.740 8.812 -13.751 1.00 34.44 H new ATOM 0 HZ3 LYS A 33 17.116 8.795 -13.255 1.00 34.44 H new ATOM 515 N LEU A 34 16.419 1.953 -14.635 1.00 1.22 N ATOM 516 CA LEU A 34 15.288 1.205 -14.096 1.00 3.51 C ATOM 517 C LEU A 34 15.766 0.004 -13.287 1.00 32.20 C ATOM 518 O LEU A 34 15.183 -0.336 -12.258 1.00 72.34 O ATOM 519 CB LEU A 34 14.373 0.740 -15.229 1.00 55.35 C ATOM 520 CG LEU A 34 13.549 1.830 -15.917 1.00 60.22 C ATOM 521 CD1 LEU A 34 13.186 1.411 -17.333 1.00 60.33 C ATOM 522 CD2 LEU A 34 12.295 2.138 -15.112 1.00 50.43 C ATOM 0 H LEU A 34 16.732 1.641 -15.554 1.00 1.22 H new ATOM 0 HA LEU A 34 14.729 1.866 -13.434 1.00 3.51 H new ATOM 0 HB2 LEU A 34 14.985 0.245 -15.983 1.00 55.35 H new ATOM 0 HB3 LEU A 34 13.688 -0.009 -14.832 1.00 55.35 H new ATOM 0 HG LEU A 34 14.153 2.736 -15.972 1.00 60.22 H new ATOM 0 HD11 LEU A 34 12.600 2.199 -17.807 1.00 60.33 H new ATOM 0 HD12 LEU A 34 14.097 1.241 -17.907 1.00 60.33 H new ATOM 0 HD13 LEU A 34 12.600 0.492 -17.302 1.00 60.33 H new ATOM 0 HD21 LEU A 34 11.721 2.915 -15.616 1.00 50.43 H new ATOM 0 HD22 LEU A 34 11.688 1.237 -15.025 1.00 50.43 H new ATOM 0 HD23 LEU A 34 12.577 2.483 -14.117 1.00 50.43 H new ATOM 534 N GLY A 35 16.833 -0.635 -13.759 1.00 14.34 N ATOM 535 CA GLY A 35 17.372 -1.790 -13.066 1.00 20.13 C ATOM 536 C GLY A 35 17.154 -3.080 -13.832 1.00 43.43 C ATOM 537 O GLY A 35 17.073 -4.157 -13.240 1.00 54.50 O ATOM 0 H GLY A 35 17.333 -0.373 -14.609 1.00 14.34 H new ATOM 0 HA2 GLY A 35 18.440 -1.645 -12.901 1.00 20.13 H new ATOM 0 HA3 GLY A 35 16.906 -1.871 -12.084 1.00 20.13 H new ATOM 541 N LEU A 36 17.058 -2.972 -15.153 1.00 4.22 N ATOM 542 CA LEU A 36 16.847 -4.139 -16.002 1.00 50.23 C ATOM 543 C LEU A 36 18.178 -4.727 -16.461 1.00 14.13 C ATOM 544 O LEU A 36 19.192 -4.031 -16.509 1.00 61.24 O ATOM 545 CB LEU A 36 15.997 -3.762 -17.217 1.00 61.42 C ATOM 546 CG LEU A 36 14.652 -3.101 -16.916 1.00 51.43 C ATOM 547 CD1 LEU A 36 13.902 -2.805 -18.206 1.00 30.21 C ATOM 548 CD2 LEU A 36 13.816 -3.984 -16.001 1.00 51.34 C ATOM 0 H LEU A 36 17.123 -2.089 -15.659 1.00 4.22 H new ATOM 0 HA LEU A 36 16.321 -4.893 -15.417 1.00 50.23 H new ATOM 0 HB2 LEU A 36 16.578 -3.088 -17.846 1.00 61.42 H new ATOM 0 HB3 LEU A 36 15.813 -4.664 -17.801 1.00 61.42 H new ATOM 0 HG LEU A 36 14.839 -2.157 -16.404 1.00 51.43 H new ATOM 0 HD11 LEU A 36 12.947 -2.335 -17.972 1.00 30.21 H new ATOM 0 HD12 LEU A 36 14.495 -2.133 -18.826 1.00 30.21 H new ATOM 0 HD13 LEU A 36 13.726 -3.735 -18.746 1.00 30.21 H new ATOM 0 HD21 LEU A 36 12.862 -3.497 -15.798 1.00 51.34 H new ATOM 0 HD22 LEU A 36 13.638 -4.944 -16.485 1.00 51.34 H new ATOM 0 HD23 LEU A 36 14.349 -4.144 -15.064 1.00 51.34 H new ATOM 560 N VAL A 37 18.166 -6.013 -16.798 1.00 54.43 N ATOM 561 CA VAL A 37 19.370 -6.694 -17.256 1.00 64.04 C ATOM 562 C VAL A 37 19.214 -7.180 -18.693 1.00 23.22 C ATOM 563 O VAL A 37 18.207 -6.909 -19.345 1.00 43.53 O ATOM 564 CB VAL A 37 19.714 -7.894 -16.354 1.00 72.32 C ATOM 565 CG1 VAL A 37 19.854 -7.451 -14.906 1.00 33.11 C ATOM 566 CG2 VAL A 37 18.657 -8.980 -16.488 1.00 63.53 C ATOM 0 H VAL A 37 17.335 -6.604 -16.762 1.00 54.43 H new ATOM 0 HA VAL A 37 20.182 -5.968 -17.207 1.00 64.04 H new ATOM 0 HB VAL A 37 20.670 -8.307 -16.676 1.00 72.32 H new ATOM 0 HG11 VAL A 37 20.097 -8.312 -14.284 1.00 33.11 H new ATOM 0 HG12 VAL A 37 20.650 -6.710 -14.827 1.00 33.11 H new ATOM 0 HG13 VAL A 37 18.915 -7.012 -14.567 1.00 33.11 H new ATOM 0 HG21 VAL A 37 18.915 -9.821 -15.844 1.00 63.53 H new ATOM 0 HG22 VAL A 37 17.686 -8.582 -16.193 1.00 63.53 H new ATOM 0 HG23 VAL A 37 18.611 -9.317 -17.524 1.00 63.53 H new ATOM 576 N GLY A 38 20.219 -7.902 -19.180 1.00 70.22 N ATOM 577 CA GLY A 38 20.174 -8.416 -20.537 1.00 12.43 C ATOM 578 C GLY A 38 21.486 -8.229 -21.271 1.00 44.14 C ATOM 579 O GLY A 38 22.558 -8.295 -20.668 1.00 74.33 O ATOM 0 H GLY A 38 21.063 -8.140 -18.659 1.00 70.22 H new ATOM 0 HA2 GLY A 38 19.923 -9.476 -20.512 1.00 12.43 H new ATOM 0 HA3 GLY A 38 19.379 -7.913 -21.087 1.00 12.43 H new ATOM 583 N TRP A 39 21.404 -7.997 -22.576 1.00 41.43 N ATOM 584 CA TRP A 39 22.596 -7.802 -23.394 1.00 52.44 C ATOM 585 C TRP A 39 22.257 -7.056 -24.681 1.00 21.24 C ATOM 586 O TRP A 39 21.164 -7.206 -25.227 1.00 63.33 O ATOM 587 CB TRP A 39 23.238 -9.150 -23.726 1.00 2.44 C ATOM 588 CG TRP A 39 22.373 -10.026 -24.580 1.00 42.11 C ATOM 589 CD1 TRP A 39 22.167 -9.912 -25.925 1.00 62.54 C ATOM 590 CD2 TRP A 39 21.597 -11.148 -24.146 1.00 54.24 C ATOM 591 NE1 TRP A 39 21.309 -10.896 -26.354 1.00 63.52 N ATOM 592 CE2 TRP A 39 20.946 -11.668 -25.282 1.00 53.13 C ATOM 593 CE3 TRP A 39 21.390 -11.765 -22.910 1.00 35.10 C ATOM 594 CZ2 TRP A 39 20.103 -12.774 -25.215 1.00 54.14 C ATOM 595 CZ3 TRP A 39 20.552 -12.862 -22.845 1.00 62.53 C ATOM 596 CH2 TRP A 39 19.918 -13.358 -23.992 1.00 72.40 C ATOM 0 H TRP A 39 20.525 -7.939 -23.091 1.00 41.43 H new ATOM 0 HA TRP A 39 23.304 -7.201 -22.823 1.00 52.44 H new ATOM 0 HB2 TRP A 39 24.185 -8.977 -24.238 1.00 2.44 H new ATOM 0 HB3 TRP A 39 23.468 -9.673 -22.798 1.00 2.44 H new ATOM 0 HD1 TRP A 39 22.613 -9.159 -26.558 1.00 62.54 H new ATOM 0 HE1 TRP A 39 20.994 -11.030 -27.315 1.00 63.52 H new ATOM 0 HE3 TRP A 39 21.876 -11.391 -22.021 1.00 35.10 H new ATOM 0 HZ2 TRP A 39 19.612 -13.157 -26.098 1.00 54.14 H new ATOM 0 HZ3 TRP A 39 20.383 -13.345 -21.894 1.00 62.53 H new ATOM 0 HH2 TRP A 39 19.271 -14.218 -23.909 1.00 72.40 H new ATOM 607 N VAL A 40 23.201 -6.252 -25.160 1.00 30.12 N ATOM 608 CA VAL A 40 23.002 -5.484 -26.383 1.00 64.21 C ATOM 609 C VAL A 40 24.162 -5.684 -27.352 1.00 63.40 C ATOM 610 O VAL A 40 25.316 -5.793 -26.939 1.00 24.21 O ATOM 611 CB VAL A 40 22.852 -3.981 -26.084 1.00 15.21 C ATOM 612 CG1 VAL A 40 24.116 -3.435 -25.438 1.00 60.22 C ATOM 613 CG2 VAL A 40 22.520 -3.215 -27.356 1.00 34.51 C ATOM 0 H VAL A 40 24.111 -6.116 -24.720 1.00 30.12 H new ATOM 0 HA VAL A 40 22.082 -5.850 -26.840 1.00 64.21 H new ATOM 0 HB VAL A 40 22.029 -3.849 -25.382 1.00 15.21 H new ATOM 0 HG11 VAL A 40 23.990 -2.372 -25.234 1.00 60.22 H new ATOM 0 HG12 VAL A 40 24.305 -3.964 -24.504 1.00 60.22 H new ATOM 0 HG13 VAL A 40 24.960 -3.578 -26.112 1.00 60.22 H new ATOM 0 HG21 VAL A 40 22.418 -2.155 -27.126 1.00 34.51 H new ATOM 0 HG22 VAL A 40 23.320 -3.353 -28.083 1.00 34.51 H new ATOM 0 HG23 VAL A 40 21.584 -3.588 -27.772 1.00 34.51 H new ATOM 623 N GLN A 41 23.847 -5.731 -28.642 1.00 71.43 N ATOM 624 CA GLN A 41 24.864 -5.919 -29.670 1.00 52.24 C ATOM 625 C GLN A 41 24.331 -5.520 -31.042 1.00 53.15 C ATOM 626 O GLN A 41 23.154 -5.715 -31.342 1.00 54.41 O ATOM 627 CB GLN A 41 25.332 -7.375 -29.695 1.00 54.14 C ATOM 628 CG GLN A 41 26.637 -7.582 -30.446 1.00 42.31 C ATOM 629 CD GLN A 41 26.830 -9.016 -30.898 1.00 1.05 C ATOM 630 OE1 GLN A 41 27.620 -9.761 -30.317 1.00 45.31 O ATOM 631 NE2 GLN A 41 26.107 -9.412 -31.938 1.00 53.44 N ATOM 0 H GLN A 41 22.896 -5.642 -29.000 1.00 71.43 H new ATOM 0 HA GLN A 41 25.711 -5.277 -29.429 1.00 52.24 H new ATOM 0 HB2 GLN A 41 25.452 -7.727 -28.670 1.00 54.14 H new ATOM 0 HB3 GLN A 41 24.557 -7.989 -30.154 1.00 54.14 H new ATOM 0 HG2 GLN A 41 26.659 -6.925 -31.315 1.00 42.31 H new ATOM 0 HG3 GLN A 41 27.470 -7.292 -29.806 1.00 42.31 H new ATOM 0 HE21 GLN A 41 25.464 -8.761 -32.390 1.00 53.44 H new ATOM 0 HE22 GLN A 41 26.194 -10.367 -32.286 1.00 53.44 H new ATOM 640 N ASN A 42 25.205 -4.960 -31.872 1.00 65.40 N ATOM 641 CA ASN A 42 24.822 -4.533 -33.213 1.00 1.03 C ATOM 642 C ASN A 42 25.166 -5.603 -34.244 1.00 62.30 C ATOM 643 O ASN A 42 26.175 -6.299 -34.121 1.00 41.23 O ATOM 644 CB ASN A 42 25.521 -3.220 -33.571 1.00 52.13 C ATOM 645 CG ASN A 42 27.031 -3.357 -33.598 1.00 31.11 C ATOM 646 OD1 ASN A 42 27.677 -3.430 -32.553 1.00 2.44 O ATOM 647 ND2 ASN A 42 27.600 -3.393 -34.797 1.00 5.11 N ATOM 0 H ASN A 42 