USER MOD reduce.3.24.130724 H: found=0, std=0, add=777, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 775 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 87 SER OG : rot 150:sc= 0.249 USER MOD Set 1.2: A 89 GLN : amide:sc= -2.35 K(o=-2.1,f=0.25) USER MOD Set 2.1: A 80 GLN : amide:sc= -2.72! C(o=-3.2!,f=-8.5!) USER MOD Set 2.2: A 84 THR OG1 : rot 150:sc= -0.462! USER MOD Set 3.1: A 46 SER OG : rot 180:sc= 0 USER MOD Set 3.2: A 72 GLN : amide:sc= -0.112 K(o=-0.11,f=0.45) USER MOD Set 4.1: A 45 LYS NZ :NH3+ 147:sc= 0.551 (180deg=0) USER MOD Set 4.2: A 48 CYS SG : rot 2:sc= -0.31 USER MOD Set 5.1: A 44 SER OG : rot 23:sc= 1.33 USER MOD Set 5.2: A 51 SER OG : rot 178:sc= 0.221 USER MOD Set 5.3: A 52 THR OG1 : rot -5:sc= 1.22 USER MOD Single : A 38 ASN : amide:sc= -0.601 K(o=-0.6,f=-0.02) USER MOD Single : A 41 MET CE :methyl 178:sc= -4.64! (180deg=-4.77!) USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 50 HIS : no HD1:sc= -1.01 X(o=-1,f=-0.96) USER MOD Single : A 55 LYS NZ :NH3+ -155:sc= -0.163 (180deg=-1.11) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 60 SER OG : rot -4:sc= 0.637! USER MOD Single : A 65 TYR OH : rot 180:sc= -0.48 USER MOD Single : A 66 ASN : amide:sc= -0.181 K(o=-0.18,f=-4.2!) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 88 ASN : amide:sc= 0 X(o=0,f=-0.42) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 THR OG1 : rot 180:sc= -0.524 USER MOD Single : A 94 ASN : amide:sc= -2.45 X(o=-2.4,f=-2.3) USER MOD Single : A 98 ASN : amide:sc= -0.116 K(o=-0.12,f=1.1) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 HIS : no HD1:sc= -0.355 X(o=-0.36,f=-0.21) USER MOD Single : A 105 CYS SG : rot -47:sc= -0.0684 USER MOD Single : A 108 THR OG1 : rot 70:sc= -0.838 USER MOD Single : A 110 GLN : amide:sc= -1.79 K(o=-1.8,f=-4.9!) USER MOD Single : A 112 HIS : no HD1:sc= -1.08 X(o=-1.1,f=-0.64) USER MOD Single : A 113 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 114 ASN : amide:sc= -1.9 X(o=-1.9,f=-2) USER MOD Single : A 118 GLN : amide:sc= 0 K(o=0,f=-1.5!) USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 65 N LEU A 27 2.372 -2.987 -5.081 1.00 44.53 N ATOM 66 CA LEU A 27 3.641 -3.340 -5.710 1.00 71.14 C ATOM 67 C LEU A 27 3.419 -4.281 -6.891 1.00 1.10 C ATOM 68 O LEU A 27 3.915 -4.038 -7.992 1.00 31.33 O ATOM 69 CB LEU A 27 4.573 -3.995 -4.689 1.00 63.03 C ATOM 70 CG LEU A 27 5.724 -4.821 -5.265 1.00 51.14 C ATOM 71 CD1 LEU A 27 7.049 -4.385 -4.659 1.00 21.32 C ATOM 72 CD2 LEU A 27 5.488 -6.305 -5.025 1.00 33.21 C ATOM 0 HA LEU A 27 4.103 -2.425 -6.080 1.00 71.14 H new ATOM 0 HB2 LEU A 27 4.994 -3.213 -4.057 1.00 63.03 H new ATOM 0 HB3 LEU A 27 3.977 -4.640 -4.044 1.00 63.03 H new ATOM 0 HG LEU A 27 5.766 -4.650 -6.341 1.00 51.14 H new ATOM 0 HD11 LEU A 27 7.856 -4.984 -5.081 1.00 21.32 H new ATOM 0 HD12 LEU A 27 7.223 -3.332 -4.883 1.00 21.32 H new ATOM 0 HD13 LEU A 27 7.019 -4.526 -3.579 1.00 21.32 H new ATOM 0 HD21 LEU A 27 6.317 -6.877 -5.442 1.00 33.21 H new ATOM 0 HD22 LEU A 27 5.419 -6.494 -3.954 1.00 33.21 H new ATOM 0 HD23 LEU A 27 4.559 -6.608 -5.508 1.00 33.21 H new ATOM 84 N ARG A 28 2.671 -5.353 -6.654 1.00 73.45 N ATOM 85 CA ARG A 28 2.383 -6.329 -7.699 1.00 24.25 C ATOM 86 C ARG A 28 1.840 -5.644 -8.949 1.00 31.04 C ATOM 87 O ARG A 28 2.045 -6.118 -10.066 1.00 70.14 O ATOM 88 CB ARG A 28 1.377 -7.365 -7.194 1.00 72.33 C ATOM 89 CG ARG A 28 1.523 -8.728 -7.853 1.00 45.40 C ATOM 90 CD ARG A 28 1.033 -8.706 -9.292 1.00 40.00 C ATOM 91 NE ARG A 28 0.545 -10.013 -9.723 1.00 13.30 N ATOM 92 CZ ARG A 28 -0.301 -10.184 -10.733 1.00 41.03 C ATOM 93 NH1 ARG A 28 -0.750 -9.137 -11.412 1.00 60.40 N ATOM 94 NH2 ARG A 28 -0.701 -11.405 -11.066 1.00 24.30 N ATOM 0 H ARG A 28 2.253 -5.568 -5.749 1.00 73.45 H new ATOM 0 HA ARG A 28 3.314 -6.832 -7.958 1.00 24.25 H new ATOM 0 HB2 ARG A 28 1.494 -7.478 -6.116 1.00 72.33 H new ATOM 0 HB3 ARG A 28 0.367 -6.993 -7.368 1.00 72.33 H new ATOM 0 HG2 ARG A 28 2.568 -9.035 -7.828 1.00 45.40 H new ATOM 0 HG3 ARG A 28 0.959 -9.469 -7.287 1.00 45.40 H new ATOM 0 HD2 ARG A 28 0.235 -7.970 -9.392 1.00 40.00 H new ATOM 0 HD3 ARG A 28 1.844 -8.388 -9.947 1.00 40.00 H new ATOM 0 HE ARG A 28 0.871 -10.839 -9.222 1.00 13.30 H new ATOM 0 HH11 ARG A 28 -0.446 -8.197 -11.159 1.00 60.40 H new ATOM 0 HH12 ARG A 28 -1.399 -9.272 -12.187 1.00 60.40 H new ATOM 0 HH21 ARG A 28 -0.359 -12.213 -10.546 1.00 24.30 H new ATOM 0 HH22 ARG A 28 -1.351 -11.535 -11.842 1.00 24.30 H new ATOM 108 N ARG A 29 1.147 -4.527 -8.752 1.00 25.35 N ATOM 109 CA ARG A 29 0.575 -3.778 -9.863 1.00 14.32 C ATOM 110 C ARG A 29 1.654 -3.374 -10.862 1.00 22.30 C ATOM 111 O ARG A 29 1.377 -3.173 -12.045 1.00 33.04 O ATOM 112 CB ARG A 29 -0.149 -2.532 -9.347 1.00 21.14 C ATOM 113 CG ARG A 29 -1.496 -2.293 -10.008 1.00 13.52 C ATOM 114 CD ARG A 29 -2.593 -3.118 -9.353 1.00 1.11 C ATOM 115 NE ARG A 29 -3.830 -2.358 -9.195 1.00 23.34 N ATOM 116 CZ ARG A 29 -3.966 -1.345 -8.345 1.00 53.05 C ATOM 117 NH1 ARG A 29 -2.947 -0.973 -7.584 1.00 12.14 N ATOM 118 NH2 ARG A 29 -5.124 -0.702 -8.259 1.00 20.23 N ATOM 0 H ARG A 29 0.968 -4.121 -7.833 1.00 25.35 H new ATOM 0 HA ARG A 29 -0.142 -4.423 -10.371 1.00 14.32 H new ATOM 0 HB2 ARG A 29 -0.294 -2.626 -8.271 1.00 21.14 H new ATOM 0 HB3 ARG A 29 0.485 -1.660 -9.509 1.00 21.14 H new ATOM 0 HG2 ARG A 29 -1.750 -1.235 -9.947 1.00 13.52 H new ATOM 0 HG3 ARG A 29 -1.433 -2.545 -11.067 1.00 13.52 H new ATOM 0 HD2 ARG A 29 -2.787 -4.006 -9.955 1.00 1.11 H new ATOM 0 HD3 ARG A 29 -2.253 -3.463 -8.377 1.00 1.11 H new ATOM 0 HE ARG A 29 -4.633 -2.618 -9.768 1.00 23.34 H new ATOM 0 HH11 ARG A 29 -2.055 -1.464 -7.650 1.00 12.14 H new ATOM 0 HH12 ARG A 29 -3.054 -0.195 -6.933 1.00 12.14 H new ATOM 0 HH21 ARG A 29 -5.909 -0.985 -8.845 1.00 20.23 H new ATOM 0 HH22 ARG A 29 -5.229 0.075 -7.607 1.00 20.23 H new ATOM 132 N ARG A 30 2.887 -3.257 -10.378 1.00 21.13 N ATOM 133 CA ARG A 30 4.008 -2.876 -11.227 1.00 41.43 C ATOM 134 C ARG A 30 4.619 -4.100 -11.902 1.00 43.12 C ATOM 135 O ARG A 30 4.887 -4.090 -13.105 1.00 4.35 O ATOM 136 CB ARG A 30 5.074 -2.148 -10.405 1.00 70.41 C ATOM 137 CG ARG A 30 4.624 -0.791 -9.889 1.00 31.51 C ATOM 138 CD ARG A 30 5.478 -0.328 -8.720 1.00 24.23 C ATOM 139 NE ARG A 30 5.668 1.119 -8.719 1.00 42.42 N ATOM 140 CZ ARG A 30 6.393 1.765 -9.627 1.00 14.45 C ATOM 141 NH1 ARG A 30 6.991 1.095 -10.602 1.00 52.42 N ATOM 142 NH2 ARG A 30 6.518 3.085 -9.560 1.00 45.43 N ATOM 0 H ARG A 30 3.134 -3.421 -9.402 1.00 21.13 H new ATOM 0 HA ARG A 30 3.634 -2.205 -12.000 1.00 41.43 H new ATOM 0 HB2 ARG A 30 5.358 -2.773 -9.558 1.00 70.41 H new ATOM 0 HB3 ARG A 30 5.966 -2.017 -11.017 1.00 70.41 H new ATOM 0 HG2 ARG A 30 4.679 -0.058 -10.694 1.00 31.51 H new ATOM 0 HG3 ARG A 30 3.580 -0.846 -9.579 1.00 31.51 H new ATOM 0 HD2 ARG A 30 5.008 -0.632 -7.785 1.00 24.23 H new ATOM 0 HD3 ARG A 30 6.449 -0.821 -8.763 1.00 24.23 H new ATOM 0 HE ARG A 30 5.220 1.664 -7.982 1.00 42.42 H new ATOM 0 HH11 ARG A 30 6.896 0.081 -10.657 1.00 52.42 H new ATOM 0 HH12 ARG A 30 7.547 1.593 -11.297 1.00 52.42 H new ATOM 0 HH21 ARG A 30 6.058 3.604 -8.812 1.00 45.43 H new ATOM 0 HH22 ARG A 30 7.074 3.581 -10.257 1.00 45.43 H new ATOM 156 N LEU A 31 4.838 -5.152 -11.123 1.00 22.45 N ATOM 157 CA LEU A 31 5.418 -6.385 -11.644 1.00 51.41 C ATOM 158 C LEU A 31 4.578 -6.941 -12.789 1.00 11.41 C ATOM 159 O LEU A 31 5.080 -7.669 -13.645 1.00 22.53 O ATOM 160 CB LEU A 31 5.537 -7.428 -10.531 1.00 41.43 C ATOM 161 CG LEU A 31 6.082 -6.923 -9.194 1.00 42.35 C ATOM 162 CD1 LEU A 31 6.149 -8.057 -8.183 1.00 72.21 C ATOM 163 CD2 LEU A 31 7.454 -6.292 -9.382 1.00 44.20 C ATOM 0 H LEU A 31 4.623 -5.177 -10.126 1.00 22.45 H new ATOM 0 HA LEU A 31 6.413 -6.155 -12.025 1.00 51.41 H new ATOM 0 HB2 LEU A 31 4.551 -7.861 -10.359 1.00 41.43 H new ATOM 0 HB3 LEU A 31 6.182 -8.234 -10.883 1.00 41.43 H new ATOM 0 HG LEU A 31 5.403 -6.161 -8.811 1.00 42.35 H new ATOM 0 HD11 LEU A 31 6.539 -7.679 -7.238 1.00 72.21 H new ATOM 0 HD12 LEU A 31 5.150 -8.464 -8.026 1.00 72.21 H new ATOM 0 HD13 LEU A 31 6.806 -8.841 -8.559 1.00 72.21 H new ATOM 0 HD21 LEU A 31 7.827 -5.938 -8.421 1.00 44.20 H new ATOM 0 HD22 LEU A 31 8.143 -7.033 -9.788 1.00 44.20 H new ATOM 0 HD23 LEU A 31 7.377 -5.452 -10.072 1.00 44.20 H new ATOM 175 N ARG A 32 3.296 -6.589 -12.800 1.00 54.10 N ATOM 176 CA ARG A 32 2.385 -7.051 -13.840 1.00 70.53 C ATOM 177 C ARG A 32 2.454 -6.145 -15.066 1.00 21.24 C ATOM 178 O ARG A 32 2.669 -6.611 -16.184 1.00 64.55 O ATOM 179 CB ARG A 32 0.952 -7.101 -13.309 1.00 41.31 C ATOM 180 CG ARG A 32 -0.002 -7.881 -14.198 1.00 62.33 C ATOM 181 CD ARG A 32 0.418 -9.338 -14.320 1.00 12.23 C ATOM 182 NE ARG A 32 -0.733 -10.235 -14.387 1.00 44.11 N ATOM 183 CZ ARG A 32 -1.505 -10.361 -15.460 1.00 64.24 C ATOM 184 NH1 ARG A 32 -1.251 -9.652 -16.551 1.00 45.14 N ATOM 185 NH2 ARG A 32 -2.534 -11.199 -15.445 1.00 11.21 N ATOM 0 H ARG A 32 2.865 -5.985 -12.100 1.00 54.10 H new ATOM 0 HA ARG A 32 2.690 -8.055 -14.134 1.00 70.53 H new ATOM 0 HB2 ARG A 32 0.958 -7.549 -12.316 1.00 41.31 H new ATOM 0 HB3 ARG A 32 0.580 -6.083 -13.197 1.00 41.31 H new ATOM 0 HG2 ARG A 32 -1.011 -7.825 -13.789 1.00 62.33 H new ATOM 0 HG3 ARG A 32 -0.033 -7.426 -15.188 1.00 62.33 H new ATOM 0 HD2 ARG A 32 1.030 -9.466 -15.213 1.00 12.23 H new ATOM 0 HD3 ARG A 32 1.040 -9.609 -13.467 1.00 12.23 H new ATOM 0 HE ARG A 32 -0.956 -10.795 -13.564 1.00 44.11 H new ATOM 0 HH11 ARG A 32 -0.461 -9.007 -16.568 1.00 45.14 H new ATOM 0 HH12 ARG A 32 -1.846 -9.751 -17.374 1.00 45.14 H new ATOM 0 HH21 ARG A 32 -2.733 -11.747 -14.608 1.00 11.21 H new ATOM 0 HH22 ARG A 32 -3.126 -11.295 -16.270 1.00 11.21 H new ATOM 199 N ASP A 33 2.271 -4.847 -14.846 1.00 33.42 N ATOM 200 CA ASP A 33 2.313 -3.875 -15.932 1.00 40.11 C ATOM 201 C ASP A 33 3.629 -3.972 -16.698 1.00 71.40 C ATOM 202 O ASP A 33 3.677 -3.729 -17.904 1.00 54.40 O ATOM 203 CB ASP A 33 2.130 -2.459 -15.383 1.00 45.25 C ATOM 204 CG ASP A 33 1.890 -1.440 -16.480 1.00 1.20 C ATOM 205 OD1 ASP A 33 1.416 -1.837 -17.565 1.00 64.54 O ATOM 206 OD2 ASP A 33 2.174 -0.246 -16.253 1.00 2.52 O ATOM 0 H ASP A 33 2.092 -4.444 -13.926 1.00 33.42 H new ATOM 0 HA ASP A 33 1.497 -4.098 -16.619 1.00 40.11 H new ATOM 0 HB2 ASP A 33 1.289 -2.447 -14.690 1.00 45.25 H new ATOM 0 HB3 ASP A 33 3.016 -2.175 -14.815 1.00 45.25 H new ATOM 211 N LEU A 34 4.694 -4.329 -15.989 1.00 1.31 N ATOM 212 CA LEU A 34 6.012 -4.457 -16.602 1.00 40.53 C ATOM 213 C LEU A 34 5.958 -5.368 -17.824 1.00 32.45 C ATOM 214 O LEU A 34 6.575 -5.084 -18.851 1.00 20.34 O ATOM 215 CB LEU A 34 7.017 -5.004 -15.587 1.00 41.41 C ATOM 216 CG LEU A 34 8.471 -4.574 -15.783 1.00 61.44 C ATOM 217 CD1 LEU A 34 9.385 -5.329 -14.831 1.00 1.21 C ATOM 218 CD2 LEU A 34 8.902 -4.796 -17.226 1.00 12.21 C ATOM 0 H LEU A 34 4.671 -4.535 -14.990 1.00 1.31 H new ATOM 0 HA LEU A 34 6.334 -3.467 -16.925 1.00 40.53 H new ATOM 0 HB2 LEU A 34 6.700 -4.697 -14.590 1.00 41.41 H new ATOM 0 HB3 LEU A 34 6.974 -6.093 -15.614 1.00 41.41 H new ATOM 0 HG LEU A 34 8.548 -3.510 -15.560 1.00 61.44 H new ATOM 0 HD11 LEU A 34 10.415 -5.009 -14.986 1.00 1.21 H new ATOM 0 HD12 LEU A 34 9.091 -5.121 -13.802 1.00 1.21 H new ATOM 0 HD13 LEU A 34 9.305 -6.399 -15.022 1.00 1.21 H new ATOM 0 HD21 LEU A 34 9.939 -4.485 -17.348 1.00 12.21 H new ATOM 0 HD22 LEU A 34 8.809 -5.853 -17.475 1.00 12.21 H new ATOM 0 HD23 LEU A 34 8.267 -4.209 -17.890 1.00 12.21 H new ATOM 230 N ILE A 35 5.216 -6.464 -17.705 1.00 33.02 N ATOM 231 CA ILE A 35 5.079 -7.416 -18.800 1.00 53.51 C ATOM 232 C ILE A 35 4.421 -6.767 -20.014 1.00 0.12 C ATOM 233 O ILE A 35 4.632 -7.193 -21.148 1.00 31.43 O ATOM 234 CB ILE A 35 4.252 -8.645 -18.378 1.00 65.35 C ATOM 235 CG1 ILE A 35 4.929 -9.366 -17.211 1.00 35.15 C ATOM 236 CG2 ILE A 35 4.069 -9.590 -19.557 1.00 25.13 C ATOM 237 CD1 ILE A 35 4.104 -9.369 -15.943 1.00 52.42 C ATOM 0 H ILE A 35 4.701 -6.715 -16.861 1.00 33.02 H new ATOM 0 HA ILE A 35 6.086 -7.739 -19.064 1.00 53.51 H new ATOM 0 HB ILE A 35 3.268 -8.308 -18.051 1.00 65.35 H new ATOM 0 HG12 ILE A 35 5.137 -10.396 -17.502 1.00 35.15 H new ATOM 0 HG13 ILE A 35 5.889 -8.892 -17.009 1.00 35.15 H new ATOM 0 HG21 ILE A 35 3.483 -10.454 -19.243 1.00 25.13 H new ATOM 0 HG22 ILE A 35 3.549 -9.071 -20.362 1.00 25.13 H new ATOM 0 HG23 ILE A 35 5.045 -9.923 -19.911 1.00 25.13 H new ATOM 0 HD11 ILE A 35 4.645 -9.897 -15.158 1.00 52.42 H new ATOM 0 HD12 ILE A 35 3.918 -8.342 -15.628 1.00 52.42 H new ATOM 0 HD13 ILE A 35 3.154 -9.870 -16.128 1.00 52.42 H new ATOM 249 N GLU A 36 3.625 -5.731 -19.765 1.00 42.03 N ATOM 250 CA GLU A 36 2.938 -5.022 -20.838 1.00 72.44 C ATOM 251 C GLU A 36 3.842 -3.960 -21.455 1.00 25.11 C ATOM 252 O GLU A 36 3.791 -3.708 -22.658 1.00 12.53 O ATOM 253 CB GLU A 36 1.657 -4.374 -20.311 1.00 74.14 C ATOM 254 CG GLU A 36 0.862 -3.640 -21.379 1.00 20.32 C ATOM 255 CD GLU A 36 0.863 -2.137 -21.177 1.00 62.22 C ATOM 256 OE1 GLU A 36 0.260 -1.672 -20.188 1.00 14.04 O ATOM 257 OE2 GLU A 36 1.465 -1.427 -22.008 1.00 42.32 O ATOM 0 H GLU A 36 3.440 -5.365 -18.831 1.00 42.03 H new ATOM 0 HA GLU A 36 2.679 -5.746 -21.610 1.00 72.44 H new ATOM 0 HB2 GLU A 36 1.027 -5.144 -19.866 1.00 74.14 H new ATOM 0 HB3 GLU A 36 1.914 -3.674 -19.516 1.00 74.14 H new ATOM 0 HG2 GLU A 36 1.278 -3.871 -22.360 1.00 20.32 H new ATOM 0 HG3 GLU A 36 -0.166 -4.003 -21.375 1.00 20.32 H new ATOM 264 N GLY A 37 4.671 -3.339 -20.621 1.00 42.02 N ATOM 265 CA GLY A 37 5.575 -2.311 -21.101 1.00 1.10 C ATOM 266 C GLY A 37 6.687 -2.873 -21.965 1.00 42.25 C ATOM 267 O GLY A 37 7.362 -2.133 -22.679 1.00 54.21 O ATOM 0 H GLY A 37 4.732 -3.530 -19.621 1.00 42.02 H new ATOM 0 HA2 GLY A 37 5.011 -1.575 -21.674 1.00 1.10 H new ATOM 0 HA3 GLY A 37 6.010 -1.788 -20.249 1.00 1.10 H new ATOM 271 N ASN A 38 6.878 -4.186 -21.900 1.00 62.21 N ATOM 272 CA ASN A 38 7.918 -4.847 -22.681 1.00 72.22 C ATOM 273 C ASN A 38 7.377 -6.107 -23.350 1.00 54.05 C ATOM 274 O ASN A 38 6.668 -6.897 -22.727 1.00 62.53 O ATOM 275 CB ASN A 38 9.108 -5.202 -21.788 1.00 21.02 C ATOM 276 CG ASN A 38 9.833 -3.972 -21.275 1.00 14.33 C ATOM 277 OD1 ASN A 38 10.925 -3.644 -21.737 1.00 14.44 O ATOM 278 ND2 ASN A 38 9.224 -3.287 -20.313 1.00 44.33 N ATOM 0 H ASN A 38 6.327 -4.814 -21.315 1.00 62.21 H new ATOM 0 HA ASN A 38 8.248 -4.157 -23.458 1.00 72.22 H new ATOM 0 HB2 ASN A 38 8.760 -5.795 -20.942 1.00 21.02 H new ATOM 0 HB3 ASN A 38 9.806 -5.825 -22.348 1.00 21.02 H new ATOM 0 HD21 ASN A 38 9.662 -2.451 -19.927 1.00 44.33 H new ATOM 0 HD22 ASN A 38 8.318 -3.597 -19.961 1.00 44.33 H new ATOM 285 N ARG A 39 7.716 -6.287 -24.622 1.00 64.12 N ATOM 286 CA ARG A 39 7.265 -7.451 -25.377 1.00 11.22 C ATOM 287 C ARG A 39 7.543 -8.739 -24.608 1.00 43.01 C ATOM 288 O ARG A 39 6.651 -9.564 -24.414 1.00 13.51 O ATOM 289 CB ARG A 39 7.955 -7.499 -26.741 1.00 21.42 C ATOM 290 CG ARG A 39 6.990 -7.643 -27.906 1.00 70.52 C ATOM 291 CD ARG A 39 6.785 -9.103 -28.283 1.00 14.44 C ATOM 292 NE ARG A 39 6.952 -9.327 -29.716 1.00 34.11 N ATOM 293 CZ ARG A 39 6.088 -8.900 -30.631 1.00 43.02 C ATOM 294 NH1 ARG A 39 5.005 -8.229 -30.265 1.00 22.53 N ATOM 295 NH2 ARG A 39 6.309 -9.144 -31.917 1.00 50.04 N ATOM 0 H ARG A 39 8.302 -5.642 -25.152 1.00 64.12 H new ATOM 0 HA ARG A 39 6.189 -7.362 -25.525 1.00 11.22 H new ATOM 0 HB2 ARG A 39 8.540 -6.589 -26.875 1.00 21.42 H new ATOM 0 HB3 ARG A 39 8.656 -8.334 -26.755 1.00 21.42 H new ATOM 0 HG2 ARG A 39 6.031 -7.196 -27.643 1.00 70.52 H new ATOM 0 HG3 ARG A 39 7.372 -7.094 -28.767 1.00 70.52 H new ATOM 0 HD2 ARG A 39 7.495 -9.722 -27.734 1.00 14.44 H new ATOM 0 HD3 ARG A 39 5.786 -9.419 -27.981 1.00 14.44 H new ATOM 0 HE ARG A 39 7.776 -9.839 -30.032 1.00 34.11 H new ATOM 0 HH11 ARG A 39 4.832 -8.039 -29.278 1.00 22.53 H new ATOM 0 HH12 ARG A 39 4.344 -7.903 -30.970 1.00 22.53 H new ATOM 0 HH21 ARG A 39 7.142 -9.659 -32.203 1.00 50.04 H new ATOM 0 HH22 ARG A 39 5.646 -8.816 -32.620 1.00 50.04 H new ATOM 309 N VAL A 40 8.789 -8.904 -24.173 1.00 71.31 N ATOM 310 CA VAL A 40 9.186 -10.092 -23.425 1.00 15.14 C ATOM 311 C VAL A 40 9.917 -9.714 -22.142 1.00 71.10 C ATOM 312 O VAL A 40 11.026 -9.180 -22.182 1.00 74.30 O ATOM 313 CB VAL A 40 10.091 -11.010 -24.268 1.00 52.12 C ATOM 314 CG1 VAL A 40 10.578 -12.188 -23.438 1.00 51.24 C ATOM 315 CG2 VAL A 40 9.354 -11.490 -25.509 1.00 52.22 C ATOM 0 H VAL A 40 9.540 -8.231 -24.326 1.00 71.31 H new ATOM 0 HA VAL A 40 8.271 -10.629 -23.174 1.00 15.14 H new ATOM 0 HB VAL A 40 10.962 -10.438 -24.589 1.00 52.12 H new ATOM 0 HG11 VAL A 40 11.216 -12.825 -24.050 1.00 51.24 H new ATOM 0 HG12 VAL A 40 11.146 -11.821 -22.583 1.00 51.24 H new ATOM 0 HG13 VAL A 40 9.722 -12.763 -23.085 1.00 51.24 H new ATOM 0 HG21 VAL A 40 10.008 -12.137 -26.093 1.00 52.22 H new ATOM 0 HG22 VAL A 40 8.465 -12.046 -25.212 1.00 52.22 H new ATOM 0 HG23 VAL A 40 9.060 -10.631 -26.113 1.00 52.22 H new ATOM 325 N MET A 41 9.289 -9.996 -21.005 1.00 5.42 N ATOM 326 CA MET A 41 9.883 -9.686 -19.709 1.00 40.20 C ATOM 327 C MET A 41 9.810 -10.891 -18.776 1.00 62.24 C ATOM 328 O MET A 41 8.788 -11.575 -18.710 1.00 71.20 O ATOM 329 CB MET A 41 9.173 -8.489 -19.072 1.00 24.34 C ATOM 330 CG MET A 41 9.731 -8.107 -17.710 1.00 32.42 C ATOM 331 SD MET A 41 8.494 -8.205 -16.402 1.00 0.15 S ATOM 332 CE MET A 41 8.148 -9.963 -16.393 1.00 42.34 C ATOM 0 H MET A 41 8.371 -10.438 -20.954 1.00 5.42 H new ATOM 0 HA MET A 41 10.932 -9.435 -19.868 1.00 40.20 H new ATOM 0 HB2 MET A 41 9.251 -7.632 -19.741 1.00 24.34 H new ATOM 0 HB3 MET A 41 8.112 -8.718 -18.970 1.00 24.34 H new ATOM 0 HG2 MET A 41 10.565 -8.764 -17.466 1.00 32.42 H new ATOM 0 HG3 MET A 41 10.127 -7.093 -17.755 1.00 32.42 H new ATOM 0 HE1 MET A 41 7.424 -10.187 -15.609 1.00 42.34 H new ATOM 0 HE2 MET A 41 7.739 -10.258 -17.359 1.00 42.34 H new ATOM 0 HE3 MET A 41 9.069 -10.514 -16.205 1.00 42.34 H new ATOM 342 N ILE A 42 10.899 -11.145 -18.058 1.00 74.22 N ATOM 343 CA ILE A 42 10.957 -12.266 -17.129 1.00 75.35 C ATOM 344 C ILE A 42 11.615 -11.860 -15.816 1.00 25.23 C ATOM 345 O ILE A 42 12.432 -10.939 -15.778 1.00 72.02 O ATOM 346 CB ILE A 42 11.728 -13.456 -17.731 1.00 61.41 C ATOM 347 CG1 ILE A 42 13.222 -13.135 -17.814 1.00 11.34 C ATOM 348 CG2 ILE A 42 11.178 -13.803 -19.107 1.00 40.53 C ATOM 349 CD1 ILE A 42 13.614 -12.404 -19.079 1.00 11.35 C ATOM 0 H ILE A 42 11.753 -10.589 -18.102 1.00 74.22 H new ATOM 0 HA ILE A 42 9.928 -12.570 -16.937 1.00 75.35 H new ATOM 0 HB ILE A 42 11.597 -14.321 -17.080 1.00 61.41 H new ATOM 0 HG12 ILE A 42 13.504 -12.530 -16.952 1.00 11.34 H new ATOM 0 HG13 ILE A 42 13.789 -14.064 -17.750 1.00 11.34 H new ATOM 0 HG21 ILE A 42 11.733 -14.646 -19.519 1.00 40.53 H new ATOM 0 HG22 ILE A 42 10.125 -14.070 -19.021 1.00 40.53 H new ATOM 0 HG23 ILE A 42 11.282 -12.942 -19.768 1.00 40.53 H new ATOM 0 HD11 ILE A 42 14.686 -12.210 -19.069 1.00 11.35 H new ATOM 0 HD12 ILE A 42 13.364 -13.016 -19.945 1.00 11.35 H new ATOM 0 HD13 ILE A 42 13.074 -11.459 -19.135 1.00 11.35 H new ATOM 361 N PHE A 43 11.257 -12.554 -14.741 1.00 3.12 N ATOM 362 CA PHE A 43 11.815 -12.265 -13.425 1.00 32.34 C ATOM 363 C PHE A 43 12.730 -13.395 -12.963 1.00 5.43 C ATOM 364 O PHE A 43 12.496 -14.564 -13.270 1.00 42.51 O ATOM 365 CB PHE A 43 10.691 -12.056 -12.407 1.00 2.31 C ATOM 366 CG PHE A 43 9.901 -10.799 -12.636 1.00 25.04 C ATOM 367 CD1 PHE A 43 10.535 -9.568 -12.700 1.00 4.14 C ATOM 368 CD2 PHE A 43 8.525 -10.848 -12.787 1.00 60.42 C ATOM 369 CE1 PHE A 43 9.812 -8.410 -12.910 1.00 75.23 C ATOM 370 CE2 PHE A 43 7.796 -9.693 -13.000 1.00 30.24 C ATOM 371 CZ PHE A 43 8.440 -8.472 -13.059 1.00 52.04 C ATOM 0 H PHE A 43 10.584 -13.320 -14.755 1.00 3.12 H new ATOM 0 HA PHE A 43 12.404 -11.351 -13.500 1.00 32.34 H new ATOM 0 HB2 PHE A 43 10.016 -12.911 -12.442 1.00 2.31 H new ATOM 0 HB3 PHE A 43 11.119 -12.029 -11.405 1.00 2.31 H new ATOM 0 HD1 PHE A 43 11.607 -9.514 -12.584 1.00 4.14 H new ATOM 0 HD2 PHE A 43 8.016 -11.799 -12.738 1.00 60.42 H new ATOM 0 HE1 PHE A 43 10.319 -7.457 -12.958 1.00 75.23 H new ATOM 0 HE2 PHE A 43 6.724 -9.745 -13.120 1.00 30.24 H new ATOM 0 HZ PHE A 43 7.872 -7.568 -13.221 1.00 52.04 H new ATOM 381 N SER A 44 13.775 -13.036 -12.222 1.00 14.04 N ATOM 382 CA SER A 44 14.729 -14.018 -11.720 1.00 45.23 C ATOM 383 C SER A 44 15.351 -13.551 -10.408 1.00 54.41 C ATOM 384 O SER A 44 14.867 -12.610 -9.778 1.00 51.12 O ATOM 385 CB SER A 44 15.827 -14.269 -12.757 1.00 52.41 C ATOM 386 OG SER A 44 15.990 -15.656 -13.001 1.00 0.52 O ATOM 0 H SER A 44 13.982 -12.073 -11.957 1.00 14.04 H new ATOM 0 HA SER A 44 14.192 -14.948 -11.536 1.00 45.23 H new ATOM 0 HB2 SER A 44 15.576 -13.760 -13.688 1.00 52.41 H new ATOM 0 HB3 SER A 44 16.768 -13.845 -12.405 1.00 52.41 H new ATOM 0 HG SER A 44 15.167 -16.130 -12.758 1.00 0.52 H new ATOM 392 N LYS A 45 16.428 -14.214 -10.001 1.00 52.31 N ATOM 393 CA LYS A 45 17.118 -13.868 -8.765 1.00 31.32 C ATOM 394 C LYS A 45 18.630 -13.990 -8.934 1.00 31.03 C ATOM 395 O LYS A 45 19.125 -14.208 -10.039 1.00 52.53 O ATOM 396 CB LYS A 45 16.647 -14.771 -7.623 1.00 62.03 C ATOM 397 CG LYS A 45 15.398 -14.266 -6.923 1.00 74.32 C ATOM 398 CD LYS A 45 15.623 -14.102 -5.430 1.00 34.43 C ATOM 399 CE LYS A 45 15.073 -15.288 -4.650 1.00 74.02 C ATOM 400 NZ LYS A 45 16.103 -15.896 -3.765 1.00 65.15 N ATOM 0 H LYS A 45 16.842 -14.995 -10.510 1.00 52.31 H new ATOM 0 HA LYS A 45 16.879 -12.833 -8.522 1.00 31.32 H new ATOM 0 HB2 LYS A 45 16.454 -15.769 -8.016 1.00 62.03 H new ATOM 0 HB3 LYS A 45 17.450 -14.866 -6.892 1.00 62.03 H new ATOM 0 HG2 LYS A 45 15.100 -13.310 -7.354 1.00 74.32 H new ATOM 0 HG3 LYS A 45 14.577 -14.963 -7.094 1.00 74.32 H new ATOM 0 HD2 LYS A 45 16.690 -13.997 -5.231 1.00 34.43 H new ATOM 0 HD3 LYS A 45 15.143 -13.185 -5.087 1.00 34.43 H new ATOM 0 HE2 LYS A 45 14.223 -14.965 -4.049 1.00 74.02 H new ATOM 0 HE3 LYS A 45 14.703 -16.040 -5.346 1.00 74.02 H new ATOM 0 HZ1 LYS A 45 15.648 -16.265 -2.906 1.00 65.15 H new ATOM 0 HZ2 LYS A 45 16.577 -16.673 -4.267 1.00 65.15 H new ATOM 0 HZ3 LYS A 45 16.805 -15.175 -3.502 1.00 65.15 H new ATOM 414 N SER A 46 19.356 -13.850 -7.830 1.00 4.14 N ATOM 415 CA SER A 46 20.812 -13.942 -7.857 1.00 23.22 C ATOM 416 C SER A 46 21.263 -15.399 -7.901 1.00 53.34 C ATOM 417 O SER A 46 22.088 -15.779 -8.732 1.00 32.12 O ATOM 418 CB SER A 46 21.410 -13.249 -6.631 1.00 45.34 C ATOM 419 OG SER A 46 21.451 -11.843 -6.809 1.00 64.45 O ATOM 0 H SER A 46 18.961 -13.673 -6.906 1.00 4.14 H new ATOM 0 HA SER A 46 21.167 -13.442 -8.758 1.00 23.22 H new ATOM 0 HB2 SER A 46 20.818 -13.490 -5.748 1.00 45.34 H new ATOM 0 HB3 SER A 46 22.417 -13.626 -6.452 1.00 45.34 H new ATOM 0 HG SER A 46 21.836 -11.423 -6.011 1.00 64.45 H new ATOM 425 N TYR A 47 20.716 -16.209 -7.002 1.00 53.33 N ATOM 426 CA TYR A 47 21.063 -17.623 -6.937 1.00 21.03 C ATOM 427 C TYR A 47 