USER MOD reduce.3.24.130724 H: found=0, std=0, add=776, rem=0, adj=16 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 43 THR OG1 : rot -54:sc= 1.27 USER MOD Set 1.2: A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 ASN : amide:sc=-0.00189 X(o=-0.0019,f=-0.19) USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 180:sc= -0.0342 USER MOD Single : A 12 TYR OH : rot 30:sc= 0 USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 27 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 GLN : amide:sc= 0 K(o=0,f=-2.3!) USER MOD Single : A 32 LYS NZ :NH3+ -145:sc= 1.1 (180deg=-0.304) USER MOD Single : A 33 LYS NZ :NH3+ 161:sc= -0.274 (180deg=-0.66) USER MOD Single : A 41 GLN : amide:sc= 0 K(o=0,f=-0.57) USER MOD Single : A 42 ASN : amide:sc= -0.203 K(o=-0.2,f=-2) USER MOD Single : A 49 GLN : amide:sc= -0.116 K(o=-0.12,f=-1.9!) USER MOD Single : A 51 GLN : amide:sc= -0.259 X(o=-0.26,f=-0.47) USER MOD Single : A 53 GLN : amide:sc= 0 K(o=0,f=-0.79) USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 62 MET CE :methyl 169:sc= -1.54! (180deg=-1.65) USER MOD Single : A 63 GLN : amide:sc= -1.38 K(o=-1.4,f=-2.4) USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 71 SER OG : rot 48:sc= 1.09 USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 SER OG : rot -61:sc= -1.04! USER MOD Single : A 75 HIS : no HD1:sc= 0 X(o=0,f=-0.0014) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 ASN : amide:sc= -0.512 X(o=-0.51,f=-0.57) USER MOD Single : A 82 ASN : amide:sc= -0.394 X(o=-0.39,f=-0.29) USER MOD Single : A 83 ASN : amide:sc= 0.515 K(o=0.51,f=-0.036) 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 -45:sc= 0.645 USER MOD Single : A 96 GLN : amide:sc= 0 X(o=0,f=-0.25) USER MOD Single : A 99 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.0115) USER MOD ----------------------------------------------------------------- ATOM 40 N ASN A 5 9.455 1.575 -7.961 1.00 64.54 N ATOM 41 CA ASN A 5 9.190 0.334 -8.682 1.00 0.44 C ATOM 42 C ASN A 5 10.170 0.156 -9.838 1.00 14.44 C ATOM 43 O ASN A 5 9.766 -0.002 -10.990 1.00 52.53 O ATOM 44 CB ASN A 5 7.754 0.324 -9.209 1.00 71.02 C ATOM 45 CG ASN A 5 6.728 0.385 -8.094 1.00 72.02 C ATOM 46 OD1 ASN A 5 6.580 1.409 -7.426 1.00 65.35 O ATOM 47 ND2 ASN A 5 6.013 -0.715 -7.888 1.00 13.23 N ATOM 0 HA ASN A 5 9.321 -0.496 -7.988 1.00 0.44 H new ATOM 0 HB2 ASN A 5 7.610 1.172 -9.878 1.00 71.02 H new ATOM 0 HB3 ASN A 5 7.593 -0.579 -9.798 1.00 71.02 H new ATOM 0 HD21 ASN A 5 5.307 -0.734 -7.152 1.00 13.23 H new ATOM 0 HD22 ASN A 5 6.170 -1.541 -8.466 1.00 13.23 H new ATOM 54 N THR A 6 11.461 0.182 -9.522 1.00 13.35 N ATOM 55 CA THR A 6 12.498 0.025 -10.533 1.00 25.54 C ATOM 56 C THR A 6 12.788 -1.448 -10.798 1.00 71.32 C ATOM 57 O THR A 6 13.634 -2.054 -10.139 1.00 61.12 O ATOM 58 CB THR A 6 13.804 0.725 -10.111 1.00 62.24 C ATOM 59 OG1 THR A 6 13.514 2.021 -9.576 1.00 24.22 O ATOM 60 CG2 THR A 6 14.752 0.859 -11.294 1.00 13.51 C ATOM 0 H THR A 6 11.813 0.310 -8.573 1.00 13.35 H new ATOM 0 HA THR A 6 12.123 0.489 -11.445 1.00 25.54 H new ATOM 0 HB THR A 6 14.286 0.117 -9.346 1.00 62.24 H new ATOM 0 HG1 THR A 6 14.349 2.459 -9.309 1.00 24.22 H new ATOM 0 HG21 THR A 6 15.667 1.356 -10.972 1.00 13.51 H new ATOM 0 HG22 THR A 6 14.993 -0.131 -11.681 1.00 13.51 H new ATOM 0 HG23 THR A 6 14.275 1.448 -12.077 1.00 13.51 H new ATOM 68 N LEU A 7 12.081 -2.020 -11.767 1.00 44.22 N ATOM 69 CA LEU A 7 12.263 -3.423 -12.121 1.00 63.30 C ATOM 70 C LEU A 7 13.552 -3.623 -12.912 1.00 40.12 C ATOM 71 O LEU A 7 13.763 -2.986 -13.945 1.00 75.41 O ATOM 72 CB LEU A 7 11.069 -3.923 -12.935 1.00 72.34 C ATOM 73 CG LEU A 7 9.851 -4.380 -12.130 1.00 45.44 C ATOM 74 CD1 LEU A 7 10.221 -5.534 -11.212 1.00 1.12 C ATOM 75 CD2 LEU A 7 9.277 -3.221 -11.329 1.00 1.40 C ATOM 0 H LEU A 7 11.376 -1.533 -12.321 1.00 44.22 H new ATOM 0 HA LEU A 7 12.332 -3.999 -11.198 1.00 63.30 H new ATOM 0 HB2 LEU A 7 10.755 -3.126 -13.609 1.00 72.34 H new ATOM 0 HB3 LEU A 7 11.401 -4.754 -13.557 1.00 72.34 H new ATOM 0 HG LEU A 7 9.088 -4.728 -12.826 1.00 45.44 H new ATOM 0 HD11 LEU A 7 9.342 -5.846 -10.647 1.00 1.12 H new ATOM 0 HD12 LEU A 7 10.585 -6.371 -11.808 1.00 1.12 H new ATOM 0 HD13 LEU A 7 11.001 -5.214 -10.521 1.00 1.12 H new ATOM 0 HD21 LEU A 7 8.411 -3.564 -10.762 1.00 1.40 H new ATOM 0 HD22 LEU A 7 10.034 -2.843 -10.642 1.00 1.40 H new ATOM 0 HD23 LEU A 7 8.974 -2.424 -12.008 1.00 1.40 H new ATOM 87 N ILE A 8 14.410 -4.512 -12.422 