26.184 -4.791 -31.639 1.00 65.40 H new ATOM 0 HA ASN A 42 23.743 -4.378 -33.224 1.00 1.03 H new ATOM 0 HB2 ASN A 42 25.172 -2.880 -34.546 1.00 52.13 H new ATOM 0 HB3 ASN A 42 25.241 -2.454 -32.848 1.00 52.13 H new ATOM 0 HD21 ASN A 42 28.613 -3.484 -34.878 1.00 5.11 H new ATOM 0 HD22 ASN A 42 27.025 -3.329 -35.637 1.00 5.11 H new ATOM 654 N THR A 43 24.321 -5.730 -35.262 1.00 74.11 N ATOM 655 CA THR A 43 24.534 -6.715 -36.315 1.00 30.22 C ATOM 656 C THR A 43 24.890 -6.041 -37.635 1.00 4.03 C ATOM 657 O THR A 43 24.903 -4.814 -37.732 1.00 51.23 O ATOM 658 CB THR A 43 23.287 -7.596 -36.521 1.00 41.44 C ATOM 659 OG1 THR A 43 22.217 -6.811 -37.059 1.00 51.22 O ATOM 660 CG2 THR A 43 22.849 -8.229 -35.210 1.00 34.23 C ATOM 0 H THR A 43 23.482 -5.162 -35.380 1.00 74.11 H new ATOM 0 HA THR A 43 25.365 -7.344 -35.996 1.00 30.22 H new ATOM 0 HB THR A 43 23.542 -8.391 -37.222 1.00 41.44 H new ATOM 0 HG1 THR A 43 21.422 -6.911 -36.495 1.00 51.22 H new ATOM 0 HG21 THR A 43 21.967 -8.846 -35.381 1.00 34.23 H new ATOM 0 HG22 THR A 43 23.655 -8.849 -34.818 1.00 34.23 H new ATOM 0 HG23 THR A 43 22.610 -7.446 -34.490 1.00 34.23 H new ATOM 668 N ASP A 44 25.179 -6.850 -38.648 1.00 31.22 N ATOM 669 CA ASP A 44 25.534 -6.331 -39.964 1.00 20.34 C ATOM 670 C ASP A 44 24.284 -6.026 -40.783 1.00 71.51 C ATOM 671 O ASP A 44 24.300 -5.162 -41.660 1.00 31.32 O ATOM 672 CB ASP A 44 26.416 -7.334 -40.710 1.00 1.43 C ATOM 673 CG ASP A 44 27.819 -7.407 -40.139 1.00 73.50 C ATOM 674 OD1 ASP A 44 28.600 -6.459 -40.360 1.00 43.41 O ATOM 675 OD2 ASP A 44 28.135 -8.414 -39.471 1.00 14.33 O ATOM 0 H ASP A 44 25.174 -7.868 -38.583 1.00 31.22 H new ATOM 0 HA ASP A 44 26.090 -5.404 -39.824 1.00 20.34 H new ATOM 0 HB2 ASP A 44 25.957 -8.321 -40.665 1.00 1.43 H new ATOM 0 HB3 ASP A 44 26.469 -7.055 -41.762 1.00 1.43 H new ATOM 680 N ARG A 45 23.203 -6.742 -40.492 1.00 72.51 N ATOM 681 CA ARG A 45 21.945 -6.550 -41.204 1.00 32.15 C ATOM 682 C ARG A 45 21.422 -5.130 -41.009 1.00 41.34 C ATOM 683 O ARG A 45 20.694 -4.605 -41.851 1.00 0.23 O ATOM 684 CB ARG A 45 20.902 -7.559 -40.720 1.00 74.34 C ATOM 685 CG ARG A 45 20.944 -8.883 -41.466 1.00 30.20 C ATOM 686 CD ARG A 45 21.858 -9.883 -40.775 1.00 45.41 C ATOM 687 NE ARG A 45 21.427 -10.166 -39.409 1.00 11.00 N ATOM 688 CZ ARG A 45 22.180 -10.800 -38.517 1.00 74.41 C ATOM 689 NH1 ARG A 45 23.395 -11.215 -38.846 1.00 4.22 N ATOM 690 NH2 ARG A 45 21.717 -11.021 -37.293 1.00 73.03 N ATOM 0 H ARG A 45 23.173 -7.460 -39.768 1.00 72.51 H new ATOM 0 HA ARG A 45 22.129 -6.709 -42.266 1.00 32.15 H new ATOM 0 HB2 ARG A 45 21.055 -7.745 -39.657 1.00 74.34 H new ATOM 0 HB3 ARG A 45 19.909 -7.122 -40.827 1.00 74.34 H new ATOM 0 HG2 ARG A 45 19.937 -9.295 -41.534 1.00 30.20 H new ATOM 0 HG3 ARG A 45 21.290 -8.716 -42.486 1.00 30.20 H new ATOM 0 HD2 ARG A 45 21.879 -10.810 -41.348 1.00 45.41 H new ATOM 0 HD3 ARG A 45 22.876 -9.494 -40.761 1.00 45.41 H new ATOM 0 HE ARG A 45 20.497 -9.860 -39.124 1.00 11.00 H new ATOM 0 HH11 ARG A 45 23.754 -11.048 -39.786 1.00 4.22 H new ATOM 0 HH12 ARG A 45 23.971 -11.702 -38.159 1.00 4.22 H new ATOM 0 HH21 ARG A 45 20.782 -10.704 -37.036 1.00 73.03 H new ATOM 0 HH22 ARG A 45 22.296 -11.508 -36.609 1.00 73.03 H new ATOM 704 N GLY A 46 21.799 -4.513 -39.893 1.00 61.13 N ATOM 705 CA GLY A 46 21.359 -3.160 -39.608 1.00 52.04 C ATOM 706 C GLY A 46 20.387 -3.099 -38.447 1.00 2.05 C ATOM 707 O GLY A 46 19.378 -2.396 -38.507 1.00 35.30 O ATOM 0 H GLY A 46 22.401 -4.926 -39.181 1.00 61.13 H new ATOM 0 HA2 GLY A 46 22.226 -2.539 -39.385 1.00 52.04 H new ATOM 0 HA3 GLY A 46 20.886 -2.740 -40.496 1.00 52.04 H new ATOM 711 N THR A 47 20.690 -3.839 -37.384 1.00 41.41 N ATOM 712 CA THR A 47 19.835 -3.868 -36.204 1.00 71.14 C ATOM 713 C THR A 47 20.657 -4.049 -34.934 1.00 22.44 C ATOM 714 O THR A 47 21.861 -4.302 -34.992 1.00 13.45 O ATOM 715 CB THR A 47 18.793 -4.999 -36.294 1.00 22.31 C ATOM 716 OG1 THR A 47 19.449 -6.272 -36.277 1.00 3.01 O ATOM 717 CG2 THR A 47 17.961 -4.869 -37.560 1.00 74.23 C ATOM 0 H THR A 47 21.521 -4.426 -37.317 1.00 41.41 H new ATOM 0 HA THR A 47 19.318 -2.909 -36.164 1.00 71.14 H new ATOM 0 HB THR A 47 18.130 -4.921 -35.433 1.00 22.31 H new ATOM 0 HG1 THR A 47 18.802 -6.976 -36.492 1.00 3.01 H new ATOM 0 HG21 THR A 47 17.232 -5.679 -37.601 1.00 74.23 H new ATOM 0 HG22 THR A 47 17.440 -3.912 -37.556 1.00 74.23 H new ATOM 0 HG23 THR A 47 18.614 -4.923 -38.431 1.00 74.23 H new ATOM 725 N VAL A 48 20.000 -3.920 -33.785 1.00 51.14 N ATOM 726 CA VAL A 48 20.670 -4.071 -32.500 1.00 22.35 C ATOM 727 C VAL A 48 19.930 -5.061 -31.607 1.00 70.21 C ATOM 728 O VAL A 48 19.017 -4.686 -30.872 1.00 50.13 O ATOM 729 CB VAL A 48 20.787 -2.722 -31.765 1.00 72.51 C ATOM 730 CG1 VAL A 48 21.464 -2.906 -30.415 1.00 73.03 C ATOM 731 CG2 VAL A 48 21.544 -1.716 -32.618 1.00 12.41 C ATOM 0 H VAL A 48 19.004 -3.711 -33.719 1.00 51.14 H new ATOM 0 HA VAL A 48 21.670 -4.451 -32.708 1.00 22.35 H new ATOM 0 HB VAL A 48 19.783 -2.334 -31.591 1.00 72.51 H new ATOM 0 HG11 VAL A 48 21.538 -1.943 -29.911 1.00 73.03 H new ATOM 0 HG12 VAL A 48 20.877 -3.591 -29.804 1.00 73.03 H new ATOM 0 HG13 VAL A 48 22.463 -3.316 -30.562 1.00 73.03 H new ATOM 0 HG21 VAL A 48 21.618 -0.769 -32.084 1.00 12.41 H new ATOM 0 HG22 VAL A 48 22.545 -2.095 -32.825 1.00 12.41 H new ATOM 0 HG23 VAL A 48 21.013 -1.563 -33.557 1.00 12.41 H new ATOM 741 N GLN A 49 20.331 -6.327 -31.677 1.00 13.53 N ATOM 742 CA GLN A 49 19.704 -7.371 -30.875 1.00 5.24 C ATOM 743 C GLN A 49 19.734 -7.010 -29.393 1.00 34.20 C ATOM 744 O GLN A 49 20.770 -7.114 -28.739 1.00 4.51 O ATOM 745 CB GLN A 49 20.411 -8.709 -31.100 1.00 13.21 C ATOM 746 CG GLN A 49 19.815 -9.528 -32.233 1.00 52.04 C ATOM 747 CD GLN A 49 18.724 -10.470 -31.762 1.00 43.32 C ATOM 748 OE1 GLN A 49 18.403 -10.522 -30.575 1.00 4.25 O ATOM 749 NE2 GLN A 49 18.147 -11.221 -32.693 1.00 44.20 N ATOM 0 H GLN A 49 21.086 -6.654 -32.280 1.00 13.53 H new ATOM 0 HA GLN A 49 18.664 -7.460 -31.188 1.00 5.24 H new ATOM 0 HB2 GLN A 49 21.464 -8.523 -31.312 1.00 13.21 H new ATOM 0 HB3 GLN A 49 20.369 -9.292 -30.180 1.00 13.21 H new ATOM 0 HG2 GLN A 49 19.408 -8.855 -32.987 1.00 52.04 H new ATOM 0 HG3 GLN A 49 20.605 -10.105 -32.714 1.00 52.04 H new ATOM 0 HE21 GLN A 49 18.444 -11.145 -33.666 1.00 44.20 H new ATOM 0 HE22 GLN A 49 17.406 -11.873 -32.435 1.00 44.20 H new ATOM 758 N GLY A 50 18.587 -6.586 -28.869 1.00 43.04 N ATOM 759 CA GLY A 50 18.504 -6.216 -27.469 1.00 14.14 C ATOM 760 C GLY A 50 17.377 -6.928 -26.747 1.00 71.51 C ATOM 761 O GLY A 50 16.290 -7.105 -27.298 1.00 21.21 O ATOM 0 H GLY A 50 17.715 -6.493 -29.390 1.00 43.04 H new ATOM 0 HA2 GLY A 50 19.449 -6.448 -26.978 1.00 14.14 H new ATOM 0 HA3 GLY A 50 18.359 -5.139 -27.389 1.00 14.14 H new ATOM 765 N LYS A 51 17.636 -7.341 -25.511 1.00 13.22 N ATOM 766 CA LYS A 51 16.636 -8.039 -24.712 1.00 13.04 C ATOM 767 C LYS A 51 16.319 -7.263 -23.437 1.00 25.11 C ATOM 768 O LYS A 51 17.184 -6.586 -22.879 1.00 64.22 O ATOM 769 CB LYS A 51 17.127 -9.444 -24.357 1.00 73.53 C ATOM 770 CG LYS A 51 16.247 -10.159 -23.346 1.00 4.25 C ATOM 771 CD LYS A 51 16.813 -11.520 -22.978 1.00 71.53 C ATOM 772 CE LYS A 51 16.295 -12.608 -23.907 1.00 32.12 C ATOM 773 NZ LYS A 51 16.363 -13.955 -23.276 1.00 21.13 N ATOM 0 H LYS A 51 18.531 -7.204 -25.041 1.00 13.22 H new ATOM 0 HA LYS A 51 15.725 -8.118 -25.305 1.00 13.04 H new ATOM 0 HB2 LYS A 51 17.180 -10.042 -25.267 1.00 73.53 H new ATOM 0 HB3 LYS A 51 18.140 -9.376 -23.961 1.00 73.53 H new ATOM 0 HG2 LYS A 51 16.153 -9.548 -22.448 1.00 4.25 H new ATOM 0 HG3 LYS A 51 15.244 -10.280 -23.756 1.00 4.25 H new ATOM 0 HD2 LYS A 51 17.902 -11.488 -23.025 1.00 71.53 H new ATOM 0 HD3 LYS A 51 16.545 -11.761 -21.949 1.00 71.53 H new ATOM 0 HE2 LYS A 51 15.264 -12.388 -24.184 1.00 32.12 H new ATOM 