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 43 THR OG1 : rot -74:sc= 1.31 USER MOD Set 1.2: A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 ASN : amide:sc= -0.749 K(o=-0.75,f=-3.8!) USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 49:sc= 0.909 USER MOD Single : A 12 TYR OH : rot 128:sc= -1.58! USER MOD Single : A 17 LYS NZ :NH3+ -139:sc= 0.00948 (180deg=0) USER MOD Single : A 19 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 HIS : no HE2:sc= -2.15 K(o=-2.2,f=-3.2) USER MOD Single : A 27 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 GLN : amide:sc= -6.85! C(o=-6.9!,f=-8.6!) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.0506) USER MOD Single : A 41 GLN : amide:sc= 0 X(o=0,f=-0.38) USER MOD Single : A 42 ASN : amide:sc= -0.83 X(o=-0.83,f=-1.1) USER MOD Single : A 49 GLN : amide:sc= -0.0301 K(o=-0.03,f=-1.6!) USER MOD Single : A 51 LYS NZ :NH3+ 176:sc= 0.0514 (180deg=0.0337) USER MOD Single : A 53 GLN : amide:sc= -0.375 K(o=-0.37,f=-5!) 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 -145:sc= -1.85 (180deg=-5.53!) USER MOD Single : A 63 GLN : amide:sc= -0.0012 X(o=-0.0012,f=0) USER MOD Single : A 64 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.049) USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 71 SER OG : rot 180:sc= 0.00422 USER MOD Single : A 74 SER OG : rot -160:sc= 0 USER MOD Single : A 75 HIS : no HD1:sc= -0.526 K(o=-0.53,f=-1.4) USER MOD Single : A 78 LYS NZ :NH3+ -144:sc= -0.0906 (180deg=-1.09) USER MOD Single : A 80 ASN : amide:sc= -0.203 K(o=-0.2,f=-0.71) USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 ASN : amide:sc= 0 X(o=0,f=-0.26) 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= -0.048 X(o=-0.048,f=0) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 40 N ASN A 5 5.285 -7.209 -10.153 1.00 24.21 N ATOM 41 CA ASN A 5 6.530 -7.967 -10.219 1.00 33.13 C ATOM 42 C ASN A 5 6.441 -9.068 -11.271 1.00 62.02 C ATOM 43 O ASN A 5 6.565 -10.253 -10.959 1.00 51.10 O ATOM 44 CB ASN A 5 6.853 -8.576 -8.853 1.00 33.51 C ATOM 45 CG ASN A 5 5.706 -9.402 -8.302 1.00 52.32 C ATOM 46 OD1 ASN A 5 4.809 -9.809 -9.041 1.00 21.53 O ATOM 47 ND2 ASN A 5 5.730 -9.651 -6.998 1.00 75.41 N ATOM 0 HA ASN A 5 7.329 -7.282 -10.502 1.00 33.13 H new ATOM 0 HB2 ASN A 5 7.740 -9.203 -8.939 1.00 33.51 H new ATOM 0 HB3 ASN A 5 7.093 -7.778 -8.150 1.00 33.51 H new ATOM 0 HD21 ASN A 5 4.985 -10.200 -6.570 1.00 75.41 H new ATOM 0 HD22 ASN A 5 6.494 -9.293 -6.424 1.00 75.41 H new ATOM 54 N THR A 6 6.227 -8.669 -12.521 1.00 15.30 N ATOM 55 CA THR A 6 6.121 -9.620 -13.620 1.00 31.11 C ATOM 56 C THR A 6 7.440 -9.738 -14.374 1.00 43.31 C ATOM 57 O THR A 6 7.549 -9.314 -15.525 1.00 41.45 O ATOM 58 CB THR A 6 5.012 -9.215 -14.609 1.00 34.11 C ATOM 59 OG1 THR A 6 3.888 -8.688 -13.895 1.00 54.04 O ATOM 60 CG2 THR A 6 4.573 -10.406 -15.448 1.00 22.03 C ATOM 0 H THR A 6 6.124 -7.693 -12.797 1.00 15.30 H new ATOM 0 HA THR A 6 5.870 -10.585 -13.179 1.00 31.11 H new ATOM 0 HB THR A 6 5.411 -8.450 -15.275 1.00 34.11 H new ATOM 0 HG1 THR A 6 3.188 -8.431 -14.531 1.00 54.04 H new ATOM 0 HG21 THR A 6 3.789 -10.095 -16.139 1.00 22.03 H new ATOM 0 HG22 THR A 6 5.424 -10.787 -16.012 1.00 22.03 H new ATOM 0 HG23 THR A 6 4.191 -11.190 -14.795 1.00 22.03 H new ATOM 68 N LEU A 7 8.441 -10.316 -13.719 1.00 70.34 N ATOM 69 CA LEU A 7 9.755 -10.491 -14.329 1.00 52.31 C ATOM 70 C LEU A 7 9.666 -11.374 -15.569 1.00 65.05 C ATOM 71 O LEU A 7 9.199 -12.511 -15.501 1.00 64.45 O ATOM 72 CB LEU A 7 10.729 -11.103 -13.321 1.00 42.14 C ATOM 73 CG LEU A 7 10.830 -10.395 -11.970 1.00 45.41 C ATOM 74 CD1 LEU A 7 11.714 -11.185 -11.018 1.00 5.01 C ATOM 75 CD2 LEU A 7 11.365 -8.981 -12.148 1.00 1.13 C ATOM 0 H LEU A 7 8.368 -10.671 -12.766 1.00 70.34 H new ATOM 0 HA LEU A 7 10.123 -9.510 -14.630 1.00 52.31 H new ATOM 0 HB2 LEU A 7 10.436 -12.138 -13.145 1.00 42.14 H new ATOM 0 HB3 LEU A 7 11.721 -11.125 -13.772 1.00 42.14 H new ATOM 0 HG LEU A 7 9.831 -10.333 -11.538 1.00 45.41 H new ATOM 0 HD11 LEU A 7 11.774 -10.666 -10.062 1.00 5.01 H new ATOM 0 HD12 LEU A 7 11.289 -12.177 -10.866 1.00 5.01 H new ATOM 0 HD13 LEU A 7 12.713 -11.279 -11.443 1.00 5.01 H new ATOM 0 HD21 LEU A 7 11.430 -8.492 -11.176 1.00 1.13 H new ATOM 0 HD22 LEU A 7 12.355 -9.021 -12.601 1.00 1.13 H new ATOM 0 HD23 LEU A 7 10.693 -8.416 -12.794 1.00 1.13 H new ATOM 87 N ILE A 8 10.120 -10.844 -16.700 1.00 53.14 N ATOM 88 CA ILE A 8 10.095 -11.586 -17.955 1.00 12.40 C ATOM 89 C ILE A 8 11.387 -11.383 -18.739 1.00 21.41 C ATOM 90 O ILE A 8 12.235 -10.575 -18.360 1.00 60.41 O ATOM 91 CB ILE A 8 8.903 -11.164 -18.834 1.00 72.25 C ATOM 92 CG1 ILE A 8 8.962 -9.664 -19.127 1.00 41.51 C ATOM 93 CG2 ILE A 8 7.590 -11.526 -18.156 1.00 0.42 C ATOM 94 CD1 ILE A 8 8.380 -9.287 -20.471 1.00 42.44 C ATOM 0 H ILE A 8 10.509 -9.904 -16.773 1.00 53.14 H new ATOM 0 HA ILE A 8 9.991 -12.640 -17.697 1.00 12.40 H new ATOM 0 HB ILE A 8 8.961 -11.702 -19.780 1.00 72.25 H new ATOM 0 HG12 ILE A 8 8.425 -9.128 -18.344 1.00 41.51 H new ATOM 0 HG13 ILE A 8 10.000 -9.334 -19.084 1.00 41.51 H new ATOM 0 HG21 ILE A 8 6.757 -11.221 -18.790 1.00 0.42 H new ATOM 0 HG22 ILE A 8 7.548 -12.603 -17.995 1.00 0.42 H new ATOM 0 HG23 ILE A 8 7.522 -11.013 -17.197 1.00 0.42 H new ATOM 0 HD11 ILE A 8 8.456 -8.209 -20.611 1.00 42.44 H new ATOM 0 HD12 ILE A 8 8.932 -9.795 -21.262 1.00 42.44 H new ATOM 0 HD13 ILE A 8 7.332 -9.585 -20.510 1.00 42.44 H new ATOM 106 N SER A 9 11.530 -12.122 -19.835 1.00 14.21 N ATOM 107 CA SER A 9 12.720 -12.025 -20.672 1.00 74.21 C ATOM 108 C SER A 9 12.341 -11.952 -22.148 1.00 72.22 C ATOM 109 O SER A 9 12.152 -12.977 -22.804 1.00 44.22 O ATOM 110 CB SER A 9 13.639 -13.224 -20.429 1.00 10.45 C ATOM 111 OG SER A 9 12.997 -14.438 -20.777 1.00 11.05 O ATOM 0 H SER A 9 10.837 -12.794 -20.164 1.00 14.21 H new ATOM 0 HA SER A 9 13.249 -11.110 -20.404 1.00 74.21 H new ATOM 0 HB2 SER A 9 14.552 -13.111 -21.014 1.00 10.45 H new ATOM 0 HB3 SER A 9 13.934 -13.253 -19.380 1.00 10.45 H new ATOM 0 HG SER A 9 12.596 -14.352 -21.667 1.00 11.05 H new ATOM 117 N VAL A 10 12.231 -10.732 -22.665 1.00 32.41 N ATOM 118 CA VAL A 10 11.876 -10.524 -24.063 1.00 54.35 C ATOM 119 C VAL A 10 13.046 -9.938 -24.846 1.00 73.41 C ATOM 120 O VAL A 10 13.702 -9.001 -24.393 1.00 4.04 O ATOM 121 CB VAL A 10 10.661 -9.587 -24.200 1.00 51.32 C ATOM 122 CG1 VAL A 10 11.004 -8.191 -23.702 1.00 41.03 C ATOM 123 CG2 VAL A 10 10.181 -9.544 -25.643 1.00 43.13 C ATOM 0 H VAL A 10 12.383 -9.873 -22.136 1.00 32.41 H new ATOM 0 HA VAL A 10 11.621 -11.501 -24.473 1.00 54.35 H new ATOM 0 HB VAL A 10 9.852 -9.978 -23.583 1.00 51.32 H new ATOM 0 HG11 VAL A 10 10.134 -7.543 -23.807 1.00 41.03 H new ATOM 0 HG12 VAL A 10 11.296 -8.240 -22.653 1.00 41.03 H new ATOM 0 HG13 VAL A 10 11.829 -7.788 -24.289 1.00 41.03 H new ATOM 0 HG21 VAL A 10 9.322 -8.877 -25.721 1.00 43.13 H new ATOM 0 HG22 VAL A 10 10.984 -9.178 -26.283 1.00 43.13 H new ATOM 0 HG23 VAL A 10 9.892 -10.546 -25.960 1.00 43.13 H new ATOM 133 N ASP A 11 13.301 -10.497 -26.024 1.00 73.20 N ATOM 134 CA ASP A 11 14.391 -10.030 -26.872 1.00 3.21 C ATOM 135 C ASP A 11 13.880 -9.659 -28.260 1.00 74.14 C ATOM 136 O ASP A 11 12.805 -10.096 -28.674 1.00 43.22 O ATOM 137 CB ASP A 11 15.475 -11.104 -26.984 1.00 13.50 C ATOM 138 CG ASP A 11 14.896 -12.492 -27.174 1.00 44.15 C ATOM 139 OD1 ASP A 11 14.134 -12.689 -28.143 1.00 51.34 O ATOM 140 OD2 ASP A 11 15.206 -13.382 -26.354 1.00 54.41 O ATOM 0 H ASP A 11 12.767 -11.274 -26.413 1.00 73.20 H new ATOM 0 HA ASP A 11 14.819 -9.139 -26.413 1.00 3.21 H new ATOM 0 HB2 ASP A 11 16.130 -10.869 -27.823 1.00 13.50 H new ATOM 0 HB3 ASP A 11 16.091 -11.090 -26.085 1.00 13.50 H new ATOM 145 N TYR A 12 14.655 -8.851 -28.974 1.00 52.44 N ATOM 146 CA TYR A 12 14.278 -8.418 -30.315 1.00 64.00 C ATOM 147 C TYR A 12 15.422 -7.663 -30.985 1.00 64.11 C ATOM 148 O TYR A 12 16.425 -7.342 -30.348 1.00 51.31 O ATOM 149 CB TYR A 12 13.033 -7.532 -30.257 1.00 32.11 C ATOM 150 CG TYR A 12 13.096 -6.469 -29.184 1.00 14.22 C ATOM 151 CD1 TYR A 12 14.053 -5.463 -29.230 1.00 11.13 C ATOM 152 CD2 TYR A 12 12.197 -6.470 -28.124 1.00 54.43 C ATOM 153 CE1 TYR A 12 14.114 -4.490 -28.251 1.00 42.00 C ATOM 154 CE2 TYR A 12 12.250 -5.500 -27.142 1.00 15.32 C ATOM 155 CZ TYR A 12 13.210 -4.512 -27.209 1.00 64.53 C ATOM 156 OH TYR A 12 13.267 -3.544 -26.233 1.00 63.32 O ATOM 0 H TYR A 12 15.548 -8.482 -28.647 1.00 52.44 H new ATOM 0 HA TYR A 12 14.056 -9.306 -30.907 1.00 64.00 H new ATOM 0 HB2 TYR A 12 12.894 -7.051 -31.225 1.00 32.11 H new ATOM 0 HB3 TYR A 12 12.159 -8.159 -30.084 1.00 32.11 H new ATOM 0 HD1 TYR A 12 14.761 -5.441 -30.045 1.00 11.13 H new ATOM 0 HD2 TYR A 12 11.444 -7.242 -28.067 1.00 54.43 H new ATOM 0 HE1 TYR A 12 14.866 -3.716 -28.301 1.00 42.00 H new ATOM 0 HE2 TYR A 12 11.543 -5.515 -26.326 1.00 15.32 H new ATOM 0 HH TYR A 12 12.382 -3.137 -26.124 1.00 63.32 H new ATOM 166 N GLU A 13 15.263 -7.383 -32.275 1.00 33.21 N ATOM 167 CA GLU A 13 16.282 -6.666 -33.032 1.00 70.10 C ATOM 168 C GLU A 13 15.713 -5.384 -33.632 1.00 14.43 C ATOM 169 O GLU A 13 15.221 -5.379 -34.761 1.00 1.12 O ATOM 170 CB GLU A 13 16.844 -7.556 -34.143 1.00 10.22 C ATOM 171 CG GLU A 13 15.773 -8.225 -34.988 1.00 13.34 C ATOM 172 CD GLU A 13 16.166 -8.336 -36.448 1.00 10.41 C ATOM 173 OE1 GLU A 13 15.921 -7.373 -37.204 1.00 13.42 O ATOM 174 OE2 GLU A 13 16.720 -9.386 -36.834 1.00 73.33 O ATOM 0 H GLU A 13 14.439 -7.642 -32.817 1.00 33.21 H new ATOM 0 HA GLU A 13 17.087 -6.400 -32.347 1.00 70.10 H new ATOM 0 HB2 GLU A 13 17.483 -6.955 -34.790 1.00 10.22 H new ATOM 0 HB3 GLU A 13 17.475 -8.324 -33.697 1.00 10.22 H new ATOM 0 HG2 GLU A 13 15.573 -9.221 -34.593 1.00 13.34 H new ATOM 0 HG3 GLU A 13 14.845 -7.658 -34.907 1.00 13.34 H new ATOM 181 N ILE A 14 15.782 -4.299 -32.868 1.00 2.31 N ATOM 182 CA ILE A 14 15.275 -3.010 -33.323 1.00 74.54 C ATOM 183 C ILE A 14 15.837 -2.652 -34.695 1.00 2.45 C ATOM 184 O ILE A 14 16.990 -2.955 -35.003 1.00 51.42 O ATOM 185 CB ILE A 14 15.619 -1.886 -32.329 1.00 63.01 C ATOM 186 CG1 ILE A 14 15.028 -2.194 -30.952 1.00 54.11 C ATOM 187 CG2 ILE A 14 15.109 -0.549 -32.844 1.00 53.41 C ATOM 188 CD1 ILE A 14 13.533 -2.424 -30.975 1.00 33.44 C ATOM 0 H ILE A 14 16.184 -4.287 -31.931 1.00 2.31 H new ATOM 0 HA ILE A 14 14.191 -3.103 -33.390 1.00 74.54 H new ATOM 0 HB ILE A 14 16.703 -1.826 -32.232 1.00 63.01 H new ATOM 0 HG12 ILE A 14 15.518 -3.079 -30.545 1.00 54.11 H new ATOM 0 HG13 ILE A 14 15.250 -1.368 -30.277 1.00 54.11 H new ATOM 0 HG21 ILE A 14 15.360 0.236 -32.130 1.00 53.41 H new ATOM 0 HG22 ILE A 14 15.574 -0.328 -33.805 1.00 53.41 H new ATOM 0 HG23 ILE A 14 14.027 -0.595 -32.967 1.00 53.41 H new ATOM 0 HD11 ILE A 14 13.182 -2.637 -29.965 1.00 33.44 H new ATOM 0 HD12 ILE A 14 13.033 -1.532 -31.352 1.00 33.44 H new ATOM 0 HD13 ILE A 14 13.305 -3.269 -31.624 1.00 33.44 H new ATOM 200 N PHE A 15 15.016 -2.002 -35.513 1.00 62.44 N ATOM 201 CA PHE A 15 15.432 -1.601 -36.852 1.00 51.42 C ATOM 202 C PHE A 15 15.974 -0.174 -36.848 1.00 70.33 C ATOM 203 O PHE A 15 16.191 0.416 -35.791 1.00 65.10 O ATOM 204 CB PHE A 15 14.258 -1.709 -37.828 1.00 21.52 C ATOM 205 CG PHE A 15 13.445 -2.959 -37.650 1.00 35.34 C ATOM 206 CD1 PHE A 15 14.061 -4.172 -37.387 1.00 3.24 C ATOM 207 CD2 PHE A 15 12.063 -2.922 -37.746 1.00 13.23 C ATOM 208 CE1 PHE A 15 13.316 -5.324 -37.222 1.00 15.23 C ATOM 209 