1.00 14.51 N ATOM 88 CA ILE A 8 15.676 -4.797 -13.085 1.00 73.11 C ATOM 89 C ILE A 8 15.774 -6.269 -13.472 1.00 10.11 C ATOM 90 O ILE A 8 14.974 -7.093 -13.029 1.00 13.53 O ATOM 91 CB ILE A 8 16.875 -4.432 -12.190 1.00 51.14 C ATOM 92 CG1 ILE A 8 16.712 -5.055 -10.802 1.00 52.34 C ATOM 93 CG2 ILE A 8 17.017 -2.921 -12.085 1.00 54.25 C ATOM 94 CD1 ILE A 8 17.988 -5.063 -9.990 1.00 71.11 C ATOM 0 H ILE A 8 14.251 -5.047 -11.568 1.00 14.51 H new ATOM 0 HA ILE A 8 15.706 -4.184 -13.986 1.00 73.11 H new ATOM 0 HB ILE A 8 17.782 -4.832 -12.643 1.00 51.14 H new ATOM 0 HG12 ILE A 8 15.946 -4.507 -10.254 1.00 52.34 H new ATOM 0 HG13 ILE A 8 16.354 -6.079 -10.912 1.00 52.34 H new ATOM 0 HG21 ILE A 8 17.869 -2.679 -11.449 1.00 54.25 H new ATOM 0 HG22 ILE A 8 17.174 -2.500 -13.078 1.00 54.25 H new ATOM 0 HG23 ILE A 8 16.110 -2.499 -11.652 1.00 54.25 H new ATOM 0 HD11 ILE A 8 17.798 -5.519 -9.018 1.00 71.11 H new ATOM 0 HD12 ILE A 8 18.751 -5.636 -10.517 1.00 71.11 H new ATOM 0 HD13 ILE A 8 18.336 -4.040 -9.849 1.00 71.11 H new ATOM 106 N SER A 9 16.762 -6.593 -14.300 1.00 51.21 N ATOM 107 CA SER A 9 16.964 -7.965 -14.749 1.00 23.45 C ATOM 108 C SER A 9 18.452 -8.292 -14.845 1.00 14.33 C ATOM 109 O SER A 9 19.237 -7.510 -15.381 1.00 22.11 O ATOM 110 CB SER A 9 16.294 -8.185 -16.106 1.00 34.11 C ATOM 111 OG SER A 9 16.712 -7.210 -17.045 1.00 61.02 O ATOM 0 H SER A 9 17.435 -5.924 -14.673 1.00 51.21 H new ATOM 0 HA SER A 9 16.509 -8.631 -14.016 1.00 23.45 H new ATOM 0 HB2 SER A 9 16.537 -9.180 -16.478 1.00 34.11 H new ATOM 0 HB3 SER A 9 15.211 -8.143 -15.991 1.00 34.11 H new ATOM 0 HG SER A 9 16.271 -7.374 -17.905 1.00 61.02 H new ATOM 117 N VAL A 10 18.831 -9.453 -14.321 1.00 4.13 N ATOM 118 CA VAL A 10 20.224 -9.885 -14.348 1.00 13.14 C ATOM 119 C VAL A 10 20.330 -11.402 -14.243 1.00 25.01 C ATOM 120 O VAL A 10 19.501 -12.050 -13.605 1.00 73.52 O ATOM 121 CB VAL A 10 21.032 -9.244 -13.204 1.00 23.21 C ATOM 122 CG1 VAL A 10 20.552 -9.760 -11.856 1.00 15.51 C ATOM 123 CG2 VAL A 10 22.518 -9.512 -13.387 1.00 64.43 C ATOM 0 H VAL A 10 18.194 -10.111 -13.873 1.00 4.13 H new ATOM 0 HA VAL A 10 20.639 -9.560 -15.302 1.00 13.14 H new ATOM 0 HB VAL A 10 20.874 -8.166 -13.231 1.00 23.21 H new ATOM 0 HG11 VAL A 10 21.135 -9.296 -11.060 1.00 15.51 H new ATOM 0 HG12 VAL A 10 19.498 -9.513 -11.726 1.00 15.51 H new ATOM 0 HG13 VAL A 10 20.678 -10.842 -11.815 1.00 15.51 H new ATOM 0 HG21 VAL A 10 23.074 -9.052 -12.570 1.00 64.43 H new ATOM 0 HG22 VAL A 10 22.696 -10.587 -13.387 1.00 64.43 H new ATOM 0 HG23 VAL A 10 22.850 -9.089 -14.335 1.00 64.43 H new ATOM 133 N ASP A 11 21.357 -11.962 -14.873 1.00 4.04 N ATOM 134 CA ASP A 11 21.575 -13.404 -14.849 1.00 55.13 C ATOM 135 C ASP A 11 22.574 -13.785 -13.762 1.00 62.40 C ATOM 136 O ASP A 11 23.186 -12.920 -13.136 1.00 10.34 O ATOM 137 CB ASP A 11 22.074 -13.888 -16.211 1.00 41.14 C ATOM 138 CG ASP A 11 23.402 -13.265 -16.596 1.00 55.21 C ATOM 139 OD1 ASP A 11 24.413 -13.563 -15.927 1.00 43.21 O ATOM 140 OD2 ASP A 11 23.429 -12.480 -17.567 1.00 12.23 O ATOM 0 H ASP A 11 22.052 -11.439 -15.407 1.00 4.04 H new ATOM 0 HA ASP A 11 20.623 -13.887 -14.627 1.00 55.13 H new ATOM 0 HB2 ASP A 11 22.177 -14.973 -16.192 1.00 41.14 H new ATOM 0 HB3 ASP A 11 21.331 -13.651 -16.972 1.00 41.14 H new ATOM 145 N TYR A 12 22.734 -15.086 -13.543 1.00 1.34 N ATOM 146 CA TYR A 12 23.657 -15.582 -12.529 1.00 12.15 C ATOM 147 C TYR A 12 24.516 -16.715 -13.081 1.00 40.14 C ATOM 148 O TYR A 12 24.082 -17.469 -13.951 1.00 32.51 O ATOM 149 CB TYR A 12 22.885 -16.065 -11.300 1.00 20.25 C ATOM 150 CG TYR A 12 22.287 -14.944 -10.481 1.00 15.23 C ATOM 151 CD1 TYR A 12 21.229 -14.187 -10.971 1.00 62.22 C ATOM 152 CD2 TYR A 12 22.779 -14.640 -9.217 1.00 74.24 C ATOM 153 CE1 TYR A 12 20.680 -13.161 -10.227 1.00 75.21 C ATOM 154 CE2 TYR A 12 22.234 -13.617 -8.466 1.00 22.02 C ATOM 155 CZ TYR A 12 21.185 -12.880 -8.975 1.00 21.31 C ATOM 156 OH TYR A 12 20.641 -11.859 -8.230 1.00 30.42 O ATOM 0 H TYR A 12 22.237 -15.815 -14.054 1.00 1.34 H new ATOM 0 HA TYR A 12 24.313 -14.761 -12.239 1.00 12.15 H new ATOM 0 HB2 TYR A 12 22.087 -16.734 -11.622 1.00 20.25 H new ATOM 0 HB3 TYR A 12 23.554 -16.649 -10.668 1.00 20.25 H new ATOM 0 HD1 TYR A 12 20.829 -14.405 -11.950 1.00 62.22 H new ATOM 0 HD2 TYR A 12 23.601 -15.213 -8.815 1.00 74.24 H new ATOM 0 HE1 TYR A 12 19.859 -12.582 -10.624 1.00 75.21 H new ATOM 0 HE2 TYR A 12 22.627 -13.395 -7.485 1.00 22.02 H new