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 43 THR OG1 : rot -79:sc= 1.25 USER MOD Set 1.2: A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 ASN : amide:sc= 0 X(o=0,f=-0.27) USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 22:sc= 0.359 USER MOD Single : A 12 TYR OH : rot 80:sc= -1.62! USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 GLN : amide:sc= -0.324 K(o=-0.32,f=-1.7!) USER MOD Single : A 25 LYS NZ :NH3+ 144:sc= -0.0813 (180deg=-1.23) USER MOD Single : A 26 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 27 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 GLN : amide:sc= -3.97! C(o=-4!,f=-6.3!) 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= -0.742 K(o=-0.74,f=-4.2!) USER MOD Single : A 42 ASN : amide:sc= -0.176 X(o=-0.18,f=-0.16) USER MOD Single : A 49 GLN : amide:sc= -1.21 K(o=-1.2,f=-2.1) USER MOD Single : A 51 LYS NZ :NH3+ -169:sc= 0.173 (180deg=0.149) USER MOD Single : A 53 GLN : amide:sc= -5.83! C(o=-5.8!,f=-14!) 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 -153:sc= -0.686 (180deg=-2.49!) USER MOD Single : A 63 GLN : amide:sc= -0.445 X(o=-0.44,f=-0.62) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 THR OG1 : rot -48:sc= 0.533 USER MOD Single : A 71 SER OG : rot 180:sc= -0.274 USER MOD Single : A 74 SER OG : rot 180:sc= 0.0493 USER MOD Single : A 75 HIS : no HD1:sc= -0.0181 X(o=-0.018,f=-0.15) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 ASN : amide:sc= 0 X(o=0,f=-0.057) USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 ASN : amide:sc=-0.00255 X(o=-0.0026,f=0) 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 X(o=0,f=0) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 40 N ASN A 5 4.083 -6.994 -11.020 1.00 12.51 N ATOM 41 CA ASN A 5 5.501 -7.327 -11.091 1.00 51.23 C ATOM 42 C ASN A 5 5.713 -8.647 -11.826 1.00 2.10 C ATOM 43 O ASN A 5 6.268 -9.597 -11.272 1.00 40.23 O ATOM 44 CB ASN A 5 6.098 -7.411 -9.685 1.00 34.21 C ATOM 45 CG ASN A 5 6.520 -6.055 -9.154 1.00 22.02 C ATOM 46 OD1 ASN A 5 5.966 -5.025 -9.539 1.00 23.23 O ATOM 47 ND2 ASN A 5 7.507 -6.049 -8.265 1.00 33.12 N ATOM 0 HA ASN A 5 6.007 -6.537 -11.646 1.00 51.23 H new ATOM 0 HB2 ASN A 5 5.366 -7.851 -9.008 1.00 34.21 H new ATOM 0 HB3 ASN A 5 6.961 -8.077 -9.699 1.00 34.21 H new ATOM 0 HD21 ASN A 5 7.835 -5.166 -7.873 1.00 33.12 H new ATOM 0 HD22 ASN A 5 7.937 -6.927 -7.975 1.00 33.12 H new ATOM 54 N THR A 6 5.268 -8.700 -13.078 1.00 1.34 N ATOM 55 CA THR A 6 5.408 -9.902 -13.889 1.00 23.43 C ATOM 56 C THR A 6 6.798 -9.988 -14.510 1.00 11.05 C ATOM 57 O THR A 6 6.999 -9.605 -15.663 1.00 15.11 O ATOM 58 CB THR A 6 4.354 -9.950 -15.010 1.00 54.22 C ATOM 59 OG1 THR A 6 3.040 -9.837 -14.452 1.00 73.31 O ATOM 60 CG2 THR A 6 4.464 -11.244 -15.803 1.00 3.52 C ATOM 0 H THR A 6 4.807 -7.923 -13.552 1.00 1.34 H new ATOM 0 HA THR A 6 5.257 -10.751 -13.223 1.00 23.43 H new ATOM 0 HB THR A 6 4.536 -9.113 -15.684 1.00 54.22 H new ATOM 0 HG1 THR A 6 2.375 -9.867 -15.172 1.00 73.31 H new ATOM 0 HG21 THR A 6 3.709 -11.254 -16.589 1.00 3.52 H new ATOM 0 HG22 THR A 6 5.455 -11.313 -16.251 1.00 3.52 H new ATOM 0 HG23 THR A 6 4.307 -12.093 -15.138 1.00 3.52 H new ATOM 68 N LEU A 7 7.755 -10.493 -13.739 1.00 31.01 N ATOM 69 CA LEU A 7 9.127 -10.630 -14.214 1.00 43.11 C ATOM 70 C LEU A 7 9.176 -11.424 -15.516 1.00 4.24 C ATOM 71 O LEU A 7 8.791 -12.593 -15.556 1.00 10.41 O ATOM 72 CB LEU A 7 9.989 -11.315 -13.153 1.00 24.35 C ATOM 73 CG LEU A 7 10.119 -10.582 -11.817 1.00 33.11 C ATOM 74 CD1 LEU A 7 11.022 -11.355 -10.869 1.00 25.00 C ATOM 75 CD2 LEU A 7 10.649 -9.172 -12.032 1.00 23.13 C ATOM 0 H LEU A 7 7.606 -10.814 -12.782 1.00 31.01 H new ATOM 0 HA LEU A 7 9.521 -9.632 -14.404 1.00 43.11 H new ATOM 0 HB2 LEU A 7 9.576 -12.306 -12.962 1.00 24.35 H new ATOM 0 HB3 LEU A 7 10.988 -11.460 -13.564 1.00 24.35 H new ATOM 0 HG LEU A 7 9.130 -10.512 -11.365 1.00 33.11 H new ATOM 0 HD11 LEU A 7 11.102 -10.818 -9.924 1.00 25.00 H new ATOM 0 HD12 LEU A 7 10.600 -12.344 -10.690 1.00 25.00 H new ATOM 0 HD13 LEU A 7 12.012 -11.458 -11.313 1.00 25.00 H new ATOM 0 HD21 LEU A 7 10.735 -8.665 -11.071 1.00 23.13 H new ATOM 0 HD22 LEU A 7 11.629 -9.220 -12.506 1.00 23.13 H new ATOM 0 HD23 LEU A 7 9.963 -8.619 -12.673 1.00 23.13 H new ATOM 87 N ILE A 8 9.654 -10.782 -16.576 1.00 63.03 N ATOM 88 CA ILE A 8 9.757 -11.430 -17.878 1.00 51.51 C ATOM 89 C ILE A 8 11.044 -11.030 -18.591 1.00 25.21 C ATOM 90 O ILE A 8 11.694 -10.053 -18.219 1.00 43.14 O ATOM 91 CB ILE A 8 8.556 -11.080 -18.777 1.00 42.20 C ATOM 92 CG1 ILE A 8 8.453 -9.564 -18.960 1.00 72.32 C ATOM 93 CG2 ILE A 8 7.271 -11.636 -18.184 1.00 35.05 C ATOM 94 CD1 ILE A 8 7.976 -9.153 -20.336 1.00 34.15 C ATOM 0 H ILE A 8 9.976 -9.814 -16.559 1.00 63.03 H new ATOM 0 HA ILE A 8 9.764 -12.505 -17.696 1.00 51.51 H new ATOM 0 HB ILE A 8 8.708 -11.536 -19.755 1.00 42.20 H new ATOM 0 HG12 ILE A 8 7.770 -9.161 -18.212 1.00 72.32 H new ATOM 0 HG13 ILE A 8 9.429 -9.116 -18.774 1.00 72.32 H new ATOM 0 HG21 ILE A 8 6.432 -11.380 -18.831 1.00 35.05 H new ATOM 0 HG22 ILE A 8 7.348 -12.720 -18.101 1.00 35.05 H new ATOM 0 HG23 ILE A 8 7.111 -11.207 -17.195 1.00 35.05 H new ATOM 0 HD11 ILE A 8 7.927 -8.066 -20.394 1.00 34.15 H new ATOM 0 HD12 ILE A 8 8.671 -9.526 -21.088 1.00 34.15 H new ATOM 0 HD13 ILE A 8 6.986 -9.571 -20.518 1.00 34.15 H new ATOM 106 N SER A 9 11.407 -11.792 -19.618 1.00 74.20 N ATOM 107 CA SER A 9 12.618 -11.519 -20.383 1.00 30.34 C ATOM 108 C SER A 9 12.309 -11.424 -21.874 1.00 24.23 C ATOM 109 O SER A 9 12.235 -12.437 -22.570 1.00 3.21 O ATOM 110 CB SER A 9 13.660 -12.612 -20.134 1.00 50.44 C ATOM 111 OG SER A 9 13.040 -13.865 -19.904 1.00 40.11 O ATOM 0 H SER A 9 10.879 -12.604 -19.939 1.00 74.20 H new ATOM 0 HA SER A 9 13.020 -10.561 -20.052 1.00 30.34 H new ATOM 0 HB2 SER A 9 14.327 -12.685 -20.993 1.00 50.44 H new ATOM 0 HB3 SER A 9 14.275 -12.344 -19.275 1.00 50.44 H new ATOM 0 HG SER A 9 12.134 -13.855 -20.278 1.00 40.11 H new ATOM 117 N VAL A 10 12.130 -10.199 -22.358 1.00 21.24 N ATOM 118 CA VAL A 10 11.830 -9.970 -23.766 1.00 5.21 C ATOM 119 C VAL A 10 13.096 -9.644 -24.551 1.00 0.41 C ATOM 120 O VAL A 10 13.918 -8.836 -24.116 1.00 74.24 O ATOM 121 CB VAL A 10 10.819 -8.822 -23.945 1.00 35.52 C ATOM 122 CG1 VAL A 10 11.421 -7.503 -23.486 1.00 55.03 C ATOM 123 CG2 VAL A 10 10.363 -8.735 -25.394 1.00 22.43 C ATOM 0 H VAL A 10 12.188 -9.350 -21.796 1.00 21.24 H new ATOM 0 HA VAL A 10 11.394 -10.892 -24.151 1.00 5.21 H new ATOM 0 HB VAL A 10 9.946 -9.030 -23.326 1.00 35.52 H new ATOM 0 HG11 VAL A 10 10.692 -6.704 -23.620 1.00 55.03 H new ATOM 0 HG12 VAL A 10 11.692 -7.574 -22.433 1.00 55.03 H new ATOM 0 HG13 VAL A 10 12.311 -7.285 -24.076 1.00 55.03 H new ATOM 0 HG21 VAL A 10 9.649 -7.919 -25.502 1.00 22.43 H new ATOM 0 HG22 VAL A 10 11.224 -8.551 -26.036 1.00 22.43 H new ATOM 0 HG23 VAL A 10 9.888 -9.673 -25.683 1.00 22.43 H new ATOM 133 N ASP A 11 13.246 -10.276 -25.709 1.00 64.23 N ATOM 134 CA ASP A 11 14.412 -10.052 -26.557 1.00 74.41 C ATOM 135 C ASP A 11 13.992 -9.793 -28.001 1.00 33.53 C ATOM 136 O ASP A 11 13.239 -10.571 -28.588 1.00 21.11 O ATOM 137 CB ASP A 11 15.353 -11.256 -26.495 1.00 20.22 C ATOM 138 CG ASP A 11 16.592 -11.067 -27.348 1.00 72.22 C ATOM 139 OD1 ASP A 11 17.091 -9.925 -27.425 1.00 2.11 O ATOM 140 OD2 ASP A 11 17.062 -12.062 -27.939 1.00 3.34 O ATOM 0 H ASP A 11 12.575 -10.948 -26.083 1.00 64.23 H new ATOM 0 HA ASP A 11 14.936 -9.171 -26.186 1.00 74.41 H new ATOM 0 HB2 ASP A 11 15.650 -11.428 -25.461 1.00 20.22 H new ATOM 0 HB3 ASP A 11 14.820 -12.147 -26.826 1.00 20.22 H new ATOM 145 N TYR A 12 14.482 -8.696 -28.566 1.00 61.11 N ATOM 146 CA TYR A 12 14.155 -8.333 -29.940 1.00 10.43 C ATOM 147 C TYR A 12 15.345 -7.669 -30.626 1.00 1.22 C ATOM 148 O TYR A 12 16.373 -7.413 -29.999 1.00 34.10 O ATOM 149 CB TYR A 12 12.948 -7.394 -29.967 1.00 55.13 C ATOM 150 CG TYR A 12 13.040 -6.258 -28.973 1.00 65.43 C ATOM 151 CD1 TYR A 12 14.030 -5.289 -29.087 1.00 32.34 C ATOM 152 CD2 TYR A 12 12.140 -6.155 -27.920 1.00 70.13 C ATOM 153 CE1 TYR A 12 14.119 -4.250 -28.180 1.00 61.35 C ATOM 154 CE2 TYR A 12 12.221 -5.119 -27.010 1.00 52.14 C ATOM 155 CZ TYR A 12 13.212 -4.169 -27.144 1.00 61.25 C ATOM 156 OH TYR A 12 13.297 -3.136 -26.239 1.00 71.23 O ATOM 0 H TYR A 12 15.107 -8.042 -28.094 1.00 61.11 H new ATOM 0 HA TYR A 12 13.910 -9.246 -30.482 1.00 10.43 H new ATOM 0 HB2 TYR A 12 12.843 -6.980 -30.970 1.00 55.13 H new ATOM 0 HB3 TYR A 12 12.046 -7.971 -29.764 1.00 55.13 H new ATOM 0 HD1 TYR A 12 14.741 -5.349 -29.898 1.00 32.34 H new ATOM 0 HD2 TYR A 12 11.364 -6.898 -27.811 1.00 70.13 H new ATOM 0 HE1 TYR A 12 14.895 -3.505 -28.282 1.00 61.35 H new ATOM 0 HE2 TYR A 12 11.512 -5.053 -26.198 1.00 52.14 H new ATOM 0 HH TYR A 12 12.894 -2.330 -26.624 1.00 71.23 H new ATOM 166 N GLU A 13 15.197 -7.392 -31.918 1.00 35.44 N ATOM 167 CA GLU A 13 16.259 -6.759 -32.690 1.00 11.55 C ATOM 168 C GLU A 13 15.750 -5.497 -33.381 1.00 5.54 C ATOM 169 O GLU A 13 15.297 -5.543 -34.525 1.00 10.45 O ATOM 170 CB GLU A 13 16.816 -7.733 -33.729 1.00 74.41 C ATOM 171 CG GLU A 13 15.741 -8.486 -34.495 1.00 34.00 C ATOM 172 CD GLU A 13 15.264 -9.726 -33.764 1.00 71.45 C ATOM 173 OE1 GLU A 13 16.039 -10.267 -32.948 1.00 35.43 O ATOM 174 OE2 GLU A 13 14.117 -10.156 -34.009 1.00 64.03 O ATOM 0 H GLU A 13 14.352 -7.596 -32.451 1.00 35.44 H new ATOM 0 HA GLU A 13 17.057 -6.480 -32.001 1.00 11.55 H new ATOM 0 HB2 GLU A 13 17.436 -7.182 -34.436 1.00 74.41 H new ATOM 0 HB3 GLU A 13 17.465 -8.452 -33.229 1.00 74.41 H new ATOM 0 HG2 GLU A 13 14.893 -7.823 -34.670 1.00 34.00 H new ATOM 0 HG3 GLU A 13 16.129 -8.772 -35.472 1.00 34.00 H new ATOM 181 N ILE A 14 15.829 -4.372 -32.678 1.00 2.33 N ATOM 182 CA ILE A 14 15.378 -3.098 -33.223 1.00 51.41 C ATOM 183 C ILE A 14 16.004 -2.831 -34.588 1.00 74.31 C ATOM 184 O ILE A 14 17.157 -3.184 -34.834 1.00 23.04 O ATOM 185 CB ILE A 14 15.717 -1.929 -32.279 1.00 21.22 C ATOM 186 CG1 ILE A 14 15.072 -2.148 -30.909 1.00 20.42 C ATOM 187 CG2 ILE A 14 15.257 -0.610 -32.882 1.00 24.22 C ATOM 188 CD1 ILE A 14 13.575 -2.359 -30.972 1.00 44.13 C ATOM 0 H ILE A 14 16.201 -4.317 -31.730 1.00 2.33 H new ATOM 0 HA ILE A 14 14.295 -3.167 -33.329 1.00 51.41 H new ATOM 0 HB ILE A 14 16.798 -1.889 -32.149 1.00 21.22 H new ATOM 0 HG12 ILE A 14 15.533 -3.014 -30.434 1.00 20.42 H new ATOM 0 HG13 ILE A 14 15.283 -1.287 -30.275 1.00 20.42 H new ATOM 0 HG21 ILE A 14 15.504 0.206 -32.203 1.00 24.22 H new ATOM 0 HG22 ILE A 14 15.759 -0.452 -33.837 1.00 24.22 H new ATOM 0 HG23 ILE A 14 14.179 -0.638 -33.039 1.00 24.22 H new ATOM 0 HD11 ILE A 14 13.186 -2.508 -29.965 1.00 44.13 H new ATOM 0 HD12 ILE A 14 13.103 -1.484 -31.418 1.00 44.13 H new ATOM 0 HD13 ILE A 14 13.357 -3.238 -31.579 1.00 44.13 H new ATOM 200 N PHE A 15 15.235 -2.205 -35.473 1.00 61.01 N ATOM 201 CA PHE A 15 15.714 -1.890 -36.814 1.00 20.01 C ATOM 202 C PHE A 15 16.287 -0.477 -36.869 1.00 25.03 C ATOM 203 O PHE A 15 16.461 0.175 -35.840 1.00 31.33 O ATOM 204 CB PHE A 15 14.579 -2.032 -37.830 1.00 40.42 C ATOM 205 CG PHE A 15 13.719 -3.242 -37.603 1.00 53.32 C ATOM 206 CD1 PHE A 15 14.286 -4.455 -37.250 1.00 22.25 C ATOM 207 CD2 PHE A 15 12.342 -3.166 -37.744 1.00 44.22 C ATOM 208 CE1 PHE A 15 13.497 -5.571 -37.040 1.00 3.45 C ATOM 209 CE2 PHE A 15 11.548 -4.278 -37.535 1.00 45.41 C ATOM 210 CZ PHE A 15 12.127 -5.482 -37.184 1.00 13.34 C ATOM 0 H PHE A 15 14.278 -1.906 -35.286 1.00 61.01 H new ATOM 0 HA PHE A 15 16.507 -2.595 -37.064 1.00 20.01 H new ATOM 0 HB2 PHE A 15 13.954 -1.140 -37.792 1.00 40.42 H new ATOM 0 HB3 PHE A 15 15.004 -2.081 -38.833 1.00 40.42 H new ATOM 0 HD1 PHE A 15 15.357 -4.530 -37.137 1.00 22.25 H new ATOM 0 HD2 PHE A 15 11.885 -2.227 -38.020 1.00 44.22 H new ATOM 0 HE1 PHE A 15 13.952 -6.511 -36.764 1.00 3.45 H new ATOM 0 HE2 PHE A 15 10.476 -4.206 -37.646 1.00 45.41 H new ATOM 0 HZ PHE A 15 11.509 -6.353 -37.022 1.00 13.34 H new ATOM 220 N GLY A 16 16.581 -0.010 -38.079 1.00 14.04 N ATOM 221 CA GLY A 16 17.132 1.322 -38.246 1.00 60.12 C ATOM 222 C GLY A 16 18.592 1.298 -38.652 1.00 63.03 C ATOM 223 O GLY A 16 19.208 0.234 -38.721 1.00 5.34 O ATOM 0 H GLY A 16 16.447 -0.530 -38.946 1.00 14.04 H new ATOM 0 HA2 GLY A 16 16.557 1.858 -39.001 1.00 60.12 H new ATOM 0 HA3 GLY A 16 17.027 1.875 -37.313 1.00 60.12 H new ATOM 227 N LYS A 17 19.148 2.474 -38.925 1.00 23.44 N ATOM 228 CA LYS A 17 20.545 2.585 -39.327 1.00 23.11 C ATOM 229 C LYS A 17 21.470 2.468 -38.119 1.00 42.45 C ATOM 230 O LYS A 17 22.169 3.418 -37.767 1.00 4.15 O ATOM 231 CB LYS A 17 20.787 3.917 -40.041 1.00 62.42 C ATOM 232 CG LYS A 17 20.345 5.127 -39.237 1.00 42.13 C ATOM 233 CD LYS A 17 21.157 6.361 -39.595 1.00 74.15 C ATOM 234 CE LYS A 17 22.566 6.285 -39.029 1.00 11.15 C ATOM 235 NZ LYS A 17 23.541 7.039 -39.864 1.00 1.32 N ATOM 0 H LYS A 17 18.652 3.364 -38.875 1.00 23.44 H new ATOM 0 HA LYS A 17 20.766 1.767 -40.012 1.00 23.11 H new ATOM 0 HB2 LYS A 17 21.849 4.010 -40.268 1.00 62.42 H new ATOM 0 HB3 LYS A 17 20.257 3.911 -40.993 1.00 62.42 H new ATOM 0 HG2 LYS A 17 19.288 5.320 -39.420 1.00 42.13 H new ATOM 0 HG3 LYS A 17 20.451 4.917 -38.173 1.00 42.13 H new ATOM 0 HD2 LYS A 17 21.204 6.465 -40.679 1.00 74.15 H new ATOM 0 HD3 LYS A 17 20.657 7.250 -39.211 1.00 74.15 H new ATOM 0 HE2 LYS A 17 22.572 6.684 -38.015 1.00 11.15 H new ATOM 0 HE3 LYS A 17 22.875 5.242 -38.963 1.00 11.15 H new ATOM 0 HZ1 LYS A 17 24.490 6.963 -39.444 1.00 1.32 H new ATOM 0 HZ2 LYS A 17 23.555 6.642 -40.825 1.00 1.32 H new ATOM 0 HZ3 LYS A 17 23.261 8.040 -39.906 1.00 1.32 H new ATOM 249 N VAL A 18 21.470 1.297 -37.490 1.00 50.44 N ATOM 250 CA VAL A 18 22.311 1.056 -36.324 1.00 60.01 C ATOM 251 C VAL A 18 23.515 0.193 -36.684 1.00 60.20 C ATOM 252 O VAL A 18 24.109 -0.451 -35.820 1.00 5.22 O ATOM 253 CB VAL A 18 21.520 0.370 -35.194 1.00 65.44 C ATOM 254 CG1 VAL A 18 20.335 1.226 -34.776 1.00 30.34 C ATOM 255 CG2 VAL A 18 21.062 -1.014 -35.630 1.00 40.00 C ATOM 0 H VAL A 18 20.897 0.501 -37.769 1.00 50.44 H new ATOM 0 HA VAL A 18 22.657 2.029 -35.976 1.00 60.01 H new ATOM 0 HB VAL A 18 22.176 0.256 -34.331 1.00 65.44 H new ATOM 0 HG11 VAL A 18 19.788 0.725 -33.977 1.00 30.34 H new ATOM 0 HG12 VAL A 18 20.692 2.193 -34.421 1.00 30.34 H new ATOM 0 HG13 VAL A 18 19.674 1.374 -35.630 1.00 30.34 H new ATOM 0 HG21 VAL A 18 20.505 -1.485 -34.820 1.00 40.00 H new ATOM 0 HG22 VAL A 18 20.422 -0.926 -36.508 1.00 40.00 H new ATOM 0 HG23 VAL A 18 21.931 -1.624 -35.875 1.00 40.00 H new ATOM 265 N GLN A 19 23.869 0.185 -37.965 1.00 52.01 N ATOM 266 CA GLN A 19 25.003 -0.600 -38.439 1.00 54.32 C ATOM 267 C GLN A 19 26.322 0.061 -38.052 1.00 73.32 C ATOM 268 O GLN A 19 27.180 -0.563 -37.430 1.00 5.32 O ATOM 269 CB GLN A 19 24.931 -0.772 -39.957 1.00 62.35 C ATOM 270 CG GLN A 19 23.669 -1.475 -40.431 1.00 42.12 C ATOM 271 CD GLN A 19 23.235 -1.027 -41.813 1.00 3.41 C ATOM 272 OE1 GLN A 19 23.931 -0.255 -42.475 1.00 34.42 O ATOM 273 NE2 GLN A 19 22.080 -1.509 -42.256 1.00 43.25 N ATOM 0 H GLN A 19 23.387 0.713 -38.693 1.00 52.01 H new ATOM 0 HA GLN A 19 24.957 -1.581 -37.966 1.00 54.32 H new ATOM 0 HB2 GLN A 19 24.989 0.209 -40.429 1.00 62.35 H new ATOM 0 HB3 GLN A 19 25.800 -1.339 -40.292 1.00 62.35 H new ATOM 0 HG2 GLN A 19 23.839 -2.552 -40.439 1.00 42.12 H new ATOM 0 HG3 GLN A 19 22.863 -1.284 -39.722 1.00 42.12 H new ATOM 0 HE21 GLN A 19 21.536 -2.146 -41.674 1.00 43.25 H new ATOM 0 HE22 GLN A 19 21.736 -1.242 -43.179 1.00 43.25 H new ATOM 282 N GLY A 20 26.476 1.328 -38.426 1.00 32.54 N ATOM 283 CA GLY A 20 27.693 2.051 -38.109 1.00 43.32 C ATOM 284 C GLY A 20 27.592 2.814 -36.803 1.00 55.03 C ATOM 285 O GLY A 20 28.337 3.766 -36.572 1.00 24.21 O ATOM 0 H GLY A 20 25.780 1.866 -38.942 1.00 32.54 H new ATOM 0 HA2 GLY A 20 28.525 1.349 -38.052 1.00 43.32 H new ATOM 0 HA3 GLY A 20 27.919 2.748 -38.916 1.00 43.32 H new ATOM 289 N VAL A 21 26.664 2.397 -35.947 1.00 3.12 N ATOM 290 CA VAL A 21 26.467 3.048 -34.657 1.00 72.12 C ATOM 291 C VAL A 21 26.685 2.069 -33.509 1.00 0.43 C ATOM 292 O VAL A 21 25.754 1.394 -33.069 1.00 2.23 O ATOM 293 CB VAL A 21 25.054 3.650 -34.543 1.00 33.22 C ATOM 294 CG1 VAL A 21 24.906 4.422 -33.241 1.00 32.04 C ATOM 295 CG2 VAL A 21 24.757 4.543 -35.738 1.00 70.42 C ATOM 0 H VAL A 21 26.037 1.612 -36.124 1.00 3.12 H new ATOM 0 HA VAL A 21 27.202 3.850 -34.591 1.00 72.12 H new ATOM 0 HB VAL A 21 24.330 2.835 -34.539 1.00 33.22 H new ATOM 0 HG11 VAL A 21 23.901 4.840 -33.178 1.00 32.04 H new ATOM 0 HG12 VAL A 21 25.073 3.750 -32.399 1.00 32.04 H new ATOM 0 HG13 VAL A 21 25.638 5.230 -33.212 1.00 32.04 H new ATOM 0 HG21 VAL A 21 23.755 4.960 -35.641 1.00 70.42 H new ATOM 0 HG22 VAL A 21 25.485 5.354 -35.776 1.00 70.42 H new ATOM 0 HG23 VAL A 21 24.819 3.957 -36.655 1.00 70.42 H new ATOM 305 N PHE A 22 27.921 1.998 -33.026 1.00 63.03 N ATOM 306 CA PHE A 22 28.263 1.101 -31.928 1.00 52.32 C ATOM 307 C PHE A 22 28.163 1.822 -30.587 1.00 24.43 C ATOM 308 O PHE A 22 29.027 1.670 -29.723 1.00 3.44 O ATOM 309 CB PHE A 22 29.675 0.544 -32.117 1.00 42.02 C ATOM 310 CG PHE A 22 29.914 -0.034 -33.483 1.00 50.40 C ATOM 311 CD1 PHE A 22 29.599 -1.355 -33.756 1.00 22.15 C ATOM 312 CD2 PHE A 22 30.454 0.745 -34.494 1.00 73.12 C ATOM 313 CE1 PHE A 22 29.817 -1.890 -35.011 1.00 42.34 C ATOM 314 CE2 PHE A 22 30.674 0.216 -35.752 1.00 34.10 C ATOM 315 CZ PHE A 22 30.356 -1.103 -36.011 1.00 21.34 C ATOM 0 H PHE A 22 28.703 2.551 -33.378 1.00 63.03 H new ATOM 0 HA PHE A 22 27.552 0.275 -31.931 1.00 52.32 H new ATOM 0 HB2 PHE A 22 30.398 1.340 -31.936 1.00 42.02 H new ATOM 0 HB3 PHE A 22 29.856 -0.227 -31.368 1.00 42.02 H new ATOM 0 HD1 PHE A 22 29.178 -1.974 -32.978 1.00 22.15 H new ATOM 0 HD2 PHE A 22 30.706 1.777 -34.297 1.00 73.12 H new ATOM 0 HE1 PHE A 22 29.567 -2.922 -35.210 1.00 42.34 H new ATOM 0 HE2 PHE A 22 31.094 0.834 -36.532 1.00 34.10 H new ATOM 0 HZ PHE A 22 30.528 -1.518 -36.993 1.00 21.34 H new ATOM 325 N PHE A 23 27.104 2.606 -30.420 1.00 52.14 N ATOM 326 CA PHE A 23 26.891 3.352 -29.185 1.00 60.14 C ATOM 327 C PHE A 23 26.013 2.563 -28.218 1.00 41.22 C ATOM 328 O PHE A 23 24.818 2.830 -28.089 1.00 42.11 O ATOM 329 CB PHE A 23 26.247 4.707 -29.487 1.00 63.33 C ATOM 330 CG PHE A 23 26.568 5.763 -28.469 1.00 1.02 C ATOM 331 CD1 PHE A 23 26.285 5.560 -27.128 1.00 25.33 C ATOM 332 CD2 PHE A 23 27.152 6.960 -28.853 1.00 32.43 C ATOM 333 CE1 PHE A 23 26.580 6.530 -26.188 1.00 33.52 C ATOM 334 CE2 PHE A 23 27.449 7.933 -27.917 1.00 74.23 C ATOM 335 CZ PHE A 23 27.161 7.718 -26.584 1.00 1.15 C ATOM 0 H PHE A 23 26.379 2.742 -31.125 1.00 52.14 H new ATOM 0 HA PHE A 23 27.862 3.515 -28.716 1.00 60.14 H new ATOM 0 HB2 PHE A 23 26.578 5.047 -30.468 1.00 63.33 H new ATOM 0 HB3 PHE A 23 25.165 4.582 -29.541 1.00 63.33 H new ATOM 0 HD1 PHE A 23 25.829 4.633 -26.813 1.00 25.33 H new ATOM 0 HD2 PHE A 23 27.377 7.134 -29.895 1.00 32.43 H new ATOM 0 HE1 PHE A 23 26.356 6.359 -25.145 1.00 33.52 H new ATOM 0 HE2 PHE A 23 27.906 8.861 -28.228 1.00 74.23 H new ATOM 0 HZ PHE A 23 27.390 8.478 -25.852 1.00 1.15 H new ATOM 345 N ARG A 24 26.615 1.590 -27.541 1.00 53.53 N ATOM 346 CA ARG A 24 25.888 0.761 -26.587 1.00 42.32 C ATOM 347 C ARG A 24 26.150 1.222 -25.156 1.00 41.34 C ATOM 348 O ARG A 24 26.057 0.437 -24.213 1.00 3.25 O ATOM 349 CB ARG A 24 26.292 -0.706 -26.743 1.00 73.04 C ATOM 350 CG ARG A 24 26.179 -1.220 -28.169 1.00 62.14 C ATOM 351 CD ARG A 24 26.911 -2.542 -28.344 1.00 55.14 C ATOM 352 NE ARG A 24 28.288 -2.350 -28.790 1.00 60.42 N ATOM 353 CZ ARG A 24 29.005 -3.296 -29.388 1.00 2.45 C ATOM 354 NH1 ARG A 24 28.478 -4.492 -29.610 1.00 12.42 N ATOM 355 NH2 ARG A 24 30.253 -3.045 -29.764 1.00 74.13 N ATOM 0 H ARG A 24 27.603 1.357 -27.636 1.00 53.53 H new ATOM 0 HA ARG A 24 24.823 0.862 -26.794 1.00 42.32 H new ATOM 0 HB2 ARG A 24 27.320 -0.829 -26.402 1.00 73.04 H new ATOM 0 HB3 ARG A 24 25.665 -1.318 -26.094 1.00 73.04 H new ATOM 0 HG2 ARG A 24 25.128 -1.347 -28.429 1.00 62.14 H new ATOM 0 HG3 ARG A 24 26.590 -0.481 -28.857 1.00 62.14 H new ATOM 0 HD2 ARG A 24 26.908 -3.086 -27.399 1.00 55.14 H new ATOM 0 HD3 ARG A 24 26.378 -3.158 -29.068 1.00 55.14 H new ATOM 0 HE ARG A 24 28.723 -1.441 -28.634 1.00 60.42 H new ATOM 0 HH11 ARG A 24 27.520 -4.688 -29.322 1.00 12.42 H new ATOM 0 HH12 ARG A 24 29.031 -5.216 -30.069 1.00 12.42 H new ATOM 0 HH21 ARG A 24 30.662 -2.126 -29.594 1.00 74.13 H new ATOM 0 HH22 ARG A 24 30.803 -3.771 -30.223 1.00 74.13 H new ATOM 369 N LYS A 25 26.478 2.501 -25.003 1.00 23.30 N ATOM 370 CA LYS A 25 26.753 3.068 -23.688 1.00 42.12 C ATOM 371 C LYS A 25 25.541 3.827 -23.159 1.00 14.11 C ATOM 372 O LYS A 25 25.365 3.970 -21.948 1.00 72.43 O ATOM 373 CB LYS A 25 27.963 4.002 -23.756 1.00 43.52 C ATOM 374 CG LYS A 25 28.267 4.701 -22.442 1.00 54.42 C ATOM 375 CD LYS A 25 29.515 5.562 -22.543 1.00 61.44 C ATOM 376 CE LYS A 25 30.771 4.758 -22.244 1.00 3.12 C ATOM 377 NZ LYS A 25 31.306 4.090 -23.462 1.00 71.44 N ATOM 0 H LYS A 25 26.560 3.164 -25.774 1.00 23.30 H new ATOM 0 HA LYS A 25 26.973 2.248 -23.005 1.00 42.12 H new ATOM 0 HB2 LYS A 25 28.837 3.428 -24.063 1.00 43.52 H new ATOM 0 HB3 LYS A 25 27.788 4.754 -24.526 1.00 43.52 H new ATOM 0 HG2 LYS A 25 27.418 5.322 -22.154 1.00 54.42 H new ATOM 0 HG3 LYS A 25 28.399 3.958 -21.656 1.00 54.42 H new ATOM 0 HD2 LYS A 25 29.584 5.989 -23.544 1.00 61.44 H new ATOM 0 HD3 LYS A 25 29.441 6.396 -21.845 1.00 61.44 H new ATOM 0 HE2 LYS A 25 31.533 5.417 -21.827 1.00 3.12 H new ATOM 0 HE3 LYS A 25 30.549 4.007 -21.486 1.00 3.12 H new ATOM 0 HZ1 LYS A 25 32.345 4.089 -23.429 1.00 71.44 H new ATOM 0 HZ2 LYS A 25 30.960 3.110 -23.501 1.00 71.44 H new ATOM 0 HZ3 LYS A 25 30.987 4.604 -24.308 1.00 71.44 H new ATOM 391 N HIS A 26 24.706 4.311 -24.073 1.00 11.50 N ATOM 392 CA HIS A 26 23.508 5.054 -23.697 1.00 41.33 C ATOM 393 C HIS A 26 22.282 4.146 -23.700 1.00 23.13 C ATOM 394 O HIS A 26 21.146 4.618 -23.731 1.00 55.53 O ATOM 395 CB HIS A 26 23.290 6.228 -24.653 1.00 35.32 C ATOM 396 CG HIS A 26 22.622 7.406 -24.012 1.00 61.51 C ATOM 397 ND1 HIS A 26 23.307 8.353 -23.282 1.00 1.53 N ATOM 398 CD2 HIS A 26 21.323 7.787 -23.997 1.00 5.11 C ATOM 399 CE1 HIS A 26 22.459 9.266 -22.843 1.00 54.24 C ATOM 400 NE2 HIS A 26 21.248 8.946 -23.264 1.00 42.00 N ATOM 0 H HIS A 26 24.837 4.202 -25.079 1.00 11.50 H new ATOM 0 HA HIS A 26 23.651 5.439 -22.687 1.00 41.33 H new ATOM 0 HB2 HIS A 26 24.253 6.542 -25.056 1.00 35.32 H new ATOM 0 HB3 HIS A 26 22.686 5.892 -25.496 1.00 35.32 H new ATOM 0 HD2 HIS A 26 20.499 7.275 -24.473 1.00 5.11 H new ATOM 0 HE1 HIS A 26 22.712 10.127 -22.242 1.00 54.24 H new ATOM 0 HE2 HIS A 26 20.396 9.474 -23.075 1.00 42.00 H new ATOM 408 N THR A 27 22.521 2.838 -23.667 1.00 14.32 N ATOM 409 CA THR A 27 21.437 1.864 -23.667 1.00 71.31 C