CE2 PHE A 15 11.312 -4.070 -37.581 1.00 72.43 C ATOM 210 CZ PHE A 15 11.939 -5.273 -37.320 1.00 71.03 C ATOM 0 H PHE A 15 14.060 -1.742 -35.273 1.00 62.44 H new ATOM 0 HA PHE A 15 16.227 -2.273 -37.175 1.00 51.42 H new ATOM 0 HB2 PHE A 15 13.610 -0.842 -37.701 1.00 21.52 H new ATOM 0 HB3 PHE A 15 14.640 -1.675 -38.848 1.00 21.52 H new ATOM 0 HD1 PHE A 15 15.137 -4.218 -37.310 1.00 3.24 H new ATOM 0 HD2 PHE A 15 11.567 -1.985 -37.952 1.00 13.23 H new ATOM 0 HE1 PHE A 15 13.809 -6.263 -37.017 1.00 15.23 H new ATOM 0 HE2 PHE A 15 10.235 -4.027 -37.656 1.00 72.43 H new ATOM 0 HZ PHE A 15 11.354 -6.172 -37.193 1.00 71.03 H new ATOM 220 N GLY A 16 16.191 0.374 -38.040 1.00 74.43 N ATOM 221 CA GLY A 16 16.706 1.726 -38.153 1.00 21.52 C ATOM 222 C GLY A 16 18.143 1.760 -38.635 1.00 54.01 C ATOM 223 O GLY A 16 18.780 0.718 -38.788 1.00 33.41 O ATOM 0 H GLY A 16 16.019 -0.095 -38.930 1.00 74.43 H new ATOM 0 HA2 GLY A 16 16.081 2.293 -38.843 1.00 21.52 H new ATOM 0 HA3 GLY A 16 16.639 2.219 -37.183 1.00 21.52 H new ATOM 227 N LYS A 17 18.655 2.962 -38.878 1.00 31.33 N ATOM 228 CA LYS A 17 20.025 3.129 -39.346 1.00 44.43 C ATOM 229 C LYS A 17 21.018 2.942 -38.203 1.00 60.04 C ATOM 230 O LYS A 17 21.708 3.881 -37.807 1.00 2.21 O ATOM 231 CB LYS A 17 20.207 4.515 -39.971 1.00 74.53 C ATOM 232 CG LYS A 17 19.785 5.653 -39.059 1.00 54.42 C ATOM 233 CD LYS A 17 20.644 6.888 -39.275 1.00 13.13 C ATOM 234 CE LYS A 17 22.070 6.665 -38.796 1.00 0.21 C ATOM 235 NZ LYS A 17 22.809 7.948 -38.638 1.00 12.54 N ATOM 0 H LYS A 17 18.141 3.835 -38.758 1.00 31.33 H new ATOM 0 HA LYS A 17 20.219 2.367 -40.101 1.00 44.43 H new ATOM 0 HB2 LYS A 17 21.254 4.647 -40.242 1.00 74.53 H new ATOM 0 HB3 LYS A 17 19.629 4.567 -40.894 1.00 74.53 H new ATOM 0 HG2 LYS A 17 18.739 5.899 -39.243 1.00 54.42 H new ATOM 0 HG3 LYS A 17 19.859 5.334 -38.019 1.00 54.42 H new ATOM 0 HD2 LYS A 17 20.651 7.147 -40.334 1.00 13.13 H new ATOM 0 HD3 LYS A 17 20.208 7.733 -38.743 1.00 13.13 H new ATOM 0 HE2 LYS A 17 22.054 6.135 -37.844 1.00 0.21 H new ATOM 0 HE3 LYS A 17 22.596 6.028 -39.507 1.00 0.21 H new ATOM 0 HZ1 LYS A 17 23.780 7.835 -38.992 1.00 12.54 H new ATOM 0 HZ2 LYS A 17 22.328 8.695 -39.179 1.00 12.54 H new ATOM 0 HZ3 LYS A 17 22.836 8.212 -37.632 1.00 12.54 H new ATOM 249 N VAL A 18 21.086 1.723 -37.678 1.00 72.34 N ATOM 250 CA VAL A 18 21.996 1.412 -36.583 1.00 21.43 C ATOM 251 C VAL A 18 23.276 0.764 -37.099 1.00 3.32 C ATOM 252 O VAL A 18 23.936 0.013 -36.381 1.00 1.50 O ATOM 253 CB VAL A 18 21.337 0.472 -35.555 1.00 42.41 C ATOM 254 CG1 VAL A 18 20.099 1.121 -34.955 1.00 40.24 C ATOM 255 CG2 VAL A 18 20.991 -0.862 -36.198 1.00 64.04 C ATOM 0 H VAL A 18 20.521 0.934 -37.994 1.00 72.34 H new ATOM 0 HA VAL A 18 22.240 2.357 -36.097 1.00 21.43 H new ATOM 0 HB VAL A 18 22.048 0.287 -34.750 1.00 42.41 H new ATOM 0 HG11 VAL A 18 19.647 0.443 -34.231 1.00 40.24 H new ATOM 0 HG12 VAL A 18 20.380 2.049 -34.456 1.00 40.24 H new ATOM 0 HG13 VAL A 18 19.382 1.337 -35.747 1.00 40.24 H new ATOM 0 HG21 VAL A 18 20.527 -1.513 -35.458 1.00 64.04 H new ATOM 0 HG22 VAL A 18 20.298 -0.699 -37.024 1.00 64.04 H new ATOM 0 HG23 VAL A 18 21.900 -1.331 -36.574 1.00 64.04 H new ATOM 265 N GLN A 19 23.621 1.061 -38.348 1.00 1.24 N ATOM 266 CA GLN A 19 24.823 0.508 -38.960 1.00 21.52 C ATOM 267 C GLN A 19 26.033 1.392 -38.680 1.00 45.21 C ATOM 268 O GLN A 19 25.929 2.618 -38.664 1.00 34.24 O ATOM 269 CB GLN A 19 24.627 0.353 -40.469 1.00 63.00 C ATOM 270 CG GLN A 19 23.907 -0.927 -40.861 1.00 52.11 C ATOM 271 CD GLN A 19 24.032 -1.238 -42.340 1.00 1.34 C ATOM 272 OE1 GLN A 19 24.950 -1.941 -42.762 1.00 61.13 O ATOM 273 NE2 GLN A 19 23.107 -0.714 -43.135 1.00 41.24 N ATOM 0 H GLN A 19 23.085 1.681 -38.955 1.00 1.24 H new ATOM 0 HA GLN A 19 25.005 -0.473 -38.522 1.00 21.52 H new ATOM 0 HB2 GLN A 19 24.062 1.207 -40.843 1.00 63.00 H new ATOM 0 HB3 GLN A 19 25.601 0.376 -40.958 1.00 63.00 H new ATOM 0 HG2 GLN A 19 24.311 -1.758 -40.283 1.00 52.11 H new ATOM 0 HG3 GLN A 19 22.852 -0.841 -40.600 1.00 52.11 H new ATOM 0 HE21 GLN A 19 22.364 -0.137 -42.741 1.00 41.24 H new ATOM 0 HE22 GLN A 19 23.140 -0.888 -44.139 1.00 41.24 H new ATOM 282 N GLY A 20 27.183 0.762 -38.460 1.00 63.40 N ATOM 283 CA GLY A 20 28.397 1.507 -38.183 1.00 41.23 C ATOM 284 C GLY A 20 28.269 2.389 -36.957 1.00 23.43 C ATOM 285 O GLY A 20 29.032 3.339 -36.784 1.00 51.52 O ATOM 0 H GLY A 20 27.295 -0.252 -38.469 1.00 63.40 H new ATOM 0 HA2 GLY A 20 29.223 0.810 -38.041 1.00 41.23 H new ATOM 0 HA3 GLY A 20 28.646 2.124 -39.046 1.00 41.23 H new ATOM 289 N VAL A 21 27.301 2.074 -36.102 1.00 71.01 N ATOM 290 CA VAL A 21 27.075 2.845 -34.885 1.00 70.33 C ATOM 291 C VAL A 21 27.317 1.994 -33.643 1.00 42.43 C ATOM 292 O VAL A 21 26.374 1.555 -32.985 1.00 22.20 O ATOM 293 CB VAL A 21 25.643 3.409 -34.836 1.00 53.12 C ATOM 294 CG1 VAL A 21 25.476 4.340 -33.645 1.00 30.12 C ATOM 295 CG2 VAL A 21 25.309 4.127 -36.135 1.00 53.11 C ATOM 0 H VAL A 21 26.661 1.290 -36.230 1.00 71.01 H new ATOM 0 HA VAL A 21 27.783 3.673 -34.899 1.00 70.33 H new ATOM 0 HB VAL A 21 24.948 2.578 -34.717 1.00 53.12 H new ATOM 0 HG11 VAL A 21 24.458 4.729 -33.627 1.00 30.12 H new ATOM 0 HG12 VAL A 21 25.671 3.791 -32.724 1.00 30.12 H new ATOM 0 HG13 VAL A 21 26.179 5.169 -33.729 1.00 30.12 H new ATOM 0 HG21 VAL A 21 24.293 4.519 -36.083 1.00 53.11 H new ATOM 0 HG22 VAL A 21 26.008 4.949 -36.286 1.00 53.11 H new ATOM 0 HG23 VAL A 21 25.386 3.428 -36.967 1.00 53.11 H new ATOM 305 N PHE A 22 28.588 1.766 -33.328 1.00 12.33 N ATOM 306 CA PHE A 22 28.955 0.968 -32.164 1.00 61.31 C ATOM 307 C PHE A 22 28.799 1.775 -30.879 1.00 3.50 C ATOM 308 O PHE A 22 29.773 2.029 -30.170 1.00 23.02 O ATOM 309 CB PHE A 22 30.396 0.469 -32.295 1.00 52.42 C ATOM 310 CG PHE A 22 30.700 -0.141 -33.634 1.00 15.05 C ATOM 311 CD1 PHE A 22 30.055 -1.296 -34.045 1.00 73.22 C ATOM 312 CD2 PHE A 22 31.629 0.441 -34.480 1.00 64.41 C ATOM 313 CE1 PHE A 22 30.333 -1.860 -35.276 1.00 20.32 C ATOM 314 CE2 PHE A 22 31.912 -0.119 -35.712 1.00 54.32 C ATOM 315 CZ PHE A 22 31.262 -1.270 -36.111 1.00 33.21 C ATOM 0 H PHE A 22 29.380 2.122 -33.862 1.00 12.33 H new ATOM 0 HA PHE A 22 28.284 0.111 -32.117 1.00 61.31 H new ATOM 0 HB2 PHE A 22 31.078 1.302 -32.121 1.00 52.42 H new ATOM 0 HB3 PHE A 22 30.589 -0.269 -31.516 1.00 52.42 H new ATOM 0 HD1 PHE A 22 29.327 -1.761 -33.397 1.00 73.22 H new ATOM 0 HD2 PHE A 22 32.138 1.343 -34.174 1.00 64.41 H new ATOM 0 HE1 PHE A 22 29.824 -2.761 -35.585 1.00 20.32 H new ATOM 0 HE2 PHE A 22 32.641 0.343 -36.361 1.00 54.32 H new ATOM 0 HZ PHE A 22 31.479 -1.708 -37.074 1.00 33.21 H new ATOM 325 N PHE A 23 27.567 2.178 -30.586 1.00 21.43 N ATOM 326 CA PHE A 23 27.283 2.958 -29.387 1.00 54.12 C ATOM 327 C PHE A 23 26.474 2.140 -28.385 1.00 11.13 C ATOM 328 O PHE A 23 25.255 2.285 -28.289 1.00 21.02 O ATOM 329 CB PHE A 23 26.522 4.234 -29.753 1.00 11.42 C ATOM 330 CG PHE A 23 27.418 5.402 -30.051 1.00 65.13 C ATOM 331 CD1 PHE A 23 28.323 5.347 -31.099 1.00 44.40 C ATOM 332 CD2 PHE A 23 27.357 6.554 -29.284 1.00 34.23 C ATOM 333 CE1 PHE A 23 29.150 6.420 -31.377 1.00 13.13 C ATOM 334 CE2 PHE A 23 28.180 7.630 -29.557 1.00 31.22 C ATOM 335 CZ PHE A 23 29.078 7.562 -30.604 1.00 4.42 C ATOM 0 H PHE A 23 26.750 1.977 -31.162 1.00 21.43 H new ATOM 0 HA PHE A 23 28.233 3.228 -28.926 1.00 54.12 H new ATOM 0 HB2 PHE A 23 25.895 4.037 -30.622 1.00 11.42 H new ATOM 0 HB3 PHE A 23 25.855 4.498 -28.932 1.00 11.42 H new ATOM 0 HD1 PHE A 23 28.383 4.456 -31.706 1.00 44.40 H new ATOM 0 HD2 PHE A 23 26.658 6.612 -28.463 1.00 34.23 H new ATOM 0 HE1 PHE A 23 29.851 6.365 -32.197 1.00 13.13 H new ATOM 0 HE2 PHE A 23 28.121 8.523 -28.952 1.00 31.22 H new ATOM 0 HZ PHE A 23 29.723 8.401 -30.818 1.00 4.42 H new ATOM 345 N ARG A 24 27.161 1.280 -27.640 1.00 44.23 N ATOM 346 CA ARG A 24 26.508 0.437 -26.646 1.00 52.43 C ATOM 347 C ARG A 24 26.524 1.103 -25.274 1.00 1.45 C ATOM 348 O ARG A 24 26.802 0.459 -24.262 1.00 10.12 O ATOM 349 CB ARG A 24 27.196 -0.927 -26.571 1.00 41.23 C ATOM 350 CG ARG A 24 27.098 -1.730 -27.858 1.00 42.10 C ATOM 351 CD ARG A 24 28.293 -2.655 -28.029 1.00 73.24 C ATOM 352 NE ARG A 24 29.537 -1.914 -28.215 1.00 42.11 N ATOM 353 CZ ARG A 24 30.652 -2.457 -28.691 1.00 40.14 C ATOM 354 NH1 ARG A 24 30.677 -3.739 -29.029 1.00 4.15 N ATOM 355 NH2 ARG A 24 31.744 -1.717 -28.832 1.00 5.13 N ATOM 0 H ARG A 24 28.170 1.149 -27.706 1.00 44.23 H new ATOM 0 HA ARG A 24 25.471 0.296 -26.951 1.00 52.43 H new ATOM 0 HB2 ARG A 24 28.247 -0.781 -26.323 1.00 41.23 H new ATOM 0 HB3 ARG A 24 26.754 -1.503 -25.758 1.00 41.23 H new ATOM 0 HG2 ARG A 24 26.180 -2.317 -27.853 1.00 42.10 H new ATOM 0 HG3 ARG A 24 27.037 -1.051 -28.708 1.00 42.10 H new ATOM 0 HD2 ARG A 24 28.382 -3.298 -27.153 1.00 73.24 H new ATOM 0 HD3 ARG A 24 28.127 -3.306 -28.887 1.00 73.24 H new ATOM 0 HE ARG A 24 29.551 -0.925 -27.966 1.00 42.11 H new ATOM 0 HH11 ARG A 24 29.839 -4.311 -28.924 1.00 4.15 H new ATOM 0 HH12 ARG A 24 31.534 -4.153 -29.394 1.00 4.15 H new ATOM 0 HH21 ARG A 24 31.728 -0.730 -28.575 1.00 5.13 H new ATOM 0 HH22 ARG A 24 32.600 -2.135 -29.198 1.00 5.13 H new ATOM 369 N LYS A 25 26.225 2.398 -25.246 1.00 71.31 N ATOM 370 CA LYS A 25 26.204 3.152 -23.999 1.00 11.43 C ATOM 371 C LYS A 25 24.815 3.724 -23.732 1.00 43.42 C ATOM 372 O LYS A 25 24.654 4.638 -22.922 1.00 42.25 O ATOM 373 CB LYS A 25 27.233 4.284 -24.046 1.00 51.20 C ATOM 374 CG LYS A 25 27.789 4.658 -22.683 1.00 64.40 C ATOM 375 CD LYS A 25 28.648 5.909 -22.755 1.00 51.31 C ATOM 376 CE LYS A 25 29.401 6.144 -21.455 1.00 1.23 C ATOM 377 NZ LYS A 25 29.583 7.595 -21.174 1.00 5.22 N ATOM 0 H LYS A 25 25.994 2.947 -26.074 1.00 71.31 H new ATOM 0 HA LYS A 25 26.459 2.471 -23.187 1.00 11.43 H new ATOM 0 HB2 LYS A 25 28.056 3.988 -24.696 1.00 51.20 H new ATOM 0 HB3 LYS A 25 26.772 5.164 -24.495 1.00 51.20 H new ATOM 0 HG2 LYS A 25 26.967 4.820 -21.986 1.00 64.40 H new ATOM 0 HG3 LYS A 25 28.381 3.831 -22.291 1.00 64.40 H new ATOM 0 HD2 LYS A 25 29.358 5.817 -23.577 1.00 51.31 H new ATOM 0 HD3 LYS A 25 28.019 6.772 -22.973 1.00 51.31 H new ATOM 0 HE2 LYS A 25 28.858 5.680 -20.632 1.00 1.23 H new ATOM 0 HE3 LYS A 25 30.376 5.659 -21.507 1.00 1.23 H new ATOM 0 HZ1 LYS A 25 30.100 7.713 -20.280 1.00 5.22 H new ATOM 0 HZ2 LYS A 25 30.123 8.033 -21.947 1.00 5.22 H new ATOM 0 HZ3 LYS A 25 28.653 8.053 -21.099 1.00 5.22 H new ATOM 391 N HIS A 26 23.814 3.180 -24.417 1.00 44.21 N ATOM 392 CA HIS A 26 22.439 3.636 -24.252 1.00 74.42 C ATOM 393 C HIS A 26 21.575 2.542 -23.630 1.00 42.14 C ATOM 394 O HIS A 26 20.711 2.817 -22.797 1.00 21.40 O ATOM 395 CB HIS A 26 21.854 4.058 -25.600 1.00 50.33 C ATOM 396 CG HIS A 26 21.908 5.536 -25.840 1.00 21.22 C ATOM 397 ND1 HIS A 26 23.085 6.219 -26.062 1.00 53.54 N ATOM 398 CD2 HIS A 26 20.921 6.461 -25.893 1.00 24.15 C ATOM 399 CE1 HIS A 26 22.820 7.501 -26.240 1.00 14.41 C ATOM 400 NE2 HIS A 26 21.514 7.674 -26.142 1.00 52.32 N ATOM 0 H HIS A 26 23.930 2.423 -25.091 1.00 44.21 H new ATOM 0 HA HIS A 26 22.445 4.496 -23.582 1.00 74.42 H new ATOM 0 HB2 HIS A 26 22.395 3.549 -26.397 1.00 50.33 H new ATOM 0 HB3 HIS A 26 20.817 3.727 -25.657 1.00 50.33 H new ATOM 0 HD1 HIS A 26 24.015 5.800 -26.085 1.00 53.54 H new ATOM 0 HD2 HIS A 26 19.864 6.279 -25.764 1.00 24.15 H new ATOM 0 HE1 HIS A 26 23.547 8.276 -26.433 1.00 14.41 H new ATOM 408 N THR A 27 21.814 1.301 -24.042 