ATOM 0 HH TYR A 12 19.692 -11.760 -8.455 1.00 30.42 H new ATOM 166 N GLU A 13 25.738 -16.827 -12.569 1.00 14.41 N ATOM 167 CA GLU A 13 26.658 -17.867 -13.011 1.00 65.12 C ATOM 168 C GLU A 13 27.420 -18.458 -11.828 1.00 61.34 C ATOM 169 O GLU A 13 28.171 -17.758 -11.148 1.00 33.42 O ATOM 170 CB GLU A 13 27.645 -17.304 -14.037 1.00 35.21 C ATOM 171 CG GLU A 13 28.759 -18.270 -14.403 1.00 51.25 C ATOM 172 CD GLU A 13 29.955 -18.158 -13.479 1.00 25.03 C ATOM 173 OE1 GLU A 13 30.634 -17.111 -13.510 1.00 4.40 O ATOM 174 OE2 GLU A 13 30.212 -19.119 -12.723 1.00 44.13 O ATOM 0 H GLU A 13 26.113 -16.210 -11.848 1.00 14.41 H new ATOM 0 HA GLU A 13 26.073 -18.660 -13.477 1.00 65.12 H new ATOM 0 HB2 GLU A 13 27.100 -17.031 -14.941 1.00 35.21 H new ATOM 0 HB3 GLU A 13 28.085 -16.388 -13.641 1.00 35.21 H new ATOM 0 HG2 GLU A 13 28.375 -19.290 -14.372 1.00 51.25 H new ATOM 0 HG3 GLU A 13 29.077 -18.080 -15.428 1.00 51.25 H new ATOM 181 N ILE A 14 27.221 -19.750 -11.590 1.00 34.11 N ATOM 182 CA ILE A 14 27.888 -20.435 -10.490 1.00 64.54 C ATOM 183 C ILE A 14 29.066 -21.264 -10.993 1.00 75.32 C ATOM 184 O ILE A 14 29.057 -21.753 -12.123 1.00 41.33 O ATOM 185 CB ILE A 14 26.917 -21.355 -9.727 1.00 13.30 C ATOM 186 CG1 ILE A 14 25.630 -20.601 -9.384 1.00 4.34 C ATOM 187 CG2 ILE A 14 27.576 -21.891 -8.465 1.00 11.31 C ATOM 188 CD1 ILE A 14 25.861 -19.366 -8.541 1.00 15.21 C ATOM 0 H ILE A 14 26.603 -20.343 -12.144 1.00 34.11 H new ATOM 0 HA ILE A 14 28.252 -19.663 -9.812 1.00 64.54 H new ATOM 0 HB ILE A 14 26.662 -22.200 -10.366 1.00 13.30 H new ATOM 0 HG12 ILE A 14 25.130 -20.312 -10.309 1.00 4.34 H new ATOM 0 HG13 ILE A 14 24.955 -21.273 -8.853 1.00 4.34 H new ATOM 0 HG21 ILE A 14 26.877 -22.539 -7.937 1.00 11.31 H new ATOM 0 HG22 ILE A 14 28.467 -22.459 -8.733 1.00 11.31 H new ATOM 0 HG23 ILE A 14 27.857 -21.059 -7.820 1.00 11.31 H new ATOM 0 HD11 ILE A 14 24.906 -18.882 -8.336 1.00 15.21 H new ATOM 0 HD12 ILE A 14 26.333 -19.650 -7.601 1.00 15.21 H new ATOM 0 HD13 ILE A 14 26.510 -18.675 -9.078 1.00 15.21 H new ATOM 200 N PHE A 15 30.077 -21.420 -10.146 1.00 20.45 N ATOM 201 CA PHE A 15 31.262 -22.191 -10.503 1.00 61.31 C ATOM 202 C PHE A 15 31.700 -23.084 -9.345 1.00 41.34 C ATOM 203 O PHE A 15 31.639 -22.686 -8.183 1.00 1.21 O ATOM 204 CB PHE A 15 32.405 -21.255 -10.901 1.00 11.13 C ATOM 205 CG PHE A 15 33.618 -21.975 -11.416 1.00 42.20 C ATOM 206 CD1 PHE A 15 33.514 -22.870 -12.468 1.00 52.05 C ATOM 207 CD2 PHE A 15 34.863 -21.756 -10.848 1.00 60.15 C ATOM 208 CE1 PHE A 15 34.629 -23.534 -12.944 1.00 35.30 C ATOM 209 CE2 PHE A 15 35.982 -22.417 -11.320 1.00 75.30 C ATOM 210 CZ PHE A 15 35.864 -23.307 -12.370 1.00 1.21 C ATOM 0 H PHE A 15 30.100 -21.023 -9.207 1.00 20.45 H new ATOM 0 HA PHE A 15 31.009 -22.826 -11.352 1.00 61.31 H new ATOM 0 HB2 PHE A 15 32.049 -20.566 -11.667 1.00 11.13 H new ATOM 0 HB3 PHE A 15 32.689 -20.654 -10.037 1.00 11.13 H new ATOM 0 HD1 PHE A 15 32.551 -23.051 -12.922 1.00 52.05 H new ATOM 0 HD2 PHE A 15 34.960 -21.061 -10.027 1.00 60.15 H new ATOM 0 HE1 PHE A 15 34.534 -24.230 -13.764 1.00 35.30 H new ATOM 0 HE2 PHE A 15 36.947 -22.238 -10.869 1.00 75.30 H new ATOM 0 HZ PHE A 15 36.736 -23.824 -12.741 1.00 1.21 H new ATOM 220 N GLY A 16 32.142 -24.294 -9.673 1.00 73.33 N ATOM 221 CA GLY A 16 32.583 -25.225 -8.651 1.00 31.00 C ATOM 222 C GLY A 16 31.940 -26.590 -8.793 1.00 74.22 C ATOM 223 O GLY A 16 32.036 -27.224 -9.844 1.00 62.32 O ATOM 0 H GLY A 16 32.203 -24.646 -10.628 1.00 73.33 H new ATOM 0 HA2 GLY A 16 33.667 -25.330 -8.703 1.00 31.00 H new ATOM 0 HA3 GLY A 16 32.349 -24.817 -7.667 1.00 31.00 H new ATOM 227 N LYS A 17 31.282 -27.046 -7.732 1.00 60.05 N ATOM 228 CA LYS A 17 30.620 -28.345 -7.742 1.00 61.21 C ATOM 229 C LYS A 17 29.168 -28.213 -8.191 1.00 44.13 C ATOM 230 O LYS A 17 28.264 -28.778 -7.576 1.00 51.22 O ATOM 231 CB LYS A 17 30.679 -28.981 -6.351 1.00 52.22 C ATOM 232 CG LYS A 17 30.286 -30.448 -6.336 1.00 24.01 C ATOM 233 CD LYS A 17 31.486 -31.349 -6.577 1.00 3.34 C ATOM 234 CE LYS A 17 31.068 -32.690 -7.161 1.00 5.53 C ATOM 235 NZ LYS A 17 32.158 -33.700 -7.064 1.00 73.30 N ATOM 0 H LYS A 17 31.193 -26.535 -6.854 1.00 60.05 H new ATOM 0 HA LYS A 17 31.144 -28.986 -8.451 1.00 61.21 H new ATOM 0 HB2 LYS A 17 31.690 -28.880 -5.957 1.00 52.22 H new ATOM 0 HB3 LYS A 17 30.020 -28.430 -5.680 1.00 52.22 H new ATOM 0 HG2 LYS A 17 29.832 -30.694 -5.376 1.00 24.01 H new ATOM 0 HG3 LYS A 17 29.532 -30.632 -7.102 1.00 24.01 H new ATOM 0 HD2 LYS A 17 32.182 -30.856 -7.256 1.00 3.34 H new ATOM 0 HD3 LYS A 17 32.016 -31.509 -5.638 1.00 3.34 H new ATOM 0 HE2 LYS A 17 30.186 -33.056 -6.636 1.00 5.53 H new ATOM 0 HE3 LYS A 17 30.786 -32.559 -8.206 1.00 5.53 H new ATOM 0 HZ1 LYS A 17 31.835 -34.600 -7.472 1.00 73.30 H new ATOM 0 HZ2 LYS A 17 32.992 -33.362 -7.586 1.00 73.30 H new ATOM 0 HZ3 LYS A 17 32.410 -33.844 -6.065 1.00 73.30 H new ATOM 249 N VAL A 18 28.953 -27.464 -9.268 1.00 73.23 N ATOM 250 CA VAL A 18 27.611 -27.260 -9.801 1.00 61.24 C ATOM 251 C VAL A 18 27.436 -27.973 -11.138 1.00 5.22 C ATOM 252 O VAL A 18 26.691 -27.514 -12.003 1.00 64.53 O ATOM 253 CB VAL A 18 27.302 -25.763 -9.986 1.00 45.45 C ATOM 254 CG1 VAL A 18 27.055 -25.098 -8.641 1.00 12.01 C ATOM 255 CG2 VAL A 18 28.436 -25.073 -10.730 1.00 64.32 C ATOM 0 H VAL A 18 29.690 -26.989 -9.788 1.00 73.23 H new ATOM 0 HA VAL A 18 26.915 -27.680 -9.075 1.00 61.24 H new ATOM 0 HB VAL A 18 26.395 -25.669 -10.583 1.00 45.45 H new ATOM 0 HG11 VAL A 18 26.838 -24.041 -8.792 1.00 12.01 H new ATOM 0 HG12 VAL A 18 26.207 -25.575 -8.149 1.00 12.01 H new ATOM 0 HG13 VAL A 18 27.942 -25.201 -8.016 1.00 12.01 H new ATOM 0 HG21 VAL A 18 28.201 -24.016 -10.852 1.00 64.32 H new ATOM 0 HG22 VAL A 18 29.360 -25.176 -10.161 1.00 64.32 H new ATOM 0 HG23 VAL A 18 28.560 -25.532 -11.711 1.00 64.32 H new ATOM 265 N GLN A 19 28.128 -29.096 -11.298 1.00 23.32 N ATOM 266 CA GLN A 19 28.049 -29.872 -12.530 1.00 24.43 C ATOM 267 C GLN A 19 27.255 -31.156 -12.314 1.00 73.24 C ATOM 268 O GLN A 19 26.328 -31.458 -13.065 1.00 62.03 O ATOM 269 CB GLN A 19 29.453 -30.207 -13.038 1.00 0.44 C ATOM 270 CG GLN A 19 30.086 -29.092 -13.855 1.00 75.03 C ATOM 271 CD GLN A 19 31.557 -29.331 -14.128 1.00 64.40 C ATOM 272 OE1 GLN A 19 32.403 -28.491 -13.819 1.00 54.21 O ATOM 273 NE2 GLN A 19 31.872 -30.483 -14.710 1.00 4.33 N ATOM 0 H GLN A 19 28.749 -29.489 -10.591 1.00 23.32 H new ATOM 0 HA GLN A 19 27.534 -29.268 -13.277 1.00 24.43 H new ATOM 0 HB2 GLN A 19 30.095 -30.431 -12.186 1.00 0.44 H new ATOM 0 HB3 GLN A 19 29.404 -31.110 -13.647 1.00 0.44 H new ATOM 0 HG2 GLN A 19 29.556 -28.995 -14.802 1.00 75.03 H new ATOM 0 HG3 GLN A 19 29.968 -28.147 -13.325 1.00 75.03 H new ATOM 0 HE21 GLN A 19 31.139 -31.151 -14.949 1.00 4.33 H new ATOM 0 HE22 GLN A 19 32.847 -30.700 -14.918 1.00 4.33 H new ATOM 282 N GLY A 20 27.624 -31.909 -11.283 1.00 24.52 N ATOM 283 CA GLY A 20 26.936 -33.152 -10.988 1.00 20.54 C ATOM 284 C GLY A 20 25.871 -32.986 -9.922 1.00 23.55 C ATOM 285 O GLY A 20 25.748 -33.818 -9.022 1.00 72.12 O ATOM 0 H GLY A 20 28.387 -31.680 -10.646 1.00 24.52 H new ATOM 0 HA2 GLY A 20 26.477 -33.535 -11.899 1.00 20.54 H new ATOM 0 HA3 GLY A 20 27.662 -33.896 -10.660 1.00 20.54 H new ATOM 289 N VAL A 21 25.100 -31.908 -10.020 1.00 63.11 N ATOM 290 CA VAL A 21 24.041 -31.635 -9.056 1.00 71.04 C ATOM 291 C VAL A 21 22.852 -30.954 -9.725 1.00 72.40 C ATOM 292 O VAL A 21 23.006 -30.253 -10.725 1.00 72.01 O ATOM 293 CB VAL A 21 24.546 -30.746 -7.904 1.00 73.31 C ATOM 294 CG1 VAL A 21 24.879 -29.352 -8.412 1.00 4.22 C ATOM 295 CG2 VAL A 21 23.513 -30.684 -6.789 1.00 4.35 C ATOM 0 H VAL A 21 25.189 -31.209 -10.758 1.00 63.11 H new ATOM 0 HA VAL A 21 23.725 -32.597 -8.651 1.00 71.04 H new ATOM 0 HB VAL A 21 25.458 -31.186 -7.500 1.00 73.31 H new ATOM 0 HG11 VAL A 21 25.234 -28.738 -7.584 1.00 4.22 H new ATOM 0 HG12 VAL A 21 25.656 -29.418 -9.174 1.00 4.22 H new ATOM 0 HG13 VAL A 21 23.986 -28.899 -8.843 1.00 4.22 H new ATOM 0 HG21 VAL A 21 23.885 -30.052 -5.983 1.00 4.35 H new ATOM 0 HG22 VAL A 21 22.583 -30.267 -7.177 1.00 4.35 H new ATOM 0 HG23 VAL A 21 23.329 -31.688 -6.407 1.00 4.35 H new ATOM 305 N PHE A 22 21.665 -31.166 -9.166 1.00 11.32 N ATOM 306 CA PHE A 22 20.448 -30.573 -9.708 1.00 51.11 C ATOM 307 C PHE A 22 19.972 -29.414 -8.836 1.00 62.34 C ATOM 308 O PHE A 22 18.777 -29.263 -8.584 1.00 12.15 O ATOM 309 CB PHE A 22 19.346 -31.629 -9.818 1.00 41.12 C ATOM 310 CG PHE A 22 19.163 -32.437 -8.566 1.00 22.24 C ATOM 311 CD1 PHE A 22 19.877 -33.608 -8.371 1.00 24.53 C ATOM 312 CD2 PHE A 22 18.278 -32.026 -7.583 1.00 14.42 C ATOM 313 CE1 PHE A 22 19.710 -34.354 -7.219 1.00 62.53 C ATOM 314 CE2 PHE A 22 18.107 -32.767 -6.429 1.00 35.30 C ATOM 315 CZ PHE A 22 18.825 -33.933 -6.247 1.00 13.33 C ATOM 0 H PHE A 22 21.520 -31.744 -8.338 1.00 11.32 H new ATOM 0 HA PHE A 22 20.673 -30.188 -10.702 1.00 51.11 H new ATOM 0 HB2 PHE A 22 