ATOM 410 C THR A 27 21.455 1.021 -22.397 1.00 61.11 C ATOM 411 O THR A 27 20.412 0.565 -21.930 1.00 11.24 O ATOM 412 CB THR A 27 21.521 0.931 -24.890 1.00 73.10 C ATOM 413 OG1 THR A 27 20.611 -0.164 -24.735 1.00 15.44 O ATOM 414 CG2 THR A 27 22.935 0.399 -25.069 1.00 52.54 C ATOM 0 H THR A 27 23.455 2.430 -23.640 1.00 14.32 H new ATOM 0 HA THR A 27 20.505 2.428 -23.712 1.00 71.31 H new ATOM 0 HB THR A 27 21.250 1.505 -25.776 1.00 73.10 H new ATOM 0 HG1 THR A 27 20.670 -0.751 -25.517 1.00 15.44 H new ATOM 0 HG21 THR A 27 22.969 -0.257 -25.939 1.00 52.54 H new ATOM 0 HG22 THR A 27 23.622 1.233 -25.216 1.00 52.54 H new ATOM 0 HG23 THR A 27 23.229 -0.160 -24.181 1.00 52.54 H new ATOM 422 N GLN A 28 22.646 0.818 -21.844 1.00 4.42 N ATOM 423 CA GLN A 28 22.799 0.030 -20.627 1.00 31.41 C ATOM 424 C GLN A 28 22.459 0.860 -19.394 1.00 3.23 C ATOM 425 O GLN A 28 22.064 0.322 -18.360 1.00 64.41 O ATOM 426 CB GLN A 28 24.227 -0.507 -20.517 1.00 60.25 C ATOM 427 CG GLN A 28 25.290 0.580 -20.549 1.00 35.54 C ATOM 428 CD GLN A 28 26.566 0.168 -19.842 1.00 11.34 C ATOM 429 OE1 GLN A 28 26.677 -0.949 -19.335 1.00 54.25 O ATOM 430 NE2 GLN A 28 27.539 1.071 -19.803 1.00 51.11 N ATOM 0 H GLN A 28 23.519 1.188 -22.219 1.00 4.42 H new ATOM 0 HA GLN A 28 22.106 -0.810 -20.679 1.00 31.41 H new ATOM 0 HB2 GLN A 28 24.324 -1.071 -19.589 1.00 60.25 H new ATOM 0 HB3 GLN A 28 24.408 -1.205 -21.335 1.00 60.25 H new ATOM 0 HG2 GLN A 28 25.518 0.830 -21.585 1.00 35.54 H new ATOM 0 HG3 GLN A 28 24.896 1.483 -20.082 1.00 35.54 H new ATOM 0 HE21 GLN A 28 27.405 1.985 -20.236 1.00 51.11 H new ATOM 0 HE22 GLN A 28 28.421 0.851 -19.340 1.00 51.11 H new ATOM 439 N ALA A 29 22.616 2.175 -19.510 1.00 63.32 N ATOM 440 CA ALA A 29 22.325 3.080 -18.405 1.00 72.34 C ATOM 441 C ALA A 29 20.821 3.252 -18.219 1.00 41.32 C ATOM 442 O ALA A 29 20.323 3.256 -17.094 1.00 72.11 O ATOM 443 CB ALA A 29 22.988 4.429 -18.639 1.00 52.14 C ATOM 0 H ALA A 29 22.943 2.637 -20.358 1.00 63.32 H new ATOM 0 HA ALA A 29 22.730 2.643 -17.492 1.00 72.34 H new ATOM 0 HB1 ALA A 29 22.762 5.095 -17.806 1.00 52.14 H new ATOM 0 HB2 ALA A 29 24.067 4.296 -18.715 1.00 52.14 H new ATOM 0 HB3 ALA A 29 22.610 4.864 -19.564 1.00 52.14 H new ATOM 449 N GLU A 30 20.104 3.396 -19.330 1.00 25.44 N ATOM 450 CA GLU A 30 18.657 3.570 -19.287 1.00 4.31 C ATOM 451 C GLU A 30 18.002 2.477 -18.449 1.00 30.54 C ATOM 452 O GLU A 30 17.012 2.717 -17.759 1.00 51.11 O ATOM 453 CB GLU A 30 18.078 3.559 -20.703 1.00 30.10 C ATOM 454 CG GLU A 30 17.525 4.903 -21.145 1.00 44.43 C ATOM 455 CD GLU A 30 18.533 6.027 -20.994 1.00 32.43 C ATOM 456 OE1 GLU A 30 19.708 5.824 -21.363 1.00 23.01 O ATOM 457 OE2 GLU A 30 18.145 7.109 -20.506 1.00 33.23 O ATOM 0 H GLU A 30 20.501 3.396 -20.269 1.00 25.44 H new ATOM 0 HA GLU A 30 18.446 4.534 -18.823 1.00 4.31 H new ATOM 0 HB2 GLU A 30 18.855 3.248 -21.402 1.00 30.10 H new ATOM 0 HB3 GLU A 30 17.284 2.814 -20.756 1.00 30.10 H new ATOM 0 HG2 GLU A 30 17.212 4.838 -22.187 1.00 44.43 H new ATOM 0 HG3 GLU A 30 16.636 5.136 -20.559 1.00 44.43 H new ATOM 464 N GLY A 31 18.563 1.273 -18.514 1.00 75.52 N ATOM 465 CA GLY A 31 18.020 0.159 -17.758 1.00 13.32 C ATOM 466 C GLY A 31 18.112 0.376 -16.260 1.00 52.04 C ATOM 467 O GLY A 31 17.203 0.010 -15.515 1.00 70.30 O ATOM 0 H GLY A 31 19.384 1.049 -19.077 1.00 75.52 H new ATOM 0 HA2 GLY A 31 16.977 0.008 -18.037 1.00 13.32 H new ATOM 0 HA3 GLY A 31 18.556 -0.752 -18.024 1.00 13.32 H new ATOM 471 N LYS A 32 19.214 0.972 -15.817 1.00 74.11 N ATOM 472 CA LYS A 32 19.423 1.237 -14.399 1.00 11.13 C ATOM 473 C LYS A 32 18.363 2.193 -13.862 1.00 14.13 C ATOM 474 O LYS A 32 17.988 2.127 -12.691 1.00 11.22 O ATOM 475 CB LYS A 32 20.817 1.824 -14.169 1.00 24.12 C ATOM 476 CG LYS A 32 21.944 0.850 -14.468 1.00 30.05 C ATOM 477 CD LYS A 32 22.157 -0.124 -13.321 1.00 65.32 C ATOM 478 CE LYS A 32 22.946 0.513 -12.187 1.00 53.33 C ATOM 479 NZ LYS A 32 23.052 -0.391 -11.009 1.00 0.22 N ATOM 0 H LYS A 32 19.976 1.281 -16.420 1.00 74.11 H new ATOM 0 HA LYS A 32 19.340 0.292 -13.863 1.00 11.13 H new ATOM 0 HB2 LYS A 32 20.937 2.709 -14.794 1.00 24.12 H new ATOM 0 HB3 LYS A 32 20.897 2.153 -13.133 1.00 24.12 H new ATOM 0 HG2 LYS A 32 21.716 0.297 -15.379 1.00 30.05 H new ATOM 0 HG3 LYS A 32 22.865 1.403 -14.653 1.00 30.05 H new ATOM 0 HD2 LYS A 32 21.191 -0.464 -12.947 1.00 65.32 H new ATOM 0 HD3 LYS A 32 22.687 -1.005 -13.684 1.00 65.32 H new ATOM 0 HE2 LYS A 32 23.945 0.769 -12.539 1.00 53.33 H new ATOM 0 HE3 LYS A 32 22.465 1.444 -11.888 1.00 53.33 H new ATOM 0 HZ1 LYS A 32 23.597 0.080 -10.258 1.00 0.22 H new ATOM 0 HZ2 LYS A 32 22.100 -0.616 -10.657 1.00 0.22 H new ATOM 0 HZ3 LYS A 32 23.534 -1.269 -11.288 1.00 0.22 H new ATOM 493 N LYS A 33 17.881 3.081 -14.725 1.00 61.22 N ATOM 494 CA LYS A 33 16.862 4.049 -14.339 1.00 54.23 C ATOM 495 C LYS A 33 15.670 3.354 -13.689 1.00 55.31 C ATOM 496 O LYS A 33 15.171 3.794 -12.652 1.00 4.10 O ATOM 497 CB LYS A 33 16.397 4.846 -15.561 1.00 22.33 C ATOM 498 CG LYS A 33 15.867 6.228 -15.220 1.00 25.10 C ATOM 499 CD LYS A 33 14.421 6.172 -14.757 1.00 5.34 C ATOM 500 CE LYS A 33 13.828 7.565 -14.614 1.00 0.43 C ATOM 501 NZ LYS A 33 13.412 8.128 -15.928 1.00 13.51 N ATOM 0 H LYS A 33 18.180 3.150 -15.698 1.00 61.22 H new ATOM 0 HA LYS A 33 17.302 4.732 -13.613 1.00 54.23 H new ATOM 0 HB2 LYS A 33 17.230 4.947 -16.257 1.00 22.33 H new ATOM 0 HB3 LYS A 33 15.618 4.284 -16.076 1.00 22.33 H new ATOM 0 HG2 LYS A 33 16.483 6.672 -14.438 1.00 25.10 H new ATOM 0 HG3 LYS A 33 15.945 6.875 -16.094 1.00 25.10 H new ATOM 0 HD2 LYS A 33 13.831 5.596 -15.470 1.00 5.34 H new ATOM 0 HD3 LYS A 33 14.364 5.651 -13.801 1.00 5.34 H new ATOM 0 HE2 LYS A 33 12.967 7.526 -13.946 1.00 0.43 H new ATOM 0 HE3 LYS A 33 14.561 8.226 -14.151 1.00 0.43 H new ATOM 0 HZ1 LYS A 33 13.013 9.078 -15.788 1.00 13.51 H new ATOM 0 HZ2 LYS A 33 14.238 8.189 -16.557 1.00 13.51 H new ATOM 0 HZ3 LYS A 33 12.694 7.511 -16.358 1.00 13.51 H new ATOM 515 N LEU A 34 15.217 2.267 -14.303 1.00 64.35 N ATOM 516 CA LEU A 34 14.084 1.509 -13.783 1.00 41.53 C ATOM 517 C LEU A 34 14.557 0.355 -12.906 1.00 4.35 C ATOM 518 O LEU A 34 13.838 -0.097 -12.016 1.00 74.54 O ATOM 519 CB LEU A 34 13.232 0.973 -14.935 1.00 10.31 C ATOM 520 CG LEU A 34 12.321 1.989 -15.626 1.00 3.15 C ATOM 521 CD1 LEU A 34 11.921 1.494 -17.007 1.00 12.53 C ATOM 522 CD2 LEU A 34 11.088 2.263 -14.777 1.00 3.41 C ATOM 0 H LEU A 34 15.617 1.890 -15.162 1.00 64.35 H new ATOM 0 HA LEU A 34 13.479 2.180 -13.173 1.00 41.53 H new ATOM 0 HB2 LEU A 34 13.898 0.544 -15.684 1.00 10.31 H new ATOM 0 HB3 LEU A 34 12.613 0.160 -14.555 1.00 10.31 H new ATOM 0 HG LEU A 34 12.872 2.922 -15.743 1.00 3.15 H new ATOM 0 HD11 LEU A 34 11.273 2.230 -17.484 1.00 12.53 H new ATOM 0 HD12 LEU A 34 12.814 1.350 -17.615 1.00 12.53 H new ATOM 0 HD13 LEU A 34 11.388 0.547 -16.914 1.00 12.53 H new ATOM 0 HD21 LEU A 34 10.451 2.988 -15.284 1.00 3.41 H new ATOM 0 HD22 LEU A 34 10.535 1.335 -14.628 1.00 3.41 H new ATOM 0 HD23 LEU A 34 11.394 2.662 -13.810 1.00 3.41 H new ATOM 534 N GLY A 35 15.775 -0.115 -13.161 1.00 35.43 N ATOM 535 CA GLY A 35 16.324 -1.211 -12.384 1.00 60.20 C ATOM 536 C GLY A 35 16.221 -2.541 -13.104 1.00 73.10 C ATOM 537 O GLY A 35 15.825 -3.547 -12.513 1.00 15.40 O ATOM 0 H GLY A 35 16.390 0.244 -13.891 1.00 35.43 H new ATOM 0 HA2 GLY A 35 17.370 -1.004 -12.158 1.00 60.20 H new ATOM 0 HA3 GLY A 35 15.799 -1.276 -11.431 1.00 60.20 H new ATOM 541 N LEU A 36 16.576 -2.548 -14.384 1.00 71.11 N ATOM 542 CA LEU A 36 16.520 -3.765 -15.187 1.00 52.30 C ATOM 543 C LEU A 36 17.914 -4.176 -15.650 1.00 74.13 C ATOM 544 O LEU A 36 18.880 -3.432 -15.482 1.00 70.13 O ATOM 545 CB LEU A 36 15.608 -3.559 -16.398 1.00 13.24 C ATOM 546 CG LEU A 36 14.239 -2.940 -16.109 1.00 64.14 C ATOM 547 CD1 LEU A 36 13.399 -2.889 -17.376 1.00 21.30 C ATOM 548 CD2 LEU A 36 13.519 -3.722 -15.020 1.00 42.33 C ATOM 0 H LEU A 36 16.906 -1.725 -14.888 1.00 71.11 H new ATOM 0 HA LEU A 36 16.114 -4.563 -14.565 1.00 52.30 H new ATOM 0 HB2 LEU A 36 16.128 -2.924 -17.115 1.00 13.24 H new ATOM 0 HB3 LEU A 36 15.454 -4.524 -16.880 1.00 13.24 H new ATOM 0 HG LEU A 36 14.390 -1.920 -15.756 1.00 64.14 H new ATOM 0 HD11 LEU A 36 12.429 -2.446 -17.152 1.00 21.30 H new ATOM 0 HD12 LEU A 36 13.909 -2.285 -18.127 1.00 21.30 H new ATOM 0 HD13 LEU A 36 13.257 -3.899 -17.759 1.00 21.30 H new ATOM 0 HD21 LEU A 36 12.547 -3.267 -14.828 1.00 42.33 H new ATOM 0 HD22 LEU A 36 13.379 -4.753 -15.344 1.00 42.33 H new ATOM 0 HD23 LEU A 36 14.114 -3.706 -14.107 1.00 42.33 H new ATOM 560 N VAL A 37 18.010 -5.365 -16.236 1.00 71.35 N ATOM 561 CA VAL A 37 19.285 -5.875 -16.728 1.00 13.44 C ATOM 562 C VAL A 37 19.171 -6.335 -18.177 1.00 1.15 C ATOM 563 O VAL A 37 18.122 -6.193 -18.804 1.00 22.14 O ATOM 564 CB VAL A 37 19.790 -7.047 -15.866 1.00 61.11 C ATOM 565 CG1 VAL A 37 19.921 -6.623 -14.411 1.00 70.31 C ATOM 566 CG2 VAL A 37 18.862 -8.245 -16.000 1.00 13.33 C ATOM 0 H VAL A 37 17.220 -5.994 -16.382 1.00 71.35 H new ATOM 0 HA VAL A 37 20.000 -5.054 -16.667 1.00 13.44 H new ATOM 0 HB VAL A 37 20.777 -7.339 -16.224 1.00 61.11 H new ATOM 0 HG11 VAL A 37 20.279 -7.464 -13.818 1.00 70.31 H new ATOM 0 HG12 VAL A 37 20.629 -5.798 -14.335 1.00 70.31 H new ATOM 0 HG13 VAL A 37 18.949 -6.303 -14.036 1.00 70.31 H new ATOM 0 HG21 VAL A 37 19.234 -9.064 -15.384 1.00 13.33 H new ATOM 0 HG22 VAL A 37 17.861 -7.968 -15.670 1.00 13.33 H new ATOM 0 HG23 VAL A 37 18.826 -8.562 -17.042 1.00 13.33 H new ATOM 576 N GLY A 38 20.260 -6.888 -18.703 1.00 75.22 N ATOM 577 CA GLY A 38 20.261 -7.362 -20.075 1.00 2.20 C ATOM 578 C GLY A 38 21.618 -7.218 -20.736 1.00 55.44 C ATOM 579 O GLY A 38 22.650 -7.267 -20.068 1.00 12.34 O ATOM 0 H GLY A 38 21.140 -7.016 -18.204 1.00 75.22 H new ATOM 0 HA2 GLY A 38 19.960 -8.409 -20.095 1.00 2.20 H new ATOM 0 HA3 GLY A 38 19.520 -6.806 -20.649 1.00 2.20 H new ATOM 583 N TRP A 39 21.616 -7.041 -22.053 1.00 30.14 N ATOM 584 CA TRP A 39 22.857 -6.891 -22.805 1.00 35.31 C ATOM 585 C TRP A 39 22.590 -6.287 -24.179 1.00 2.40 C ATOM 586 O TRP A 39 21.538 -6.516 -24.776 1.00 1.13 O ATOM 587 CB TRP A 39 23.552 -8.245 -22.956 1.00 21.20 C ATOM 588 CG TRP A 39 22.780 -9.220 -23.793 1.00 51.41 C ATOM 589 CD1 TRP A 39 22.699 -9.245 -25.156 1.00 60.11 C ATOM 590 CD2 TRP A 39 21.978 -10.308 -23.321 1.00 65.01 C ATOM 591 NE1 TRP A 39 21.895 -10.284 -25.560 1.00 25.01 N ATOM 592 CE2 TRP A 39 21.442 -10.952 -24.453 1.00 52.23 C ATOM 593 CE3 TRP A 39 21.664 -10.803 -22.053 1.00 14.23 C ATOM 594 CZ2 TRP A 39 20.608 -12.062 -24.352 1.00 62.35 C ATOM 595 CZ3 TRP A 39 20.836 -11.905 -21.954 1.00 52.13 C ATOM 596 CH2 TRP A 39 20.316 -12.525 -23.098 1.00 64.43 C ATOM 0 H TRP A 39 20.770 -6.998 -22.621 1.00 30.14 H new ATOM 0 HA TRP A 39 23.509 -6.215 -22.252 1.00 35.31 H new ATOM 0 HB2 TRP A 39 24.535 -8.093 -23.402 1.00 21.20 H new ATOM 0 HB3 TRP A 39 23.714 -8.674 -21.967 1.00 21.20 H new ATOM 0 HD1 TRP A 39 23.194 -8.551 -25.819 1.00 60.11 H new ATOM 0 HE1 TRP A 39 21.672 -10.519 -26.527 1.00 25.01 H new ATOM 0 HE3 TRP A 39 22.061 -10.333 -21.166 1.00 14.23 H new ATOM 0 HZ2 TRP A 39 20.206 -12.541 -25.232 1.00 62.35 H new ATOM 0 HZ3 TRP A 39 20.585 -12.295 -20.978 1.00 52.13 H new ATOM 0 HH2 TRP A 39 19.672 -13.385 -22.988 1.00 64.43 H new ATOM 607 N VAL A 40 23.550 -5.513 -24.677 1.00 30.04 N ATOM 608 CA VAL A 40 23.419 -4.876 -25.982 