USER MOD reduce.3.24.130724 H: found=0, std=0, add=776, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 774 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 9 SER OG : rot -167:sc= -0.648 USER MOD Set 1.2: A 53 GLN : amide:sc= -2.13 X(o=-2.8,f=-3.1) USER MOD Single : A 5 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 TYR OH : rot 176:sc= -1.37 USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 GLN : amide:sc= -1.33 K(o=-1.3,f=-7.5!) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) 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= -0.157 USER MOD Single : A 28 GLN : amide:sc= -0.931 K(o=-0.93,f=-1.6) 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= 0.193 K(o=0.19,f=-3!) USER MOD Single : A 42 ASN : amide:sc=-0.00135 K(o=-0.0014,f=-1.2) USER MOD Single : A 43 THR OG1 : rot -58:sc= 1.71 USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 GLN : amide:sc= -0.0548 X(o=-0.055,f=0) USER MOD Single : A 51 GLN : amide:sc= 0 X(o=0,f=-0.13) USER MOD Single : A 57 SER OG : rot -50:sc= 0.261 USER MOD Single : A 58 LYS NZ :NH3+ -179:sc= -0.374 (180deg=-0.377) USER MOD Single : A 61 HIS : no HD1:sc= 0 X(o=0,f=-0.044) USER MOD Single : A 62 MET CE :methyl -179:sc= -2.38 (180deg=-2.4) USER MOD Single : A 63 GLN : amide:sc= -1.51 K(o=-1.5,f=-2.1) USER MOD Single : A 68 THR OG1 : rot 180:sc= -0.142 USER MOD Single : A 71 SER OG : rot -131:sc= -0.209 USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 SER OG : rot -27:sc= 0.631 USER MOD Single : A 75 HIS : no HD1:sc= 0 X(o=0,f=-0.0012) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 ASN : amide:sc= -0.725 K(o=-0.72,f=-3.3!) USER MOD Single : A 82 ASN : amide:sc= 0 K(o=0,f=-0.65) USER MOD Single : A 83 ASN : amide:sc= -0.0193 K(o=-0.019,f=-1.2) 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= -0.189 K(o=-0.19,f=-2.2!) USER MOD Single : A 99 LYS NZ :NH3+ 160:sc= -0.0584 (180deg=-0.312) USER MOD ----------------------------------------------------------------- ATOM 40 N ASN A 5 9.021 1.942 -7.862 1.00 54.23 N ATOM 41 CA ASN A 5 8.439 0.839 -8.618 1.00 63.31 C ATOM 42 C ASN A 5 9.202 0.610 -9.920 1.00 32.54 C ATOM 43 O ASN A 5 8.616 0.251 -10.941 1.00 75.25 O ATOM 44 CB ASN A 5 6.966 1.120 -8.920 1.00 10.00 C ATOM 45 CG ASN A 5 6.177 1.469 -7.673 1.00 12.30 C ATOM 46 OD1 ASN A 5 6.010 0.641 -6.778 1.00 24.31 O ATOM 47 ND2 ASN A 5 5.686 2.702 -7.609 1.00 61.34 N ATOM 0 HA ASN A 5 8.512 -0.063 -8.010 1.00 63.31 H new ATOM 0 HB2 ASN A 5 6.894 1.941 -9.634 1.00 10.00 H new ATOM 0 HB3 ASN A 5 6.522 0.245 -9.395 1.00 10.00 H new ATOM 0 HD21 ASN A 5 5.146 2.994 -6.794 1.00 61.34 H new ATOM 0 HD22 ASN A 5 5.849 3.356 -8.374 1.00 61.34 H new ATOM 54 N THR A 6 10.514 0.819 -9.875 1.00 60.21 N ATOM 55 CA THR A 6 11.357 0.636 -11.050 1.00 24.15 C ATOM 56 C THR A 6 11.842 -0.805 -11.159 1.00 61.24 C ATOM 57 O THR A 6 12.843 -1.183 -10.549 1.00 43.51 O ATOM 58 CB THR A 6 12.578 1.575 -11.016 1.00 71.04 C ATOM 59 OG1 THR A 6 12.229 2.810 -10.381 1.00 31.33 O ATOM 60 CG2 THR A 6 13.088 1.849 -12.423 1.00 51.41 C ATOM 0 H THR A 6 11.016 1.115 -9.038 1.00 60.21 H new ATOM 0 HA THR A 6 10.745 0.878 -11.919 1.00 24.15 H new ATOM 0 HB THR A 6 13.369 1.086 -10.448 1.00 71.04 H new ATOM 0 HG1 THR A 6 13.011 3.400 -10.362 1.00 31.33 H new ATOM 0 HG21 THR A 6 13.950 2.514 -12.374 1.00 51.41 H new ATOM 0 HG22 THR A 6 13.380 0.910 -12.893 1.00 51.41 H new ATOM 0 HG23 THR A 6 12.300 2.319 -13.011 1.00 51.41 H new ATOM 68 N LEU A 7 11.127 -1.607 -11.941 1.00 42.21 N ATOM 69 CA LEU A 7 11.485 -3.008 -12.132 1.00 23.02 C ATOM 70 C LEU A 7 12.877 -3.136 -12.744 1.00 34.01 C ATOM 71 O LEU A 7 13.168 -2.534 -13.778 1.00 23.03 O ATOM 72 CB LEU A 7 10.456 -3.701 -13.027 1.00 43.40 C ATOM 73 CG LEU A 7 9.294 -4.386 -12.308 1.00 21.04 C ATOM 74 CD1 LEU A 7 9.810 -5.467 -11.371 1.00 35.42 C ATOM 75 CD2 LEU A 7 8.464 -3.366 -11.542 1.00 44.40 C ATOM 0 H LEU A 7 10.296 -1.311 -12.453 1.00 42.21 H new ATOM 0 HA LEU A 7 11.492 -3.492 -11.155 1.00 23.02 H new ATOM 0 HB2 LEU A 7 10.046 -2.962 -13.715 1.00 43.40 H new ATOM 0 HB3 LEU A 7 10.973 -4.446 -13.631 1.00 43.40 H new ATOM 0 HG LEU A 7 8.655 -4.856 -13.056 1.00 21.04 H new ATOM 0 HD11 LEU A 7 8.969 -5.944 -10.868 1.00 35.42 H new ATOM 0 HD12 LEU A 7 10.360 -6.213 -11.944 1.00 35.42 H new ATOM 0 HD13 LEU A 7 10.471 -5.020 -10.629 1.00 35.42 H new ATOM 0 HD21 LEU A 7 7.641 -3.872 -11.037 1.00 44.40 H new ATOM 0 HD22 LEU A 7 9.092 -2.867 -10.804 1.00 44.40 H new ATOM 0 HD23 LEU A 7 8.064 -2.627 -12.236 1.00 44.40 H new ATOM 87 N ILE A 8 13.730 -3.925 -12.100 1.00 62.01 N ATOM 88 CA ILE A 8 15.089 -4.134 -12.583 1.00 63.42 C ATOM 89 C ILE A 8 15.378 -5.618 -12.787 1.00 0.15 C ATOM 90 O ILE A 8 14.521 -6.467 -12.542 1.00 0.14 O ATOM 91 CB ILE A 8 16.129 -3.549 -11.610 1.00 23.34 C ATOM 92 CG1 ILE A 8 15.980 -4.186 -10.226 1.00 62.24 C ATOM 93 CG2 ILE A 8 15.981 -2.038 -11.521 1.00 53.35 C ATOM 94 CD1 ILE A 8 17.077 -5.174 -9.895 1.00 34.04 C ATOM 0 H ILE A 8 13.504 -4.430 -11.243 1.00 62.01 H new ATOM 0 HA ILE A 8 15.167 -3.616 -13.539 1.00 63.42 H new ATOM 0 HB ILE A 8 17.126 -3.775 -11.989 1.00 23.34 H new ATOM 0 HG12 ILE A 8 15.971 -3.399 -9.472 1.00 62.24 H new ATOM 0 HG13 ILE A 8 15.017 -4.693 -10.170 1.00 62.24 H new ATOM 0 HG21 ILE A 8 16.723 -1.640 -10.829 1.00 53.35 H new ATOM 0 HG22 ILE A 8 16.132 -1.599 -12.507 1.00 53.35 H new ATOM 0 HG23 ILE A 8 14.982 -1.791 -11.163 1.00 53.35 H new ATOM 0 HD11 ILE A 8 16.908 -5.586 -8.900 1.00 34.04 H new ATOM 0 HD12 ILE A 8 17.073 -5.981 -10.628 1.00 34.04 H new ATOM 0 HD13 ILE A 8 18.042 -4.668 -9.919 1.00 34.04 H new ATOM 106 N SER A 9 16.592 -5.923 -13.235 1.00 13.05 N ATOM 107 CA SER A 9 16.994 -7.304 -13.473 1.00 33.32 C ATOM 108 C SER A 9 18.513 -7.425 -13.534 1.00 43.13 C ATOM 109 O SER A 9 19.215 -6.447 -13.792 1.00 5.04 O ATOM 110 CB SER A 9 16.377 -7.820 -14.774 1.00 74.02 C ATOM 111 OG SER A 9 17.014 -9.010 -15.204 1.00 61.43 O ATOM 0 H SER A 9 17.314 -5.232 -13.440 1.00 13.05 H new ATOM 0 HA SER A 9 16.632 -7.910 -12.642 1.00 33.32 H new ATOM 0 HB2 SER A 9 15.313 -8.006 -14.627 1.00 74.02 H new ATOM 0 HB3 SER A 9 16.463 -7.058 -15.548 1.00 74.02 H new ATOM 0 HG SER A 9 16.751 -9.207 -16.127 1.00 61.43 H new ATOM 117 N VAL A 10 19.015 -8.633 -13.296 1.00 50.31 N ATOM 118 CA VAL A 10 20.451 -8.883 -13.325 1.00 71.41 C ATOM 119 C VAL A 10 20.753 -10.290 -13.828 1.00 61.45 C ATOM 120 O VAL A 10 19.963 -11.214 -13.631 1.00 65.24 O ATOM 121 CB VAL A 10 21.081 -8.703 -11.931 1.00 54.41 C ATOM 122 CG1 VAL A 10 20.590 -9.783 -10.979 1.00 64.13 C ATOM 123 CG2 VAL A 10 22.599 -8.714 -12.027 1.00 53.31 C ATOM 0 H VAL A 10 18.448 -9.453 -13.081 1.00 50.31 H new ATOM 0 HA VAL A 10 20.885 -8.154 -14.009 1.00 71.41 H new ATOM 0 HB VAL A 10 20.772 -7.736 -11.534 1.00 54.41 H new ATOM 0 HG11 VAL A 10 21.046 -9.639 -9.999 1.00 64.13 H new ATOM 0 HG12 VAL A 10 19.506 -9.721 -10.887 1.00 64.13 H new ATOM 0 HG13 VAL A 10 20.866 -10.763 -11.367 1.00 64.13 H new ATOM 0 HG21 VAL A 10 23.027 -8.586 -11.033 1.00 53.31 H new ATOM 0 HG22 VAL A 10 22.930 -9.665 -12.445 1.00 53.31 H new ATOM 0 HG23 VAL A 10 22.929 -7.900 -12.672 1.00 53.31 H new ATOM 133 N ASP A 11 21.901 -10.446 -14.479 1.00 31.23 N ATOM 134 CA ASP A 11 22.309 -11.742 -15.010 1.00 2.43 C ATOM 135 C ASP A 11 22.861 -12.633 -13.902 1.00 24.30 C ATOM 136 O ASP A 11 22.846 -12.263 -12.728 1.00 21.33 O ATOM 137 CB ASP A 11 23.360 -11.559 -16.106 1.00 71.10 C ATOM 138 CG ASP A 11 24.759 -11.394 -15.545 1.00 52.15 C ATOM 139 OD1 ASP A 11 24.895 -10.793 -14.460 1.00 2.33 O ATOM 140 OD2 ASP A 11 25.717 -11.865 -16.193 1.00 63.20 O ATOM 0 H ASP A 11 22.565 -9.691 -14.652 1.00 31.23 H new ATOM 0 HA ASP A 11 21.431 -12.226 -15.437 1.00 2.43 H new ATOM 0 HB2 ASP A 11 23.339 -12.421 -16.773 1.00 71.10 H new ATOM 0 HB3 ASP A 11 23.107 -10.685 -16.706 1.00 71.10 H new ATOM 145 N TYR A 12 23.347 -13.809 -14.283 1.00 62.33 N ATOM 146 CA TYR A 12 23.901 -14.756 -13.322 1.00 40.51 C ATOM 147 C TYR A 12 24.750 -15.811 -14.024 1.00 74.40 C ATOM 148 O TYR A 12 24.482 -16.177 -15.168 1.00 64.30 O ATOM 149 CB TYR A 12 22.777 -15.430 -12.533 1.00 63.04 C ATOM 150 CG TYR A 12 23.185 -15.855 -11.141 1.00 5.11 C ATOM 151 CD1 TYR A 12 23.757 -14.949 -10.256 1.00 64.03 C ATOM 152 CD2 TYR A 12 22.998 -17.162 -10.710 1.00 21.54 C ATOM 153 CE1 TYR A 12 24.133 -15.333 -8.984 1.00 35.24 C ATOM 154 CE2 TYR A 12 23.369 -17.555 -9.438 1.00 72.20 C ATOM 155 CZ TYR A 12 23.936 -16.637 -8.579 1.00 30.20 C ATOM 156 OH TYR A 12 24.307 -17.023 -7.311 1.00 71.44 O ATOM 0 H TYR A 12 23.369 -14.130 -15.251 1.00 62.33 H new ATOM 0 HA TYR A 12 24.539 -14.204 -12.632 1.00 40.51 H new ATOM 0 HB2 TYR A 12 21.933 -14.744 -12.462 1.00 63.04 H new ATOM 0 HB3 TYR A 12 22.431 -16.305 -13.084 1.00 63.04 H new ATOM 0 HD1 TYR A 12 23.910 -13.927 -10.569 1.00 64.03 H new ATOM 0 HD2 TYR A 12 22.555 -17.884 -11.380 1.00 21.54 H new ATOM 0 HE1 TYR A 12 24.579 -14.617 -8.310 1.00 35.24 H new ATOM 0 HE2 TYR A 12 23.216 -18.575 -9.118 1.00 72.20 H new ATOM 0 HH TYR A 12 24.042 -17.955 -7.162 1.00 71.44 H new ATOM 166 N GLU A 13 25.773 -16.297 -13.328 1.00 43.35 N ATOM 167 CA GLU A 13 26.662 -17.311 -13.885 1.00 13.53 C ATOM 168 C GLU A 13 27.532 -17.929 -12.794 1.00 75.11 C ATOM 169 O GLU A 13 28.418 -17.273 -12.247 1.00 24.44 O ATOM 170 CB GLU A 13 27.547 -16.702 -14.975 1.00 32.34 C ATOM 171 CG GLU A 13 28.411 -17.722 -15.697 1.00 31.54 C ATOM 172 CD GLU A 13 28.910 -17.220 -17.037 1.00 41.23 C ATOM 173 OE1 GLU A 13 28.144 -16.516 -17.729 1.00 22.12 O ATOM 174 OE2 GLU A 13 30.065 -17.530 -17.395 1.00 44.21 O ATOM 0 H GLU A 13 26.007 -16.006 -12.379 1.00 43.35 H new ATOM 0 HA GLU A 13 26.047 -18.096 -14.324 1.00 13.53 H new ATOM 0 HB2 GLU A 13 26.915 -16.194 -15.703 1.00 32.34 H new ATOM 0 HB3 GLU A 13 28.191 -15.945 -14.528 1.00 32.34 H new ATOM 0 HG2 GLU A 13 29.264 -17.979 -15.069 1.00 31.54 H new ATOM 0 HG3 GLU A 13 27.838 -18.637 -15.847 1.00 31.54 H new ATOM 181 N ILE A 14 27.270 -19.194 -12.484 1.00 64.51 N ATOM 182 CA ILE A 14 28.029 -19.902 -11.460 1.00 1.30 C ATOM 183 C ILE A 14 29.088 -20.803 -12.085 1.00 22.41 C ATOM 184 O ILE A 14 28.910 -21.314 -13.191 1.00 20.43 O ATOM 185 CB ILE A 14 27.109 -20.753 -10.565 1.00 61.33 C ATOM 186 CG1 ILE A 14 25.928 -19.917 -10.069 1.00 31.13 C ATOM 187 CG2 ILE A 14 27.892 -21.324 -9.392 1.00 13.21 C ATOM 188 CD1 ILE A 14 26.339 -18.736 -9.218 1.00 30.25 C ATOM 0 H ILE A 14 26.538 -19.750 -12.927 1.00 64.51 H new ATOM 0 HA ILE A 14 28.517 -19.144 -10.848 1.00 1.30 H new ATOM 0 HB ILE A 14 26.719 -21.583 -11.154 1.00 61.33 H new ATOM 0 HG12 ILE A 14 25.362 -19.556 -10.928 1.00 31.13 H new ATOM 0 HG13 ILE A 14 25.259 -20.555 -9.492 1.00 31.13 H new ATOM 0 HG21 ILE A 14 27.228 -21.923 -8.769 1.00 13.21 H new ATOM 0 HG22 ILE A 14 28.702 -21.950 -9.766 1.00 13.21 H new ATOM 0 HG23 ILE A 14 28.307 -20.508 -8.800 1.00 13.21 H new ATOM 0 HD11 ILE A 14 25.451 -18.189 -8.902 1.00 30.25 H new ATOM 0 HD12 ILE A 14 26.879 -19.091 -8.340 1.00 30.25 H new ATOM 0 HD13 ILE A 14 26.984 -18.076 -9.798 1.00 30.25 H new ATOM 200 N PHE A 15 30.191 -20.996 -11.369 1.00 32.04 N ATOM 201 CA PHE A 15 31.279 -21.837 -11.852 1.00 64.21 C ATOM 202 C PHE A 15 31.755 -22.792 -10.761 1.00 0.11 C ATOM 203 O PHE A 15 31.806 -22.433 -9.585 1.00 55.24 O ATOM 204 CB PHE A 15 32.446 -20.972 -12.332 1.00 43.24 C ATOM 205 CG PHE A 15 33.304 -21.643 -13.367 1.00 