18.405 -31.136 -10.064 1.00 41.12 H new ATOM 0 HB3 PHE A 22 19.579 -32.301 -10.644 1.00 41.12 H new ATOM 0 HD1 PHE A 22 20.572 -33.942 -9.127 1.00 24.53 H new ATOM 0 HD2 PHE A 22 17.714 -31.115 -7.720 1.00 14.42 H new ATOM 0 HE1 PHE A 22 20.272 -35.266 -7.080 1.00 62.53 H new ATOM 0 HE2 PHE A 22 17.413 -32.435 -5.671 1.00 35.30 H new ATOM 0 HZ PHE A 22 18.694 -34.514 -5.346 1.00 13.33 H new ATOM 325 N PHE A 23 20.917 -28.599 -8.379 1.00 71.03 N ATOM 326 CA PHE A 23 20.596 -27.455 -7.534 1.00 52.44 C ATOM 327 C PHE A 23 19.580 -26.543 -8.217 1.00 4.31 C ATOM 328 O PHE A 23 18.833 -25.823 -7.554 1.00 42.44 O ATOM 329 CB PHE A 23 21.865 -26.666 -7.203 1.00 73.24 C ATOM 330 CG PHE A 23 22.399 -25.876 -8.364 1.00 2.05 C ATOM 331 CD1 PHE A 23 23.069 -26.508 -9.399 1.00 53.42 C ATOM 332 CD2 PHE A 23 22.232 -24.502 -8.419 1.00 14.33 C ATOM 333 CE1 PHE A 23 23.562 -25.783 -10.467 1.00 42.44 C ATOM 334 CE2 PHE A 23 22.723 -23.771 -9.485 1.00 35.44 C ATOM 335 CZ PHE A 23 23.388 -24.413 -10.511 1.00 32.12 C ATOM 0 H PHE A 23 21.911 -28.710 -8.580 1.00 71.03 H new ATOM 0 HA PHE A 23 20.158 -27.830 -6.609 1.00 52.44 H new ATOM 0 HB2 PHE A 23 21.656 -25.986 -6.377 1.00 73.24 H new ATOM 0 HB3 PHE A 23 22.634 -27.358 -6.860 1.00 73.24 H new ATOM 0 HD1 PHE A 23 23.207 -27.579 -9.371 1.00 53.42 H new ATOM 0 HD2 PHE A 23 21.712 -23.995 -7.619 1.00 14.33 H new ATOM 0 HE1 PHE A 23 24.083 -26.287 -11.267 1.00 42.44 H new ATOM 0 HE2 PHE A 23 22.587 -22.700 -9.515 1.00 35.44 H new ATOM 0 HZ PHE A 23 23.771 -23.845 -11.346 1.00 32.12 H new ATOM 345 N ARG A 24 19.560 -26.579 -9.545 1.00 62.12 N ATOM 346 CA ARG A 24 18.639 -25.755 -10.318 1.00 74.32 C ATOM 347 C ARG A 24 17.205 -25.938 -9.829 1.00 11.11 C ATOM 348 O ARG A 24 16.407 -25.000 -9.845 1.00 64.10 O ATOM 349 CB ARG A 24 18.730 -26.107 -11.804 1.00 44.12 C ATOM 350 CG ARG A 24 18.370 -27.551 -12.112 1.00 25.33 C ATOM 351 CD ARG A 24 18.504 -27.855 -13.596 1.00 12.22 C ATOM 352 NE ARG A 24 17.840 -29.103 -13.961 1.00 34.21 N ATOM 353 CZ ARG A 24 18.379 -30.303 -13.778 1.00 71.31 C ATOM 354 NH1 ARG A 24 19.584 -30.417 -13.237 1.00 50.30 N ATOM 355 NH2 ARG A 24 17.712 -31.393 -14.136 1.00 61.22 N ATOM 0 H ARG A 24 20.171 -27.170 -10.108 1.00 62.12 H new ATOM 0 HA ARG A 24 18.922 -24.711 -10.180 1.00 74.32 H new ATOM 0 HB2 ARG A 24 18.067 -25.449 -12.366 1.00 44.12 H new ATOM 0 HB3 ARG A 24 19.744 -25.912 -12.153 1.00 44.12 H new ATOM 0 HG2 ARG A 24 19.018 -28.218 -11.543 1.00 25.33 H new ATOM 0 HG3 ARG A 24 17.348 -27.749 -11.790 1.00 25.33 H new ATOM 0 HD2 ARG A 24 18.078 -27.035 -14.174 1.00 12.22 H new ATOM 0 HD3 ARG A 24 19.560 -27.916 -13.860 1.00 12.22 H new ATOM 0 HE ARG A 24 16.911 -29.050 -14.379 1.00 34.21 H new ATOM 0 HH11 ARG A 24 20.100 -29.582 -12.960 1.00 50.30 H new ATOM 0 HH12 ARG A 24 19.995 -31.340 -13.098 1.00 50.30 H new ATOM 0 HH21 ARG A 24 16.784 -31.310 -14.552 1.00 61.22 H new ATOM 0 HH22 ARG A 24 18.127 -32.314 -13.995 1.00 61.22 H new ATOM 369 N LYS A 25 16.884 -27.152 -9.394 1.00 54.25 N ATOM 370 CA LYS A 25 15.547 -27.459 -8.900 1.00 11.04 C ATOM 371 C LYS A 25 15.197 -26.586 -7.699 1.00 4.32 C ATOM 372 O LYS A 25 14.042 -26.204 -7.512 1.00 34.15 O ATOM 373 CB LYS A 25 15.451 -28.937 -8.514 1.00 54.12 C ATOM 374 CG LYS A 25 15.408 -29.875 -9.708 1.00 32.22 C ATOM 375 CD LYS A 25 15.256 -31.323 -9.273 1.00 62.44 C ATOM 376 CE LYS A 25 13.807 -31.662 -8.957 1.00 45.31 C ATOM 377 NZ LYS A 25 13.545 -33.124 -9.058 1.00 33.14 N ATOM 0 H LYS A 25 17.532 -27.939 -9.374 1.00 54.25 H new ATOM 0 HA LYS A 25 14.835 -27.251 -9.699 1.00 11.04 H new ATOM 0 HB2 LYS A 25 16.305 -29.197 -7.889 1.00 54.12 H new ATOM 0 HB3 LYS A 25 14.556 -29.089 -7.910 1.00 54.12 H new ATOM 0 HG2 LYS A 25 14.577 -29.600 -10.358 1.00 32.22 H new ATOM 0 HG3 LYS A 25 16.321 -29.764 -10.293 1.00 32.22 H new ATOM 0 HD2 LYS A 25 15.621 -31.981 -10.062 1.00 62.44 H new ATOM 0 HD3 LYS A 25 15.874 -31.506 -8.394 1.00 62.44 H new ATOM 0 HE2 LYS A 25 13.565 -31.318 -7.951 1.00 45.31 H new ATOM 0 HE3 LYS A 25 13.151 -31.127 -9.644 1.00 45.31 H new ATOM 0 HZ1 LYS A 25 12.547 -33.314 -8.835 1.00 33.14 H new ATOM 0 HZ2 LYS A 25 13.752 -33.448 -10.024 1.00 33.14 H new ATOM 0 HZ3 LYS A 25 14.153 -33.633 -8.385 1.00 33.14 H new ATOM 391 N HIS A 26 16.203 -26.271 -6.888 1.00 62.45 N ATOM 392 CA HIS A 26 16.002 -25.441 -5.707 1.00 13.25 C ATOM 393 C HIS A 26 15.854 -23.972 -6.093 1.00 74.43 C ATOM 394 O HIS A 26 15.104 -23.226 -5.464 