1.00 20.43 C ATOM 609 C VAL A 40 24.482 -5.384 -26.950 1.00 34.11 C ATOM 610 O VAL A 40 25.678 -5.278 -26.684 1.00 24.33 O ATOM 611 CB VAL A 40 23.530 -3.344 -25.872 1.00 60.03 C ATOM 612 CG1 VAL A 40 23.194 -2.688 -27.203 1.00 10.22 C ATOM 613 CG2 VAL A 40 22.624 -2.822 -24.767 1.00 62.22 C ATOM 0 H VAL A 40 24.427 -5.312 -24.196 1.00 30.04 H new ATOM 0 HA VAL A 40 22.431 -5.135 -26.363 1.00 20.43 H new ATOM 0 HB VAL A 40 24.559 -3.089 -25.617 1.00 60.03 H new ATOM 0 HG11 VAL A 40 23.278 -1.606 -27.106 1.00 10.22 H new ATOM 0 HG12 VAL A 40 23.888 -3.039 -27.967 1.00 10.22 H new ATOM 0 HG13 VAL A 40 22.175 -2.949 -27.490 1.00 10.22 H new ATOM 0 HG21 VAL A 40 22.715 -1.738 -24.703 1.00 62.22 H new ATOM 0 HG22 VAL A 40 21.590 -3.087 -24.989 1.00 62.22 H new ATOM 0 HG23 VAL A 40 22.917 -3.267 -23.816 1.00 62.22 H new ATOM 623 N GLN A 41 24.035 -5.935 -28.074 1.00 41.01 N ATOM 624 CA GLN A 41 24.949 -6.459 -29.082 1.00 75.54 C ATOM 625 C GLN A 41 24.507 -6.048 -30.483 1.00 64.22 C ATOM 626 O GLN A 41 23.314 -5.957 -30.767 1.00 31.33 O ATOM 627 CB GLN A 41 25.027 -7.984 -28.987 1.00 35.15 C ATOM 628 CG GLN A 41 26.290 -8.568 -29.597 1.00 23.21 C ATOM 629 CD GLN A 41 26.110 -8.958 -31.051 1.00 20.03 C ATOM 630 OE1 GLN A 41 25.025 -8.813 -31.614 1.00 51.24 O ATOM 631 NE2 GLN A 41 27.176 -9.456 -31.667 1.00 34.31 N ATOM 0 H GLN A 41 23.047 -6.030 -28.309 1.00 41.01 H new ATOM 0 HA GLN A 41 25.937 -6.039 -28.894 1.00 75.54 H new ATOM 0 HB2 GLN A 41 24.971 -8.278 -27.939 1.00 35.15 H new ATOM 0 HB3 GLN A 41 24.159 -8.416 -29.486 1.00 35.15 H new ATOM 0 HG2 GLN A 41 27.097 -7.840 -29.517 1.00 23.21 H new ATOM 0 HG3 GLN A 41 26.594 -9.445 -29.025 1.00 23.21 H new ATOM 0 HE21 GLN A 41 28.056 -9.559 -31.161 1.00 34.31 H new ATOM 0 HE22 GLN A 41 27.115 -9.736 -32.646 1.00 34.31 H new ATOM 640 N ASN A 42 25.479 -5.800 -31.355 1.00 62.23 N ATOM 641 CA ASN A 42 25.191 -5.397 -32.727 1.00 32.31 C ATOM 642 C ASN A 42 25.430 -6.552 -33.695 1.00 24.11 C ATOM 643 O ASN A 42 26.321 -7.377 -33.487 1.00 40.14 O ATOM 644 CB ASN A 42 26.056 -4.199 -33.121 1.00 42.32 C ATOM 645 CG ASN A 42 26.087 -3.976 -34.621 1.00 15.11 C ATOM 646 OD1 ASN A 42 27.121 -4.152 -35.265 1.00 11.10 O ATOM 647 ND2 ASN A 42 24.949 -3.586 -35.184 1.00 72.42 N ATOM 0 H ASN A 42 26.473 -5.871 -31.136 1.00 62.23 H new ATOM 0 HA ASN A 42 24.140 -5.112 -32.782 1.00 32.31 H new ATOM 0 HB2 ASN A 42 25.675 -3.303 -32.631 1.00 42.32 H new ATOM 0 HB3 ASN A 42 27.072 -4.353 -32.758 1.00 42.32 H new ATOM 0 HD21 ASN A 42 24.908 -3.420 -36.190 1.00 72.42 H new ATOM 0 HD22 ASN A 42 24.116 -3.453 -34.611 1.00 72.42 H new ATOM 654 N THR A 43 24.629 -6.605 -34.755 1.00 3.24 N ATOM 655 CA THR A 43 24.753 -7.658 -35.755 1.00 1.34 C ATOM 656 C THR A 43 25.351 -7.119 -37.049 1.00 50.02 C ATOM 657 O THR A 43 25.675 -5.935 -37.149 1.00 70.41 O ATOM 658 CB THR A 43 23.389 -8.304 -36.062 1.00 51.52 C ATOM 659 OG1 THR A 43 22.490 -7.322 -36.591 1.00 2.14 O ATOM 660 CG2 THR A 43 22.790 -8.925 -34.810 1.00 33.13 C ATOM 0 H THR A 43 23.887 -5.930 -34.943 1.00 3.24 H new ATOM 0 HA THR A 43 25.419 -8.414 -35.338 1.00 1.34 H new ATOM 0 HB THR A 43 23.542 -9.091 -36.800 1.00 51.52 H new ATOM 0 HG1 THR A 43 22.127 -6.782 -35.858 1.00 2.14 H new ATOM 0 HG21 THR A 43 21.827 -9.375 -35.052 1.00 33.13 H new ATOM 0 HG22 THR A 43 23.463 -9.692 -34.427 1.00 33.13 H new ATOM 0 HG23 THR A 43 22.650 -8.154 -34.053 1.00 33.13 H new ATOM 668 N ASP A 44 25.494 -7.994 -38.038 1.00 71.04 N ATOM 669 CA ASP A 44 26.052 -7.605 -39.329 1.00 34.34 C ATOM 670 C ASP A 44 24.944 -7.226 -40.307 1.00 64.01 C ATOM 671 O ASP A 44 25.151 -6.414 -41.209 1.00 60.11 O ATOM 672 CB ASP A 44 26.894 -8.743 -39.908 1.00 33.01 C ATOM 673 CG ASP A 44 28.219 -8.906 -39.190 1.00 41.23 C ATOM 674 OD1 ASP A 44 28.778 -7.885 -38.737 1.00 11.14 O ATOM 675 OD2 ASP A 44 28.697 -10.054 -39.081 1.00 63.05 O ATOM 0 H ASP A 44 25.232 -8.977 -37.971 1.00 71.04 H new ATOM 0 HA ASP A 44 26.689 -6.734 -39.175 1.00 34.34 H new ATOM 0 HB2 ASP A 44 26.333 -9.675 -39.844 1.00 33.01 H new ATOM 0 HB3 ASP A 44 27.078 -8.553 -40.965 1.00 33.01 H new ATOM 680 N ARG A 45 23.770 -7.820 -40.123 1.00 12.12 N ATOM 681 CA ARG A 45 22.631 -7.546 -40.991 1.00 32.14 C ATOM 682 C ARG A 45 22.249 -6.070 -40.937 1.00 43.44 C ATOM 683 O ARG A 45 22.105 -5.418 -41.971 1.00 13.33 O ATOM 684 CB ARG A 45 21.434 -8.408 -40.584 1.00 40.02 C ATOM 685 CG ARG A 45 20.442 -8.643 -41.711 1.00 52.14 C ATOM 686 CD ARG A 45 19.675 -9.942 -41.517 1.00 42.30 C ATOM 687 NE ARG A 45 20.450 -11.104 -41.944 1.00 0.23 N ATOM 688 CZ ARG A 45 19.972 -12.343 -41.951 1.00 62.21 C ATOM 689 NH1 ARG A 45 18.729 -12.580 -41.557 1.00 75.24 N ATOM 690 NH2 ARG A 45 20.739 -13.349 -42.353 1.00 51.35 N ATOM 0 H ARG A 45 23.582 -8.494 -39.381 1.00 12.12 H new ATOM 0 HA ARG A 45 22.918 -7.793 -42.013 1.00 32.14 H new ATOM 0 HB2 ARG A 45 21.796 -9.371 -40.223 1.00 40.02 H new ATOM 0 HB3 ARG A 45 20.919 -7.929 -39.751 1.00 40.02 H new ATOM 0 HG2 ARG A 45 19.741 -7.809 -41.760 1.00 52.14 H new ATOM 0 HG3 ARG A 45 20.972 -8.671 -42.663 1.00 52.14 H new ATOM 0 HD2 ARG A 45 19.407 -10.051 -40.466 1.00 42.30 H new ATOM 0 HD3 ARG A 45 18.743 -9.901 -42.081 1.00 42.30 H new ATOM 0 HE ARG A 45 21.411 -10.956 -42.254 1.00 0.23 H new ATOM 0 HH11 ARG A 45 18.137 -11.810 -41.247 1.00 75.24 H new ATOM 0 HH12 ARG A 45 18.365 -13.533 -41.564 1.00 75.24 H new ATOM 0 HH21 ARG A 45 21.696 -13.171 -42.657 1.00 51.35 H new ATOM 0 HH22 ARG A 45 20.371 -14.300 -42.358 1.00 51.35 H new ATOM 704 N GLY A 46 22.087 -5.549 -39.725 1.00 3.42 N ATOM 705 CA GLY A 46 21.724 -4.153 -39.559 1.00 75.54 C ATOM 706 C GLY A 46 20.651 -3.955 -38.507 1.00 3.25 C ATOM 707 O GLY A 46 19.691 -3.213 -38.719 1.00 23.25 O ATOM 0 H GLY A 46 22.201 -6.068 -38.855 1.00 3.42 H new ATOM 0 HA2 GLY A 46 22.610 -3.581 -39.283 1.00 75.54 H new ATOM 0 HA3 GLY A 46 21.373 -3.756 -40.511 1.00 75.54 H new ATOM 711 N THR A 47 20.812 -4.620 -37.367 1.00 24.40 N ATOM 712 CA THR A 47 19.849 -4.516 -36.278 1.00 44.11 C ATOM 713 C THR A 47 20.520 -4.740 -34.928 1.00 31.04 C ATOM 714 O THR A 47 21.414 -5.576 -34.798 1.00 60.42 O ATOM 715 CB THR A 47 18.702 -5.530 -36.444 1.00 21.45 C ATOM 716 OG1 THR A 47 19.233 -6.855 -36.565 1.00 11.22 O ATOM 717 CG2 THR A 47 17.861 -5.201 -37.668 1.00 23.52 C ATOM 0 H THR A 47 21.601 -5.237 -37.174 1.00 24.40 H new ATOM 0 HA THR A 47 19.439 -3.507 -36.313 1.00 44.11 H new ATOM 0 HB THR A 47 18.066 -5.473 -35.561 1.00 21.45 H new ATOM 0 HG1 THR A 47 18.497 -7.494 -36.669 1.00 11.22 H new ATOM 0 HG21 THR A 47 17.057 -5.931 -37.764 1.00 23.52 H new ATOM 0 HG22 THR A 47 17.434 -4.204 -37.559 1.00 23.52 H new ATOM 0 HG23 THR A 47 18.488 -5.232 -38.559 1.00 23.52 H new ATOM 725 N VAL A 48 20.082 -3.988 -33.923 1.00 22.04 N ATOM 726 CA VAL A 48 20.639 -4.106 -32.580 1.00 62.24 C ATOM 727 C VAL A 48 19.997 -5.260 -31.819 1.00 23.24 C ATOM 728 O VAL A 48 18.860 -5.157 -31.359 1.00 43.43 O ATOM 729 CB VAL A 48 20.448 -2.806 -31.777 1.00 43.01 C ATOM 730 CG1 VAL A 48 21.003 -2.962 -30.369 1.00 54.32 C ATOM 731 CG2 VAL A 48 21.108 -1.637 -32.492 1.00 40.43 C ATOM 0 H VAL A 48 19.343 -3.291 -34.013 1.00 22.04 H new ATOM 0 HA VAL A 48 21.706 -4.299 -32.695 1.00 62.24 H new ATOM 0 HB VAL A 48 19.380 -2.600 -31.700 1.00 43.01 H new ATOM 0 HG11 VAL A 48 20.859 -2.034 -29.816 1.00 54.32 H new ATOM 0 HG12 VAL A 48 20.481 -3.772 -29.860 1.00 54.32 H new ATOM 0 HG13 VAL A 48 22.067 -3.192 -30.421 1.00 54.32 H new ATOM 0 HG21 VAL A 48 20.963 -0.726 -31.911 1.00 40.43 H new ATOM 0 HG22 VAL A 48 22.175 -1.832 -32.601 1.00 40.43 H new ATOM 0 HG23 VAL A 48 20.660 -1.513 -33.478 1.00 40.43 H new ATOM 741 N GLN A 49 20.734 -6.359 -31.688 1.00 41.44 N ATOM 742 CA GLN A 49 20.236 -7.533 -30.982 1.00 11.21 C ATOM 743 C GLN A 49 20.457 -7.398 -29.479 1.00 33.11 C ATOM 744 O GLN A 49 21.578 -7.534 -28.991 1.00 71.23 O ATOM 745 CB GLN A 49 20.926 -8.796 -31.499 1.00 74.34 C ATOM 746 CG GLN A 49 20.221 -9.430 -32.688 1.00 64.41 C ATOM 747 CD GLN A 49 20.841 -10.752 -33.096 1.00 71.42 C ATOM 748 OE1 GLN A 49 21.788 -11.227 -32.469 1.00 62.20 O ATOM 749 NE2 GLN A 49 20.308 -11.355 -34.153 1.00 31.24 N ATOM 0 H GLN A 49 21.678 -6.460 -32.062 1.00 41.44 H new ATOM 0 HA GLN A 49 19.165 -7.611 -31.168 1.00 11.21 H new ATOM 0 HB2 GLN A 49 21.950 -8.551 -31.782 1.00 74.34 H new ATOM 0 HB3 GLN A 49 20.985 -9.525 -30.691 1.00 74.34 H new ATOM 0 HG2 GLN A 49 19.171 -9.586 -32.442 1.00 64.41 H new ATOM 0 HG3 GLN A 49 20.252 -8.742 -33.533 1.00 64.41 H new ATOM 0 HE21 GLN A 49 19.523 -10.926 -34.643 1.00 31.24 H new ATOM 0 HE22 GLN A 49 20.683 -12.247 -34.474 1.00 31.24 H new ATOM 758 N GLY A 50 19.378 -7.129 -28.749 1.00 23.21 N ATOM 759 CA GLY A 50 19.476 -6.980 -27.309 1.00 12.14 C ATOM 760 C GLY A 50 18.148 -7.203 -26.612 1.00 3.35 C ATOM 761 O GLY A 50 17.091 -6.891 -27.159 1.00 75.42 O ATOM 0 H GLY A 50 18.439 -7.012 -29.129 1.00 23.21 H new ATOM 0 HA2 GLY A 50 20.209 -7.688 -26.923 1.00 12.14 H new ATOM 0 HA3 GLY A 50 19.843 -5.981 -27.074 1.00 12.14 H new ATOM 765 N LYS A 51 18.202 -7.745 -25.400 1.00 0.13 N ATOM 766 CA LYS A 51 16.995 -8.010 -24.626 1.00 22.34 C ATOM 767 C LYS A 51 16.874 -7.039 -23.456 1.00 5.31 C ATOM 768 O LYS A 51 17.764 -6.219 -23.222 1.00 20.53 O ATOM 769 CB LYS A 51 17.003 -9.450 -24.107 1.00 63.34 C ATOM 770 CG LYS A 51 18.008 -9.690 -22.994 1.00 32.43 C ATOM 771 CD LYS A 51 17.317 -9.936 -21.663 1.00 32.01 C ATOM 772 CE LYS A 51 16.603 -11.279 -21.645 1.00 52.12 C ATOM 773 NZ LYS A 51 17.411 -12.328 -20.963 1.00 53.35 N ATOM 0 H LYS A 51 19.069 -8.009 -24.932 1.00 0.13 H new ATOM 0 HA LYS A 51 16.136 -7.870 -25.282 1.00 22.34 H new ATOM 0 HB2 LYS A 51 16.006 -9.703 -23.746 1.00 63.34 H new ATOM 0 HB3 LYS A 51 17.222 -10.124 -24.935 1.00 63.34 H new ATOM 0 HG2 LYS A 51 18.632 -10.547 -23.245 1.00 32.43 H new ATOM 0 HG3 LYS A 51 18.670 -8.828 -22.908 1.00 32.43 H new ATOM 0 HD2 LYS A 51 18.052 -9.903 -20.859 1.00 32.01 H new ATOM 0 HD3 LYS A 51 16.599 -9.138 -21.472 1.00 32.01 H new ATOM 0 HE2 LYS A 51 15.644 -11.173 -21.139 1.00 52.12 H new ATOM 0 HE3 LYS A 51 16.391 -11.591 -22.668 1.00 52.12 H new ATOM 0 HZ1 LYS A 51 16.983 -13.261 -21.132 1.00 53.35 H new ATOM 0 HZ2 LYS A 51 18.380 -12.319 -21.339 1.00 53.35 H new ATOM 0 HZ3 LYS A 51 17.435 -12.138 -19.941 1.00 53.35 H new ATOM 787 N LEU A 52 15.770 -7.136 -22.724 1.00 3.22 N ATOM 788 CA LEU A 52 15.534 -6.266 -21.577 1.00 30.24 C ATOM 789 C LEU A 52 14.755 -6.999 -20.489 1.00 22.10 C ATOM 790 O LEU A 52 13.526 -7.057 -20.525 1.00 5.22 O ATOM 791 CB LEU A 52 14.771 -5.013 -22.010 1.00 73.40 C ATOM 792 CG LEU A 52 15.534 -4.040 -22.909 1.00 11.10 C ATOM 793 CD1 LEU A 52 14.569 -3.115 -23.634 1.00 50.22 C ATOM 794 CD2 LEU A 52 16.536 -3.236 -22.094 1.00 42.41 C ATOM 0 H LEU A 52 15.024 -7.808 -22.904 1.00 3.22 H new ATOM 0 HA LEU A 52 16.502 -5.972 -21.170 1.00 30.24 H new ATOM 0 HB2 LEU A 52 13.866 -5.325 -22.532 1.00 73.40 H new ATOM 0 HB3 LEU A 52 14.454 -4.477 -21.115 1.00 73.40 H new ATOM 0 HG LEU A 52 16.081 -4.617 -23.655 1.00 11.10 H new ATOM 0 HD11 LEU A 52 15.130 -2.429 -24.269 1.00 50.22 H new ATOM 0 HD12 LEU A 52 13.891 -3.706 -24.249 1.00 50.22 H new ATOM 0 HD13 LEU A 52 13.994 -2.545 -22.904 1.00 50.22 H new ATOM 0 HD21 LEU A 52 17.070 -2.549 -22.750 1.00 42.41 H new ATOM 0 HD22 LEU A 52 16.009 -2.669 -21.326 1.00 42.41 H new