0 HE3 LYS A 51 16.879 -12.608 -24.827 1.00 32.12 H new ATOM 0 HZ1 LYS A 51 16.001 -14.668 -23.941 1.00 21.13 H new ATOM 0 HZ2 LYS A 51 17.350 -14.176 -23.035 1.00 21.13 H new ATOM 0 HZ3 LYS A 51 15.785 -13.963 -22.411 1.00 21.13 H new ATOM 787 N LEU A 52 15.076 -7.367 -22.980 1.00 5.31 N ATOM 788 CA LEU A 52 14.646 -6.676 -21.769 1.00 44.32 C ATOM 789 C LEU A 52 14.262 -7.673 -20.681 1.00 2.34 C ATOM 790 O LEU A 52 13.106 -8.083 -20.582 1.00 62.24 O ATOM 791 CB LEU A 52 13.463 -5.757 -22.076 1.00 54.20 C ATOM 792 CG LEU A 52 13.516 -5.016 -23.413 1.00 25.42 C ATOM 793 CD1 LEU A 52 12.346 -4.054 -23.537 1.00 52.43 C ATOM 794 CD2 LEU A 52 14.837 -4.275 -23.559 1.00 2.22 C ATOM 0 H LEU A 52 14.348 -7.923 -23.429 1.00 5.31 H new ATOM 0 HA LEU A 52 15.480 -6.075 -21.407 1.00 44.32 H new ATOM 0 HB2 LEU A 52 12.550 -6.352 -22.050 1.00 54.20 H new ATOM 0 HB3 LEU A 52 13.386 -5.019 -21.278 1.00 54.20 H new ATOM 0 HG LEU A 52 13.443 -5.749 -24.216 1.00 25.42 H new ATOM 0 HD11 LEU A 52 12.401 -3.536 -24.495 1.00 52.43 H new ATOM 0 HD12 LEU A 52 11.410 -4.610 -23.478 1.00 52.43 H new ATOM 0 HD13 LEU A 52 12.387 -3.325 -22.727 1.00 52.43 H new ATOM 0 HD21 LEU A 52 14.858 -3.753 -24.516 1.00 2.22 H new ATOM 0 HD22 LEU A 52 14.940 -3.552 -22.749 1.00 2.22 H new ATOM 0 HD23 LEU A 52 15.661 -4.988 -23.516 1.00 2.22 H new ATOM 806 N GLN A 53 15.239 -8.056 -19.865 1.00 11.44 N ATOM 807 CA GLN A 53 15.002 -9.003 -18.782 1.00 71.10 C ATOM 808 C GLN A 53 14.750 -8.274 -17.466 1.00 72.42 C ATOM 809 O GLN A 53 15.595 -7.515 -16.994 1.00 32.44 O ATOM 810 CB GLN A 53 16.194 -9.950 -18.634 1.00 43.32 C ATOM 811 CG GLN A 53 16.112 -10.845 -17.408 1.00 43.31 C ATOM 812 CD GLN A 53 17.113 -11.983 -17.448 1.00 42.42 C ATOM 813 OE1 GLN A 53 18.113 -11.971 -16.729 1.00 35.32 O ATOM 814 NE2 GLN A 53 16.850 -12.974 -18.292 1.00 13.33 N ATOM 0 H GLN A 53 16.201 -7.725 -19.933 1.00 11.44 H new ATOM 0 HA GLN A 53 14.114 -9.584 -19.030 1.00 71.10 H new ATOM 0 HB2 GLN A 53 16.264 -10.574 -19.525 1.00 43.32 H new ATOM 0 HB3 GLN A 53 17.110 -9.362 -18.584 1.00 43.32 H new ATOM 0 HG2 GLN A 53 16.284 -10.246 -16.514 1.00 43.31 H new ATOM 0 HG3 GLN A 53 15.105 -11.255 -17.329 1.00 43.31 H new ATOM 0 HE21 GLN A 53 16.009 -12.943 -18.869 1.00 13.33 H new ATOM 0 HE22 GLN A 53 17.489 -13.766 -18.363 1.00 13.33 H new ATOM 823 N GLY A 54 13.580 -8.511 -16.879 1.00 4.50 N ATOM 824 CA GLY A 54 13.238 -7.869 -15.623 1.00 52.43 C ATOM 825 C GLY A 54 11.741 -7.723 -15.436 1.00 54.23 C ATOM 826 O GLY A 54 10.942 -8.306 -16.170 1.00 1.12 O ATOM 0 H GLY A 54 12.864 -9.135 -17.251 1.00 4.50 H new ATOM 0 HA2 GLY A 54 13.649 -8.450 -14.798 1.00 52.43 H new ATOM 0 HA3 GLY A 54 13.704 -6.884 -15.583 1.00 52.43 H new ATOM 830 N PRO A 55 11.340 -6.929 -14.432 1.00 24.12 N ATOM 831 CA PRO A 55 9.927 -6.691 -14.126 1.00 54.13 C ATOM 832 C PRO A 55 9.236 -5.851 -15.195 1.00 71.24 C ATOM 833 O PRO A 55 9.775 -4.841 -15.648 1.00 14.41 O ATOM 834 CB PRO A 55 9.974 -5.932 -12.798 1.00 12.11 C ATOM 835 CG PRO A 55 11.310 -5.272 -12.786 1.00 34.44 C ATOM 836 CD PRO A 55 12.237 -6.203 -13.517 1.00 42.54 C ATOM 0 HA PRO A 55 9.358 -7.620 -14.082 1.00 54.13 H new ATOM 0 HB2 PRO A 55 9.170 -5.199 -12.732 1.00 12.11 H new ATOM 0 HB3 PRO A 55 9.859 -6.608 -11.951 1.00 12.11 H new ATOM 0 HG2 PRO A 55 11.269 -4.299 -13.275 1.00 34.44 H new ATOM 0 HG3 PRO A 55 11.652 -5.102 -11.765 1.00 34.44 H new ATOM 0 HD2 PRO A 55 13.009 -5.657 -14.060 1.00 42.54 H new ATOM 0 HD3 PRO A 55 12.747 -6.881 -12.833 1.00 42.54 H new ATOM 844 N ILE A 56 8.042 -6.275 -15.594 1.00 74.53 N ATOM 845 CA ILE A 56 7.277 -5.561 -16.609 1.00 44.21 C ATOM 846 C ILE A 56 6.976 -4.133 -16.166 1.00 61.14 C ATOM 847 O ILE A 56 6.853 -3.229 -16.993 1.00 11.03 O ATOM 848 CB ILE A 56 5.952 -6.279 -16.925 1.00 41.23 C ATOM 849 CG1 ILE A 56 6.222 -7.706 -17.405 1.00 60.34 C ATOM 850 CG2 ILE A 56 5.165 -5.502 -17.971 1.00 24.43 C ATOM 851 CD1 ILE A 56 5.003 -8.601 -17.356 1.00 25.25 C ATOM 0 H ILE A 56 7.583 -7.110 -15.230 1.00 74.53 H new ATOM 0 HA ILE A 56 7.891 -5.538 -17.509 1.00 44.21 H new ATOM 0 HB ILE A 56 5.356 -6.329 -16.014 1.00 41.23 H new ATOM 0 HG12 ILE A 56 6.597 -7.672 -18.428 1.00 60.34 H new ATOM 0 HG13 ILE A 56 7.009 -8.144 -16.792 1.00 60.34 H new ATOM 0 HG21 ILE A 56 4.231 -6.022 -18.184 1.00 24.43 H new ATOM 0 HG22 ILE A 56 4.946 -4.503 -17.594 1.00 24.43 H new ATOM 0 HG23 ILE A 56 5.753 -5.424 -18.885 1.00 24.43 H new ATOM 0 HD11 ILE A 56 5.268 -9.597 -17.710 1.00 25.25 H new ATOM 0 HD12 ILE A 56 4.640 -8.666 -16.330 1.00 25.25 H new ATOM 0 HD13 ILE A 56 4.221 -8.186 -17.992 1.00 25.25 H new ATOM 863 N SER A 57 6.860 -3.937 -14.857 1.00 24.32 N ATOM 864 CA SER A 57 6.572 -2.619 -14.303 1.00 74.55 C ATOM 865 C SER A 57 7.550 -1.579 -14.840 1.00 12.21 C ATOM 866 O SER A 57 7.211 -0.403 -14.977 1.00 71.25 O ATOM 867 CB SER A 57 6.638 -2.659 -12.776 1.00 4.25 C ATOM 868 OG SER A 57 6.930 -1.378 -12.245 1.00 1.33 O ATOM 0 H SER A 57 6.961 -4.674 -14.160 1.00 24.32 H new ATOM 0 HA SER A 57 5.565 -2.336 -14.608 1.00 74.55 H new ATOM 0 HB2 SER A 57 5.688 -3.014 -12.377 1.00 4.25 H new ATOM 0 HB3 SER A 57 7.402 -3.370 -12.460 1.00 4.25 H new ATOM 0 HG SER A 57 6.965 -1.430 -11.267 1.00 1.33 H new ATOM 874 N LYS A 58 8.766 -2.020 -15.142 1.00 3.23 N ATOM 875 CA LYS A 58 9.796 -1.129 -15.665 1.00 33.35 C ATOM 876 C LYS A 58 10.005 -1.357 -17.158 1.00 70.31 C ATOM 877 O LYS A 58 10.139 -0.406 -17.929 1.00 23.54 O ATOM 878 CB LYS A 58 11.113 -1.344 -14.916 1.00 10.34 C ATOM 879 CG LYS A 58 11.192 -0.593 -13.597 1.00 62.53 C ATOM 880 CD LYS A 58 10.438 -1.320 -12.496 1.00 51.32 C ATOM 881 CE LYS A 58 10.381 -0.493 -11.221 1.00 14.31 C ATOM 882 NZ LYS A 58 10.267 -1.350 -10.009 1.00 31.04 N ATOM 0 H LYS A 58 9.063 -2.990 -15.034 1.00 3.23 H new ATOM 0 HA LYS A 58 9.463 -0.102 -15.515 1.00 33.35 H new ATOM 0 HB2 LYS A 58 11.244 -2.409 -14.726 1.00 10.34 H new ATOM 0 HB3 LYS A 58 11.939 -1.030 -15.554 1.00 10.34 H new ATOM 0 HG2 LYS A 58 12.236 -0.474 -13.307 1.00 62.53 H new ATOM 0 HG3 LYS A 58 10.780 0.408 -13.722 1.00 62.53 H new ATOM 0 HD2 LYS A 58 9.425 -1.542 -12.832 1.00 51.32 H new ATOM 0 HD3 LYS A 58 10.922 -2.275 -12.291 1.00 51.32 H new ATOM 0 HE2 LYS A 58 11.277 0.123 -11.147 1.00 14.31 H new ATOM 0 HE3 LYS A 58 9.530 0.187 -11.267 1.00 14.31 H new ATOM 0 HZ1 LYS A 58 10.231 -0.749 -9.161 1.00 31.04 H new ATOM 0 HZ2 LYS A 58 9.399 -1.919 -10.067 1.00 31.04 H new ATOM 0 HZ3 LYS A 58 11.092 -1.981 -9.951 1.00 31.04 H new ATOM 896 N VAL A 59 10.030 -2.624 -17.561 1.00 43.31 N ATOM 897 CA VAL A 59 10.220 -2.976 -18.963 1.00 64.30 C ATOM 898 C VAL A 59 9.229 -2.237 -19.855 1.00 23.01 C ATOM 899 O VAL A 59 9.538 -1.902 -20.999 1.00 32.33 O ATOM 900 CB VAL A 59 10.064 -4.492 -19.187 1.00 30.12 C ATOM 901 CG1 VAL A 59 10.344 -4.849 -20.639 1.00 22.55 C ATOM 902 CG2 VAL A 59 10.982 -5.266 -18.252 1.00 55.30 C ATOM 0 H VAL A 59 9.921 -3.423 -16.936 1.00 43.31 H new ATOM 0 HA VAL A 59 11.235 -2.679 -19.229 1.00 64.30 H new ATOM 0 HB VAL A 59 9.035 -4.771 -18.961 1.00 30.12 H new ATOM 0 HG11 VAL A 59 10.229 -5.924 -20.778 1.00 22.55 H new ATOM 0 HG12 VAL A 59 9.642 -4.322 -21.285 1.00 22.55 H new ATOM 0 HG13 VAL A 59 11.362 -4.557 -20.896 1.00 22.55 H new ATOM 0 HG21 VAL A 59 10.859 -6.335 -18.424 1.00 55.30 H new ATOM 0 HG22 VAL A 59 12.017 -4.985 -18.444 1.00 55.30 H new ATOM 0 HG23 VAL A 59 10.728 -5.033 -17.218 1.00 55.30 H new ATOM 912 N ARG A 60 8.037 -1.985 -19.324 1.00 5.14 N ATOM 913 CA ARG A 60 7.000 -1.285 -20.072 1.00 31.53 C ATOM 914 C ARG A 60 7.534 0.022 -20.650 1.00 20.23 C ATOM 915 O ARG A 60 7.082 0.477 -21.700 1.00 24.01 O ATOM 916 CB ARG A 60 5.795 -1.003 -19.172 1.00 61.32 C ATOM 917 CG ARG A 60 4.922 -2.222 -18.924 1.00 74.10 C ATOM 918 CD ARG A 60 3.823 -2.342 -19.969 1.00 