1.00 20.54 N ATOM 409 CA THR A 27 21.058 0.166 -23.527 1.00 14.12 C ATOM 410 C THR A 27 21.493 -0.187 -22.109 1.00 73.12 C ATOM 411 O THR A 27 20.678 -0.606 -21.287 1.00 42.02 O ATOM 412 CB THR A 27 21.222 -1.074 -24.426 1.00 44.41 C ATOM 413 OG1 THR A 27 20.486 -2.175 -23.882 1.00 52.44 O ATOM 414 CG2 THR A 27 22.689 -1.454 -24.559 1.00 62.51 C ATOM 0 H THR A 27 22.525 1.056 -24.731 1.00 20.54 H new ATOM 0 HA THR A 27 20.009 0.463 -23.519 1.00 14.12 H new ATOM 0 HB THR A 27 20.834 -0.833 -25.415 1.00 44.41 H new ATOM 0 HG1 THR A 27 20.594 -2.959 -24.460 1.00 52.44 H new ATOM 0 HG21 THR A 27 22.781 -2.332 -25.198 1.00 62.51 H new ATOM 0 HG22 THR A 27 23.241 -0.624 -25.001 1.00 62.51 H new ATOM 0 HG23 THR A 27 23.098 -1.678 -23.574 1.00 62.51 H new ATOM 422 N GLN A 28 22.781 -0.015 -21.830 1.00 54.51 N ATOM 423 CA GLN A 28 23.323 -0.316 -20.510 1.00 52.44 C ATOM 424 C GLN A 28 22.997 0.799 -19.521 1.00 65.51 C ATOM 425 O GLN A 28 23.256 0.674 -18.324 1.00 74.03 O ATOM 426 CB GLN A 28 24.837 -0.516 -20.592 1.00 1.35 C ATOM 427 CG GLN A 28 25.593 0.729 -21.029 1.00 73.43 C ATOM 428 CD GLN A 28 26.957 0.843 -20.377 1.00 75.14 C ATOM 429 OE1 GLN A 28 27.358 -0.020 -19.596 1.00 41.10 O ATOM 430 NE2 GLN A 28 27.678 1.912 -20.696 1.00 34.51 N ATOM 0 H GLN A 28 23.468 0.331 -22.500 1.00 54.51 H new ATOM 0 HA GLN A 28 22.861 -1.237 -20.155 1.00 52.44 H new ATOM 0 HB2 GLN A 28 25.207 -0.832 -19.616 1.00 1.35 H new ATOM 0 HB3 GLN A 28 25.051 -1.325 -21.291 1.00 1.35 H new ATOM 0 HG2 GLN A 28 25.712 0.715 -22.112 1.00 73.43 H new ATOM 0 HG3 GLN A 28 25.003 1.612 -20.785 1.00 73.43 H new ATOM 0 HE21 GLN A 28 27.306 2.602 -21.348 1.00 34.51 H new ATOM 0 HE22 GLN A 28 28.604 2.043 -20.289 1.00 34.51 H new ATOM 439 N ALA A 29 22.430 1.887 -20.029 1.00 53.33 N ATOM 440 CA ALA A 29 22.068 3.023 -19.190 1.00 73.31 C ATOM 441 C ALA A 29 20.553 3.152 -19.064 1.00 64.32 C ATOM 442 O ALA A 29 20.027 3.340 -17.968 1.00 51.12 O ATOM 443 CB ALA A 29 22.664 4.305 -19.751 1.00 53.23 C ATOM 0 H ALA A 29 22.211 2.006 -21.018 1.00 53.33 H new ATOM 0 HA ALA A 29 22.476 2.852 -18.194 1.00 73.31 H new ATOM 0 HB1 ALA A 29 22.385 5.145 -19.114 1.00 53.23 H new ATOM 0 HB2 ALA A 29 23.750 4.218 -19.782 1.00 53.23 H new ATOM 0 HB3 ALA A 29 22.284 4.472 -20.759 1.00 53.23 H new ATOM 449 N GLU A 30 19.859 3.050 -20.194 1.00 25.44 N ATOM 450 CA GLU A 30 18.405 3.157 -20.208 1.00 63.31 C ATOM 451 C GLU A 30 17.775 2.135 -19.266 1.00 61.34 C ATOM 452 O GLU A 30 16.905 2.468 -18.463 1.00 2.40 O ATOM 453 CB GLU A 30 17.871 2.956 -21.628 1.00 21.22 C ATOM 454 CG GLU A 30 17.704 4.251 -22.404 1.00 53.21 C ATOM 455 CD GLU A 30 18.021 4.093 -23.878 1.00 62.14 C ATOM 456 OE1 GLU A 30 18.120 2.939 -24.344 1.00 25.40 O ATOM 457 OE2 GLU A 30 18.170 5.124 -24.567 1.00 0.54 O ATOM 0 H GLU A 30 20.280 2.894 -21.110 1.00 25.44 H new ATOM 0 HA GLU A 30 18.136 4.156 -19.864 1.00 63.31 H new ATOM 0 HB2 GLU A 30 18.550 2.301 -22.173 1.00 21.22 H new ATOM 0 HB3 GLU A 30 16.909 2.446 -21.577 1.00 21.22 H new ATOM 0 HG2 GLU A 30 16.680 4.607 -22.293 1.00 53.21 H new ATOM 0 HG3 GLU A 30 18.355 5.013 -21.976 1.00 53.21 H new ATOM 464 N GLY A 31 18.221 0.887 -19.373 1.00 21.43 N ATOM 465 CA GLY A 31 17.690 -0.166 -18.526 1.00 10.40 C ATOM 466 C GLY A 31 17.892 0.120 -17.051 1.00 73.20 C ATOM 467 O GLY A 31 17.220 -0.464 -16.200 1.00 51.31 O ATOM 0 H GLY A 31 18.940 0.586 -20.031 1.00 21.43 H new ATOM 0 HA2 GLY A 31 16.626 -0.288 -18.727 1.00 10.40 H new ATOM 0 HA3 GLY A 31 18.172 -1.110 -18.779 1.00 10.40 H new ATOM 471 N LYS A 32 18.821 1.019 -16.746 1.00 21.12 N ATOM 472 CA LYS A 32 19.111 1.381 -15.364 1.00 1.35 C ATOM 473 C LYS A 32 18.077 2.368 -14.831 1.00 74.32 C ATOM 474 O LYS A 32 17.801 2.407 -13.632 1.00 12.51 O ATOM 475 CB LYS A 32 20.512 1.988 -15.257 1.00 20.11 C ATOM 476 CG LYS A 32 21.567 1.223 -16.037 1.00 22.22 C ATOM 477 CD LYS A 32 22.963 1.496 -15.502 1.00 20.40 C ATOM 478 CE LYS A 32 23.393 2.929 -15.773 1.00 3.14 C ATOM 479 NZ LYS A 32 24.348 3.425 -14.743 1.00 45.24 N ATOM 0 H LYS A 32 19.387 1.511 -17.438 1.00 21.12 H new ATOM 0 HA LYS A 32 19.067 0.474 -14.761 1.00 1.35 H new ATOM 0 HB2 LYS A 32 20.482 3.017 -15.616 1.00 20.11 H new ATOM 0 HB3 LYS A 32 20.804 2.025 -14.207 1.00 20.11 H new ATOM 0 HG2 LYS A 32 21.358 0.155 -15.982 1.00 22.22 H new ATOM 0 HG3 LYS A 32 21.518 1.504 -17.089 1.00 22.22 H new ATOM 0 HD2 LYS A 32 22.987 1.305 -14.429 1.00 20.40 H new ATOM 0 HD3 LYS A 32 23.672 0.809 -15.964 1.00 20.40 H new ATOM 0 HE2 LYS A 32 23.857 2.989 -16.758 1.00 3.14 H new ATOM 0 HE3 LYS A 32 22.515 3.574 -15.795 1.00 3.14 H new ATOM 0 HZ1 LYS A 32 24.617 4.405 -14.963 1.00 45.24 H new ATOM 0 HZ2 LYS A 32 23.897 3.392 -13.807 1.00 45.24 H new ATOM 0 HZ3 LYS A 32 25.197 2.825 -14.740 1.00 45.24 H new ATOM 493 N LYS A 33 17.506 3.162 -15.730 1.00 54.03 N ATOM 494 CA LYS A 33 16.499 4.147 -15.352 1.00 61.14 C ATOM 495 C LYS A 33 15.367 3.494 -14.567 1.00 35.41 C ATOM 496 O LYS A 33 14.720 4.136 -13.738 1.00 45.53 O ATOM 497 CB LYS A 33 15.938 4.837 -16.598 1.00 3.01 C ATOM 498 CG LYS A 33 15.512 6.275 -16.357 1.00 24.11 C ATOM 499 CD LYS A 33 14.056 6.361 -15.931 1.00 43.44 C ATOM 500 CE LYS A 33 13.486 7.750 -16.174 1.00 42.50 C ATOM 501 NZ LYS A 33 13.209 7.992 -17.617 1.00 60.11 N ATOM 0 H LYS A 33 17.723 3.143 -16.726 1.00 54.03 H new ATOM 0 HA LYS A 33 16.976 4.892 -14.715 1.00 61.14 H new ATOM 0 HB2 LYS A 33 16.692 4.817 -17.385 1.00 3.01 H new ATOM 0 HB3 LYS A 33 15.082 4.270 -16.963 1.00 3.01 H new ATOM 0 HG2 LYS A 33 16.144 6.719 -15.588 1.00 24.11 H new ATOM 0 HG3 LYS A 33 15.661 6.857 -17.267 1.00 24.11 H new ATOM 0 HD2 LYS A 33 13.470 5.625 -16.482 1.00 43.44 H new ATOM 0 HD3 LYS A 33 13.970 6.111 -14.874 1.00 43.44 H new ATOM 0 HE2 LYS A 33 12.566 7.870 -15.603 1.00 42.50 H new ATOM 0 HE3 LYS A 33 14.188 8.500 -15.808 1.00 42.50 H new ATOM 0 HZ1 LYS A 33 12.655 8.866 -17.722 1.00 60.11 H new ATOM 0 HZ2 LYS A 33 14.108 8.088 -18.132 1.00 60.11 H new ATOM 0 HZ3 LYS A 33 12.671 7.192 -18.006 1.00 60.11 H new ATOM 515 N LEU A 34 15.132 2.213 -14.831 1.00 14.00 N ATOM 516 CA LEU A 34 14.077 1.472 -14.147 1.00 65.32 C ATOM 517 C LEU A 34 14.656 0.292 -13.373 1.00 30.22 C ATOM 518 O LEU A 34 14.132 -0.096 -12.329 1.00 41.14 O ATOM 519 CB LEU A 34 13.040 0.975 -15.155 1.00 53.24 C ATOM 520 CG LEU A 34 11.962 1.982 -15.560 1.00 63.25 C ATOM 521 CD1 LEU A 34 11.168 1.464 -16.750 1.00 3.22 C ATOM 522 CD2 LEU A 34 11.039 2.275 -14.387 1.00 54.33 C ATOM 0 H LEU A 34 15.657 1.666 -15.513 1.00 14.00 H new ATOM 0 HA LEU A 34 13.593 2.146 -13.440 1.00 65.32 H new ATOM 0 HB2 LEU A 34 13.563 0.651 -16.055 1.00 53.24 H new ATOM 0 HB3 LEU A 34 12.549 0.096 -14.738 1.00 53.24 H new ATOM 0 HG LEU A 34 12.451 2.911 -15.853 1.00 63.25 H new ATOM 0 HD11 LEU A 34 10.406 2.193 -17.024 1.00 3.22 H new ATOM 0 HD12 LEU A 34 11.839 1.306 -17.594 1.00 3.22 H new ATOM 0 HD13 LEU A 34 10.689 0.521 -16.485 1.00 3.22 H new ATOM 0 HD21 LEU A 34 10.278 2.993 -14.693 1.00 54.33 H new ATOM 0 HD22 LEU A 34 10.557 1.352 -14.064 1.00 54.33 H new ATOM 0 HD23 LEU A 34 11.619 2.690 -13.563 1.00 54.33 H new ATOM 534 N GLY A 35 15.742 -0.274 -13.891 1.00 30.33 N ATOM 535 CA GLY A 35 16.375 -1.403 -13.234 1.00 2.22 C ATOM 536 C GLY A 35 16.120 -2.711 -13.955 1.00 33.40 C ATOM 537 O GLY A 35 15.286 -3.512 -13.529 1.00 11.54 O ATOM 0 H GLY A 35 16.195 0.029 -14.753 1.00 30.33 H new ATOM 0 HA2 GLY A 35 17.449 -1.229 -13.173 1.00 2.22 H new ATOM 0 HA3 GLY A 35 16.006 -1.478 -12.211 1.00 2.22 H new ATOM 541 N LEU A 36 16.837 -2.931 -15.051 1.00 50.54 N ATOM 542 CA LEU A 36 16.683 -4.151 -15.835 1.00 71.22 C ATOM 543 C LEU A 36 18.037 -4.669 -16.308 1.00 63.24 C ATOM 544 O LEU A 36 19.005 -3.914 -16.399 1.00 64.02 O ATOM 545 CB LEU A 36 15.773 -3.897 -17.038 1.00 52.11 C ATOM 546 CG LEU A 36 14.567 -2.990 -16.788 1.00 21.42 C ATOM 547 CD1 LEU A 36 13.913 -2.597 -18.103 1.00 42.51 C ATOM 548 CD2 LEU A 36 13.562 -3.679 -15.876 1.00 23.03 C ATOM 0 H LEU A 36 17.531 -2.280 -15.417 1.00 50.54 H new ATOM 0 HA LEU A 36 16.228 -4.908 -15.197 1.00 71.22 H new ATOM 0 HB2 LEU A 36 16.373 -3.459 -17.836 1.00 52.11 H new ATOM 0 HB3 LEU A 36 15.410 -4.858 -17.403 1.00 52.11 H new ATOM 0 HG LEU A 36 14.915 -2.083 -16.294 1.00 21.42 H new ATOM 0 HD11 LEU A 36 13.057 -1.952 -17.905 1.00 42.51 H new ATOM 0 HD12 LEU A 36 14.634 -2.064 -18.723 1.00 42.51 H new ATOM 0 HD13 LEU A 36 13.579 -3.493 -18.625 1.00 42.51 H new ATOM 0 HD21 LEU A 36 12.710 -3.019 -15.709 1.00 23.03 H new ATOM 0 HD22 LEU A 36 13.220 -4.602 -16.344 1.00 23.03 H new ATOM 0 HD23 LEU A 36 14.035 -3.910 -14.922 1.00 23.03 H new ATOM 560 N VAL A 37 18.098 -5.962 -16.611 1.00 30.22 N ATOM 561 CA VAL A 37 19.333 -6.581 -17.078 1.00 53.12 C ATOM 562 C VAL A 37 19.252 -6.915 -18.564 1.00 30.05 C ATOM 563 O VAL A 37 18.290 -6.554 -19.240 1.00 44.35 O ATOM 564 CB VAL A 37 19.650 -7.866 -16.291 1.00 14.04 C ATOM 565 CG1 VAL A 37 19.709 -7.577 -14.798 1.00 75.14 C ATOM 566 CG2 VAL A 37 18.619 -8.944 -16.593 1.00 44.52 C ATOM 0 H VAL A 37 17.306 -6.601 -16.541 1.00 30.22 H new ATOM 0 HA VAL A 37 20.131 -5.857 -16.914 1.00 53.12 H new ATOM 0 HB VAL A 37 20.627 -8.232 -16.605 1.00 14.04 H new ATOM 0 HG11 VAL A 37 19.934 -8.497 -14.258 1.00 75.14 H new ATOM 0 HG12 VAL A 37 20.488 -6.840 -14.600 1.00 75.14 H new ATOM 0 HG13 VAL A 37 18.747 -7.187 -14.465 1.00 75.14 H new ATOM 0 HG21 VAL A 37 18.859 -9.845 -16.028 1.00 44.52 H new ATOM 0 HG22 VAL A 37 17.628 -8.590 -16.308 1.00 44.52 H new ATOM 0 HG23 VAL A 37 18.631 -9.170 -17.659 1.00 44.52 H new ATOM 576 N GLY A 38 20.270 -7.609 -19.065 1.00 14.32 N ATOM 577 CA GLY A 38 20.294 -7.981 -20.467 1.00 43.23 C ATOM 578 C GLY A 38 21.657 -7.772 -21.099 1.00 34.15 C ATOM 579 O GLY A 38 22.667 -7.697 -20.399 1.00 71.24 O ATOM 0 H GLY A 38 21.078 -7.920 -18.525 1.00 14.32 H new ATOM 0 HA2 GLY A 38 20.007 -9.028 -20.567 1.00 43.23 H new ATOM 0 HA3 GLY A 38 19.552 -7.394 -21.008 1.00 43.23 H new ATOM 583 N TRP A 39 21.685 -7.680 -22.423 1.00 52.10 N ATOM 584 CA TRP A 39 22.934 -7.480 -23.149 1.00 23.44 C ATOM 585 C TRP A 39 22.695 -6.716 -24.446 1.00 14.45 C ATOM 586 O TRP A 39 21.553 -6.425 -24.804 1.00 44.14 O ATOM 587 CB TRP A 39 23.593 -8.827 -23.451 1.00 21.34 C ATOM 588 CG TRP A 39 22.903 -9.596 -24.537 1.00 10.13 C ATOM 589 CD1 TRP A 39 23.065 -9.436 -25.883 1.00 75.33 C ATOM 590 CD2 TRP A 39 21.941 -10.643 -24.367 1.00 41.32 C ATOM 591 NE1 TRP A 39 22.261 -10.321 -26.561 1.00 51.13 N ATOM 592 CE2 TRP A 39 21.562 -11.073 -25.654 1.00 44.21 C ATOM 593 CE3 TRP A 39 21.364 -11.260 -23.254 1.00 64.01 C ATOM 594 CZ2 TRP A 39 20.633 -12.090 -25.855 1.00 42.01 C ATOM 595 CZ3 TRP A 39 20.442 -12.269 -23.455 1.00 61.23 C ATOM 596 CH2 TRP A 39 20.084 -12.677 -24.747 1.00 44.34 C ATOM 0 H TRP A 39 20.857 -7.741 -23.016 1.00 52.10 H new ATOM 0 HA TRP A 39 23.600 -6.890 -22.520 1.00 23.44 H new ATOM 0 HB2 TRP A 39 24.631 -8.659 -23.738 1.00 21.34 H new ATOM 0 HB3 TRP A 39 23.607 -9.429 -22.542 1.00 21.34 H new ATOM 0 HD1 TRP A 39 23.727 -8.720 -26.347 1.00 75.33 H new ATOM 0 HE1 TRP A 39 22.195 -10.404 -27.575 1.00 51.13 H new ATOM 0 HE3 TRP A 39 21.634 -10.954 -22.254 1.00 64.01 H new ATOM 0 HZ2 TRP A 39 20.355 -12.405 -26.850 1.00 42.01 H new ATOM 0 HZ3 TRP A 39 19.989 -12.752 -22.602 1.00 61.23 H new ATOM 0 HH2 TRP A 39 19.361 -13.470 -24.871 1.00 44.34 H new ATOM 607 N VAL A 40 