ATOM 0 HD23 LEU A 52 17.247 -3.913 -21.621 1.00 42.41 H new ATOM 806 N GLN A 53 15.479 -7.555 -19.523 1.00 30.31 N ATOM 807 CA GLN A 53 14.855 -8.283 -18.424 1.00 60.01 C ATOM 808 C GLN A 53 14.042 -7.343 -17.540 1.00 44.53 C ATOM 809 O GLN A 53 14.052 -6.128 -17.736 1.00 13.03 O ATOM 810 CB GLN A 53 15.919 -8.996 -17.588 1.00 32.14 C ATOM 811 CG GLN A 53 16.173 -10.431 -18.022 1.00 3.44 C ATOM 812 CD GLN A 53 15.366 -11.434 -17.222 1.00 61.21 C ATOM 813 OE1 GLN A 53 15.907 -12.412 -16.704 1.00 52.15 O ATOM 814 NE2 GLN A 53 14.064 -11.197 -17.117 1.00 33.34 N ATOM 0 H GLN A 53 16.497 -7.515 -19.479 1.00 30.31 H new ATOM 0 HA GLN A 53 14.180 -9.025 -18.850 1.00 60.01 H new ATOM 0 HB2 GLN A 53 16.852 -8.436 -17.649 1.00 32.14 H new ATOM 0 HB3 GLN A 53 15.612 -8.990 -16.542 1.00 32.14 H new ATOM 0 HG2 GLN A 53 15.930 -10.535 -19.079 1.00 3.44 H new ATOM 0 HG3 GLN A 53 17.234 -10.656 -17.915 1.00 3.44 H new ATOM 0 HE21 GLN A 53 13.658 -10.374 -17.562 1.00 33.34 H new ATOM 0 HE22 GLN A 53 13.470 -11.838 -16.591 1.00 33.34 H new ATOM 823 N GLY A 54 13.339 -7.913 -16.567 1.00 21.13 N ATOM 824 CA GLY A 54 12.530 -7.111 -15.668 1.00 2.12 C ATOM 825 C GLY A 54 11.046 -7.372 -15.834 1.00 3.01 C ATOM 826 O GLY A 54 10.617 -8.082 -16.743 1.00 63.53 O ATOM 0 H GLY A 54 13.315 -8.916 -16.385 1.00 21.13 H new ATOM 0 HA2 GLY A 54 12.820 -7.321 -14.638 1.00 2.12 H new ATOM 0 HA3 GLY A 54 12.732 -6.055 -15.847 1.00 2.12 H new ATOM 830 N PRO A 55 10.235 -6.790 -14.938 1.00 41.34 N ATOM 831 CA PRO A 55 8.778 -6.950 -14.968 1.00 43.34 C ATOM 832 C PRO A 55 8.141 -6.236 -16.156 1.00 21.13 C ATOM 833 O PRO A 55 8.720 -5.305 -16.716 1.00 2.34 O ATOM 834 CB PRO A 55 8.324 -6.311 -13.654 1.00 1.53 C ATOM 835 CG PRO A 55 9.396 -5.331 -13.319 1.00 34.34 C ATOM 836 CD PRO A 55 10.678 -5.930 -13.828 1.00 14.11 C ATOM 0 HA PRO A 55 8.485 -7.994 -15.073 1.00 43.34 H new ATOM 0 HB2 PRO A 55 7.358 -5.818 -13.766 1.00 1.53 H new ATOM 0 HB3 PRO A 55 8.211 -7.058 -12.869 1.00 1.53 H new ATOM 0 HG2 PRO A 55 9.203 -4.366 -13.788 1.00 34.34 H new ATOM 0 HG3 PRO A 55 9.445 -5.159 -12.244 1.00 34.34 H new ATOM 0 HD2 PRO A 55 11.373 -5.162 -14.167 1.00 14.11 H new ATOM 0 HD3 PRO A 55 11.189 -6.503 -13.054 1.00 14.11 H new ATOM 844 N ILE A 56 6.947 -6.678 -16.534 1.00 74.33 N ATOM 845 CA ILE A 56 6.231 -6.080 -17.654 1.00 51.03 C ATOM 846 C ILE A 56 5.881 -4.624 -17.368 1.00 55.20 C ATOM 847 O ILE A 56 5.832 -3.796 -18.278 1.00 11.14 O ATOM 848 CB ILE A 56 4.938 -6.854 -17.974 1.00 45.15 C ATOM 849 CG1 ILE A 56 5.259 -8.315 -18.297 1.00 45.30 C ATOM 850 CG2 ILE A 56 4.202 -6.199 -19.134 1.00 25.11 C ATOM 851 CD1 ILE A 56 4.040 -9.209 -18.329 1.00 14.42 C ATOM 0 H ILE A 56 6.455 -7.448 -16.081 1.00 74.33 H new ATOM 0 HA ILE A 56 6.896 -6.129 -18.516 1.00 51.03 H new ATOM 0 HB ILE A 56 4.291 -6.829 -17.097 1.00 45.15 H new ATOM 0 HG12 ILE A 56 5.760 -8.363 -19.264 1.00 45.30 H new ATOM 0 HG13 ILE A 56 5.960 -8.697 -17.555 1.00 45.30 H new ATOM 0 HG21 ILE A 56 3.291 -6.757 -19.348 1.00 25.11 H new ATOM 0 HG22 ILE A 56 3.945 -5.173 -18.869 1.00 25.11 H new ATOM 0 HG23 ILE A 56 4.842 -6.197 -20.016 1.00 25.11 H new ATOM 0 HD11 ILE A 56 4.343 -10.229 -18.564 1.00 14.42 H new ATOM 0 HD12 ILE A 56 3.550 -9.191 -17.356 1.00 14.42 H new ATOM 0 HD13 ILE A 56 3.347 -8.852 -19.091 1.00 14.42 H new ATOM 863 N SER A 57 5.639 -4.318 -16.097 1.00 53.23 N ATOM 864 CA SER A 57 5.291 -2.961 -15.690 1.00 72.45 C ATOM 865 C SER A 57 6.421 -1.990 -16.016 1.00 40.25 C ATOM 866 O SER A 57 6.191 -0.798 -16.222 1.00 43.24 O ATOM 867 CB SER A 57 4.983 -2.919 -14.193 1.00 14.24 C ATOM 868 OG SER A 57 6.102 -3.335 -13.429 1.00 50.55 O ATOM 0 H SER A 57 5.677 -4.991 -15.332 1.00 53.23 H new ATOM 0 HA SER A 57 4.403 -2.657 -16.245 1.00 72.45 H new ATOM 0 HB2 SER A 57 4.699 -1.907 -13.906 1.00 14.24 H new ATOM 0 HB3 SER A 57 4.131 -3.563 -13.976 1.00 14.24 H new ATOM 0 HG SER A 57 5.879 -3.297 -12.475 1.00 50.55 H new ATOM 874 N LYS A 58 7.644 -2.508 -16.062 1.00 34.14 N ATOM 875 CA LYS A 58 8.812 -1.689 -16.364 1.00 33.25 C ATOM 876 C LYS A 58 9.214 -1.834 -17.828 1.00 11.03 C ATOM 877 O LYS A 58 9.473 -0.844 -18.512 1.00 13.43 O ATOM 878 CB LYS A 58 9.983 -2.082 -15.460 1.00 70.45 C ATOM 879 CG LYS A 58 10.038 -1.300 -14.160 1.00 14.12 C ATOM 880 CD LYS A 58 8.749 -1.444 -13.368 1.00 31.12 C ATOM 881 CE LYS A 58 8.797 -0.645 -12.075 1.00 11.33 C ATOM 882 NZ LYS A 58 9.361 -1.442 -10.951 1.00 4.35 N ATOM 0 H LYS A 58 7.852 -3.492 -15.894 1.00 34.14 H new ATOM 0 HA LYS A 58 8.552 -0.647 -16.179 1.00 33.25 H new ATOM 0 HB2 LYS A 58 9.913 -3.146 -15.232 1.00 70.45 H new ATOM 0 HB3 LYS A 58 10.916 -1.933 -16.003 1.00 70.45 H new ATOM 0 HG2 LYS A 58 10.877 -1.651 -13.559 1.00 14.12 H new ATOM 0 HG3 LYS A 58 10.218 -0.247 -14.375 1.00 14.12 H new ATOM 0 HD2 LYS A 58 7.909 -1.107 -13.974 1.00 31.12 H new ATOM 0 HD3 LYS A 58 8.576 -2.496 -13.141 1.00 31.12 H new ATOM 0 HE2 LYS A 58 9.400 0.251 -12.224 1.00 11.33 H new ATOM 0 HE3 LYS A 58 7.792 -0.313 -11.816 1.00 11.33 H new ATOM 0 HZ1 LYS A 58 9.377 -0.862 -10.088 1.00 4.35 H new ATOM 0 HZ2 LYS A 58 8.771 -2.284 -10.792 1.00 4.35 H new ATOM 0 HZ3 LYS A 58 10.330 -1.738 -11.187 1.00 4.35 H new ATOM 896 N VAL A 59 9.263 -3.074 -18.303 1.00 62.34 N ATOM 897 CA VAL A 59 9.631 -3.348 -19.687 1.00 63.33 C ATOM 898 C VAL A 59 8.770 -2.544 -20.655 1.00 33.44 C ATOM 899 O VAL A 59 9.239 -2.112 -21.708 1.00 33.25 O ATOM 900 CB VAL A 59 9.495 -4.846 -20.018 1.00 75.34 C ATOM 901 CG1 VAL A 59 9.855 -5.107 -21.473 1.00 52.20 C ATOM 902 CG2 VAL A 59 10.364 -5.679 -19.088 1.00 13.31 C ATOM 0 H VAL A 59 9.053 -3.905 -17.750 1.00 62.34 H new ATOM 0 HA VAL A 59 10.674 -3.052 -19.801 1.00 63.33 H new ATOM 0 HB VAL A 59 8.456 -5.140 -19.867 1.00 75.34 H new ATOM 0 HG11 VAL A 59 9.753 -6.171 -21.688 1.00 52.20 H new ATOM 0 HG12 VAL A 59 9.186 -4.540 -22.121 1.00 52.20 H new ATOM 0 HG13 VAL A 59 10.884 -4.797 -21.654 1.00 52.20 H new ATOM 0 HG21 VAL A 59 10.255 -6.735 -19.337 1.00 13.31 H new ATOM 0 HG22 VAL A 59 11.407 -5.385 -19.204 1.00 13.31 H new ATOM 0 HG23 VAL A 59 10.053 -5.515 -18.056 1.00 13.31 H new ATOM 912 N ARG A 60 7.507 -2.347 -20.290 1.00 30.41 N ATOM 913 CA ARG A 60 6.579 -1.596 -21.126 1.00 13.41 C ATOM 914 C ARG A 60 7.100 -0.185 -21.385 1.00 22.22 C ATOM 915 O ARG A 60 6.773 0.431 -22.398 1.00 51.03 O ATOM 916 CB ARG A 60 5.202 -1.528 -20.463 1.00 32.13 C ATOM 917 CG ARG A 60 4.397 -2.810 -20.598 1.00 21.42 C ATOM 918 CD ARG A 60 3.712 -2.898 -21.953 1.00 21.14 C ATOM 919 NE ARG A 60 2.478 -2.118 -21.993 1.00 60.34 N ATOM 920 CZ ARG A 60 1.340 -2.514 -21.435 1.00 75.44 C ATOM 921 NH1 ARG A 60 1.279 -3.675 -20.797 1.00 10.33 N ATOM 922 NH2 ARG A 60 0.259 -1.749 -21.515 1.00 54.10 N ATOM 0 H ARG A 60 7.104 -2.697 -19.421 1.00 30.41 H new ATOM 0 HA ARG A 60 6.490 -2.114 -22.081 1.00 13.41 H new ATOM 0 HB2 ARG A 60 5.328 -1.298 -19.405 1.00 32.13 H new ATOM 0 HB3 ARG A 60 4.637 -0.706 -20.902 1.00 32.13 H new ATOM 0 HG2 ARG A 60 5.054 -3.669 -20.465 1.00 21.42 H new ATOM 0 HG3 ARG A 60 3.648 -2.856 -19.807 1.00 21.42 H new ATOM 0 HD2 ARG A 60 4.392 -2.541 -22.727 1.00 21.14 H new ATOM 0 HD3 ARG A 60 3.490 -3.941 -22.180 1.00 21.14 H new ATOM 0 HE ARG A 60 2.491 -1.220 -22.476 1.00 60.34 H new ATOM 0 HH11 ARG A 60 2.108 -4.266 -20.734 1.00 10.33 H new ATOM 0 HH12 ARG A 60 0.403 -3.977 -20.369 1.00 10.33 H new ATOM 0 HH21 ARG A 60 0.302 -0.856 -22.006 1.00 54.10 H new ATOM 0 HH22 ARG A 60 -0.615 -2.054 -21.086 1.00 54.10 H new ATOM 936 N GLU A 61 7.913 0.319 -20.461 1.00 74.20 N ATOM 937 CA GLU A 61 8.478 1.657 -20.590 1.00 34.14 C ATOM 938 C GLU A 61 9.819 1.614 -21.316 1.00 71.40 C ATOM 939 O GLU A 61 10.178 2.546 -22.034 1.00 1.41 O ATOM 940 CB GLU A 61 8.653 2.295 -19.210 1.00 53.41 C ATOM 941 CG GLU A 61 7.445 2.127 -18.304 1.00 12.12 C ATOM 942 CD GLU A 61 6.220 2.855 -18.823 1.00 0.12 C ATOM 943 OE1 GLU A 61 6.349 4.038 -19.203 1.00 34.44 O ATOM 944 OE2 GLU A 61 5.133 2.241 -18.849 1.00 54.21 O ATOM 0 H GLU A 61 8.195 -0.179 -19.616 1.00 74.20 H new ATOM 0 HA GLU A 61 7.786 2.261 -21.177 1.00 34.14 H new ATOM 0 HB2 GLU A 61 9.525 1.856 -18.724 1.00 53.41 H new ATOM 0 HB3 GLU A 61 8.858 3.358 -19.334 1.00 53.41 H new ATOM 0 HG2 GLU A 61 7.217 1.066 -18.203 1.00 12.12 H new ATOM 0 HG3 GLU A 61 7.688 2.497 -17.308 1.00 12.12 H new ATOM 951 N MET A 62 10.555 0.524 -21.123 1.00 73.10 N ATOM 952 CA MET A 62 11.856 0.358 -21.760 1.00 1.30 C ATOM 953 C MET A 62 11.700 0.098 -23.255 1.00 5.20 C ATOM 954 O MET A 62 12.515 0.549 -24.060 1.00 13.51 O ATOM 955 CB MET A 62 12.624 -0.793 -21.108 1.00 4.35 C ATOM 956 CG MET A 62 14.128 -0.576 -21.071 1.00 5.31 C ATOM 957 SD MET A 62 14.661 0.352 -19.620 1.00 2.24 S ATOM 958 CE MET A 62 14.589 2.029 -20.244 1.00 55.24 C ATOM 0 H MET A 62 10.273 -0.257 -20.531 1.00 73.10 H new ATOM 0 HA MET A 62 12.418 1.282 -21.626 1.00 1.30 H new ATOM 0 HB2 MET A 62 12.260 -0.931 -20.090 1.00 4.35 H new ATOM 0 HB3 MET A 62 12.411 -1.714 -21.650 1.00 4.35 H new ATOM 0 HG2 MET A 62 14.631 -1.543 -21.084 1.00 5.31 H new ATOM 0 HG3 MET A 62 14.437 -0.044 -21.971 1.00 5.31 H new ATOM 0 HE1 MET A 62 15.300 2.650 -19.700 1.00 55.24 H new ATOM 0 HE2 MET A 62 14.840 2.034 -21.305 1.00 55.24 H new ATOM 0 HE3 MET A 62 13.583 2.425 -20.107 1.00 55.24 H new ATOM 968 N GLN A 63 10.651 -0.632 -23.618 1.00 53.30 N ATOM 969 CA GLN A 63 10.390 -0.952 -25.017 1.00 4.24 C ATOM 970 C GLN A 63 10.207 0.318 -25.841 1.00 5.32 C ATOM 971 O GLN A 63 10.455 0.330 -27.047 1.00 34.21 O ATOM 972 CB GLN A 63 9.148 -1.835 -25.137 1.00 35.34 C ATOM 973 CG GLN A 63 7.910 -1.236 -24.489 1.00 10.24 C ATOM 974 CD GLN A 63 6.631 -1.621 -25.205 1.00 70.43 C ATOM 975 OE1 GLN A 63 5.888 -2.491 -24.749 1.00 64.44 O ATOM 976 NE2 GLN A 63 6.366 -0.974 -26.334 1.00 65.32 N ATOM 0 H GLN A 63 9.968 -1.013 -22.963 1.00 53.30 H new ATOM 0 HA GLN A 63 11.252 -1.495 -25.406 1.00 4.24 H new ATOM 0 HB2 GLN A 63 8.943 -2.018 -26.192 1.00 35.34 H new ATOM 0 HB3 GLN A 63 9.355 -2.803 -24.680 1.00 35.34 H new ATOM 0 HG2 GLN A 63 7.853 -1.564 -23.451 1.00 10.24 H new ATOM 0 HG3 GLN A 63 8.001 -0.150 -24.476 1.00 10.24 H new ATOM 0 HE21 GLN A 63 7.009 -0.260 -26.676 1.00 65.32 H new ATOM 0 HE22 GLN A 63 5.519 -1.191 -26.859 1.00 65.32 H new ATOM 985 N LYS A 64 9.772 1.387 -25.182 1.00 44.35 N ATOM 986 CA LYS A 64 9.557 2.664 -25.853 1.00 34.01 C ATOM 987 C LYS A 64 10.866 3.434 -25.992 1.00 61.41 C ATOM 988 O LYS A 64 11.041 4.215 -26.927 1.00 61.12 O ATOM 989 CB LYS A 64 8.539 3.504 -25.079 1.00 14.43 C ATOM 990 CG LYS A 64 7.117 3.364 -25.594 1.00 13.31 C ATOM 991 CD LYS A 64 6.362 2.271 -24.857 1.00 33.22 C ATOM 992 CE LYS A 64 4.860 2.506 -24.898 1.00 34.13 C ATOM 993 NZ LYS A 64 4.414 3.437 -23.824 1.00 24.32 N ATOM 0 H LYS A 64 9.561 1.394 -24.184 1.00 44.35 H new ATOM 0 HA LYS A 64 9.169 2.461 -26.851 1.00 34.01 H new ATOM 0 HB2 LYS A 64 8.566 3.215 -24.028 1.00 14.43 H new ATOM 0 HB3 LYS A 64 8.833 4.552 -25.129 1.00 14.43 H new ATOM 0 HG2 LYS A 64 6.592 4.312 -25.478 1.00 13.31 H new ATOM 0 HG3 LYS A 64 7.136 3.139 -26.660 1.00 13.31 H new ATOM 0 HD2 LYS A 64 6.592 1.304 -25.304 1.00 33.22 H new ATOM 0 HD3 LYS A 64 6.697 2.231 -23.820 1.00 33.22 H new ATOM 0 HE2 LYS A 64 4.583 2.914 -25.870 1.00 34.13 H new ATOM 0 HE3 LYS A 64 4.340 1.554 -24.792 1.00 34.13 H new ATOM 0 HZ1 LYS A 64 3.385 3.571 -23.886 1.00 24.32 H new