19.811 -18.494 -6.993 1.00 65.15 C ATOM 428 O TYR A 47 19.448 -19.144 -6.012 1.00 24.04 O ATOM 429 CB TYR A 47 21.846 -17.919 -5.656 1.00 25.31 C ATOM 430 CG TYR A 47 21.480 -17.016 -4.500 1.00 54.23 C ATOM 431 CD1 TYR A 47 20.328 -17.240 -3.756 1.00 53.34 C ATOM 432 CD2 TYR A 47 22.285 -15.939 -4.152 1.00 54.45 C ATOM 433 CE1 TYR A 47 19.988 -16.417 -2.700 1.00 22.54 C ATOM 434 CE2 TYR A 47 21.954 -15.111 -3.096 1.00 72.34 C ATOM 435 CZ TYR A 47 20.805 -15.355 -2.373 1.00 53.42 C ATOM 436 OH TYR A 47 20.471 -14.533 -1.321 1.00 50.23 O ATOM 0 H TYR A 47 20.030 -15.910 -6.308 1.00 53.33 H new ATOM 0 HA TYR A 47 21.687 -17.858 -7.799 1.00 21.03 H new ATOM 0 HB2 TYR A 47 21.673 -18.955 -5.366 1.00 25.31 H new ATOM 0 HB3 TYR A 47 22.912 -17.819 -5.861 1.00 25.31 H new ATOM 0 HD1 TYR A 47 19.687 -18.072 -4.008 1.00 53.34 H new ATOM 0 HD2 TYR A 47 23.185 -15.745 -4.716 1.00 54.45 H new ATOM 0 HE1 TYR A 47 19.088 -16.604 -2.134 1.00 22.54 H new ATOM 0 HE2 TYR A 47 22.591 -14.278 -2.838 1.00 72.34 H new ATOM 0 HH TYR A 47 21.151 -13.835 -1.223 1.00 50.23 H new ATOM 446 N CYS A 48 19.158 -18.503 -8.149 1.00 73.04 N ATOM 447 CA CYS A 48 17.946 -19.294 -8.336 1.00 23.34 C ATOM 448 C CYS A 48 17.881 -19.864 -9.749 1.00 53.53 C ATOM 449 O CYS A 48 17.479 -19.190 -10.698 1.00 53.12 O ATOM 450 CB CYS A 48 16.707 -18.441 -8.060 1.00 23.13 C ATOM 451 SG CYS A 48 16.547 -17.909 -6.338 1.00 41.15 S ATOM 0 H CYS A 48 19.446 -17.972 -8.971 1.00 73.04 H new ATOM 0 HA CYS A 48 17.971 -20.124 -7.630 1.00 23.34 H new ATOM 0 HB2 CYS A 48 16.736 -17.559 -8.700 1.00 23.13 H new ATOM 0 HB3 CYS A 48 15.819 -19.008 -8.338 1.00 23.13 H new ATOM 0 HG CYS A 48 17.566 -18.339 -5.655 1.00 41.15 H new ATOM 457 N PRO A 49 18.287 -21.133 -9.895 1.00 61.32 N ATOM 458 CA PRO A 49 18.286 -21.821 -11.190 1.00 21.01 C ATOM 459 C PRO A 49 16.875 -22.112 -11.691 1.00 24.24 C ATOM 460 O PRO A 49 15.900 -21.947 -10.957 1.00 35.21 O ATOM 461 CB PRO A 49 19.030 -23.127 -10.899 1.00 42.43 C ATOM 462 CG PRO A 49 18.832 -23.359 -9.441 1.00 55.02 C ATOM 463 CD PRO A 49 18.779 -21.996 -8.808 1.00 51.01 C ATOM 0 HA PRO A 49 18.746 -21.217 -11.972 1.00 21.01 H new ATOM 0 HB2 PRO A 49 18.629 -23.951 -11.489 1.00 42.43 H new ATOM 0 HB3 PRO A 49 20.088 -23.043 -11.146 1.00 42.43 H new ATOM 0 HG2 PRO A 49 17.911 -23.912 -9.255 1.00 55.02 H new ATOM 0 HG3 PRO A 49 19.648 -23.951 -9.026 1.00 55.02 H new ATOM 0 HD2 PRO A 49 18.110 -21.979 -7.947 1.00 51.01 H new ATOM 0 HD3 PRO A 49 19.760 -21.678 -8.456 1.00 51.01 H new ATOM 471 N HIS A 50 16.774 -22.546 -12.942 1.00 52.11 N ATOM 472 CA HIS A 50 15.481 -22.861 -13.540 1.00 23.52 C ATOM 473 C HIS A 50 14.755 -21.589 -13.966 1.00 30.40 C ATOM 474 O HIS A 50 14.294 -21.477 -15.102 1.00 64.12 O ATOM 475 CB HIS A 50 14.619 -23.650 -12.554 1.00 53.11 C ATOM 476 CG HIS A 50 15.373 -24.710 -11.812 1.00 53.23 C ATOM 477 ND1 HIS A 50 16.086 -25.707 -12.443 1.00 2.21 N ATOM 478 CD2 HIS A 50 15.524 -24.923 -10.484 1.00 75.34 C ATOM 479 CE1 HIS A 50 16.642 -26.489 -11.535 1.00 4.42 C ATOM 480 NE2 HIS A 50 16.316 -26.036 -10.338 1.00 43.52 N ATOM 0 H HIS A 50 17.571 -22.688 -13.562 1.00 52.11 H new ATOM 0 HA HIS A 50 15.656 -23.471 -14.426 1.00 23.52 H new ATOM 0 HB2 HIS A 50 14.179 -22.959 -11.835 1.00 53.11 H new ATOM 0 HB3 HIS A 50 13.795 -24.114 -13.096 1.00 53.11 H new ATOM 0 HD2 HIS A 50 15.101 -24.329 -9.688 1.00 75.34 H new ATOM 0 HE1 HIS A 50 17.259 -27.352 -11.737 1.00 4.42 H new ATOM 0 HE2 HIS A 50 16.605 -26.446 -9.450 1.00 43.52 H new ATOM 488 N SER A 51 14.656 -20.634 -13.047 1.00 13.31 N ATOM 489 CA SER A 51 13.982 -19.372 -13.326 1.00 33.10 C ATOM 490 C SER A 51 14.837 -18.486 -14.227 1.00 22.51 C ATOM 491 O SER A 51 14.321 -17.636 -14.953 1.00 5.43 O ATOM 492 CB SER A 51 13.667 -18.639 -12.021 1.00 55.41 C ATOM 493 OG SER A 51 13.509 -17.248 -12.243 1.00 40.42 O ATOM 0 H SER A 51 15.034 -20.710 -12.103 1.00 13.31 H new ATOM 0 HA SER A 51 13.049 -19.594 -13.845 1.00 33.10 H new ATOM 0 HB2 SER A 51 12.756 -19.046 -11.582 1.00 55.41 H new ATOM 0 HB3 SER A 51 14.470 -18.807 -11.303 1.00 55.41 H new ATOM 0 HG SER A 51 13.276 -16.807 -11.400 1.00 40.42 H new ATOM 499 N THR A 52 16.150 -18.692 -14.175 1.00 32.22 N ATOM 500 CA THR A 52 17.079 -17.913 -14.983 1.00 73.20 C ATOM 501 C THR A 52 17.249 -18.526 -16.368 1.00 64.22 C ATOM 502 O THR A 52 17.180 -17.828 -17.380 1.00 12.14 O ATOM 503 CB THR A 52 18.459 -17.807 -14.308 1.00 10.23 C ATOM 504 OG1 THR A 52 18.379 -16.949 -13.164 1.00 24.51 O ATOM 505 CG2 THR A 52 19.497 -17.268 -15.281 1.00 11.43 C ATOM 0 H THR A 52 16.593 -19.393 -13.581 1.00 32.22 H new ATOM 0 HA THR A 52 16.653 -16.914 -15.080 1.00 73.20 H new ATOM 0 HB THR A 52 18.763 -18.805 -13.993 1.00 10.23 H new ATOM 0 HG1 THR A 52 17.483 -16.555 -13.113 1.00 24.51 H new ATOM 0 HG21 THR A 52 20.464 -17.202 -14.782 1.00 11.43 H new ATOM 0 HG22 THR A 52 19.576 -17.938 -16.137 1.00 11.43 H new ATOM 0 HG23 THR A 52 19.196 -16.277 -15.622 1.00 11.43 H new ATOM 513 N ARG A 53 17.472 -19.836 -16.407 1.00 43.32 N ATOM 514 CA ARG A 53 17.653 -20.543 -17.669 1.00 12.33 C ATOM 515 C ARG A 53 16.512 -20.234 -18.634 1.00 63.41 C ATOM 516 O ARG A 53 16.736 -19.983 -19.818 1.00 65.22 O ATOM 517 CB ARG A 53 17.737 -22.051 -17.426 1.00 11.12 C ATOM 518 CG ARG A 53 16.947 -22.875 -18.429 1.00 51.45 C ATOM 519 CD ARG A 53 17.116 -24.366 -18.184 1.00 5.14 C ATOM 520 NE ARG A 53 18.162 -24.943 -19.024 1.00 73.31 N ATOM 521 CZ ARG A 53 18.762 -26.099 -18.760 1.00 11.21 C ATOM 522 NH1 ARG A 53 18.421 -26.795 -17.685 1.00 65.21 N ATOM 523 NH2 ARG A 53 19.706 -26.558 -19.572 1.00 74.21 N ATOM 0 H ARG A 53 17.532 -20.429 -15.579 1.00 43.32 H new ATOM 0 HA ARG A 53 18.586 -20.202 -18.117 1.00 12.33 H new ATOM 0 HB2 ARG A 53 18.782 -22.358 -17.460 1.00 11.12 H new ATOM 0 HB3 ARG A 53 17.373 -22.269 -16.422 1.00 11.12 H new ATOM 0 HG2 ARG A 53 15.891 -22.612 -18.365 1.00 51.45 H new ATOM 0 HG3 ARG A 53 17.275 -22.632 -19.440 1.00 51.45 H new ATOM 0 HD2 ARG A 53 17.358 -24.536 -17.135 1.00 5.14 H new ATOM 0 HD3 ARG A 53 16.172 -24.875 -18.379 1.00 5.14 H new ATOM 0 HE ARG A 53 18.448 -24.431 -19.859 1.00 73.31 H new ATOM 0 HH11 ARG A 53 17.697 -26.444 -17.059 1.00 65.21 H new ATOM 0 HH12 ARG A 53 18.883 -27.682 -17.484 1.00 65.21 H new ATOM 0 HH21 ARG A 53 19.971 -26.023 -20.399 1.00 74.21 H new ATOM 0 HH22 ARG A 53 20.166 -27.445 -19.369 1.00 74.21 H new ATOM 537 N VAL A 54 15.286 -20.256 -18.119 1.00 22.50 N ATOM 538 CA VAL A 54 14.109 -19.979 -18.934 1.00 25.34 C ATOM 539 C VAL A 54 14.289 -18.698 -19.740 1.00 64.24 C ATOM 540 O VAL A 54 13.737 -18.555 -20.831 1.00 51.00 O ATOM 541 CB VAL A 54 12.843 -19.853 -18.066 1.00 51.20 C ATOM 542 CG1 VAL A 54 12.871 -18.561 -17.264 1.00 63.33 C ATOM 543 CG2 VAL A 54 11.595 -19.926 -18.933 1.00 73.20 C ATOM 0 H VAL A 54 15.083 -20.463 -17.141 1.00 22.50 H new ATOM 0 HA VAL A 54 13.990 -20.821 -19.616 1.00 25.34 H new ATOM 0 HB VAL A 54 12.820 -20.686 -17.364 1.00 51.20 H new ATOM 0 HG11 VAL A 54 11.968 -18.490 -16.657 1.00 63.33 H new ATOM 0 HG12 VAL A 54 13.746 -18.555 -16.615 1.00 63.33 H new ATOM 0 HG13 VAL A 54 12.918 -17.711 -17.945 1.00 63.33 H new ATOM 0 HG21 VAL A 54 10.709 -19.835 -18.304 1.00 73.20 H new ATOM 0 HG22 VAL A 54 11.609 -19.114 -19.660 1.00 73.20 H new ATOM 0 HG23 VAL A 54 11.572 -20.881 -19.457 1.00 73.20 H new ATOM 553 N LYS A 55 15.066 -17.767 -19.197 1.00 65.50 N ATOM 554 CA LYS A 55 15.323 -16.497 -19.866 1.00 33.23 C ATOM 555 C LYS A 55 16.423 -16.644 -20.910 1.00 64.22 C ATOM 556 O LYS A 55 16.389 -15.996 -21.956 1.00 64.33 O ATOM 557 CB LYS A 55 15.715 -15.428 -18.843 1.00 60.50 C ATOM 558 CG LYS A 55 17.205 -15.140 -18.806 1.00 1.13 C ATOM 559 CD LYS A 55 17.565 -14.206 -17.663 1.00 41.21 C ATOM 560 CE LYS A 55 19.042 -14.297 -17.312 1.00 33.33 C ATOM 561 NZ LYS A 55 19.868 -13.378 -18.142 1.00 12.23 N ATOM 0 H LYS A 55 15.529 -17.868 -18.294 1.00 65.50 H new ATOM 0 HA LYS A 55 14.407 -16.190 -20.371 1.00 33.23 H new ATOM 0 HB2 LYS A 55 15.181 -14.506 -19.071 1.00 60.50 H new ATOM 0 HB3 LYS A 55 15.391 -15.748 -17.853 1.00 60.50 H new ATOM 0 HG2 LYS A 55 17.755 -16.075 -18.699 1.00 1.13 H new ATOM 0 HG3 LYS A 55 17.514 -14.695 -19.752 1.00 1.13 H new ATOM 0 HD2 LYS A 55 17.318 -13.181 -17.938 1.00 41.21 H new ATOM 0 HD3 LYS A 55 16.966 -14.454 -16.787 1.00 41.21 H new ATOM 0 HE2 LYS A 55 19.180 -14.057 -16.258 1.00 33.33 H new ATOM 0 HE3 LYS A 55 19.386 -15.322 -17.453 1.00 33.33 H new ATOM 0 HZ1 LYS A 55 20.841 -13.741 -18.198 1.00 12.23 H new ATOM 0 HZ2 LYS A 55 19.465 -13.318 -19.099 1.00 12.23 H new ATOM 0 HZ3 LYS A 55 19.876 -12.432 -17.710 1.00 12.23 H new ATOM 575 N GLU A 56 17.398 -17.501 -20.621 1.00 41.21 N ATOM 576 CA GLU A 56 18.509 -17.732 -21.537 1.00 75.41 C ATOM 577 C GLU A 56 18.026 -18.408 -22.817 1.00 34.50 C ATOM 578 O GLU A 56 18.713 -18.391 -23.839 1.00 54.43 O ATOM 579 CB GLU A 56 19.582 -18.593 -20.866 1.00 34.12 C ATOM 580 CG GLU A 56 20.931 -17.903 -20.751 1.00 73.41 C ATOM 581 CD GLU A 56 21.759 -18.432 -19.596 1.00 0.31 C ATOM 582 OE1 GLU A 56 22.024 -19.651 -19.565 1.00 32.43 O ATOM 583 OE2 GLU A 56 22.143 -17.624 -18.724 1.00 52.11 O ATOM 0 H GLU A 56 17.441 -18.046 -19.760 1.00 41.21 H new ATOM 0 HA GLU A 56 18.940 -16.765 -21.797 1.00 75.41 H new ATOM 0 HB2 GLU A 56 19.240 -18.873 -19.870 1.00 34.12 H new ATOM 0 HB3 GLU A 56 19.702 -19.516 -21.433 1.00 34.12 H new ATOM 0 HG2 GLU A 56 21.484 -18.037 -21.681 1.00 73.41 H new ATOM 0 HG3 GLU A 56 20.777 -16.832 -20.623 1.00 73.41 H new ATOM 590 N LEU A 57 16.840 -19.005 -22.753 1.00 21.24 N ATOM 591 CA LEU A 57 16.264 -19.689 -23.906 1.00 24.42 C ATOM 592 C LEU A 57 15.780 -18.685 -24.948 1.00 63.32 C ATOM 593 O LEU A 57 16.011 -18.858 -26.145 1.00 75.34 O ATOM 594 CB LEU A 57 15.104 -20.584 -23.467 1.00 22.13 C ATOM 595 CG LEU A 57 14.114 -20.985 -24.560 1.00 22.12 C ATOM 596 CD1 LEU A 57 14.852 -21.514 -25.780 1.00 33.43 C ATOM 597 CD2 LEU A 57 13.132 -22.022 -24.036 1.00 14.32 C ATOM 0 H LEU A 57 16.259 -19.029 -21.915 1.00 21.24 H new ATOM 0 HA LEU A 57 17.041 -20.307 -24.356 1.00 24.42 H new ATOM 0 HB2 LEU A 57 15.518 -21.492 -23.029 1.00 22.13 H new ATOM 0 HB3 LEU A 57 14.555 -20.071 -22.678 1.00 22.13 H new ATOM 0 HG LEU A 57 13.551 -20.100 -24.857 1.00 22.12 H new ATOM 0 HD11 LEU A 57 14.131 -21.795 -26.548 1.00 33.43 H new ATOM 0 HD12 LEU A 57 15.514 -20.740 -26.169 1.00 33.43 H new ATOM 0 HD13 LEU A 57 15.441 -22.387 -25.499 1.00 33.43 H new ATOM 0 HD21 LEU A 57 12.435 -22.296 -24.828 1.00 14.32 H new ATOM 0 HD22 LEU A 57 13.677 -22.908 -23.711 1.00 14.32 H new ATOM 0 HD23 LEU A 57 12.579 -21.607 -23.193 1.00 14.32 H new ATOM 609 N PHE A 58 15.112 -17.635 -24.484 1.00 12.50 N ATOM 610 CA PHE A 58 14.596 -16.602 -25.375 1.00 42.13 C ATOM 611 C PHE A 58 15.693 -16.087 -26.303 1.00 23.51 C ATOM 612 O PHE A 58 15.454 -15.832 -27.483 1.00 53.24 O ATOM 613 CB PHE A 58 14.014 -15.443 -24.564 1.00 51.05 C ATOM 614 CG PHE A 58 12.662 -15.740 -23.981 1.00 73.23 C ATOM 615 CD1 PHE A 58 11.685 -16.363 -24.742 1.00 42.52 C ATOM 616 CD2 PHE A 58 12.367 -15.397 -22.672 1.00 44.20 C ATOM 617 CE1 PHE A 58 10.440 -16.637 -24.208 1.00 63.53 C ATOM 618 CE2 PHE A 58 11.125 -15.670 -22.132 1.00 14.44 C ATOM 619 CZ PHE A 58 10.160 -16.289 -22.902 1.00 55.00 C ATOM 0 H PHE A 58 14.915 -17.476 -23.496 1.00 12.50 H new ATOM 0 HA PHE A 58 13.806 -17.043 -25.983 1.00 42.13 