21.34 C ATOM 919 NE ARG A 60 2.748 -1.379 -19.746 1.00 44.20 N ATOM 920 CZ ARG A 60 1.729 -1.209 -20.581 1.00 1.13 C ATOM 921 NH1 ARG A 60 1.646 -1.935 -21.687 1.00 41.53 N ATOM 922 NH2 ARG A 60 0.790 -0.312 -20.309 1.00 13.01 N ATOM 0 H ARG A 60 7.766 -2.255 -18.379 1.00 5.14 H new ATOM 0 HA ARG A 60 6.687 -1.925 -20.897 1.00 31.53 H new ATOM 0 HB2 ARG A 60 6.149 -0.619 -18.215 1.00 61.32 H new ATOM 0 HB3 ARG A 60 5.189 -0.219 -19.626 1.00 61.32 H new ATOM 0 HG2 ARG A 60 5.538 -3.121 -18.937 1.00 74.10 H new ATOM 0 HG3 ARG A 60 4.476 -2.156 -17.931 1.00 74.10 H new ATOM 0 HD2 ARG A 60 4.248 -2.188 -20.961 1.00 21.34 H new ATOM 0 HD3 ARG A 60 3.414 -3.352 -19.951 1.00 21.34 H new ATOM 0 HE ARG A 60 2.781 -0.806 -18.903 1.00 44.20 H new ATOM 0 HH11 ARG A 60 2.366 -2.626 -21.899 1.00 41.53 H new ATOM 0 HH12 ARG A 60 0.862 -1.802 -22.326 1.00 41.53 H new ATOM 0 HH21 ARG A 60 0.850 0.248 -19.458 1.00 13.01 H new ATOM 0 HH22 ARG A 60 0.008 -0.182 -20.951 1.00 13.01 H new ATOM 936 N GLU A 61 8.497 0.620 -19.956 1.00 23.13 N ATOM 937 CA GLU A 61 9.091 1.875 -20.400 1.00 42.41 C ATOM 938 C GLU A 61 10.226 1.621 -21.388 1.00 21.21 C ATOM 939 O GLU A 61 10.376 2.339 -22.376 1.00 11.33 O ATOM 940 CB GLU A 61 9.612 2.671 -19.202 1.00 5.04 C ATOM 941 CG GLU A 61 8.579 2.868 -18.105 1.00 72.34 C ATOM 942 CD GLU A 61 7.516 3.882 -18.481 1.00 2.31 C ATOM 943 OE1 GLU A 61 6.600 3.524 -19.251 1.00 24.12 O ATOM 944 OE2 GLU A 61 7.600 5.034 -18.006 1.00 23.24 O ATOM 0 H GLU A 61 8.882 0.256 -19.085 1.00 23.13 H new ATOM 0 HA GLU A 61 8.317 2.455 -20.903 1.00 42.41 H new ATOM 0 HB2 GLU A 61 10.479 2.158 -18.785 1.00 5.04 H new ATOM 0 HB3 GLU A 61 9.954 3.647 -19.546 1.00 5.04 H new ATOM 0 HG2 GLU A 61 8.103 1.913 -17.884 1.00 72.34 H new ATOM 0 HG3 GLU A 61 9.080 3.193 -17.193 1.00 72.34 H new ATOM 951 N MET A 62 11.023 0.593 -21.113 1.00 12.32 N ATOM 952 CA MET A 62 12.144 0.243 -21.977 1.00 51.23 C ATOM 953 C MET A 62 11.688 0.095 -23.425 1.00 61.44 C ATOM 954 O MET A 62 12.426 0.422 -24.354 1.00 3.52 O ATOM 955 CB MET A 62 12.797 -1.055 -21.500 1.00 63.33 C ATOM 956 CG MET A 62 14.131 -1.346 -22.169 1.00 3.44 C ATOM 957 SD MET A 62 15.404 -0.147 -21.728 1.00 24.34 S ATOM 958 CE MET A 62 15.541 -0.432 -19.964 1.00 52.45 C ATOM 0 H MET A 62 10.913 -0.012 -20.299 1.00 12.32 H new ATOM 0 HA MET A 62 12.876 1.049 -21.926 1.00 51.23 H new ATOM 0 HB2 MET A 62 12.945 -1.003 -20.421 1.00 63.33 H new ATOM 0 HB3 MET A 62 12.116 -1.885 -21.689 1.00 63.33 H new ATOM 0 HG2 MET A 62 14.464 -2.345 -21.887 1.00 3.44 H new ATOM 0 HG3 MET A 62 13.998 -1.348 -23.251 1.00 3.44 H new ATOM 0 HE1 MET A 62 16.341 0.186 -19.557 1.00 52.45 H new ATOM 0 HE2 MET A 62 14.600 -0.173 -19.479 1.00 52.45 H new ATOM 0 HE3 MET A 62 15.766 -1.483 -19.782 1.00 52.45 H new ATOM 968 N GLN A 63 10.469 -0.402 -23.609 1.00 52.54 N ATOM 969 CA GLN A 63 9.917 -0.594 -24.945 1.00 55.11 C ATOM 970 C GLN A 63 9.672 0.746 -25.631 1.00 54.10 C ATOM 971 O GLN A 63 10.104 0.965 -26.763 1.00 22.22 O ATOM 972 CB GLN A 63 8.611 -1.388 -24.871 1.00 24.33 C ATOM 973 CG GLN A 63 8.675 -2.576 -23.924 1.00 43.00 C ATOM 974 CD GLN A 63 7.793 -3.726 -24.370 1.00 3.43 C ATOM 975 OE1 GLN A 63 6.683 -3.517 -24.861 1.00 24.51 O ATOM 976 NE2 GLN A 63 8.283 -4.948 -24.201 1.00 23.14 N ATOM 0 H GLN A 63 9.845 -0.679 -22.851 1.00 52.54 H new ATOM 0 HA GLN A 63 10.643 -1.155 -25.533 1.00 55.11 H new ATOM 0 HB2 GLN A 63 7.808 -0.723 -24.553 1.00 24.33 H new ATOM 0 HB3 GLN A 63 8.354 -1.743 -25.869 1.00 24.33 H new ATOM 0 HG2 GLN A 63 9.706 -2.922 -23.850 1.00 43.00 H new ATOM 0 HG3 GLN A 63 8.373 -2.257 -22.926 1.00 43.00 H new ATOM 0 HE21 GLN A 63 9.208 -5.074 -23.790 1.00 23.14 H new ATOM 0 HE22 GLN A 63 7.735 -5.761 -24.482 1.00 23.14 H new ATOM 985 N LYS A 64 8.975 1.641 -24.939 1.00 35.32 N ATOM 986 CA LYS A 64 8.672 2.960 -25.480 1.00 11.52 C ATOM 987 C LYS A 64 9.920 3.837 -25.507 1.00 22.30 C ATOM 988 O LYS A 64 9.923 4.910 -26.110 1.00 23.10 O ATOM 989 CB LYS A 64 7.579 3.637 -24.649 1.00 22.33 C ATOM 990 CG LYS A 64 6.410 2.724 -24.324 1.00 35.22 C ATOM 991 CD LYS A 64 5.707 2.248 -25.584 1.00 72.21 C ATOM 992 CE LYS A 64 5.030 3.398 -26.313 1.00 15.31 C ATOM 993 NZ LYS A 64 4.248 2.926 -27.489 1.00 51.22 N ATOM 0 H LYS A 64 8.609 1.476 -24.001 1.00 35.32 H new ATOM 0 HA LYS A 64 8.316 2.832 -26.502 1.00 11.52 H new ATOM 0 HB2 LYS A 64 8.015 4.001 -23.719 1.00 22.33 H new ATOM 0 HB3 LYS A 64 7.210 4.508 -25.190 1.00 22.33 H new ATOM 0 HG2 LYS A 64 6.766 1.863 -23.758 1.00 35.22 H new ATOM 0 HG3 LYS A 64 5.700 3.253 -23.688 1.00 35.22 H new ATOM 0 HD2 LYS A 64 6.429 1.771 -26.246 1.00 72.21 H new ATOM 0 HD3 LYS A 64 4.965 1.493 -25.325 1.00 72.21 H new ATOM 0 HE2 LYS A 64 4.369 3.925 -25.625 1.00 15.31 H new ATOM 0 HE3 LYS A 64 5.784 4.114 -26.642 1.00 15.31 H new ATOM 0 HZ1 LYS A 64 3.802 3.740 -27.959 1.00 51.22 H new ATOM 0 HZ2 LYS A 64 4.883 2.445 -28.158 1.00 51.22 H new ATOM 0 HZ3 LYS A 64 3.512 2.263 -27.173 1.00 51.22 H new ATOM 1007 N TRP A 65 10.978 3.372 -24.852 1.00 72.21 N ATOM 1008 CA TRP A 65 12.233 4.113 -24.803 1.00 12.40 C ATOM 1009 C TRP A 65 13.200 3.618 -25.872 1.00 60.04 C ATOM 1010 O TRP A 65 14.103 4.344 -26.291 1.00 73.25 O ATOM 1011 CB TRP A 65 12.872 3.983 -23.420 1.00 2.04 C ATOM 1012 CG TRP A 65 12.481 5.082 -22.479 1.00 3.14 C ATOM 1013 CD1 TRP A 65 11.657 4.979 -21.395 1.00 34.41 C ATOM 1014 CD2 TRP A 65 12.898 6.451 -22.539 1.00 74.41 C ATOM 1015 NE1 TRP A 65 11.535 6.200 -20.778 1.00 41.52 N ATOM 1016 CE2 TRP A 65 12.287 7.120 -21.460 1.00 64.22 C ATOM 1017 CE3 TRP A 65 13.728 7.175 -23.398 1.00 50.32 C ATOM 1018 CZ2 TRP A 65 12.482 8.478 -21.221 1.00 72.40 C ATOM 1019 CZ3 TRP A 65 13.920 8.523 -23.160 1.00 34.13 C ATOM 1020 CH2 TRP A 65 13.300 9.163 -22.078 1.00 74.41 C ATOM 0 H TRP A 65 10.992 2.486 -24.348 1.00 72.21 H new ATOM 0 HA TRP A 65 12.014 5.163 -24.997 1.00 12.40 H new ATOM 0 HB2 TRP A 65 12.589 3.024 -22.985 1.00 2.04 H new ATOM 0 HB3 TRP A 65 13.957 3.976 -23.528 1.00 2.04 H new ATOM 0 HD1 TRP A 65 11.172 4.070 -21.070 1.00 34.41 H new ATOM 0 HE1 TRP A 65 10.975 6.391 -19.947 1.00 41.52 H new ATOM 0 HE3 TRP A 65 14.211 6.690 -24.233 1.00 50.32 H new ATOM 0 HZ2 TRP A 65 12.004 8.973 -20.388 1.00 72.40 H new ATOM 0 HZ3 TRP A 65 14.559 9.093 -23.819 1.00 34.13 H new ATOM 0 HH2 TRP A 65 13.471 10.217 -21.918 1.00 74.41 H new ATOM 1031 N LEU A 66 13.006 2.379 -26.311 1.00 4.02 N ATOM 1032 CA LEU A 66 13.862 1.787 -27.333 1.00 24.42 C ATOM 1033 C LEU A 66 13.176 1.804 -28.695 1.00 2.30 C ATOM 1034 O LEU A 66 13.836 1.756 -29.733 1.00 15.22 O ATOM 1035 CB LEU A 66 14.227 0.351 -26.951 1.00 72.23 C ATOM 1036 CG LEU A 66 15.428 0.188 -26.020 1.00 4.23 C ATOM 1037 CD1 LEU A 66 15.555 -1.255 -25.559 1.00 21.52 C ATOM 1038 CD2 LEU A 66 16.705 0.643 -26.712 1.00 1.02 C ATOM 0 H LEU A 66 12.264 1.765 -25.975 1.00 4.02 H new ATOM 0 HA LEU A 66 14.773 2.382 -27.398 1.00 24.42 H new ATOM 0 HB2 LEU A 66 13.360 -0.109 -26.476 1.00 72.23 H new ATOM 0 HB3 LEU A 66 14.424 -0.208 -27.866 1.00 72.23 H new ATOM 0 HG LEU A 66 15.270 0.815 -25.143 1.00 4.23 H new ATOM 0 HD11 LEU A 66 16.416 -1.351 -24.897 1.00 21.52 H new ATOM 0 HD12 LEU A 66 14.651 -1.547 -25.024 1.00 21.52 H new ATOM 0 HD13 LEU A 66 15.689 -1.903 -26.425 1.00 21.52 H new ATOM 0 HD21 LEU A 66 17.550 0.520 -26.034 1.00 1.02 H new ATOM 0 HD22 LEU A 66 16.867 0.043 -27.607 1.00 1.02 H new ATOM 0 HD23 LEU A 66 16.614 1.693 -26.991 1.00 1.02 H new ATOM 1050 N GLU A 67 11.849 1.876 -28.682 1.00 72.24 N ATOM 1051 CA GLU A 67 11.074 1.902 -29.918 1.00 22.54 C ATOM 1052 C GLU A 67 10.997 3.317 -30.482 1.00 42.21 C ATOM 1053 O GLU A 67 11.468 3.584 -31.589 1.00 33.24 O ATOM 1054 CB GLU A 67 9.664 1.361 -29.673 1.00 31.04 C ATOM 1055 CG GLU A 67 8.782 1.380 -30.909 1.00 75.54 C ATOM 1056 