ATOM 0 HZ2 LYS A 64 4.656 3.037 -22.895 1.00 24.32 H new ATOM 0 HZ3 LYS A 64 4.890 4.354 -23.940 1.00 24.32 H new ATOM 1007 N TRP A 65 11.782 3.207 -25.058 1.00 64.40 N ATOM 1008 CA TRP A 65 13.077 3.878 -25.078 1.00 51.22 C ATOM 1009 C TRP A 65 13.920 3.400 -26.255 1.00 60.11 C ATOM 1010 O TRP A 65 14.811 4.110 -26.723 1.00 1.34 O ATOM 1011 CB TRP A 65 13.823 3.631 -23.766 1.00 63.12 C ATOM 1012 CG TRP A 65 13.585 4.695 -22.738 1.00 24.02 C ATOM 1013 CD1 TRP A 65 12.759 4.617 -21.654 1.00 34.33 C ATOM 1014 CD2 TRP A 65 14.179 5.997 -22.699 1.00 4.12 C ATOM 1015 NE1 TRP A 65 12.803 5.792 -20.943 1.00 32.10 N ATOM 1016 CE2 TRP A 65 13.668 6.654 -21.563 1.00 13.52 C ATOM 1017 CE3 TRP A 65 15.095 6.671 -23.511 1.00 61.13 C ATOM 1018 CZ2 TRP A 65 14.041 7.952 -21.223 1.00 24.24 C ATOM 1019 CZ3 TRP A 65 15.465 7.959 -23.172 1.00 72.44 C ATOM 1020 CH2 TRP A 65 14.939 8.588 -22.036 1.00 24.10 C ATOM 0 H TRP A 65 11.652 2.564 -24.277 1.00 64.40 H new ATOM 0 HA TRP A 65 12.902 4.948 -25.192 1.00 51.22 H new ATOM 0 HB2 TRP A 65 13.517 2.667 -23.359 1.00 63.12 H new ATOM 0 HB3 TRP A 65 14.892 3.566 -23.971 1.00 63.12 H new ATOM 0 HD1 TRP A 65 12.159 3.758 -21.393 1.00 34.33 H new ATOM 0 HE1 TRP A 65 12.277 5.990 -20.092 1.00 32.10 H new ATOM 0 HE3 TRP A 65 15.507 6.194 -24.388 1.00 61.13 H new ATOM 0 HZ2 TRP A 65 13.636 8.439 -20.349 1.00 24.24 H new ATOM 0 HZ3 TRP A 65 16.171 8.489 -23.793 1.00 72.44 H new ATOM 0 HH2 TRP A 65 15.248 9.595 -21.797 1.00 24.10 H new ATOM 1031 N LEU A 66 13.634 2.193 -26.730 1.00 71.22 N ATOM 1032 CA LEU A 66 14.366 1.620 -27.854 1.00 65.40 C ATOM 1033 C LEU A 66 13.474 1.509 -29.086 1.00 61.21 C ATOM 1034 O LEU A 66 13.813 0.822 -30.049 1.00 34.50 O ATOM 1035 CB LEU A 66 14.914 0.241 -27.481 1.00 62.22 C ATOM 1036 CG LEU A 66 16.333 0.214 -26.911 1.00 72.24 C ATOM 1037 CD1 LEU A 66 16.511 -0.975 -25.980 1.00 64.21 C ATOM 1038 CD2 LEU A 66 17.358 0.172 -28.035 1.00 42.20 C ATOM 0 H LEU A 66 12.900 1.592 -26.354 1.00 71.22 H new ATOM 0 HA LEU A 66 15.198 2.284 -28.090 1.00 65.40 H new ATOM 0 HB2 LEU A 66 14.242 -0.209 -26.751 1.00 62.22 H new ATOM 0 HB3 LEU A 66 14.889 -0.390 -28.369 1.00 62.22 H new ATOM 0 HG LEU A 66 16.491 1.126 -26.336 1.00 72.24 H new ATOM 0 HD11 LEU A 66 17.526 -0.978 -25.584 1.00 64.21 H new ATOM 0 HD12 LEU A 66 15.801 -0.902 -25.157 1.00 64.21 H new ATOM 0 HD13 LEU A 66 16.334 -1.898 -26.531 1.00 64.21 H new ATOM 0 HD21 LEU A 66 18.362 0.153 -27.611 1.00 42.20 H new ATOM 0 HD22 LEU A 66 17.201 -0.723 -28.637 1.00 42.20 H new ATOM 0 HD23 LEU A 66 17.246 1.056 -28.663 1.00 42.20 H new ATOM 1050 N GLU A 67 12.334 2.192 -29.048 1.00 62.32 N ATOM 1051 CA GLU A 67 11.394 2.170 -30.163 1.00 3.31 C ATOM 1052 C GLU A 67 11.138 3.581 -30.685 1.00 55.02 C ATOM 1053 O GLU A 67 11.018 3.797 -31.892 1.00 1.33 O ATOM 1054 CB GLU A 67 10.075 1.525 -29.734 1.00 53.40 C ATOM 1055 CG GLU A 67 9.004 1.555 -30.812 1.00 1.11 C ATOM 1056 CD GLU A 67 7.916 0.524 -30.582 1.00 63.01 C ATOM 1057 OE1 GLU A 67 7.511 0.338 -29.416 1.00 23.32 O ATOM 1058 OE2 GLU A 67 7.470 -0.097 -31.570 1.00 12.52 O ATOM 0 H GLU A 67 12.039 2.767 -28.258 1.00 62.32 H new ATOM 0 HA GLU A 67 11.834 1.578 -30.966 1.00 3.31 H new ATOM 0 HB2 GLU A 67 10.262 0.490 -29.448 1.00 53.40 H new ATOM 0 HB3 GLU A 67 9.701 2.037 -28.848 1.00 53.40 H new ATOM 0 HG2 GLU A 67 8.557 2.548 -30.847 1.00 1.11 H new ATOM 0 HG3 GLU A 67 9.466 1.379 -31.783 1.00 1.11 H new ATOM 1065 N THR A 68 11.053 4.539 -29.768 1.00 12.35 N ATOM 1066 CA THR A 68 10.809 5.929 -30.134 1.00 35.44 C ATOM 1067 C THR A 68 11.992 6.813 -29.757 1.00 31.31 C ATOM 1068 O THR A 68 12.220 7.855 -30.371 1.00 1.23 O ATOM 1069 CB THR A 68 9.538 6.474 -29.454 1.00 23.31 C ATOM 1070 OG1 THR A 68 9.770 6.648 -28.052 1.00 15.54 O ATOM 1071 CG2 THR A 68 8.364 5.530 -29.666 1.00 11.14 C ATOM 0 H THR A 68 11.150 4.378 -28.765 1.00 12.35 H new ATOM 0 HA THR A 68 10.672 5.952 -31.215 1.00 35.44 H new ATOM 0 HB THR A 68 9.295 7.437 -29.904 1.00 23.31 H new ATOM 0 HG1 THR A 68 10.188 5.840 -27.687 1.00 15.54 H new ATOM 0 HG21 THR A 68 7.478 5.936 -29.177 1.00 11.14 H new ATOM 0 HG22 THR A 68 8.172 5.422 -30.734 1.00 11.14 H new ATOM 0 HG23 THR A 68 8.599 4.555 -29.239 1.00 11.14 H new ATOM 1079 N ARG A 69 12.742 6.390 -28.745 1.00 22.51 N ATOM 1080 CA ARG A 69 13.902 7.144 -28.286 1.00 65.14 C ATOM 1081 C ARG A 69 15.198 6.468 -28.726 1.00 3.44 C ATOM 1082 O ARG A 69 15.177 5.453 -29.419 1.00 73.51 O ATOM 1083 CB ARG A 69 13.878 7.282 -26.763 1.00 51.41 C ATOM 1084 CG ARG A 69 12.591 7.889 -26.227 1.00 63.23 C ATOM 1085 CD ARG A 69 12.481 9.364 -26.581 1.00 21.33 C ATOM 1086 NE ARG A 69 13.423 10.181 -25.820 1.00 35.33 N ATOM 1087 CZ ARG A 69 13.437 11.509 -25.852 1.00 75.43 C ATOM 1088 NH1 ARG A 69 12.564 12.166 -26.604 1.00 63.21 N ATOM 1089 NH2 ARG A 69 14.324 12.182 -25.131 1.00 61.24 N ATOM 0 H ARG A 69 12.567 5.529 -28.227 1.00 22.51 H new ATOM 0 HA ARG A 69 13.859 8.137 -28.734 1.00 65.14 H new ATOM 0 HB2 ARG A 69 14.020 6.298 -26.315 1.00 51.41 H new ATOM 0 HB3 ARG A 69 14.719 7.900 -26.449 1.00 51.41 H new ATOM 0 HG2 ARG A 69 11.736 7.351 -26.636 1.00 63.23 H new ATOM 0 HG3 ARG A 69 12.555 7.770 -25.144 1.00 63.23 H new ATOM 0 HD2 ARG A 69 12.666 9.496 -27.647 1.00 21.33 H new ATOM 0 HD3 ARG A 69 11.465 9.708 -26.389 1.00 21.33 H new ATOM 0 HE ARG A 69 14.108 9.706 -25.232 1.00 35.33 H new ATOM 0 HH11 ARG A 69 11.880 11.652 -27.159 1.00 63.21 H new ATOM 0 HH12 ARG A 69 12.576 13.186 -26.627 1.00 63.21 H new ATOM 0 HH21 ARG A 69 14.996 11.680 -24.551 1.00 61.24 H new ATOM 0 HH22 ARG A 69 14.334 13.202 -25.156 1.00 61.24 H new ATOM 1103 N GLY A 70 16.327 7.041 -28.317 1.00 15.22 N ATOM 1104 CA GLY A 70 17.616 6.482 -28.678 1.00 72.40 C ATOM 1105 C GLY A 70 18.680 7.546 -28.858 1.00 51.01 C ATOM 1106 O GLY A 70 18.431 8.728 -28.623 1.00 51.41 O ATOM 0 H GLY A 70 16.371 7.882 -27.742 1.00 15.22 H new ATOM 0 HA2 GLY A 70 17.934 5.782 -27.906 1.00 72.40 H new ATOM 0 HA3 GLY A 70 17.516 5.913 -29.602 1.00 72.40 H new ATOM 1110 N SER A 71 19.870 7.126 -29.275 1.00 2.22 N ATOM 1111 CA SER A 71 20.978 8.052 -29.481 1.00 22.42 C ATOM 1112 C SER A 71 20.791 8.845 -30.771 1.00 31.34 C ATOM 1113 O SER A 71 20.018 8.471 -31.653 1.00 33.32 O ATOM 1114 CB SER A 71 22.305 7.291 -29.525 1.00 34.43 C ATOM 1115 OG SER A 71 23.114 7.611 -28.407 1.00 11.45 O ATOM 0 H SER A 71 20.092 6.151 -29.477 1.00 2.22 H new ATOM 0 HA SER A 71 20.995 8.751 -28.645 1.00 22.42 H new ATOM 0 HB2 SER A 71 22.112 6.218 -29.543 1.00 34.43 H new ATOM 0 HB3 SER A 71 22.837 7.535 -30.445 1.00 34.43 H new ATOM 0 HG SER A 71 23.955 7.111 -28.458 1.00 11.45 H new ATOM 1121 N PRO A 72 21.516 9.968 -30.884 1.00 74.42 N ATOM 1122 CA PRO A 72 21.448 10.838 -32.062 1.00 71.30 C ATOM 1123 C PRO A 72 22.072 10.194 -33.295 1.00 61.52 C ATOM 1124 O PRO A 72 21.584 10.368 -34.411 1.00 70.32 O ATOM 1125 CB PRO A 72 22.250 12.071 -31.639 1.00 22.32 C ATOM 1126 CG PRO A 72 23.188 11.572 -30.594 1.00 51.10 C ATOM 1127 CD PRO A 72 22.457 10.474 -29.872 1.00 3.12 C ATOM 0 HA PRO A 72 20.419 11.059 -32.347 1.00 71.30 H new ATOM 0 HB2 PRO A 72 22.790 12.501 -32.483 1.00 22.32 H new ATOM 0 HB3 PRO A 72 21.598 12.852 -31.246 1.00 22.32 H new ATOM 0 HG2 PRO A 72 24.109 11.199 -31.042 1.00 51.10 H new ATOM 0 HG3 PRO A 72 23.469 12.371 -29.908 1.00 51.10 H new ATOM 0 HD2 PRO A 72 23.138 9.694 -29.531 1.00 3.12 H new ATOM 0 HD3 PRO A 72 21.936 10.850 -28.991 1.00 3.12 H new ATOM 1135 N GLU A 73 23.153 9.449 -33.085 1.00 61.13 N ATOM 1136 CA GLU A 73 23.843 8.779 -34.182 1.00 3.45 C ATOM 1137 C GLU A 73 22.918 7.790 -34.884 1.00 54.30 C ATOM 1138 O GLU A 73 22.653 7.913 -36.080 1.00 2.11 O ATOM 1139 CB GLU A 73 25.086 8.052 -33.663 1.00 14.00 C ATOM 1140 CG GLU A 73 26.318 8.260 -34.528 1.00 33.43 C ATOM 1141 CD GLU A 73 26.035 8.058 -36.004 1.00 22.12 C ATOM 1142 OE1 GLU A 73 25.624 9.033 -36.667 1.00 35.11 O ATOM 1143 OE2 GLU A 73 26.225 6.926 -36.496 1.00 3.04 O ATOM 0 H GLU A 73 23.569 9.294 -32.167 1.00 61.13 H new ATOM 0 HA GLU A 73 24.148 9.538 -34.903 1.00 3.45 H new ATOM 0 HB2 GLU A 73 25.301 8.395 -32.651 1.00 14.00 H new ATOM 0 HB3 GLU A 73 24.873 6.985 -33.600 1.00 14.00 H new ATOM 0 HG2 GLU A 73 26.702 9.268 -34.370 1.00 33.43 H new ATOM 0 HG3 GLU A 73 27.099 7.568 -34.214 1.00 33.43 H new ATOM 1150 N SER A 74 22.429 6.810 -34.132 1.00 32.43 N ATOM 1151 CA SER A 74 21.536 5.796 -34.682 1.00 42.31 C ATOM 1152 C SER A 74 20.129 6.356 -34.870 1.00 22.45 C ATOM 1153 O SER A 74 19.714 7.273 -34.160 1.00 75.43 O ATOM 1154 CB SER A 74 21.493 4.572 -33.765 1.00 53.33 C ATOM 1155 OG SER A 74 21.502 4.956 -32.401 1.00 53.32 O ATOM 0 H SER A 74 22.636 6.696 -33.140 1.00 32.43 H new ATOM 0 HA SER A 74 21.922 5.497 -35.656 1.00 42.31 H new ATOM 0 HB2 SER A 74 20.597 3.987 -33.976 1.00 53.33 H new ATOM 0 HB3 SER A 74 22.349 3.929 -33.971 1.00 53.33 H new ATOM 0 HG SER A 74 21.472 4.156 -31.836 1.00 53.32 H new ATOM 1161 N HIS A 75 19.400 5.797 -35.830 1.00 60.32 N ATOM 1162 CA HIS A 75 18.039 6.238 -36.112 1.00 13.42 C ATOM 1163 C HIS A 75 17.086 5.049 -36.188 1.00 23.12 C ATOM 1164 O HIS A 75 17.305 4.115 -36.960 1.00 51.23 O ATOM 1165 CB HIS A 75 17.996 7.025 -37.422 1.00 42.30 C ATOM 1166 CG HIS A 75 16.803 7.923 -37.543 1.00 63.12 C ATOM 1167 ND1 HIS A 75 16.461 8.853 -36.585 1.00 2.33 N ATOM 1168 CD2 HIS A 75 15.871 8.030 -38.519 1.00 23.21 C ATOM 1169 CE1 HIS A 75 15.369 9.493 -36.965 1.00 23.52 C ATOM 1170 NE2 HIS A 75 14.991 9.012 -38.136 1.00 24.15 N ATOM 0 H HIS A 75 19.729 5.037 -36.426 1.00 60.32 H new ATOM 0 HA HIS A 75 17.718 6.886 -35.297 1.00 13.42 H new ATOM 0 HB2 HIS A 75 18.902 7.625 -37.506 1.00 42.30 H new ATOM 0 HB3 HIS A 75 17.999 6.325 -38.257 1.00 42.30 H new ATOM 0 HD2 HIS A 75 15.828 7.451 -39.429 1.00 23.21 H new ATOM 0 HE1 HIS A 75 14.871 10.276 -36.413 1.00 23.52 H new ATOM 0 HE2 HIS A 75 14.178 9.320 -38.669 1.00 24.15 H new ATOM 1178 N ILE A 76 16.031 5.090 -35.381 1.00 61.45 N ATOM 1179 CA ILE A 76 15.046 4.015 -35.358 1.00 41.43 C ATOM 1180 C ILE A 76 13.806 4.390 -36.162 1.00 74.44 C ATOM 1181 O ILE A 76 12.932 5.108 -35.676 1.00 74.45 O ATOM 1182 CB ILE A 76 14.625 3.668 -33.918 1.00 42.50 C ATOM 1183 CG1 ILE A 76 15.841 3.226 -33.101 1.00 34.50 C ATOM 1184 CG2 ILE A 76 13.560 2.582 -33.925 1.00 0.24 C ATOM 1185 CD1 ILE A 76 15.737 3.565 -31.631 1.00 13.34 C ATOM 0 H ILE A 76 15.836 5.855 -34.735 1.00 61.45 H new ATOM 0 HA ILE A 76 15.519 3.143 -35.809 1.00 41.43 H new ATOM 0 HB ILE A 76 14.203 4.559 -33.453 1.00 42.50 H new ATOM 0 HG12 ILE A 76 15.969 2.149 -33.209 1.00 34.50 H new ATOM 0 HG13 ILE A 76 16.735 3.696 -33.512 1.00 34.50 H new ATOM 0 HG21 ILE A 76 13.273 2.348 -32.900 1.00 0.24 H new ATOM 0 HG22 ILE A 76 12.687 2.932 -34.476 1.00 0.24 H new ATOM 0 HG23 ILE A 76 13.956 1.687 -34.404 1.00 0.24 H new ATOM 0 HD11 ILE A 76 16.633 3.222 -31.114 1.00 13.34 H new ATOM 0 HD12 ILE A 76 15.640 4.644 -31.512 1.00 13.34 H new ATOM 0 HD13 ILE A 76 14.862 3.073 -31.205 1.00 13.34 H new ATOM 1197 N ASP A 77 13.735 3.897 -37.394 1.00 31.30 N ATOM 1198 CA ASP A 77 12.600 4.177 -38.266 1.00 33.45 C ATOM 1199 C ASP A 77 11.439 3.234 -37.965 1.00 74.22 C ATOM 1200 O ASP A 77 10.278 3.564 -38.207 1.00 54.23 O ATOM 1201 CB ASP A 77 13.012 4.047 -39.733 1.00 33.03 C ATOM 1202 CG ASP A 77 11.933 4.532 -40.682 1.00 25.31 C ATOM 1203 OD1 ASP A 77 11.639 5.746 -40.676 