H new ATOM 0 HB2 PHE A 58 14.702 -15.193 -23.757 1.00 51.05 H new ATOM 0 HB3 PHE A 58 13.940 -14.563 -25.203 1.00 51.05 H new ATOM 0 HD1 PHE A 58 11.899 -16.638 -25.764 1.00 42.52 H new ATOM 0 HD2 PHE A 58 13.117 -14.910 -22.066 1.00 44.20 H new ATOM 0 HE1 PHE A 58 9.687 -17.123 -24.812 1.00 63.53 H new ATOM 0 HE2 PHE A 58 10.909 -15.400 -21.109 1.00 14.44 H new ATOM 0 HZ PHE A 58 9.187 -16.501 -22.483 1.00 55.00 H new ATOM 629 N SER A 59 16.897 -15.938 -25.760 1.00 63.11 N ATOM 630 CA SER A 59 18.031 -15.450 -26.537 1.00 63.54 C ATOM 631 C SER A 59 18.238 -16.300 -27.787 1.00 42.44 C ATOM 632 O SER A 59 18.409 -15.773 -28.887 1.00 62.10 O ATOM 633 CB SER A 59 19.302 -15.458 -25.685 1.00 71.31 C ATOM 634 OG SER A 59 20.324 -14.685 -26.287 1.00 63.34 O ATOM 0 H SER A 59 17.113 -16.148 -24.785 1.00 63.11 H new ATOM 0 HA SER A 59 17.816 -14.427 -26.845 1.00 63.54 H new ATOM 0 HB2 SER A 59 19.081 -15.065 -24.693 1.00 71.31 H new ATOM 0 HB3 SER A 59 19.648 -16.483 -25.552 1.00 71.31 H new ATOM 0 HG SER A 59 21.125 -14.705 -25.722 1.00 63.34 H new ATOM 640 N SER A 60 18.222 -17.616 -27.610 1.00 71.22 N ATOM 641 CA SER A 60 18.412 -18.540 -28.723 1.00 0.43 C ATOM 642 C SER A 60 17.216 -18.502 -29.670 1.00 44.34 C ATOM 643 O SER A 60 17.251 -19.083 -30.756 1.00 3.14 O ATOM 644 CB SER A 60 18.619 -19.964 -28.202 1.00 43.24 C ATOM 645 OG SER A 60 18.491 -20.912 -29.247 1.00 34.43 O ATOM 0 H SER A 60 18.079 -18.068 -26.707 1.00 71.22 H new ATOM 0 HA SER A 60 19.300 -18.230 -29.273 1.00 0.43 H new ATOM 0 HB2 SER A 60 19.607 -20.049 -27.749 1.00 43.24 H new ATOM 0 HB3 SER A 60 17.890 -20.178 -27.421 1.00 43.24 H new ATOM 0 HG SER A 60 18.226 -20.455 -30.073 1.00 34.43 H new ATOM 651 N LEU A 61 16.160 -17.814 -29.253 1.00 1.25 N ATOM 652 CA LEU A 61 14.953 -17.699 -30.063 1.00 15.45 C ATOM 653 C LEU A 61 15.027 -16.485 -30.982 1.00 44.54 C ATOM 654 O LEU A 61 14.034 -16.096 -31.596 1.00 4.40 O ATOM 655 CB LEU A 61 13.720 -17.597 -29.164 1.00 53.12 C ATOM 656 CG LEU A 61 12.507 -18.427 -29.589 1.00 41.54 C ATOM 657 CD1 LEU A 61 12.274 -18.300 -31.087 1.00 52.33 C ATOM 658 CD2 LEU A 61 12.696 -19.884 -29.199 1.00 20.54 C ATOM 0 H LEU A 61 16.115 -17.327 -28.358 1.00 1.25 H new ATOM 0 HA LEU A 61 14.873 -18.594 -30.680 1.00 15.45 H new ATOM 0 HB2 LEU A 61 14.005 -17.897 -28.156 1.00 53.12 H new ATOM 0 HB3 LEU A 61 13.419 -16.551 -29.112 1.00 53.12 H new ATOM 0 HG LEU A 61 11.628 -18.044 -29.071 1.00 41.54 H new ATOM 0 HD11 LEU A 61 11.408 -18.897 -31.372 1.00 52.33 H new ATOM 0 HD12 LEU A 61 12.094 -17.255 -31.340 1.00 52.33 H new ATOM 0 HD13 LEU A 61 13.153 -18.657 -31.624 1.00 52.33 H new ATOM 0 HD21 LEU A 61 11.824 -20.460 -29.509 1.00 20.54 H new ATOM 0 HD22 LEU A 61 13.585 -20.280 -29.690 1.00 20.54 H new ATOM 0 HD23 LEU A 61 12.815 -19.959 -28.118 1.00 20.54 H new ATOM 670 N GLY A 62 16.214 -15.891 -31.075 1.00 11.32 N ATOM 671 CA GLY A 62 16.397 -14.727 -31.923 1.00 22.21 C ATOM 672 C GLY A 62 15.593 -13.532 -31.450 1.00 52.12 C ATOM 673 O GLY A 62 15.456 -12.543 -32.170 1.00 64.13 O ATOM 0 H GLY A 62 17.051 -16.195 -30.578 1.00 11.32 H new ATOM 0 HA2 GLY A 62 17.454 -14.463 -31.948 1.00 22.21 H new ATOM 0 HA3 GLY A 62 16.106 -14.976 -32.944 1.00 22.21 H new ATOM 677 N VAL A 63 15.058 -13.623 -30.237 1.00 12.11 N ATOM 678 CA VAL A 63 14.263 -12.541 -29.669 1.00 62.20 C ATOM 679 C VAL A 63 14.988 -11.880 -28.502 1.00 72.05 C ATOM 680 O VAL A 63 15.989 -12.397 -28.007 1.00 64.52 O ATOM 681 CB VAL A 63 12.890 -13.047 -29.186 1.00 42.30 C ATOM 682 CG1 VAL A 63 12.983 -13.562 -27.758 1.00 64.11 C ATOM 683 CG2 VAL A 63 11.848 -11.945 -29.297 1.00 55.31 C ATOM 0 H VAL A 63 15.161 -14.435 -29.628 1.00 12.11 H new ATOM 0 HA VAL A 63 14.114 -11.808 -30.462 1.00 62.20 H new ATOM 0 HB VAL A 63 12.581 -13.874 -29.825 1.00 42.30 H new ATOM 0 HG11 VAL A 63 12.004 -13.915 -27.434 1.00 64.11 H new ATOM 0 HG12 VAL A 63 13.698 -14.383 -27.713 1.00 64.11 H new ATOM 0 HG13 VAL A 63 13.314 -12.757 -27.102 1.00 64.11 H new ATOM 0 HG21 VAL A 63 10.884 -12.319 -28.952 1.00 55.31 H new ATOM 0 HG22 VAL A 63 12.149 -11.097 -28.682 1.00 55.31 H new ATOM 0 HG23 VAL A 63 11.763 -11.628 -30.336 1.00 55.31 H new ATOM 693 N VAL A 64 14.476 -10.734 -28.067 1.00 34.44 N ATOM 694 CA VAL A 64 15.073 -10.002 -26.956 1.00 74.14 C ATOM 695 C VAL A 64 14.155 -10.005 -25.739 1.00 61.20 C ATOM 696 O VAL A 64 12.938 -10.146 -25.866 1.00 42.40 O ATOM 697 CB VAL A 64 15.384 -8.545 -27.347 1.00 42.15 C ATOM 698 CG1 VAL A 64 14.098 -7.772 -27.595 1.00 3.20 C ATOM 699 CG2 VAL A 64 16.221 -7.872 -26.270 1.00 50.32 C ATOM 0 H VAL A 64 13.649 -10.292 -28.467 1.00 34.44 H new ATOM 0 HA VAL A 64 16.004 -10.510 -26.706 1.00 74.14 H new ATOM 0 HB VAL A 64 15.960 -8.551 -28.272 1.00 42.15 H new ATOM 0 HG11 VAL A 64 14.338 -6.745 -27.870 1.00 3.20 H new ATOM 0 HG12 VAL A 64 13.540 -8.243 -28.404 1.00 3.20 H new ATOM 0 HG13 VAL A 64 13.492 -7.773 -26.689 1.00 3.20 H new ATOM 0 HG21 VAL A 64 16.432 -6.843 -26.563 1.00 50.32 H new ATOM 0 HG22 VAL A 64 15.673 -7.876 -25.328 1.00 50.32 H new ATOM 0 HG23 VAL A 64 17.159 -8.413 -26.147 1.00 50.32 H new ATOM 709 N TYR A 65 14.746 -9.849 -24.560 1.00 11.22 N ATOM 710 CA TYR A 65 13.982 -9.835 -23.318 1.00 30.23 C ATOM 711 C TYR A 65 14.650 -8.943 -22.276 1.00 40.25 C ATOM 712 O TYR A 65 15.802 -8.541 -22.435 1.00 4.54 O ATOM 713 CB TYR A 65 13.834 -11.256 -22.770 1.00 44.31 C ATOM 714 CG TYR A 65 15.135 -12.023 -22.719 1.00 4.22 C ATOM 715 CD1 TYR A 65 15.639 -12.653 -23.850 1.00 74.14 C ATOM 716 CD2 TYR A 65 15.864 -12.117 -21.539 1.00 54.50 C ATOM 717 CE1 TYR A 65 16.827 -13.356 -23.808 1.00 62.25 C ATOM 718 CE2 TYR A 65 17.054 -12.816 -21.488 1.00 71.32 C ATOM 719 CZ TYR A 65 17.531 -13.434 -22.625 1.00 73.24 C ATOM 720 OH TYR A 65 18.716 -14.132 -22.579 1.00 31.41 O ATOM 0 H TYR A 65 15.752 -9.730 -24.438 1.00 11.22 H new ATOM 0 HA TYR A 65 12.993 -9.431 -23.535 1.00 30.23 H new ATOM 0 HB2 TYR A 65 13.411 -11.207 -21.767 1.00 44.31 H new ATOM 0 HB3 TYR A 65 13.123 -11.803 -23.389 1.00 44.31 H new ATOM 0 HD1 TYR A 65 15.092 -12.592 -24.779 1.00 74.14 H new ATOM 0 HD2 TYR A 65 15.493 -11.635 -20.647 1.00 54.50 H new ATOM 0 HE1 TYR A 65 17.202 -13.842 -24.697 1.00 62.25 H new ATOM 0 HE2 TYR A 65 17.608 -12.878 -20.563 1.00 71.32 H new ATOM 0 HH TYR A 65 19.086 -14.089 -21.673 1.00 31.41 H new ATOM 730 N ASN A 66 13.917 -8.637 -21.211 1.00 54.21 N ATOM 731 CA ASN A 66 14.438 -7.792 -20.142 1.00 22.15 C ATOM 732 C ASN A 66 14.973 -8.639 -18.991 1.00 61.20 C ATOM 733 O ASN A 66 14.426 -9.697 -18.680 1.00 21.43 O ATOM 734 CB ASN A 66 13.346 -6.849 -19.631 1.00 71.13 C ATOM 735 CG ASN A 66 13.916 -5.640 -18.915 1.00 32.32 C ATOM 736 OD1 ASN A 66 13.696 -5.455 -17.718 1.00 3.33 O ATOM 737 ND2 ASN A 66 14.650 -4.811 -19.645 1.00 65.15 N ATOM 0 H ASN A 66 12.961 -8.961 -21.065 1.00 54.21 H new ATOM 0 HA ASN A 66 15.259 -7.201 -20.547 1.00 22.15 H new ATOM 0 HB2 ASN A 66 12.735 -6.516 -20.470 1.00 71.13 H new ATOM 0 HB3 ASN A 66 12.688 -7.393 -18.953 1.00 71.13 H new ATOM 0 HD21 ASN A 66 15.058 -3.980 -19.217 1.00 65.15 H new ATOM 0 HD22 ASN A 66 14.806 -5.004 -20.634 1.00 65.15 H new ATOM 744 N ILE A 67 16.044 -8.165 -18.364 1.00 22.54 N ATOM 745 CA ILE A 67 16.651 -8.877 -17.247 1.00 24.44 C ATOM 746 C ILE A 67 16.340 -8.190 -15.921 1.00 74.43 C ATOM 747 O ILE A 67 16.800 -7.077 -15.663 1.00 74.31 O ATOM 748 CB ILE A 67 18.179 -8.983 -17.410 1.00 43.54 C ATOM 749 CG1 ILE A 67 18.536 -9.349 -18.852 1.00 12.40 C ATOM 750 CG2 ILE A 67 18.746 -10.010 -16.442 1.00 63.22 C ATOM 751 CD1 ILE A 67 17.892 -10.633 -19.327 1.00 1.04 C ATOM 0 H ILE A 67 16.509 -7.291 -18.611 1.00 22.54 H new ATOM 0 HA ILE A 67 16.223 -9.879 -17.243 1.00 24.44 H new ATOM 0 HB ILE A 67 18.621 -8.014 -17.180 1.00 43.54 H new ATOM 0 HG12 ILE A 67 18.233 -8.535 -19.510 1.00 12.40 H new ATOM 0 HG13 ILE A 67 19.619 -9.442 -18.937 1.00 12.40 H new ATOM 0 HG21 ILE A 67 19.827 -10.073 -16.570 1.00 63.22 H new ATOM 0 HG22 ILE A 67 18.519 -9.710 -15.419 1.00 63.22 H new ATOM 0 HG23 ILE A 67 18.300 -10.984 -16.642 1.00 63.22 H new ATOM 0 HD11 ILE A 67 18.189 -10.830 -20.357 1.00 1.04 H new ATOM 0 HD12 ILE A 67 18.215 -11.458 -18.692 1.00 1.04 H new ATOM 0 HD13 ILE A 67 16.807 -10.537 -19.274 1.00 1.04 H new ATOM 763 N LEU A 68 15.557 -8.862 -15.084 1.00 13.44 N ATOM 764 CA LEU A 68 15.184 -8.317 -13.783 1.00 34.34 C ATOM 765 C LEU A 68 15.353 -9.363 -12.686 1.00 31.01 C ATOM 766 O LEU A 68 14.796 -10.458 -12.769 1.00 2.01 O ATOM 767 CB LEU A 68 13.738 -7.820 -13.811 1.00 55.23 C ATOM 768 CG LEU A 68 13.324 -7.026 -15.051 1.00 65.25 C ATOM 769 CD1 LEU A 68 12.203 -7.739 -15.793 1.00 10.23 C ATOM 770 CD2 LEU A 68 12.900 -5.617 -14.666 1.00 45.33 C ATOM 0 H LEU A 68 15.169 -9.784 -15.283 1.00 13.44 H new ATOM 0 HA LEU A 68 15.845 -7.478 -13.565 1.00 34.34 H new ATOM 0 HB2 LEU A 68 13.077 -8.682 -13.719 1.00 55.23 H new ATOM 0 HB3 LEU A 68 13.572 -7.196 -12.933 1.00 55.23 H new ATOM 0 HG LEU A 68 14.184 -6.955 -15.717 1.00 65.25 H new ATOM 0 HD11 LEU A 68 11.922 -7.159 -16.672 1.00 10.23 H new ATOM 0 HD12 LEU A 68 12.543 -8.727 -16.104 1.00 10.23 H new ATOM 0 HD13 LEU A 68 11.340 -7.843 -15.136 1.00 10.23 H new ATOM 0 HD21 LEU A 68 12.609 -5.067 -15.561 1.00 45.33 H new ATOM 0 HD22 LEU A 68 12.055 -5.666 -13.980 1.00 45.33 H new ATOM 0 HD23 LEU A 68 13.732 -5.106 -14.181 1.00 45.33 H new ATOM 782 N GLU A 69 16.122 -9.018 -11.658 1.00 44.44 N ATOM 783 CA GLU A 69 16.362 -9.928 -10.544 1.00 53.54 C ATOM 784 C GLU A 69 15.789 -9.363 -9.247 1.00 41.44 C ATOM 785 O GLU A 69 16.236 -8.324 -8.760 1.00 31.05 O ATOM 786 CB GLU A 69 17.861 -10.187 -10.383 1.00 21.10 C ATOM 787 CG GLU A 69 18.558 -10.561 -11.681 1.00 30.24 C ATOM 788 CD GLU A 69 20.065 -10.629 -11.535 1.00 5.43 C ATOM 789 OE1 GLU A 69 20.545 -10.785 -10.392 1.00 54.31 O ATOM 790 OE2 GLU A 69 20.767 -10.525 -12.563 1.00 50.51 O ATOM 0 H GLU A 69 16.589 -8.115 -11.574 1.00 44.44 H new ATOM 0 HA GLU A 69 15.859 -10.870 -10.762 1.00 53.54 H new ATOM 0 HB2 GLU A 69 18.333 -9.295 -9.971 1.00 21.10 H new ATOM 0 HB3 GLU A 69 18.007 -10.988 -9.658 1.00 21.10 H new ATOM 0 HG2 GLU A 69 18.186 -11.527 -12.024 1.00 30.24 H new ATOM 0 HG3 GLU A 69 18.304 -9.831 -12.449 1.00 30.24 H new ATOM 797 N LEU A 70 14.799 -10.053 -8.696 1.00 34.24 N ATOM 798 CA LEU A 70 14.163 -9.622 -7.455 1.00 52.14 C ATOM 799 C LEU A 70 15.160 -9.632 -6.300 1.00 55.15 C ATOM 800 O LEU A 70 14.916 -9.035 -5.252 1.00 25.11 O ATOM 801 CB LEU A 70 12.974 -10.526 -7.126 1.00 72.41 C ATOM 802 CG LEU A 70 11.910 -10.659 -8.217 1.00 30.41 C ATOM 803 CD1 LEU A 70 11.852 -9.398 -9.063 1.00 41.42 C ATOM 804 CD2 LEU A 70 12.190 -11.876 -9.088 1.00 15.04 C ATOM 0 H LEU A 70 14.418 -10.914 -9.088 1.00 34.24 H new ATOM 0 HA LEU A 70 13.807 -8.601 -7.594 1.00 52.14 H new ATOM 0 HB2 LEU A 70 13.353 -11.521 -6.893 1.00 72.41 H new ATOM 0 HB3 LEU A 70 12.495 -10.148 -6.223 1.00 72.41 H new ATOM 0 HG LEU A 70 10.940 -10.794 -7.738 1.00 30.41 H new ATOM 0 HD11 LEU A 70 11.089 -9.512 -9.834 1.00 41.42 H new ATOM 0 HD12 LEU A 70 11.604 -8.546 -8.430 1.00 41.42 H new ATOM 0 HD13 LEU A 70 12.821 -9.231 -9.533 1.00 41.42 H new ATOM 0 HD21 LEU A 70 11.424 -11.956 -9.859 1.00 15.04 H new ATOM 0 HD22 LEU A 70 13.168 -11.770 -9.558 1.00 15.04 H new ATOM 0 HD23 LEU A 70 12.179 -12.775 -8.472 1.00 15.04 H new ATOM 816 N ASP A 71 16.282 -10.313 -6.501 1.00 