1.00 14.44 O ATOM 395 CB HIS A 26 17.170 -25.609 -4.734 1.00 55.11 C ATOM 396 CG HIS A 26 16.923 -26.637 -3.674 1.00 34.25 C ATOM 397 ND1 HIS A 26 16.401 -26.330 -2.434 1.00 62.24 N ATOM 398 CD2 HIS A 26 17.127 -27.975 -3.673 1.00 61.20 C ATOM 399 CE1 HIS A 26 16.297 -27.435 -1.717 1.00 43.40 C ATOM 400 NE2 HIS A 26 16.731 -28.447 -2.446 1.00 32.21 N ATOM 0 H HIS A 26 17.165 -26.579 -7.028 1.00 62.45 H new ATOM 0 HA HIS A 26 15.083 -25.765 -5.219 1.00 13.25 H new ATOM 0 HB2 HIS A 26 18.063 -25.885 -5.295 1.00 55.11 H new ATOM 0 HB3 HIS A 26 17.376 -24.650 -4.258 1.00 55.11 H new ATOM 0 HD2 HIS A 26 17.527 -28.562 -4.486 1.00 61.20 H new ATOM 0 HE1 HIS A 26 15.921 -27.500 -0.707 1.00 43.40 H new ATOM 0 HE2 HIS A 26 16.766 -29.421 -2.146 1.00 32.21 H new ATOM 408 N THR A 27 16.574 -23.563 -7.133 1.00 24.41 N ATOM 409 CA THR A 27 16.525 -22.185 -7.602 1.00 51.42 C ATOM 410 C THR A 27 15.089 -21.743 -7.861 1.00 70.11 C ATOM 411 O THR A 27 14.714 -20.611 -7.557 1.00 24.12 O ATOM 412 CB THR A 27 17.347 -22.000 -8.892 1.00 20.22 C ATOM 413 OG1 THR A 27 18.718 -22.337 -8.651 1.00 72.12 O ATOM 414 CG2 THR A 27 17.252 -20.567 -9.394 1.00 22.42 C ATOM 0 H THR A 27 17.198 -24.168 -7.667 1.00 24.41 H new ATOM 0 HA THR A 27 16.956 -21.568 -6.814 1.00 51.42 H new ATOM 0 HB THR A 27 16.939 -22.663 -9.655 1.00 20.22 H new ATOM 0 HG1 THR A 27 19.234 -22.219 -9.476 1.00 72.12 H new ATOM 0 HG21 THR A 27 17.840 -20.461 -10.305 1.00 22.42 H new ATOM 0 HG22 THR A 27 16.211 -20.323 -9.604 1.00 22.42 H new ATOM 0 HG23 THR A 27 17.637 -19.889 -8.633 1.00 22.42 H new ATOM 422 N GLN A 28 14.290 -22.644 -8.424 1.00 21.14 N ATOM 423 CA GLN A 28 12.895 -22.346 -8.723 1.00 15.11 C ATOM 424 C GLN A 28 12.119 -22.032 -7.448 1.00 22.35 C ATOM 425 O GLN A 28 11.228 -21.184 -7.444 1.00 52.03 O ATOM 426 CB GLN A 28 12.245 -23.523 -9.452 1.00 54.14 C ATOM 427 CG GLN A 28 10.788 -23.284 -9.817 1.00 3.42 C ATOM 428 CD GLN A 28 10.047 -24.568 -10.133 1.00 43.23 C ATOM 429 OE1 GLN A 28 10.398 -25.285 -11.071 1.00 34.44 O ATOM 430 NE2 GLN A 28 9.016 -24.865 -9.351 1.00 3.21 N ATOM 0 H GLN A 28 14.585 -23.586 -8.682 1.00 21.14 H new ATOM 0 HA GLN A 28 12.868 -21.468 -9.368 1.00 15.11 H new ATOM 0 HB2 GLN A 28 12.809 -23.733 -10.361 1.00 54.14 H new ATOM 0 HB3 GLN A 28 12.312 -24.411 -8.823 1.00 54.14 H new ATOM 0 HG2 GLN A 28 10.290 -22.775 -8.992 1.00 3.42 H new ATOM 0 HG3 GLN A 28 10.738 -22.619 -10.679 1.00 3.42 H new ATOM 0 HE21 GLN A 28 8.761 -24.242 -8.585 1.00 3.21 H new ATOM 0 HE22 GLN A 28 8.479 -25.717 -9.516 1.00 3.21 H new ATOM 439 N ALA A 29 12.465 -22.723 -6.366 1.00 10.32 N ATOM 440 CA ALA A 29 11.803 -22.516 -5.084 1.00 34.41 C ATOM 441 C ALA A 29 12.251 -21.209 -4.438 1.00 74.55 C ATOM 442 O ALA A 29 11.454 -20.513 -3.811 1.00 3.54 O ATOM 443 CB ALA A 29 12.078 -23.688 -4.153 1.00 75.32 C ATOM 0 H ALA A 29 13.200 -23.431 -6.352 1.00 10.32 H new ATOM 0 HA ALA A 29 10.730 -22.452 -5.264 1.00 34.41 H new ATOM 0 HB1 ALA A 29 11.578 -23.520 -3.199 1.00 75.32 H new ATOM 0 HB2 ALA A 29 11.702 -24.607 -4.603 1.00 75.32 H new ATOM 0 HB3 ALA A 29 13.152 -23.778 -3.989 1.00 75.32 H new ATOM 449 N GLU A 30 13.530 -20.884 -4.597 1.00 72.42 N ATOM 450 CA GLU A 30 14.083 -19.661 -4.028 1.00 33.13 C ATOM 451 C GLU A 30 13.321 -18.436 -4.526 1.00 32.33 C ATOM 452 O GLU A 30 13.313 -17.391 -3.878 1.00 11.34 O ATOM 453 CB GLU A 30 15.566 -19.532 -4.382 1.00 55.13 C ATOM 454 CG GLU A 30 16.492 -20.188 -3.373 1.00 22.42 C ATOM 455 CD GLU A 30 16.701 -21.665 -3.647 1.00 23.01 C ATOM 456 OE1 GLU A 30 17.611 -22.000 -4.434 1.00 75.03 O ATOM 457 OE2 GLU A 30 15.955 -22.486 -3.073 1.00 11.30 O ATOM 0 H GLU A 30 14.202 -21.450 -5.115 1.00 72.42 H new ATOM 0 HA GLU A 30 13.979 -19.716 -2.944 1.00 33.13 H new ATOM 0 HB2 GLU A 30 15.737 -19.977 -5.362 1.00 55.13 H new ATOM 0 HB3 GLU A 30 15.821 -18.475 -4.463 1.00 55.13 H new ATOM 0 HG2 GLU A 30 17.456 -19.680 -3.386 1.00 22.42 H new ATOM 0 HG3 GLU A 30 16.080 -20.063 -2.372 1.00 22.42 H new ATOM 464 N GLY A 31 12.681 -18.575 -5.683 1.00 50.31 N ATOM 465 CA GLY A 31 11.926 -17.473 -6.250 1.00 14.44 C ATOM 466 C GLY A 31 10.781 -17.035 -5.357 1.00 41.02 C ATOM 467 O GLY A 31 10.590 -15.842 -5.119 1.00 25.22 O ATOM 0 H GLY A 31 12.672 -19.431 -6.238 1.00 50.31 H new ATOM 0 HA2 GLY A 31 12.594 -16.628 -6.420 1.00 14.44 H new ATOM 0 HA3 GLY A 31 11.532 -17.769 -7.222 1.00 14.44 H new ATOM 471 N LYS A 32 10.015 -18.002 -4.863 1.00 42.30 N ATOM 