1.00 65.32 O ATOM 1204 OD2 ASP A 77 11.384 3.697 -41.431 1.00 2.41 O ATOM 0 H ASP A 77 14.450 3.301 -37.811 1.00 31.30 H new ATOM 0 HA ASP A 77 12.272 5.200 -38.079 1.00 33.45 H new ATOM 0 HB2 ASP A 77 13.925 4.618 -39.903 1.00 33.03 H new ATOM 0 HB3 ASP A 77 13.243 3.004 -39.952 1.00 33.03 H new ATOM 1209 N LYS A 78 11.760 2.058 -37.437 1.00 73.41 N ATOM 1210 CA LYS A 78 10.745 1.066 -37.103 1.00 33.40 C ATOM 1211 C LYS A 78 11.296 0.030 -36.128 1.00 61.13 C ATOM 1212 O LYS A 78 12.461 -0.357 -36.213 1.00 21.11 O ATOM 1213 CB LYS A 78 10.243 0.372 -38.371 1.00 63.34 C ATOM 1214 CG LYS A 78 11.356 -0.037 -39.322 1.00 13.34 C ATOM 1215 CD LYS A 78 10.910 -1.148 -40.257 1.00 41.02 C ATOM 1216 CE LYS A 78 10.055 -0.610 -41.394 1.00 40.12 C ATOM 1217 NZ LYS A 78 9.816 -1.639 -42.444 1.00 25.02 N ATOM 0 H LYS A 78 12.716 1.768 -37.231 1.00 73.41 H new ATOM 0 HA LYS A 78 9.912 1.582 -36.625 1.00 33.40 H new ATOM 0 HB2 LYS A 78 9.673 -0.514 -38.089 1.00 63.34 H new ATOM 0 HB3 LYS A 78 9.557 1.039 -38.893 1.00 63.34 H new ATOM 0 HG2 LYS A 78 11.672 0.827 -39.907 1.00 13.34 H new ATOM 0 HG3 LYS A 78 12.222 -0.368 -38.749 1.00 13.34 H new ATOM 0 HD2 LYS A 78 11.785 -1.654 -40.666 1.00 41.02 H new ATOM 0 HD3 LYS A 78 10.345 -1.892 -39.696 1.00 41.02 H new ATOM 0 HE2 LYS A 78 9.099 -0.266 -40.998 1.00 40.12 H new ATOM 0 HE3 LYS A 78 10.546 0.256 -41.839 1.00 40.12 H new ATOM 0 HZ1 LYS A 78 9.230 -1.233 -43.201 1.00 25.02 H new ATOM 0 HZ2 LYS A 78 10.726 -1.949 -42.840 1.00 25.02 H new ATOM 0 HZ3 LYS A 78 9.325 -2.455 -42.025 1.00 25.02 H new ATOM 1231 N ALA A 79 10.451 -0.416 -35.205 1.00 12.33 N ATOM 1232 CA ALA A 79 10.853 -1.409 -34.217 1.00 30.13 C ATOM 1233 C ALA A 79 9.728 -2.403 -33.948 1.00 11.32 C ATOM 1234 O ALA A 79 8.641 -2.291 -34.512 1.00 15.20 O ATOM 1235 CB ALA A 79 11.277 -0.727 -32.925 1.00 2.33 C ATOM 0 H ALA A 79 9.483 -0.105 -35.121 1.00 12.33 H new ATOM 0 HA ALA A 79 11.702 -1.961 -34.619 1.00 30.13 H new ATOM 0 HB1 ALA A 79 11.575 -1.481 -32.196 1.00 2.33 H new ATOM 0 HB2 ALA A 79 12.118 -0.062 -33.123 1.00 2.33 H new ATOM 0 HB3 ALA A 79 10.443 -0.148 -32.528 1.00 2.33 H new ATOM 1241 N ASN A 80 9.998 -3.375 -33.083 1.00 34.12 N ATOM 1242 CA ASN A 80 9.008 -4.390 -32.740 1.00 54.32 C ATOM 1243 C ASN A 80 9.533 -5.316 -31.648 1.00 4.11 C ATOM 1244 O ASN A 80 10.737 -5.558 -31.550 1.00 74.35 O ATOM 1245 CB ASN A 80 8.633 -5.205 -33.979 1.00 72.23 C ATOM 1246 CG ASN A 80 7.235 -5.787 -33.888 1.00 25.34 C ATOM 1247 OD1 ASN A 80 6.252 -5.055 -33.772 1.00 25.23 O ATOM 1248 ND2 ASN A 80 7.142 -7.111 -33.939 1.00 15.12 N ATOM 0 H ASN A 80 10.894 -3.481 -32.607 1.00 34.12 H new ATOM 0 HA ASN A 80 8.120 -3.883 -32.364 1.00 54.32 H new ATOM 0 HB2 ASN A 80 8.702 -4.570 -34.862 1.00 72.23 H new ATOM 0 HB3 ASN A 80 9.352 -6.013 -34.110 1.00 72.23 H new ATOM 0 HD21 ASN A 80 6.228 -7.561 -33.881 1.00 15.12 H new ATOM 0 HD22 ASN A 80 7.984 -7.678 -34.036 1.00 15.12 H new ATOM 1255 N PHE A 81 8.623 -5.832 -30.828 1.00 43.43 N ATOM 1256 CA PHE A 81 8.995 -6.731 -29.742 1.00 73.23 C ATOM 1257 C PHE A 81 8.643 -8.175 -30.088 1.00 33.21 C ATOM 1258 O PHE A 81 7.789 -8.433 -30.937 1.00 42.50 O ATOM 1259 CB PHE A 81 8.292 -6.319 -28.447 1.00 72.02 C ATOM 1260 CG PHE A 81 6.814 -6.102 -28.610 1.00 24.01 C ATOM 1261 CD1 PHE A 81 5.930 -7.165 -28.516 1.00 3.42 C ATOM 1262 CD2 PHE A 81 6.310 -4.835 -28.857 1.00 60.54 C ATOM 1263 CE1 PHE A 81 4.570 -6.968 -28.665 1.00 21.34 C ATOM 1264 CE2 PHE A 81 4.951 -4.633 -29.007 1.00 20.14 C ATOM 1265 CZ PHE A 81 4.080 -5.701 -28.911 1.00 41.14 C ATOM 0 H PHE A 81 7.623 -5.643 -30.895 1.00 43.43 H new ATOM 0 HA PHE A 81 10.073 -6.662 -29.599 1.00 73.23 H new ATOM 0 HB2 PHE A 81 8.457 -7.088 -27.693 1.00 72.02 H new ATOM 0 HB3 PHE A 81 8.747 -5.402 -28.072 1.00 72.02 H new ATOM 0 HD1 PHE A 81 6.308 -8.158 -28.324 1.00 3.42 H new ATOM 0 HD2 PHE A 81 6.986 -3.996 -28.933 1.00 60.54 H new ATOM 0 HE1 PHE A 81 3.891 -7.805 -28.589 1.00 21.34 H new ATOM 0 HE2 PHE A 81 4.570 -3.641 -29.199 1.00 20.14 H new ATOM 0 HZ PHE A 81 3.018 -5.545 -29.028 1.00 41.14 H new ATOM 1275 N LYS A 82 9.307 -9.115 -29.424 1.00 3.22 N ATOM 1276 CA LYS A 82 9.066 -10.534 -29.658 1.00 42.42 C ATOM 1277 C LYS A 82 8.310 -11.157 -28.490 1.00 30.34 C ATOM 1278 O LYS A 82 7.937 -10.468 -27.541 1.00 73.33 O ATOM 1279 CB LYS A 82 10.391 -11.269 -29.873 1.00 2.44 C ATOM 1280 CG LYS A 82 11.236 -10.686 -30.992 1.00 52.25 C ATOM 1281 CD LYS A 82 12.115 -11.744 -31.637 1.00 21.44 C ATOM 1282 CE LYS A 82 11.376 -12.489 -32.738 1.00 14.42 C ATOM 1283 NZ LYS A 82 12.314 -13.139 -33.694 1.00 54.35 N ATOM 0 H LYS A 82 10.017 -8.919 -28.719 1.00 3.22 H new ATOM 0 HA LYS A 82 8.455 -10.630 -30.556 1.00 42.42 H new ATOM 0 HB2 LYS A 82 10.964 -11.245 -28.946 1.00 2.44 H new ATOM 0 HB3 LYS A 82 10.184 -12.316 -30.093 1.00 2.44 H new ATOM 0 HG2 LYS A 82 10.586 -10.242 -31.746 1.00 52.25 H new ATOM 0 HG3 LYS A 82 11.860 -9.884 -30.598 1.00 52.25 H new ATOM 0 HD2 LYS A 82 13.007 -11.274 -32.050 1.00 21.44 H new ATOM 0 HD3 LYS A 82 12.450 -12.452 -30.879 1.00 21.44 H new ATOM 0 HE2 LYS A 82 10.729 -13.245 -32.294 1.00 14.42 H new ATOM 0 HE3 LYS A 82 10.732 -11.795 -33.277 1.00 14.42 H new ATOM 0 HZ1 LYS A 82 11.771 -13.636 -34.429 1.00 54.35 H new ATOM 0 HZ2 LYS A 82 12.915 -12.415 -34.137 1.00 54.35 H new ATOM 0 HZ3 LYS A 82 12.912 -13.821 -33.185 1.00 54.35 H new ATOM 1297 N ASN A 83 8.089 -12.466 -28.564 1.00 50.24 N ATOM 1298 CA ASN A 83 7.378 -13.182 -27.512 1.00 21.33 C ATOM 1299 C ASN A 83 8.231 -13.284 -26.251 1.00 64.21 C ATOM 1300 O ASN A 83 9.059 -14.185 -26.122 1.00 22.41 O ATOM 1301 CB ASN A 83 6.989 -14.582 -27.992 1.00 13.10 C ATOM 1302 CG ASN A 83 6.187 -15.346 -26.956 1.00 63.41 C ATOM 1303 OD1 ASN A 83 6.597 -16.415 -26.503 1.00 70.42 O ATOM 1304 ND2 ASN A 83 5.038 -14.800 -26.576 1.00 70.44 N ATOM 0 H ASN A 83 8.392 -13.052 -29.342 1.00 50.24 H new ATOM 0 HA ASN A 83 6.474 -12.622 -27.274 1.00 21.33 H new ATOM 0 HB2 ASN A 83 6.407 -14.500 -28.910 1.00 13.10 H new ATOM 0 HB3 ASN A 83 7.891 -15.143 -28.236 1.00 13.10 H new ATOM 0 HD21 ASN A 83 4.456 -15.268 -25.882 1.00 70.44 H new ATOM 0 HD22 ASN A 83 4.738 -13.912 -26.978 1.00 70.44 H new ATOM 1311 N GLU A 84 8.022 -12.354 -25.325 1.00 4.12 N ATOM 1312 CA GLU A 84 8.773 -12.339 -24.075 1.00 30.54 C ATOM 1313 C GLU A 84 8.701 -13.697 -23.381 1.00 51.11 C ATOM 1314 O GLU A 84 7.726 -14.434 -23.533 1.00 2.34 O ATOM 1315 CB GLU A 84 8.236 -11.250 -23.144 1.00 40.11 C ATOM 1316 CG GLU A 84 6.758 -11.397 -22.824 1.00 52.45 C ATOM 1317 CD GLU A 84 5.872 -10.654 -23.806 1.00 62.44 C ATOM 1318 OE1 GLU A 84 5.605 -9.457 -23.577 1.00 14.42 O ATOM 1319 OE2 GLU A 84 5.447 -11.272 -24.805 1.00 61.31 O ATOM 0 H GLU A 84 7.339 -11.602 -25.416 1.00 4.12 H new ATOM 0 HA GLU A 84 9.815 -12.124 -24.310 1.00 30.54 H new ATOM 0 HB2 GLU A 84 8.804 -11.267 -22.214 1.00 40.11 H new ATOM 0 HB3 GLU A 84 8.405 -10.276 -23.603 1.00 40.11 H new ATOM 0 HG2 GLU A 84 6.492 -12.454 -22.829 1.00 52.45 H new ATOM 0 HG3 GLU A 84 6.569 -11.025 -21.817 1.00 52.45 H new ATOM 1326 N LYS A 85 9.740 -14.021 -22.620 1.00 23.52 N ATOM 1327 CA LYS A 85 9.797 -15.289 -21.901 1.00 70.04 C ATOM 1328 C LYS A 85 9.614 -15.074 -20.402 1.00 43.44 C ATOM 1329 O LYS A 85 10.566 -14.753 -19.691 1.00 2.23 O ATOM 1330 CB LYS A 85 11.131 -15.991 -22.168 1.00 13.42 C ATOM 1331 CG LYS A 85 11.106 -17.479 -21.867 1.00 33.22 C ATOM 1332 CD LYS A 85 10.385 -18.256 -22.956 1.00 31.24 C ATOM 1333 CE LYS A 85 9.994 -19.648 -22.482 1.00 13.55 C ATOM 1334 NZ LYS A 85 11.075 -20.642 -22.727 1.00 52.34 N ATOM 0 H LYS A 85 10.555 -13.423 -22.485 1.00 23.52 H new ATOM 0 HA LYS A 85 8.984 -15.919 -22.261 1.00 70.04 H new ATOM 0 HB2 LYS A 85 11.406 -15.845 -23.212 1.00 13.42 H new ATOM 0 HB3 LYS A 85 11.907 -15.520 -21.565 1.00 13.42 H new ATOM 0 HG2 LYS A 85 12.127 -17.849 -21.770 1.00 33.22 H new ATOM 0 HG3 LYS A 85 10.613 -17.649 -20.910 1.00 33.22 H new ATOM 0 HD2 LYS A 85 9.492 -17.711 -23.263 1.00 31.24 H new ATOM 0 HD3 LYS A 85 11.027 -18.336 -23.833 1.00 31.24 H new ATOM 0 HE2 LYS A 85 9.763 -19.617 -21.417 1.00 13.55 H new ATOM 0 HE3 LYS A 85 9.086 -19.965 -22.996 1.00 13.55 H new ATOM 0 HZ1 LYS A 85 10.769 -21.577 -22.390 1.00 52.34 H new ATOM 0 HZ2 LYS A 85 11.278 -20.690 -23.746 1.00 52.34 H new ATOM 0 HZ3 LYS A 85 11.934 -20.354 -22.216 1.00 52.34 H new ATOM 1348 N VAL A 86 8.385 -15.253 -19.929 1.00 24.33 N ATOM 1349 CA VAL A 86 8.079 -15.081 -18.514 1.00 32.13 C ATOM 1350 C VAL A 86 8.914 -16.022 -17.652 1.00 53.30 C ATOM 1351 O VAL A 86 8.948 -17.230 -17.888 1.00 42.33 O ATOM 1352 CB VAL A 86 6.586 -15.331 -18.229 1.00 11.45 C ATOM 1353 CG1 VAL A 86 6.254 -14.991 -16.784 1.00 0.35 C ATOM 1354 CG2 VAL A 86 5.719 -14.527 -19.186 1.00 63.14 C ATOM 0 H VAL A 86 7.585 -15.517 -20.505 1.00 24.33 H new ATOM 0 HA VAL A 86 8.323 -14.049 -18.261 1.00 32.13 H new ATOM 0 HB VAL A 86 6.377 -16.389 -18.386 1.00 11.45 H new ATOM 0 HG11 VAL A 86 5.195 -15.174 -16.601 1.00 0.35 H new ATOM 0 HG12 VAL A 86 6.850 -15.614 -16.117 1.00 0.35 H new ATOM 0 HG13 VAL A 86 6.479 -13.941 -16.596 1.00 0.35 H new ATOM 0 HG21 VAL A 86 4.667 -14.716 -18.970 1.00 63.14 H new ATOM 0 HG22 VAL A 86 5.930 -13.465 -19.063 1.00 63.14 H new ATOM 0 HG23 VAL A 86 5.938 -14.824 -20.212 1.00 63.14 H new ATOM 1364 N ILE A 87 9.585 -15.460 -16.652 1.00 52.02 N ATOM 1365 CA ILE A 87 10.418 -16.249 -15.754 1.00 25.10 C ATOM 1366 C ILE A 87 10.169 -15.871 -14.298 1.00 10.20 C ATOM 1367 O ILE A 87 9.451 -14.912 -14.008 1.00 64.52 O ATOM 1368 CB ILE A 87 11.915 -16.068 -16.070 1.00 72.35 C ATOM 1369 CG1 ILE A 87 12.311 -14.596 -15.944 1.00 0.14 C ATOM 1370 CG2 ILE A 87 12.228 -16.588 -17.466 1.00 33.35 C ATOM 1371 CD1 ILE A 87 13.774 -14.337 -16.226 1.00 25.43 C ATOM 0 H ILE A 87 9.568 -14.462 -16.444 1.00 52.02 H new ATOM 0 HA ILE A 87 10.146 -17.293 -15.908 1.00 25.10 H new ATOM 0 HB ILE A 87 12.495 -16.644 -15.349 1.00 72.35 H new ATOM 0 HG12 ILE A 87 11.707 -14.005 -16.633 1.00 0.14 H new ATOM 0 HG13 ILE A 87 12.077 -14.250 -14.937 1.00 0.14 H new ATOM 0 HG21 ILE A 87 13.289 -16.453 -17.675 1.00 33.35 H new ATOM 0 HG22 ILE A 87 11.978 -17.647 -17.524 1.00 33.35 H new ATOM 0 HG23 ILE A 87 11.641 -16.036 -18.200 1.00 33.35 H new ATOM 0 HD11 ILE A 87 13.982 -13.273 -16.118 1.00 25.43 H new ATOM 0 HD12 ILE A 87 14.386 -14.900 -15.521 1.00 25.43 H new ATOM 0 HD13 ILE A 87 14.010 -14.651 -17.243 1.00 25.43 H new ATOM 1383 N LEU A 88 10.767 -16.628 -13.385 1.00 60.10 N ATOM 1384 CA LEU A 88 10.612 -16.372 -11.957 1.00 52.33 C ATOM 1385 C LEU A 88 11.827 -15.637 -11.401 1.00 23.33 C ATOM 1386 O LEU A 88 11.710 -14.830 -10.479 1.00 0.51 O ATOM 1387 CB LEU A 88 10.406 -17.686 -11.202 1.00 71.14 C ATOM 1388 CG LEU A 88 9.123 -18.452 -11.526 1.00 14.12 C ATOM 1389 CD1 LEU A 88 7.932 -17.507 -11.562 1.00 14.14 C ATOM 1390 CD2 LEU A 88 9.261 -19.189 -12.850 1.00 33.21 C ATOM 0 H LEU A 88 11.364 -17.424 -13.608 1.00 60.10 H new ATOM 0 HA LEU A 88 9.734 -15.741 -11.819 1.00 52.33 H new ATOM 0 HB2 LEU A 88 11.256 -18.337 -11.407 1.00 71.14 H new ATOM 0 HB3 LEU A 88 10.418 -17.473 -10.133 1.00 71.14 H new ATOM 0 HG LEU A 88 8.954 -19.188 -10.740 1.00 14.12 H new ATOM 0 HD11 LEU A 88 7.028 -18.070 -11.794 1.00 14.14 H new ATOM 0 HD12 LEU A 88 7.820 -17.025 -10.591 1.00 14.14 H new ATOM 0 HD13 LEU A 88 8.093 -16.748 -12.327 1.00 14.14 H new