24.21 N ATOM 817 CA ASP A 71 17.318 -10.400 -5.478 1.00 14.42 C ATOM 818 C ASP A 71 18.325 -9.263 -5.628 1.00 64.43 C ATOM 819 O ASP A 71 19.339 -9.225 -4.931 1.00 71.41 O ATOM 820 CB ASP A 71 18.035 -11.747 -5.560 1.00 23.41 C ATOM 821 CG ASP A 71 18.238 -12.380 -4.197 1.00 13.13 C ATOM 822 OD1 ASP A 71 17.301 -12.326 -3.373 1.00 11.02 O ATOM 823 OD2 ASP A 71 19.332 -12.928 -3.955 1.00 21.31 O ATOM 0 H ASP A 71 16.498 -10.813 -7.363 1.00 24.21 H new ATOM 0 HA ASP A 71 16.839 -10.312 -4.503 1.00 14.42 H new ATOM 0 HB2 ASP A 71 17.458 -12.424 -6.189 1.00 23.41 H new ATOM 0 HB3 ASP A 71 19.003 -11.611 -6.042 1.00 23.41 H new ATOM 828 N GLN A 72 18.040 -8.342 -6.542 1.00 34.20 N ATOM 829 CA GLN A 72 18.922 -7.208 -6.784 1.00 13.40 C ATOM 830 C GLN A 72 18.195 -5.890 -6.534 1.00 14.21 C ATOM 831 O GLN A 72 18.799 -4.910 -6.098 1.00 14.41 O ATOM 832 CB GLN A 72 19.454 -7.245 -8.217 1.00 45.24 C ATOM 833 CG GLN A 72 20.483 -8.339 -8.456 1.00 3.44 C ATOM 834 CD GLN A 72 21.763 -8.116 -7.675 1.00 25.32 C ATOM 835 OE1 GLN A 72 22.147 -8.939 -6.843 1.00 41.12 O ATOM 836 NE2 GLN A 72 22.431 -6.999 -7.938 1.00 43.22 N ATOM 0 H GLN A 72 17.205 -8.359 -7.127 1.00 34.20 H new ATOM 0 HA GLN A 72 19.760 -7.278 -6.091 1.00 13.40 H new ATOM 0 HB2 GLN A 72 18.618 -7.388 -8.902 1.00 45.24 H new ATOM 0 HB3 GLN A 72 19.900 -6.280 -8.455 1.00 45.24 H new ATOM 0 HG2 GLN A 72 20.055 -9.302 -8.178 1.00 3.44 H new ATOM 0 HG3 GLN A 72 20.715 -8.389 -9.520 1.00 3.44 H new ATOM 0 HE21 GLN A 72 22.076 -6.345 -8.636 1.00 43.22 H new ATOM 0 HE22 GLN A 72 23.299 -6.795 -7.443 1.00 43.22 H new ATOM 845 N VAL A 73 16.895 -5.874 -6.813 1.00 41.01 N ATOM 846 CA VAL A 73 16.086 -4.677 -6.617 1.00 71.02 C ATOM 847 C VAL A 73 16.109 -4.231 -5.160 1.00 15.33 C ATOM 848 O VAL A 73 16.782 -4.836 -4.325 1.00 13.23 O ATOM 849 CB VAL A 73 14.625 -4.910 -7.049 1.00 24.34 C ATOM 850 CG1 VAL A 73 14.526 -5.011 -8.563 1.00 31.34 C ATOM 851 CG2 VAL A 73 14.068 -6.161 -6.384 1.00 40.31 C ATOM 0 H VAL A 73 16.380 -6.676 -7.175 1.00 41.01 H new ATOM 0 HA VAL A 73 16.521 -3.895 -7.240 1.00 71.02 H new ATOM 0 HB VAL A 73 14.027 -4.057 -6.727 1.00 24.34 H new ATOM 0 HG11 VAL A 73 13.487 -5.175 -8.850 1.00 31.34 H new ATOM 0 HG12 VAL A 73 14.885 -4.086 -9.014 1.00 31.34 H new ATOM 0 HG13 VAL A 73 15.135 -5.845 -8.913 1.00 31.34 H new ATOM 0 HG21 VAL A 73 13.036 -6.312 -6.699 1.00 40.31 H new ATOM 0 HG22 VAL A 73 14.666 -7.025 -6.675 1.00 40.31 H new ATOM 0 HG23 VAL A 73 14.103 -6.044 -5.301 1.00 40.31 H new ATOM 861 N ASP A 74 15.368 -3.169 -4.860 1.00 64.12 N ATOM 862 CA ASP A 74 15.302 -2.642 -3.502 1.00 60.32 C ATOM 863 C ASP A 74 14.066 -3.165 -2.776 1.00 14.44 C ATOM 864 O ASP A 74 14.107 -3.432 -1.574 1.00 54.55 O ATOM 865 CB ASP A 74 15.286 -1.112 -3.526 1.00 71.31 C ATOM 866 CG ASP A 74 16.240 -0.539 -4.556 1.00 30.53 C ATOM 867 OD1 ASP A 74 17.434 -0.902 -4.524 1.00 45.45 O ATOM 868 OD2 ASP A 74 15.791 0.269 -5.394 1.00 50.41 O ATOM 0 H ASP A 74 14.805 -2.657 -5.539 1.00 64.12 H new ATOM 0 HA ASP A 74 16.188 -2.980 -2.964 1.00 60.32 H new ATOM 0 HB2 ASP A 74 14.275 -0.765 -3.739 1.00 71.31 H new ATOM 0 HB3 ASP A 74 15.551 -0.733 -2.539 1.00 71.31 H new ATOM 873 N ASP A 75 12.970 -3.307 -3.513 1.00 0.23 N ATOM 874 CA ASP A 75 11.722 -3.798 -2.939 1.00 64.00 C ATOM 875 C ASP A 75 11.616 -5.312 -3.084 1.00 22.55 C ATOM 876 O ASP A 75 10.536 -5.885 -2.948 1.00 14.04 O ATOM 877 CB ASP A 75 10.526 -3.123 -3.614 1.00 41.01 C ATOM 878 CG ASP A 75 10.693 -1.621 -3.721 1.00 41.10 C ATOM 879 OD1 ASP A 75 11.363 -1.033 -2.845 1.00 34.35 O ATOM 880 OD2 ASP A 75 10.156 -1.031 -4.681 1.00 50.34 O ATOM 0 H ASP A 75 12.920 -3.089 -4.508 1.00 0.23 H new ATOM 0 HA ASP A 75 11.717 -3.552 -1.877 1.00 64.00 H new ATOM 0 HB2 ASP A 75 10.391 -3.542 -4.611 1.00 41.01 H new ATOM 0 HB3 ASP A 75 9.621 -3.346 -3.049 1.00 41.01 H new ATOM 885 N GLY A 76 12.746 -5.956 -3.363 1.00 11.21 N ATOM 886 CA GLY A 76 12.758 -7.398 -3.523 1.00 33.22 C ATOM 887 C GLY A 76 11.937 -8.106 -2.463 1.00 20.42 C ATOM 888 O GLY A 76 11.322 -9.137 -2.731 1.00 24.44 O ATOM 0 H GLY A 76 13.653 -5.504 -3.481 1.00 11.21 H new ATOM 0 HA2 GLY A 76 12.371 -7.654 -4.509 1.00 33.22 H new ATOM 0 HA3 GLY A 76 13.786 -7.757 -3.481 1.00 33.22 H new ATOM 892 N ALA A 77 11.928 -7.551 -1.255 1.00 23.40 N ATOM 893 CA ALA A 77 11.177 -8.136 -0.152 1.00 23.23 C ATOM 894 C ALA A 77 9.737 -8.427 -0.561 1.00 1.55 C ATOM 895 O ALA A 77 9.276 -9.565 -0.479 1.00 12.42 O ATOM 896 CB ALA A 77 11.208 -7.212 1.057 1.00 2.21 C ATOM 0 H ALA A 77 12.432 -6.697 -1.016 1.00 23.40 H new ATOM 0 HA ALA A 77 11.649 -9.081 0.115 1.00 23.23 H new ATOM 0 HB1 ALA A 77 10.643 -7.662 1.873 1.00 2.21 H new ATOM 0 HB2 ALA A 77 12.240 -7.059 1.371 1.00 2.21 H new ATOM 0 HB3 ALA A 77 10.763 -6.253 0.793 1.00 2.21 H new ATOM 902 N SER A 78 9.031 -7.390 -0.999 1.00 63.03 N ATOM 903 CA SER A 78 7.641 -7.533 -1.417 1.00 62.14 C ATOM 904 C SER A 78 7.555 -8.001 -2.867 1.00 51.42 C ATOM 905 O SER A 78 6.728 -8.846 -3.211 1.00 12.51 O ATOM 906 CB SER A 78 6.898 -6.206 -1.252 1.00 75.11 C ATOM 907 OG SER A 78 6.696 -5.902 0.117 1.00 11.52 O ATOM 0 H SER A 78 9.398 -6.441 -1.074 1.00 63.03 H new ATOM 0 HA SER A 78 7.172 -8.285 -0.783 1.00 62.14 H new ATOM 0 HB2 SER A 78 7.467 -5.406 -1.725 1.00 75.11 H new ATOM 0 HB3 SER A 78 5.936 -6.258 -1.762 1.00 75.11 H new ATOM 0 HG SER A 78 6.221 -5.049 0.196 1.00 11.52 H new ATOM 913 N VAL A 79 8.416 -7.444 -3.714 1.00 0.11 N ATOM 914 CA VAL A 79 8.439 -7.804 -5.126 1.00 43.51 C ATOM 915 C VAL A 79 8.421 -9.317 -5.309 1.00 4.11 C ATOM 916 O VAL A 79 7.473 -9.874 -5.862 1.00 3.21 O ATOM 917 CB VAL A 79 9.680 -7.227 -5.833 1.00 24.35 C ATOM 918 CG1 VAL A 79 9.820 -7.810 -7.230 1.00 14.11 C ATOM 919 CG2 VAL A 79 9.607 -5.708 -5.884 1.00 61.41 C ATOM 0 H VAL A 79 9.106 -6.742 -3.446 1.00 0.11 H new ATOM 0 HA VAL A 79 7.543 -7.376 -5.575 1.00 43.51 H new ATOM 0 HB VAL A 79 10.564 -7.506 -5.260 1.00 24.35 H new ATOM 0 HG11 VAL A 79 10.702 -7.390 -7.713 1.00 14.11 H new ATOM 0 HG12 VAL A 79 9.924 -8.893 -7.164 1.00 14.11 H new ATOM 0 HG13 VAL A 79 8.934 -7.566 -7.817 1.00 14.11 H new ATOM 0 HG21 VAL A 79 10.492 -5.318 -6.387 1.00 61.41 H new ATOM 0 HG22 VAL A 79 8.715 -5.405 -6.432 1.00 61.41 H new ATOM 0 HG23 VAL A 79 9.562 -5.312 -4.870 1.00 61.41 H new ATOM 929 N GLN A 80 9.475 -9.976 -4.840 1.00 42.00 N ATOM 930 CA GLN A 80 9.581 -11.427 -4.951 1.00 52.14 C ATOM 931 C GLN A 80 8.495 -12.116 -4.133 1.00 31.14 C ATOM 932 O GLN A 80 8.053 -13.214 -4.470 1.00 14.41 O ATOM 933 CB GLN A 80 10.961 -11.896 -4.489 1.00 33.22 C ATOM 934 CG GLN A 80 11.393 -13.217 -5.105 1.00 53.21 C ATOM 935 CD GLN A 80 11.105 -14.402 -4.204 1.00 41.01 C ATOM 936 OE1 GLN A 80 10.203 -14.356 -3.367 1.00 62.12 O ATOM 937 NE2 GLN A 80 11.873 -15.473 -4.371 1.00 72.24 N ATOM 0 H GLN A 80 10.268 -9.529 -4.380 1.00 42.00 H new ATOM 0 HA GLN A 80 9.447 -11.697 -5.998 1.00 52.14 H new ATOM 0 HB2 GLN A 80 11.697 -11.131 -4.737 1.00 33.22 H new ATOM 0 HB3 GLN A 80 10.957 -11.995 -3.404 1.00 33.22 H new ATOM 0 HG2 GLN A 80 10.879 -13.355 -6.056 1.00 53.21 H new ATOM 0 HG3 GLN A 80 12.461 -13.181 -5.322 1.00 53.21 H new ATOM 0 HE21 GLN A 80 12.609 -15.468 -5.077 1.00 72.24 H new ATOM 0 HE22 GLN A 80 11.726 -16.301 -3.793 1.00 72.24 H new ATOM 946 N GLU A 81 8.070 -11.463 -3.055 1.00 32.53 N ATOM 947 CA GLU A 81 7.037 -12.016 -2.186 1.00 53.34 C ATOM 948 C GLU A 81 5.753 -12.281 -2.969 1.00 71.11 C ATOM 949 O GLU A 81 5.137 -13.337 -2.833 1.00 62.52 O ATOM 950 CB GLU A 81 6.751 -11.062 -1.026 1.00 3.33 C ATOM 951 CG GLU A 81 5.497 -11.414 -0.242 1.00 52.55 C ATOM 952 CD GLU A 81 5.481 -10.795 1.142 1.00 43.22 C ATOM 953 OE1 GLU A 81 5.730 -9.577 1.252 1.00 42.34 O ATOM 954 OE2 GLU A 81 5.219 -11.532 2.116 1.00 1.24 O ATOM 0 H GLU A 81 8.424 -10.552 -2.763 1.00 32.53 H new ATOM 0 HA GLU A 81 7.402 -12.962 -1.787 1.00 53.34 H new ATOM 0 HB2 GLU A 81 7.605 -11.062 -0.348 1.00 3.33 H new ATOM 0 HB3 GLU A 81 6.653 -10.049 -1.416 1.00 3.33 H new ATOM 0 HG2 GLU A 81 4.620 -11.078 -0.796 1.00 52.55 H new ATOM 0 HG3 GLU A 81 5.422 -12.498 -0.152 1.00 52.55 H new ATOM 961 N VAL A 82 5.356 -11.312 -3.788 1.00 63.32 N ATOM 962 CA VAL A 82 4.147 -11.439 -4.593 1.00 63.32 C ATOM 963 C VAL A 82 4.437 -12.144 -5.914 1.00 4.53 C ATOM 964 O VAL A 82 3.538 -12.700 -6.545 1.00 14.13 O ATOM 965 CB VAL A 82 3.520 -10.063 -4.885 1.00 0.31 C ATOM 966 CG1 VAL A 82 2.021 -10.195 -5.102 1.00 54.43 C ATOM 967 CG2 VAL A 82 3.819 -9.090 -3.754 1.00 30.11 C ATOM 0 H VAL A 82 5.854 -10.430 -3.911 1.00 63.32 H new ATOM 0 HA VAL A 82 3.442 -12.036 -4.013 1.00 63.32 H new ATOM 0 HB VAL A 82 3.963 -9.668 -5.800 1.00 0.31 H new ATOM 0 HG11 VAL A 82 1.595 -9.213 -5.307 1.00 54.43 H new ATOM 0 HG12 VAL A 82 1.833 -10.856 -5.948 1.00 54.43 H new ATOM 0 HG13 VAL A 82 1.559 -10.611 -4.207 1.00 54.43 H new ATOM 0 HG21 VAL A 82 3.368 -8.123 -3.977 1.00 30.11 H new ATOM 0 HG22 VAL A 82 3.405 -9.477 -2.823 1.00 30.11 H new ATOM 0 HG23 VAL A 82 4.898 -8.972 -3.651 1.00 30.11 H new ATOM 977 N LEU A 83 5.700 -12.117 -6.327 1.00 22.43 N ATOM 978 CA LEU A 83 6.111 -12.754 -7.572 1.00 61.14 C ATOM 979 C LEU A 83 6.169 -14.270 -7.416 1.00 5.32 C ATOM 980 O LEU A 83 5.653 -15.013 -8.253 1.00 4.33 O ATOM 981 CB LEU A 83 7.476 -12.222 -8.014 1.00 75.54 C ATOM 982 CG LEU A 83 7.564 -11.717 -9.455 1.00 25.11 C ATOM 983 CD1 LEU A 83 8.663 -10.673 -9.587 1.00 12.00 C ATOM 984 CD2 LEU A 83 7.808 -12.874 -10.412 1.00 72.24 C ATOM 0 H LEU A 83 6.456 -11.661 -5.817 1.00 22.43 H new ATOM 0 HA LEU A 83 5.370 -12.515 -8.335 1.00 61.14 H new ATOM 0 HB2 LEU A 83 7.760 -11.408 -7.347 1.00 75.54 H new ATOM 0 HB3 LEU A 83 8.213 -13.014 -7.882 1.00 75.54 H new ATOM 0 HG LEU A 83 6.614 -11.251 -9.716 1.00 25.11 H new ATOM 0 HD11 LEU A 83 8.712 -10.325 -10.619 1.00 12.00 H new ATOM 0 HD12 LEU A 83 8.446 -9.831 -8.929 1.00 12.00 H new ATOM 0 HD13 LEU A 83 9.620 -11.114 -9.308 1.00 12.00 H new ATOM 0 HD21 LEU A 83 7.868 -12.496 -11.432 1.00 72.24 H new ATOM 0 HD22 LEU A 83 8.744 -13.369 -10.153 1.00 72.24 H new ATOM 0 HD23 LEU A 83 6.987 -13.587 -10.337 1.00 72.24 H new ATOM 996 N THR A 84 6.800 -14.724 -6.337 1.00 35.33 N ATOM 997 CA THR A 84 6.924 -16.152 -6.070 1.00 3.13 C ATOM 998 C THR A 84 5.561 -16.832 -6.063 1.00 73.03 C ATOM 999 O THR A 84 5.453 -18.030 -6.322 1.00 12.40 O ATOM 1000 CB THR A 84 7.621 -16.412 -4.720 1.00 41.45 C ATOM 1001 OG1 THR A 84 9.026 -16.163 -4.839 1.00 34.02 O ATOM 1002 CG2 THR A 84 7.391 -17.843 -4.259 1.00 42.33 C ATOM 0 H THR A 84 7.233 -14.124 -5.635 1.00 35.33 H new ATOM 0 HA THR A 84 7.531 -16.571 -6.872 1.00 3.13 H new ATOM 0 HB THR A 84 7.194 -15.736 -3.979 1.00 41.45 H new ATOM 0 HG1 THR A 84 9.380 -15.865 -3.975 1.00 34.02 H new ATOM 0 HG21 THR A 84 7.892 -18.003 -3.304 1.00 42.33 H new ATOM 0 HG22 THR A 84 6.322 -18.020 -4.142 1.00 42.33 H new ATOM 0 HG23 THR A 84 7.794 -18.533 -5.000 1.00 42.33 H new ATOM 1010 N GLU A 85 4.520 -16.058 -5.767 1.00 22.21 N ATOM 1011 CA GLU A 85 3.162 -16.588 -5.728 1.00 53.12 C ATOM 1012 C GLU A 85 2.596 -16.740 -7.137 1.00 23.20 C ATOM 1013 O GLU A 85 1.717 -17.568 -7.378 1.00 51.24 O ATOM 1014 CB GLU A 85 2.258 -15.674 -4.898 1.00 43.44 C ATOM 1015 CG GLU A 85 1.819 -16.286 -3.579 1.00 12.11 C ATOM 1016 CD GLU A 85 0.368 -16.723 -3.592 1.00 73.54 C ATOM 1017 OE1 GLU A 85 -0.465 -15.996 -4.174 1.00 11.55 O ATOM 1018 OE2 