51.51 C ATOM 206 CD1 PHE A 15 34.150 -22.682 -13.017 1.00 4.14 C ATOM 207 CD2 PHE A 15 33.264 -21.233 -14.690 1.00 71.23 C ATOM 208 CE1 PHE A 15 34.941 -23.302 -13.966 1.00 53.44 C ATOM 209 CE2 PHE A 15 34.051 -21.849 -15.644 1.00 65.34 C ATOM 210 CZ PHE A 15 34.892 -22.884 -15.282 1.00 12.21 C ATOM 0 H PHE A 15 30.355 -20.581 -10.452 1.00 32.04 H new ATOM 0 HA PHE A 15 30.904 -22.427 -12.688 1.00 64.21 H new ATOM 0 HB2 PHE A 15 32.053 -20.043 -12.744 1.00 43.24 H new ATOM 0 HB3 PHE A 15 33.066 -20.704 -11.476 1.00 43.24 H new ATOM 0 HD1 PHE A 15 34.192 -23.012 -11.990 1.00 4.14 H new ATOM 0 HD2 PHE A 15 32.610 -20.423 -14.979 1.00 71.23 H new ATOM 0 HE1 PHE A 15 35.596 -24.111 -13.679 1.00 53.44 H new ATOM 0 HE2 PHE A 15 34.009 -21.522 -16.672 1.00 65.34 H new ATOM 0 HZ PHE A 15 35.510 -23.365 -16.026 1.00 12.21 H new ATOM 220 N GLY A 16 32.103 -24.012 -11.160 1.00 55.22 N ATOM 221 CA GLY A 16 32.569 -25.000 -10.205 1.00 73.12 C ATOM 222 C GLY A 16 31.790 -26.298 -10.288 1.00 22.14 C ATOM 223 O GLY A 16 31.716 -26.921 -11.347 1.00 44.11 O ATOM 0 H GLY A 16 32.070 -24.333 -12.128 1.00 55.22 H new ATOM 0 HA2 GLY A 16 33.625 -25.202 -10.382 1.00 73.12 H new ATOM 0 HA3 GLY A 16 32.486 -24.594 -9.197 1.00 73.12 H new ATOM 227 N LYS A 17 31.208 -26.709 -9.166 1.00 64.41 N ATOM 228 CA LYS A 17 30.431 -27.942 -9.114 1.00 65.21 C ATOM 229 C LYS A 17 28.960 -27.671 -9.409 1.00 52.34 C ATOM 230 O LYS A 17 28.075 -28.157 -8.705 1.00 0.23 O ATOM 231 CB LYS A 17 30.574 -28.601 -7.740 1.00 72.44 C ATOM 232 CG LYS A 17 30.048 -30.025 -7.692 1.00 35.44 C ATOM 233 CD LYS A 17 31.137 -31.034 -8.013 1.00 25.10 C ATOM 234 CE LYS A 17 30.602 -32.458 -7.995 1.00 4.34 C ATOM 235 NZ LYS A 17 31.310 -33.329 -8.973 1.00 23.10 N ATOM 0 H LYS A 17 31.260 -26.206 -8.280 1.00 64.41 H new ATOM 0 HA LYS A 17 30.817 -28.618 -9.877 1.00 65.21 H new ATOM 0 HB2 LYS A 17 31.626 -28.601 -7.454 1.00 72.44 H new ATOM 0 HB3 LYS A 17 30.043 -28.001 -7.001 1.00 72.44 H new ATOM 0 HG2 LYS A 17 29.641 -30.230 -6.702 1.00 35.44 H new ATOM 0 HG3 LYS A 17 29.228 -30.135 -8.402 1.00 35.44 H new ATOM 0 HD2 LYS A 17 31.559 -30.815 -8.994 1.00 25.10 H new ATOM 0 HD3 LYS A 17 31.947 -30.939 -7.289 1.00 25.10 H new ATOM 0 HE2 LYS A 17 30.710 -32.874 -6.993 1.00 4.34 H new ATOM 0 HE3 LYS A 17 29.536 -32.448 -8.223 1.00 4.34 H new ATOM 0 HZ1 LYS A 17 30.916 -34.291 -8.930 1.00 23.10 H new ATOM 0 HZ2 LYS A 17 31.186 -32.947 -9.932 1.00 23.10 H new ATOM 0 HZ3 LYS A 17 32.323 -33.359 -8.741 1.00 23.10 H new ATOM 249 N VAL A 18 28.705 -26.893 -10.456 1.00 53.44 N ATOM 250 CA VAL A 18 27.340 -26.559 -10.846 1.00 50.14 C ATOM 251 C VAL A 18 26.982 -27.190 -12.187 1.00 73.01 C ATOM 252 O VAL A 18 25.810 -27.429 -12.478 1.00 11.51 O ATOM 253 CB VAL A 18 27.140 -25.035 -10.939 1.00 54.52 C ATOM 254 CG1 VAL A 18 27.075 -24.419 -9.550 1.00 12.22 C ATOM 255 CG2 VAL A 18 28.252 -24.400 -11.761 1.00 74.40 C ATOM 0 H VAL A 18 29.426 -26.482 -11.049 1.00 53.44 H new ATOM 0 HA VAL A 18 26.683 -26.958 -10.073 1.00 50.14 H new ATOM 0 HB VAL A 18 26.192 -24.841 -11.441 1.00 54.52 H new ATOM 0 HG11 VAL A 18 26.933 -23.342 -9.636 1.00 12.22 H new ATOM 0 HG12 VAL A 18 26.240 -24.852 -8.999 1.00 12.22 H new ATOM 0 HG13 VAL A 18 28.005 -24.621 -9.018 1.00 12.22 H new ATOM 0 HG21 VAL A 18 28.094 -23.323 -11.816 1.00 74.40 H new ATOM 0 HG22 VAL A 18 29.214 -24.602 -11.290 1.00 74.40 H new ATOM 0 HG23 VAL A 18 28.246 -24.819 -12.767 1.00 74.40 H new ATOM 265 N GLN A 19 27.999 -27.458 -12.999 1.00 71.43 N ATOM 266 CA GLN A 19 27.791 -28.062 -14.310 1.00 75.11 C ATOM 267 C GLN A 19 27.851 -29.584 -14.224 1.00 51.44 C ATOM 268 O GLN A 19 28.515 -30.235 -15.029 1.00 43.13 O ATOM 269 CB GLN A 19 28.838 -27.553 -15.302 1.00 23.43 C ATOM 270 CG GLN A 19 30.265 -27.906 -14.913 1.00 41.15 C ATOM 271 CD GLN A 19 30.936 -26.815 -14.102 1.00 53.22 C ATOM 272 OE1 GLN A 19 30.269 -25.951 -13.532 1.00 1.15 O ATOM 273 NE2 GLN A 19 32.262 -26.848 -14.046 1.00 71.45 N ATOM 0 H GLN A 19 28.975 -27.267 -12.773 1.00 71.43 H new ATOM 0 HA GLN A 19 26.800 -27.775 -14.661 1.00 75.11 H new ATOM 0 HB2 GLN A 19 28.625 -27.968 -16.287 1.00 23.43 H new ATOM 0 HB3 GLN A 19 28.750 -26.470 -15.387 1.00 23.43 H new ATOM 0 HG2 GLN A 19 30.262 -28.832 -14.337 1.00 41.15 H new ATOM 0 HG3 GLN A 19 30.848 -28.093 -15.815 1.00 41.15 H new ATOM 0 HE21 GLN A 19 32.775 -27.582 -14.534 1.00 71.45 H new ATOM 0 HE22 GLN A 19 32.768 -26.139 -13.515 1.00 71.45 H new ATOM 282 N GLY A 20 27.152 -30.145 -13.242 1.00 1.50 N ATOM 283 CA GLY A 20 27.140 -31.585 -13.069 1.00 22.31 C ATOM 284 C GLY A 20 26.298 -32.020 -11.886 1.00 22.31 C ATOM 285 O GLY A 20 26.606 -33.014 -11.227 1.00 51.14 O ATOM 0 H GLY A 20 26.594 -29.627 -12.563 1.00 1.50 H new ATOM 0 HA2 GLY A 20 26.757 -32.054 -13.976 1.00 22.31 H new ATOM 0 HA3 GLY A 20 28.162 -31.940 -12.934 1.00 22.31 H new ATOM 289 N VAL A 21 25.233 -31.274 -11.613 1.00 54.35 N ATOM 290 CA VAL A 21 24.344 -31.587 -10.501 1.00 73.21 C ATOM 291 C VAL A 21 22.915 -31.148 -10.799 1.00 54.21 C ATOM 292 O VAL A 21 22.626 -30.626 -11.876 1.00 73.43 O ATOM 293 CB VAL A 21 24.815 -30.914 -9.199 1.00 3.42 C ATOM 294 CG1 VAL A 21 26.041 -31.623 -8.644 1.00 43.22 C ATOM 295 CG2 VAL A 21 25.104 -29.439 -9.436 1.00 61.14 C ATOM 0 H VAL A 21 24.965 -30.448 -12.147 1.00 54.35 H new ATOM 0 HA VAL A 21 24.369 -32.669 -10.371 1.00 73.21 H new ATOM 0 HB VAL A 21 24.016 -30.991 -8.462 1.00 3.42 H new ATOM 0 HG11 VAL A 21 26.359 -31.133 -7.724 1.00 43.22 H new ATOM 0 HG12 VAL A 21 25.796 -32.664 -8.435 1.00 43.22 H new ATOM 0 HG13 VAL A 21 26.848 -31.581 -9.375 1.00 43.22 H new ATOM 0 HG21 VAL A 21 25.436 -28.979 -8.505 1.00 61.14 H new ATOM 0 HG22 VAL A 21 25.885 -29.338 -10.189 1.00 61.14 H new ATOM 0 HG23 VAL A 21 24.198 -28.942 -9.784 1.00 61.14 H new ATOM 305 N PHE A 22 22.023 -31.361 -9.837 1.00 60.40 N ATOM 306 CA PHE A 22 20.622 -30.988 -9.996 1.00 44.20 C ATOM 307 C PHE A 22 20.275 -29.793 -9.113 1.00 53.11 C ATOM 308 O PHE A 22 19.133 -29.639 -8.678 1.00 62.32 O ATOM 309 CB PHE A 22 19.715 -32.171 -9.653 1.00 11.00 C ATOM 310 CG PHE A 22 19.860 -32.647 -8.236 1.00 10.43 C ATOM 311 CD1 PHE A 22 20.839 -33.566 -7.896 1.00 60.34 C ATOM 312 CD2 PHE A 22 19.017 -32.174 -7.243 1.00 32.22 C ATOM 313 CE1 PHE A 22 20.976 -34.006 -6.593 1.00 54.20 C ATOM 314 CE2 PHE A 22 19.149 -32.610 -5.938 1.00 12.32 C ATOM 315 CZ PHE A 22 20.129 -33.528 -5.613 1.00 15.53 C ATOM 0 H PHE A 22 22.246 -31.790 -8.939 1.00 60.40 H new ATOM 0 HA PHE A 22 20.462 -30.707 -11.037 1.00 44.20 H new ATOM 0 HB2 PHE A 22 18.678 -31.886 -9.827 1.00 11.00 H new ATOM 0 HB3 PHE A 22 19.937 -32.996 -10.330 1.00 11.00 H new ATOM 0 HD1 PHE A 22 21.504 -33.944 -8.659 1.00 60.34 H new ATOM 0 HD2 PHE A 22 18.249 -31.457 -7.491 1.00 32.22 H new ATOM 0 HE1 PHE A 22 21.744 -34.722 -6.342 1.00 54.20 H new ATOM 0 HE2 PHE A 22 18.486 -32.233 -5.173 1.00 12.32 H new ATOM 0 HZ PHE A 22 20.232 -33.871 -4.594 1.00 15.53 H new ATOM 325 N PHE A 23 21.268 -28.949 -8.852 1.00 34.22 N ATOM 326 CA PHE A 23 21.068 -27.768 -8.020 1.00 24.44 C ATOM 327 C PHE A 23 19.899 -26.933 -8.532 1.00 35.24 C ATOM 328 O PHE A 23 19.231 -26.243 -7.761 1.00 75.23 O ATOM 329 CB PHE A 23 22.341 -26.919 -7.989 1.00 30.41 C ATOM 330 CG PHE A 23 22.599 -26.179 -9.270 1.00 72.22 C ATOM 331 CD1 PHE A 23 23.042 -26.852 -10.397 1.00 75.24 C ATOM 332 CD2 PHE A 23 22.399 -24.810 -9.347 1.00 60.31 C ATOM 333 CE1 PHE A 23 23.279 -26.174 -11.578 1.00 64.22 C ATOM 334 CE2 PHE A 23 22.635 -24.127 -10.525 1.00 72.11 C ATOM 335 CZ PHE A 23 23.077 -24.810 -11.642 1.00 13.43 C ATOM 0 H PHE A 23 22.219 -29.061 -9.204 1.00 34.22 H new ATOM 0 HA PHE A 23 20.837 -28.102 -7.008 1.00 24.44 H new ATOM 0 HB2 PHE A 23 22.270 -26.201 -7.172 1.00 30.41 H new ATOM 0 HB3 PHE A 23 23.193 -27.564 -7.773 1.00 30.41 H new ATOM 0 HD1 PHE A 23 23.204 -27.919 -10.352 1.00 75.24 H new ATOM 0 HD2 PHE A 23 22.055 -24.271 -8.477 1.00 60.31 H new ATOM 0 HE1 PHE A 23 23.622 -26.711 -12.450 1.00 64.22 H new ATOM 0 HE2 PHE A 23 22.474 -23.060 -10.573 1.00 72.11 H new ATOM 0 HZ PHE A 23 23.264 -24.278 -12.563 1.00 13.43 H new ATOM 345 N ARG A 24 19.658 -27.001 -9.837 1.00 15.22 N ATOM 346 CA ARG A 24 18.570 -26.250 -10.453 1.00 22.11 C ATOM 347 C ARG A 24 17.251 -26.512 -9.731 1.00 65.13 C ATOM 348 O ARG A 24 16.429 -25.610 -9.571 1.00 74.43 O ATOM 349 CB ARG A 24 18.438 -26.623 -11.931 1.00 10.33 C ATOM 350 CG ARG A 24 18.242 -28.111 -12.168 1.00 65.14 C ATOM 351 CD ARG A 24 16.775 -28.455 -12.367 1.00 33.50 C ATOM 352 NE ARG A 24 16.591 -29.533 -13.335 1.00 65.33 N ATOM 353 CZ ARG A 24 15.405 -30.029 -13.667 1.00 73.22 C ATOM 354 NH1 ARG A 24 14.302 -29.546 -13.112 1.00 31.11 N ATOM 355 NH2 ARG A 24 15.319 -31.010 -14.557 1.00 24.02 N ATOM 0 H ARG A 24 20.201 -27.568 -10.488 1.00 15.22 H new ATOM 0 HA ARG A 24 18.803 -25.188 -10.372 1.00 22.11 H new ATOM 0 HB2 ARG A 24 17.595 -26.081 -12.360 1.00 10.33 H new ATOM 0 HB3 ARG A 24 19.332 -26.294 -12.461 1.00 10.33 H new ATOM 0 HG2 ARG A 24 18.811 -28.419 -13.045 1.00 65.14 H new ATOM 0 HG3 ARG A 24 18.636 -28.671 -11.320 1.00 65.14 H new ATOM 0 HD2 ARG A 24 16.339 -28.747 -11.412 1.00 33.50 H new ATOM 0 HD3 ARG A 24 16.238 -27.569 -12.705 1.00 33.50 H new ATOM 0 HE ARG A 24 17.420 -29.927 -13.781 1.00 65.33 H new ATOM 0 HH11 ARG A 24 14.363 -28.792 -12.428 1.00 31.11 H new ATOM 0 HH12 ARG A 24 13.392 -29.929 -13.369 1.00 31.11 H new ATOM 0 HH21 ARG A 24 16.165 -31.384 -14.987 1.00 24.02 H new ATOM 0 HH22 ARG A 24 14.407 -31.390 -14.811 1.00 24.02 H new ATOM 369 N LYS A 25 17.057 -27.753 -9.298 1.00 13.13 N ATOM 370 CA LYS A 25 15.839 -28.135 -8.592 1.00 62.25 C ATOM 371 C LYS A 25 15.611 -27.242 -7.377 1.00 23.30 C ATOM 372 O LYS A 25 14.473 -27.010 -6.969 1.00 74.23 O ATOM 373 CB LYS A 25 15.917 -29.600 -8.155 1.00 50.32 C ATOM 374 CG LYS A 25 14.594 -30.158 -7.660 1.00 51.22 C ATOM 375 CD LYS A 25 13.518 -30.075 -8.730 1.00 43.32 C ATOM 376 CE LYS A 25 12.228 -30.741 -8.277 1.00 3.12 C ATOM 377 NZ LYS A 25 11.112 -30.495 -9.231 1.00 70.32 N ATOM 0 H LYS A 25 17.727 -28.512 -9.423 1.00 13.13 H new ATOM 0 HA LYS A 25 14.999 -28.010 -9.275 1.00 62.25 H new ATOM 0 HB2 LYS A 25 16.265 -30.203 -8.994 1.00 50.32 H new ATOM 0 HB3 LYS A 25 16.661 -29.695 -7.364 1.00 50.32 H new ATOM 0 HG2 LYS A 25 14.727 -31.196 -7.356 1.00 51.22 H new ATOM 0 HG3 LYS A 25 14.273 -29.606 -6.777 1.00 51.22 H new ATOM 0 HD2 LYS A 25 13.324 -29.030 -8.972 1.00 43.32 H new ATOM 0 HD3 LYS A 25 13.874 -30.552 -9.643 1.00 43.32 H new ATOM 0 HE2 LYS A 25 12.389 -31.814 -8.176 1.00 3.12 H new ATOM 0 HE3 LYS A 25 11.952 -30.366 -7.291 1.00 3.12 H new ATOM 0 HZ1 LYS A 25 10.251 -30.965 -8.887 1.00 70.32 H new ATOM 0 HZ2 LYS A 25 10.941 -29.472 -9.308 1.00 70.32 H new ATOM 0 HZ3 LYS A 25 11.364 -30.875 -10.166 1.00 70.32 H new ATOM 391 N HIS A 26 16.701 -26.743 -6.803 1.00 0.43 N ATOM 392 CA HIS A 26 16.619 -25.873 -5.635 1.00 2.14 C ATOM 393 C HIS A 26 16.457 -24.415 -6.053 1.00 41.33 C ATOM 394 O HIS A 26 15.905 -23.602 -5.311 1.00 2.31 O ATOM 395 CB HIS A 26 17.868 -26.031 -4.767 1.00 10.44 C ATOM 396 CG HIS A 26 17.687 -26.982 -3.624 1.00 61.22 C ATOM 397 ND1 HIS A 26 17.474 -28.334 -3.797 1.00 12.50 N ATOM 398 CD2 HIS A 26 17.691 -26.771 -2.287 1.00 75.22 C ATOM 399 CE1 HIS A 26 17.352 -28.912 -2.616 1.00 20.33 C ATOM 400 NE2 HIS A 26 17.480 -27.986 -1.683 1.00 21.13 N ATOM 0 H HIS A 26 17.651 -26.926 -7.127 