ATOM 0 HD21 LEU A 88 8.338 -19.728 -13.064 1.00 33.21 H new ATOM 0 HD22 LEU A 88 9.455 -18.472 -13.647 1.00 33.21 H new ATOM 0 HD23 LEU A 88 10.089 -19.896 -12.788 1.00 33.21 H new ATOM 1402 N LYS A 89 12.995 -15.922 -11.968 1.00 13.51 N ATOM 1403 CA LYS A 89 14.233 -15.286 -11.532 1.00 34.31 C ATOM 1404 C LYS A 89 14.979 -14.679 -12.716 1.00 32.05 C ATOM 1405 O LYS A 89 15.045 -15.274 -13.792 1.00 62.10 O ATOM 1406 CB LYS A 89 15.127 -16.302 -10.818 1.00 63.21 C ATOM 1407 CG LYS A 89 15.606 -17.429 -11.717 1.00 54.04 C ATOM 1408 CD LYS A 89 15.886 -18.695 -10.924 1.00 54.44 C ATOM 1409 CE LYS A 89 16.965 -19.538 -11.584 1.00 64.44 C ATOM 1410 NZ LYS A 89 16.404 -20.440 -12.628 1.00 30.41 N ATOM 0 H LYS A 89 13.110 -16.589 -12.731 1.00 13.51 H new ATOM 0 HA LYS A 89 13.977 -14.485 -10.838 1.00 34.31 H new ATOM 0 HB2 LYS A 89 15.993 -15.784 -10.406 1.00 63.21 H new ATOM 0 HB3 LYS A 89 14.579 -16.727 -9.977 1.00 63.21 H new ATOM 0 HG2 LYS A 89 14.853 -17.634 -12.477 1.00 54.04 H new ATOM 0 HG3 LYS A 89 16.511 -17.119 -12.240 1.00 54.04 H new ATOM 0 HD2 LYS A 89 16.196 -18.431 -9.913 1.00 54.44 H new ATOM 0 HD3 LYS A 89 14.970 -19.279 -10.834 1.00 54.44 H new ATOM 0 HE2 LYS A 89 17.713 -18.884 -12.033 1.00 64.44 H new ATOM 0 HE3 LYS A 89 17.475 -20.133 -10.826 1.00 64.44 H new ATOM 0 HZ1 LYS A 89 17.172 -20.998 -13.054 1.00 30.41 H new ATOM 0 HZ2 LYS A 89 15.709 -21.081 -12.196 1.00 30.41 H new ATOM 0 HZ3 LYS A 89 15.939 -19.872 -13.365 1.00 30.41 H new ATOM 1424 N LEU A 90 15.540 -13.493 -12.510 1.00 11.24 N ATOM 1425 CA LEU A 90 16.283 -12.805 -13.560 1.00 25.43 C ATOM 1426 C LEU A 90 17.588 -13.533 -13.868 1.00 42.35 C ATOM 1427 O LEU A 90 18.210 -14.117 -12.981 1.00 0.42 O ATOM 1428 CB LEU A 90 16.577 -11.363 -13.144 1.00 15.23 C ATOM 1429 CG LEU A 90 15.397 -10.577 -12.569 1.00 61.15 C ATOM 1430 CD1 LEU A 90 15.823 -9.162 -12.210 1.00 52.02 C ATOM 1431 CD2 LEU A 90 14.240 -10.553 -13.558 1.00 23.42 C ATOM 0 H LEU A 90 15.495 -12.987 -11.625 1.00 11.24 H new ATOM 0 HA LEU A 90 15.669 -12.798 -14.461 1.00 25.43 H new ATOM 0 HB2 LEU A 90 17.376 -11.375 -12.402 1.00 15.23 H new ATOM 0 HB3 LEU A 90 16.957 -10.826 -14.013 1.00 15.23 H new ATOM 0 HG LEU A 90 15.061 -11.075 -11.660 1.00 61.15 H new ATOM 0 HD11 LEU A 90 14.971 -8.618 -11.803 1.00 52.02 H new ATOM 0 HD12 LEU A 90 16.619 -9.199 -11.466 1.00 52.02 H new ATOM 0 HD13 LEU A 90 16.185 -8.653 -13.103 1.00 52.02 H new ATOM 0 HD21 LEU A 90 13.409 -9.990 -13.133 1.00 23.42 H new ATOM 0 HD22 LEU A 90 14.563 -10.079 -14.485 1.00 23.42 H new ATOM 0 HD23 LEU A 90 13.918 -11.573 -13.766 1.00 23.42 H new ATOM 1443 N ASP A 91 17.998 -13.491 -15.131 1.00 71.14 N ATOM 1444 CA ASP A 91 19.231 -14.143 -15.557 1.00 72.41 C ATOM 1445 C ASP A 91 20.446 -13.289 -15.208 1.00 72.35 C ATOM 1446 O ASP A 91 21.551 -13.804 -15.037 1.00 32.53 O ATOM 1447 CB ASP A 91 19.197 -14.413 -17.062 1.00 73.42 C ATOM 1448 CG ASP A 91 19.579 -13.194 -17.878 1.00 74.00 C ATOM 1449 OD1 ASP A 91 19.040 -12.102 -17.600 1.00 60.42 O ATOM 1450 OD2 ASP A 91 20.416 -13.332 -18.795 1.00 14.51 O ATOM 0 H ASP A 91 17.494 -13.012 -15.878 1.00 71.14 H new ATOM 0 HA ASP A 91 19.312 -15.092 -15.027 1.00 72.41 H new ATOM 0 HB2 ASP A 91 19.878 -15.231 -17.297 1.00 73.42 H new ATOM 0 HB3 ASP A 91 18.197 -14.739 -17.347 1.00 73.42 H new ATOM 1455 N TYR A 92 20.234 -11.982 -15.107 1.00 13.04 N ATOM 1456 CA TYR A 92 21.312 -11.056 -14.782 1.00 41.21 C ATOM 1457 C TYR A 92 20.942 -10.186 -13.584 1.00 74.53 C ATOM 1458 O TYR A 92 19.779 -10.124 -13.184 1.00 62.20 O ATOM 1459 CB TYR A 92 21.633 -10.172 -15.988 1.00 44.51 C ATOM 1460 CG TYR A 92 22.642 -10.782 -16.935 1.00 75.22 C ATOM 1461 CD1 TYR A 92 23.961 -10.979 -16.545 1.00 55.54 C ATOM 1462 CD2 TYR A 92 22.274 -11.164 -18.220 1.00 4.11 C ATOM 1463 CE1 TYR A 92 24.885 -11.535 -17.408 1.00 31.43 C ATOM 1464 CE2 TYR A 92 23.192 -11.723 -19.089 1.00 12.15 C ATOM 1465 CZ TYR A 92 24.496 -11.906 -18.678 1.00 72.10 C ATOM 1466 OH TYR A 92 25.413 -12.462 -19.540 1.00 23.44 O ATOM 0 H TYR A 92 19.325 -11.540 -15.246 1.00 13.04 H new ATOM 0 HA TYR A 92 22.194 -11.642 -14.523 1.00 41.21 H new ATOM 0 HB2 TYR A 92 20.712 -9.968 -16.534 1.00 44.51 H new ATOM 0 HB3 TYR A 92 22.013 -9.213 -15.634 1.00 44.51 H new ATOM 0 HD1 TYR A 92 24.269 -10.693 -15.550 1.00 55.54 H new ATOM 0 HD2 TYR A 92 21.254 -11.022 -18.545 1.00 4.11 H new ATOM 0 HE1 TYR A 92 25.907 -11.678 -17.090 1.00 31.43 H new ATOM 0 HE2 TYR A 92 22.890 -12.015 -20.084 1.00 12.15 H new ATOM 0 HH TYR A 92 24.977 -12.668 -20.393 1.00 23.44 H new ATOM 1476 N SER A 93 21.939 -9.516 -13.017 1.00 23.11 N ATOM 1477 CA SER A 93 21.721 -8.652 -11.863 1.00 33.13 C ATOM 1478 C SER A 93 22.025 -7.197 -12.208 1.00 34.32 C ATOM 1479 O SER A 93 21.479 -6.276 -11.600 1.00 32.54 O ATOM 1480 CB SER A 93 22.593 -9.103 -10.689 1.00 52.43 C ATOM 1481 OG SER A 93 22.185 -10.372 -10.209 1.00 1.24 O ATOM 0 H SER A 93 22.906 -9.555 -13.338 1.00 23.11 H new ATOM 0 HA SER A 93 20.672 -8.728 -11.577 1.00 33.13 H new ATOM 0 HB2 SER A 93 23.636 -9.147 -11.003 1.00 52.43 H new ATOM 0 HB3 SER A 93 22.533 -8.370 -9.885 1.00 52.43 H new ATOM 0 HG SER A 93 22.759 -10.639 -9.460 1.00 1.24 H new ATOM 1487 N ASP A 94 22.899 -6.999 -13.188 1.00 1.22 N ATOM 1488 CA ASP A 94 23.276 -5.657 -13.616 1.00 41.20 C ATOM 1489 C ASP A 94 23.422 -5.591 -15.133 1.00 73.22 C ATOM 1490 O ASP A 94 24.005 -6.483 -15.750 1.00 43.53 O ATOM 1491 CB ASP A 94 24.585 -5.234 -12.947 1.00 13.41 C ATOM 1492 CG ASP A 94 25.675 -6.276 -13.097 1.00 43.11 C ATOM 1493 OD1 ASP A 94 25.685 -7.243 -12.307 1.00 72.31 O ATOM 1494 OD2 ASP A 94 26.519 -6.125 -14.005 1.00 53.23 O ATOM 0 H ASP A 94 23.360 -7.750 -13.701 1.00 1.22 H new ATOM 0 HA ASP A 94 22.484 -4.971 -13.315 1.00 41.20 H new ATOM 0 HB2 ASP A 94 24.924 -4.293 -13.381 1.00 13.41 H new ATOM 0 HB3 ASP A 94 24.405 -5.050 -11.888 1.00 13.41 H new ATOM 1499 N PHE A 95 22.887 -4.531 -15.729 1.00 15.44 N ATOM 1500 CA PHE A 95 22.955 -4.350 -17.174 1.00 11.41 C ATOM 1501 C PHE A 95 24.404 -4.268 -17.644 1.00 24.51 C ATOM 1502 O PHE A 95 25.190 -3.474 -17.129 1.00 44.42 O ATOM 1503 CB PHE A 95 22.201 -3.083 -17.587 1.00 25.51 C ATOM 1504 CG PHE A 95 21.602 -3.164 -18.962 1.00 23.11 C ATOM 1505 CD1 PHE A 95 22.406 -3.369 -20.071 1.00 63.34 C ATOM 1506 CD2 PHE A 95 20.235 -3.034 -19.145 1.00 30.13 C ATOM 1507 CE1 PHE A 95 21.858 -3.444 -21.338 1.00 61.41 C ATOM 1508 CE2 PHE A 95 19.681 -3.109 -20.409 1.00 1.22 C ATOM 1509 CZ PHE A 95 20.494 -3.313 -21.507 1.00 13.11 C ATOM 0 H PHE A 95 22.401 -3.784 -15.233 1.00 15.44 H new ATOM 0 HA PHE A 95 22.486 -5.214 -17.646 1.00 11.41 H new ATOM 0 HB2 PHE A 95 21.408 -2.890 -16.865 1.00 25.51 H new ATOM 0 HB3 PHE A 95 22.883 -2.234 -17.546 1.00 25.51 H new ATOM 0 HD1 PHE A 95 23.474 -3.471 -19.944 1.00 63.34 H new ATOM 0 HD2 PHE A 95 19.595 -2.872 -18.290 1.00 30.13 H new ATOM 0 HE1 PHE A 95 22.496 -3.605 -22.194 1.00 61.41 H new ATOM 0 HE2 PHE A 95 18.613 -3.008 -20.538 1.00 1.22 H new ATOM 0 HZ PHE A 95 20.063 -3.370 -22.496 1.00 13.11 H new ATOM 1519 N GLN A 96 24.750 -5.097 -18.624 1.00 34.20 N ATOM 1520 CA GLN A 96 26.104 -5.120 -19.162 1.00 65.35 C ATOM 1521 C GLN A 96 26.095 -4.892 -20.670 1.00 71.24 C ATOM 1522 O GLN A 96 25.033 -4.801 -21.287 1.00 50.41 O ATOM 1523 CB GLN A 96 26.781 -6.454 -18.841 1.00 1.02 C ATOM 1524 CG GLN A 96 28.282 -6.339 -18.626 1.00 54.32 C ATOM 1525 CD GLN A 96 28.842 -7.477 -17.797 1.00 33.51 C ATOM 1526 OE1 GLN A 96 29.390 -7.262 -16.716 1.00 20.04 O ATOM 1527 NE2 GLN A 96 28.706 -8.699 -18.300 1.00 4.10 N ATOM 0 H GLN A 96 24.111 -5.761 -19.061 1.00 34.20 H new ATOM 0 HA GLN A 96 26.667 -4.313 -18.694 1.00 65.35 H new ATOM 0 HB2 GLN A 96 26.326 -6.877 -17.946 1.00 1.02 H new ATOM 0 HB3 GLN A 96 26.592 -7.153 -19.655 1.00 1.02 H new ATOM 0 HG2 GLN A 96 28.783 -6.319 -19.594 1.00 54.32 H new ATOM 0 HG3 GLN A 96 28.503 -5.392 -18.133 1.00 54.32 H new ATOM 0 HE21 GLN A 96 28.245 -8.832 -19.200 1.00 4.10 H new ATOM 0 HE22 GLN A 96 29.063 -9.505 -17.786 1.00 4.10 H new ATOM 1536 N ILE A 97 27.283 -4.801 -21.257 1.00 63.05 N ATOM 1537 CA ILE A 97 27.411 -4.584 -22.693 1.00 71.32 C ATOM 1538 C ILE A 97 28.213 -5.703 -23.349 1.00 74.40 C ATOM 1539 O ILE A 97 29.179 -6.207 -22.777 1.00 22.14 O ATOM 1540 CB ILE A 97 28.087 -3.235 -23.001 1.00 62.20 C ATOM 1541 CG1 ILE A 97 27.369 -2.101 -22.268 1.00 14.32 C ATOM 1542 CG2 ILE A 97 28.100 -2.979 -24.501 1.00 24.43 C ATOM 1543 CD1 ILE A 97 28.067 -0.765 -22.390 1.00 2.44 C ATOM 0 H ILE A 97 28.171 -4.874 -20.761 1.00 63.05 H new ATOM 0 HA ILE A 97 26.401 -4.576 -23.102 1.00 71.32 H new ATOM 0 HB ILE A 97 29.118 -3.274 -22.650 1.00 62.20 H new ATOM 0 HG12 ILE A 97 26.356 -2.010 -22.660 1.00 14.32 H new ATOM 0 HG13 ILE A 97 27.280 -2.360 -21.213 1.00 14.32 H new ATOM 0 HG21 ILE A 97 28.581 -2.022 -24.703 1.00 24.43 H new ATOM 0 HG22 ILE A 97 28.652 -3.775 -25.001 1.00 24.43 H new ATOM 0 HG23 ILE A 97 27.076 -2.957 -24.875 1.00 24.43 H new ATOM 0 HD11 ILE A 97 27.502 -0.008 -21.846 1.00 2.44 H new ATOM 0 HD12 ILE A 97 29.071 -0.839 -21.971 1.00 2.44 H new ATOM 0 HD13 ILE A 97 28.132 -0.483 -23.441 1.00 2.44 H new ATOM 1555 N VAL A 98 27.806 -6.087 -24.555 1.00 33.31 N ATOM 1556 CA VAL A 98 28.488 -7.145 -25.291 1.00 74.01 C ATOM 1557 C VAL A 98 29.313 -6.572 -26.438 1.00 31.32 C ATOM 1558 O VAL A 98 28.917 -5.597 -27.077 1.00 34.34 O ATOM 1559 CB VAL A 98 27.487 -8.171 -25.856 1.00 11.14 C ATOM 1560 CG1 VAL A 98 28.214 -9.243 -26.653 1.00 32.23 C ATOM 1561 CG2 VAL A 98 26.670 -8.791 -24.732 1.00 61.54 C ATOM 0 H VAL A 98 27.007 -5.681 -25.043 1.00 33.31 H new ATOM 0 HA VAL A 98 29.150 -7.646 -24.585 1.00 74.01 H new ATOM 0 HB VAL A 98 26.803 -7.654 -26.529 1.00 11.14 H new ATOM 0 HG11 VAL A 98 27.491 -9.959 -27.044 1.00 32.23 H new ATOM 0 HG12 VAL A 98 28.750 -8.780 -27.481 1.00 32.23 H new ATOM 0 HG13 VAL A 98 28.922 -9.760 -26.006 1.00 32.23 H new ATOM 0 HG21 VAL A 98 25.968 -9.513 -25.148 1.00 61.54 H new ATOM 0 HG22 VAL A 98 27.337 -9.295 -24.033 1.00 61.54 H new ATOM 0 HG23 VAL A 98 26.119 -8.009 -24.209 1.00 61.54 H new ATOM 1571 N LYS A 99 30.464 -7.185 -26.695 1.00 13.14 N ATOM 1572 CA LYS A 99 31.346 -6.738 -27.766 1.00 22.40 C ATOM 1573 C LYS A 99 30.654 -6.846 -29.121 1.00 44.22 C ATOM 1574 O LYS A 99 29.960 -7.824 -29.399 1.00 12.14 O ATOM 1575 CB LYS A 99 32.634 -7.565 -27.772 1.00 31.32 C ATOM 1576 CG LYS A 99 33.840 -6.810 -28.303 1.00 53.40 C ATOM 1577 CD LYS A 99 35.122 -7.603 -28.115 1.00 40.30 C ATOM 1578 CE LYS A 99 35.303 -8.638 -29.214 1.00 62.23 C ATOM 1579 NZ LYS A 99 35.991 -8.068 -30.406 1.00 2.15 N ATOM 0 H LYS A 99 30.807 -7.993 -26.176 1.00 13.14 H new ATOM 0 HA LYS A 99 31.594 -5.692 -27.586 1.00 22.40 H new ATOM 0 HB2 LYS A 99 32.845 -7.901 -26.757 1.00 31.32 H new ATOM 0 HB3 LYS A 99 32.480 -8.458 -28.378 1.00 31.32 H new ATOM 0 HG2 LYS A 99 33.697 -6.593 -29.362 1.00 53.40 H new ATOM 0 HG3 LYS A 99 33.925 -5.852 -27.790 1.00 53.40 H new ATOM 0 HD2 LYS A 99 35.974 -6.923 -28.110 1.00 40.30 H new ATOM 0 HD3 LYS A 99 35.105 -8.100 -27.145 1.00 40.30 H new ATOM 0 HE2 LYS A 99 35.880 -9.479 -28.829 1.00 62.23 H new ATOM 0 HE3 LYS A 99 34.329 -9.028 -29.509 1.00 62.23 H new ATOM 0 HZ1 LYS A 99 36.095 -8.805 -31.132 1.00 2.15 H new ATOM 0 HZ2 LYS A 99 35.428 -7.282 -30.789 1.00 2.15 H new ATOM 0 HZ3 LYS A 99 36.931 -7.719 -30.130 1.00 2.15 H new