CD GLU A 67 7.992 2.667 -31.044 1.00 5.41 C ATOM 1057 OE1 GLU A 67 6.893 2.753 -30.458 1.00 31.32 O ATOM 1058 OE2 GLU A 67 8.474 3.589 -31.735 1.00 12.41 O ATOM 0 H GLU A 67 11.288 1.917 -27.831 1.00 72.24 H new ATOM 0 HA GLU A 67 11.578 1.266 -30.646 1.00 22.54 H new ATOM 0 HB2 GLU A 67 9.736 0.338 -29.304 1.00 31.04 H new ATOM 0 HB3 GLU A 67 9.189 1.950 -28.889 1.00 31.04 H new ATOM 0 HG2 GLU A 67 9.402 1.244 -31.795 1.00 75.54 H new ATOM 0 HG3 GLU A 67 8.092 0.537 -30.871 1.00 75.54 H new ATOM 1065 N THR A 68 10.399 4.223 -29.714 1.00 25.21 N ATOM 1066 CA THR A 68 10.258 5.610 -30.137 1.00 4.44 C ATOM 1067 C THR A 68 11.529 6.404 -29.852 1.00 33.40 C ATOM 1068 O THR A 68 12.014 7.145 -30.707 1.00 74.31 O ATOM 1069 CB THR A 68 9.071 6.294 -29.433 1.00 2.23 C ATOM 1070 OG1 THR A 68 9.394 6.545 -28.060 1.00 52.03 O ATOM 1071 CG2 THR A 68 7.822 5.430 -29.515 1.00 61.25 C ATOM 0 H THR A 68 10.005 4.020 -28.795 1.00 25.21 H new ATOM 0 HA THR A 68 10.075 5.596 -31.211 1.00 4.44 H new ATOM 0 HB THR A 68 8.873 7.239 -29.938 1.00 2.23 H new ATOM 0 HG1 THR A 68 9.456 5.694 -27.578 1.00 52.03 H new ATOM 0 HG21 THR A 68 6.997 5.934 -29.011 1.00 61.25 H new ATOM 0 HG22 THR A 68 7.562 5.265 -30.561 1.00 61.25 H new ATOM 0 HG23 THR A 68 8.011 4.471 -29.032 1.00 61.25 H new ATOM 1079 N ARG A 69 12.063 6.243 -28.646 1.00 65.20 N ATOM 1080 CA ARG A 69 13.278 6.945 -28.249 1.00 11.00 C ATOM 1081 C ARG A 69 14.511 6.080 -28.495 1.00 51.53 C ATOM 1082 O ARG A 69 14.399 4.900 -28.824 1.00 54.41 O ATOM 1083 CB ARG A 69 13.205 7.339 -26.773 1.00 10.43 C ATOM 1084 CG ARG A 69 11.997 8.196 -26.430 1.00 43.32 C ATOM 1085 CD ARG A 69 12.020 9.517 -27.184 1.00 14.15 C ATOM 1086 NE ARG A 69 13.254 10.261 -26.947 1.00 13.31 N ATOM 1087 CZ ARG A 69 13.558 11.396 -27.566 1.00 53.44 C ATOM 1088 NH1 ARG A 69 12.721 11.915 -28.455 1.00 3.23 N ATOM 1089 NH2 ARG A 69 14.700 12.015 -27.297 1.00 42.22 N ATOM 0 H ARG A 69 11.674 5.633 -27.927 1.00 65.20 H new ATOM 0 HA ARG A 69 13.361 7.847 -28.855 1.00 11.00 H new ATOM 0 HB2 ARG A 69 13.183 6.435 -26.165 1.00 10.43 H new ATOM 0 HB3 ARG A 69 14.112 7.881 -26.505 1.00 10.43 H new ATOM 0 HG2 ARG A 69 11.083 7.653 -26.672 1.00 43.32 H new ATOM 0 HG3 ARG A 69 11.978 8.388 -25.357 1.00 43.32 H new ATOM 0 HD2 ARG A 69 11.911 9.327 -28.252 1.00 14.15 H new ATOM 0 HD3 ARG A 69 11.167 10.123 -26.879 1.00 14.15 H new ATOM 0 HE ARG A 69 13.919 9.889 -26.269 1.00 13.31 H new ATOM 0 HH11 ARG A 69 11.842 11.442 -28.664 1.00 3.23 H new ATOM 0 HH12 ARG A 69 12.957 12.787 -28.929 1.00 3.23 H new ATOM 0 HH21 ARG A 69 15.346 11.619 -26.614 1.00 42.22 H new ATOM 0 HH22 ARG A 69 14.932 12.887 -27.773 1.00 42.22 H new ATOM 1103 N GLY A 70 15.688 6.678 -28.334 1.00 60.41 N ATOM 1104 CA GLY A 70 16.925 5.948 -28.544 1.00 32.15 C ATOM 1105 C GLY A 70 18.152 6.805 -28.302 1.00 34.35 C ATOM 1106 O GLY A 70 18.252 7.483 -27.279 1.00 74.21 O ATOM 0 H GLY A 70 15.807 7.654 -28.062 1.00 60.41 H new ATOM 0 HA2 GLY A 70 16.951 5.085 -27.879 1.00 32.15 H new ATOM 0 HA3 GLY A 70 16.949 5.565 -29.564 1.00 32.15 H new ATOM 1110 N SER A 71 19.089 6.773 -29.244 1.00 13.33 N ATOM 1111 CA SER A 71 20.318 7.549 -29.125 1.00 71.23 C ATOM 1112 C SER A 71 20.265 8.789 -30.012 1.00 11.42 C ATOM 1113 O SER A 71 19.464 8.885 -30.942 1.00 45.14 O ATOM 1114 CB SER A 71 21.526 6.690 -29.503 1.00 23.34 C ATOM 1115 OG SER A 71 22.409 6.540 -28.404 1.00 15.12 O ATOM 0 H SER A 71 19.021 6.219 -30.097 1.00 13.33 H new ATOM 0 HA SER A 71 20.418 7.869 -28.088 1.00 71.23 H new ATOM 0 HB2 SER A 71 21.188 5.710 -29.839 1.00 23.34 H new ATOM 0 HB3 SER A 71 22.055 7.148 -30.339 1.00 23.34 H new ATOM 0 HG SER A 71 23.172 5.986 -28.671 1.00 15.12 H new ATOM 1121 N PRO A 72 21.138 9.764 -29.717 1.00 64.33 N ATOM 1122 CA PRO A 72 21.212 11.016 -30.475 1.00 44.32 C ATOM 1123 C PRO A 72 21.765 10.811 -31.881 1.00 44.24 C ATOM 1124 O PRO A 72 21.285 11.413 -32.841 1.00 14.44 O ATOM 1125 CB PRO A 72 22.168 11.877 -29.645 1.00 53.32 C ATOM 1126 CG PRO A 72 23.009 10.899 -28.900 1.00 52.20 C ATOM 1127 CD PRO A 72 22.122 9.717 -28.622 1.00 15.40 C ATOM 0 HA PRO A 72 20.229 11.464 -30.619 1.00 44.32 H new ATOM 0 HB2 PRO A 72 22.777 12.519 -30.282 1.00 53.32 H new ATOM 0 HB3 PRO A 72 21.622 12.530 -28.964 1.00 53.32 H new ATOM 0 HG2 PRO A 72 23.878 10.605 -29.488 1.00 52.20 H new ATOM 0 HG3 PRO A 72 23.383 11.333 -27.973 1.00 52.20 H new ATOM 0 HD2 PRO A 72 22.684 8.783 -28.627 1.00 15.40 H new ATOM 0 HD3 PRO A 72 21.642 9.795 -27.647 1.00 15.40 H new ATOM 1135 N GLU A 73 22.778 9.957 -31.996 1.00 11.35 N ATOM 1136 CA GLU A 73 23.396 9.674 -33.286 1.00 13.04 C ATOM 1137 C GLU A 73 22.516 8.746 -34.118 1.00 70.30 C ATOM 1138 O GLU A 73 22.082 9.101 -35.214 1.00 1.43 O ATOM 1139 CB GLU A 73 24.776 9.045 -33.088 1.00 23.32 C ATOM 1140 CG GLU A 73 25.883 10.062 -32.867 1.00 0.10 C ATOM 1141 CD GLU A 73 25.823 10.700 -31.493 1.00 3.13 C ATOM 1142 OE1 GLU A 73 26.438 10.148 -30.556 1.00 43.40 O ATOM 1143 OE2 GLU A 73 25.162 11.750 -31.354 1.00 10.05 O ATOM 0 H GLU A 73 23.188 9.450 -31.212 1.00 11.35 H new ATOM 0 HA GLU A 73 23.508 10.617 -33.821 1.00 13.04 H new ATOM 0 HB2 GLU A 73 24.739 8.370 -32.233 1.00 23.32 H new ATOM 0 HB3 GLU A 73 25.019 8.440 -33.962 1.00 23.32 H new ATOM 0 HG2 GLU A 73 26.850 9.575 -32.995 1.00 0.10 H new ATOM 0 HG3 GLU A 73 25.814 10.839 -33.628 1.00 0.10 H new ATOM 1150 N SER A 74 22.258 7.554 -33.590 1.00 33.33 N ATOM 1151 CA SER A 74 21.434 6.572 -34.285 1.00 33.31 C ATOM 1152 C SER A 74 20.001 7.073 -34.435 1.00 13.43 C ATOM 1153 O SER A 74 19.619 8.084 -33.842 1.00 62.55 O ATOM 1154 CB SER A 74 21.444 5.241 -33.531 1.00 30.42 C ATOM 1155 OG SER A 74 20.295 5.110 -32.711 1.00 44.02 O ATOM 0 H SER A 74 22.608 7.245 -32.683 1.00 33.33 H new ATOM 0 HA SER A 74 21.854 6.422 -35.280 1.00 33.31 H new ATOM 0 HB2 SER A 74 21.482 4.417 -34.243 1.00 30.42 H new ATOM 0 HB3 SER A 74 22.342 5.174 -32.917 1.00 30.42 H new ATOM 0 HG SER A 74 19.964 4.189 -32.756 1.00 44.02 H new ATOM 1161 N HIS A 75 19.211 6.360 -35.231 1.00 52.11 N ATOM 1162 CA HIS A 75 17.819 6.732 -35.459 1.00 71.53 C ATOM 1163 C HIS A 75 16.952 5.492 -35.661 1.00 11.44 C ATOM 1164 O HIS A 75 17.248 4.647 -36.506 1.00 33.03 O ATOM 1165 CB HIS A 75 17.707 7.650 -36.677 1.00 21.23 C ATOM 1166 CG HIS A 75 16.423 8.419 -36.731 1.00 2.12 C ATOM 1167 ND1 HIS A 75 15.959 9.183 -35.681 1.00 41.41 N ATOM 1168 CD2 HIS A 75 15.505 8.541 -37.718 1.00 32.44 C ATOM 1169 CE1 HIS A 75 14.810 9.740 -36.019 1.00 51.33 C ATOM 1170 NE2 HIS A 75 14.512 9.366 -37.251 1.00 1.54 N ATOM 0 H HIS A 75 19.511 5.522 -35.729 1.00 52.11 H new ATOM 0 HA HIS A 75 17.462 7.265 -34.578 1.00 71.53 H new ATOM 0 HB2 HIS A 75 18.541 8.352 -36.671 1.00 21.23 H new ATOM 0 HB3 HIS A 75 17.801 7.051 -37.583 1.00 21.23 H new ATOM 0 HD2 HIS A 75 15.546 8.076 -38.692 1.00 32.44 H new ATOM 0 HE1 HIS A 75 14.215 10.390 -35.395 1.00 51.33 H new ATOM 0 HE2 HIS A 75 13.680 9.645 -37.770 1.00 1.54 H new ATOM 1178 N ILE A 76 15.882 5.391 -34.879 1.00 42.30 N ATOM 1179 CA ILE A 76 14.973 4.256 -34.972 1.00 60.24 C ATOM 1180 C ILE A 76 13.756 4.595 -35.826 1.00 14.13 C ATOM 1181 O ILE A 76 12.849 5.299 -35.380 1.00 42.22 O ATOM 1182 CB ILE A 76 14.499 3.798 -33.580 1.00 52.43 C ATOM 1183 CG1 ILE A 76 15.695 3.390 -32.719 1.00 4.14 C ATOM 1184 CG2 ILE A 76 13.514 2.646 -33.709 1.00 13.25 C ATOM 1185 CD1 ILE A 76 15.493 3.650 -31.242 1.00 64.31 C ATOM 0 H ILE A 76 15.624 6.082 -34.174 1.00 42.30 H new ATOM 0 HA ILE A 76 15.529 3.445 -35.442 1.00 60.24 H new ATOM 0 HB ILE A 76 13.992 4.631 -33.092 1.00 52.43 H new ATOM 0 HG12 ILE A 76 15.895 2.329 -32.869 1.00 4.14 H new ATOM 0 HG13 ILE A 76 16.578 3.932 -33.058 1.00 4.14 H new ATOM 0 HG21 ILE A 76 13.188 2.333 -32.717 1.00 13.25 H new ATOM 0 HG22 ILE A 76 12.650 2.969 -34.290 1.00 13.25 H new ATOM 0 HG23 ILE A 76 13.997 1.809 -34.213 1.00 13.25 H new ATOM 0 HD11 ILE A 76 16.381 3.337 -30.693 1.00 64.31 H new ATOM 0 HD12 ILE A 76 15.323 4.714 -31.080 1.00 64.31 H new ATOM 0 HD13 ILE A 76 14.630 3.087 -30.888 1.00 64.31 H new ATOM 1197 N ASP A 77 13.741 4.088 -37.054 1.00 0.35 N ATOM 1198 CA ASP A 77 12.633 4.335 -37.969 1.00 62.23 C ATOM 1199 C ASP A 77 11.459 3.411 -37.662 1.00 55.23 C ATOM 1200 O ASP A 77 10.306 3.740 -37.945 1.00 30.35 O ATOM 1201 CB ASP A 77 13.087 4.139 -39.417 1.00 10.32 C ATOM 1202 CG ASP A 77 13.991 5.258 -39.896 1.00 54.14 C ATOM 1203 OD1 ASP A 77 14.627 5.913 -39.044 1.00 73.15 O ATOM 1204 OD2 ASP A 77 14.061 5.480 -41.124 1.00 22.44 O ATOM 0 H ASP A 77 14.483 3.504 -37.438 1.00 0.35 H new ATOM 0 HA ASP A 77 12.306 5.366 -37.835 1.00 62.23 H new ATOM 0 HB2 ASP A 77 13.613 3.188 -39.504 1.00 10.32 H new ATOM 0 HB3 ASP A 77 12.212 4.080 -40.064 1.00 10.32 H new ATOM 1209 N LYS A 78 11.758 2.254 -37.083 1.00 64.53 N ATOM 1210 CA LYS A 78 10.728 1.281 -36.737 1.00 45.22 C ATOM 1211 C LYS A 78 11.287 0.203 -35.814 1.00 73.43 C ATOM 1212 O LYS A 78 12.500 0.029 -35.710 1.00 45.01 O ATOM 1213 CB LYS A 78 10.158 0.639 -38.004 1.00 24.43 C ATOM 1214 CG LYS A 78 11.223 0.193 -38.991 1.00 73.44 C ATOM 1215 CD LYS A 78 10.754 -0.993 -39.819 1.00 1.25 C ATOM 1216 CE LYS A 78 11.783 -1.381 -40.869 1.00 50.45 C ATOM 1217 NZ LYS A 78 11.763 -0.453 -42.034 1.00 50.21 N ATOM 0 H LYS A 78 12.707 1.966 -36.843 1.00 64.53 H new ATOM 0 HA LYS A 78 9.929 1.805 -36.212 1.00 45.22 H new ATOM 0 HB2 LYS A 78 9.551 -0.222 -37.724 1.00 24.43 H new ATOM 0 HB3 LYS A 78 9.494 1.351 -38.495 1.00 24.43 H new ATOM 0 HG2 LYS A 78 11.478 1.021 -39.652 1.00 73.44 H new ATOM 0 HG3 LYS A 78 12.131 -0.075 -38.451 1.00 73.44 H new ATOM 0 HD2 LYS A 78 10.563 -1.843 -39.164 1.00 1.25 H new ATOM 0 HD3 LYS A 78 9.810 -0.748 -40.306 1.00 1.25 H new ATOM 0 HE2 LYS A 78 12.777 -1.381 -40.421 1.00 50.45 H new ATOM 0 HE3 LYS A 78 11.588 -2.397 -41.211 1.00 50.45 H new ATOM 0 HZ1 LYS A 78 12.478 -0.751 -42.728 1.00 50.21 H new ATOM 0 HZ2 LYS A 78 10.822 -0.472 -42.477 1.00 50.21 H new ATOM 0 HZ3 LYS A 78 11.974 0.513 -41.712 1.00 50.21 H new ATOM 1231 N ALA A 79 10.393 -0.520 -35.148 1.00 35.23 N ATOM 1232 CA ALA A 79 10.796 -1.584 -34.237 1.00 22.03 C ATOM 1233 C ALA A 79 9.695 -2.629 -34.091 1.00 24.12 C ATOM 1234 O ALA A 79 8.590 -2.455 -34.602 1.00 61.32 O ATOM 1235 CB ALA A 79 11.160 -1.005 -32.878 1.00 24.14 C ATOM 0 H ALA A 79 9.384 -0.388 -35.222 1.00 35.23 H new ATOM 0 HA ALA A 79 11.673 -2.075 -34.658 1.00 22.03 H new ATOM 0 HB1 ALA A 79 11.459 -1.811 -32.208 1.00 24.14 H new ATOM 0 HB2 ALA A 79 11.985 -0.302 -32.991 1.00 24.14 H new ATOM 0 HB3 ALA A 79 10.297 -0.487 -32.460 1.00 24.14 H new ATOM 1241 N ASN A 80 10.006 -3.715 -33.390 1.00 72.02 N ATOM 1242 CA ASN A 80 9.042 -4.789 -33.178 1.00 63.24 C ATOM 1243 C ASN A 80 9.607 -5.849 -32.238 1.00 24.05 C ATOM 1244 O ASN A 80 10.757 -6.267 -32.375 1.00 3.13 O ATOM 1245 CB ASN A 80 8.659 -5.429 -34.514 1.00 71.32 C ATOM 1246 CG ASN A 80 9.674 -6.458 -34.975 1.00 13.31 C ATOM 1247 OD1 ASN A 80 10.878 -6.201 -34.975 1.00 72.15 O ATOM 1248 ND2 ASN A 80 9.190 -7.630 -35.370 1.00 44.32 N ATOM 0 H ASN A 80 10.917 -3.874 -32.960 1.00 72.02 H new ATOM 0 HA ASN A 80 8.151 -4.359 -32.719 1.00 63.24 H new ATOM 0 HB2 ASN A 80 7.682 -5.903 -34.420 1.00 71.32 H new ATOM 0 HB3 ASN A 80 8.564 -4.652 -35.272 1.00 71.32 H new ATOM 0 HD21 ASN A 80 9.824 -8.362 -35.690 1.00 44.32 H new ATOM 0 HD22 ASN A 80 8.184 -7.798 -35.353 1.00 44.32 H new ATOM 1255 N PHE A 81 8.791 -6.280 -31.282 1.00 75.21 N ATOM 1256 CA PHE A 81 9.208 -7.291 -30.318 1.00 23.13 C ATOM 1257 C PHE A 81 8.979 -8.696 -30.868 1.00 50.43 C ATOM 1258 O PHE A 81 8.276 -8.878 -31.862 1.00 73.51 O ATOM 1259 CB PHE A 81 8.447 -7.116 -29.002 1.00 24.42 C ATOM 1260 CG PHE A 81 6.955 -7.152 -29.163 1.00 54.43 C ATOM 1261 CD1 PHE A 81 6.285 -8.359 -29.278 1.00 61.21 C ATOM 1262 CD2 PHE A 81 6.221 -5.977 -29.201 1.00 12.20 C ATOM 1263 CE1 PHE A 81 4.911 -8.395 -29.426 1.00 63.15 C ATOM 1264 CE2 PHE A 81 4.847 -6.007 -29.349 1.00 11.53 C ATOM 1265 CZ PHE A 81 4.192 -7.217 -29.463 1.00 35.01 C ATOM 0 H PHE A 81 7.836 -5.944 -31.154 1.00 75.21 H new ATOM 0 HA PHE A 81 10.274 -7.162 -30.133 1.00 23.13 H new ATOM 0 HB2 PHE A 81 8.749 -7.902 -28.310 1.00 24.42 H new ATOM 0 HB3 PHE A 81 8.733 -6.166 -28.550 1.00 24.42 H new ATOM 0 HD1 PHE A 81 6.843 -9.283 -29.252 1.00 61.21 H new ATOM 0 HD2 PHE A 81 6.728 -5.027 -29.114 1.00 12.20 H new ATOM 0 HE1 PHE A 81 4.401 -9.343 -29.513 1.00 63.15 H new ATOM 0 HE2 PHE A 81 4.286 -5.084 -29.375 1.00 11.53 H new ATOM 0 HZ PHE A 81 3.119 -7.242 -29.581 1.00 35.01 H new ATOM 1275 N LYS A 82 9.578 -9.686 -30.215 1.00 44.45 N ATOM 1276 CA LYS A 82 9.441 -11.075 -30.637 1.00 54.50 C ATOM 1277 C LYS A 82 8.441 -11.815 -29.754 1.00 2.33 C ATOM 1278 O LYS A 82 7.331 -12.125 -30.183 1.00 31.53 O ATOM 1279 CB LYS A 82 10.798 -11.780 -30.591 1.00 51.14 C ATOM 1280 CG LYS A 82 11.852 -11.129 -31.470 1.00 54.15 C ATOM 1281 CD LYS A 82 13.158 -11.904 -31.442 1.00 3.13 C ATOM 1282 CE LYS A 82 13.066 -13.183 -32.260 1.00 11.22 C ATOM 1283 NZ LYS A 82 14.393 -13.597 -32.793 1.00 21.41 N ATOM 0 H LYS A 82 10.164 -9.552 -29.391 1.00 44.45 H new ATOM 0 HA LYS A 82 9.070 -11.083 -31.662 1.00 54.50 H new ATOM 0 HB2 LYS A 82 11.155 -11.796 -29.561 1.00 51.14 H new ATOM 0 HB3 LYS A 82 10.670 -12.817 -30.900 1.00 51.14 H new ATOM 0 HG2 LYS A 82 11.486 -11.069 -32.495 1.00 54.15 H new ATOM 0 HG3 LYS A 82 12.027 -10.107 -31.133 1.00 54.15 H new ATOM 0 HD2 LYS A 82 13.961 -11.279 -31.832 1.00 3.13 H new ATOM 0 HD3 LYS A 82 13.415 -12.148 -30.411 1.00 3.13 H new ATOM 0 HE2 LYS A 82 12.658 -13.982 -31.640 1.00 11.22 H new ATOM 0 HE3 LYS A 82 12.372 -13.036 -33.088 1.00 11.22 H new ATOM 0 HZ1 LYS A 82 14.288 -14.472 -33.345 1.00 21.41 H new ATOM 0 HZ2 LYS A 82 14.771 -12.846 -33.405 1.00 21.41 H new ATOM 0 HZ3 LYS A 82 15.048 -13.762 -32.003 1.00 21.41 H new ATOM 1297 N ASN A 83 8.843 -12.092 -28.518 1.00 21.53 N ATOM 1298 CA ASN A 83 7.982 -12.795 -27.574 1.00 33.32 C ATOM 1299 C ASN A 83 8.599 -12.807 -26.179 1.00 11.45 C ATOM 1300 O ASN A 83 9.709 -13.300 -25.985 1.00 3.11 O ATOM 1301 CB ASN A 83 7.736 -14.230 -28.046 1.00 54.43 C ATOM 1302 CG ASN A 83 6.497 -14.840 -27.420 1.00 31.23 C ATOM 1303 OD1 ASN A 83 5.555 -14.132 -27.064 1.00 33.45 O ATOM 1304 ND2 ASN A 83 6.493 -16.161 -27.282 1.00 45.01 N ATOM 0 H ASN A 83 9.759 -11.841 -28.147 1.00 21.53 H new ATOM 0 HA ASN A 83 7.030 -12.266 -27.527 1.00 33.32 H new ATOM 0 HB2 ASN A 83 7.634 -14.240 -29.131 1.00 54.43 H new ATOM 0 HB3 ASN A 83 8.603 -14.844 -27.802 1.00 54.43 H new ATOM 0 HD21 ASN A 83 5.687 -16.628 -26.867 1.00 45.01 H new ATOM 0 HD22 ASN A 83 7.296 -16.709 -27.591 1.00 45.01 H new ATOM 1311 N GLU A 84 7.870 -12.260 -25.210 1.00 50.15 N ATOM 1312 CA GLU A 84 8.347 -12.207 -23.833 1.00 75.24 C ATOM 1313 C GLU A 84 8.213 -13.569 -23.159 1.00 33.51 C ATOM 1314 O GLU A 84 7.314 -14.348 -23.478 1.00 53.21 O ATOM 1315 CB GLU A 84 7.568 -11.155 -23.041 1.00 2.21 C ATOM 1316 CG GLU A 84 6.074 -11.422 -22.978 1.00 31.31 C ATOM 1317 CD GLU A 84 5.404 -10.722 -21.811 1.00 64.04 C ATOM 1318 OE1 GLU A 84 5.063 -9.529 -21.952 1.00 35.33 O ATOM 1319 OE2 GLU A 84 5.222 -11.368 -20.758 1.00 3.30 O ATOM 0 H GLU A 84 6.948 -11.848 -25.353 1.00 50.15 H new ATOM 0 HA GLU A 84 9.401 -11.931 -23.850 1.00 75.24 H new ATOM 0 HB2 GLU A 84 7.963 -11.110 -22.026 1.00 2.21 H new ATOM 0 HB3 GLU A 84 7.735 -10.177 -23.491 1.00 2.21 H new ATOM 0 HG2 GLU A 84 5.611 -11.093 -23.908 1.00 31.31 H new ATOM 0 HG3 GLU A 84 5.904 -12.496 -22.899 1.00 31.31 H new ATOM 1326 N LYS A 85 9.114 -13.851 -22.224 1.00 61.43 N ATOM 1327 CA LYS A 85 9.098 -15.118 -21.503 1.00 24.41 C ATOM 1328 C LYS A 85 8.906 -14.890 -20.007 1.00 75.40 C ATOM 1329 O LYS A 85 9.783 -14.351 -19.333 1.00 23.42 O ATOM 1330 CB LYS A 85 10.400 -15.885 -21.749 1.00 72.11 C ATOM 1331 CG LYS A 85 10.250 -17.392 -21.630 1.00 12.15 C ATOM 1332 CD LYS A 85 10.058 -17.820 -20.184 1.00 71.34 C ATOM 1333 CE LYS A 85 10.474 -19.268 -19.972 1.00 51.22 C ATOM 1334 NZ LYS A 85 11.953 -19.432 -20.014 1.00 44.32 N ATOM 0 H LYS A 85 9.865 -13.218 -21.948 1.00 61.43 H new ATOM 0 HA LYS A 85 8.260 -15.708 -21.874 1.00 24.41 H new ATOM 0 HB2 LYS A 85 10.772 -15.643 -22.745 1.00 72.11 H new ATOM 0 HB3 LYS A 85 11.152 -15.546 -21.037 1.00 72.11 H new ATOM 0 HG2 LYS A 85 9.398 -17.722 -22.224 1.00 12.15 H new ATOM 0 HG3 LYS A 85 11.134 -17.880 -22.041 1.00 12.15 H new ATOM 0 HD2 LYS A 85 10.643 -17.173 -19.531 1.00 71.34 H new ATOM 0 HD3 LYS A 85 9.012 -17.696 -19.902 1.00 71.34 H new ATOM 0 HE2 LYS A 85 10.097 -19.617 -19.011 1.00 51.22 H new ATOM 0 HE3 LYS A 85 10.017 -19.893 -20.739 1.00 51.22 H new ATOM 0 HZ1 LYS A 85 12.212 -20.352 -19.605 1.00 44.32 H new ATOM 0 HZ2 LYS A 85 12.279 -19.387 -21.000 1.00 44.32 H new ATOM 0 HZ3 LYS A 85 12.402 -18.671 -19.466 1.00 44.32 H new ATOM 1348 N VAL A 86 7.752 -15.305 -19.494 1.00 32.54 N ATOM 1349 CA VAL A 86 7.445 -15.149 -18.077 1.00 1.21 C ATOM 1350 C VAL A 86 8.323 -16.055 -17.221 1.00 74.41 C ATOM 1351 O VAL A 86 8.151 -17.275 -17.214 1.00 4.21 O ATOM 1352 CB VAL A 86 5.965 -15.461 -17.785 1.00 43.11 C ATOM 1353 CG1 VAL A 86 5.654 -15.243 -16.312 1.00 53.24 C ATOM 1354 CG2 VAL A 86 5.059 -14.610 -18.662 1.00 71.20 C ATOM 0 H VAL A 86 7.014 -15.752 -20.039 1.00 32.54 H new ATOM 0 HA VAL A 86 7.646 -14.108 -17.823 1.00 1.21 H new ATOM 0 HB VAL A 86 5.779 -16.509 -18.019 1.00 43.11 H new ATOM 0 HG11 VAL A 86 4.604 -15.468 -16.125 1.00 53.24 H new ATOM 0 HG12 VAL A 86 6.280 -15.899 -15.707 1.00 53.24 H new ATOM 0 HG13 VAL A 86 5.855 -14.205 -16.047 1.00 53.24 H new ATOM 0 HG21 VAL A 86 4.017 -14.843 -18.443 1.00 71.20 H new ATOM 0 HG22 VAL A 86 5.245 -13.555 -18.461 1.00 71.20 H new ATOM 0 HG23 VAL A 86 5.265 -14.821 -19.711 1.00 71.20 H new ATOM 1364 N ILE A 87 9.262 -15.452 -16.501 1.00 11.22 N ATOM 1365 CA ILE A 87 10.165 -16.205 -15.640 1.00 4.21 C ATOM 1366 C ILE A 87 9.932 -15.869 -14.171 1.00 21.23 C ATOM 1367 O ILE A 87 9.181 -14.949 -13.844 1.00 72.23 O ATOM 1368 CB ILE A 87 11.639 -15.927 -15.990 1.00 62.14 C ATOM 1369 CG1 ILE A 87 11.943 -14.432 -15.867 1.00 75.50 C ATOM 1370 CG2 ILE A 87 11.952 -16.422 -17.394 1.00 70.45 C ATOM 1371 CD1 ILE A 87 13.387 -14.084 -16.150 1.00 51.44 C ATOM 0 H ILE A 87 9.418 -14.444 -16.497 1.00 11.22 H new ATOM 0 HA ILE A 87 9.953 -17.261 -15.807 1.00 4.21 H new ATOM 0 HB ILE A 87 12.272 -16.466 -15.285 1.00 62.14 H new ATOM 0 HG12 ILE A 87 11.303 -13.881 -16.557 1.00 75.50 H new ATOM 0 HG13 ILE A 87 11.688 -14.099 -14.861 1.00 75.50 H new ATOM 0 HG21 ILE A 87 12.997 -16.219 -17.627 1.00 70.45 H new ATOM 0 HG22 ILE A 87 11.770 -17.495 -17.450 1.00 70.45 H new ATOM 0 HG23 ILE A 87 11.313 -15.907 -18.112 1.00 70.45 H new ATOM 0 HD11 ILE A 87 13.530 -13.009 -16.044 1.00 51.44 H new ATOM 0 HD12 ILE A 87 14.032 -14.607 -15.444 1.00 51.44 H new ATOM 0 HD13 ILE A 87 13.642 -14.386 -17.166 1.00 51.44 H new ATOM 1383 N LEU A 88 10.582 -16.620 -13.288 1.00 12.31 N ATOM 1384 CA LEU A 88 10.447 -16.401 -11.852 1.00 22.12 C ATOM 1385 C LEU A 88 11.686 -15.714 -11.287 1.00 65.40 C ATOM 1386 O LEU A 88 11.608 -14.978 -10.303 1.00 71.14 O ATOM 1387 CB LEU A 88 10.215 -17.731 -11.133 1.00 61.42 C ATOM 1388 CG LEU A 88 8.772 -18.237 -11.106 1.00 1.44 C ATOM 1389 CD1 LEU A 88 8.732 -19.718 -10.765 1.00 33.22 C ATOM 1390 CD2 LEU A 88 7.946 -17.436 -10.110 1.00 54.31 C ATOM 0 H LEU A 88 11.207 -17.385 -13.541 1.00 12.31 H new ATOM 0 HA LEU A 88 9.587 -15.751 -11.688 1.00 22.12 H new ATOM 0 HB2 LEU A 88 10.836 -18.491 -11.607 1.00 61.42 H new ATOM 0 HB3 LEU A 88 10.563 -17.631 -10.105 1.00 61.42 H new ATOM 0 HG LEU A 88 8.341 -18.102 -12.098 1.00 1.44 H new ATOM 0 HD11 LEU A 88 7.697 -20.060 -10.750 1.00 33.22 H new ATOM 0 HD12 LEU A 88 9.289 -20.279 -11.515 1.00 33.22 H new ATOM 0 HD13 LEU A 88 9.181 -19.878 -9.785 1.00 33.22 H new ATOM 0 HD21 LEU A 88 6.922 -17.809 -10.103 1.00 54.31 H new ATOM 0 HD22 LEU A 88 8.376 -17.540 -9.114 1.00 54.31 H new ATOM 0 HD23 LEU A 88 7.947 -16.385 -10.398 1.00 54.31 H new ATOM 1402 N LYS A 89 12.831 -15.958 -11.917 1.00 34.40 N ATOM 1403 CA LYS A 89 14.087 -15.362 -11.481 1.00 3.54 C ATOM 1404 C LYS A 89 14.878 -14.828 -12.671 1.00 24.23 C ATOM 1405 O LYS A 89 14.771 -15.346 -13.783 1.00 53.02 O ATOM 1406 CB LYS A 89 14.926 -16.389 -10.717 1.00 14.14 C ATOM 1407 CG LYS A 89 14.237 -16.936 -9.478 1.00 50.40 C ATOM 1408 CD LYS A 89 14.145 -15.887 -8.382 1.00 53.25 C ATOM 1409 CE LYS A 89 13.932 -16.524 -7.018 1.00 11.53 C ATOM 1410 NZ LYS A 89 12.494 -16.813 -6.759 1.00 2.54 N ATOM 0 H LYS A 89 12.914 -16.565 -12.732 1.00 34.40 H new ATOM 0 HA LYS A 89 13.853 -14.529 -10.819 1.00 3.54 H new ATOM 0 HB2 LYS A 89 15.167 -17.217 -11.384 1.00 14.14 H new ATOM 0 HB3 LYS A 89 15.870 -15.929 -10.425 1.00 14.14 H new ATOM 0 HG2 LYS A 89 13.236 -17.280 -9.739 1.00 50.40 H new ATOM 0 HG3 LYS A 89 14.785 -17.803 -9.108 1.00 50.40 H new ATOM 0 HD2 LYS A 89 15.058 -15.292 -8.368 1.00 53.25 H new ATOM 0 HD3 LYS A 89 13.323 -15.204 -8.598 1.00 53.25 H new ATOM 0 HE2 LYS A 89 14.505 -17.449 -6.956 1.00 11.53 H new ATOM 0 HE3 LYS A 89 14.314 -15.859 -6.243 1.00 11.53 H new ATOM 0 HZ1 LYS A 89 12.391 -17.247 -5.819 1.00 2.54 H new ATOM 0 HZ2 LYS A 89 11.950 -15.927 -6.793 1.00 2.54 H new ATOM 0 HZ3 LYS A 89 12.135 -17.467 -7.483 1.00 2.54 H new ATOM 1424 N LEU A 90 15.674 -13.792 -12.430 1.00 20.02 N ATOM 1425 CA LEU A 90 16.485 -13.189 -13.482 1.00 22.31 C ATOM 1426 C LEU A 90 17.798 -13.946 -13.659 1.00 33.24 C ATOM 1427 O LEU A 90 18.494 -14.237 -12.686 1.00 2.42 O ATOM 1428 CB LEU A 90 16.769 -11.722 -13.157 1.00 4.15 C ATOM 1429 CG LEU A 90 15.558 -10.874 -12.767 1.00 21.15 C ATOM 1430 CD1 LEU A 90 15.965 -9.423 -12.562 1.00 65.24 C ATOM 1431 CD2 LEU A 90 14.470 -10.981 -13.825 1.00 13.43 C ATOM 0 H LEU A 90 15.775 -13.352 -11.515 1.00 20.02 H new ATOM 0 HA LEU A 90 15.925 -13.246 -14.416 1.00 22.31 H new ATOM 0 HB2 LEU A 90 17.491 -11.685 -12.341 1.00 4.15 H new ATOM 0 HB3 LEU A 90 17.244 -11.264 -14.025 1.00 4.15 H new ATOM 0 HG LEU A 90 15.160 -11.254 -11.826 1.00 21.15 H new ATOM 0 HD11 LEU A 90 15.090 -8.835 -12.285 1.00 65.24 H new ATOM 0 HD12 LEU A 90 16.709 -9.363 -11.768 1.00 65.24 H new ATOM 0 HD13 LEU A 90 16.388 -9.030 -13.486 1.00 65.24 H new ATOM 0 HD21 LEU A 90 13.616 -10.371 -13.531 1.00 13.43 H new ATOM 0 HD22 LEU A 90 14.856 -10.628 -14.781 1.00 13.43 H new ATOM 0 HD23 LEU A 90 14.158 -12.021 -13.922 1.00 13.43 H new ATOM 1443 N ASP A 91 18.130 -14.261 -14.906 1.00 13.13 N ATOM 1444 CA ASP A 91 19.361 -14.981 -15.211 1.00 35.13 C ATOM 1445 C ASP A 91 20.577 -14.076 -15.039 1.00 35.25 C ATOM 1446 O ASP A 91 21.679 -14.548 -14.759 1.00 42.44 O ATOM 1447 CB ASP A 91 19.315 -15.530 -16.638 1.00 4.42 C ATOM 1448 CG ASP A 91 20.321 -16.642 -16.863 1.00 11.34 C ATOM 1449 OD1 ASP A 91 21.529 -16.339 -16.962 1.00 54.14 O ATOM 1450 OD2 ASP A 91 19.900 -17.815 -16.938 1.00 44.10 O ATOM 0 H ASP A 91 17.564 -14.029 -15.722 1.00 13.13 H new ATOM 0 HA ASP A 91 19.449 -15.813 -14.513 1.00 35.13 H new ATOM 0 HB2 ASP A 91 18.313 -15.903 -16.849 1.00 4.42 H new ATOM 0 HB3 ASP A 91 19.509 -14.721 -17.342 1.00 4.42 H new ATOM 1455 N TYR A 92 20.368 -12.775 -15.208 1.00 20.42 N ATOM 1456 CA TYR A 92 21.448 -11.805 -15.075 1.00 12.43 C ATOM 1457 C TYR A 92 21.207 -10.882 -13.884 1.00 22.14 C ATOM 1458 O TYR A 92 20.074 -10.712 -13.434 1.00 73.45 O ATOM 1459 CB TYR A 92 21.580 -10.979 -16.355 1.00 