1.00 0.43 H new ATOM 0 HA HIS A 26 15.743 -26.166 -5.056 1.00 2.14 H new ATOM 0 HB2 HIS A 26 18.692 -26.378 -5.390 1.00 10.44 H new ATOM 0 HB3 HIS A 26 18.154 -25.055 -4.375 1.00 10.44 H new ATOM 0 HD2 HIS A 26 17.834 -25.824 -1.788 1.00 75.22 H new ATOM 0 HE1 HIS A 26 17.177 -29.964 -2.442 1.00 20.33 H new ATOM 0 HE2 HIS A 26 17.430 -28.147 -0.677 1.00 21.13 H new ATOM 408 N THR A 27 16.942 -24.089 -7.247 1.00 65.35 N ATOM 409 CA THR A 27 16.853 -22.729 -7.764 1.00 63.50 C ATOM 410 C THR A 27 15.408 -22.247 -7.796 1.00 13.04 C ATOM 411 O THR A 27 15.091 -21.175 -7.280 1.00 72.32 O ATOM 412 CB THR A 27 17.448 -22.627 -9.181 1.00 50.23 C ATOM 413 OG1 THR A 27 18.812 -23.062 -9.173 1.00 20.30 O ATOM 414 CG2 THR A 27 17.369 -21.198 -9.699 1.00 25.51 C ATOM 0 H THR A 27 17.401 -24.749 -7.875 1.00 65.35 H new ATOM 0 HA THR A 27 17.429 -22.096 -7.090 1.00 63.50 H new ATOM 0 HB THR A 27 16.867 -23.270 -9.842 1.00 50.23 H new ATOM 0 HG1 THR A 27 19.182 -22.995 -10.078 1.00 20.30 H new ATOM 0 HG21 THR A 27 17.795 -21.150 -10.701 1.00 25.51 H new ATOM 0 HG22 THR A 27 16.327 -20.880 -9.732 1.00 25.51 H new ATOM 0 HG23 THR A 27 17.928 -20.539 -9.035 1.00 25.51 H new ATOM 422 N GLN A 28 14.535 -23.045 -8.403 1.00 25.11 N ATOM 423 CA GLN A 28 13.123 -22.698 -8.501 1.00 13.12 C ATOM 424 C GLN A 28 12.540 -22.393 -7.125 1.00 5.53 C ATOM 425 O GLN A 28 11.742 -21.469 -6.969 1.00 5.23 O ATOM 426 CB GLN A 28 12.340 -23.837 -9.157 1.00 43.55 C ATOM 427 CG GLN A 28 10.833 -23.649 -9.104 1.00 13.20 C ATOM 428 CD GLN A 28 10.214 -24.250 -7.858 1.00 34.23 C ATOM 429 OE1 GLN A 28 10.580 -25.348 -7.436 1.00 53.23 O ATOM 430 NE2 GLN A 28 9.270 -23.533 -7.260 1.00 14.30 N ATOM 0 H GLN A 28 14.781 -23.936 -8.834 1.00 25.11 H new ATOM 0 HA GLN A 28 13.037 -21.804 -9.119 1.00 13.12 H new ATOM 0 HB2 GLN A 28 12.650 -23.927 -10.198 1.00 43.55 H new ATOM 0 HB3 GLN A 28 12.598 -24.775 -8.665 1.00 43.55 H new ATOM 0 HG2 GLN A 28 10.602 -22.585 -9.143 1.00 13.20 H new ATOM 0 HG3 GLN A 28 10.382 -24.105 -9.985 1.00 13.20 H new ATOM 0 HE21 GLN A 28 8.997 -22.628 -7.643 1.00 14.30 H new ATOM 0 HE22 GLN A 28 8.818 -23.887 -6.417 1.00 14.30 H new ATOM 439 N ALA A 29 12.945 -23.175 -6.130 1.00 30.14 N ATOM 440 CA ALA A 29 12.465 -22.987 -4.766 1.00 74.13 C ATOM 441 C ALA A 29 12.946 -21.659 -4.193 1.00 4.23 C ATOM 442 O ALA A 29 12.209 -20.975 -3.484 1.00 54.24 O ATOM 443 CB ALA A 29 12.917 -24.141 -3.883 1.00 43.35 C ATOM 0 H ALA A 29 13.604 -23.945 -6.243 1.00 30.14 H new ATOM 0 HA ALA A 29 11.375 -22.968 -4.790 1.00 74.13 H new ATOM 0 HB1 ALA A 29 12.551 -23.987 -2.868 1.00 43.35 H new ATOM 0 HB2 ALA A 29 12.518 -25.077 -4.275 1.00 43.35 H new ATOM 0 HB3 ALA A 29 14.006 -24.187 -3.873 1.00 43.35 H new ATOM 449 N GLU A 30 14.189 -21.301 -4.503 1.00 74.12 N ATOM 450 CA GLU A 30 14.768 -20.055 -4.016 1.00 41.23 C ATOM 451 C GLU A 30 13.898 -18.862 -4.404 1.00 22.32 C ATOM 452 O GLU A 30 13.911 -17.828 -3.737 1.00 72.34 O ATOM 453 CB GLU A 30 16.181 -19.872 -4.574 1.00 3.44 C ATOM 454 CG GLU A 30 17.115 -19.130 -3.632 1.00 44.13 C ATOM 455 CD GLU A 30 17.218 -19.791 -2.271 1.00 52.14 C ATOM 456 OE1 GLU A 30 16.405 -19.455 -1.385 1.00 74.14 O ATOM 457 OE2 GLU A 30 18.112 -20.645 -2.093 1.00 53.31 O ATOM 0 H GLU A 30 14.813 -21.856 -5.089 1.00 74.12 H new ATOM 0 HA GLU A 30 14.818 -20.108 -2.928 1.00 41.23 H new ATOM 0 HB2 GLU A 30 16.605 -20.851 -4.796 1.00 3.44 H new ATOM 0 HB3 GLU A 30 16.123 -19.329 -5.517 1.00 3.44 H new ATOM 0 HG2 GLU A 30 18.107 -19.073 -4.080 1.00 44.13 H new ATOM 0 HG3 GLU A 30 16.762 -18.106 -3.509 1.00 44.13 H new ATOM 464 N GLY A 31 13.143 -19.015 -5.488 1.00 23.23 N ATOM 465 CA GLY A 31 12.278 -17.944 -5.946 1.00 44.04 C ATOM 466 C GLY A 31 11.080 -17.739 -5.041 1.00 53.15 C ATOM 467 O GLY A 31 10.446 -16.684 -5.067 1.00 52.31 O ATOM 0 H GLY A 31 13.115 -19.861 -6.057 1.00 23.23 H new ATOM 0 HA2 GLY A 31 12.850 -17.018 -6.002 1.00 44.04 H new ATOM 0 HA3 GLY A 31 11.933 -18.167 -6.956 1.00 44.04 H new ATOM 471 N LYS A 32 10.766 -18.751 -4.240 1.00 12.24 N ATOM 472 CA LYS A 32 9.635 -18.678 -3.322 1.00 72.33 C ATOM 473 C LYS A 32 9.978 -17.830 -2.102 1.00 33.33 C ATOM 474 O LYS A 32 9.096 -17.246 -1.471 1.00 23.53 O ATOM 475 CB LYS A 32 9.219 -20.083 -2.880 1.00 65.31 C ATOM 476 CG LYS A 32 7.924 -20.114 -2.088 1.00 54.43 C ATOM 477 CD LYS A 32 7.827 -21.360 -1.224 1.00 3.51 C ATOM 478 CE LYS A 32 6.651 -21.282 -0.263 1.00 11.41 C ATOM 479 NZ LYS A 32 6.280 -22.622 0.269 1.00 35.00 N ATOM 0 H LYS A 32 11.279 -19.632 -4.208 1.00 12.24 H new ATOM 0 HA LYS A 32 8.803 -18.208 -3.847 1.00 72.33 H new ATOM 0 HB2 LYS A 32 9.111 -20.715 -3.762 1.00 65.31 H new ATOM 0 HB3 LYS A 32 10.016 -20.515 -2.274 1.00 65.31 H new ATOM 0 HG2 LYS A 32 7.861 -19.227 -1.457 1.00 54.43 H new ATOM 0 HG3 LYS A 32 7.077 -20.079 -2.773 1.00 54.43 H new ATOM 0 HD2 LYS A 32 7.720 -22.238 -1.861 1.00 3.51 H new ATOM 0 HD3 LYS A 32 8.751 -21.486 -0.660 1.00 3.51 H new ATOM 0 HE2 LYS A 32 6.902 -20.619 0.565 1.00 11.41 H new ATOM 0 HE3 LYS A 32 5.793 -20.844 -0.773 1.00 11.41 H new ATOM 0 HZ1 LYS A 32 5.475 -22.526 0.920 1.00 35.00 H new ATOM 0 HZ2 LYS A 32 6.016 -23.247 -0.519 1.00 35.00 H new ATOM 0 HZ3 LYS A 32 7.090 -23.030 0.778 1.00 35.00 H new ATOM 493 N LYS A 33 11.264 -17.765 -1.774 1.00 72.45 N ATOM 494 CA LYS A 33 11.725 -16.987 -0.631 1.00 54.42 C ATOM 495 C LYS A 33 11.191 -15.559 -0.695 1.00 30.03 C ATOM 496 O LYS A 33 10.499 -15.103 0.217 1.00 51.15 O ATOM 497 CB LYS A 33 13.254 -16.969 -0.583 1.00 41.00 C ATOM 498 CG LYS A 33 13.850 -18.097 0.241 1.00 72.42 C ATOM 499 CD LYS A 33 13.419 -19.457 -0.283 1.00 22.43 C ATOM 500 CE LYS A 33 14.227 -20.580 0.351 1.00 14.23 C ATOM 501 NZ LYS A 33 13.654 -21.005 1.658 1.00 35.42 N ATOM 0 H LYS A 33 12.006 -18.243 -2.285 1.00 72.45 H new ATOM 0 HA LYS A 33 11.345 -17.459 0.275 1.00 54.42 H new ATOM 0 HB2 LYS A 33 13.642 -17.029 -1.600 1.00 41.00 H new ATOM 0 HB3 LYS A 33 13.585 -16.016 -0.171 1.00 41.00 H new ATOM 0 HG2 LYS A 33 14.938 -18.027 0.223 1.00 72.42 H new ATOM 0 HG3 LYS A 33 13.541 -17.992 1.281 1.00 72.42 H new ATOM 0 HD2 LYS A 33 12.359 -19.608 -0.077 1.00 22.43 H new ATOM 0 HD3 LYS A 33 13.541 -19.486 -1.366 1.00 22.43 H new ATOM 0 HE2 LYS A 33 14.258 -21.433 -0.327 1.00 14.23 H new ATOM 0 HE3 LYS A 33 15.256 -20.251 0.495 1.00 14.23 H new ATOM 0 HZ1 LYS A 33 14.232 -21.771 2.058 1.00 35.42 H new ATOM 0 HZ2 LYS A 33 13.648 -20.198 2.313 1.00 35.42 H new ATOM 0 HZ3 LYS A 33 12.681 -21.343 1.517 1.00 35.42 H new ATOM 515 N LEU A 34 11.515 -14.859 -1.776 1.00 4.31 N ATOM 516 CA LEU A 34 11.067 -13.483 -1.959 1.00 41.41 C ATOM 517 C LEU A 34 9.819 -13.429 -2.834 1.00 14.53 C ATOM 518 O LEU A 34 8.931 -12.605 -2.616 1.00 41.22 O ATOM 519 CB LEU A 34 12.180 -12.642 -2.587 1.00 63.10 C ATOM 520 CG LEU A 34 13.433 -12.442 -1.734 1.00 22.35 C ATOM 521 CD1 LEU A 34 14.406 -11.500 -2.426 1.00 12.04 C ATOM 522 CD2 LEU A 34 13.061 -11.911 -0.357 1.00 25.33 C ATOM 0 H LEU A 34 12.086 -15.221 -2.539 1.00 4.31 H new ATOM 0 HA LEU A 34 10.820 -13.074 -0.979 1.00 41.41 H new ATOM 0 HB2 LEU A 34 12.475 -13.110 -3.526 1.00 63.10 H new ATOM 0 HB3 LEU A 34 11.772 -11.662 -2.833 1.00 63.10 H new ATOM 0 HG LEU A 34 13.922 -13.408 -1.609 1.00 22.35 H new ATOM 0 HD11 LEU A 34 15.291 -11.370 -1.804 1.00 12.04 H new ATOM 0 HD12 LEU A 34 14.697 -11.921 -3.388 1.00 12.04 H new ATOM 0 HD13 LEU A 34 13.927 -10.533 -2.583 1.00 12.04 H new ATOM 0 HD21 LEU A 34 13.965 -11.775 0.237 1.00 25.33 H new ATOM 0 HD22 LEU A 34 12.548 -10.955 -0.462 1.00 25.33 H new ATOM 0 HD23 LEU A 34 12.403 -12.623 0.142 1.00 25.33 H new ATOM 534 N GLY A 35 9.756 -14.314 -3.823 1.00 64.53 N ATOM 535 CA GLY A 35 8.612 -14.352 -4.714 1.00 74.14 C ATOM 536 C GLY A 35 8.910 -13.738 -6.068 1.00 22.41 C ATOM 537 O GLY A 35 8.119 -12.951 -6.589 1.00 5.41 O ATOM 0 H GLY A 35 10.478 -15.006 -4.023 1.00 64.53 H new ATOM 0 HA2 GLY A 35 8.295 -15.386 -4.849 1.00 74.14 H new ATOM 0 HA3 GLY A 35 7.779 -13.821 -4.253 1.00 74.14 H new ATOM 541 N LEU A 36 10.055 -14.098 -6.639 1.00 55.40 N ATOM 542 CA LEU A 36 10.457 -13.576 -7.940 1.00 41.44 C ATOM 543 C LEU A 36 10.308 -14.639 -9.024 1.00 34.04 C ATOM 544 O LEU A 36 9.803 -15.733 -8.769 1.00 51.33 O ATOM 545 CB LEU A 36 11.905 -13.084 -7.889 1.00 14.40 C ATOM 546 CG LEU A 36 12.202 -11.977 -6.877 1.00 12.14 C ATOM 547 CD1 LEU A 36 13.686 -11.647 -6.867 1.00 24.34 C ATOM 548 CD2 LEU A 36 11.380 -10.735 -7.188 1.00 12.41 C ATOM 0 H LEU A 36 10.720 -14.749 -6.221 1.00 55.40 H new ATOM 0 HA LEU A 36 9.803 -12.739 -8.185 1.00 41.44 H new ATOM 0 HB2 LEU A 36 12.549 -13.935 -7.666 1.00 14.40 H new ATOM 0 HB3 LEU A 36 12.181 -12.726 -8.881 1.00 14.40 H new ATOM 0 HG LEU A 36 11.923 -12.334 -5.885 1.00 12.14 H new ATOM 0 HD11 LEU A 36 13.878 -10.857 -6.141 1.00 24.34 H new ATOM 0 HD12 LEU A 36 14.255 -12.536 -6.595 1.00 24.34 H new ATOM 0 HD13 LEU A 36 13.991 -11.311 -7.858 1.00 24.34 H new ATOM 0 HD21 LEU A 36 11.604 -9.958 -6.457 1.00 12.41 H new ATOM 0 HD22 LEU A 36 11.627 -10.376 -8.187 1.00 12.41 H new ATOM 0 HD23 LEU A 36 10.319 -10.980 -7.142 1.00 12.41 H new ATOM 560 N VAL A 37 10.752 -14.311 -10.233 1.00 33.21 N ATOM 561 CA VAL A 37 10.671 -15.239 -11.355 1.00 34.14 C ATOM 562 C VAL A 37 12.058 -15.583 -11.885 1.00 20.13 C ATOM 563 O VAL A 37 13.070 -15.182 -11.312 1.00 21.35 O ATOM 564 CB VAL A 37 9.824 -14.659 -12.503 1.00 14.02 C ATOM 565 CG1 VAL A 37 8.435 -14.285 -12.006 1.00 63.13 C ATOM 566 CG2 VAL A 37 10.519 -13.456 -13.122 1.00 61.22 C ATOM 0 H VAL A 37 11.172 -13.410 -10.461 1.00 33.21 H new ATOM 0 HA VAL A 37 10.193 -16.145 -10.982 1.00 34.14 H new ATOM 0 HB VAL A 37 9.715 -15.423 -13.273 1.00 14.02 H new ATOM 0 HG11 VAL A 37 7.851 -13.877 -12.831 1.00 63.13 H new ATOM 0 HG12 VAL A 37 7.938 -15.172 -11.613 1.00 63.13 H new ATOM 0 HG13 VAL A 37 8.520 -13.538 -11.217 1.00 63.13 H new ATOM 0 HG21 VAL A 37 9.907 -13.059 -13.932 1.00 61.22 H new ATOM 0 HG22 VAL A 37 10.660 -12.687 -12.363 1.00 61.22 H new ATOM 0 HG23 VAL A 37 11.489 -13.759 -13.516 1.00 61.22 H new ATOM 576 N GLY A 38 12.097 -16.329 -12.985 1.00 3.12 N ATOM 577 CA GLY A 38 13.366 -16.714 -13.575 1.00 32.41 C ATOM 578 C GLY A 38 13.367 -18.150 -14.060 1.00 60.43 C ATOM 579 O GLY A 38 12.349 -18.839 -13.985 1.00 2.30 O ATOM 0 H GLY A 38 11.273 -16.673 -13.478 1.00 3.12 H new ATOM 0 HA2 GLY A 38 13.591 -16.051 -14.411 1.00 32.41 H new ATOM 0 HA3 GLY A 38 14.160 -16.581 -12.840 1.00 32.41 H new ATOM 583 N TRP A 39 14.511 -18.603 -14.561 1.00 12.30 N ATOM 584 CA TRP A 39 14.639 -19.966 -15.063 1.00 21.34 C ATOM 585 C TRP A 39 16.069 -20.472 -14.906 1.00 1.42 C ATOM 586 O TRP A 39 16.931 -19.770 -14.376 1.00 21.52 O ATOM 587 CB TRP A 39 14.220 -20.033 -16.532 1.00 51.51 C ATOM 588 CG TRP A 39 15.169 -19.328 -17.453 1.00 44.20 C ATOM 589 CD1 TRP A 39 16.232 -19.878 -18.112 1.00 54.44 C ATOM 590 CD2 TRP A 39 15.143 -17.943 -17.815 1.00 5.24 C ATOM 591 NE1 TRP A 39 16.868 -18.918 -18.862 1.00 54.40 N ATOM 592 CE2 TRP A 39 16.219 -17.722 -18.697 1.00 70.42 C ATOM 593 CE3 TRP A 39 14.315 -16.868 -17.480 1.00 44.24 C ATOM 594 CZ2 TRP A 39 16.486 -16.471 -19.247 1.00 21.32 C ATOM 595 CZ3 TRP A 39 14.582 -15.627 -18.026 1.00 41.25 C ATOM 596 CH2 TRP A 39 15.659 -15.437 -18.902 1.00 44.22 C ATOM 0 H TRP A 39 15.363 -18.046 -14.630 1.00 12.30 H new ATOM 0 HA TRP A 39 13.980 -20.606 -14.476 1.00 21.34 H new ATOM 0 HB2 TRP A 39 14.142 -21.078 -16.833 1.00 51.51 H new ATOM 0 HB3 TRP A 39 13.228 -19.595 -16.640 1.00 51.51 H new ATOM 0 HD1 TRP A 39 16.529 -20.915 -18.052 1.00 54.44 H new ATOM 0 HE1 TRP A 39 17.690 -19.071 -19.447 1.00 54.40 H new ATOM 0 HE3 TRP A 39 13.482 -17.005 -16.807 1.00 44.24 H new ATOM 0 HZ2 TRP A 39 17.316 -16.322 -19.922 1.00 21.32 H new ATOM 0 HZ3 TRP A 39 13.950 -14.789 -17.773 1.00 41.25 H new ATOM 0 HH2 TRP A 39 15.840 -14.455 -19.313 1.00 44.22 H new ATOM 607 N VAL A 40 16.315 -21.693 -15.370 1.00 50.31 N ATOM 608 CA VAL A 40 17.642 -22.291 -15.282 1.00 74.13 C ATOM 609 C VAL A 40 18.016 -22.990 -16.584 1.00 62.52 C ATOM 610 O VAL A 40 17.234 -23.770 -17.128 1.00 43.42 O ATOM 611 CB VAL A 40 17.725 -23.305 -14.126 1.00 13.34 C ATOM 612 CG1 VAL A 40 19.158 -23.774 -13.929 1.00 20.33 C ATOM 613 CG2 VAL A 40 17.173 -22.697 -12.845 1.00 4.14 C ATOM 0 H VAL A 40 15.613 -22.287 -15.811 1.00 50.31 H new ATOM 0 HA VAL A 40 18.344 -21.479 -15.094 1.00 74.13 H new ATOM 0 HB VAL A 40 17.117 -24.173 -14.381 1.00 13.34 H new ATOM 0 HG11 VAL A 40 19.197 -24.490 -13.108 1.00 20.33 H new ATOM 0 HG12 VAL A 40 19.514 -24.250 -14.843 1.00 20.33 H new ATOM 0 HG13 VAL A 40 19.792 -22.919 -13.695 1.00 20.33 H new ATOM 0 HG21 VAL A 40 17.239 -23.427 -12.038 1.00 4.14 H new ATOM 0 HG22 VAL A 40 17.753 -21.812 -12.583 1.00 4.14 H new ATOM 0 HG23 VAL A 40 16.131 -22.416 -12.995 1.00 4.14 H new ATOM 623 N GLN A 41 19.217 -22.707 -17.078 1.00 3.34 N ATOM 624 CA GLN A 41 19.695 -23.309 -18.316 1.00 45.14 C ATOM 625 C GLN A 41 21.164 -23.705 -18.198 1.00 55.21 C ATOM 626 O GLN A 41 22.037 -22.850 -18.057 1.00 62.32 O ATOM 627 CB GLN A 41 19.509 -22.339 -19.485 1.00 20.33 C ATOM 628 CG GLN A 41 18.162 -22.471 -20.176 1.00 35.41 C ATOM 629 CD GLN A 41 17.754 -21.207 -20.906 1.00 14.22 C ATOM 630 OE1 GLN A 41 18.513 -20.240 -20.968 1.00 1.42 O ATOM 631 NE2 GLN A 41 16.549 -21.208 -21.464 1.00 14.43 N ATOM 0 H GLN A 41 19.877 -22.064 -16.639 1.00 3.34 H new ATOM 0 HA GLN A 41 19.109 -24.209 -18.502 1.00 45.14 H new ATOM 0 HB2 GLN A 41 19.623 -21.318 -19.121 1.00 20.33 H new ATOM 0 HB3 GLN A 41 20.301 -22.507 -20.215 1.00 20.33 H new ATOM 0 HG2 GLN A 41 18.201 -23.299 -20.884 1.00 35.41 H new ATOM 0 HG3 GLN A 41 17.401 -22.720 -19.436 1.00 35.41 H new ATOM 0 HE21 GLN A 41 15.952 -22.032 -21.388 1.00 14.43 H new ATOM 0 HE22 GLN A 41 16.220 -20.385 -21.969 1.00 14.43 H new ATOM 640 N ASN A 42 21.427 -25.006 -18.256 1.00 31.21 N ATOM 641 CA ASN A 42 22.790 -25.516 -18.154 1.00 53.51 C ATOM 642 C ASN A 42 23.373 -25.788 -19.537 1.00 43.12 C ATOM 643 O ASN A 42 22.679 -26.268 -20.433 1.00 73.45 O ATOM 644 CB ASN A 42 22.817 -26.795 -17.316 1.00 31.12 C ATOM 645 CG ASN A 42 21.747 -27.784 -17.736 1.00 32.33 C ATOM 646 OD1 ASN A 42 20.576 -27.636 -17.384 1.00 3.00 O ATOM 647 ND2 ASN A 42 22.145 -28.801 -18.492 1.00 11.23 N ATOM 0 H ASN A 42 20.715 -25.727 -18.373 1.00 31.21 H new ATOM 0 HA ASN A 42 23.400 -24.757 -17.665 1.00 53.51 H new ATOM 0 HB2 ASN A 42 23.797 -27.264 -17.406 1.00 31.12 H new ATOM 0 HB3 ASN A 42 22.680 -26.540 -16.265 1.00 31.12 H new ATOM 0 HD21 ASN A 42 21.470 -29.499 -18.805 1.00 11.23 H new ATOM 0 HD22 ASN A 42 23.126 -28.884 -18.760 1.00 11.23 H new ATOM 654 N THR A 43 24.655 -25.478 -19.704 1.00 64.12 N ATOM 655 CA THR A 43 25.333 -25.688 -20.977 1.00 61.51 C ATOM 656 C THR A 43 25.716 -27.153 -21.161 1.00 0.52 C ATOM 657 O THR A 43 25.687 -27.935 -20.211 1.00 25.30 O ATOM 658 CB THR A 43 26.600 -24.820 -21.089 1.00 64.22 C ATOM 659 OG1 THR A 43 27.563 -25.230 -20.111 1.00 52.50 O ATOM 660 CG2 THR A 43 26.267 -23.349 -20.895 1.00 41.42 C ATOM 0 H THR A 43 25.245 -25.080 -18.973 1.00 64.12 H new ATOM 0 HA THR A 43 24.632 -25.397 -21.760 1.00 61.51 H new ATOM 0 HB THR A 43 27.018 -24.953 -22.087 1.00 64.22 H new ATOM 0 HG1 THR A 43 27.172 -25.154 -19.215 1.00 52.50 H new ATOM 0 HG21 THR A 43 27.178 -22.756 -20.978 1.00 41.42 H new ATOM 0 HG22 THR A 43 25.557 -23.033 -21.659 1.00 41.42 H new ATOM 0 HG23 THR A 43 25.828 -23.202 -19.908 1.00 41.42 H new ATOM 668 N ASP A 44 26.075 -27.516 -22.387 1.00 53.11 N ATOM 669 CA ASP A 44 26.466 -28.887 -22.695 1.00 15.32 C ATOM 670 C ASP A 44 27.694 -29.295 -21.888 1.00 62.54 C ATOM 671 O ASP A 44 27.853 -30.462 -21.528 1.00 73.14 O ATOM 672 CB ASP A 44 26.749 -29.035 -24.190 1.00 61.34 C ATOM 673 CG ASP A 44 25.557 -28.656 -25.046 1.00 74.03 C ATOM 674 OD1 ASP A 44 24.430 -28.614 -24.509 1.00 24.22 O ATOM 675 OD2 ASP A 44 25.749 -28.402 -26.254 1.00 5.31 O ATOM 0 H ASP A 44 26.103 -26.880 -23.184 1.00 53.11 H new ATOM 0 HA ASP A 44 25.640 -29.545 -22.423 1.00 15.32 H new ATOM 0 HB2 ASP A 44 27.600 -28.409 -24.459 1.00 61.34 H new ATOM 0 HB3 ASP A 44 27.032 -30.066 -24.403 1.00 61.34 H new ATOM 680 N ARG A 45 28.561 -28.328 -21.609 1.00 44.24 N ATOM 681 CA ARG A 45 29.777 -28.588 -20.848 1.00 1.53 C ATOM 682 C ARG A 45 30.562 -27.299 -20.620 1.00 14.22 C ATOM 683 O ARG A 45 31.330 -26.868 -21.478 1.00 45.01 O ATOM 684 CB ARG A 45 30.653 -29.608 -21.577 1.00 31.12 C ATOM 685 CG ARG A 45 32.033 -29.776 -20.962 1.00 52.01 C ATOM 686 CD ARG A 45 31.946 -30.231 -19.514 1.00 11.23 C ATOM 687 NE ARG A 45 33.263 -30.323 -18.889 1.00 72.51 N ATOM 688 CZ ARG A 45 33.447 -30.530 -17.590 1.00 1.11 C ATOM 689 NH1 ARG A 45 32.404 -30.665 -16.782 1.00 44.13 N ATOM 690 NH2 ARG A 45 34.677 -30.602 -17.096 1.00 73.23 N ATOM 0 H ARG A 45 28.444 -27.357 -21.899 1.00 44.24 H new ATOM 0 HA ARG A 45 29.488 -28.994 -19.879 1.00 1.53 H new ATOM 0 HB2 ARG A 45 30.146 -30.573 -21.580 1.00 31.12 H new ATOM 0 HB3 ARG A 45 30.763 -29.302 -22.617 1.00 31.12 H new ATOM 0 HG2 ARG A 45 32.604 -30.503 -21.539 1.00 52.01 H new ATOM 0 HG3 ARG A 45 32.574 -28.831 -21.016 1.00 52.01 H new ATOM 0 HD2 ARG A 45 31.326 -29.533 -18.951 1.00 11.23 H new ATOM 0 HD3 ARG A 45 31.454 -31.203 -19.468 1.00 11.23 H new ATOM 0 HE ARG A 45 34.086 -30.223 -19.483 1.00 72.51 H new ATOM 0 HH11 ARG A 45 31.457 -30.610 -17.158 1.00 44.13 H new ATOM 0 HH12 ARG A 45 32.549 -30.824 -15.785 1.00 44.13 H new ATOM 0 HH21 ARG A 45 35.482 -30.498 -17.714 1.00 73.23 H new ATOM 0 HH22 ARG A 45 34.817 -30.761 -16.098 1.00 73.23 H new ATOM 704 N GLY A 46 30.361 -26.687 -19.456 1.00 73.41 N ATOM 705 CA GLY A 46 31.055 -25.454 -19.137 1.00 25.15 C ATOM 706 C GLY A 46 30.512 -24.790 -17.887 1.00 4.21 C ATOM 707 O GLY A 46 31.193 -24.725 -16.863 1.00 1.24 O ATOM 0 H GLY A 46 29.730 -27.024 -18.729 1.00 73.41 H new ATOM 0 HA2 GLY A 46 32.116 -25.662 -19.002 1.00 25.15 H new ATOM 0 HA3 GLY A 46 30.970 -24.765 -19.977 1.00 25.15 H new ATOM 711 N THR A 47 29.282 -24.293 -17.970 1.00 2.34 N ATOM 712 CA THR A 47 28.649 -23.627 -16.838 1.00 70.40 C ATOM 713 C THR A 47 27.139 -23.539 -17.027 1.00 11.11 C ATOM 714 O THR A 47 26.610 -23.923 -18.070 1.00 30.51 O ATOM 715 CB THR A 47 29.213 -22.209 -16.633 1.00 2.12 C ATOM 716 OG1 THR A 47 29.664 -21.675 -17.883 1.00 24.53 O ATOM 717 CG2 THR A 47 30.363 -22.223 -15.637 1.00 1.31 C ATOM 0 H THR A 47 28.704 -24.339 -18.809 1.00 2.34 H new ATOM 0 HA THR A 47 28.868 -24.228 -15.955 1.00 70.40 H new ATOM 0 HB THR A 47 28.417 -21.579 -16.236 1.00 2.12 H new ATOM 0 HG1 THR A 47 30.020 -20.772 -17.744 1.00 24.53 H new ATOM 0 HG21 THR A 47 30.745 -21.210 -15.508 1.00 1.31 H new ATOM 0 HG22 THR A 47 30.009 -22.602 -14.678 1.00 1.31 H new ATOM 0 HG23 THR A 47 31.160 -22.867 -16.010 1.00 1.31 H new ATOM 725 N VAL A 48 26.449 -23.029 -16.011 1.00 70.15 N ATOM 726 CA VAL A 48 24.999 -22.888 -16.067 1.00 32.34 C ATOM 727 C VAL A 48 24.590 -21.420 -16.097 1.00 40.15 C ATOM 728 O VAL A 48 24.798 -20.688 -15.131 1.00 2.25 O ATOM 729 CB VAL A 48 24.322 -23.573 -14.864 1.00 63.12 C ATOM 730 CG1 VAL A 48 22.811 -23.578 -15.034 1.00 33.54 C ATOM 731 CG2 VAL A 48 24.853 -24.988 -14.690 1.00 34.22 C ATOM 0 H VAL A 48 26.871 -22.707 -15.140 1.00 70.15 H new ATOM 0 HA VAL A 48 24.669 -23.373 -16.986 1.00 32.34 H new ATOM 0 HB VAL A 48 24.560 -23.007 -13.963 1.00 63.12 H new ATOM 0 HG11 VAL A 48 22.350 -24.066 -14.175 1.00 33.54 H new ATOM 0 HG12 VAL A 48 22.450 -22.552 -15.106 1.00 33.54 H new ATOM 0 HG13 VAL A 48 22.549 -24.120 -15.943 1.00 33.54 H new ATOM 0 HG21 VAL A 48 24.365 -25.457 -13.836 1.00 34.22 H new ATOM 0 HG22 VAL A 48 24.647 -25.567 -15.590 1.00 34.22 H new ATOM 0 HG23 VAL A 48 25.929 -24.954 -14.519 1.00 34.22 H new ATOM 741 N GLN A 49 24.007 -20.997 -17.214 1.00 70.05 N ATOM 742 CA GLN A 49 23.569 -19.615 -17.371 1.00 31.10 C ATOM 743 C GLN A 49 22.276 -19.364 -16.603 1.00 15.21 C ATOM 744 O GLN A 49 21.311 -20.118 -16.727 1.00 44.22 O ATOM 745 CB GLN A 49 23.369 -19.286 -18.851 1.00 42.23 C ATOM 746 CG GLN A 49 22.416 -20.233 -19.562 1.00 51.11 C ATOM 747 CD GLN A 49 22.141 -19.818 -20.994 1.00 71.20 C ATOM 748 OE1 GLN A 49 22.361 -20.589 -21.929 1.00 2.21 O ATOM 749 NE2 GLN A 49 21.656 -18.595 -21.174 1.00 4.02 N ATOM 0 H GLN A 49 23.827 -21.591 -18.023 1.00 70.05 H new ATOM 0 HA GLN A 49 24.344 -18.966 -16.964 1.00 31.10 H new ATOM 0 HB2 GLN A 49 22.990 -18.268 -18.940 1.00 42.23 H new ATOM 0 HB3 GLN A 49 24.336 -19.311 -19.354 1.00 42.23 H new ATOM 0 HG2 GLN A 49 22.836 -21.239 -19.554 1.00 51.11 H new ATOM 0 HG3 GLN A 49 21.475 -20.276 -19.013 1.00 51.11 H new ATOM 0 HE21 GLN A 49 21.489 -17.989 -20.371 1.00 4.02 H new ATOM 0 HE22 GLN A 49 21.451 -18.261 -22.116 1.00 4.02 H new ATOM 758 N GLY A 50 22.263 -18.298 -15.808 1.00 35.12 N ATOM 759 CA GLY A 50 21.083 -17.967 -15.031 1.00 15.33 C ATOM 760 C GLY A 50 20.742 -16.491 -15.095 1.00 35.20 C ATOM 761 O GLY A 50 21.611 -15.658 -15.346 1.00 4.41 O ATOM 0 H GLY A 50 23.048 -17.658 -15.688 1.00 35.12 H new ATOM 0 HA2 GLY A 50 20.236 -18.549 -15.396 1.00 15.33 H new ATOM 0 HA3 GLY A 50 21.243 -18.255 -13.992 1.00 15.33 H new ATOM 765 N GLN A 51 19.472 -16.168 -14.869 1.00 61.45 N ATOM 766 CA GLN A 51 19.019 -14.783 -14.906 1.00 34.03 C ATOM 767 C GLN A 51 17.801 -14.585 -14.009 1.00 23.14 C ATOM 768 O GLN A 51 16.718 -15.100 -14.291 1.00 44.21 O ATOM 769 CB GLN A 51 18.682 -14.372 -16.340 1.00 42.31 C ATOM 770 CG GLN A 51 19.901 -14.257 -17.242 1.00 13.13 C ATOM 771 CD GLN A 51 19.639 -13.410 -18.472 1.00 32.42 C ATOM 772 OE1 GLN A 51 19.194 -12.267 -18.369 1.00 53.23 O ATOM 773 NE2 GLN A 51 19.914 -13.969 -19.645 1.00 4.34 N ATOM 0 H GLN A 51 18.740 -16.846 -14.659 1.00 61.45 H new ATOM 0 HA GLN A 51 19.828 -14.153 -14.536 1.00 34.03 H new ATOM 0 HB2 GLN A 51 17.993 -15.101 -16.766 1.00 42.31 H new ATOM 0 HB3 GLN A 51 18.162 -13.414 -16.322 1.00 42.31 H new ATOM 0 HG2 GLN A 51 20.727 -13.825 -16.677 1.00 13.13 H new ATOM 0 HG3 GLN A 51 20.214 -15.254 -17.552 1.00 13.13 H new ATOM 0 HE21 GLN A 51 20.282 -14.920 -19.683 1.00 4.34 H new ATOM 0 HE22 GLN A 51 19.758 -13.448 -20.508 1.00 4.34 H new ATOM 782 N LEU A 52 17.986 -13.837 -12.926 1.00 75.04 N ATOM 783 CA LEU A 52 16.902 -13.571 -11.987 1.00 11.04 C ATOM 784 C LEU A 52 16.282 -12.201 -12.244 1.00 22.22 C ATOM 785 O LEU A 52 16.957 -11.281 -12.704 1.00 64.00 O ATOM 786 CB LEU A 52 17.417 -13.648 -10.548 1.00 62.44 C ATOM 787 CG LEU A 52 16.464 -13.141 -9.466 1.00 21.13 C ATOM 788 CD1 LEU A 52 15.273 -14.076 -9.323 1.00 12.42 C ATOM 789 CD2 LEU A 52 17.193 -12.997 -8.138 1.00 5.10 C ATOM 0 H LEU A 52 18.876 -13.405 -12.677 1.00 75.04 H new ATOM 0 HA LEU A 52 16.134 -14.330 -12.133 1.00 11.04 H new ATOM 0 HB2 LEU A 52 17.666 -14.686 -10.327 1.00 62.44 H new ATOM 0 HB3 LEU A 52 18.344 -13.078 -10.484 1.00 62.44 