GLU A 85 0.064 -17.793 -3.024 1.00 1.21 O ATOM 0 H GLU A 85 4.592 -15.064 -5.551 1.00 22.21 H new ATOM 0 HA GLU A 85 3.197 -17.573 -5.262 1.00 53.12 H new ATOM 0 HB2 GLU A 85 2.784 -14.741 -4.698 1.00 43.44 H new ATOM 0 HB3 GLU A 85 1.374 -15.422 -5.484 1.00 43.44 H new ATOM 0 HG2 GLU A 85 2.451 -17.145 -3.353 1.00 12.11 H new ATOM 0 HG3 GLU A 85 1.969 -15.561 -2.779 1.00 12.11 H new ATOM 1025 N ILE A 86 3.106 -15.935 -8.063 1.00 11.55 N ATOM 1026 CA ILE A 86 2.652 -15.979 -9.447 1.00 70.11 C ATOM 1027 C ILE A 86 2.728 -17.396 -10.005 1.00 41.21 C ATOM 1028 O ILE A 86 1.865 -17.818 -10.774 1.00 42.34 O ATOM 1029 CB ILE A 86 3.484 -15.041 -10.342 1.00 72.23 C ATOM 1030 CG1 ILE A 86 3.380 -13.599 -9.843 1.00 41.03 C ATOM 1031 CG2 ILE A 86 3.020 -15.142 -11.788 1.00 5.02 C ATOM 1032 CD1 ILE A 86 4.186 -12.616 -10.662 1.00 42.02 C ATOM 0 H ILE A 86 3.834 -15.244 -7.880 1.00 11.55 H new ATOM 0 HA ILE A 86 1.614 -15.645 -9.450 1.00 70.11 H new ATOM 0 HB ILE A 86 4.529 -15.347 -10.293 1.00 72.23 H new ATOM 0 HG12 ILE A 86 2.333 -13.295 -9.852 1.00 41.03 H new ATOM 0 HG13 ILE A 86 3.715 -13.557 -8.807 1.00 41.03 H new ATOM 0 HG21 ILE A 86 3.617 -14.474 -12.409 1.00 5.02 H new ATOM 0 HG22 ILE A 86 3.141 -16.167 -12.138 1.00 5.02 H new ATOM 0 HG23 ILE A 86 1.970 -14.857 -11.854 1.00 5.02 H new ATOM 0 HD11 ILE A 86 4.065 -11.614 -10.250 1.00 42.02 H new ATOM 0 HD12 ILE A 86 5.239 -12.895 -10.633 1.00 42.02 H new ATOM 0 HD13 ILE A 86 3.836 -12.629 -11.694 1.00 42.02 H new ATOM 1044 N SER A 87 3.766 -18.127 -9.610 1.00 54.42 N ATOM 1045 CA SER A 87 3.956 -19.497 -10.072 1.00 42.13 C ATOM 1046 C SER A 87 4.003 -20.465 -8.895 1.00 64.10 C ATOM 1047 O SER A 87 3.961 -21.682 -9.077 1.00 3.25 O ATOM 1048 CB SER A 87 5.243 -19.607 -10.891 1.00 1.21 C ATOM 1049 OG SER A 87 5.018 -20.301 -12.106 1.00 72.22 O ATOM 0 H SER A 87 4.488 -17.793 -8.971 1.00 54.42 H new ATOM 0 HA SER A 87 3.109 -19.763 -10.704 1.00 42.13 H new ATOM 0 HB2 SER A 87 5.628 -18.610 -11.104 1.00 1.21 H new ATOM 0 HB3 SER A 87 6.005 -20.125 -10.309 1.00 1.21 H new ATOM 0 HG SER A 87 5.637 -19.971 -12.791 1.00 72.22 H new ATOM 1055 N ASN A 88 4.092 -19.916 -7.689 1.00 23.54 N ATOM 1056 CA ASN A 88 4.147 -20.731 -6.480 1.00 72.44 C ATOM 1057 C ASN A 88 5.235 -21.795 -6.590 1.00 53.43 C ATOM 1058 O ASN A 88 5.010 -22.961 -6.267 1.00 34.42 O ATOM 1059 CB ASN A 88 2.792 -21.395 -6.226 1.00 41.23 C ATOM 1060 CG ASN A 88 2.455 -21.473 -4.750 1.00 30.45 C ATOM 1061 OD1 ASN A 88 3.340 -21.614 -3.906 1.00 31.42 O ATOM 1062 ND2 ASN A 88 1.168 -21.385 -4.431 1.00 20.00 N ATOM 0 H ASN A 88 4.128 -18.910 -7.522 1.00 23.54 H new ATOM 0 HA ASN A 88 4.387 -20.077 -5.641 1.00 72.44 H new ATOM 0 HB2 ASN A 88 2.013 -20.836 -6.745 1.00 41.23 H new ATOM 0 HB3 ASN A 88 2.798 -22.400 -6.648 1.00 41.23 H new ATOM 0 HD21 ASN A 88 0.880 -21.434 -3.454 1.00 20.00 H new ATOM 0 HD22 ASN A 88 0.468 -21.269 -5.164 1.00 20.00 H new ATOM 1069 N GLN A 89 6.413 -21.384 -7.048 1.00 24.32 N ATOM 1070 CA GLN A 89 7.535 -22.302 -7.200 1.00 72.31 C ATOM 1071 C GLN A 89 8.741 -21.826 -6.397 1.00 43.23 C ATOM 1072 O GLN A 89 8.896 -20.632 -6.138 1.00 34.31 O ATOM 1073 CB GLN A 89 7.911 -22.440 -8.676 1.00 23.40 C ATOM 1074 CG GLN A 89 7.129 -23.521 -9.405 1.00 22.42 C ATOM 1075 CD GLN A 89 6.312 -22.973 -10.557 1.00 35.13 C ATOM 1076 OE1 GLN A 89 5.138 -23.309 -10.715 1.00 51.43 O ATOM 1077 NE2 GLN A 89 6.929 -22.123 -11.370 1.00 13.04 N ATOM 0 H GLN A 89 6.615 -20.422 -7.320 1.00 24.32 H new ATOM 0 HA GLN A 89 7.230 -23.276 -6.818 1.00 72.31 H new ATOM 0 HB2 GLN A 89 7.746 -21.485 -9.175 1.00 23.40 H new ATOM 0 HB3 GLN A 89 8.976 -22.660 -8.752 1.00 23.40 H new ATOM 0 HG2 GLN A 89 7.822 -24.274 -9.781 1.00 22.42 H new ATOM 0 HG3 GLN A 89 6.466 -24.022 -8.700 1.00 22.42 H new ATOM 0 HE21 GLN A 89 7.903 -21.872 -11.202 1.00 13.04 H new ATOM 0 HE22 GLN A 89 6.429 -21.721 -12.163 1.00 13.04 H new ATOM 1086 N LYS A 90 9.595 -22.766 -6.006 1.00 14.24 N ATOM 1087 CA LYS A 90 10.789 -22.443 -5.234 1.00 31.33 C ATOM 1088 C LYS A 90 11.500 -21.226 -5.816 1.00 24.14 C ATOM 1089 O LYS A 90 12.014 -20.383 -5.080 1.00 31.13 O ATOM 1090 CB LYS A 90 11.743 -23.639 -5.205 1.00 75.45 C ATOM 1091 CG LYS A 90 12.708 -23.621 -4.033 1.00 74.32 C ATOM 1092 CD LYS A 90 13.498 -24.916 -3.942 1.00 0.53 C ATOM 1093 CE LYS A 90 14.278 -25.001 -2.638 1.00 42.43 C ATOM 1094 NZ LYS A 90 13.406 -25.388 -1.495 1.00 70.42 N ATOM 0 H LYS A 90 9.482 -23.759 -6.211 1.00 14.24 H new ATOM 0 HA LYS A 90 10.480 -22.209 -4.215 1.00 31.33 H new ATOM 0 HB2 LYS A 90 11.158 -24.558 -5.169 1.00 75.45 H new ATOM 0 HB3 LYS A 90 12.313 -23.660 -6.134 1.00 75.45 H new ATOM 0 HG2 LYS A 90 13.395 -22.781 -4.139 1.00 74.32 H new ATOM 0 HG3 LYS A 90 12.155 -23.465 -3.107 1.00 74.32 H new ATOM 0 HD2 LYS A 90 12.818 -25.765 -4.017 1.00 0.53 H new ATOM 0 HD3 LYS A 90 14.186 -24.984 -4.784 1.00 0.53 H new ATOM 0 HE2 LYS A 90 15.083 -25.728 -2.743 1.00 42.43 H new ATOM 0 HE3 LYS A 90 14.744 -24.038 -2.430 1.00 42.43 H new ATOM 0 HZ1 LYS A 90 13.974 -25.435 -0.625 1.00 70.42 H new ATOM 0 HZ2 LYS A 90 12.652 -24.681 -1.378 1.00 70.42 H new ATOM 0 HZ3 LYS A 90 12.981 -26.319 -1.682 1.00 70.42 H new ATOM 1108 N THR A 91 11.527 -21.139 -7.142 1.00 11.15 N ATOM 1109 CA THR A 91 12.175 -20.025 -7.823 1.00 11.35 C ATOM 1110 C THR A 91 11.161 -18.958 -8.218 1.00 54.23 C ATOM 1111 O THR A 91 9.980 -19.055 -7.885 1.00 63.00 O ATOM 1112 CB THR A 91 12.926 -20.496 -9.082 1.00 72.05 C ATOM 1113 OG1 THR A 91 12.152 -21.482 -9.774 1.00 34.43 O ATOM 1114 CG2 THR A 91 14.284 -21.075 -8.717 1.00 61.03 C ATOM 0 H THR A 91 11.107 -21.828 -7.766 1.00 11.15 H new ATOM 0 HA THR A 91 12.892 -19.599 -7.121 1.00 11.35 H new ATOM 0 HB THR A 91 13.079 -19.634 -9.731 1.00 72.05 H new ATOM 0 HG1 THR A 91 12.636 -21.775 -10.574 1.00 34.43 H new ATOM 0 HG21 THR A 91 14.796 -21.401 -9.622 1.00 61.03 H new ATOM 0 HG22 THR A 91 14.882 -20.313 -8.216 1.00 61.03 H new ATOM 0 HG23 THR A 91 14.149 -21.926 -8.050 1.00 61.03 H new ATOM 1122 N VAL A 92 11.630 -17.939 -8.933 1.00 32.01 N ATOM 1123 CA VAL A 92 10.763 -16.854 -9.376 1.00 31.23 C ATOM 1124 C VAL A 92 10.668 -16.812 -10.897 1.00 60.13 C ATOM 1125 O VAL A 92 10.921 -15.787 -11.531 1.00 72.32 O ATOM 1126 CB VAL A 92 11.266 -15.490 -8.866 1.00 32.32 C ATOM 1127 CG1 VAL A 92 10.122 -14.488 -8.806 1.00 2.10 C ATOM 1128 CG2 VAL A 92 11.926 -15.641 -7.503 1.00 74.14 C ATOM 0 H VAL A 92 12.605 -17.843 -9.217 1.00 32.01 H new ATOM 0 HA VAL A 92 9.775 -17.048 -8.959 1.00 31.23 H new ATOM 0 HB VAL A 92 12.012 -15.112 -9.565 1.00 32.32 H new ATOM 0 HG11 VAL A 92 10.496 -13.530 -8.444 1.00 2.10 H new ATOM 0 HG12 VAL A 92 9.699 -14.359 -9.802 1.00 2.10 H new ATOM 0 HG13 VAL A 92 9.351 -14.856 -8.129 1.00 2.10 H new ATOM 0 HG21 VAL A 92 12.275 -14.668 -7.158 1.00 74.14 H new ATOM 0 HG22 VAL A 92 11.204 -16.040 -6.791 1.00 74.14 H new ATOM 0 HG23 VAL A 92 12.772 -16.323 -7.582 1.00 74.14 H new ATOM 1138 N PRO A 93 10.297 -17.952 -11.498 1.00 34.43 N ATOM 1139 CA PRO A 93 10.158 -18.071 -12.953 1.00 23.42 C ATOM 1140 C PRO A 93 8.968 -17.285 -13.489 1.00 11.35 C ATOM 1141 O PRO A 93 7.830 -17.504 -13.075 1.00 4.45 O ATOM 1142 CB PRO A 93 9.948 -19.572 -13.167 1.00 61.13 C ATOM 1143 CG PRO A 93 9.369 -20.060 -11.884 1.00 74.12 C ATOM 1144 CD PRO A 93 9.980 -19.211 -10.804 1.00 32.21 C ATOM 0 HA PRO A 93 11.023 -17.668 -13.479 1.00 23.42 H new ATOM 0 HB2 PRO A 93 9.275 -19.762 -14.003 1.00 61.13 H new ATOM 0 HB3 PRO A 93 10.888 -20.075 -13.394 1.00 61.13 H new ATOM 0 HG2 PRO A 93 8.283 -19.967 -11.886 1.00 74.12 H new ATOM 0 HG3 PRO A 93 9.598 -21.114 -11.728 1.00 74.12 H new ATOM 0 HD2 PRO A 93 9.287 -19.051 -9.978 1.00 32.21 H new ATOM 0 HD3 PRO A 93 10.873 -19.675 -10.385 1.00 32.21 H new ATOM 1152 N ASN A 94 9.238 -16.368 -14.413 1.00 72.42 N ATOM 1153 CA ASN A 94 8.187 -15.549 -15.006 1.00 65.04 C ATOM 1154 C ASN A 94 8.376 -15.431 -16.516 1.00 12.21 C ATOM 1155 O ASN A 94 9.317 -14.789 -16.985 1.00 35.23 O ATOM 1156 CB ASN A 94 8.179 -14.156 -14.372 1.00 33.45 C ATOM 1157 CG ASN A 94 7.015 -13.963 -13.418 1.00 21.31 C ATOM 1158 OD1 ASN A 94 6.265 -12.993 -13.526 1.00 35.33 O ATOM 1159 ND2 ASN A 94 6.861 -14.889 -12.478 1.00 11.33 N ATOM 0 H ASN A 94 10.175 -16.174 -14.767 1.00 72.42 H new ATOM 0 HA ASN A 94 7.230 -16.035 -14.814 1.00 65.04 H new ATOM 0 HB2 ASN A 94 9.115 -13.998 -13.836 1.00 33.45 H new ATOM 0 HB3 ASN A 94 8.130 -13.402 -15.158 1.00 33.45 H new ATOM 0 HD21 ASN A 94 6.096 -14.813 -11.807 1.00 11.33 H new ATOM 0 HD22 ASN A 94 7.508 -15.676 -12.427 1.00 11.33 H new ATOM 1166 N ILE A 95 7.477 -16.053 -17.269 1.00 73.34 N ATOM 1167 CA ILE A 95 7.544 -16.016 -18.725 1.00 34.40 C ATOM 1168 C ILE A 95 6.230 -15.524 -19.323 1.00 11.00 C ATOM 1169 O ILE A 95 5.256 -16.274 -19.414 1.00 24.04 O ATOM 1170 CB ILE A 95 7.873 -17.403 -19.309 1.00 3.20 C ATOM 1171 CG1 ILE A 95 7.367 -18.505 -18.377 1.00 71.34 C ATOM 1172 CG2 ILE A 95 9.371 -17.539 -19.536 1.00 25.23 C ATOM 1173 CD1 ILE A 95 8.357 -18.886 -17.298 1.00 71.23 C ATOM 0 H ILE A 95 6.693 -16.589 -16.896 1.00 73.34 H new ATOM 0 HA ILE A 95 8.343 -15.322 -18.987 1.00 34.40 H new ATOM 0 HB ILE A 95 7.369 -17.507 -20.270 1.00 3.20 H new ATOM 0 HG12 ILE A 95 6.440 -18.176 -17.908 1.00 71.34 H new ATOM 0 HG13 ILE A 95 7.129 -19.389 -18.969 1.00 71.34 H new ATOM 0 HG21 ILE A 95 9.588 -18.524 -19.949 1.00 25.23 H new ATOM 0 HG22 ILE A 95 9.704 -16.771 -20.234 1.00 25.23 H new ATOM 0 HG23 ILE A 95 9.895 -17.419 -18.588 1.00 25.23 H new ATOM 0 HD11 ILE A 95 7.931 -19.672 -16.675 1.00 71.23 H new ATOM 0 HD12 ILE A 95 9.277 -19.246 -17.759 1.00 71.23 H new ATOM 0 HD13 ILE A 95 8.577 -18.014 -16.682 1.00 71.23 H new ATOM 1185 N PHE A 96 6.209 -14.261 -19.734 1.00 10.22 N ATOM 1186 CA PHE A 96 5.014 -13.668 -20.325 1.00 61.01 C ATOM 1187 C PHE A 96 5.383 -12.728 -21.468 1.00 72.42 C ATOM 1188 O PHE A 96 5.996 -11.682 -21.254 1.00 42.35 O ATOM 1189 CB PHE A 96 4.216 -12.909 -19.263 1.00 1.21 C ATOM 1190 CG PHE A 96 3.960 -13.711 -18.018 1.00 51.32 C ATOM 1191 CD1 PHE A 96 4.955 -13.879 -17.069 1.00 54.52 C ATOM 1192 CD2 PHE A 96 2.724 -14.298 -17.800 1.00 2.21 C ATOM 1193 CE1 PHE A 96 4.722 -14.616 -15.923 1.00 2.52 C ATOM 1194 CE2 PHE A 96 2.486 -15.035 -16.655 1.00 71.44 C ATOM 1195 CZ PHE A 96 3.486 -15.195 -15.716 1.00 64.03 C ATOM 0 H PHE A 96 7.006 -13.628 -19.669 1.00 10.22 H new ATOM 0 HA PHE A 96 4.398 -14.474 -20.724 1.00 61.01 H new ATOM 0 HB2 PHE A 96 4.755 -12.000 -18.996 1.00 1.21 H new ATOM 0 HB3 PHE A 96 3.262 -12.600 -19.689 1.00 1.21 H new ATOM 0 HD1 PHE A 96 5.924 -13.429 -17.226 1.00 54.52 H new ATOM 0 HD2 PHE A 96 1.939 -14.179 -18.532 1.00 2.21 H new ATOM 0 HE1 PHE A 96 5.506 -14.739 -15.190 1.00 2.52 H new ATOM 0 HE2 PHE A 96 1.518 -15.486 -16.495 1.00 71.44 H new ATOM 0 HZ PHE A 96 3.301 -15.772 -14.822 1.00 64.03 H new ATOM 1205 N VAL A 97 5.005 -13.109 -22.685 1.00 51.20 N ATOM 1206 CA VAL A 97 5.294 -12.301 -23.863 1.00 41.52 C ATOM 1207 C VAL A 97 4.012 -11.899 -24.582 1.00 51.34 C ATOM 1208 O VAL A 97 3.105 -12.711 -24.755 1.00 13.14 O ATOM 1209 CB VAL A 97 6.209 -13.053 -24.848 1.00 40.44 C ATOM 1210 CG1 VAL A 97 5.661 -14.444 -25.129 1.00 45.24 C ATOM 1211 CG2 VAL A 97 6.366 -12.262 -26.138 1.00 53.14 C ATOM 0 H VAL A 97 4.498 -13.972 -22.880 1.00 51.20 H new ATOM 0 HA VAL A 97 5.807 -11.405 -23.514 1.00 41.52 H new ATOM 0 HB VAL A 