51.53 C ATOM 1460 CG TYR A 92 22.322 -11.692 -17.462 1.00 62.34 C ATOM 1461 CD1 TYR A 92 21.668 -12.588 -18.299 1.00 33.32 C ATOM 1462 CD2 TYR A 92 23.678 -11.472 -17.671 1.00 51.45 C ATOM 1463 CE1 TYR A 92 22.342 -13.243 -19.311 1.00 71.32 C ATOM 1464 CE2 TYR A 92 24.360 -12.121 -18.682 1.00 53.02 C ATOM 1465 CZ TYR A 92 23.688 -13.006 -19.499 1.00 55.12 C ATOM 1466 OH TYR A 92 24.364 -13.656 -20.506 1.00 55.13 O ATOM 0 H TYR A 92 19.461 -12.368 -15.437 1.00 20.42 H new ATOM 0 HA TYR A 92 22.375 -12.352 -14.906 1.00 12.43 H new ATOM 0 HB2 TYR A 92 20.584 -10.712 -16.710 1.00 51.53 H new ATOM 0 HB3 TYR A 92 22.096 -10.047 -16.124 1.00 51.53 H new ATOM 0 HD1 TYR A 92 20.614 -12.775 -18.156 1.00 33.32 H new ATOM 0 HD2 TYR A 92 24.208 -10.781 -17.032 1.00 51.45 H new ATOM 0 HE1 TYR A 92 21.818 -13.937 -19.952 1.00 71.32 H new ATOM 0 HE2 TYR A 92 25.414 -11.936 -18.832 1.00 53.02 H new ATOM 0 HH TYR A 92 25.303 -13.376 -20.503 1.00 55.13 H new ATOM 1476 N SER A 93 22.283 -10.288 -13.377 1.00 52.31 N ATOM 1477 CA SER A 93 22.191 -9.384 -12.236 1.00 71.31 C ATOM 1478 C SER A 93 22.267 -7.929 -12.688 1.00 34.00 C ATOM 1479 O SER A 93 21.721 -7.037 -12.038 1.00 43.34 O ATOM 1480 CB SER A 93 23.310 -9.678 -11.235 1.00 34.13 C ATOM 1481 OG SER A 93 23.274 -11.030 -10.812 1.00 72.23 O ATOM 0 H SER A 93 23.228 -10.416 -13.738 1.00 52.31 H new ATOM 0 HA SER A 93 21.228 -9.546 -11.752 1.00 71.31 H new ATOM 0 HB2 SER A 93 24.276 -9.462 -11.691 1.00 34.13 H new ATOM 0 HB3 SER A 93 23.211 -9.021 -10.371 1.00 34.13 H new ATOM 0 HG SER A 93 24.000 -11.193 -10.174 1.00 72.23 H new ATOM 1487 N ASP A 94 22.947 -7.698 -13.806 1.00 15.14 N ATOM 1488 CA ASP A 94 23.094 -6.352 -14.346 1.00 52.34 C ATOM 1489 C ASP A 94 23.235 -6.389 -15.865 1.00 1.41 C ATOM 1490 O ASP A 94 23.654 -7.396 -16.436 1.00 32.04 O ATOM 1491 CB ASP A 94 24.308 -5.660 -13.725 1.00 41.54 C ATOM 1492 CG ASP A 94 24.156 -4.152 -13.682 1.00 52.21 C ATOM 1493 OD1 ASP A 94 23.140 -3.643 -14.201 1.00 42.53 O ATOM 1494 OD2 ASP A 94 25.052 -3.481 -13.128 1.00 74.14 O ATOM 0 H ASP A 94 23.405 -8.425 -14.355 1.00 15.14 H new ATOM 0 HA ASP A 94 22.196 -5.786 -14.096 1.00 52.34 H new ATOM 0 HB2 ASP A 94 24.459 -6.036 -12.713 1.00 41.54 H new ATOM 0 HB3 ASP A 94 25.200 -5.916 -14.296 1.00 41.54 H new ATOM 1499 N PHE A 95 22.882 -5.284 -16.514 1.00 1.00 N ATOM 1500 CA PHE A 95 22.968 -5.191 -17.967 1.00 14.53 C ATOM 1501 C PHE A 95 24.421 -5.101 -18.421 1.00 44.14 C ATOM 1502 O PHE A 95 25.158 -4.207 -18.006 1.00 53.40 O ATOM 1503 CB PHE A 95 22.189 -3.972 -18.467 1.00 72.33 C ATOM 1504 CG PHE A 95 21.701 -4.112 -19.881 1.00 43.01 C ATOM 1505 CD1 PHE A 95 22.589 -4.051 -20.943 1.00 50.42 C ATOM 1506 CD2 PHE A 95 20.355 -4.305 -20.148 1.00 25.21 C ATOM 1507 CE1 PHE A 95 22.143 -4.178 -22.245 1.00 72.10 C ATOM 1508 CE2 PHE A 95 19.903 -4.434 -21.448 1.00 4.32 C ATOM 1509 CZ PHE A 95 20.799 -4.371 -22.498 1.00 34.14 C ATOM 0 H PHE A 95 22.534 -4.441 -16.057 1.00 1.00 H new ATOM 0 HA PHE A 95 22.529 -6.094 -18.391 1.00 14.53 H new ATOM 0 HB2 PHE A 95 21.335 -3.802 -17.811 1.00 72.33 H new ATOM 0 HB3 PHE A 95 22.825 -3.090 -18.396 1.00 72.33 H new ATOM 0 HD1 PHE A 95 23.641 -3.903 -20.751 1.00 50.42 H new ATOM 0 HD2 PHE A 95 19.651 -4.355 -19.331 1.00 25.21 H new ATOM 0 HE1 PHE A 95 22.845 -4.126 -23.064 1.00 72.10 H new ATOM 0 HE2 PHE A 95 18.851 -4.584 -21.643 1.00 4.32 H new ATOM 0 HZ PHE A 95 20.449 -4.472 -23.515 1.00 34.14 H new ATOM 1519 N GLN A 96 24.826 -6.034 -19.276 1.00 64.53 N ATOM 1520 CA GLN A 96 26.192 -6.062 -19.786 1.00 41.23 C ATOM 1521 C GLN A 96 26.218 -5.797 -21.288 1.00 73.52 C ATOM 1522 O GLN A 96 25.225 -6.015 -21.983 1.00 52.03 O ATOM 1523 CB GLN A 96 26.845 -7.411 -19.483 1.00 25.12 C ATOM 1524 CG GLN A 96 28.363 -7.352 -19.421 1.00 2.01 C ATOM 1525 CD GLN A 96 28.972 -8.601 -18.814 1.00 53.03 C ATOM 1526 OE1 GLN A 96 28.419 -9.695 -18.933 1.00 23.12 O ATOM 1527 NE2 GLN A 96 30.116 -8.444 -18.160 1.00 24.33 N ATOM 0 H GLN A 96 24.228 -6.781 -19.630 1.00 64.53 H new ATOM 0 HA GLN A 96 26.755 -5.274 -19.287 1.00 41.23 H new ATOM 0 HB2 GLN A 96 26.465 -7.784 -18.532 1.00 25.12 H new ATOM 0 HB3 GLN A 96 26.549 -8.129 -20.248 1.00 25.12 H new ATOM 0 HG2 GLN A 96 28.759 -7.212 -20.427 1.00 2.01 H new ATOM 0 HG3 GLN A 96 28.665 -6.484 -18.836 1.00 2.01 H new ATOM 0 HE21 GLN A 96 30.539 -7.519 -18.086 1.00 24.33 H new ATOM 0 HE22 GLN A 96 30.573 -9.249 -17.731 1.00 24.33 H new ATOM 1536 N ILE A 97 27.358 -5.327 -21.782 1.00 22.23 N ATOM 1537 CA ILE A 97 27.512 -5.034 -23.201 1.00 64.12 C ATOM 1538 C ILE A 97 28.308 -6.128 -23.905 1.00 71.21 C ATOM 1539 O ILE A 97 29.287 -6.644 -23.365 1.00 73.24 O ATOM 1540 CB ILE A 97 28.214 -3.681 -23.424 1.00 33.12 C ATOM 1541 CG1 ILE A 97 27.472 -2.569 -22.679 1.00 60.03 C ATOM 1542 CG2 ILE A 97 28.298 -3.366 -24.910 1.00 31.42 C ATOM 1543 CD1 ILE A 97 28.185 -1.235 -22.720 1.00 33.43 C ATOM 0 H ILE A 97 28.189 -5.141 -21.220 1.00 22.23 H new ATOM 0 HA ILE A 97 26.508 -4.988 -23.624 1.00 64.12 H new ATOM 0 HB ILE A 97 29.228 -3.744 -23.029 1.00 33.12 H new ATOM 0 HG12 ILE A 97 26.478 -2.454 -23.111 1.00 60.03 H new ATOM 0 HG13 ILE A 97 27.336 -2.867 -21.640 1.00 60.03 H new ATOM 0 HG21 ILE A 97 28.796 -2.407 -25.051 1.00 31.42 H new ATOM 0 HG22 ILE A 97 28.865 -4.147 -25.416 1.00 31.42 H new ATOM 0 HG23 ILE A 97 27.293 -3.318 -25.329 1.00 31.42 H new ATOM 0 HD11 ILE A 97 27.603 -0.494 -22.172 1.00 33.43 H new ATOM 0 HD12 ILE A 97 29.169 -1.334 -22.262 1.00 33.43 H new ATOM 0 HD13 ILE A 97 28.298 -0.914 -23.756 1.00 33.43 H new ATOM 1555 N VAL A 98 27.882 -6.477 -25.115 1.00 51.21 N ATOM 1556 CA VAL A 98 28.556 -7.508 -25.895 1.00 51.44 C ATOM 1557 C VAL A 98 29.505 -6.891 -26.917 1.00 22.13 C ATOM 1558 O VAL A 98 29.117 -6.019 -27.694 1.00 45.13 O ATOM 1559 CB VAL A 98 27.544 -8.408 -26.629 1.00 40.42 C ATOM 1560 CG1 VAL A 98 28.267 -9.465 -27.449 1.00 74.44 C ATOM 1561 CG2 VAL A 98 26.587 -9.052 -25.637 1.00 44.23 C ATOM 0 H VAL A 98 27.073 -6.061 -25.576 1.00 51.21 H new ATOM 0 HA VAL A 98 29.127 -8.114 -25.192 1.00 51.44 H new ATOM 0 HB VAL A 98 26.961 -7.789 -27.311 1.00 40.42 H new ATOM 0 HG11 VAL A 98 27.536 -10.091 -27.960 1.00 74.44 H new ATOM 0 HG12 VAL A 98 28.907 -8.979 -28.185 1.00 74.44 H new ATOM 0 HG13 VAL A 98 28.877 -10.083 -26.790 1.00 74.44 H new ATOM 0 HG21 VAL A 98 25.879 -9.684 -26.173 1.00 44.23 H new ATOM 0 HG22 VAL A 98 27.151 -9.658 -24.928 1.00 44.23 H new ATOM 0 HG23 VAL A 98 26.044 -8.275 -25.098 1.00 44.23 H new ATOM 1571 N LYS A 99 30.752 -7.350 -26.910 1.00 30.50 N ATOM 1572 CA LYS A 99 31.759 -6.847 -27.837 1.00 15.53 C ATOM 1573 C LYS A 99 31.301 -7.015 -29.282 1.00 15.02 C ATOM 1574 O LYS A 99 31.539 -6.149 -30.124 1.00 1.22 O ATOM 1575 CB LYS A 99 33.088 -7.575 -27.624 1.00 13.44 C ATOM 1576 CG LYS A 99 33.015 -9.067 -27.898 1.00 15.24 C ATOM 1577 CD LYS A 99 34.249 -9.789 -27.384 1.00 71.13 C ATOM 1578 CE LYS A 99 34.560 -11.023 -28.218 1.00 52.30 C ATOM 1579 NZ LYS A 99 33.552 -12.099 -28.013 1.00 33.32 N ATOM 0 H LYS A 99 31.090 -8.070 -26.272 1.00 30.50 H new ATOM 0 HA LYS A 99 31.899 -5.784 -27.640 1.00 15.53 H new ATOM 0 HB2 LYS A 99 33.844 -7.132 -28.273 1.00 13.44 H new ATOM 0 HB3 LYS A 99 33.418 -7.418 -26.597 1.00 13.44 H new ATOM 0 HG2 LYS A 99 32.126 -9.482 -27.424 1.00 15.24 H new ATOM 0 HG3 LYS A 99 32.913 -9.237 -28.970 1.00 15.24 H new ATOM 0 HD2 LYS A 99 35.103 -9.111 -27.402 1.00 71.13 H new ATOM 0 HD3 LYS A 99 34.095 -10.080 -26.345 1.00 71.13 H new ATOM 0 HE2 LYS A 99 34.591 -10.750 -29.273 1.00 52.30 H new ATOM 0 HE3 LYS A 99 35.550 -11.398 -27.957 1.00 52.30 H new ATOM 0 HZ1 LYS A 99 33.799 -12.922 -28.598 1.00 33.32 H new ATOM 0 HZ2 LYS A 99 33.540 -12.377 -27.011 1.00 33.32 H new ATOM 0 HZ3 LYS A 99 32.611 -11.750 -28.286 1.00 33.32 H new