472 CA LYS A 32 8.883 -17.711 -3.992 1.00 75.40 C ATOM 473 C LYS A 32 9.324 -16.902 -2.777 1.00 10.20 C ATOM 474 O LYS A 32 8.529 -16.175 -2.180 1.00 23.33 O ATOM 475 CB LYS A 32 8.216 -19.012 -3.537 1.00 2.20 C ATOM 476 CG LYS A 32 8.962 -19.719 -2.419 1.00 4.43 C ATOM 477 CD LYS A 32 8.908 -21.229 -2.580 1.00 5.43 C ATOM 478 CE LYS A 32 9.594 -21.937 -1.422 1.00 32.44 C ATOM 479 NZ LYS A 32 10.983 -21.444 -1.213 1.00 42.22 N ATOM 0 H LYS A 32 10.158 -18.994 -5.051 1.00 42.30 H new ATOM 0 HA LYS A 32 8.164 -17.119 -4.558 1.00 75.40 H new ATOM 0 HB2 LYS A 32 7.201 -18.793 -3.204 1.00 2.20 H new ATOM 0 HB3 LYS A 32 8.133 -19.686 -4.390 1.00 2.20 H new ATOM 0 HG2 LYS A 32 10.001 -19.390 -2.409 1.00 4.43 H new ATOM 0 HG3 LYS A 32 8.530 -19.439 -1.458 1.00 4.43 H new ATOM 0 HD2 LYS A 32 7.869 -21.553 -2.642 1.00 5.43 H new ATOM 0 HD3 LYS A 32 9.387 -21.514 -3.517 1.00 5.43 H new ATOM 0 HE2 LYS A 32 9.015 -21.787 -0.511 1.00 32.44 H new ATOM 0 HE3 LYS A 32 9.615 -23.010 -1.614 1.00 32.44 H new ATOM 0 HZ1 LYS A 32 11.588 -22.232 -0.904 1.00 42.22 H new ATOM 0 HZ2 LYS A 32 11.351 -21.053 -2.104 1.00 42.22 H new ATOM 0 HZ3 LYS A 32 10.982 -20.702 -0.484 1.00 42.22 H new ATOM 493 N LYS A 33 10.596 -17.030 -2.417 1.00 24.45 N ATOM 494 CA LYS A 33 11.145 -16.309 -1.274 1.00 63.05 C ATOM 495 C LYS A 33 10.841 -14.818 -1.375 1.00 54.13 C ATOM 496 O LYS A 33 10.138 -14.259 -0.532 1.00 73.02 O ATOM 497 CB LYS A 33 12.658 -16.527 -1.187 1.00 14.44 C ATOM 498 CG LYS A 33 13.196 -16.492 0.233 1.00 14.43 C ATOM 499 CD LYS A 33 12.988 -17.820 0.941 1.00 64.20 C ATOM 500 CE LYS A 33 13.946 -18.883 0.423 1.00 12.33 C ATOM 501 NZ LYS A 33 15.369 -18.498 0.636 1.00 33.42 N ATOM 0 H LYS A 33 11.267 -17.627 -2.900 1.00 24.45 H new ATOM 0 HA LYS A 33 10.675 -16.698 -0.371 1.00 63.05 H new ATOM 0 HB2 LYS A 33 12.905 -17.489 -1.637 1.00 14.44 H new ATOM 0 HB3 LYS A 33 13.162 -15.761 -1.777 1.00 14.44 H new ATOM 0 HG2 LYS A 33 14.259 -16.251 0.214 1.00 14.43 H new ATOM 0 HG3 LYS A 33 12.699 -15.699 0.792 1.00 14.43 H new ATOM 0 HD2 LYS A 33 13.133 -17.689 2.013 1.00 64.20 H new ATOM 0 HD3 LYS A 33 11.960 -18.153 0.797 1.00 64.20 H new ATOM 0 HE2 LYS A 33 13.746 -19.829 0.927 1.00 12.33 H new ATOM 0 HE3 LYS A 33 13.769 -19.045 -0.640 1.00 12.33 H new ATOM 0 HZ1 LYS A 33 15.970 -19.345 0.578 1.00 33.42 H new ATOM 0 HZ2 LYS A 33 15.658 -17.818 -0.096 1.00 33.42 H new ATOM 0 HZ3 LYS A 33 15.474 -18.063 1.575 1.00 33.42 H new ATOM 515 N LEU A 34 11.372 -14.179 -2.412 1.00 10.03 N ATOM 516 CA LEU A 34 11.155 -12.752 -2.624 1.00 3.03 C ATOM 517 C LEU A 34 10.138 -12.515 -3.735 1.00 41.13 C ATOM 518 O LEU A 34 10.130 -11.460 -4.368 1.00 75.03 O ATOM 519 CB LEU A 34 12.476 -12.061 -2.969 1.00 72.54 C ATOM 520 CG LEU A 34 13.624 -12.276 -1.983 1.00 21.51 C ATOM 521 CD1 LEU A 34 14.832 -11.442 -2.379 1.00 51.33 C ATOM 522 CD2 LEU A 34 13.181 -11.938 -0.567 1.00 21.11 C ATOM 0 H LEU A 34 11.956 -14.626 -3.119 1.00 10.03 H new ATOM 0 HA LEU A 34 10.761 -12.328 -1.700 1.00 3.03 H new ATOM 0 HB2 LEU A 34 12.798 -12.407 -3.951 1.00 72.54 H new ATOM 0 HB3 LEU A 34 12.292 -10.990 -3.053 1.00 72.54 H new ATOM 0 HG LEU A 34 13.910 -13.327 -2.012 1.00 21.51 H new ATOM 0 HD11 LEU A 34 15.639 -11.608 -1.665 1.00 51.33 H new ATOM 0 HD12 LEU A 34 15.164 -11.732 -3.376 1.00 51.33 H new ATOM 0 HD13 LEU A 34 14.561 -10.386 -2.380 1.00 51.33 H new ATOM 0 HD21 LEU A 34 14.011 -12.097 0.122 1.00 21.11 H new ATOM 0 HD22 LEU A 34 12.868 -10.895 -0.523 1.00 21.11 H new ATOM 0 HD23 LEU A 34 12.347 -12.580 -0.284 1.00 21.11 H new ATOM 534 N GLY A 35 9.280 -13.504 -3.966 1.00 13.20 N ATOM 535 CA GLY A 35 8.268 -13.382 -5.000 1.00 25.32 C ATOM 536 C GLY A 35 8.854 -12.984 -6.340 1.00 3.32 C ATOM 537 O GLY A 35 8.303 -12.132 -7.038 1.00 41.22 O ATOM 0 H GLY A 35 9.267 -14.387 -3.456 1.00 13.20 H new ATOM 0 HA2 GLY A 35 7.743 -14.331 -5.104 1.00 25.32 H new ATOM 0 HA3 GLY A 35 7.529 -12.641 -4.695 1.00 25.32 H new ATOM 541 N LEU A 36 9.975 -13.599 -6.700 1.00 43.21 N ATOM 542 CA LEU A 36 10.638 -13.302 -7.965 1.00 60.34 C ATOM 543 C LEU A 36 10.386 -14.409 -8.984 1.00 41.25 C ATOM 544 O LEU A 36 9.963 -15.509 -8.630 1.00 22.30 O ATOM 545 CB LEU A 36 12.142 -13.127 -7.747 1.00 51.02 C ATOM 546 CG LEU A 36 12.558 -11.969 -6.839 1.00 31.53 C ATOM 547 CD1 LEU A 36 14.072 -11.835 -6.805 1.00 24.32 C ATOM 548 CD2 LEU A 36 11.916 -10.670 -7.303 1.00 33.25 C ATOM 0 H LEU A 36 10.444 -14.306 -6.134 1.00 43.21 H