H new ATOM 0 HG LEU A 52 16.096 -12.159 -9.764 1.00 21.13 H new ATOM 0 HD11 LEU A 52 14.605 -13.699 -8.548 1.00 12.42 H new ATOM 0 HD12 LEU A 52 14.736 -14.129 -10.270 1.00 12.42 H new ATOM 0 HD13 LEU A 52 15.623 -15.071 -9.048 1.00 12.42 H new ATOM 0 HD21 LEU A 52 16.499 -12.635 -7.379 1.00 5.10 H new ATOM 0 HD22 LEU A 52 17.590 -13.966 -7.834 1.00 5.10 H new ATOM 0 HD23 LEU A 52 18.013 -12.287 -8.248 1.00 5.10 H new ATOM 801 N GLN A 53 14.994 -12.074 -11.941 1.00 42.13 N ATOM 802 CA GLN A 53 14.284 -10.816 -12.139 1.00 4.44 C ATOM 803 C GLN A 53 13.640 -10.345 -10.839 1.00 52.31 C ATOM 804 O GLN A 53 13.704 -11.029 -9.819 1.00 21.11 O ATOM 805 CB GLN A 53 13.218 -10.972 -13.224 1.00 35.25 C ATOM 806 CG GLN A 53 13.704 -11.724 -14.452 1.00 24.45 C ATOM 807 CD GLN A 53 14.788 -10.976 -15.203 1.00 30.23 C ATOM 808 OE1 GLN A 53 14.557 -9.886 -15.726 1.00 10.32 O ATOM 809 NE2 GLN A 53 15.980 -11.559 -15.260 1.00 34.40 N ATOM 0 H GLN A 53 14.421 -12.826 -11.558 1.00 42.13 H new ATOM 0 HA GLN A 53 15.007 -10.066 -12.458 1.00 4.44 H new ATOM 0 HB2 GLN A 53 12.359 -11.495 -12.805 1.00 35.25 H new ATOM 0 HB3 GLN A 53 12.873 -9.984 -13.527 1.00 35.25 H new ATOM 0 HG2 GLN A 53 14.084 -12.700 -14.149 1.00 24.45 H new ATOM 0 HG3 GLN A 53 12.862 -11.904 -15.120 1.00 24.45 H new ATOM 0 HE21 GLN A 53 16.127 -12.463 -14.812 1.00 34.40 H new ATOM 0 HE22 GLN A 53 16.748 -11.102 -15.752 1.00 34.40 H new ATOM 818 N GLY A 54 13.018 -9.170 -10.884 1.00 61.11 N ATOM 819 CA GLY A 54 12.371 -8.628 -9.704 1.00 2.52 C ATOM 820 C GLY A 54 12.657 -7.151 -9.513 1.00 20.21 C ATOM 821 O GLY A 54 13.561 -6.587 -10.130 1.00 22.35 O ATOM 0 H GLY A 54 12.951 -8.585 -11.717 1.00 61.11 H new ATOM 0 HA2 GLY A 54 11.294 -8.779 -9.782 1.00 2.52 H new ATOM 0 HA3 GLY A 54 12.707 -9.177 -8.824 1.00 2.52 H new ATOM 825 N PRO A 55 11.872 -6.500 -8.641 1.00 63.43 N ATOM 826 CA PRO A 55 12.026 -5.072 -8.352 1.00 12.43 C ATOM 827 C PRO A 55 13.304 -4.771 -7.576 1.00 34.44 C ATOM 828 O PRO A 55 13.850 -5.644 -6.900 1.00 70.12 O ATOM 829 CB PRO A 55 10.795 -4.748 -7.501 1.00 41.21 C ATOM 830 CG PRO A 55 10.418 -6.044 -6.871 1.00 61.23 C ATOM 831 CD PRO A 55 10.775 -7.109 -7.871 1.00 21.42 C ATOM 0 HA PRO A 55 12.101 -4.478 -9.263 1.00 12.43 H new ATOM 0 HB2 PRO A 55 11.022 -3.993 -6.748 1.00 41.21 H new ATOM 0 HB3 PRO A 55 9.983 -4.354 -8.113 1.00 41.21 H new ATOM 0 HG2 PRO A 55 10.954 -6.193 -5.934 1.00 61.23 H new ATOM 0 HG3 PRO A 55 9.354 -6.069 -6.637 1.00 61.23 H new ATOM 0 HD2 PRO A 55 11.091 -8.030 -7.381 1.00 21.42 H new ATOM 0 HD3 PRO A 55 9.928 -7.361 -8.509 1.00 21.42 H new ATOM 839 N ILE A 56 13.774 -3.533 -7.676 1.00 64.03 N ATOM 840 CA ILE A 56 14.987 -3.119 -6.982 1.00 42.51 C ATOM 841 C ILE A 56 14.817 -3.221 -5.470 1.00 43.42 C ATOM 842 O ILE A 56 15.797 -3.254 -4.726 1.00 22.11 O ATOM 843 CB ILE A 56 15.379 -1.675 -7.347 1.00 41.51 C ATOM 844 CG1 ILE A 56 16.769 -1.346 -6.797 1.00 55.41 C ATOM 845 CG2 ILE A 56 14.346 -0.694 -6.812 1.00 60.03 C ATOM 846 CD1 ILE A 56 17.325 -0.035 -7.307 1.00 3.33 C ATOM 0 H ILE A 56 13.334 -2.799 -8.231 1.00 64.03 H new ATOM 0 HA ILE A 56 15.780 -3.794 -7.302 1.00 42.51 H new ATOM 0 HB ILE A 56 15.408 -1.586 -8.433 1.00 41.51 H new ATOM 0 HG12 ILE A 56 16.722 -1.313 -5.709 1.00 55.41 H new ATOM 0 HG13 ILE A 56 17.455 -2.150 -7.062 1.00 55.41 H new ATOM 0 HG21 ILE A 56 14.637 0.322 -7.078 1.00 60.03 H new ATOM 0 HG22 ILE A 56 13.372 -0.918 -7.247 1.00 60.03 H new ATOM 0 HG23 ILE A 56 14.288 -0.782 -5.727 1.00 60.03 H new ATOM 0 HD11 ILE A 56 18.312 0.134 -6.876 1.00 3.33 H new ATOM 0 HD12 ILE A 56 17.405 -0.072 -8.393 1.00 3.33 H new ATOM 0 HD13 ILE A 56 16.660 0.779 -7.019 1.00 3.33 H new ATOM 858 N SER A 57 13.567 -3.271 -5.023 1.00 34.42 N ATOM 859 CA SER A 57 13.268 -3.368 -3.599 1.00 15.12 C ATOM 860 C SER A 57 13.039 -4.820 -3.189 1.00 11.40 C ATOM 861 O SER A 57 12.320 -5.101 -2.230 1.00 1.23 O ATOM 862 CB SER A 57 12.034 -2.529 -3.257 1.00 63.42 C ATOM 863 OG SER A 57 11.933 -2.317 -1.860 1.00 31.53 O ATOM 0 H SER A 57 12.745 -3.246 -5.626 1.00 34.42 H new ATOM 0 HA SER A 57 14.125 -2.984 -3.046 1.00 15.12 H new ATOM 0 HB2 SER A 57 12.089 -1.569 -3.771 1.00 63.42 H new ATOM 0 HB3 SER A 57 11.137 -3.032 -3.617 1.00 63.42 H new ATOM 0 HG SER A 57 12.020 -3.174 -1.392 1.00 31.53 H new ATOM 869 N LYS A 58 13.656 -5.739 -3.923 1.00 70.12 N ATOM 870 CA LYS A 58 13.523 -7.163 -3.638 1.00 13.22 C ATOM 871 C LYS A 58 14.751 -7.931 -4.115 1.00 4.35 C ATOM 872 O LYS A 58 15.276 -8.787 -3.402 1.00 52.11 O ATOM 873 CB LYS A 58 12.266 -7.723 -4.308 1.00 42.12 C ATOM 874 CG LYS A 58 12.077 -9.215 -4.095 1.00 51.14 C ATOM 875 CD LYS A 58 10.616 -9.615 -4.219 1.00 3.10 C ATOM 876 CE LYS A 58 9.813 -9.172 -3.006 1.00 33.42 C ATOM 877 NZ LYS A 58 10.223 -9.900 -1.773 1.00 70.41 N ATOM 0 H LYS A 58 14.254 -5.523 -4.721 1.00 70.12 H new ATOM 0 HA LYS A 58 13.437 -7.285 -2.558 1.00 13.22 H new ATOM 0 HB2 LYS A 58 11.393 -7.196 -3.922 1.00 42.12 H new ATOM 0 HB3 LYS A 58 12.314 -7.520 -5.378 1.00 42.12 H new ATOM 0 HG2 LYS A 58 12.669 -9.766 -4.826 1.00 51.14 H new ATOM 0 HG3 LYS A 58 12.449 -9.493 -3.109 1.00 51.14 H new ATOM 0 HD2 LYS A 58 10.191 -9.172 -5.120 1.00 3.10 H new ATOM 0 HD3 LYS A 58 10.542 -10.697 -4.331 1.00 3.10 H new ATOM 0 HE2 LYS A 58 9.944 -8.100 -2.855 1.00 33.42 H new ATOM 0 HE3 LYS A 58 8.752 -9.341 -3.191 1.00 33.42 H new ATOM 0 HZ1 LYS A 58 9.641 -9.582 -0.972 1.00 70.41 H new ATOM 0 HZ2 LYS A 58 10.090 -10.922 -1.913 1.00 70.41 H new ATOM 0 HZ3 LYS A 58 11.225 -9.705 -1.572 1.00 70.41 H new ATOM 891 N VAL A 59 15.207 -7.618 -5.323 1.00 50.25 N ATOM 892 CA VAL A 59 16.376 -8.277 -5.894 1.00 52.41 C ATOM 893 C VAL A 59 17.604 -8.078 -5.012 1.00 74.15 C ATOM 894 O VAL A 59 18.524 -8.896 -5.020 1.00 2.54 O ATOM 895 CB VAL A 59 16.682 -7.750 -7.309 1.00 4.45 C ATOM 896 CG1 VAL A 59 17.841 -8.518 -7.925 1.00 61.24 C ATOM 897 CG2 VAL A 59 15.445 -7.837 -8.189 1.00 40.10 C ATOM 0 H VAL A 59 14.785 -6.912 -5.926 1.00 50.25 H new ATOM 0 HA VAL A 59 16.143 -9.340 -5.953 1.00 52.41 H new ATOM 0 HB VAL A 59 16.972 -6.702 -7.233 1.00 4.45 H new ATOM 0 HG11 VAL A 59 18.043 -8.132 -8.924 1.00 61.24 H new ATOM 0 HG12 VAL A 59 18.728 -8.398 -7.303 1.00 61.24 H new ATOM 0 HG13 VAL A 59 17.584 -9.575 -7.989 1.00 61.24 H new ATOM 0 HG21 VAL A 59 15.680 -7.461 -9.185 1.00 40.10 H new ATOM 0 HG22 VAL A 59 15.122 -8.875 -8.261 1.00 40.10 H new ATOM 0 HG23 VAL A 59 14.646 -7.237 -7.753 1.00 40.10 H new ATOM 907 N ARG A 60 17.610 -6.987 -4.253 1.00 62.24 N ATOM 908 CA ARG A 60 18.726 -6.681 -3.366 1.00 55.40 C ATOM 909 C ARG A 60 18.947 -7.808 -2.362 1.00 64.11 C ATOM 910 O ARG A 60 20.057 -8.000 -1.863 1.00 13.31 O ATOM 911 CB ARG A 60 18.469 -5.367 -2.625 1.00 44.23 C ATOM 912 CG ARG A 60 19.739 -4.617 -2.258 1.00 25.10 C ATOM 913 CD ARG A 60 20.315 -5.109 -0.939 1.00 64.45 C ATOM 914 NE ARG A 60 21.025 -4.052 -0.223 1.00 75.44 N ATOM 915 CZ ARG A 60 21.382 -4.142 1.053 1.00 43.42 C ATOM 916 NH1 ARG A 60 21.099 -5.234 1.749 1.00 0.44 N ATOM 917 NH2 ARG A 60 22.025 -3.137 1.635 1.00 64.34 N ATOM 0 H ARG A 60 16.855 -6.301 -4.234 1.00 62.24 H new ATOM 0 HA ARG A 60 19.624 -6.578 -3.975 1.00 55.40 H new ATOM 0 HB2 ARG A 60 17.845 -4.725 -3.247 1.00 44.23 H new ATOM 0 HB3 ARG A 60 17.905 -5.576 -1.716 1.00 44.23 H new ATOM 0 HG2 ARG A 60 20.479 -4.743 -3.049 1.00 25.10 H new ATOM 0 HG3 ARG A 60 19.526 -3.550 -2.188 1.00 25.10 H new ATOM 0 HD2 ARG A 60 19.510 -5.493 -0.313 1.00 64.45 H new ATOM 0 HD3 ARG A 60 20.996 -5.939 -1.128 1.00 64.45 H new ATOM 0 HE ARG A 60 21.259 -3.199 -0.730 1.00 75.44 H new ATOM 0 HH11 ARG A 60 20.606 -6.008 1.305 1.00 0.44 H new ATOM 0 HH12 ARG A 60 21.375 -5.300 2.729 1.00 0.44 H new ATOM 0 HH21 ARG A 60 22.245 -2.296 1.102 1.00 64.34 H new ATOM 0 HH22 ARG A 60 22.299 -3.206 2.615 1.00 64.34 H new ATOM 931 N HIS A 61 17.885 -8.551 -2.070 1.00 74.32 N ATOM 932 CA HIS A 61 17.963 -9.660 -1.126 1.00 22.12 C ATOM 933 C HIS A 61 18.408 -10.940 -1.827 1.00 20.24 C ATOM 934 O HIS A 61 19.403 -11.555 -1.443 1.00 73.25 O ATOM 935 CB HIS A 61 16.609 -9.879 -0.450 1.00 2.11 C ATOM 936 CG HIS A 61 16.419 -9.059 0.789 1.00 73.01 C ATOM 937 ND1 HIS A 61 17.162 -9.244 1.936 1.00 70.15 N ATOM 938 CD2 HIS A 61 15.564 -8.044 1.056 1.00 31.21 C ATOM 939 CE1 HIS A 61 16.771 -8.380 2.855 1.00 3.20 C ATOM 940 NE2 HIS A 61 15.803 -7.640 2.346 1.00 12.44 N ATOM 0 H HIS A 61 16.960 -8.405 -2.474 1.00 74.32 H new ATOM 0 HA HIS A 61 18.703 -9.407 -0.367 1.00 22.12 H new ATOM 0 HB2 HIS A 61 15.816 -9.641 -1.159 1.00 2.11 H new ATOM 0 HB3 HIS A 61 16.505 -10.934 -0.197 1.00 2.11 H new ATOM 0 HD2 HIS A 61 14.831 -7.629 0.380 1.00 31.21 H new ATOM 0 HE1 HIS A 61 17.174 -8.293 3.853 1.00 3.20 H new ATOM 0 HE2 HIS A 61 15.312 -6.890 2.833 1.00 12.44 H new ATOM 948 N MET A 62 17.664 -11.336 -2.854 1.00 51.33 N ATOM 949 CA MET A 62 17.983 -12.543 -3.608 1.00 54.43 C ATOM 950 C MET A 62 19.416 -12.496 -4.128 1.00 71.23 C ATOM 951 O MET A 62 20.150 -13.480 -4.038 1.00 11.23 O ATOM 952 CB MET A 62 17.009 -12.712 -4.776 1.00 42.24 C ATOM 953 CG MET A 62 16.709 -14.164 -5.112 1.00 42.30 C ATOM 954 SD MET A 62 15.727 -14.982 -3.840 1.00 41.13 S ATOM 955 CE MET A 62 14.109 -14.978 -4.608 1.00 32.43 C ATOM 0 H MET A 62 16.836 -10.839 -3.183 1.00 51.33 H new ATOM 0 HA MET A 62 17.887 -13.397 -2.937 1.00 54.43 H new ATOM 0 HB2 MET A 62 16.076 -12.203 -4.537 1.00 42.24 H new ATOM 0 HB3 MET A 62 17.423 -12.222 -5.657 1.00 42.24 H new ATOM 0 HG2 MET A 62 16.177 -14.211 -6.062 1.00 42.30 H new ATOM 0 HG3 MET A 62 17.647 -14.704 -5.245 1.00 42.30 H new ATOM 0 HE1 MET A 62 13.385 -15.436 -3.934 1.00 32.43 H new ATOM 0 HE2 MET A 62 13.809 -13.952 -4.819 1.00 32.43 H new ATOM 0 HE3 MET A 62 14.147 -15.544 -5.539 1.00 32.43 H new ATOM 965 N GLN A 63 19.806 -11.348 -4.672 1.00 64.25 N ATOM 966 CA GLN A 63 21.152 -11.176 -5.207 1.00 52.44 C ATOM 967 C GLN A 63 22.203 -11.504 -4.153 1.00 23.13 C ATOM 968 O GLN A 63 23.314 -11.921 -4.480 1.00 31.04 O ATOM 969 CB GLN A 63 21.345 -9.743 -5.708 1.00 35.01 C ATOM 970 CG GLN A 63 21.506 -8.725 -4.591 1.00 12.23 C ATOM 971 CD GLN A 63 21.727 -7.318 -5.111 1.00 30.13 C ATOM 972 OE1 GLN A 63 21.538 -7.045 -6.296 1.00 61.35 O ATOM 973 NE2 GLN A 63 22.129 -6.415 -4.224 1.00 23.31 N ATOM 0 H GLN A 63 19.210 -10.524 -4.754 1.00 64.25 H new ATOM 0 HA GLN A 63 21.274 -11.865 -6.042 1.00 52.44 H new ATOM 0 HB2 GLN A 63 22.225 -9.707 -6.351 1.00 35.01 H new ATOM 0 HB3 GLN A 63 20.489 -9.463 -6.323 1.00 35.01 H new ATOM 0 HG2 GLN A 63 20.617 -8.740 -3.960 1.00 12.23 H new ATOM 0 HG3 GLN A 63 22.348 -9.012 -3.962 1.00 12.23 H new ATOM 0 HE21 GLN A 63 22.273 -6.685 -3.251 1.00 23.31 H new ATOM 0 HE22 GLN A 63 22.293 -5.452 -4.516 1.00 23.31 H new ATOM 982 N GLU A 64 21.845 -11.313 -2.887 1.00 12.10 N ATOM 983 CA GLU A 64 22.759 -11.588 -1.785 1.00 21.11 C ATOM 984 C GLU A 64 22.404 -12.904 -1.099 1.00 34.11 C ATOM 985 O GLU A 64 22.687 -13.096 0.084 1.00 51.14 O ATOM 986 CB GLU A 64 22.726 -10.445 -0.768 1.00 62.21 C ATOM 987 CG GLU A 64 23.557 -9.241 -1.179 1.00 24.34 C ATOM 988 CD GLU A 64 25.011 -9.593 -1.427 1.00 62.52 C ATOM 989 OE1 GLU A 64 25.536 -10.482 -0.724 1.00 74.32 O ATOM 990 OE2 GLU A 64 25.624 -8.980 -2.326 1.00 4.33 O ATOM 0 H GLU A 64 20.929 -10.969 -2.599 1.00 12.10 H new ATOM 0 HA GLU A 64 23.766 -11.672 -2.194 1.00 21.11 H new ATOM 0 HB2 GLU A 64 21.693 -10.130 -0.621 1.00 62.21 H new