97 7.194 -13.161 -24.393 1.00 40.44 H new ATOM 0 HG11 VAL A 97 6.320 -14.961 -25.827 1.00 45.24 H new ATOM 0 HG12 VAL A 97 5.605 -15.008 -24.198 1.00 45.24 H new ATOM 0 HG13 VAL A 97 4.665 -14.362 -25.564 1.00 45.24 H new ATOM 0 HG21 VAL A 97 7.015 -12.808 -26.823 1.00 53.14 H new ATOM 0 HG22 VAL A 97 5.389 -12.121 -26.600 1.00 53.14 H new ATOM 0 HG23 VAL A 97 6.807 -11.290 -25.917 1.00 53.14 H new ATOM 1221 N ASN A 98 3.945 -10.638 -25.001 1.00 73.43 N ATOM 1222 CA ASN A 98 2.773 -10.128 -25.703 1.00 61.11 C ATOM 1223 C ASN A 98 1.547 -10.141 -24.795 1.00 3.30 C ATOM 1224 O ASN A 98 0.442 -10.469 -25.229 1.00 41.11 O ATOM 1225 CB ASN A 98 2.501 -10.960 -26.958 1.00 12.30 C ATOM 1226 CG ASN A 98 1.755 -10.177 -28.020 1.00 55.35 C ATOM 1227 OD1 ASN A 98 0.590 -9.820 -27.841 1.00 41.22 O ATOM 1228 ND2 ASN A 98 2.423 -9.906 -29.135 1.00 24.41 N ATOM 0 H ASN A 98 4.688 -9.952 -24.866 1.00 73.43 H new ATOM 0 HA ASN A 98 2.976 -9.098 -25.996 1.00 61.11 H new ATOM 0 HB2 ASN A 98 3.447 -11.313 -27.368 1.00 12.30 H new ATOM 0 HB3 ASN A 98 1.922 -11.843 -26.687 1.00 12.30 H new ATOM 0 HD21 ASN A 98 1.972 -9.383 -29.885 1.00 24.41 H new ATOM 0 HD22 ASN A 98 3.387 -10.221 -29.241 1.00 24.41 H new ATOM 1235 N LYS A 99 1.749 -9.781 -23.532 1.00 1.12 N ATOM 1236 CA LYS A 99 0.662 -9.749 -22.561 1.00 72.51 C ATOM 1237 C LYS A 99 -0.028 -11.107 -22.472 1.00 11.33 C ATOM 1238 O LYS A 99 -1.254 -11.187 -22.389 1.00 21.42 O ATOM 1239 CB LYS A 99 -0.357 -8.671 -22.941 1.00 22.22 C ATOM 1240 CG LYS A 99 0.261 -7.301 -23.159 1.00 1.13 C ATOM 1241 CD LYS A 99 0.187 -6.881 -24.617 1.00 61.33 C ATOM 1242 CE LYS A 99 1.453 -6.161 -25.055 1.00 4.44 C ATOM 1243 NZ LYS A 99 1.153 -4.851 -25.697 1.00 70.33 N ATOM 0 H LYS A 99 2.657 -9.507 -23.157 1.00 1.12 H new ATOM 0 HA LYS A 99 1.086 -9.512 -21.585 1.00 72.51 H new ATOM 0 HB2 LYS A 99 -0.874 -8.976 -23.851 1.00 22.22 H new ATOM 0 HB3 LYS A 99 -1.109 -8.600 -22.155 1.00 22.22 H new ATOM 0 HG2 LYS A 99 -0.255 -6.566 -22.541 1.00 1.13 H new ATOM 0 HG3 LYS A 99 1.302 -7.315 -22.836 1.00 1.13 H new ATOM 0 HD2 LYS A 99 0.032 -7.760 -25.242 1.00 61.33 H new ATOM 0 HD3 LYS A 99 -0.674 -6.229 -24.766 1.00 61.33 H new ATOM 0 HE2 LYS A 99 2.098 -6.002 -24.191 1.00 4.44 H new ATOM 0 HE3 LYS A 99 2.005 -6.790 -25.754 1.00 4.44 H new ATOM 0 HZ1 LYS A 99 2.042 -4.392 -25.981 1.00 70.33 H new ATOM 0 HZ2 LYS A 99 0.559 -5.004 -26.537 1.00 70.33 H new ATOM 0 HZ3 LYS A 99 0.649 -4.241 -25.022 1.00 70.33 H new ATOM 1257 N VAL A 100 0.767 -12.172 -22.488 1.00 52.32 N ATOM 1258 CA VAL A 100 0.233 -13.525 -22.407 1.00 34.53 C ATOM 1259 C VAL A 100 1.086 -14.399 -21.496 1.00 25.52 C ATOM 1260 O VAL A 100 2.254 -14.097 -21.243 1.00 33.14 O ATOM 1261 CB VAL A 100 0.149 -14.182 -23.799 1.00 14.43 C ATOM 1262 CG1 VAL A 100 1.388 -15.021 -24.068 1.00 22.43 C ATOM 1263 CG2 VAL A 100 -1.112 -15.024 -23.915 1.00 13.42 C ATOM 0 H VAL A 100 1.784 -12.123 -22.556 1.00 52.32 H new ATOM 0 HA VAL A 100 -0.771 -13.443 -21.992 1.00 34.53 H new ATOM 0 HB VAL A 100 0.102 -13.395 -24.552 1.00 14.43 H new ATOM 0 HG11 VAL A 100 1.311 -15.477 -25.055 1.00 22.43 H new ATOM 0 HG12 VAL A 100 2.273 -14.386 -24.030 1.00 22.43 H new ATOM 0 HG13 VAL A 100 1.469 -15.802 -23.312 1.00 22.43 H new ATOM 0 HG21 VAL A 100 -1.155 -15.480 -24.904 1.00 13.42 H new ATOM 0 HG22 VAL A 100 -1.099 -15.805 -23.155 1.00 13.42 H new ATOM 0 HG23 VAL A 100 -1.987 -14.391 -23.769 1.00 13.42 H new ATOM 1273 N HIS A 101 0.499 -15.487 -21.006 1.00 53.33 N ATOM 1274 CA HIS A 101 1.208 -16.407 -20.123 1.00 32.14 C ATOM 1275 C HIS A 101 1.778 -17.583 -20.909 1.00 23.04 C ATOM 1276 O HIS A 101 1.073 -18.221 -21.692 1.00 42.13 O ATOM 1277 CB HIS A 101 0.271 -16.917 -19.027 1.00 4.23 C ATOM 1278 CG HIS A 101 -1.035 -17.431 -19.546 1.00 32.10 C ATOM 1279 ND1 HIS A 101 -2.190 -16.676 -19.560 1.00 62.52 N ATOM 1280 CD2 HIS A 101 -1.367 -18.633 -20.073 1.00 62.22 C ATOM 1281 CE1 HIS A 101 -3.175 -17.393 -20.072 1.00 51.45 C ATOM 1282 NE2 HIS A 101 -2.702 -18.584 -20.393 1.00 2.52 N ATOM 0 H HIS A 101 -0.465 -15.753 -21.205 1.00 53.33 H new ATOM 0 HA HIS A 101 2.035 -15.866 -19.662 1.00 32.14 H new ATOM 0 HB2 HIS A 101 0.771 -17.712 -18.474 1.00 4.23 H new ATOM 0 HB3 HIS A 101 0.079 -16.110 -18.320 1.00 4.23 H new ATOM 0 HD2 HIS A 101 -0.705 -19.474 -20.215 1.00 62.22 H new ATOM 0 HE1 HIS A 101 -4.194 -17.061 -20.205 1.00 51.45 H new ATOM 0 HE2 HIS A 101 -3.240 -19.343 -20.810 1.00 2.52 H new ATOM 1290 N VAL A 102 3.059 -17.866 -20.696 1.00 43.30 N ATOM 1291 CA VAL A 102 3.724 -18.966 -21.383 1.00 42.52 C ATOM 1292 C VAL A 102 3.788 -20.208 -20.501 1.00 51.33 C ATOM 1293 O VAL A 102 3.558 -21.323 -20.965 1.00 21.14 O ATOM 1294 CB VAL A 102 5.153 -18.579 -21.810 1.00 74.11 C ATOM 1295 CG1 VAL A 102 5.865 -19.770 -22.434 1.00 2.22 C ATOM 1296 CG2 VAL A 102 5.120 -17.402 -22.774 1.00 64.12 C ATOM 0 H VAL A 102 3.657 -17.348 -20.052 1.00 43.30 H new ATOM 0 HA VAL A 102 3.133 -19.186 -22.272 1.00 42.52 H new ATOM 0 HB VAL A 102 5.710 -18.277 -20.923 1.00 74.11 H new ATOM 0 HG11 VAL A 102 6.873 -19.478 -22.729 1.00 2.22 H new ATOM 0 HG12 VAL A 102 5.921 -20.582 -21.709 1.00 2.22 H new ATOM 0 HG13 VAL A 102 5.313 -20.105 -23.312 1.00 2.22 H new ATOM 0 HG21 VAL A 102 6.138 -17.142 -23.065 1.00 64.12 H new ATOM 0 HG22 VAL A 102 4.547 -17.674 -23.660 1.00 64.12 H new ATOM 0 HG23 VAL A 102 4.652 -16.546 -22.288 1.00 64.12 H new ATOM 1306 N GLY A 103 4.103 -20.005 -19.226 1.00 31.13 N ATOM 1307 CA GLY A 103 4.191 -21.117 -18.298 1.00 15.02 C ATOM 1308 C GLY A 103 5.588 -21.295 -17.737 1.00 44.12 C ATOM 1309 O GLY A 103 5.901 -20.789 -16.660 1.00 65.30 O ATOM 0 H GLY A 103 4.299 -19.090 -18.819 1.00 31.13 H new ATOM 0 HA2 GLY A 103 3.491 -20.958 -17.478 1.00 15.02 H new ATOM 0 HA3 GLY A 103 3.886 -22.033 -18.804 1.00 15.02 H new ATOM 1313 N GLY A 104 6.430 -22.019 -18.468 1.00 42.41 N ATOM 1314 CA GLY A 104 7.791 -22.250 -18.020 1.00 65.31 C ATOM 1315 C GLY A 104 7.937 -23.554 -17.261 1.00 30.20 C ATOM 1316 O GLY A 104 6.952 -24.110 -16.774 1.00 55.40 O ATOM 0 H GLY A 104 6.194 -22.450 -19.362 1.00 42.41 H new ATOM 0 HA2 GLY A 104 8.458 -22.258 -18.882 1.00 65.31 H new ATOM 0 HA3 GLY A 104 8.105 -21.424 -17.382 1.00 65.31 H new ATOM 1320 N CYS A 105 9.167 -24.043 -17.161 1.00 21.44 N ATOM 1321 CA CYS A 105 9.439 -25.292 -16.457 1.00 73.33 C ATOM 1322 C CYS A 105 8.790 -26.472 -17.174 1.00 22.11 C ATOM 1323 O CYS A 105 8.718 -27.576 -16.633 1.00 23.11 O ATOM 1324 CB CYS A 105 8.929 -25.211 -15.018 1.00 21.30 C ATOM 1325 SG CYS A 105 9.668 -26.428 -13.903 1.00 20.23 S ATOM 0 H CYS A 105 9.992 -23.594 -17.558 1.00 21.44 H new ATOM 0 HA CYS A 105 10.518 -25.447 -16.444 1.00 73.33 H new ATOM 0 HB2 CYS A 105 9.126 -24.212 -14.630 1.00 21.30 H new ATOM 0 HB3 CYS A 105 7.847 -25.345 -15.019 1.00 21.30 H new ATOM 0 HG CYS A 105 9.643 -27.601 -14.463 1.00 20.23 H new ATOM 1331 N ASP A 106 8.319 -26.231 -18.392 1.00 51.25 N ATOM 1332 CA ASP A 106 7.676 -27.274 -19.183 1.00 43.25 C ATOM 1333 C ASP A 106 7.110 -26.701 -20.479 1.00 32.33 C ATOM 1334 O ASP A 106 7.284 -27.277 -21.553 1.00 4.11 O ATOM 1335 CB ASP A 106 6.561 -27.942 -18.376 1.00 45.43 C ATOM 1336 CG ASP A 106 5.770 -26.948 -17.550 1.00 35.10 C ATOM 1337 OD1 ASP A 106 4.940 -26.220 -18.135 1.00 33.43 O ATOM 1338 OD2 ASP A 106 5.979 -26.897 -16.320 1.00 62.35 O ATOM 0 H ASP A 106 8.370 -25.323 -18.853 1.00 51.25 H new ATOM 0 HA ASP A 106 8.429 -28.021 -19.435 1.00 43.25 H new ATOM 0 HB2 ASP A 106 5.887 -28.463 -19.056 1.00 45.43 H new ATOM 0 HB3 ASP A 106 6.994 -28.695 -17.717 1.00 45.43 H new ATOM 1343 N ARG A 107 6.429 -25.565 -20.370 1.00 11.04 N ATOM 1344 CA ARG A 107 5.834 -24.916 -21.532 1.00 42.32 C ATOM 1345 C ARG A 107 6.893 -24.171 -22.340 1.00 71.30 C ATOM 1346 O ARG A 107 7.099 -24.451 -23.522 1.00 23.12 O ATOM 1347 CB ARG A 107 4.736 -23.944 -21.094 1.00 34.32 C ATOM 1348 CG ARG A 107 3.447 -24.086 -21.886 1.00 62.54 C ATOM 1349 CD ARG A 107 3.670 -23.813 -23.366 1.00 12.31 C ATOM 1350 NE ARG A 107 2.437 -23.946 -24.138 1.00 45.05 N ATOM 1351 CZ ARG A 107 1.893 -25.115 -24.459 1.00 23.22 C ATOM 1352 NH1 ARG A 107 2.470 -26.245 -24.075 1.00 75.14 N ATOM 1353 NH2 ARG A 107 0.770 -25.155 -25.165 1.00 0.43 N ATOM 0 H ARG A 107 6.276 -25.075 -19.489 1.00 11.04 H new ATOM 0 HA ARG A 107 5.396 -25.689 -22.163 1.00 42.32 H new ATOM 0 HB2 ARG A 107 4.523 -24.102 -20.037 1.00 34.32 H new ATOM 0 HB3 ARG A 107 5.104 -22.923 -21.195 1.00 34.32 H new ATOM 0 HG2 ARG A 107 3.048 -25.092 -21.756 1.00 62.54 H new ATOM 0 HG3 ARG A 107 2.701 -23.394 -21.496 1.00 62.54 H new ATOM 0 HD2 ARG A 107 4.071 -22.807 -23.493 1.00 12.31 H new ATOM 0 HD3 ARG A 107 4.417 -24.505 -23.754 1.00 12.31 H new ATOM 0 HE ARG A 107 1.968 -23.095 -24.448 1.00 45.05 H new ATOM 0 HH11 ARG A 107 3.333 -26.218 -23.532 1.00 75.14 H new ATOM 0 HH12 ARG A 107 2.051 -27.141 -24.322 1.00 75.14 H new ATOM 0 HH21 ARG A 107 0.323 -24.288 -25.462 1.00 0.43 H new ATOM 0 HH22 ARG A 107 0.354 -26.053 -25.411 1.00 0.43 H new ATOM 1367 N THR A 108 7.563 -23.221 -21.695 1.00 0.43 N ATOM 1368 CA THR A 108 8.599 -22.435 -22.353 1.00 72.41 C ATOM 1369 C THR A 108 9.692 -23.334 -22.923 1.00 13.41 C ATOM 1370 O THR A 108 10.407 -22.947 -23.848 1.00 53.00 O ATOM 1371 CB THR A 108 9.237 -21.422 -21.384 1.00 30.42 C ATOM 1372 OG1 THR A 108 8.278 -20.423 -21.019 1.00 25.23 O ATOM 1373 CG2 THR A 108 10.452 -20.759 -22.016 1.00 72.24 C ATOM 0 H THR A 108 7.406 -22.977 -20.717 1.00 0.43 H new ATOM 0 HA THR A 108 8.116 -21.893 -23.166 1.00 72.41 H new ATOM 0 HB THR A 108 9.559 -21.959 -20.492 1.00 30.42 H new ATOM 0 HG1 THR A 108 7.591 -20.823 -20.446 1.00 25.23 H new ATOM 0 HG21 THR A 108 10.885 -20.048 -21.313 1.00 72.24 H new ATOM 0 HG22 THR A 108 11.192 -21.519 -22.266 1.00 72.24 H new ATOM 0 HG23 THR A 108 10.150 -20.235 -22.923 1.00 72.24 H new ATOM 1381 N PHE A 109 9.814 -24.533 -22.366 1.00 64.31 N ATOM 1382 CA PHE A 109 10.820 -25.487 -22.819 1.00 61.22 C ATOM 1383 C PHE A 109 10.309 -26.294 -24.009 1.00 31.34 C ATOM 1384 O PHE A 109 11.013 -26.467 -25.002 1.00 70.23 O ATOM 1385 CB PHE A 109 11.211 -26.429 -21.679 1.00 20.50 C ATOM 1386 CG PHE A 109 12.656 -26.327 -21.284 1.00 44.52 C ATOM 1387 CD1 PHE A 109 13.219 -25.098 -20.977 1.00 13.15 C ATOM 1388 CD2 PHE A 109 13.453 -27.459 -21.220 1.00 50.45 C ATOM 1389 CE1 PHE A 109 14.548 -25.000 -20.613 1.00 4.52 C ATOM 1390 CE2 PHE A 109 14.783 -27.366 -20.857 1.00 20.41 C ATOM 1391 CZ PHE A 109 15.332 -26.135 -20.553 1.00 73.35 C ATOM 0 H PHE A 109 9.229 -24.868 -21.600 1.00 64.31 H new ATOM 0 HA PHE A 109 11.700 -24.926 -23.135 1.00 61.22 H new ATOM 0 HB2 PHE A 109 10.589 -26.212 -20.810 1.00 20.50 H new ATOM 0 HB3 PHE A 109 10.996 -27.455 -21.977 1.00 20.50 H new ATOM 0 HD1 PHE A 109 12.611 -24.206 -21.023 1.00 13.15 H new ATOM 0 HD2 PHE A 109 13.030 -28.424 -21.456 1.00 50.45 H new ATOM 0 HE1 PHE A 109 14.974 -24.036 -20.375 1.00 4.52 H new ATOM 0 HE2 PHE A 109 15.394 -28.256 -20.811 1.00 20.41 H new ATOM 0 HZ PHE A 109 16.371 -26.061 -20.269 1.00 73.35 H new ATOM 1401 N GLN A 110 9.079 -26.786 -23.897 1.00 14.53 N ATOM 1402 CA GLN A 110 8.472 -27.575 -24.962 1.00 63.44 C ATOM 1403 C GLN A 110 8.123 -26.697 -26.160 1.00 2.22 C ATOM 1404 O GLN A 110 8.552 -26.961 -27.282 1.00 22.21 O ATOM 1405 CB GLN A 110 7.217 -28.283 -24.450 1.00 74.32 C ATOM 1406 CG GLN A 110 7.494 -29.648 -23.840 1.00 10.10 