23.777 -6.392 -25.146 1.00 22.03 N ATOM 608 CA VAL A 40 23.684 -5.662 -26.404 1.00 52.22 C ATOM 609 C VAL A 40 24.886 -5.949 -27.297 1.00 1.44 C ATOM 610 O VAL A 40 25.992 -6.181 -26.808 1.00 53.34 O ATOM 611 CB VAL A 40 23.586 -4.143 -26.166 1.00 32.20 C ATOM 612 CG1 VAL A 40 24.847 -3.626 -25.492 1.00 2.24 C ATOM 613 CG2 VAL A 40 23.335 -3.414 -27.477 1.00 52.21 C ATOM 0 H VAL A 40 24.729 -6.624 -24.863 1.00 22.03 H new ATOM 0 HA VAL A 40 22.776 -6.004 -26.901 1.00 52.22 H new ATOM 0 HB VAL A 40 22.743 -3.950 -25.502 1.00 32.20 H new ATOM 0 HG11 VAL A 40 24.760 -2.551 -25.332 1.00 2.24 H new ATOM 0 HG12 VAL A 40 24.978 -4.126 -24.533 1.00 2.24 H new ATOM 0 HG13 VAL A 40 25.709 -3.829 -26.128 1.00 2.24 H new ATOM 0 HG21 VAL A 40 23.268 -2.342 -27.290 1.00 52.21 H new ATOM 0 HG22 VAL A 40 24.156 -3.612 -28.166 1.00 52.21 H new ATOM 0 HG23 VAL A 40 22.401 -3.765 -27.915 1.00 52.21 H new ATOM 623 N GLN A 41 24.662 -5.930 -28.606 1.00 73.24 N ATOM 624 CA GLN A 41 25.728 -6.189 -29.567 1.00 55.33 C ATOM 625 C GLN A 41 25.316 -5.748 -30.968 1.00 62.12 C ATOM 626 O GLN A 41 24.451 -6.360 -31.593 1.00 22.51 O ATOM 627 CB GLN A 41 26.089 -7.675 -29.573 1.00 34.12 C ATOM 628 CG GLN A 41 27.347 -7.993 -30.364 1.00 41.41 C ATOM 629 CD GLN A 41 27.505 -9.475 -30.639 1.00 60.12 C ATOM 630 OE1 GLN A 41 28.222 -10.178 -29.926 1.00 40.40 O ATOM 631 NE2 GLN A 41 26.834 -9.959 -31.678 1.00 23.52 N ATOM 0 H GLN A 41 23.753 -5.738 -29.026 1.00 73.24 H new ATOM 0 HA GLN A 41 26.602 -5.612 -29.266 1.00 55.33 H new ATOM 0 HB2 GLN A 41 26.222 -8.012 -28.545 1.00 34.12 H new ATOM 0 HB3 GLN A 41 25.256 -8.241 -29.989 1.00 34.12 H new ATOM 0 HG2 GLN A 41 27.323 -7.452 -31.310 1.00 41.41 H new ATOM 0 HG3 GLN A 41 28.217 -7.635 -29.814 1.00 41.41 H new ATOM 0 HE21 GLN A 41 26.251 -9.340 -32.242 1.00 23.52 H new ATOM 0 HE22 GLN A 41 26.901 -10.950 -31.912 1.00 23.52 H new ATOM 640 N ASN A 42 25.942 -4.682 -31.455 1.00 40.44 N ATOM 641 CA ASN A 42 25.640 -4.158 -32.783 1.00 20.22 C ATOM 642 C ASN A 42 25.957 -5.191 -33.860 1.00 34.32 C ATOM 643 O ASN A 42 27.121 -5.486 -34.131 1.00 23.35 O ATOM 644 CB ASN A 42 26.434 -2.876 -33.041 1.00 70.00 C ATOM 645 CG ASN A 42 26.480 -2.511 -34.512 1.00 51.12 C ATOM 646 OD1 ASN A 42 27.528 -2.599 -35.153 1.00 34.23 O ATOM 647 ND2 ASN A 42 25.341 -2.098 -35.055 1.00 14.51 N ATOM 0 H ASN A 42 26.661 -4.164 -30.951 1.00 40.44 H new ATOM 0 HA ASN A 42 24.574 -3.932 -32.823 1.00 20.22 H new ATOM 0 HB2 ASN A 42 25.987 -2.056 -32.480 1.00 70.00 H new ATOM 0 HB3 ASN A 42 27.451 -3.000 -32.668 1.00 70.00 H new ATOM 0 HD21 ASN A 42 25.311 -1.838 -36.041 1.00 14.51 H new ATOM 0 HD22 ASN A 42 24.496 -2.040 -34.486 1.00 14.51 H new ATOM 654 N THR A 43 24.912 -5.739 -34.473 1.00 15.41 N ATOM 655 CA THR A 43 25.077 -6.739 -35.520 1.00 1.22 C ATOM 656 C THR A 43 25.548 -6.100 -36.821 1.00 41.22 C ATOM 657 O THR A 43 25.792 -4.894 -36.879 1.00 74.44 O ATOM 658 CB THR A 43 23.764 -7.501 -35.781 1.00 63.12 C ATOM 659 OG1 THR A 43 22.837 -6.657 -36.474 1.00 24.44 O ATOM 660 CG2 THR A 43 23.146 -7.978 -34.475 1.00 43.25 C ATOM 0 H THR A 43 23.942 -5.506 -34.262 1.00 15.41 H new ATOM 0 HA THR A 43 25.833 -7.442 -35.169 1.00 1.22 H new ATOM 0 HB THR A 43 23.991 -8.372 -36.396 1.00 63.12 H new ATOM 0 HG1 THR A 43 22.471 -5.994 -35.852 1.00 24.44 H new ATOM 0 HG21 THR A 43 22.220 -8.513 -34.685 1.00 43.25 H new ATOM 0 HG22 THR A 43 23.842 -8.644 -33.965 1.00 43.25 H new ATOM 0 HG23 THR A 43 22.932 -7.119 -33.839 1.00 43.25 H new ATOM 668 N ASP A 44 25.674 -6.914 -37.863 1.00 72.30 N ATOM 669 CA ASP A 44 26.114 -6.428 -39.165 1.00 42.43 C ATOM 670 C ASP A 44 24.937 -6.309 -40.128 1.00 34.41 C ATOM 671 O ASP A 44 24.966 -5.511 -41.065 1.00 32.42 O ATOM 672 CB ASP A 44 27.175 -7.361 -39.750 1.00 43.12 C ATOM 673 CG ASP A 44 28.560 -7.079 -39.201 1.00 21.40 C ATOM 674 OD1 ASP A 44 29.188 -6.097 -39.649 1.00 63.34 O ATOM 675 OD2 ASP A 44 29.015 -7.841 -38.322 1.00 43.51 O ATOM 0 H ASP A 44 25.477 -7.914 -37.831 1.00 72.30 H new ATOM 0 HA ASP A 44 26.548 -5.438 -39.027 1.00 42.43 H new ATOM 0 HB2 ASP A 44 26.905 -8.395 -39.533 1.00 43.12 H new ATOM 0 HB3 ASP A 44 27.189 -7.256 -40.835 1.00 43.12 H new ATOM 680 N ARG A 45 23.902 -7.110 -39.891 1.00 4.33 N ATOM 681 CA ARG A 45 22.716 -7.096 -40.738 1.00 20.41 C ATOM 682 C ARG A 45 22.122 -5.693 -40.819 1.00 73.32 C ATOM 683 O ARG A 45 21.451 -5.347 -41.791 1.00 21.51 O ATOM 684 CB ARG A 45 21.669 -8.075 -40.202 1.00 4.12 C ATOM 685 CG ARG A 45 21.851 -9.497 -40.706 1.00 31.33 C ATOM 686 CD ARG A 45 21.051 -10.489 -39.875 1.00 43.11 C ATOM 687 NE ARG A 45 19.644 -10.112 -39.779 1.00 35.42 N ATOM 688 CZ ARG A 45 18.771 -10.271 -40.768 1.00 21.11 C ATOM 689 NH1 ARG A 45 19.160 -10.797 -41.921 1.00 51.33 N ATOM 690 NH2 ARG A 45 17.507 -9.904 -40.604 1.00 35.11 N ATOM 0 H ARG A 45 23.862 -7.776 -39.120 1.00 4.33 H new ATOM 0 HA ARG A 45 23.012 -7.404 -41.741 1.00 20.41 H new ATOM 0 HB2 ARG A 45 21.709 -8.077 -39.113 1.00 4.12 H new ATOM 0 HB3 ARG A 45 20.677 -7.723 -40.484 1.00 4.12 H new ATOM 0 HG2 ARG A 45 21.538 -9.558 -41.748 1.00 31.33 H new ATOM 0 HG3 ARG A 45 22.908 -9.763 -40.675 1.00 31.33 H new ATOM 0 HD2 ARG A 45 21.131 -11.481 -40.319 1.00 43.11 H new ATOM 0 HD3 ARG A 45 21.479 -10.552 -38.874 1.00 43.11 H new ATOM 0 HE ARG A 45 19.313 -9.704 -38.905 1.00 35.42 H new ATOM 0 HH11 ARG A 45 20.131 -11.081 -42.050 1.00 51.33 H new ATOM 0 HH12 ARG A 45 18.488 -10.918 -42.679 1.00 51.33 H new ATOM 0 HH21 ARG A 45 17.204 -9.499 -39.718 1.00 35.11 H new ATOM 0 HH22 ARG A 45 16.838 -10.026 -41.364 1.00 35.11 H new ATOM 704 N GLY A 46 22.373 -4.889 -39.790 1.00 73.24 N ATOM 705 CA GLY A 46 21.855 -3.534 -39.765 1.00 11.32 C ATOM 706 C GLY A 46 20.835 -3.323 -38.663 1.00 25.11 C ATOM 707 O GLY A 46 19.999 -2.423 -38.744 1.00 33.22 O ATOM 0 H GLY A 46 22.926 -5.152 -38.974 1.00 73.24 H new ATOM 0 HA2 GLY A 46 22.681 -2.835 -39.630 1.00 11.32 H new ATOM 0 HA3 GLY A 46 21.398 -3.305 -40.728 1.00 11.32 H new ATOM 711 N THR A 47 20.903 -4.156 -37.629 1.00 70.41 N ATOM 712 CA THR A 47 19.977 -4.059 -36.508 1.00 23.43 C ATOM 713 C THR A 47 20.711 -4.180 -35.177 1.00 42.00 C ATOM 714 O THR A 47 21.846 -4.654 -35.123 1.00 60.11 O ATOM 715 CB THR A 47 18.889 -5.147 -36.581 1.00 64.44 C ATOM 716 OG1 THR A 47 19.472 -6.398 -36.965 1.00 43.22 O ATOM 717 CG2 THR A 47 17.805 -4.761 -37.576 1.00 34.44 C ATOM 0 H THR A 47 21.590 -4.905 -37.545 1.00 70.41 H new ATOM 0 HA THR A 47 19.505 -3.079 -36.573 1.00 23.43 H new ATOM 0 HB THR A 47 18.437 -5.245 -35.594 1.00 64.44 H new ATOM 0 HG1 THR A 47 18.774 -7.085 -37.007 1.00 43.22 H new ATOM 0 HG21 THR A 47 17.048 -5.544 -37.611 1.00 34.44 H new ATOM 0 HG22 THR A 47 17.344 -3.823 -37.266 1.00 34.44 H new ATOM 0 HG23 THR A 47 18.246 -4.639 -38.565 1.00 34.44 H new ATOM 725 N VAL A 48 20.056 -3.749 -34.104 1.00 0.42 N ATOM 726 CA VAL A 48 20.646 -3.810 -32.772 1.00 30.10 C ATOM 727 C VAL A 48 20.018 -4.925 -31.944 1.00 32.24 C ATOM 728 O VAL A 48 18.928 -4.765 -31.395 1.00 1.32 O ATOM 729 CB VAL A 48 20.482 -2.474 -32.023 1.00 74.30 C ATOM 730 CG1 VAL A 48 21.077 -2.568 -30.627 1.00 21.15 C ATOM 731 CG2 VAL A 48 21.122 -1.341 -32.810 1.00 1.43 C ATOM 0 H VAL A 48 19.116 -3.354 -34.131 1.00 0.42 H new ATOM 0 HA VAL A 48 21.708 -4.014 -32.905 1.00 30.10 H new ATOM 0 HB VAL A 48 19.418 -2.261 -31.924 1.00 74.30 H new ATOM 0 HG11 VAL A 48 20.952 -1.615 -30.113 1.00 21.15 H new ATOM 0 HG12 VAL A 48 20.568 -3.352 -30.067 1.00 21.15 H new ATOM 0 HG13 VAL A 48 22.139 -2.805 -30.699 1.00 21.15 H new ATOM 0 HG21 VAL A 48 20.997 -0.404 -32.267 1.00 1.43 H new ATOM 0 HG22 VAL A 48 22.185 -1.545 -32.942 1.00 1.43 H new ATOM 0 HG23 VAL A 48 20.644 -1.261 -33.786 1.00 1.43 H new ATOM 741 N GLN A 49 20.713 -6.055 -31.858 1.00 1.32 N ATOM 742 CA GLN A 49 20.223 -7.197 -31.096 1.00 34.11 C ATOM 743 C GLN A 49 20.310 -6.930 -29.597 1.00 0.20 C ATOM 744 O GLN A 49 21.391 -6.970 -29.011 1.00 61.11 O ATOM 745 CB GLN A 49 21.021 -8.453 -31.449 1.00 73.24 C ATOM 746 CG GLN A 49 20.428 -9.246 -32.603 1.00 71.10 C ATOM 747 CD GLN A 49 19.441 -10.300 -32.141 1.00 12.34 C ATOM 748 OE1 GLN A 49 18.245 -10.035 -32.018 1.00 15.12 O ATOM 749 NE2 GLN A 49 19.938 -11.504 -31.881 1.00 54.45 N ATOM 0 H GLN A 49 21.617 -6.204 -32.307 1.00 1.32 H new ATOM 0 HA GLN A 49 19.177 -7.354 -31.358 1.00 34.11 H new ATOM 0 HB2 GLN A 49 22.041 -8.166 -31.703 1.00 73.24 H new ATOM 0 HB3 GLN A 49 21.080 -9.095 -30.570 1.00 73.24 H new ATOM 0 HG2 GLN A 49 19.929 -8.562 -33.290 1.00 71.10 H new ATOM 0 HG3 GLN A 49 21.232 -9.726 -33.160 1.00 71.10 H new ATOM 0 HE21 GLN A 49 20.936 -11.680 -31.997 1.00 54.45 H new ATOM 0 HE22 GLN A 49 19.322 -12.253 -31.566 1.00 54.45 H new ATOM 758 N GLY A 50 19.164 -6.656 -28.982 1.00 35.14 N ATOM 759 CA GLY A 50 19.133 -6.386 -27.556 1.00 51.41 C ATOM 760 C GLY A 50 17.958 -7.048 -26.865 1.00 72.53 C ATOM 761 O GLY A 50 16.913 -7.272 -27.477 1.00 62.24 O ATOM 0 H GLY A 50 18.256 -6.616 -29.445 1.00 35.14 H new ATOM 0 HA2 GLY A 50 20.061 -6.736 -27.103 1.00 51.41 H new ATOM 0 HA3 GLY A 50 19.086 -5.309 -27.394 1.00 51.41 H new ATOM 765 N LYS A 51 18.128 -7.366 -25.586 1.00 55.32 N ATOM 766 CA LYS A 51 17.073 -8.008 -24.810 1.00 42.32 C ATOM 767 C LYS A 51 16.721 -7.178 -23.580 1.00 11.41 C ATOM 768 O LYS A 51 17.578 -6.504 -23.006 1.00 61.15 O ATOM 769 CB LYS A 51 17.508 -9.412 -24.384 1.00 3.42 C ATOM 770 CG LYS A 51 16.566 -10.064 -23.387 1.00 73.15 C ATOM 771 CD LYS A 51 17.077 -11.425 -22.944 1.00 42.45 C ATOM 772 CE LYS A 51 16.893 -12.471 -24.033 1.00 42.21 C ATOM 773 NZ LYS A 51 17.252 -13.835 -23.557 1.00 62.43 N ATOM 0 H LYS A 51 18.987 -7.190 -25.065 1.00 55.32 H new ATOM 0 HA LYS A 51 16.187 -8.084 -25.441 1.00 42.32 H new ATOM 0 HB2 LYS A 51 17.582 -10.044 -25.269 1.00 3.42 H new ATOM 0 HB3 LYS A 51 18.505 -9.357 -23.947 1.00 3.42 H new ATOM 0 HG2 LYS A 51 16.451 -9.417 -22.517 1.00 73.15 H new ATOM 0 HG3 LYS A 51 15.579 -10.174 -23.836 1.00 73.15 H new ATOM 0 HD2 LYS A 51 18.133 -11.351 -22.684 1.00 42.45 H new ATOM 0 HD3 LYS A 51 16.548 -11.738 -22.044 1.00 42.45 H new ATOM 0 HE2 LYS A 51 15.857 -12.465 -24.371 1.00 42.21 H new ATOM 0 HE3 LYS A 51 17.510 -12.212 -24.893 1.00 42.21 H new ATOM 0 HZ1 LYS A 51 17.049 -14.528 -24.305 1.00 62.43 H new ATOM 0 HZ2 LYS A 51 18.265 -13.865 -23.322 1.00 62.43 H new ATOM 0 HZ3 LYS A 51 16.693 -14.066 -22.711 1.00 62.43 H new ATOM 787 N LEU A 52 15.456 -7.231 -23.178 1.00 72.32 N ATOM 788 CA LEU A 52 14.990 -6.485 -22.014 1.00 64.42 C ATOM 789 C LEU A 52 14.436 -7.427 -20.950 1.00 73.01 C ATOM 790 O LEU A 52 13.258 -7.782 -20.976 1.00 72.41 O ATOM 791 CB LEU A 52 13.918 -5.475 -22.426 1.00 62.24 C ATOM 792 CG LEU A 52 14.427 -4.119 -22.915 1.00 53.45 C ATOM 793 CD1 LEU A 52 13.265 -3.237 -23.348 1.00 21.43 C ATOM 794 CD2 LEU A 52 15.244 -3.433 -21.830 1.00 51.34 C ATOM 0 H LEU A 52 14.734 -7.783 -23.641 1.00 72.32 H new ATOM 0 HA LEU A 52 15.841 -5.950 -21.592 1.00 64.42 H new ATOM 0 HB2 LEU A 52 13.312 -5.920 -23.216 1.00 62.24 H new ATOM 0 HB3 LEU A 52 13.258 -5.308 -21.575 1.00 62.24 H new ATOM 0 HG LEU A 52 15.072 -4.284 -23.778 1.00 53.45 H new ATOM 0 HD11 LEU A 52 13.647 -2.276 -23.693 1.00 21.43 H new ATOM 0 HD12 LEU A 52 12.721 -3.723 -24.158 1.00 21.43 H new ATOM 0 HD13 LEU A 52 12.594 -3.079 -22.504 1.00 21.43 H new ATOM 0 HD21 LEU A 52 15.598 -2.469 -22.196 1.00 51.34 H new