ATOM 0 HB3 GLU A 64 23.086 -10.814 0.192 1.00 62.21 H new ATOM 0 HG2 GLU A 64 23.134 -8.804 -2.083 1.00 24.34 H new ATOM 0 HG3 GLU A 64 23.499 -8.481 -0.400 1.00 24.34 H new ATOM 997 N TRP A 65 21.782 -13.806 -1.849 1.00 74.03 N ATOM 998 CA TRP A 65 21.386 -15.104 -1.314 1.00 5.01 C ATOM 999 C TRP A 65 21.822 -16.232 -2.243 1.00 4.41 C ATOM 1000 O TRP A 65 22.282 -17.280 -1.789 1.00 65.33 O ATOM 1001 CB TRP A 65 19.872 -15.154 -1.107 1.00 52.31 C ATOM 1002 CG TRP A 65 19.407 -16.399 -0.414 1.00 5.22 C ATOM 1003 CD1 TRP A 65 19.415 -17.668 -0.917 1.00 24.42 C ATOM 1004 CD2 TRP A 65 18.865 -16.492 0.908 1.00 23.11 C ATOM 1005 NE1 TRP A 65 18.911 -18.545 0.013 1.00 73.52 N ATOM 1006 CE2 TRP A 65 18.567 -17.849 1.141 1.00 10.11 C ATOM 1007 CE3 TRP A 65 18.605 -15.562 1.918 1.00 31.21 C ATOM 1008 CZ2 TRP A 65 18.021 -18.295 2.342 1.00 73.15 C ATOM 1009 CZ3 TRP A 65 18.062 -16.007 3.109 1.00 44.41 C ATOM 1010 CH2 TRP A 65 17.776 -17.363 3.313 1.00 52.00 C ATOM 0 H TRP A 65 21.541 -13.663 -2.830 1.00 74.03 H new ATOM 0 HA TRP A 65 21.881 -15.238 -0.352 1.00 5.01 H new ATOM 0 HB2 TRP A 65 19.563 -14.286 -0.524 1.00 52.31 H new ATOM 0 HB3 TRP A 65 19.378 -15.080 -2.076 1.00 52.31 H new ATOM 0 HD1 TRP A 65 19.766 -17.942 -1.901 1.00 24.42 H new ATOM 0 HE1 TRP A 65 18.810 -19.552 -0.116 1.00 73.52 H new ATOM 0 HE3 TRP A 65 18.824 -14.515 1.771 1.00 31.21 H new ATOM 0 HZ2 TRP A 65 17.799 -19.340 2.501 1.00 73.15 H new ATOM 0 HZ3 TRP A 65 17.855 -15.297 3.896 1.00 44.41 H new ATOM 0 HH2 TRP A 65 17.354 -17.679 4.255 1.00 52.00 H new ATOM 1021 N LEU A 66 21.676 -16.010 -3.544 1.00 75.14 N ATOM 1022 CA LEU A 66 22.055 -17.009 -4.538 1.00 51.41 C ATOM 1023 C LEU A 66 23.567 -17.206 -4.561 1.00 62.34 C ATOM 1024 O LEU A 66 24.055 -18.302 -4.838 1.00 52.41 O ATOM 1025 CB LEU A 66 21.562 -16.590 -5.924 1.00 44.14 C ATOM 1026 CG LEU A 66 20.063 -16.746 -6.179 1.00 53.42 C ATOM 1027 CD1 LEU A 66 19.705 -16.259 -7.575 1.00 61.21 C ATOM 1028 CD2 LEU A 66 19.638 -18.195 -5.992 1.00 54.32 C ATOM 0 H LEU A 66 21.298 -15.147 -3.936 1.00 75.14 H new ATOM 0 HA LEU A 66 21.588 -17.955 -4.264 1.00 51.41 H new ATOM 0 HB2 LEU A 66 21.830 -15.545 -6.082 1.00 44.14 H new ATOM 0 HB3 LEU A 66 22.100 -17.174 -6.671 1.00 44.14 H new ATOM 0 HG LEU A 66 19.525 -16.134 -5.454 1.00 53.42 H new ATOM 0 HD11 LEU A 66 18.634 -16.378 -7.738 1.00 61.21 H new ATOM 0 HD12 LEU A 66 19.972 -15.207 -7.673 1.00 61.21 H new ATOM 0 HD13 LEU A 66 20.252 -16.843 -8.315 1.00 61.21 H new ATOM 0 HD21 LEU A 66 18.568 -18.287 -6.178 1.00 54.32 H new ATOM 0 HD22 LEU A 66 20.184 -18.827 -6.692 1.00 54.32 H new ATOM 0 HD23 LEU A 66 19.858 -18.510 -4.972 1.00 54.32 H new ATOM 1040 N GLU A 67 24.303 -16.139 -4.267 1.00 61.01 N ATOM 1041 CA GLU A 67 25.760 -16.197 -4.253 1.00 41.22 C ATOM 1042 C GLU A 67 26.266 -16.851 -2.971 1.00 65.31 C ATOM 1043 O GLU A 67 27.353 -17.430 -2.942 1.00 43.14 O ATOM 1044 CB GLU A 67 26.350 -14.791 -4.389 1.00 34.43 C ATOM 1045 CG GLU A 67 26.137 -13.921 -3.161 1.00 65.42 C ATOM 1046 CD GLU A 67 26.794 -12.561 -3.290 1.00 3.32 C ATOM 1047 OE1 GLU A 67 26.413 -11.803 -4.206 1.00 54.32 O ATOM 1048 OE2 GLU A 67 27.689 -12.254 -2.475 1.00 44.02 O ATOM 0 H GLU A 67 23.915 -15.225 -4.035 1.00 61.01 H new ATOM 0 HA GLU A 67 26.082 -16.802 -5.101 1.00 41.22 H new ATOM 0 HB2 GLU A 67 27.419 -14.872 -4.586 1.00 34.43 H new ATOM 0 HB3 GLU A 67 25.903 -14.300 -5.254 1.00 34.43 H new ATOM 0 HG2 GLU A 67 25.068 -13.790 -2.994 1.00 65.42 H new ATOM 0 HG3 GLU A 67 26.536 -14.432 -2.285 1.00 65.42 H new ATOM 1055 N THR A 68 25.471 -16.755 -1.910 1.00 71.13 N ATOM 1056 CA THR A 68 25.838 -17.335 -0.625 1.00 33.33 C ATOM 1057 C THR A 68 25.281 -18.747 -0.479 1.00 53.24 C ATOM 1058 O THR A 68 26.023 -19.727 -0.545 1.00 51.11 O ATOM 1059 CB THR A 68 25.331 -16.472 0.546 1.00 34.42 C ATOM 1060 OG1 THR A 68 23.947 -16.154 0.357 1.00 45.11 O ATOM 1061 CG2 THR A 68 26.140 -15.190 0.664 1.00 42.13 C ATOM 0 H THR A 68 24.568 -16.281 -1.916 1.00 71.13 H new ATOM 0 HA THR A 68 26.927 -17.372 -0.595 1.00 33.33 H new ATOM 0 HB THR A 68 25.450 -17.043 1.467 1.00 34.42 H new ATOM 0 HG1 THR A 68 23.632 -15.606 1.106 1.00 45.11 H new ATOM 0 HG21 THR A 68 25.763 -14.597 1.498 1.00 42.13 H new ATOM 0 HG22 THR A 68 27.188 -15.436 0.838 1.00 42.13 H new ATOM 0 HG23 THR A 68 26.050 -14.617 -0.259 1.00 42.13 H new ATOM 1069 N ARG A 69 23.970 -18.843 -0.282 1.00 70.33 N ATOM 1070 CA ARG A 69 23.314 -20.136 -0.127 1.00 52.03 C ATOM 1071 C ARG A 69 23.368 -20.932 -1.428 1.00 31.53 C ATOM 1072 O ARG A 69 23.893 -20.461 -2.435 1.00 53.43 O ATOM 1073 CB ARG A 69 21.859 -19.945 0.306 1.00 2.21 C ATOM 1074 CG ARG A 69 21.673 -19.910 1.814 1.00 14.11 C ATOM 1075 CD ARG A 69 21.390 -21.296 2.373 1.00 44.23 C ATOM 1076 NE ARG A 69 21.735 -21.396 3.788 1.00 31.03 N ATOM 1077 CZ ARG A 69 21.352 -22.401 4.568 1.00 4.25 C ATOM 1078 NH1 ARG A 69 20.617 -23.386 4.073 1.00 70.41 N ATOM 1079 NH2 ARG A 69 21.706 -22.421 5.847 1.00 30.23 N ATOM 0 H ARG A 69 23.342 -18.041 -0.226 1.00 70.33 H new ATOM 0 HA ARG A 69 23.845 -20.695 0.644 1.00 52.03 H new ATOM 0 HB2 ARG A 69 21.481 -19.016 -0.120 1.00 2.21 H new ATOM 0 HB3 ARG A 69 21.256 -20.754 -0.107 1.00 2.21 H new ATOM 0 HG2 ARG A 69 22.569 -19.503 2.283 1.00 14.11 H new ATOM 0 HG3 ARG A 69 20.850 -19.240 2.065 1.00 14.11 H new ATOM 0 HD2 ARG A 69 20.334 -21.532 2.240 1.00 44.23 H new ATOM 0 HD3 ARG A 69 21.956 -22.037 1.809 1.00 44.23 H new ATOM 0 HE ARG A 69 22.301 -20.654 4.200 1.00 31.03 H new ATOM 0 HH11 ARG A 69 20.344 -23.374 3.090 1.00 70.41 H new ATOM 0 HH12 ARG A 69 20.325 -24.156 4.675 1.00 70.41 H new ATOM 0 HH21 ARG A 69 22.272 -21.665 6.231 1.00 30.23 H new ATOM 0 HH22 ARG A 69 21.412 -23.193 6.446 1.00 30.23 H new ATOM 1093 N GLY A 70 22.821 -22.144 -1.397 1.00 24.32 N ATOM 1094 CA GLY A 70 22.818 -22.987 -2.578 1.00 65.12 C ATOM 1095 C GLY A 70 22.831 -24.464 -2.237 1.00 2.12 C ATOM 1096 O GLY A 70 23.091 -24.842 -1.094 1.00 51.34 O ATOM 0 H GLY A 70 22.380 -22.557 -0.575 1.00 24.32 H new ATOM 0 HA2 GLY A 70 21.936 -22.764 -3.178 1.00 65.12 H new ATOM 0 HA3 GLY A 70 23.688 -22.751 -3.191 1.00 65.12 H new ATOM 1100 N SER A 71 22.549 -25.302 -3.229 1.00 55.44 N ATOM 1101 CA SER A 71 22.523 -26.746 -3.027 1.00 40.52 C ATOM 1102 C SER A 71 23.817 -27.226 -2.378 1.00 23.11 C ATOM 1103 O SER A 71 24.844 -26.548 -2.404 1.00 43.53 O ATOM 1104 CB SER A 71 22.310 -27.465 -4.361 1.00 4.24 C ATOM 1105 OG SER A 71 20.930 -27.618 -4.643 1.00 2.10 O ATOM 0 H SER A 71 22.335 -25.006 -4.181 1.00 55.44 H new ATOM 0 HA SER A 71 21.693 -26.981 -2.360 1.00 40.52 H new ATOM 0 HB2 SER A 71 22.788 -26.901 -5.162 1.00 4.24 H new ATOM 0 HB3 SER A 71 22.789 -28.444 -4.331 1.00 4.24 H new ATOM 0 HG SER A 71 20.749 -28.547 -4.899 1.00 2.10 H new ATOM 1111 N PRO A 72 23.768 -28.426 -1.780 1.00 44.30 N ATOM 1112 CA PRO A 72 24.928 -29.025 -1.113 1.00 33.44 C ATOM 1113 C PRO A 72 26.008 -29.452 -2.100 1.00 23.40 C ATOM 1114 O PRO A 72 27.182 -29.562 -1.743 1.00 53.15 O ATOM 1115 CB PRO A 72 24.337 -30.247 -0.405 1.00 73.41 C ATOM 1116 CG PRO A 72 23.123 -30.593 -1.197 1.00 21.42 C ATOM 1117 CD PRO A 72 22.578 -29.289 -1.710 1.00 72.41 C ATOM 0 HA PRO A 72 25.420 -28.322 -0.441 1.00 33.44 H new ATOM 0 HB2 PRO A 72 25.046 -31.075 -0.385 1.00 73.41 H new ATOM 0 HB3 PRO A 72 24.083 -30.020 0.630 1.00 73.41 H new ATOM 0 HG2 PRO A 72 23.372 -31.263 -2.020 1.00 21.42 H new ATOM 0 HG3 PRO A 72 22.387 -31.107 -0.579 1.00 21.42 H new ATOM 0 HD2 PRO A 72 22.109 -29.406 -2.687 1.00 72.41 H new ATOM 0 HD3 PRO A 72 21.822 -28.878 -1.040 1.00 72.41 H new ATOM 1125 N LYS A 73 25.606 -29.692 -3.343 1.00 72.33 N ATOM 1126 CA LYS A 73 26.540 -30.106 -4.384 1.00 54.20 C ATOM 1127 C LYS A 73 26.758 -28.985 -5.395 1.00 62.25 C ATOM 1128 O LYS A 73 27.096 -29.237 -6.552 1.00 24.21 O ATOM 1129 CB LYS A 73 26.020 -31.356 -5.097 1.00 32.32 C ATOM 1130 CG LYS A 73 27.121 -32.292 -5.565 1.00 2.15 C ATOM 1131 CD LYS A 73 27.701 -33.092 -4.410 1.00 52.01 C ATOM 1132 CE LYS A 73 26.862 -34.325 -4.110 1.00 3.10 C ATOM 1133 NZ LYS A 73 27.291 -34.995 -2.851 1.00 44.40 N ATOM 0 H LYS A 73 24.639 -29.607 -3.655 1.00 72.33 H new ATOM 0 HA LYS A 73 27.495 -30.336 -3.911 1.00 54.20 H new ATOM 0 HB2 LYS A 73 25.356 -31.898 -4.424 1.00 32.32 H new ATOM 0 HB3 LYS A 73 25.423 -31.052 -5.957 1.00 32.32 H new ATOM 0 HG2 LYS A 73 26.725 -32.973 -6.318 1.00 2.15 H new ATOM 0 HG3 LYS A 73 27.912 -31.714 -6.042 1.00 2.15 H new ATOM 0 HD2 LYS A 73 28.720 -33.394 -4.651 1.00 52.01 H new ATOM 0 HD3 LYS A 73 27.756 -32.463 -3.522 1.00 52.01 H new ATOM 0 HE2 LYS A 73 25.813 -34.040 -4.030 1.00 3.10 H new ATOM 0 HE3 LYS A 73 26.939 -35.028 -4.940 1.00 3.10 H new ATOM 0 HZ1 LYS A 73 26.695 -35.830 -2.682 1.00 44.40 H new ATOM 0 HZ2 LYS A 73 28.285 -35.290 -2.936 1.00 44.40 H new ATOM 0 HZ3 LYS A 73 27.193 -34.333 -2.055 1.00 44.40 H new ATOM 1147 N SER A 74 26.564 -27.747 -4.952 1.00 21.44 N ATOM 1148 CA SER A 74 26.738 -26.588 -5.819 1.00 70.21 C ATOM 1149 C SER A 74 27.726 -25.598 -5.211 1.00 12.54 C ATOM 1150 O SER A 74 27.333 -24.558 -4.680 1.00 41.23 O ATOM 1151 CB SER A 74 25.393 -25.901 -6.062 1.00 42.45 C ATOM 1152 OG SER A 74 24.841 -25.417 -4.850 1.00 73.43 O ATOM 0 H SER A 74 26.286 -27.521 -3.997 1.00 21.44 H new ATOM 0 HA SER A 74 27.138 -26.934 -6.772 1.00 70.21 H new ATOM 0 HB2 SER A 74 25.524 -25.075 -6.761 1.00 42.45 H new ATOM 0 HB3 SER A 74 24.701 -26.604 -6.525 1.00 42.45 H new ATOM 0 HG SER A 74 25.167 -25.960 -4.102 1.00 73.43 H new ATOM 1158 N HIS A 75 29.011 -25.928 -5.291 1.00 51.20 N ATOM 1159 CA HIS A 75 30.057 -25.068 -4.749 1.00 13.40 C ATOM 1160 C HIS A 75 30.243 -23.826 -5.616 1.00 70.34 C ATOM 1161 O HIS A 75 30.789 -23.903 -6.717 1.00 71.24 O ATOM 1162 CB HIS A 75 31.375 -25.835 -4.646 1.00 43.14 C ATOM 1163 CG HIS A 75 31.495 -26.655 -3.399 1.00 63.42 C ATOM 1164 ND1 HIS A 75 31.554 -28.033 -3.407 1.00 70.04 N ATOM 1165 CD2 HIS A 75 31.569 -26.285 -2.099 1.00 44.14 C ATOM 1166 CE1 HIS A 75 31.657 -28.474 -2.167 1.00 22.55 C ATOM 1167 NE2 HIS A 75 31.669 -27.434 -1.354 1.00 3.54 N ATOM 0 H HIS A 75 29.353 -26.785 -5.726 1.00 51.20 H new ATOM 0 HA HIS A 75 29.752 -24.751 -3.752 1.00 13.40 H new ATOM 0 HB2 HIS A 75 31.474 -26.489 -5.512 1.00 43.14 H new ATOM 0 HB3 HIS A 75 32.202 -25.126 -4.686 1.00 43.14 H new ATOM 0 HD2 HIS A 75 31.552 -25.274 -1.719 1.00 44.14 H new ATOM 0 HE1 HIS A 75 31.721 -29.510 -1.868 1.00 22.55 H new ATOM 0 HE2 HIS A 75 31.741 -27.477 -0.337 1.00 3.54 H new ATOM 1175 N ILE A 76 29.785 -22.685 -5.113 1.00 45.22 N ATOM 1176 CA ILE A 76 29.902 -21.428 -5.842 1.00 63.12 C ATOM 1177 C ILE A 76 31.315 -20.864 -5.742 1.00 44.22 C ATOM 1178 O ILE A 76 31.552 -19.872 -5.052 1.00 34.44 O ATOM 1179 CB ILE A 76 28.904 -20.379 -5.318 1.00 43.54 C ATOM 1180 CG1 ILE A 76 27.493 -20.967 -5.264 1.00 21.42 C ATOM 1181 CG2 ILE A 76 28.932 -19.137 -6.197 1.00 2.54 C ATOM 1182 CD1 ILE A 76 26.459 -20.009 -4.717 1.00 0.44 C ATOM 0 H ILE A 76 29.330 -22.605 -4.204 1.00 45.22 H new ATOM 0 HA ILE A 76 29.674 -21.646 -6.885 1.00 63.12 H new ATOM 0 HB ILE A 76 29.197 -20.093 -4.308 1.00 43.54 H new ATOM 0 HG12 ILE A 76 27.197 -21.274 -6.267 1.00 21.42 H new ATOM 0 HG13 ILE A 76 27.506 -21.866 -4.647 1.00 21.42 H new ATOM 0 HG21 ILE A 76 28.221 -18.404 -5.814 1.00 2.54 H new ATOM 0 HG22 ILE A 76 29.934 -18.709 -6.190 1.00 2.54 H new ATOM 0 HG23 ILE A 76 28.660 -19.407 -7.217 