C ATOM 1407 CD GLN A 110 8.536 -29.595 -22.740 1.00 13.12 C ATOM 1408 OE1 GLN A 110 9.704 -29.295 -22.989 1.00 51.41 O ATOM 1409 NE2 GLN A 110 8.118 -29.886 -21.514 1.00 61.31 N ATOM 0 H GLN A 110 8.484 -26.652 -23.080 1.00 14.53 H new ATOM 0 HA GLN A 110 9.197 -28.323 -25.283 1.00 63.44 H new ATOM 0 HB2 GLN A 110 6.733 -27.652 -23.704 1.00 74.32 H new ATOM 0 HB3 GLN A 110 6.513 -28.399 -25.274 1.00 74.32 H new ATOM 0 HG2 GLN A 110 6.567 -30.057 -23.438 1.00 10.10 H new ATOM 0 HG3 GLN A 110 7.830 -30.329 -24.621 1.00 10.10 H new ATOM 0 HE21 GLN A 110 7.141 -30.129 -21.353 1.00 61.31 H new ATOM 0 HE22 GLN A 110 8.774 -29.866 -20.733 1.00 61.31 H new ATOM 1418 N ALA A 111 7.340 -25.652 -25.912 1.00 75.41 N ATOM 1419 CA ALA A 111 6.934 -24.734 -26.969 1.00 62.31 C ATOM 1420 C ALA A 111 8.122 -24.339 -27.839 1.00 50.02 C ATOM 1421 O ALA A 111 7.969 -24.066 -29.030 1.00 54.44 O ATOM 1422 CB ALA A 111 6.280 -23.497 -26.371 1.00 51.15 C ATOM 0 H ALA A 111 6.974 -25.420 -24.988 1.00 75.41 H new ATOM 0 HA ALA A 111 6.208 -25.245 -27.602 1.00 62.31 H new ATOM 0 HB1 ALA A 111 5.982 -22.820 -27.172 1.00 51.15 H new ATOM 0 HB2 ALA A 111 5.401 -23.791 -25.798 1.00 51.15 H new ATOM 0 HB3 ALA A 111 6.989 -22.992 -25.714 1.00 51.15 H new ATOM 1428 N HIS A 112 9.307 -24.311 -27.238 1.00 3.02 N ATOM 1429 CA HIS A 112 10.522 -23.949 -27.958 1.00 40.14 C ATOM 1430 C HIS A 112 10.795 -24.933 -29.093 1.00 11.24 C ATOM 1431 O HIS A 112 10.871 -24.544 -30.258 1.00 65.41 O ATOM 1432 CB HIS A 112 11.715 -23.911 -27.003 1.00 44.13 C ATOM 1433 CG HIS A 112 13.040 -23.871 -27.701 1.00 11.13 C ATOM 1434 ND1 HIS A 112 14.127 -24.618 -27.297 1.00 34.42 N ATOM 1435 CD2 HIS A 112 13.450 -23.168 -28.782 1.00 71.22 C ATOM 1436 CE1 HIS A 112 15.147 -24.375 -28.098 1.00 63.13 C ATOM 1437 NE2 HIS A 112 14.764 -23.500 -29.009 1.00 54.14 N ATOM 0 H HIS A 112 9.452 -24.535 -26.253 1.00 3.02 H new ATOM 0 HA HIS A 112 10.378 -22.957 -28.387 1.00 40.14 H new ATOM 0 HB2 HIS A 112 11.626 -23.036 -26.359 1.00 44.13 H new ATOM 0 HB3 HIS A 112 11.680 -24.788 -26.356 1.00 44.13 H new ATOM 0 HD2 HIS A 112 12.855 -22.475 -29.359 1.00 71.22 H new ATOM 0 HE1 HIS A 112 16.129 -24.817 -28.021 1.00 63.13 H new ATOM 0 HE2 HIS A 112 15.348 -23.131 -29.759 1.00 54.14 H new ATOM 1445 N GLN A 113 10.940 -26.207 -28.742 1.00 44.10 N ATOM 1446 CA GLN A 113 11.205 -27.245 -29.732 1.00 20.12 C ATOM 1447 C GLN A 113 9.924 -27.652 -30.450 1.00 54.42 C ATOM 1448 O GLN A 113 9.966 -28.308 -31.491 1.00 13.52 O ATOM 1449 CB GLN A 113 11.838 -28.466 -29.062 1.00 65.14 C ATOM 1450 CG GLN A 113 13.263 -28.229 -28.587 1.00 62.13 C ATOM 1451 CD GLN A 113 13.814 -29.394 -27.790 1.00 0.45 C ATOM 1452 OE1 GLN A 113 14.590 -30.200 -28.302 1.00 70.21 O ATOM 1453 NE2 GLN A 113 13.414 -29.488 -26.526 1.00 64.44 N ATOM 0 H GLN A 113 10.879 -26.545 -27.782 1.00 44.10 H new ATOM 0 HA GLN A 113 11.900 -26.841 -30.469 1.00 20.12 H new ATOM 0 HB2 GLN A 113 11.225 -28.762 -28.211 1.00 65.14 H new ATOM 0 HB3 GLN A 113 11.832 -29.299 -29.764 1.00 65.14 H new ATOM 0 HG2 GLN A 113 13.904 -28.049 -29.450 1.00 62.13 H new ATOM 0 HG3 GLN A 113 13.292 -27.328 -27.974 1.00 62.13 H new ATOM 0 HE21 GLN A 113 12.769 -28.797 -26.142 1.00 64.44 H new ATOM 0 HE22 GLN A 113 13.752 -30.251 -25.940 1.00 64.44 H new ATOM 1462 N ASN A 114 8.785 -27.259 -29.888 1.00 63.21 N ATOM 1463 CA ASN A 114 7.491 -27.585 -30.475 1.00 54.34 C ATOM 1464 C ASN A 114 7.076 -26.530 -31.496 1.00 10.52 C ATOM 1465 O ASN A 114 6.208 -26.769 -32.335 1.00 23.43 O ATOM 1466 CB ASN A 114 6.426 -27.700 -29.382 1.00 41.14 C ATOM 1467 CG ASN A 114 5.019 -27.734 -29.948 1.00 34.24 C ATOM 1468 OD1 ASN A 114 4.761 -28.382 -30.963 1.00 2.14 O ATOM 1469 ND2 ASN A 114 4.101 -27.035 -29.291 1.00 51.11 N ATOM 0 H ASN A 114 8.732 -26.715 -29.027 1.00 63.21 H new ATOM 0 HA ASN A 114 7.583 -28.544 -30.986 1.00 54.34 H new ATOM 0 HB2 ASN A 114 6.603 -28.604 -28.800 1.00 41.14 H new ATOM 0 HB3 ASN A 114 6.519 -26.857 -28.697 1.00 41.14 H new ATOM 0 HD21 ASN A 114 3.137 -27.020 -29.623 1.00 51.11 H new ATOM 0 HD22 ASN A 114 4.360 -26.513 -28.454 1.00 51.11 H new ATOM 1476 N GLY A 115 7.702 -25.360 -31.418 1.00 44.02 N ATOM 1477 CA GLY A 115 7.386 -24.285 -32.341 1.00 73.23 C ATOM 1478 C GLY A 115 6.282 -23.384 -31.825 1.00 73.50 C ATOM 1479 O GLY A 115 5.960 -22.368 -32.441 1.00 41.14 O ATOM 0 H GLY A 115 8.423 -25.137 -30.732 1.00 44.02 H new ATOM 0 HA2 GLY A 115 8.281 -23.690 -32.522 1.00 73.23 H new ATOM 0 HA3 GLY A 115 7.086 -24.709 -33.299 1.00 73.23 H new ATOM 1483 N LEU A 116 5.697 -23.758 -30.692 1.00 12.25 N ATOM 1484 CA LEU A 116 4.620 -22.978 -30.093 1.00 14.42 C ATOM 1485 C LEU A 116 5.164 -21.710 -29.441 1.00 14.41 C ATOM 1486 O LEU A 116 4.421 -20.758 -29.194 1.00 65.24 O ATOM 1487 CB LEU A 116 3.870 -23.816 -29.057 1.00 64.22 C ATOM 1488 CG LEU A 116 2.598 -23.193 -28.482 1.00 32.52 C ATOM 1489 CD1 LEU A 116 1.597 -24.275 -28.105 1.00 0.22 C ATOM 1490 CD2 LEU A 116 2.927 -22.324 -27.277 1.00 32.12 C ATOM 0 H LEU A 116 5.951 -24.597 -30.170 1.00 12.25 H new ATOM 0 HA LEU A 116 3.930 -22.690 -30.886 1.00 14.42 H new ATOM 0 HB2 LEU A 116 3.609 -24.771 -29.512 1.00 64.22 H new ATOM 0 HB3 LEU A 116 4.550 -24.031 -28.233 1.00 64.22 H new ATOM 0 HG LEU A 116 2.148 -22.561 -29.248 1.00 32.52 H new ATOM 0 HD11 LEU A 116 0.698 -23.813 -27.697 1.00 0.22 H new ATOM 0 HD12 LEU A 116 1.337 -24.855 -28.991 1.00 0.22 H new ATOM 0 HD13 LEU A 116 2.038 -24.933 -27.356 1.00 0.22 H new ATOM 0 HD21 LEU A 116 2.010 -21.889 -26.881 1.00 32.12 H new ATOM 0 HD22 LEU A 116 3.401 -22.933 -26.508 1.00 32.12 H new ATOM 0 HD23 LEU A 116 3.606 -21.527 -27.578 1.00 32.12 H new ATOM 1502 N LEU A 117 6.462 -21.703 -29.167 1.00 3.14 N ATOM 1503 CA LEU A 117 7.107 -20.552 -28.545 1.00 40.11 C ATOM 1504 C LEU A 117 7.557 -19.545 -29.599 1.00 1.05 C ATOM 1505 O LEU A 117 7.273 -18.352 -29.491 1.00 74.25 O ATOM 1506 CB LEU A 117 8.307 -21.003 -27.710 1.00 4.20 C ATOM 1507 CG LEU A 117 8.630 -20.149 -26.483 1.00 13.31 C ATOM 1508 CD1 LEU A 117 7.526 -20.269 -25.443 1.00 64.53 C ATOM 1509 CD2 LEU A 117 9.971 -20.554 -25.889 1.00 31.41 C ATOM 0 H LEU A 117 7.090 -22.482 -29.366 1.00 3.14 H new ATOM 0 HA LEU A 117 6.380 -20.068 -27.893 1.00 40.11 H new ATOM 0 HB2 LEU A 117 8.130 -22.026 -27.379 1.00 4.20 H new ATOM 0 HB3 LEU A 117 9.186 -21.024 -28.355 1.00 4.20 H new ATOM 0 HG LEU A 117 8.694 -19.107 -26.796 1.00 13.31 H new ATOM 0 HD11 LEU A 117 7.773 -19.655 -24.577 1.00 64.53 H new ATOM 0 HD12 LEU A 117 6.583 -19.929 -25.872 1.00 64.53 H new ATOM 0 HD13 LEU A 117 7.429 -21.310 -25.134 1.00 64.53 H new ATOM 0 HD21 LEU A 117 10.184 -19.936 -25.017 1.00 31.41 H new ATOM 0 HD22 LEU A 117 9.935 -21.602 -25.591 1.00 31.41 H new ATOM 0 HD23 LEU A 117 10.755 -20.415 -26.633 1.00 31.41 H new ATOM 1521 N GLN A 118 8.258 -20.034 -30.617 1.00 33.22 N ATOM 1522 CA GLN A 118 8.744 -19.176 -31.690 1.00 65.22 C ATOM 1523 C GLN A 118 7.598 -18.398 -32.327 1.00 51.12 C ATOM 1524 O GLN A 118 7.765 -17.249 -32.737 1.00 70.14 O ATOM 1525 CB GLN A 118 9.462 -20.011 -32.753 1.00 73.24 C ATOM 1526 CG GLN A 118 8.517 -20.785 -33.659 1.00 73.11 C ATOM 1527 CD GLN A 118 9.246 -21.552 -34.744 1.00 43.13 C ATOM 1528 OE1 GLN A 118 9.634 -22.705 -34.552 1.00 34.23 O ATOM 1529 NE2 GLN A 118 9.439 -20.915 -35.893 1.00 75.22 N ATOM 0 H GLN A 118 8.502 -21.019 -30.721 1.00 33.22 H new ATOM 0 HA GLN A 118 9.448 -18.463 -31.260 1.00 65.22 H new ATOM 0 HB2 GLN A 118 10.080 -19.353 -33.364 1.00 73.24 H new ATOM 0 HB3 GLN A 118 10.135 -20.712 -32.259 1.00 73.24 H new ATOM 0 HG2 GLN A 118 7.932 -21.481 -33.058 1.00 73.11 H new ATOM 0 HG3 GLN A 118 7.813 -20.092 -34.120 1.00 73.11 H new ATOM 0 HE21 GLN A 118 9.101 -19.960 -36.010 1.00 75.22 H new ATOM 0 HE22 GLN A 118 9.925 -21.381 -36.659 1.00 75.22 H new ATOM 1538 N LYS A 119 6.432 -19.031 -32.408 1.00 52.32 N ATOM 1539 CA LYS A 119 5.257 -18.398 -32.994 1.00 51.34 C ATOM 1540 C LYS A 119 4.675 -17.351 -32.051 1.00 3.54 C ATOM 1541 O LYS A 119 4.043 -16.388 -32.488 1.00 55.51 O ATOM 1542 CB LYS A 119 4.195 -19.451 -33.322 1.00 15.45 C ATOM 1543 CG LYS A 119 3.707 -20.220 -32.106 1.00 4.33 C ATOM 1544 CD LYS A 119 2.596 -21.192 -32.471 1.00 4.14 C ATOM 1545 CE LYS A 119 1.526 -21.243 -31.391 1.00 35.31 C ATOM 1546 NZ LYS A 119 0.295 -20.511 -31.796 1.00 12.54 N ATOM 0 H LYS A 119 6.276 -19.982 -32.075 1.00 52.32 H new ATOM 0 HA LYS A 119 5.564 -17.901 -33.914 1.00 51.34 H new ATOM 0 HB2 LYS A 119 3.345 -18.962 -33.798 1.00 15.45 H new ATOM 0 HB3 LYS A 119 4.604 -20.155 -34.047 1.00 15.45 H new ATOM 0 HG2 LYS A 119 4.539 -20.767 -31.662 1.00 4.33 H new ATOM 0 HG3 LYS A 119 3.347 -19.520 -31.352 1.00 4.33 H new ATOM 0 HD2 LYS A 119 2.146 -20.893 -33.418 1.00 4.14 H new ATOM 0 HD3 LYS A 119 3.015 -22.188 -32.617 1.00 4.14 H new ATOM 0 HE2 LYS A 119 1.277 -22.282 -31.176 1.00 35.31 H new ATOM 0 HE3 LYS A 119 1.919 -20.812 -30.470 1.00 35.31 H new ATOM 0 HZ1 LYS A 119 -0.410 -20.569 -31.034 1.00 12.54 H new ATOM 0 HZ2 LYS A 119 0.528 -19.514 -31.977 1.00 12.54 H new ATOM 0 HZ3 LYS A 119 -0.094 -20.938 -32.661 1.00 12.54 H new ATOM 1560 N LEU A 120 4.893 -17.542 -30.754 1.00 61.34 N ATOM 1561 CA LEU A 120 4.392 -16.613 -29.747 1.00 41.32 C ATOM 1562 C LEU A 120 5.224 -15.335 -29.724 1.00 52.32 C ATOM 1563 O LEU A 120 4.691 -14.232 -29.852 1.00 34.02 O ATOM 1564 CB LEU A 120 4.406 -17.270 -28.366 1.00 42.21 C ATOM 1565 CG LEU A 120 3.360 -16.764 -27.372 1.00 5.44 C ATOM 1566 CD1 LEU A 120 3.560 -17.413 -26.011 1.00 22.23 C ATOM 1567 CD2 LEU A 120 3.424 -15.248 -27.257 1.00 15.35 C ATOM 0 H LEU A 120 5.414 -18.333 -30.375 1.00 61.34 H new ATOM 0 HA LEU A 120 3.366 -16.352 -30.007 1.00 41.32 H new ATOM 0 HB2 LEU A 120 4.266 -18.343 -28.495 1.00 42.21 H new ATOM 0 HB3 LEU A 120 5.394 -17.127 -27.928 1.00 42.21 H new ATOM 0 HG LEU A 120 2.372 -17.039 -27.741 1.00 5.44 H new ATOM 0 HD11 LEU A 120 2.807 -17.041 -25.316 1.00 22.23 H new ATOM 0 HD12 LEU A 120 3.464 -18.495 -26.106 1.00 22.23 H new ATOM 0 HD13 LEU A 120 4.553 -17.169 -25.634 1.00 22.23 H new ATOM 0 HD21 LEU A 120 2.673 -14.905 -26.546 1.00 15.35 H new ATOM 0 HD22 LEU A 120 4.414 -14.951 -26.911 1.00 15.35 H new ATOM 0 HD23 LEU A 120 3.231 -14.801 -28.232 1.00 15.35 H new ATOM 1579 N LEU A 121 6.534 -15.490 -29.564 1.00 34.23 N ATOM 1580 CA LEU A 121 7.441 -14.348 -29.526 1.00 72.43 C ATOM 1581 C LEU A 121 7.392 -13.571 -30.837 1.00 41.04 C ATOM 1582 O LEU A 121 7.695 -12.379 -30.875 1.00 11.14 O ATOM 1583 CB LEU A 121 8.871 -14.817 -29.249 1.00 52.54 C ATOM 1584 CG LEU A 121 9.028 -15.893 -28.175 1.00 21.21 C ATOM 1585 CD1 LEU A 121 10.497 -16.106 -27.846 1.00 25.14 C ATOM 1586 CD2 LEU A 121 8.249 -15.516 -26.924 1.00 74.11 C ATOM 0 H LEU A 121 6.992 -16.395 -29.459 1.00 34.23 H new ATOM 0 HA LEU A 121 7.121 -13.686 -28.721 1.00 72.43 H new ATOM 0 HB2 LEU A 121 9.294 -15.196 -30.179 1.00 52.54 H new ATOM 0 HB3 LEU A 121 9.466 -13.951 -28.957 1.00 52.54 H new ATOM 0 HG LEU A 121 8.623 -16.828 -28.562 1.00 21.21 H new ATOM 0 HD11 LEU A 121 10.590 -16.875 -27.080 1.00 25.14 H new ATOM 0 HD12 LEU A 121 11.029 -16.422 -28.744 1.00 25.14 H new ATOM 0 HD13 LEU A 121 10.926 -15.174 -27.479 1.00 25.14 H new ATOM 0 HD21 LEU A 121 8.372 -16.294 -26.170 1.00 74.11 H new ATOM 0 HD22 LEU A 121 8.623 -14.570 -26.534 1.00 74.11 H new ATOM 0 HD23 LEU A 121 7.192 -15.414 -27.170 1.00 74.11 H new