ATOM 0 HD22 LEU A 52 14.622 -3.280 -20.948 1.00 51.34 H new ATOM 0 HD23 LEU A 52 16.098 -4.058 -21.568 1.00 51.34 H new ATOM 806 N GLN A 53 15.292 -7.825 -20.015 1.00 63.10 N ATOM 807 CA GLN A 53 14.887 -8.724 -18.941 1.00 73.22 C ATOM 808 C GLN A 53 14.498 -7.940 -17.692 1.00 64.00 C ATOM 809 O GLN A 53 15.281 -7.140 -17.181 1.00 30.11 O ATOM 810 CB GLN A 53 16.016 -9.703 -18.613 1.00 53.20 C ATOM 811 CG GLN A 53 16.164 -10.824 -19.629 1.00 52.31 C ATOM 812 CD GLN A 53 16.974 -11.990 -19.098 1.00 11.32 C ATOM 813 OE1 GLN A 53 16.686 -12.523 -18.026 1.00 23.30 O ATOM 814 NE2 GLN A 53 17.994 -12.392 -19.847 1.00 31.33 N ATOM 0 H GLN A 53 16.270 -7.539 -19.979 1.00 63.10 H new ATOM 0 HA GLN A 53 14.017 -9.286 -19.280 1.00 73.22 H new ATOM 0 HB2 GLN A 53 16.955 -9.154 -18.551 1.00 53.20 H new ATOM 0 HB3 GLN A 53 15.835 -10.137 -17.630 1.00 53.20 H new ATOM 0 HG2 GLN A 53 15.175 -11.177 -19.921 1.00 52.31 H new ATOM 0 HG3 GLN A 53 16.642 -10.434 -20.528 1.00 52.31 H new ATOM 0 HE21 GLN A 53 18.196 -11.921 -20.729 1.00 31.33 H new ATOM 0 HE22 GLN A 53 18.575 -13.172 -19.541 1.00 31.33 H new ATOM 823 N GLY A 54 13.284 -8.175 -17.205 1.00 75.03 N ATOM 824 CA GLY A 54 12.812 -7.482 -16.020 1.00 65.42 C ATOM 825 C GLY A 54 11.301 -7.488 -15.908 1.00 31.43 C ATOM 826 O GLY A 54 10.600 -8.109 -16.707 1.00 51.23 O ATOM 0 H GLY A 54 12.618 -8.833 -17.610 1.00 75.03 H new ATOM 0 HA2 GLY A 54 13.241 -7.950 -15.134 1.00 65.42 H new ATOM 0 HA3 GLY A 54 13.168 -6.452 -16.040 1.00 65.42 H new ATOM 830 N PRO A 55 10.776 -6.785 -14.893 1.00 64.11 N ATOM 831 CA PRO A 55 9.333 -6.697 -14.654 1.00 12.01 C ATOM 832 C PRO A 55 8.617 -5.876 -15.722 1.00 23.44 C ATOM 833 O PRO A 55 9.036 -4.765 -16.048 1.00 21.32 O ATOM 834 CB PRO A 55 9.240 -6.001 -13.294 1.00 25.24 C ATOM 835 CG PRO A 55 10.504 -5.219 -13.181 1.00 74.44 C ATOM 836 CD PRO A 55 11.552 -6.021 -13.902 1.00 22.34 C ATOM 0 HA PRO A 55 8.856 -7.677 -14.681 1.00 12.01 H new ATOM 0 HB2 PRO A 55 8.366 -5.351 -13.241 1.00 25.24 H new ATOM 0 HB3 PRO A 55 9.149 -6.725 -12.484 1.00 25.24 H new ATOM 0 HG2 PRO A 55 10.393 -4.231 -13.627 1.00 74.44 H new ATOM 0 HG3 PRO A 55 10.778 -5.068 -12.137 1.00 74.44 H new ATOM 0 HD2 PRO A 55 12.292 -5.378 -14.380 1.00 22.34 H new ATOM 0 HD3 PRO A 55 12.093 -6.679 -13.222 1.00 22.34 H new ATOM 844 N ILE A 56 7.537 -6.430 -16.262 1.00 31.15 N ATOM 845 CA ILE A 56 6.763 -5.748 -17.291 1.00 40.12 C ATOM 846 C ILE A 56 6.224 -4.416 -16.781 1.00 54.24 C ATOM 847 O ILE A 56 6.048 -3.470 -17.550 1.00 71.50 O ATOM 848 CB ILE A 56 5.585 -6.614 -17.777 1.00 5.33 C ATOM 849 CG1 ILE A 56 6.097 -7.948 -18.324 1.00 53.10 C ATOM 850 CG2 ILE A 56 4.785 -5.872 -18.837 1.00 34.24 C ATOM 851 CD1 ILE A 56 4.992 -8.905 -18.712 1.00 35.21 C ATOM 0 H ILE A 56 7.178 -7.349 -16.004 1.00 31.15 H new ATOM 0 HA ILE A 56 7.439 -5.568 -18.127 1.00 40.12 H new ATOM 0 HB ILE A 56 4.929 -6.818 -16.931 1.00 5.33 H new ATOM 0 HG12 ILE A 56 6.724 -7.758 -19.195 1.00 53.10 H new ATOM 0 HG13 ILE A 56 6.729 -8.421 -17.573 1.00 53.10 H new ATOM 0 HG21 ILE A 56 3.956 -6.496 -19.171 1.00 34.24 H new ATOM 0 HG22 ILE A 56 4.395 -4.945 -18.416 1.00 34.24 H new ATOM 0 HG23 ILE A 56 5.430 -5.642 -19.685 1.00 34.24 H new ATOM 0 HD11 ILE A 56 5.428 -9.829 -19.091 1.00 35.21 H new ATOM 0 HD12 ILE A 56 4.378 -9.125 -17.839 1.00 35.21 H new ATOM 0 HD13 ILE A 56 4.373 -8.451 -19.486 1.00 35.21 H new ATOM 863 N SER A 57 5.964 -4.348 -15.480 1.00 3.25 N ATOM 864 CA SER A 57 5.443 -3.132 -14.866 1.00 40.24 C ATOM 865 C SER A 57 6.332 -1.935 -15.191 1.00 62.43 C ATOM 866 O SER A 57 5.868 -0.796 -15.240 1.00 73.22 O ATOM 867 CB SER A 57 5.336 -3.305 -13.350 1.00 61.31 C ATOM 868 OG SER A 57 5.131 -2.059 -12.707 1.00 71.14 O ATOM 0 H SER A 57 6.106 -5.121 -14.830 1.00 3.25 H new ATOM 0 HA SER A 57 4.449 -2.946 -15.274 1.00 40.24 H new ATOM 0 HB2 SER A 57 4.512 -3.979 -13.115 1.00 61.31 H new ATOM 0 HB3 SER A 57 6.246 -3.769 -12.969 1.00 61.31 H new ATOM 0 HG SER A 57 5.064 -2.197 -11.739 1.00 71.14 H new ATOM 874 N LYS A 58 7.615 -2.202 -15.413 1.00 32.51 N ATOM 875 CA LYS A 58 8.571 -1.150 -15.735 1.00 25.24 C ATOM 876 C LYS A 58 9.006 -1.237 -17.194 1.00 73.33 C ATOM 877 O LYS A 58 9.102 -0.223 -17.885 1.00 63.03 O ATOM 878 CB LYS A 58 9.795 -1.248 -14.821 1.00 21.22 C ATOM 879 CG LYS A 58 9.648 -0.474 -13.522 1.00 41.14 C ATOM 880 CD LYS A 58 9.032 -1.331 -12.429 1.00 2.51 C ATOM 881 CE LYS A 58 9.518 -0.909 -11.051 1.00 14.45 C ATOM 882 NZ LYS A 58 9.234 -1.946 -10.021 1.00 33.41 N ATOM 0 H LYS A 58 8.016 -3.139 -15.376 1.00 32.51 H new ATOM 0 HA LYS A 58 8.082 -0.189 -15.577 1.00 25.24 H new ATOM 0 HB2 LYS A 58 9.982 -2.297 -14.590 1.00 21.22 H new ATOM 0 HB3 LYS A 58 10.669 -0.879 -15.357 1.00 21.22 H new ATOM 0 HG2 LYS A 58 10.625 -0.116 -13.198 1.00 41.14 H new ATOM 0 HG3 LYS A 58 9.026 0.406 -13.690 1.00 41.14 H new ATOM 0 HD2 LYS A 58 7.946 -1.253 -12.473 1.00 2.51 H new ATOM 0 HD3 LYS A 58 9.284 -2.378 -12.600 1.00 2.51 H new ATOM 0 HE2 LYS A 58 10.590 -0.717 -11.087 1.00 14.45 H new ATOM 0 HE3 LYS A 58 9.036 0.027 -10.767 1.00 14.45 H new ATOM 0 HZ1 LYS A 58 9.580 -1.621 -9.096 1.00 33.41 H new ATOM 0 HZ2 LYS A 58 8.209 -2.111 -9.968 1.00 33.41 H new ATOM 0 HZ3 LYS A 58 9.714 -2.832 -10.278 1.00 33.41 H new ATOM 896 N VAL A 59 9.265 -2.456 -17.658 1.00 42.31 N ATOM 897 CA VAL A 59 9.686 -2.675 -19.037 1.00 24.34 C ATOM 898 C VAL A 59 8.726 -2.011 -20.017 1.00 62.41 C ATOM 899 O VAL A 59 9.121 -1.605 -21.110 1.00 23.20 O ATOM 900 CB VAL A 59 9.778 -4.178 -19.363 1.00 4.22 C ATOM 901 CG1 VAL A 59 10.190 -4.385 -20.812 1.00 72.44 C ATOM 902 CG2 VAL A 59 10.752 -4.869 -18.420 1.00 14.34 C ATOM 0 H VAL A 59 9.191 -3.306 -17.099 1.00 42.31 H new ATOM 0 HA VAL A 59 10.674 -2.227 -19.142 1.00 24.34 H new ATOM 0 HB VAL A 59 8.793 -4.624 -19.222 1.00 4.22 H new ATOM 0 HG11 VAL A 59 10.250 -5.452 -21.024 1.00 72.44 H new ATOM 0 HG12 VAL A 59 9.452 -3.925 -21.469 1.00 72.44 H new ATOM 0 HG13 VAL A 59 11.164 -3.926 -20.983 1.00 72.44 H new ATOM 0 HG21 VAL A 59 10.805 -5.930 -18.665 1.00 14.34 H new ATOM 0 HG22 VAL A 59 11.741 -4.423 -18.527 1.00 14.34 H new ATOM 0 HG23 VAL A 59 10.409 -4.750 -17.392 1.00 14.34 H new ATOM 912 N ARG A 60 7.463 -1.904 -19.619 1.00 31.04 N ATOM 913 CA ARG A 60 6.445 -1.290 -20.463 1.00 1.34 C ATOM 914 C ARG A 60 6.897 0.086 -20.945 1.00 72.54 C ATOM 915 O ARG A 60 6.542 0.515 -22.043 1.00 4.45 O ATOM 916 CB ARG A 60 5.126 -1.166 -19.699 1.00 15.22 C ATOM 917 CG ARG A 60 4.323 -2.456 -19.657 1.00 14.30 C ATOM 918 CD ARG A 60 3.451 -2.610 -20.894 1.00 4.12 C ATOM 919 NE ARG A 60 2.466 -3.677 -20.740 1.00 12.55 N ATOM 920 CZ ARG A 60 1.645 -4.065 -21.709 1.00 44.14 C ATOM 921 NH1 ARG A 60 1.693 -3.478 -22.897 1.00 54.41 N ATOM 922 NH2 ARG A 60 0.776 -5.043 -21.492 1.00 74.22 N ATOM 0 H ARG A 60 7.120 -2.235 -18.717 1.00 31.04 H new ATOM 0 HA ARG A 60 6.295 -1.930 -21.332 1.00 1.34 H new ATOM 0 HB2 ARG A 60 5.336 -0.845 -18.679 1.00 15.22 H new ATOM 0 HB3 ARG A 60 4.521 -0.386 -20.160 1.00 15.22 H new ATOM 0 HG2 ARG A 60 5.001 -3.306 -19.581 1.00 14.30 H new ATOM 0 HG3 ARG A 60 3.696 -2.467 -18.765 1.00 14.30 H new ATOM 0 HD2 ARG A 60 2.938 -1.670 -21.095 1.00 4.12 H new ATOM 0 HD3 ARG A 60 4.081 -2.821 -21.758 1.00 4.12 H new ATOM 0 HE ARG A 60 2.405 -4.150 -19.839 1.00 12.55 H new ATOM 0 HH11 ARG A 60 2.361 -2.727 -23.068 1.00 54.41 H new ATOM 0 HH12 ARG A 60 1.061 -3.778 -23.640 1.00 54.41 H new ATOM 0 HH21 ARG A 60 0.738 -5.498 -20.580 1.00 74.22 H new ATOM 0 HH22 ARG A 60 0.146 -5.340 -22.237 1.00 74.22 H new ATOM 936 N GLU A 61 7.680 0.770 -20.118 1.00 23.23 N ATOM 937 CA GLU A 61 8.179 2.097 -20.461 1.00 33.45 C ATOM 938 C GLU A 61 9.481 2.001 -21.251 1.00 14.32 C ATOM 939 O GLU A 61 9.754 2.830 -22.119 1.00 1.05 O ATOM 940 CB GLU A 61 8.398 2.926 -19.194 1.00 12.52 C ATOM 941 CG GLU A 61 7.252 2.834 -18.200 1.00 24.44 C ATOM 942 CD GLU A 61 5.971 3.450 -18.726 1.00 42.35 C ATOM 943 OE1 GLU A 61 5.305 2.809 -19.566 1.00 11.33 O ATOM 944 OE2 GLU A 61 5.635 4.575 -18.299 1.00 21.53 O ATOM 0 H GLU A 61 7.983 0.428 -19.206 1.00 23.23 H new ATOM 0 HA GLU A 61 7.432 2.589 -21.084 1.00 33.45 H new ATOM 0 HB2 GLU A 61 9.316 2.596 -18.708 1.00 12.52 H new ATOM 0 HB3 GLU A 61 8.542 3.970 -19.473 1.00 12.52 H new ATOM 0 HG2 GLU A 61 7.073 1.787 -17.954 1.00 24.44 H new ATOM 0 HG3 GLU A 61 7.538 3.334 -17.275 1.00 24.44 H new ATOM 951 N MET A 62 10.280 0.985 -20.943 1.00 73.01 N ATOM 952 CA MET A 62 11.553 0.781 -21.625 1.00 34.33 C ATOM 953 C MET A 62 11.336 0.505 -23.109 1.00 42.23 C ATOM 954 O MET A 62 12.225 0.738 -23.928 1.00 51.01 O ATOM 955 CB MET A 62 12.318 -0.380 -20.985 1.00 14.51 C ATOM 956 CG MET A 62 13.823 -0.171 -20.954 1.00 60.21 C ATOM 957 SD MET A 62 14.336 1.004 -19.687 1.00 12.05 S ATOM 958 CE MET A 62 14.437 2.513 -20.645 1.00 41.54 C ATOM 0 H MET A 62 10.069 0.291 -20.226 1.00 73.01 H new ATOM 0 HA MET A 62 12.141 1.693 -21.525 1.00 34.33 H new ATOM 0 HB2 MET A 62 11.958 -0.524 -19.966 1.00 14.51 H new ATOM 0 HB3 MET A 62 12.098 -1.296 -21.533 1.00 14.51 H new ATOM 0 HG2 MET A 62 14.315 -1.127 -20.777 1.00 60.21 H new ATOM 0 HG3 MET A 62 14.157 0.184 -21.929 1.00 60.21 H new ATOM 0 HE1 MET A 62 15.257 3.126 -20.272 1.00 41.54 H new ATOM 0 HE2 MET A 62 14.614 2.268 -21.692 1.00 41.54 H new ATOM 0 HE3 MET A 62 13.501 3.065 -20.555 1.00 41.54 H new ATOM 968 N GLN A 63 10.151 0.008 -23.448 1.00 11.32 N ATOM 969 CA GLN A 63 9.820 -0.299 -24.834 1.00 72.41 C ATOM 970 C GLN A 63 9.736 0.974 -25.669 1.00 74.02 C ATOM 971 O GLN A 63 10.313 1.058 -26.754 1.00 34.44 O ATOM 972 CB GLN A 63 8.495 -1.060 -24.907 1.00 73.14 C ATOM 973 CG GLN A 63 8.358 -2.147 -23.854 1.00 23.33 C ATOM 974 CD GLN A 63 7.772 -3.429 -24.411 1.00 34.44 C ATOM 975 OE1 GLN A 63 6.648 -3.444 -24.915 1.00 2.03 O ATOM 976 NE2 GLN A 63 8.531 -4.515 -24.323 1.00 33.33 N ATOM 0 H GLN A 63 9.404 -0.191 -22.782 1.00 11.32 H new ATOM 0 HA GLN A 63 10.614 -0.926 -25.240 1.00 72.41 H new ATOM 0 HB2 GLN A 63 7.673 -0.353 -24.796 1.00 73.14 H new ATOM 0 HB3 GLN A 63 8.398 -1.509 -25.895 1.00 73.14 H new ATOM 0 HG2 GLN A 63 9.338 -2.357 -23.424 1.00 23.33 H new ATOM 0 HG3 GLN A 63 7.725 -1.785 -23.044 1.00 23.33 H new ATOM 0 HE21 GLN A 63 9.456 -4.457 -23.898 1.00 33.33 H new ATOM 0 HE22 GLN A 63 8.189 -5.407 -24.681 1.00 33.33 H new ATOM 985 N LYS A 64 9.013 1.964 -25.158 1.00 14.45 N ATOM 986 CA LYS A 64 8.853 3.235 -25.855 1.00 34.13 C ATOM 987 C LYS A 64 10.174 3.995 -25.911 1.00 61.44 C ATOM 988 O LYS A 64 10.310 4.967 -26.654 1.00 0.35 O ATOM 989 CB LYS A 64 7.790 4.090 -25.161 1.00 53.34 C ATOM 990 CG LYS A 64 6.383 3.852 -25.682 1.00 51.41 C ATOM 991 CD LYS A 64 5.334 4.334 -24.694 1.00 53.53 C ATOM 992 CE LYS A 64 3.925 4.093 -25.215 1.00 62.00 C ATOM 993 NZ LYS A 64 3.587 2.643 -25.249 1.00 3.04 N ATOM 0 H LYS A 64 8.528 1.911 -24.262 1.00 14.45 H new ATOM 0 HA LYS A 64 8.532 3.024 -26.875 1.00 34.13 H new ATOM 0 HB2 LYS A 64 7.812 3.884 -24.091 1.00 53.34 H new ATOM 0 HB3 LYS A 64 8.042 5.143 -25.288 1.00 53.34 H new ATOM 0 HG2 LYS A 64 6.254 4.369 -26.633 1.00 51.41 H new ATOM 0 HG3 LYS A 64 6.241 2.789 -25.876 1.00 51.41 H new ATOM 0 HD2 LYS A 64 5.464 3.818 -23.743 1.00 53.53 H new ATOM 0 HD3 LYS A 64 5.475 5.398 -24.502 1.00 53.53 H new ATOM 0 HE2 LYS A 64 3.209 4.618 -24.583 1.00 62.00 H new ATOM 0 HE3 LYS A 64 3.832 4.511 -26.217 1.00 62.00 H new ATOM 0 