1.00 2.54 H new ATOM 0 HD11 ILE A 76 25.483 -20.494 -4.708 1.00 0.44 H new ATOM 0 HD12 ILE A 76 26.731 -19.721 -3.701 1.00 0.44 H new ATOM 0 HD13 ILE A 76 26.417 -19.120 -5.347 1.00 0.44 H new ATOM 1194 N ASP A 77 32.251 -21.501 -6.437 1.00 42.23 N ATOM 1195 CA ASP A 77 33.642 -21.061 -6.430 1.00 14.14 C ATOM 1196 C ASP A 77 33.744 -19.577 -6.769 1.00 61.22 C ATOM 1197 O ASP A 77 34.351 -18.801 -6.031 1.00 52.41 O ATOM 1198 CB ASP A 77 34.464 -21.882 -7.424 1.00 22.33 C ATOM 1199 CG ASP A 77 34.448 -23.364 -7.103 1.00 60.14 C ATOM 1200 OD1 ASP A 77 33.922 -23.734 -6.033 1.00 4.52 O ATOM 1201 OD2 ASP A 77 34.962 -24.154 -7.923 1.00 72.21 O ATOM 0 H ASP A 77 32.072 -22.324 -7.013 1.00 42.23 H new ATOM 0 HA ASP A 77 34.041 -21.214 -5.427 1.00 14.14 H new ATOM 0 HB2 ASP A 77 34.074 -21.727 -8.430 1.00 22.33 H new ATOM 0 HB3 ASP A 77 35.494 -21.524 -7.423 1.00 22.33 H new ATOM 1206 N LYS A 78 33.148 -19.190 -7.892 1.00 12.24 N ATOM 1207 CA LYS A 78 33.171 -17.800 -8.330 1.00 50.53 C ATOM 1208 C LYS A 78 31.820 -17.389 -8.908 1.00 2.33 C ATOM 1209 O LYS A 78 31.482 -17.746 -10.036 1.00 23.13 O ATOM 1210 CB LYS A 78 34.269 -17.591 -9.376 1.00 20.42 C ATOM 1211 CG LYS A 78 35.606 -18.196 -8.982 1.00 52.34 C ATOM 1212 CD LYS A 78 36.225 -17.461 -7.806 1.00 3.15 C ATOM 1213 CE LYS A 78 37.153 -18.366 -7.009 1.00 15.01 C ATOM 1214 NZ LYS A 78 38.426 -18.631 -7.733 1.00 44.33 N ATOM 0 H LYS A 78 32.643 -19.820 -8.515 1.00 12.24 H new ATOM 0 HA LYS A 78 33.381 -17.175 -7.462 1.00 50.53 H new ATOM 0 HB2 LYS A 78 33.947 -18.027 -10.321 1.00 20.42 H new ATOM 0 HB3 LYS A 78 34.399 -16.522 -9.546 1.00 20.42 H new ATOM 0 HG2 LYS A 78 35.469 -19.246 -8.725 1.00 52.34 H new ATOM 0 HG3 LYS A 78 36.287 -18.162 -9.833 1.00 52.34 H new ATOM 0 HD2 LYS A 78 36.781 -16.596 -8.168 1.00 3.15 H new ATOM 0 HD3 LYS A 78 35.436 -17.083 -7.155 1.00 3.15 H new ATOM 0 HE2 LYS A 78 37.372 -17.904 -6.046 1.00 15.01 H new ATOM 0 HE3 LYS A 78 36.650 -19.310 -6.802 1.00 15.01 H new ATOM 0 HZ1 LYS A 78 39.030 -19.251 -7.157 1.00 44.33 H new ATOM 0 HZ2 LYS A 78 38.219 -19.095 -8.640 1.00 44.33 H new ATOM 0 HZ3 LYS A 78 38.919 -17.732 -7.908 1.00 44.33 H new ATOM 1228 N ALA A 79 31.053 -16.635 -8.127 1.00 52.13 N ATOM 1229 CA ALA A 79 29.741 -16.173 -8.563 1.00 11.30 C ATOM 1230 C ALA A 79 29.866 -15.024 -9.558 1.00 61.34 C ATOM 1231 O ALA A 79 30.021 -13.868 -9.169 1.00 41.44 O ATOM 1232 CB ALA A 79 28.907 -15.746 -7.364 1.00 53.01 C ATOM 0 H ALA A 79 31.318 -16.331 -7.190 1.00 52.13 H new ATOM 0 HA ALA A 79 29.240 -17.001 -9.065 1.00 11.30 H new ATOM 0 HB1 ALA A 79 27.930 -15.403 -7.704 1.00 53.01 H new ATOM 0 HB2 ALA A 79 28.780 -16.592 -6.689 1.00 53.01 H new ATOM 0 HB3 ALA A 79 29.413 -14.936 -6.839 1.00 53.01 H new ATOM 1238 N ASN A 80 29.799 -15.352 -10.845 1.00 35.24 N ATOM 1239 CA ASN A 80 29.906 -14.347 -11.896 1.00 73.42 C ATOM 1240 C ASN A 80 28.558 -13.677 -12.147 1.00 45.04 C ATOM 1241 O ASN A 80 27.556 -14.347 -12.397 1.00 22.25 O ATOM 1242 CB ASN A 80 30.420 -14.985 -13.189 1.00 11.43 C ATOM 1243 CG ASN A 80 30.300 -14.054 -14.380 1.00 1.52 C ATOM 1244 OD1 ASN A 80 29.209 -13.844 -14.910 1.00 43.54 O ATOM 1245 ND2 ASN A 80 31.425 -13.490 -14.806 1.00 32.42 N ATOM 0 H ASN A 80 29.671 -16.305 -11.184 1.00 35.24 H new ATOM 0 HA ASN A 80 30.614 -13.586 -11.567 1.00 73.42 H new ATOM 0 HB2 ASN A 80 31.463 -15.272 -13.059 1.00 11.43 H new ATOM 0 HB3 ASN A 80 29.860 -15.899 -13.388 1.00 11.43 H new ATOM 0 HD21 ASN A 80 31.407 -12.854 -15.603 1.00 32.42 H new ATOM 0 HD22 ASN A 80 32.307 -13.693 -14.336 1.00 32.42 H new ATOM 1252 N PHE A 81 28.543 -12.350 -12.081 1.00 14.22 N ATOM 1253 CA PHE A 81 27.319 -11.588 -12.301 1.00 12.14 C ATOM 1254 C PHE A 81 27.632 -10.114 -12.541 1.00 14.12 C ATOM 1255 O PHE A 81 28.781 -9.687 -12.436 1.00 34.24 O ATOM 1256 CB PHE A 81 26.380 -11.733 -11.101 1.00 2.10 C ATOM 1257 CG PHE A 81 27.067 -11.555 -9.777 1.00 43.43 C ATOM 1258 CD1 PHE A 81 27.591 -10.324 -9.414 1.00 63.40 C ATOM 1259 CD2 PHE A 81 27.189 -12.617 -8.896 1.00 53.21 C ATOM 1260 CE1 PHE A 81 28.225 -10.158 -8.197 1.00 13.00 C ATOM 1261 CE2 PHE A 81 27.821 -12.456 -7.677 1.00 73.34 C ATOM 1262 CZ PHE A 81 28.338 -11.225 -7.327 1.00 45.21 C ATOM 0 H PHE A 81 29.364 -11.780 -11.877 1.00 14.22 H new ATOM 0 HA PHE A 81 26.827 -11.986 -13.189 1.00 12.14 H new ATOM 0 HB2 PHE A 81 25.578 -11.000 -11.187 1.00 2.10 H new ATOM 0 HB3 PHE A 81 25.915 -12.719 -11.131 1.00 2.10 H new ATOM 0 HD1 PHE A 81 27.503 -9.486 -10.089 1.00 63.40 H new ATOM 0 HD2 PHE A 81 26.786 -13.582 -9.165 1.00 53.21 H new ATOM 0 HE1 PHE A 81 28.632 -9.195 -7.927 1.00 13.00 H new ATOM 0 HE2 PHE A 81 27.910 -13.292 -6.999 1.00 73.34 H new ATOM 0 HZ PHE A 81 28.830 -11.096 -6.374 1.00 45.21 H new ATOM 1272 N ASN A 82 26.600 -9.341 -12.865 1.00 33.33 N ATOM 1273 CA ASN A 82 26.764 -7.915 -13.121 1.00 73.03 C ATOM 1274 C ASN A 82 26.069 -7.085 -12.046 1.00 34.50 C ATOM 1275 O ASN A 82 25.255 -7.600 -11.280 1.00 53.03 O ATOM 1276 CB ASN A 82 26.204 -7.556 -14.499 1.00 42.03 C ATOM 1277 CG ASN A 82 27.045 -8.119 -15.629 1.00 51.31 C ATOM 1278 OD1 ASN A 82 27.171 -9.334 -15.778 1.00 23.23 O ATOM 1279 ND2 ASN A 82 27.625 -7.234 -16.432 1.00 72.21 N ATOM 0 H ASN A 82 25.642 -9.678 -12.956 1.00 33.33 H new ATOM 0 HA ASN A 82 27.830 -7.688 -13.098 1.00 73.03 H new ATOM 0 HB2 ASN A 82 25.185 -7.935 -14.584 1.00 42.03 H new ATOM 0 HB3 ASN A 82 26.150 -6.472 -14.595 1.00 42.03 H new ATOM 0 HD21 ASN A 82 28.203 -7.553 -17.210 1.00 72.21 H new ATOM 0 HD22 ASN A 82 27.493 -6.236 -16.271 1.00 72.21 H new ATOM 1286 N ASN A 83 26.396 -5.798 -11.996 1.00 34.22 N ATOM 1287 CA ASN A 83 25.803 -4.897 -11.015 1.00 12.34 C ATOM 1288 C ASN A 83 24.280 -4.988 -11.042 1.00 21.32 C ATOM 1289 O ASN A 83 23.665 -5.533 -10.126 1.00 23.14 O ATOM 1290 CB ASN A 83 26.243 -3.456 -11.283 1.00 61.22 C ATOM 1291 CG ASN A 83 27.741 -3.272 -11.135 1.00 21.41 C ATOM 1292 OD1 ASN A 83 28.449 -4.181 -10.702 1.00 64.51 O ATOM 1293 ND2 ASN A 83 28.230 -2.091 -11.494 1.00 65.44 N ATOM 0 H ASN A 83 27.068 -5.356 -12.623 1.00 34.22 H new ATOM 0 HA ASN A 83 26.150 -5.198 -10.027 1.00 12.34 H new ATOM 0 HB2 ASN A 83 25.942 -3.169 -12.290 1.00 61.22 H new ATOM 0 HB3 ASN A 83 25.728 -2.787 -10.593 1.00 61.22 H new ATOM 0 HD21 ASN A 83 29.230 -1.908 -11.416 1.00 65.44 H new ATOM 0 HD22 ASN A 83 27.605 -1.367 -11.848 1.00 65.44 H new ATOM 1300 N GLU A 84 23.679 -4.452 -12.099 1.00 41.23 N ATOM 1301 CA GLU A 84 22.228 -4.473 -12.245 1.00 64.31 C ATOM 1302 C GLU A 84 21.803 -3.807 -13.550 1.00 51.42 C ATOM 1303 O GLU A 84 22.612 -3.178 -14.233 1.00 23.23 O ATOM 1304 CB GLU A 84 21.564 -3.770 -11.060 1.00 10.30 C ATOM 1305 CG GLU A 84 20.323 -4.481 -10.548 1.00 14.30 C ATOM 1306 CD GLU A 84 19.972 -4.091 -9.125 1.00 23.10 C ATOM 1307 OE1 GLU A 84 19.465 -2.967 -8.926 1.00 73.41 O ATOM 1308 OE2 GLU A 84 20.206 -4.909 -8.211 1.00 14.12 O ATOM 0 H GLU A 84 24.174 -3.998 -12.867 1.00 41.23 H new ATOM 0 HA GLU A 84 21.905 -5.514 -12.267 1.00 64.31 H new ATOM 0 HB2 GLU A 84 22.286 -3.686 -10.247 1.00 10.30 H new ATOM 0 HB3 GLU A 84 21.296 -2.755 -11.354 1.00 10.30 H new ATOM 0 HG2 GLU A 84 19.482 -4.251 -11.202 1.00 14.30 H new ATOM 0 HG3 GLU A 84 20.480 -5.559 -10.597 1.00 14.30 H new ATOM 1315 N LYS A 85 20.527 -3.949 -13.892 1.00 13.34 N ATOM 1316 CA LYS A 85 19.991 -3.361 -15.114 1.00 1.14 C ATOM 1317 C LYS A 85 18.520 -2.996 -14.943 1.00 32.35 C ATOM 1318 O LYS A 85 17.794 -3.642 -14.187 1.00 33.04 O ATOM 1319 CB LYS A 85 20.154 -4.332 -16.285 1.00 71.11 C ATOM 1320 CG LYS A 85 19.503 -3.850 -17.570 1.00 10.21 C ATOM 1321 CD LYS A 85 20.161 -2.581 -18.086 1.00 73.11 C ATOM 1322 CE LYS A 85 19.256 -1.840 -19.059 1.00 32.14 C ATOM 1323 NZ LYS A 85 20.025 -1.234 -20.180 1.00 43.12 N ATOM 0 H LYS A 85 19.844 -4.467 -13.339 1.00 13.34 H new ATOM 0 HA LYS A 85 20.551 -2.450 -15.325 1.00 1.14 H new ATOM 0 HB2 LYS A 85 21.216 -4.496 -16.465 1.00 71.11 H new ATOM 0 HB3 LYS A 85 19.725 -5.296 -16.010 1.00 71.11 H new ATOM 0 HG2 LYS A 85 19.571 -4.630 -18.328 1.00 10.21 H new ATOM 0 HG3 LYS A 85 18.443 -3.666 -17.395 1.00 10.21 H new ATOM 0 HD2 LYS A 85 20.406 -1.930 -17.247 1.00 73.11 H new ATOM 0 HD3 LYS A 85 21.100 -2.832 -18.580 1.00 73.11 H new ATOM 0 HE2 LYS A 85 18.512 -2.529 -19.460 1.00 32.14 H new ATOM 0 HE3 LYS A 85 18.713 -1.059 -18.527 1.00 32.14 H new ATOM 0 HZ1 LYS A 85 19.373 -0.738 -20.821 1.00 43.12 H new ATOM 0 HZ2 LYS A 85 20.718 -0.558 -19.800 1.00 43.12 H new ATOM 0 HZ3 LYS A 85 20.523 -1.982 -20.704 1.00 43.12 H new ATOM 1337 N VAL A 86 18.086 -1.958 -15.651 1.00 33.44 N ATOM 1338 CA VAL A 86 16.700 -1.510 -15.579 1.00 3.22 C ATOM 1339 C VAL A 86 15.956 -1.815 -16.874 1.00 21.22 C ATOM 1340 O VAL A 86 16.478 -1.597 -17.968 1.00 30.34 O ATOM 1341 CB VAL A 86 16.614 0.001 -15.294 1.00 53.40 C ATOM 1342 CG1 VAL A 86 17.145 0.799 -16.476 1.00 35.15 C ATOM 1343 CG2 VAL A 86 15.182 0.401 -14.971 1.00 0.05 C ATOM 0 H VAL A 86 18.674 -1.412 -16.281 1.00 33.44 H new ATOM 0 HA VAL A 86 16.233 -2.055 -14.758 1.00 3.22 H new ATOM 0 HB VAL A 86 17.235 0.225 -14.427 1.00 53.40 H new ATOM 0 HG11 VAL A 86 17.076 1.864 -16.256 1.00 35.15 H new ATOM 0 HG12 VAL A 86 18.186 0.532 -16.657 1.00 35.15 H new ATOM 0 HG13 VAL A 86 16.553 0.573 -17.363 1.00 35.15 H new ATOM 0 HG21 VAL A 86 15.139 1.472 -14.772 1.00 0.05 H new ATOM 0 HG22 VAL A 86 14.538 0.163 -15.818 1.00 0.05 H new ATOM 0 HG23 VAL A 86 14.841 -0.145 -14.091 1.00 0.05 H new ATOM 1353 N ILE A 87 14.734 -2.320 -16.742 1.00 62.34 N ATOM 1354 CA ILE A 87 13.917 -2.654 -17.902 1.00 63.25 C ATOM 1355 C ILE A 87 12.492 -2.136 -17.739 1.00 45.10 C ATOM 1356 O ILE A 87 12.166 -1.487 -16.744 1.00 44.12 O ATOM 1357 CB ILE A 87 13.874 -4.175 -18.142 1.00 1.02 C ATOM 1358 CG1 ILE A 87 13.306 -4.890 -16.914 1.00 61.54 C ATOM 1359 CG2 ILE A 87 15.264 -4.699 -18.471 1.00 51.12 C ATOM 1360 CD1 ILE A 87 14.353 -5.240 -15.880 1.00 64.35 C ATOM 0 H ILE A 87 14.288 -2.507 -15.844 1.00 62.34 H new ATOM 0 HA ILE A 87 14.380 -2.172 -18.763 1.00 63.25 H new ATOM 0 HB ILE A 87 13.221 -4.376 -18.991 1.00 1.02 H new ATOM 0 HG12 ILE A 87 12.549 -4.256 -16.452 1.00 61.54 H new ATOM 0 HG13 ILE A 87 12.805 -5.803 -17.235 1.00 61.54 H new ATOM 0 HG21 ILE A 87 15.217 -5.775 -18.638 1.00 51.12 H new ATOM 0 HG22 ILE A 87 15.634 -4.208 -19.371 1.00 51.12 H new ATOM 0 HG23 ILE A 87 15.938 -4.490 -17.640 1.00 51.12 H new ATOM 0 HD11 ILE A 87 13.879 -5.744 -15.038 1.00 64.35 H new ATOM 0 HD12 ILE A 87 15.098 -5.900 -16.325 1.00 64.35 H new ATOM 0 HD13 ILE A 87 14.838 -4.329 -15.531 1.00 64.35 H new ATOM 1372 N LEU A 88 11.646 -2.428 -18.721 1.00 5.13 N ATOM 1373 CA LEU A 88 10.254 -1.993 -18.686 1.00 23.34 C ATOM 1374 C LEU A 88 9.441 -2.849 -17.720 1.00 72.22 C ATOM 1375 O LEU A 88 8.632 -2.335 -16.947 1.00 41.23 O ATOM 1376 CB LEU A 88 9.643 -2.062 -20.086 1.00 35.21 C ATOM 1377 CG LEU A 88 10.451 -1.405 -21.205 1.00 25.21 C ATOM 1378 CD1 LEU A 88 9.698 -1.481 -22.524 1.00 31.13 C ATOM 1379 CD2 LEU A 88 10.771 0.041 -20.854 1.00 22.43 C ATOM 0 H LEU A 88 11.900 -2.964 -19.551 1.00 5.13 H new ATOM 0 HA LEU A 88 10.229 -0.961 -18.336 1.00 23.34 H new ATOM 0 HB2 LEU A 88 9.491 -3.110 -20.343 1.00 35.21 H new ATOM 0 HB3 LEU A 88 8.658 -1.595 -20.054 1.00 35.21 H new ATOM 0 HG LEU A 88 11.390 -1.948 -21.315 1.00 25.21 H new ATOM 0 HD11 LEU A 88 10.289 -1.008 -23.308 1.00 31.13 H new ATOM 0 HD12 LEU A 88 9.521 -2.525 -22.782 1.00 31.13 H new ATOM 0 HD13 LEU A 88 8.743 -0.964 -22.428 1.00 31.13 H new ATOM 0 HD21 LEU A 88 11.347 0.493 -21.662 1.00 22.43 H new ATOM 0 HD22 LEU A 88 9.843 0.596 -20.715 1.00 22.43 H new ATOM 0 HD23 LEU A 88 11.353 0.072 -19.933 1.00 22.43 H new ATOM 1391 N LYS A 89 9.662 -4.159 -17.768 1.00 52.52 N ATOM 1392 CA LYS A 89 8.953 -5.087 -16.896 1.00 74.10 C ATOM 1393 C LYS A 89 9.504 -6.502 -17.045 1.00 15.34 C ATOM 1394 O LYS A 89 10.347 -6.763 -17.903 1.00 72.55 O ATOM 1395 CB LYS A 89 7.456 -5.075 -17.214 1.00 33.42 C ATOM 1396 CG LYS A 89 7.131 -5.524 -18.628 1.00 54.01 C ATOM 1397 CD LYS A 89 5.636 -5.714 -18.823 1.00 53.21 C ATOM 1398 CE LYS A 89 5.277 -5.835 -20.296 1.00 72.32 C ATOM 1399 NZ LYS A 89 3.803 -5.873 -20.507 1.00 1.42 N ATOM 0 H LYS A 89 10.327 -4.601 -18.402 1.00 52.52 H new ATOM 0 HA LYS A 89 9.102 -4.764 -15.866 1.00 74.10 H new ATOM 0 HB2 LYS A 89 6.938 -5.724 -16.508 1.00 33.42 H new ATOM 0 HB3 LYS A 89 7.069 -4.067 -17.064 1.00 33.42 H new ATOM 0 HG2 LYS A 89 7.501 -4.785 -19.339 1.00 54.01 H new ATOM 0 HG3 LYS A 89 7.648 -6.459 -18.842 1.00 54.01 H new ATOM 0 HD2 LYS A 89 5.310 -6.609 -18.293 1.00 53.21 H new ATOM 0 HD3 LYS A 89 5.101 -4.871 -18.385 1.00 53.21 H new ATOM 0 HE2 LYS A 89 5.700 -4.993 -20.843 1.00 72.32 H new ATOM 0 HE3 LYS A 89 5.726 -6.740 -20.706 1.00 72.32 H new ATOM 0 HZ1 LYS A 89 3.600 -5.956 -21.524 1.00 1.42 H new ATOM 0 HZ2 LYS A 89 3.402 -6.691 -20.006 1.00 1.42 H new ATOM 0 HZ3 LYS A 89 3.377 -4.999 -20.139 1.00 1.42 H new ATOM 1413 N LEU A 90 9.021 -7.411 -16.205 1.00 3.35 N ATOM 1414 CA LEU A 90 9.464 -8.800 -16.244 1.00 25.15 C ATOM 1415 C LEU A 90 9.290 -9.388 -17.640 1.00 62.21 C ATOM 1416 O LEU A 90 8.576 -8.831 -18.474 1.00 63.34 O ATOM 1417 CB LEU A 90 8.684 -9.634 -15.226 1.00 1.33 C ATOM 1418 CG LEU A 90 8.632 -9.078 -13.802 1.00 72.01 C ATOM 1419 CD1 LEU A 90 7.717 -9.925 -12.932 1.00 30.54 C ATOM 1420 CD2 LEU A 90 10.029 -9.012 -13.204 1.00 4.33 C ATOM 0 H LEU A 90 8.323 -7.211 -15.489 1.00 3.35 H new ATOM 0 HA LEU A 90 10.523 -8.825 -15.989 1.00 25.15 H new ATOM 0 HB2 LEU A 90 7.662 -9.749 -15.587 1.00 1.33 H new ATOM 0 HB3 LEU A 90 9.124 -10.631 -15.190 1.00 1.33 H new ATOM 0 HG LEU A 90 8.228 -8.067 -13.842 1.00 72.01 H new ATOM 0 HD11 LEU A 90 7.692 -9.515 -11.923 1.00 30.54 H new ATOM 0 HD12 LEU A 90 6.710 -9.920 -13.350 1.00 30.54 H new ATOM 0 HD13 LEU A 90 8.091 -10.948 -12.899 1.00 30.54 H new ATOM 0 HD21 LEU A 90 9.973 -8.614 -12.191 1.00 4.33 H new ATOM 0 HD22 LEU A 90 10.461 -10.012 -13.177 1.00 4.33 H new ATOM 0 HD23 LEU A 90 10.656 -8.362 -13.815 1.00 4.33 H new ATOM 1432 N ASP A 91 9.945 -10.517 -17.887 1.00 21.33 N ATOM 1433 CA ASP A 91 9.860 -11.183 -19.181 1.00 62.42 C ATOM 1434 C ASP A 91 9.213 -12.558 -19.044 1.00 25.25 C ATOM 1435 O ASP A 91 8.617 -13.073 -19.990 1.00 44.41 O ATOM 1436 CB ASP A 91 11.252 -11.321 -19.800 1.00 51.54 C ATOM 1437 CG ASP A 91 11.204 -11.437 -21.311 1.00 65.22 C ATOM 1438 OD1 ASP A 91 10.250 -10.907 -21.917 1.00 72.51 O ATOM 1439 OD2 ASP A 91 12.122 -12.059 -21.888 1.00 35.12 O ATOM 0 H ASP A 91 10.541 -10.990 -17.208 1.00 21.33 H new ATOM 0 HA ASP A 91 9.238 -10.572 -19.835 1.00 62.42 H new ATOM 0 HB2 ASP A 91 11.857 -10.457 -19.524 1.00 51.54 H new ATOM 0 HB3 ASP A 91 11.745 -12.201 -19.386 1.00 51.54 H new ATOM 1444 N TYR A 92 9.336 -13.148 -17.860 1.00 23.03 N ATOM 1445 CA TYR A 92 8.767 -14.465 -17.599 1.00 52.21 C ATOM 1446 C TYR A 92 7.420 -14.346 -16.892 1.00 40.24 C ATOM 1447 O TYR A 92 6.441 -14.980 -17.287 1.00 3.24 O ATOM 1448 CB TYR A 92 9.728 -15.301 -16.752 1.00 12.40 C ATOM 1449 CG TYR A 92 9.696 -16.777 -17.079 1.00 11.54 C ATOM 1450 CD1 TYR A 92 8.548 -17.530 -16.867 1.00 73.12 C ATOM 1451 CD2 TYR A 92 10.814 -17.418 -17.598 1.00 12.24 C ATOM 1452 CE1 TYR A 92 8.514 -18.879 -17.163 1.00 60.05 C ATOM 1453 CE2 TYR A 92 10.789 -18.766 -17.898 1.00 53.12 C ATOM 1454 CZ TYR A 92 9.637 -19.492 -17.679 1.00 73.12 C ATOM 1455 OH TYR A 92 9.608 -20.836 -17.976 1.00 2.50 O ATOM 0 H TYR A 92 9.825 -12.735 -17.066 1.00 23.03 H new ATOM 0 HA TYR A 92 8.612 -14.962 -18.557 1.00 52.21 H new ATOM 0 HB2 TYR A 92 10.742 -14.928 -16.894 1.00 12.40 H new ATOM 0 HB3 TYR A 92 9.483 -15.165 -15.699 1.00 12.40 H new ATOM 0 HD1 TYR A 92 7.667 -17.053 -16.464 1.00 73.12 H new ATOM 0 HD2 TYR A 92 11.718 -16.853 -17.770 1.00 12.24 H new ATOM 0 HE1 TYR A 92 7.614 -19.450 -16.991 1.00 60.05 H new ATOM 0 HE2 TYR A 92 11.667 -19.249 -18.302 1.00 53.12 H new ATOM 0 HH TYR A 92 10.479 -21.111 -18.332 1.00 2.50 H new ATOM 1465 N SER A 93 7.379 -13.528 -15.846 1.00 13.34 N ATOM 1466 CA SER A 93 6.154 -13.327 -15.081 1.00 13.54 C ATOM 1467 C SER A 93 5.704 -14.628 -14.423 1.00 51.23 C ATOM 1468 O SER A 93 4.518 -14.825 -14.159 1.00 73.13 O ATOM 1469 CB SER A 93 5.044 -12.789 -15.986 1.00 60.35 C ATOM 1470 OG SER A 93 5.506 -11.703 -16.770 1.00 3.43 O ATOM 0 H SER A 93 8.180 -12.994 -15.509 1.00 13.34 H new ATOM 0 HA SER A 93 6.360 -12.597 -14.298 1.00 13.54 H new ATOM 0 HB2 SER A 93 4.684 -13.585 -16.638 1.00 60.35 H new ATOM 0 HB3 SER A 93 4.198 -12.469 -15.378 1.00 60.35 H new ATOM 0 HG SER A 93 4.778 -11.379 -17.341 1.00 3.43 H new ATOM 1476 N ASP A 94 6.660 -15.512 -14.162 1.00 31.31 N ATOM 1477 CA ASP A 94 6.364 -16.795 -13.534 1.00 60.05 C ATOM 1478 C ASP A 94 7.646 -17.576 -13.263 1.00 41.13 C ATOM 1479 O ASP A 94 8.667 -17.360 -13.917 1.00 72.21 O ATOM 1480 CB ASP A 94 5.429 -17.618 -14.422 1.00 42.35 C ATOM 1481 CG ASP A 94 4.530 -18.538 -13.621 1.00 10.14 C ATOM 1482 OD1 ASP A 94 4.061 -18.117 -12.542 1.00 64.14 O ATOM 1483 OD2 ASP A 94 4.295 -19.679 -14.071 1.00 24.24 O ATOM 0 H ASP A 94 7.646 -15.364 -14.375 1.00 31.31 H new ATOM 0 HA ASP A 94 5.870 -16.600 -12.582 1.00 60.05 H new ATOM 0 HB2 ASP A 94 4.815 -16.945 -15.020 1.00 42.35 H new ATOM 0 HB3 ASP A 94 6.022 -18.211 -15.118 1.00 42.35 H new ATOM 1488 N PHE A 95 7.587 -18.483 -12.294 1.00 75.22 N ATOM 1489 CA PHE A 95 8.743 -19.295 -11.935 1.00 24.03 C ATOM 1490 C PHE A 95 8.638 -20.691 -12.542 1.00 42.22 C ATOM 1491 O PHE A 95 7.602 -21.347 -12.438 1.00 63.02 O ATOM 1492 CB PHE A 95 8.869 -19.397 -10.413 1.00 53.22 C ATOM 1493 CG PHE A 95 7.599 -19.824 -9.734 1.00 71.54 C ATOM 1494 CD1 PHE A 95 7.310 -21.168 -9.559 1.00 25.34 C ATOM 1495 CD2 PHE A 95 6.694 -18.883 -9.272 1.00 10.23 C ATOM 1496 CE1 PHE A 95 6.142 -21.564 -8.935 1.00 64.30 C ATOM 1497 CE2 PHE A 95 5.524 -19.273 -8.647 1.00 3.10 C ATOM 1498 CZ PHE A 95 5.249 -20.616 -8.478 1.00 12.44 C ATOM 0 H PHE A 95 6.750 -18.674 -11.743 1.00 75.22 H new ATOM 0 HA PHE A 95 9.633 -18.810 -12.335 1.00 24.03 H new ATOM 0 HB2 PHE A 95 9.659 -20.107 -10.169 1.00 53.22 H new ATOM 0 HB3 PHE A 95 9.176 -18.429 -10.016 1.00 53.22 H new ATOM 0 HD1 PHE A 95 8.005 -21.914 -9.914 1.00 25.34 H new ATOM 0 HD2 PHE A 95 6.905 -17.832 -9.401 1.00 10.23 H new ATOM 0 HE1 PHE A 95 5.928 -22.615 -8.805 1.00 64.30 H new ATOM 0 HE2 PHE A 95 4.826 -18.529 -8.292 1.00 3.10 H new ATOM 0 HZ PHE A 95 4.337 -20.924 -7.989 1.00 12.44 H new ATOM 1508 N GLN A 96 9.718 -21.136 -13.176 1.00 72.54 N ATOM 1509 CA GLN A 96 9.747 -22.453 -13.802 1.00 34.42 C ATOM 1510 C GLN A 96 11.176 -22.865 -14.138 1.00 21.20 C ATOM 1511 O GLN A 96 12.094 -22.046 -14.096 1.00 43.34 O ATOM 1512 CB GLN A 96 8.890 -22.458 -15.069 1.00 64.24 C ATOM 1513 CG GLN A 96 7.473 -22.960 -14.844 1.00 42.23 C ATOM 1514 CD GLN A 96 6.897 -23.649 -16.066 1.00 2.14 C ATOM 1515 OE1 GLN A 96 7.634 -24.105 -16.940 1.00 71.43 O ATOM 1516 NE2 GLN A 96 5.573 -23.728 -16.132 1.00 23.12 N ATOM 0 H GLN A 96 10.584 -20.605 -13.270 1.00 72.54 H new ATOM 0 HA GLN A 96 9.338 -23.173 -13.093 1.00 34.42 H new ATOM 0 HB2 GLN A 96 8.848 -21.447 -15.473 1.00 64.24 H new ATOM 0 HB3 GLN A 96 9.372 -23.082 -15.821 1.00 64.24 H new ATOM 0 HG2 GLN A 96 7.467 -23.654 -14.004 1.00 42.23 H new ATOM 0 HG3 GLN A 96 6.834 -22.121 -14.569 1.00 42.23 H new ATOM 0 HE21 GLN A 96 5.001 -23.336 -15.384 1.00 23.12 H new ATOM 0 HE22 GLN A 96 5.128 -24.181 -16.931 1.00 23.12 H new ATOM 1525 N ILE A 97 11.357 -24.139 -14.470 1.00 51.13 N ATOM 1526 CA ILE A 97 12.675 -24.658 -14.814 1.00 74.52 C ATOM 1527 C ILE A 97 12.697 -25.200 -16.240 1.00 4.43 C ATOM 1528 O ILE A 97 11.749 -25.847 -16.685 1.00 3.51 O ATOM 1529 CB ILE A 97 13.110 -25.775 -13.846 1.00 52.43 C ATOM 1530 CG1 ILE A 97 12.908 -25.330 -12.396 1.00 50.34 C ATOM 1531 CG2 ILE A 97 14.563 -26.153 -14.093 1.00 13.42 C ATOM 1532 CD1 ILE A 97 13.254 -26.398 -11.383 1.00 4.22 C ATOM 0 H ILE A 97 10.608 -24.830 -14.508 1.00 51.13 H new ATOM 0 HA ILE A 97 13.374 -23.825 -14.733 1.00 74.52 H new ATOM 0 HB ILE A 97 12.491 -26.654 -14.026 1.00 52.43 H new ATOM 0 HG12 ILE A 97 13.520 -24.449 -12.206 1.00 50.34 H new ATOM 0 HG13 ILE A 97 11.869 -25.032 -12.257 1.00 50.34 H new ATOM 0 HG21 ILE A 97 14.856 -26.943 -13.402 1.00 13.42 H new ATOM 0 HG22 ILE A 97 14.678 -26.506 -15.118 1.00 13.42 H new ATOM 0 HG23 ILE A 97 15.198 -25.281 -13.937 1.00 13.42 H new ATOM 0 HD11 ILE A 97 13.087 -26.013 -10.377 1.00 4.22 H new ATOM 0 HD12 ILE A 97 12.624 -27.272 -11.546 1.00 4.22 H new ATOM 0 HD13 ILE A 97 14.301 -26.680 -11.494 1.00 4.22 H new ATOM 1544 N VAL A 98 13.788 -24.932 -16.951 1.00 52.12 N ATOM 1545 CA VAL A 98 13.936 -25.394 -18.326 1.00 23.31 C ATOM 1546 C VAL A 98 14.830 -26.627 -18.398 1.00 22.25 C ATOM 1547 O VAL A 98 15.994 -26.588 -17.997 1.00 71.43 O ATOM 1548 CB VAL A 98 14.525 -24.293 -19.228 1.00 25.52 C ATOM 1549 CG1 VAL A 98 14.593 -24.766 -20.672 1.00 41.32 C ATOM 1550 CG2 VAL A 98 13.706 -23.017 -19.113 1.00 45.45 C ATOM 0 H VAL A 98 14.582 -24.398 -16.598 1.00 52.12 H new ATOM 0 HA VAL A 98 12.938 -25.650 -18.683 1.00 23.31 H new ATOM 0 HB VAL A 98 15.540 -24.077 -18.894 1.00 25.52 H new ATOM 0 HG11 VAL A 98 15.012 -23.975 -21.295 1.00 41.32 H new ATOM 0 HG12 VAL A 98 15.226 -25.651 -20.735 1.00 41.32 H new ATOM 0 HG13 VAL A 98 13.590 -25.011 -21.022 1.00 41.32 H new ATOM 0 HG21 VAL A 98 14.136 -22.250 -19.757 1.00 45.45 H new ATOM 0 HG22 VAL A 98 12.679 -23.215 -19.420 1.00 45.45 H new ATOM 0 HG23 VAL A 98 13.715 -22.671 -18.080 1.00 45.45 H new ATOM 1560 N LYS A 99 14.279 -27.722 -18.911 1.00 11.23 N ATOM 1561 CA LYS A 99 15.026 -28.968 -19.037 1.00 54.24 C ATOM 1562 C LYS A 99 15.927 -28.939 -20.267 1.00 62.05 C ATOM 1563 O LYS A 99 17.077 -29.377 -20.217 1.00 11.33 O ATOM 1564 CB LYS A 99 14.065 -30.156 -19.124 1.00 14.30 C ATOM 1565 CG LYS A 99 13.645 -30.698 -17.769 1.00 31.51 C ATOM 1566 CD LYS A 99 12.434 -29.960 -17.223 1.00 63.11 C ATOM 1567 CE LYS A 99 11.138 -30.525 -17.783 1.00 32.11 C ATOM 1568 NZ LYS A 99 10.861 -31.894 -17.267 1.00 34.15 N ATOM 0 H LYS A 99 13.317 -27.772 -19.246 1.00 11.23 H new ATOM 0 HA LYS A 99 15.652 -29.079 -18.152 1.00 54.24 H new ATOM 0 HB2 LYS A 99 13.176 -29.853 -19.677 1.00 14.30 H new ATOM 0 HB3 LYS A 99 14.539 -30.955 -19.695 1.00 14.30 H new ATOM 0 HG2 LYS A 99 13.416 -31.760 -17.856 1.00 31.51 H new ATOM 0 HG3 LYS A 99 14.474 -30.607 -17.067 1.00 31.51 H new ATOM 0 HD2 LYS A 99 12.423 -30.031 -16.135 1.00 63.11 H new ATOM 0 HD3 LYS A 99 12.509 -28.902 -17.473 1.00 63.11 H new ATOM 0 HE2 LYS A 99 10.311 -29.864 -17.522 1.00 32.11 H new ATOM 0 HE3 LYS A 99 11.194 -30.551 -18.871 1.00 32.11 H new ATOM 0 HZ1 LYS A 99 9.850 -32.111 -17.382 1.00 34.15 H new ATOM 0 HZ2 LYS A 99 11.426 -32.586 -17.799 1.00 34.15 H new ATOM 0 HZ3 LYS A 99 11.113 -31.943 -16.259 1.00 34.15 H new