HZ1 LYS A 64 2.579 2.527 -25.479 1.00 3.04 H new ATOM 0 HZ2 LYS A 64 4.164 2.169 -25.973 1.00 3.04 H new ATOM 0 HZ3 LYS A 64 3.781 2.219 -24.319 1.00 3.04 H new ATOM 1007 N TRP A 65 11.144 3.544 -25.125 1.00 23.34 N ATOM 1008 CA TRP A 65 12.456 4.181 -25.087 1.00 72.10 C ATOM 1009 C TRP A 65 13.354 3.643 -26.196 1.00 1.44 C ATOM 1010 O TRP A 65 14.280 4.322 -26.642 1.00 2.13 O ATOM 1011 CB TRP A 65 13.116 3.957 -23.725 1.00 74.14 C ATOM 1012 CG TRP A 65 12.883 5.080 -22.761 1.00 2.22 C ATOM 1013 CD1 TRP A 65 12.040 5.077 -21.687 1.00 15.11 C ATOM 1014 CD2 TRP A 65 13.501 6.371 -22.784 1.00 44.51 C ATOM 1015 NE1 TRP A 65 12.096 6.289 -21.041 1.00 71.32 N ATOM 1016 CE2 TRP A 65 12.986 7.100 -21.694 1.00 70.20 C ATOM 1017 CE3 TRP A 65 14.441 6.983 -23.618 1.00 64.42 C ATOM 1018 CZ2 TRP A 65 13.379 8.407 -21.420 1.00 24.12 C ATOM 1019 CZ3 TRP A 65 14.831 8.280 -23.345 1.00 34.01 C ATOM 1020 CH2 TRP A 65 14.301 8.981 -22.253 1.00 20.40 C ATOM 0 H TRP A 65 11.048 2.740 -24.505 1.00 23.34 H new ATOM 0 HA TRP A 65 12.318 5.251 -25.244 1.00 72.10 H new ATOM 0 HB2 TRP A 65 12.736 3.032 -23.293 1.00 74.14 H new ATOM 0 HB3 TRP A 65 14.189 3.825 -23.866 1.00 74.14 H new ATOM 0 HD1 TRP A 65 11.420 4.244 -21.389 1.00 15.11 H new ATOM 0 HE1 TRP A 65 11.562 6.543 -20.210 1.00 71.32 H new ATOM 0 HE3 TRP A 65 14.855 6.451 -24.462 1.00 64.42 H new ATOM 0 HZ2 TRP A 65 12.971 8.949 -20.580 1.00 24.12 H new ATOM 0 HZ3 TRP A 65 15.556 8.762 -23.984 1.00 34.01 H new ATOM 0 HH2 TRP A 65 14.626 9.994 -22.065 1.00 20.40 H new ATOM 1031 N LEU A 66 13.076 2.422 -26.637 1.00 35.23 N ATOM 1032 CA LEU A 66 13.859 1.793 -27.695 1.00 1.15 C ATOM 1033 C LEU A 66 13.033 1.644 -28.968 1.00 44.04 C ATOM 1034 O LEU A 66 13.389 0.878 -29.863 1.00 32.40 O ATOM 1035 CB LEU A 66 14.364 0.424 -27.237 1.00 72.51 C ATOM 1036 CG LEU A 66 15.772 0.392 -26.642 1.00 62.54 C ATOM 1037 CD1 LEU A 66 15.970 -0.862 -25.805 1.00 34.41 C ATOM 1038 CD2 LEU A 66 16.818 0.469 -27.745 1.00 5.14 C ATOM 0 H LEU A 66 12.314 1.847 -26.278 1.00 35.23 H new ATOM 0 HA LEU A 66 14.713 2.434 -27.912 1.00 1.15 H new ATOM 0 HB2 LEU A 66 13.669 0.032 -26.495 1.00 72.51 H new ATOM 0 HB3 LEU A 66 14.336 -0.255 -28.089 1.00 72.51 H new ATOM 0 HG LEU A 66 15.891 1.260 -25.993 1.00 62.54 H new ATOM 0 HD11 LEU A 66 16.978 -0.867 -25.390 1.00 34.41 H new ATOM 0 HD12 LEU A 66 15.243 -0.876 -24.993 1.00 34.41 H new ATOM 0 HD13 LEU A 66 15.831 -1.743 -26.431 1.00 34.41 H new ATOM 0 HD21 LEU A 66 17.814 0.445 -27.304 1.00 5.14 H new ATOM 0 HD22 LEU A 66 16.699 -0.379 -28.419 1.00 5.14 H new ATOM 0 HD23 LEU A 66 16.691 1.397 -28.303 1.00 5.14 H new ATOM 1050 N GLU A 67 11.931 2.384 -29.043 1.00 63.32 N ATOM 1051 CA GLU A 67 11.057 2.334 -30.209 1.00 35.02 C ATOM 1052 C GLU A 67 11.114 3.644 -30.989 1.00 2.44 C ATOM 1053 O GLU A 67 11.346 3.651 -32.198 1.00 55.42 O ATOM 1054 CB GLU A 67 9.616 2.045 -29.781 1.00 40.30 C ATOM 1055 CG GLU A 67 8.610 2.159 -30.914 1.00 62.13 C ATOM 1056 CD GLU A 67 7.393 1.279 -30.704 1.00 41.14 C ATOM 1057 OE1 GLU A 67 6.917 1.191 -29.553 1.00 52.32 O ATOM 1058 OE2 GLU A 67 6.917 0.679 -31.690 1.00 63.43 O ATOM 0 H GLU A 67 11.623 3.024 -28.311 1.00 63.32 H new ATOM 0 HA GLU A 67 11.405 1.530 -30.858 1.00 35.02 H new ATOM 0 HB2 GLU A 67 9.565 1.040 -29.361 1.00 40.30 H new ATOM 0 HB3 GLU A 67 9.336 2.737 -28.987 1.00 40.30 H new ATOM 0 HG2 GLU A 67 8.291 3.197 -31.009 1.00 62.13 H new ATOM 0 HG3 GLU A 67 9.093 1.887 -31.853 1.00 62.13 H new ATOM 1065 N THR A 68 10.901 4.754 -30.287 1.00 64.43 N ATOM 1066 CA THR A 68 10.927 6.070 -30.912 1.00 61.14 C ATOM 1067 C THR A 68 12.099 6.899 -30.399 1.00 55.52 C ATOM 1068 O THR A 68 12.764 7.593 -31.168 1.00 63.13 O ATOM 1069 CB THR A 68 9.617 6.839 -30.657 1.00 22.13 C ATOM 1070 OG1 THR A 68 9.761 8.202 -31.070 1.00 11.31 O ATOM 1071 CG2 THR A 68 9.238 6.787 -29.184 1.00 51.14 C ATOM 0 H THR A 68 10.709 4.767 -29.285 1.00 64.43 H new ATOM 0 HA THR A 68 11.042 5.909 -31.984 1.00 61.14 H new ATOM 0 HB THR A 68 8.824 6.366 -31.237 1.00 22.13 H new ATOM 0 HG1 THR A 68 8.923 8.684 -30.906 1.00 11.31 H new ATOM 0 HG21 THR A 68 8.310 7.337 -29.028 1.00 51.14 H new ATOM 0 HG22 THR A 68 9.101 5.749 -28.880 1.00 51.14 H new ATOM 0 HG23 THR A 68 10.032 7.238 -28.588 1.00 51.14 H new ATOM 1079 N ARG A 69 12.345 6.823 -29.096 1.00 4.34 N ATOM 1080 CA ARG A 69 13.437 7.568 -28.480 1.00 1.21 C ATOM 1081 C ARG A 69 14.783 7.129 -29.048 1.00 43.03 C ATOM 1082 O ARG A 69 15.404 7.850 -29.829 1.00 21.45 O ATOM 1083 CB ARG A 69 13.424 7.373 -26.963 1.00 11.13 C ATOM 1084 CG ARG A 69 12.415 8.254 -26.244 1.00 43.41 C ATOM 1085 CD ARG A 69 12.741 9.730 -26.418 1.00 75.44 C ATOM 1086 NE ARG A 69 14.132 10.026 -26.089 1.00 21.12 N ATOM 1087 CZ ARG A 69 14.711 11.197 -26.329 1.00 51.13 C ATOM 1088 NH1 ARG A 69 14.022 12.177 -26.898 1.00 33.40 N ATOM 1089 NH2 ARG A 69 15.982 11.390 -26.000 1.00 52.43 N ATOM 0 H ARG A 69 11.803 6.253 -28.446 1.00 4.34 H new ATOM 0 HA ARG A 69 13.294 8.625 -28.705 1.00 1.21 H new ATOM 0 HB2 ARG A 69 13.205 6.329 -26.741 1.00 11.13 H new ATOM 0 HB3 ARG A 69 14.419 7.580 -26.570 1.00 11.13 H new ATOM 0 HG2 ARG A 69 11.415 8.053 -26.629 1.00 43.41 H new ATOM 0 HG3 ARG A 69 12.404 8.005 -25.183 1.00 43.41 H new ATOM 0 HD2 ARG A 69 12.541 10.026 -27.448 1.00 75.44 H new ATOM 0 HD3 ARG A 69 12.084 10.324 -25.782 1.00 75.44 H new ATOM 0 HE ARG A 69 14.690 9.293 -25.651 1.00 21.12 H new ATOM 0 HH11 ARG A 69 13.045 12.032 -27.152 1.00 33.40 H new ATOM 0 HH12 ARG A 69 14.469 13.075 -27.081 1.00 33.40 H new ATOM 0 HH21 ARG A 69 16.515 10.639 -25.562 1.00 52.43 H new ATOM 0 HH22 ARG A 69 16.426 12.290 -26.185 1.00 52.43 H new ATOM 1103 N GLY A 70 15.229 5.941 -28.650 1.00 50.05 N ATOM 1104 CA GLY A 70 16.499 5.427 -29.129 1.00 73.33 C ATOM 1105 C GLY A 70 17.657 6.349 -28.806 1.00 1.32 C ATOM 1106 O GLY A 70 17.556 7.196 -27.918 1.00 30.10 O ATOM 0 H GLY A 70 14.734 5.326 -28.005 1.00 50.05 H new ATOM 0 HA2 GLY A 70 16.682 4.449 -28.684 1.00 73.33 H new ATOM 0 HA3 GLY A 70 16.445 5.281 -30.208 1.00 73.33 H new ATOM 1110 N SER A 71 18.762 6.185 -29.527 1.00 33.13 N ATOM 1111 CA SER A 71 19.946 7.006 -29.308 1.00 5.41 C ATOM 1112 C SER A 71 20.046 8.107 -30.359 1.00 51.44 C ATOM 1113 O SER A 71 19.438 8.037 -31.428 1.00 0.52 O ATOM 1114 CB SER A 71 21.207 6.140 -29.340 1.00 32.22 C ATOM 1115 OG SER A 71 20.881 4.772 -29.519 1.00 41.31 O ATOM 0 H SER A 71 18.861 5.491 -30.268 1.00 33.13 H new ATOM 0 HA SER A 71 19.858 7.471 -28.326 1.00 5.41 H new ATOM 0 HB2 SER A 71 21.859 6.471 -30.149 1.00 32.22 H new ATOM 0 HB3 SER A 71 21.763 6.266 -28.411 1.00 32.22 H new ATOM 0 HG SER A 71 21.703 4.239 -29.538 1.00 41.31 H new ATOM 1121 N PRO A 72 20.831 9.150 -30.051 1.00 1.03 N ATOM 1122 CA PRO A 72 21.030 10.286 -30.955 1.00 41.32 C ATOM 1123 C PRO A 72 21.847 9.911 -32.187 1.00 75.30 C ATOM 1124 O PRO A 72 21.554 10.357 -33.296 1.00 33.41 O ATOM 1125 CB PRO A 72 21.794 11.295 -30.094 1.00 44.34 C ATOM 1126 CG PRO A 72 22.491 10.468 -29.070 1.00 44.11 C ATOM 1127 CD PRO A 72 21.586 9.300 -28.795 1.00 73.30 C ATOM 0 HA PRO A 72 20.086 10.666 -31.345 1.00 41.32 H new ATOM 0 HB2 PRO A 72 22.504 11.867 -30.691 1.00 44.34 H new ATOM 0 HB3 PRO A 72 21.117 12.012 -29.630 1.00 44.34 H new ATOM 0 HG2 PRO A 72 23.462 10.132 -29.435 1.00 44.11 H new ATOM 0 HG3 PRO A 72 22.673 11.043 -28.162 1.00 44.11 H new ATOM 0 HD2 PRO A 72 22.153 8.400 -28.557 1.00 73.30 H new ATOM 0 HD3 PRO A 72 20.926 9.494 -27.950 1.00 73.30 H new ATOM 1135 N GLU A 73 22.871 9.088 -31.984 1.00 72.13 N ATOM 1136 CA GLU A 73 23.729 8.653 -33.080 1.00 2.30 C ATOM 1137 C GLU A 73 22.906 8.021 -34.198 1.00 53.24 C ATOM 1138 O GLU A 73 22.826 8.557 -35.304 1.00 33.02 O ATOM 1139 CB GLU A 73 24.774 7.656 -32.574 1.00 75.24 C ATOM 1140 CG GLU A 73 26.062 8.309 -32.105 1.00 45.42 C ATOM 1141 CD GLU A 73 26.698 9.178 -33.173 1.00 45.02 C ATOM 1142 OE1 GLU A 73 26.710 8.758 -34.349 1.00 65.22 O ATOM 1143 OE2 GLU A 73 27.184 10.277 -32.833 1.00 61.04 O ATOM 0 H GLU A 73 23.126 8.709 -31.072 1.00 72.13 H new ATOM 0 HA GLU A 73 24.238 9.530 -33.479 1.00 2.30 H new ATOM 0 HB2 GLU A 73 24.347 7.082 -31.752 1.00 75.24 H new ATOM 0 HB3 GLU A 73 25.004 6.949 -33.371 1.00 75.24 H new ATOM 0 HG2 GLU A 73 25.857 8.916 -31.223 1.00 45.42 H new ATOM 0 HG3 GLU A 73 26.768 7.536 -31.803 1.00 45.42 H new ATOM 1150 N SER A 74 22.296 6.878 -33.902 1.00 54.05 N ATOM 1151 CA SER A 74 21.482 6.170 -34.883 1.00 74.34 C ATOM 1152 C SER A 74 20.023 6.609 -34.798 1.00 20.22 C ATOM 1153 O SER A 74 19.683 7.534 -34.060 1.00 5.25 O ATOM 1154 CB SER A 74 21.585 4.659 -34.667 1.00 73.42 C ATOM 1155 OG SER A 74 21.171 4.301 -33.360 1.00 3.12 O ATOM 0 H SER A 74 22.350 6.422 -32.991 1.00 54.05 H new ATOM 0 HA SER A 74 21.859 6.415 -35.876 1.00 74.34 H new ATOM 0 HB2 SER A 74 20.969 4.141 -35.402 1.00 73.42 H new ATOM 0 HB3 SER A 74 22.613 4.335 -34.828 1.00 73.42 H new ATOM 0 HG SER A 74 21.531 3.418 -33.133 1.00 3.12 H new ATOM 1161 N HIS A 75 19.164 5.938 -35.559 1.00 31.14 N ATOM 1162 CA HIS A 75 17.741 6.258 -35.569 1.00 72.42 C ATOM 1163 C HIS A 75 16.898 4.986 -35.583 1.00 64.43 C ATOM 1164 O HIS A 75 17.415 3.890 -35.808 1.00 13.43 O ATOM 1165 CB HIS A 75 17.400 7.122 -36.783 1.00 51.41 C ATOM 1166 CG HIS A 75 17.890 8.533 -36.670 1.00 43.12 C ATOM 1167 ND1 HIS A 75 18.477 9.212 -37.717 1.00 65.21 N ATOM 1168 CD2 HIS A 75 17.877 9.394 -35.626 1.00 54.20 C ATOM 1169 CE1 HIS A 75 18.805 10.429 -37.321 1.00 63.22 C ATOM 1170 NE2 HIS A 75 18.451 10.565 -36.056 1.00 51.01 N ATOM 0 H HIS A 75 19.428 5.170 -36.176 1.00 31.14 H new ATOM 0 HA HIS A 75 17.513 6.815 -34.660 1.00 72.42 H new ATOM 0 HB2 HIS A 75 17.830 6.667 -37.675 1.00 51.41 H new ATOM 0 HB3 HIS A 75 16.319 7.131 -36.920 1.00 51.41 H new ATOM 0 HD2 HIS A 75 17.488 9.197 -34.638 1.00 54.20 H new ATOM 0 HE1 HIS A 75 19.282 11.184 -37.928 1.00 63.22 H new ATOM 0 HE2 HIS A 75 18.583 11.404 -35.490 1.00 51.01 H new ATOM 1178 N ILE A 76 15.601 5.138 -35.342 1.00 11.44 N ATOM 1179 CA ILE A 76 14.688 4.002 -35.327 1.00 0.20 C ATOM 1180 C ILE A 76 13.411 4.313 -36.100 1.00 71.02 C ATOM 1181 O ILE A 76 12.406 4.722 -35.519 1.00 54.45 O ATOM 1182 CB ILE A 76 14.318 3.596 -33.888 1.00 73.03 C ATOM 1183 CG1 ILE A 76 15.579 3.260 -33.089 1.00 54.14 C ATOM 1184 CG2 ILE A 76 13.362 2.413 -33.901 1.00 74.35 C ATOM 1185 CD1 ILE A 76 15.358 3.238 -31.593 1.00 71.11 C ATOM 0 H ILE A 76 15.158 6.037 -35.154 1.00 11.44 H new ATOM 0 HA ILE A 76 15.208 3.173 -35.807 1.00 0.20 H new ATOM 0 HB ILE A 76 13.819 4.437 -33.406 1.00 73.03 H new ATOM 0 HG12 ILE A 76 15.953 2.287 -33.407 1.00 54.14 H new ATOM 0 HG13 ILE A 76 16.353 3.991 -33.323 1.00 54.14 H new ATOM 0 HG21 ILE A 76 13.110 2.138 -32.877 1.00 74.35 H new ATOM 0 HG22 ILE A 76 12.453 2.685 -34.438 1.00 74.35 H new ATOM 0 HG23 ILE A 76 13.837 1.567 -34.398 1.00 74.35 H new ATOM 0 HD11 ILE A 76 16.294 2.993 -31.091 1.00 71.11 H new ATOM 0 HD12 ILE A 76 15.014 4.218 -31.262 1.00 71.11 H new ATOM 0 HD13 ILE A 76 14.607 2.487 -31.347 1.00 71.11 H new ATOM 1197 N ASP A 77 13.458 4.114 -37.413 1.00 15.02 N ATOM 1198 CA ASP A 77 12.303 4.370 -38.266 1.00 42.14 C ATOM 1199 C ASP A 77 11.143 3.449 -37.902 1.00 50.11 C ATOM 1200 O ASP A 77 9.979 3.775 -38.138 1.00 3.34 O ATOM 1201 CB ASP A 77 12.678 4.182 -39.737 1.00 71.42 C ATOM 1202 CG ASP A 77 11.600 4.683 -40.678 1.00 41.21 C ATOM 1203 OD1 ASP A 77 10.701 3.890 -41.027 1.00 54.12 O ATOM 1204 OD2 ASP A 77 11.656 5.869 -41.065 1.00 14.24 O ATOM 0 H ASP A 77 14.283 3.777 -37.909 1.00 15.02 H new ATOM 0 HA ASP A 77 11.987 5.401 -38.108 1.00 42.14 H new ATOM 0 HB2 ASP A 77 13.609 4.710 -39.942 1.00 71.42 H new ATOM 0 HB3 ASP A 77 12.862 3.125 -39.930 1.00 71.42 H new ATOM 1209 N LYS A 78 11.468 2.296 -37.327 1.00 54.11 N ATOM 1210 CA LYS A 78 10.454 1.327 -36.929 1.00 73.45 C ATOM 1211 C LYS A 78 11.041 0.279 -35.989 1.00 4.40 C ATOM 1212 O LYS A 78 12.235 -0.017 -36.043 1.00 14.23 O ATOM 1213 CB LYS A 78 9.860 0.643 -38.164 1.00 2.44 C ATOM 1214 CG LYS A 78 10.903 0.209 -39.179 1.00 10.11 C ATOM 1215 CD LYS A 78 10.393 -0.925 -40.052 1.00 72.00 C ATOM 1216 CE LYS A 78 9.417 -0.422 -41.105 1.00 21.20 C ATOM 1217 NZ LYS A 78 8.035 -0.295 -40.565 1.00 2.32 N ATOM 0 H LYS A 78 12.426 2.010 -37.126 1.00 54.11 H new ATOM 0 HA LYS A 78 9.664 1.862 -36.401 1.00 73.45 H new ATOM 0 HB2 LYS A 78 9.289 -0.229 -37.846 1.00 2.44 H new ATOM 0 HB3 LYS A 78 9.159 1.325 -38.645 1.00 2.44 H new ATOM 0 HG2 LYS A 78 11.177 1.057 -39.806 1.00 10.11 H new ATOM 0 HG3 LYS A 78 11.807 -0.109 -38.660 1.00 10.11 H new ATOM 0 HD2 LYS A 78 11.235 -1.417 -40.540 1.00 72.00 H new ATOM 0 HD3 LYS A 78 9.904 -1.674 -39.429 1.00 72.00 H new ATOM 0 HE2 LYS A 78 9.752 0.546 -41.477 1.00 21.20 H new ATOM 0 HE3 LYS A 78 9.414 -1.106 -41.954 1.00 21.20 H new ATOM 0 HZ1 LYS A 78 7.349 -0.553 -41.303 1.00 2.32 H new ATOM 0 HZ2 LYS A 78 7.921 -0.930 -39.749 1.00 2.32 H new ATOM 0 HZ3 LYS A 78 7.868 0.687 -40.266 1.00 2.32 H new ATOM 1231 N ALA A 79 10.195 -0.279 -35.129 1.00 44.52 N ATOM 1232 CA ALA A 79 10.631 -1.295 -34.180 1.00 32.23 C ATOM 1233 C ALA A 79 9.494 -2.254 -33.842 1.00 11.31 C ATOM 1234 O ALA A 79 8.334 -1.992 -34.158 1.00 2.42 O ATOM 1235 CB ALA A 79 11.166 -0.641 -32.914 1.00 72.04 C ATOM 0 H ALA A 79 9.204 -0.044 -35.070 1.00 44.52 H new ATOM 0 HA ALA A 79 11.432 -1.871 -34.644 1.00 32.23 H new ATOM 0 HB1 ALA A 79 11.488 -1.412 -32.214 1.00 72.04 H new ATOM 0 HB2 ALA A 79 12.013 -0.002 -33.165 1.00 72.04 H new ATOM 0 HB3 ALA A 79 10.381 -0.040 -32.455 1.00 72.04 H new ATOM 1241 N ASN A 80 9.835 -3.366 -33.199 1.00 11.44 N ATOM 1242 CA ASN A 80 8.842 -4.364 -32.819 1.00 60.22 C ATOM 1243 C ASN A 80 9.478 -5.477 -31.992 1.00 4.01 C ATOM 1244 O ASN A 80 10.646 -5.817 -32.183 1.00 60.31 O ATOM 1245 CB ASN A 80 8.180 -4.955 -34.066 1.00 2.22 C ATOM 1246 CG ASN A 80 7.105 -5.968 -33.724 1.00 61.43 C ATOM 1247 OD1 ASN A 80 7.266 -7.165 -33.964 1.00 71.14 O ATOM 1248 ND2 ASN A 80 6.001 -5.492 -33.161 1.00 73.31 N ATOM 0 H ASN A 80 10.791 -3.599 -32.930 1.00 11.44 H new ATOM 0 HA ASN A 80 8.083 -3.872 -32.211 1.00 60.22 H new ATOM 0 HB2 ASN A 80 7.743 -4.151 -34.658 1.00 2.22 H new ATOM 0 HB3 ASN A 80 8.939 -5.431 -34.687 1.00 2.22 H new ATOM 0 HD21 ASN A 80 5.243 -6.126 -32.909 1.00 73.31 H new ATOM 0 HD22 ASN A 80 5.911 -4.492 -32.980 1.00 73.31 H new ATOM 1255 N PHE A 81 8.702 -6.041 -31.072 1.00 43.32 N ATOM 1256 CA PHE A 81 9.189 -7.115 -30.215 1.00 65.20 C ATOM 1257 C PHE A 81 9.075 -8.465 -30.917 1.00 63.21 C ATOM 1258 O PHE A 81 8.524 -8.563 -32.014 1.00 23.43 O ATOM 1259 CB PHE A 81 8.406 -7.143 -28.901 1.00 60.11 C ATOM 1260 CG PHE A 81 6.918 -7.225 -29.092 1.00 4.32 C ATOM 1261 CD1 PHE A 81 6.319 -8.417 -29.465 1.00 12.25 C ATOM 1262 CD2 PHE A 81 6.120 -6.109 -28.899 1.00 33.02 C ATOM 1263 CE1 PHE A 81 4.950 -8.496 -29.641 1.00 1.55 C ATOM 1264 CE2 PHE A 81 4.751 -6.182 -29.073 1.00 14.22 C ATOM 1265 CZ PHE A 81 4.165 -7.376 -29.445 1.00 62.14 C ATOM 0 H PHE A 81 7.733 -5.772 -30.901 1.00 43.32 H new ATOM 0 HA PHE A 81 10.240 -6.925 -29.999 1.00 65.20 H new ATOM 0 HB2 PHE A 81 8.736 -7.996 -28.309 1.00 60.11 H new ATOM 0 HB3 PHE A 81 8.642 -6.247 -28.327 1.00 60.11 H new ATOM 0 HD1 PHE A 81 6.929 -9.295 -29.620 1.00 12.25 H new ATOM 0 HD2 PHE A 81 6.573 -5.172 -28.610 1.00 33.02 H new ATOM 0 HE1 PHE A 81 4.495 -9.431 -29.931 1.00 1.55 H new ATOM 0 HE2 PHE A 81 4.139 -5.305 -28.918 1.00 14.22 H new ATOM 0 HZ PHE A 81 3.095 -7.434 -29.582 1.00 62.14 H new ATOM 1275 N LYS A 82 9.601 -9.504 -30.277 1.00 72.31 N ATOM 1276 CA LYS A 82 9.559 -10.850 -30.837 1.00 54.35 C ATOM 1277 C LYS A 82 8.658 -11.757 -30.006 1.00 73.41 C ATOM 1278 O LYS A 82 7.544 -12.083 -30.414 1.00 33.34 O ATOM 1279 CB LYS A 82 10.969 -11.439 -30.908 1.00 60.51 C ATOM 1280 CG LYS A 82 11.902 -10.676 -31.832 1.00 72.45 C ATOM 1281 CD LYS A 82 13.187 -11.446 -32.088 1.00 33.32 C ATOM 1282 CE LYS A 82 13.010 -12.473 -33.196 1.00 22.32 C ATOM 1283 NZ LYS A 82 14.313 -12.864 -33.803 1.00 12.32 N ATOM 0 H LYS A 82 10.062 -9.440 -29.369 1.00 72.31 H new ATOM 0 HA LYS A 82 9.148 -10.785 -31.845 1.00 54.35 H new ATOM 0 HB2 LYS A 82 11.397 -11.456 -29.906 1.00 60.51 H new ATOM 0 HB3 LYS A 82 10.905 -12.474 -31.244 1.00 60.51 H new ATOM 0 HG2 LYS A 82 11.399 -10.482 -32.779 1.00 72.45 H new ATOM 0 HG3 LYS A 82 12.139 -9.707 -31.392 1.00 72.45 H new ATOM 0 HD2 LYS A 82 13.981 -10.750 -32.359 1.00 33.32 H new ATOM 0 HD3 LYS A 82 13.501 -11.947 -31.172 1.00 33.32 H new ATOM 0 HE2 LYS A 82 12.516 -13.358 -32.795 1.00 22.32 H new ATOM 0 HE3 LYS A 82 12.357 -12.066 -33.968 1.00 22.32 H new ATOM 0 HZ1 LYS A 82 14.150 -13.565 -34.554 1.00 12.32 H new ATOM 0 HZ2 LYS A 82 14.773 -12.024 -34.208 1.00 12.32 H new ATOM 0 HZ3 LYS A 82 14.927 -13.276 -33.072 1.00 12.32 H new ATOM 1297 N ASN A 83 9.148 -12.161 -28.838 1.00 55.23 N ATOM 1298 CA ASN A 83 8.386 -13.030 -27.949 1.00 75.22 C ATOM 1299 C ASN A 83 8.911 -12.941 -26.520 1.00 20.34 C ATOM 1300 O ASN A 83 10.080 -13.225 -26.259 1.00 53.23 O ATOM 1301 CB ASN A 83 8.450 -14.478 -28.439 1.00 62.21 C ATOM 1302 CG ASN A 83 7.755 -15.440 -27.495 1.00 11.32 C ATOM 1303 OD1 ASN A 83 6.727 -15.111 -26.903 1.00 34.22 O ATOM 1304 ND2 ASN A 83 8.315 -16.635 -27.350 1.00 31.04 N ATOM 0 H ASN A 83 10.069 -11.900 -28.486 1.00 55.23 H new ATOM 0 HA ASN A 83 7.348 -12.696 -27.957 1.00 75.22 H new ATOM 0 HB2 ASN A 83 7.990 -14.545 -29.425 1.00 62.21 H new ATOM 0 HB3 ASN A 83 9.493 -14.774 -28.552 1.00 62.21 H new ATOM 0 HD21 ASN A 83 7.893 -17.324 -26.728 1.00 31.04 H new ATOM 0 HD22 ASN A 83 9.167 -16.864 -27.861 1.00 31.04 H new ATOM 1311 N GLU A 84 8.039 -12.546 -25.598 1.00 35.34 N ATOM 1312 CA GLU A 84 8.415 -12.420 -24.195 1.00 24.14 C ATOM 1313 C GLU A 84 8.185 -13.732 -23.449 1.00 51.43 C ATOM 1314 O GLU A 84 7.406 -14.579 -23.886 1.00 61.24 O ATOM 1315 CB GLU A 84 7.619 -11.296 -23.529 1.00 2.21 C ATOM 1316 CG GLU A 84 6.121 -11.546 -23.500 1.00 12.25 C ATOM 1317 CD GLU A 84 5.413 -10.990 -24.720 1.00 34.22 C ATOM 1318 OE1 GLU A 84 5.635 -9.806 -25.047 1.00 55.13 O ATOM 1319 OE2 GLU A 84 4.636 -11.741 -25.347 1.00 43.33 O ATOM 0 H GLU A 84 7.067 -12.308 -25.797 1.00 35.34 H new ATOM 0 HA GLU A 84 9.477 -12.179 -24.151 1.00 24.14 H new ATOM 0 HB2 GLU A 84 7.977 -11.165 -22.508 1.00 2.21 H new ATOM 0 HB3 GLU A 84 7.813 -10.363 -24.057 1.00 2.21 H new ATOM 0 HG2 GLU A 84 5.937 -12.618 -23.435 1.00 12.25 H new ATOM 0 HG3 GLU A 84 5.698 -11.095 -22.602 1.00 12.25 H new ATOM 1326 N LYS A 85 8.868 -13.892 -22.321 1.00 64.13 N ATOM 1327 CA LYS A 85 8.739 -15.099 -21.513 1.00 44.11 C ATOM 1328 C LYS A 85 8.666 -14.754 -20.029 1.00 22.41 C ATOM 1329 O LYS A 85 9.452 -13.950 -19.528 1.00 65.24 O ATOM 1330 CB LYS A 85 9.919 -16.039 -21.772 1.00 31.13 C ATOM 1331 CG LYS A 85 9.924 -17.269 -20.880 1.00 15.52 C ATOM 1332 CD LYS A 85 8.687 -18.124 -21.103 1.00 5.24 C ATOM 1333 CE LYS A 85 8.813 -19.475 -20.415 1.00 43.24 C ATOM 1334 NZ LYS A 85 7.880 -20.481 -20.994 1.00 41.44 N ATOM 0 H LYS A 85 9.517 -13.201 -21.945 1.00 64.13 H new ATOM 0 HA LYS A 85 7.814 -15.600 -21.798 1.00 44.11 H new ATOM 0 HB2 LYS A 85 9.898 -16.357 -22.814 1.00 31.13 H new ATOM 0 HB3 LYS A 85 10.849 -15.490 -21.625 1.00 31.13 H new ATOM 0 HG2 LYS A 85 10.817 -17.861 -21.080 1.00 15.52 H new ATOM 0 HG3 LYS A 85 9.972 -16.962 -19.835 1.00 15.52 H new ATOM 0 HD2 LYS A 85 7.809 -17.602 -20.724 1.00 5.24 H new ATOM 0 HD3 LYS A 85 8.533 -18.272 -22.172 1.00 5.24 H new ATOM 0 HE2 LYS A 85 9.838 -19.835 -20.506 1.00 43.24 H new ATOM 0 HE3 LYS A 85 8.609 -19.361 -19.350 1.00 43.24 H new ATOM 0 HZ1 LYS A 85 7.996 -21.388 -20.498 1.00 41.44 H new ATOM 0 HZ2 LYS A 85 6.900 -20.150 -20.884 1.00 41.44 H new ATOM 0 HZ3 LYS A 85 8.091 -20.609 -22.004 1.00 41.44 H new ATOM 1348 N VAL A 86 7.718 -15.369 -19.329 1.00 72.44 N ATOM 1349 CA VAL A 86 7.544 -15.130 -17.902 1.00 12.33 C ATOM 1350 C VAL A 86 8.478 -16.010 -17.079 1.00 11.11 C ATOM 1351 O VAL A 86 8.412 -17.237 -17.148 1.00 75.52 O ATOM 1352 CB VAL A 86 6.091 -15.390 -17.462 1.00 31.22 C ATOM 1353 CG1 VAL A 86 5.937 -15.164 -15.965 1.00 63.45 C ATOM 1354 CG2 VAL A 86 5.131 -14.506 -18.244 1.00 63.20 C ATOM 0 H VAL A 86 7.058 -16.037 -19.728 1.00 72.44 H new ATOM 0 HA VAL A 86 7.787 -14.082 -17.725 1.00 12.33 H new ATOM 0 HB VAL A 86 5.846 -16.431 -17.675 1.00 31.22 H new ATOM 0 HG11 VAL A 86 4.904 -15.352 -15.673 1.00 63.45 H new ATOM 0 HG12 VAL A 86 6.596 -15.843 -15.425 1.00 63.45 H new ATOM 0 HG13 VAL A 86 6.200 -14.134 -15.724 1.00 63.45 H new ATOM 0 HG21 VAL A 86 4.109 -14.703 -17.920 1.00 63.20 H new ATOM 0 HG22 VAL A 86 5.373 -13.458 -18.065 1.00 63.20 H new ATOM 0 HG23 VAL A 86 5.222 -14.722 -19.308 1.00 63.20 H new ATOM 1364 N ILE A 87 9.347 -15.375 -16.300 1.00 42.44 N ATOM 1365 CA ILE A 87 10.294 -16.100 -15.463 1.00 20.14 C ATOM 1366 C ILE A 87 10.339 -15.519 -14.053 1.00 73.24 C ATOM 1367 O ILE A 87 10.452 -14.306 -13.873 1.00 44.15 O ATOM 1368 CB ILE A 87 11.712 -16.073 -16.062 1.00 43.33 C ATOM 1369 CG1 ILE A 87 12.108 -14.640 -16.426 1.00 62.21 C ATOM 1370 CG2 ILE A 87 11.788 -16.976 -17.284 1.00 42.44 C ATOM 1371 CD1 ILE A 87 13.499 -14.528 -17.011 1.00 12.44 C ATOM 0 H ILE A 87 9.415 -14.360 -16.231 1.00 42.44 H new ATOM 0 HA ILE A 87 9.948 -17.132 -15.418 1.00 20.14 H new ATOM 0 HB ILE A 87 12.413 -16.445 -15.315 1.00 43.33 H new ATOM 0 HG12 ILE A 87 11.388 -14.243 -17.142 1.00 62.21 H new ATOM 0 HG13 ILE A 87 12.046 -14.017 -15.534 1.00 62.21 H new ATOM 0 HG21 ILE A 87 12.797 -16.946 -17.696 1.00 42.44 H new ATOM 0 HG22 ILE A 87 11.543 -17.999 -16.997 1.00 42.44 H new ATOM 0 HG23 ILE A 87 11.078 -16.631 -18.036 1.00 42.44 H new ATOM 0 HD11 ILE A 87 13.712 -13.485 -17.245 1.00 12.44 H new ATOM 0 HD12 ILE A 87 14.228 -14.894 -16.288 1.00 12.44 H new ATOM 0 HD13 ILE A 87 13.560 -15.124 -17.921 1.00 12.44 H new ATOM 1383 N LEU A 88 10.250 -16.393 -13.056 1.00 43.45 N ATOM 1384 CA LEU A 88 10.283 -15.967 -11.661 1.00 74.14 C ATOM 1385 C LEU A 88 11.492 -15.079 -11.391 1.00 45.50 C ATOM 1386 O LEU A 88 11.427 -14.150 -10.586 1.00 12.53 O ATOM 1387 CB LEU A 88 10.313 -17.185 -10.737 1.00 23.32 C ATOM 1388 CG LEU A 88 8.953 -17.754 -10.331 1.00 63.50 C ATOM 1389 CD1 LEU A 88 8.442 -18.721 -11.388 1.00 43.01 C ATOM 1390 CD2 LEU A 88 9.046 -18.442 -8.977 1.00 34.42 C ATOM 0 H LEU A 88 10.155 -17.400 -13.188 1.00 43.45 H new ATOM 0 HA LEU A 88 9.381 -15.389 -11.461 1.00 74.14 H new ATOM 0 HB2 LEU A 88 10.883 -17.974 -11.228 1.00 23.32 H new ATOM 0 HB3 LEU A 88 10.857 -16.916 -9.831 1.00 23.32 H new ATOM 0 HG LEU A 88 8.245 -16.929 -10.250 1.00 63.50 H new ATOM 0 HD11 LEU A 88 7.473 -19.116 -11.082 1.00 43.01 H new ATOM 0 HD12 LEU A 88 8.337 -18.198 -12.339 1.00 43.01 H new ATOM 0 HD13 LEU A 88 9.149 -19.543 -11.502 1.00 43.01 H new ATOM 0 HD21 LEU A 88 8.069 -18.841 -8.704 1.00 34.42 H new ATOM 0 HD22 LEU A 88 9.768 -19.256 -9.032 1.00 34.42 H new ATOM 0 HD23 LEU A 88 9.367 -17.722 -8.224 1.00 34.42 H new ATOM 1402 N LYS A 89 12.597 -15.368 -12.071 1.00 33.42 N ATOM 1403 CA LYS A 89 13.822 -14.594 -11.908 1.00 34.53 C ATOM 1404 C LYS A 89 14.483 -14.333 -13.257 1.00 5.32 C ATOM 1405 O LYS A 89 14.203 -15.018 -14.241 1.00 33.10 O ATOM 1406 CB LYS A 89 14.795 -15.330 -10.984 1.00 61.43 C ATOM 1407 CG LYS A 89 14.191 -15.714 -9.645 1.00 34.22 C ATOM 1408 CD LYS A 89 15.176 -16.494 -8.791 1.00 4.11 C ATOM 1409 CE LYS A 89 15.457 -17.869 -9.378 1.00 53.31 C ATOM 1410 NZ LYS A 89 16.123 -18.767 -8.395 1.00 2.54 N ATOM 0 H LYS A 89 12.669 -16.134 -12.741 1.00 33.42 H new ATOM 0 HA LYS A 89 13.561 -13.635 -11.460 1.00 34.53 H new ATOM 0 HB2 LYS A 89 15.148 -16.231 -11.486 1.00 61.43 H new ATOM 0 HB3 LYS A 89 15.667 -14.699 -10.812 1.00 61.43 H new ATOM 0 HG2 LYS A 89 13.881 -14.814 -9.114 1.00 34.22 H new ATOM 0 HG3 LYS A 89 13.295 -16.313 -9.808 1.00 34.22 H new ATOM 0 HD2 LYS A 89 16.108 -15.936 -8.707 1.00 4.11 H new ATOM 0 HD3 LYS A 89 14.778 -16.602 -7.782 1.00 4.11 H new ATOM 0 HE2 LYS A 89 14.521 -18.321 -9.707 1.00 53.31 H new ATOM 0 HE3 LYS A 89 16.088 -17.765 -10.260 1.00 53.31 H new ATOM 0 HZ1 LYS A 89 16.297 -19.694 -8.834 1.00 2.54 H new ATOM 0 HZ2 LYS A 89 17.028 -18.348 -8.100 1.00 2.54 H new ATOM 0 HZ3 LYS A 89 15.510 -18.887 -7.564 1.00 2.54 H new ATOM 1424 N LEU A 90 15.364 -13.339 -13.296 1.00 11.34 N ATOM 1425 CA LEU A 90 16.068 -12.987 -14.524 1.00 75.42 C ATOM 1426 C LEU A 90 17.252 -13.919 -14.759 1.00 71.50 C ATOM 1427 O LEU A 90 17.986 -14.254 -13.829 1.00 14.44 O ATOM 1428 CB LEU A 90 16.550 -11.537 -14.462 1.00 72.02 C ATOM 1429 CG LEU A 90 15.459 -10.471 -14.352 1.00 30.25 C ATOM 1430 CD1 LEU A 90 14.329 -10.761 -15.327 1.00 14.03 C ATOM 1431 CD2 LEU A 90 14.930 -10.395 -12.927 1.00 23.14 C ATOM 0 H LEU A 90 15.608 -12.762 -12.491 1.00 11.34 H new ATOM 0 HA LEU A 90 15.372 -13.096 -15.356 1.00 75.42 H new ATOM 0 HB2 LEU A 90 17.218 -11.434 -13.607 1.00 72.02 H new ATOM 0 HB3 LEU A 90 17.141 -11.333 -15.355 1.00 72.02 H new ATOM 0 HG LEU A 90 15.894 -9.505 -14.609 1.00 30.25 H new ATOM 0 HD11 LEU A 90 13.562 -9.992 -15.234 1.00 14.03 H new ATOM 0 HD12 LEU A 90 14.719 -10.764 -16.345 1.00 14.03 H new ATOM 0 HD13 LEU A 90 13.895 -11.735 -15.102 1.00 14.03 H new ATOM 0 HD21 LEU A 90 14.155 -9.631 -12.867 1.00 23.14 H new ATOM 0 HD22 LEU A 90 14.512 -11.360 -12.642 1.00 23.14 H new ATOM 0 HD23 LEU A 90 15.745 -10.139 -12.250 1.00 23.14 H new ATOM 1443 N ASP A 91 17.433 -14.334 -16.008 1.00 43.20 N ATOM 1444 CA ASP A 91 18.531 -15.225 -16.366 1.00 52.22 C ATOM 1445 C ASP A 91 19.876 -14.598 -16.016 1.00 5.54 C ATOM 1446 O ASP A 91 20.862 -15.301 -15.794 1.00 31.54 O ATOM 1447 CB ASP A 91 18.481 -15.555 -17.859 1.00 24.12 C ATOM 1448 CG ASP A 91 17.075 -15.852 -18.340 1.00 33.12 C ATOM 1449 OD1 ASP A 91 16.350 -16.588 -17.637 1.00 51.41 O ATOM 1450 OD2 ASP A 91 16.698 -15.348 -19.418 1.00 63.45 O ATOM 0 H ASP A 91 16.834 -14.068 -16.789 1.00 43.20 H new ATOM 0 HA ASP A 91 18.421 -16.146 -15.794 1.00 52.22 H new ATOM 0 HB2 ASP A 91 18.887 -14.718 -18.427 1.00 24.12 H new ATOM 0 HB3 ASP A 91 19.120 -16.415 -18.059 1.00 24.12 H new ATOM 1455 N TYR A 92 19.910 -13.270 -15.969 1.00 24.52 N ATOM 1456 CA TYR A 92 21.136 -12.548 -15.649 1.00 32.11 C ATOM 1457 C TYR A 92 21.077 -11.974 -14.237 1.00 20.24 C ATOM 1458 O TYR A 92 20.032 -12.002 -13.586 1.00 64.20 O ATOM 1459 CB TYR A 92 21.368 -11.423 -16.659 1.00 62.32 C ATOM 1460 CG TYR A 92 22.092 -11.872 -17.909 1.00 14.31 C ATOM 1461 CD1 TYR A 92 23.472 -12.031 -17.917 1.00 53.34 C ATOM 1462 CD2 TYR A 92 21.394 -12.137 -19.081 1.00 63.41 C ATOM 1463 CE1 TYR A 92 24.137 -12.439 -19.057 1.00 74.42 C ATOM 1464 CE2 TYR A 92 22.051 -12.548 -20.225 1.00 73.02 C ATOM 1465 CZ TYR A 92 23.422 -12.697 -20.208 1.00 71.04 C ATOM 1466 OH TYR A 92 24.080 -13.106 -21.345 1.00 44.35 O ATOM 0 H TYR A 92 19.103 -12.672 -16.148 1.00 24.52 H new ATOM 0 HA TYR A 92 21.967 -13.252 -15.701 1.00 32.11 H new ATOM 0 HB2 TYR A 92 20.406 -10.994 -16.940 1.00 62.32 H new ATOM 0 HB3 TYR A 92 21.943 -10.630 -16.181 1.00 62.32 H new ATOM 0 HD1 TYR A 92 24.034 -11.832 -17.017 1.00 53.34 H new ATOM 0 HD2 TYR A 92 20.321 -12.020 -19.098 1.00 63.41 H new ATOM 0 HE1 TYR A 92 25.211 -12.555 -19.047 1.00 74.42 H new ATOM 0 HE2 TYR A 92 21.494 -12.751 -21.128 1.00 73.02 H new ATOM 0 HH TYR A 92 23.431 -13.246 -22.066 1.00 44.35 H new ATOM 1476 N SER A 93 22.207 -11.453 -13.769 1.00 60.30 N ATOM 1477 CA SER A 93 22.287 -10.875 -12.433 1.00 33.02 C ATOM 1478 C SER A 93 22.348 -9.352 -12.503 1.00 32.23 C ATOM 1479 O SER A 93 22.018 -8.662 -11.538 1.00 42.31 O ATOM 1480 CB SER A 93 23.514 -11.413 -11.694 1.00 14.43 C ATOM 1481 OG SER A 93 23.302 -12.743 -11.255 1.00 62.40 O ATOM 0 H SER A 93 23.080 -11.419 -14.296 1.00 60.30 H new ATOM 0 HA SER A 93 21.389 -11.160 -11.886 1.00 33.02 H new ATOM 0 HB2 SER A 93 24.383 -11.378 -12.351 1.00 14.43 H new ATOM 0 HB3 SER A 93 23.736 -10.775 -10.838 1.00 14.43 H new ATOM 0 HG SER A 93 24.101 -13.064 -10.787 1.00 62.40 H new ATOM 1487 N ASP A 94 22.772 -8.836 -13.651 1.00 10.33 N ATOM 1488 CA ASP A 94 22.876 -7.395 -13.849 1.00 0.43 C ATOM 1489 C ASP A 94 23.190 -7.068 -15.305 1.00 51.53 C ATOM 1490 O ASP A 94 23.842 -7.846 -16.001 1.00 23.43 O ATOM 1491 CB ASP A 94 23.956 -6.810 -12.937 1.00 43.25 C ATOM 1492 CG ASP A 94 25.181 -7.698 -12.848 1.00 24.31 C ATOM 1493 OD1 ASP A 94 25.894 -7.830 -13.865 1.00 33.31 O ATOM 1494 OD2 ASP A 94 25.428 -8.262 -11.761 1.00 74.30 O ATOM 0 H ASP A 94 23.049 -9.394 -14.459 1.00 10.33 H new ATOM 0 HA ASP A 94 21.915 -6.948 -13.594 1.00 0.43 H new ATOM 0 HB2 ASP A 94 24.249 -5.828 -13.309 1.00 43.25 H new ATOM 0 HB3 ASP A 94 23.544 -6.663 -11.939 1.00 43.25 H new ATOM 1499 N PHE A 95 22.720 -5.911 -15.761 1.00 43.11 N ATOM 1500 CA PHE A 95 22.949 -5.481 -17.136 1.00 30.52 C ATOM 1501 C PHE A 95 24.432 -5.554 -17.489 1.00 13.03 C ATOM 1502 O PHE A 95 25.294 -5.357 -16.633 1.00 33.32 O ATOM 1503 CB PHE A 95 22.434 -4.055 -17.339 1.00 71.13 C ATOM 1504 CG PHE A 95 22.833 -3.111 -16.241 1.00 34.41 C ATOM 1505 CD1 PHE A 95 24.153 -2.719 -16.092 1.00 22.10 C ATOM 1506 CD2 PHE A 95 21.887 -2.616 -15.358 1.00 31.13 C ATOM 1507 CE1 PHE A 95 24.523 -1.852 -15.082 1.00 13.54 C ATOM 1508 CE2 PHE A 95 22.250 -1.748 -14.346 1.00 4.24 C ATOM 1509 CZ PHE A 95 23.570 -1.364 -14.208 1.00 60.31 C ATOM 0 H PHE A 95 22.178 -5.255 -15.199 1.00 43.11 H new ATOM 0 HA PHE A 95 22.403 -6.154 -17.797 1.00 30.52 H new ATOM 0 HB2 PHE A 95 22.809 -3.674 -18.289 1.00 71.13 H new ATOM 0 HB3 PHE A 95 21.347 -4.077 -17.411 1.00 71.13 H new ATOM 0 HD1 PHE A 95 24.902 -3.095 -16.773 1.00 22.10 H new ATOM 0 HD2 PHE A 95 20.854 -2.912 -15.462 1.00 31.13 H new ATOM 0 HE1 PHE A 95 25.556 -1.556 -14.975 1.00 13.54 H new ATOM 0 HE2 PHE A 95 21.503 -1.370 -13.664 1.00 4.24 H new ATOM 0 HZ PHE A 95 23.856 -0.684 -13.419 1.00 60.31 H new ATOM 1519 N GLN A 96 24.719 -5.838 -18.755 1.00 22.32 N ATOM 1520 CA GLN A 96 26.097 -5.938 -19.221 1.00 22.21 C ATOM 1521 C GLN A 96 26.188 -5.656 -20.717 1.00 33.50 C ATOM 1522 O GLN A 96 25.176 -5.647 -21.419 1.00 30.42 O ATOM 1523 CB GLN A 96 26.661 -7.327 -18.916 1.00 64.14 C ATOM 1524 CG GLN A 96 28.177 -7.355 -18.796 1.00 75.43 C ATOM 1525 CD GLN A 96 28.687 -8.630 -18.153 1.00 43.41 C ATOM 1526 OE1 GLN A 96 29.446 -9.385 -18.761 1.00 42.34 O ATOM 1527 NE2 GLN A 96 28.273 -8.876 -16.916 1.00 11.33 N ATOM 0 H GLN A 96 24.016 -6.003 -19.476 1.00 22.32 H new ATOM 0 HA GLN A 96 26.688 -5.190 -18.693 1.00 22.21 H new ATOM 0 HB2 GLN A 96 26.224 -7.691 -17.986 1.00 64.14 H new ATOM 0 HB3 GLN A 96 26.354 -8.016 -19.703 1.00 64.14 H new ATOM 0 HG2 GLN A 96 28.618 -7.251 -19.787 1.00 75.43 H new ATOM 0 HG3 GLN A 96 28.507 -6.499 -18.208 1.00 75.43 H new ATOM 0 HE21 GLN A 96 27.644 -8.223 -16.449 1.00 11.33 H new ATOM 0 HE22 GLN A 96 28.584 -9.718 -16.432 1.00 11.33 H new ATOM 1536 N ILE A 97 27.405 -5.427 -21.198 1.00 52.32 N ATOM 1537 CA ILE A 97 27.627 -5.145 -22.611 1.00 75.41 C ATOM 1538 C ILE A 97 28.450 -6.248 -23.268 1.00 52.14 C ATOM 1539 O ILE A 97 29.308 -6.860 -22.633 1.00 1.25 O ATOM 1540 CB ILE A 97 28.343 -3.797 -22.811 1.00 12.21 C ATOM 1541 CG1 ILE A 97 27.600 -2.685 -22.067 1.00 40.12 C ATOM 1542 CG2 ILE A 97 28.452 -3.469 -24.293 1.00 33.33 C ATOM 1543 CD1 ILE A 97 28.335 -1.363 -22.066 1.00 41.14 C ATOM 0 H ILE A 97 28.252 -5.431 -20.630 1.00 52.32 H new ATOM 0 HA ILE A 97 26.645 -5.098 -23.082 1.00 75.41 H new ATOM 0 HB ILE A 97 29.350 -3.873 -22.401 1.00 12.21 H new ATOM 0 HG12 ILE A 97 26.620 -2.546 -22.523 1.00 40.12 H new ATOM 0 HG13 ILE A 97 27.431 -2.998 -21.037 1.00 40.12 H new ATOM 0 HG21 ILE A 97 28.961 -2.513 -24.418 1.00 33.33 H new ATOM 0 HG22 ILE A 97 29.020 -4.251 -24.798 1.00 33.33 H new ATOM 0 HG23 ILE A 97 27.454 -3.408 -24.727 1.00 33.33 H new ATOM 0 HD11 ILE A 97 27.750 -0.622 -21.521 1.00 41.14 H new ATOM 0 HD12 ILE A 97 29.305 -1.486 -21.584 1.00 41.14 H new ATOM 0 HD13 ILE A 97 28.481 -1.027 -23.093 1.00 41.14 H new ATOM 1555 N VAL A 98 28.184 -6.495 -24.547 1.00 74.31 N ATOM 1556 CA VAL A 98 28.902 -7.522 -25.293 1.00 34.13 C ATOM 1557 C VAL A 98 29.808 -6.901 -26.350 1.00 31.13 C ATOM 1558 O VAL A 98 29.468 -5.885 -26.956 1.00 11.10 O ATOM 1559 CB VAL A 98 27.930 -8.502 -25.977 1.00 12.12 C ATOM 1560 CG1 VAL A 98 28.689 -9.674 -26.580 1.00 43.40 C ATOM 1561 CG2 VAL A 98 26.880 -8.988 -24.989 1.00 5.04 C ATOM 0 H VAL A 98 27.477 -5.998 -25.088 1.00 74.31 H new ATOM 0 HA VAL A 98 29.511 -8.069 -24.573 1.00 34.13 H new ATOM 0 HB VAL A 98 27.420 -7.976 -26.784 1.00 12.12 H new ATOM 0 HG11 VAL A 98 27.986 -10.355 -27.059 1.00 43.40 H new ATOM 0 HG12 VAL A 98 29.399 -9.305 -27.321 1.00 43.40 H new ATOM 0 HG13 VAL A 98 29.228 -10.202 -25.793 1.00 43.40 H new ATOM 0 HG21 VAL A 98 26.202 -9.679 -25.489 1.00 5.04 H new ATOM 0 HG22 VAL A 98 27.370 -9.497 -24.159 1.00 5.04 H new ATOM 0 HG23 VAL A 98 26.315 -8.136 -24.610 1.00 5.04 H new ATOM 1571 N LYS A 99 30.964 -7.519 -26.567 1.00 10.02 N ATOM 1572 CA LYS A 99 31.921 -7.029 -27.552 1.00 74.22 C ATOM 1573 C LYS A 99 31.719 -7.721 -28.897 1.00 11.23 C ATOM 1574 O LYS A 99 32.368 -8.724 -29.193 1.00 44.25 O ATOM 1575 CB LYS A 99 33.352 -7.255 -27.060 1.00 71.31 C ATOM 1576 CG LYS A 99 33.669 -6.535 -25.761 1.00 43.11 C ATOM 1577 CD LYS A 99 34.736 -7.266 -24.964 1.00 65.42 C ATOM 1578 CE LYS A 99 36.101 -7.158 -25.628 1.00 55.33 C ATOM 1579 NZ LYS A 99 37.204 -7.503 -24.690 1.00 34.44 N ATOM 0 H LYS A 99 31.261 -8.361 -26.074 1.00 10.02 H new ATOM 0 HA LYS A 99 31.754 -5.960 -27.684 1.00 74.22 H new ATOM 0 HB2 LYS A 99 33.515 -8.324 -26.922 1.00 71.31 H new ATOM 0 HB3 LYS A 99 34.049 -6.922 -27.829 1.00 71.31 H new ATOM 0 HG2 LYS A 99 34.007 -5.522 -25.979 1.00 43.11 H new ATOM 0 HG3 LYS A 99 32.763 -6.447 -25.162 1.00 43.11 H new ATOM 0 HD2 LYS A 99 34.787 -6.852 -23.957 1.00 65.42 H new ATOM 0 HD3 LYS A 99 34.461 -8.316 -24.864 1.00 65.42 H new ATOM 0 HE2 LYS A 99 36.138 -7.822 -26.492 1.00 55.33 H new ATOM 0 HE3 LYS A 99 36.245 -6.143 -26.000 1.00 55.33 H new ATOM 0 HZ1 LYS A 99 38.117 -7.417 -25.181 1.00 34.44 H new ATOM 0 HZ2 LYS A 99 37.185 -6.854 -23.878 1.00 34.44 H new ATOM 0 HZ3 LYS A 99 37.082 -8.480 -24.355 1.00 34.44 H new