new ATOM 0 HA LEU A 36 10.223 -12.372 -8.355 1.00 60.34 H new ATOM 0 HB2 LEU A 36 12.538 -14.052 -7.328 1.00 51.02 H new ATOM 0 HB3 LEU A 36 12.616 -12.989 -8.719 1.00 51.02 H new ATOM 0 HG LEU A 36 12.210 -12.182 -5.828 1.00 31.53 H new ATOM 0 HD11 LEU A 36 14.349 -11.006 -6.154 1.00 24.32 H new ATOM 0 HD12 LEU A 36 14.510 -12.758 -6.425 1.00 24.32 H new ATOM 0 HD13 LEU A 36 14.443 -11.645 -7.812 1.00 24.32 H new ATOM 0 HD21 LEU A 36 12.223 -9.857 -6.645 1.00 33.25 H new ATOM 0 HD22 LEU A 36 12.233 -10.451 -8.323 1.00 33.25 H new ATOM 0 HD23 LEU A 36 10.831 -10.770 -7.274 1.00 33.25 H new ATOM 560 N VAL A 37 10.651 -14.110 -10.252 1.00 73.14 N ATOM 561 CA VAL A 37 10.456 -15.080 -11.323 1.00 60.32 C ATOM 562 C VAL A 37 11.737 -15.278 -12.125 1.00 25.40 C ATOM 563 O VAL A 37 12.789 -14.743 -11.777 1.00 21.43 O ATOM 564 CB VAL A 37 9.329 -14.644 -12.278 1.00 35.24 C ATOM 565 CG1 VAL A 37 8.030 -14.440 -11.512 1.00 41.22 C ATOM 566 CG2 VAL A 37 9.722 -13.378 -13.023 1.00 64.25 C ATOM 0 H VAL A 37 11.001 -13.204 -10.562 1.00 73.14 H new ATOM 0 HA VAL A 37 10.177 -16.021 -10.850 1.00 60.32 H new ATOM 0 HB VAL A 37 9.171 -15.435 -13.011 1.00 35.24 H new ATOM 0 HG11 VAL A 37 7.245 -14.132 -12.203 1.00 41.22 H new ATOM 0 HG12 VAL A 37 7.742 -15.374 -11.028 1.00 41.22 H new ATOM 0 HG13 VAL A 37 8.171 -13.668 -10.756 1.00 41.22 H new ATOM 0 HG21 VAL A 37 8.914 -13.085 -13.693 1.00 64.25 H new ATOM 0 HG22 VAL A 37 9.908 -12.578 -12.307 1.00 64.25 H new ATOM 0 HG23 VAL A 37 10.626 -13.563 -13.604 1.00 64.25 H new ATOM 576 N GLY A 38 11.642 -16.052 -13.202 1.00 55.35 N ATOM 577 CA GLY A 38 12.800 -16.307 -14.038 1.00 3.20 C ATOM 578 C GLY A 38 12.940 -17.771 -14.404 1.00 60.10 C ATOM 579 O GLY A 38 12.145 -18.605 -13.970 1.00 1.32 O ATOM 0 H GLY A 38 10.783 -16.507 -13.510 1.00 55.35 H new ATOM 0 HA2 GLY A 38 12.724 -15.714 -14.949 1.00 3.20 H new ATOM 0 HA3 GLY A 38 13.699 -15.978 -13.517 1.00 3.20 H new ATOM 583 N TRP A 39 13.951 -18.085 -15.206 1.00 3.33 N ATOM 584 CA TRP A 39 14.191 -19.459 -15.632 1.00 0.05 C ATOM 585 C TRP A 39 15.649 -19.850 -15.414 1.00 54.23 C ATOM 586 O TRP A 39 16.521 -18.989 -15.291 1.00 75.43 O ATOM 587 CB TRP A 39 13.818 -19.630 -17.105 1.00 63.40 C ATOM 588 CG TRP A 39 14.779 -18.964 -18.042 1.00 43.32 C ATOM 589 CD1 TRP A 39 15.966 -19.466 -18.493 1.00 62.45 C ATOM 590 CD2 TRP A 39 14.635 -17.671 -18.641 1.00 22.21 C ATOM 591 NE1 TRP A 39 16.569 -18.564 -19.337 1.00 33.14 N ATOM 592 CE2 TRP A 39 15.772 -17.455 -19.444 1.00 70.13 C ATOM 593 CE3 TRP A 39 13.656 -16.676 -18.578 1.00 71.33 C ATOM 594 CZ2 TRP A 39 15.954 -16.285 -20.176 1.00 41.05 C ATOM 595 CZ3 TRP A 39 13.838 -15.515 -19.305 1.00 63.44 C ATOM 596 CH2 TRP A 39 14.979 -15.328 -20.097 1.00 5.35 C ATOM 0 H TRP A 39 14.618 -17.407 -15.574 1.00 3.33 H new ATOM 0 HA TRP A 39 13.565 -20.115 -15.028 1.00 0.05 H new ATOM 0 HB2 TRP A 39 13.771 -20.693 -17.339 1.00 63.40 H new ATOM 0 HB3 TRP A 39 12.820 -19.223 -17.269 1.00 63.40 H new ATOM 0 HD1 TRP A 39 16.372 -20.431 -18.226 1.00 62.45 H new ATOM 0 HE1 TRP A 39 17.464 -18.699 -19.807 1.00 33.14 H new ATOM 0 HE3 TRP A 39 12.773 -16.812 -17.972 1.00 71.33 H new ATOM 0 HZ2 TRP A 39 16.834 -16.138 -20.785 1.00 41.05 H new ATOM 0 HZ3 TRP A 39 13.088 -14.739 -19.262 1.00 63.44 H new ATOM 0 HH2 TRP A 39 15.091 -14.411 -20.656 1.00 5.35 H new ATOM 607 N VAL A 40 15.907 -21.153 -15.368 1.00 41.12 N ATOM 608 CA VAL A 40 17.260 -21.657 -15.167 1.00 62.31 C ATOM 609 C VAL A 40 17.699 -22.535 -16.334 1.00 53.42 C ATOM 610 O VAL A 40 16.937 -23.375 -16.811 1.00 61.50 O ATOM 611 CB VAL A 40 17.369 -22.467 -13.861 1.00 41.13 C ATOM 612 CG1 VAL A 40 18.816 -22.849 -13.589 1.00 31.02 C ATOM 613 CG2 VAL A 40 16.789 -21.679 -12.697 1.00 33.15 C ATOM 0 H VAL A 40 15.197 -21.878 -15.467 1.00 41.12 H new ATOM 0 HA VAL A 40 17.915 -20.788 -15.103 1.00 62.31 H new ATOM 0 HB VAL A 40 16.791 -23.385 -13.973 1.00 41.13 H new ATOM 0 HG11 VAL A 40 18.873 -23.421 -12.663 1.00 31.02 H new ATOM 0 HG12 VAL A 40 19.194 -23.455 -14.413 1.00 31.02 H new ATOM 0 HG13 VAL A 40 19.419 -21.946 -13.496 1.00 31.02 H new ATOM 0 HG21 VAL A 40 16.874 -22.266 -11.782 1.00 33.15 H new ATOM 0 HG22 VAL A 40 17.338 -20.744 -12.581 1.00 33.15 H new ATOM 0 HG23 VAL A 40 15.739 -21.461 -12.892 1.00 33.15 H new ATOM 623 N GLN A 41 18.931 -22.333 -16.789 1.00 3.33 N ATOM 624 CA GLN A 41 19.471 -23.106 -17.901 1.00 1.12 C ATOM 625 C GLN A 41 20.884 -23.590 -17.592 1.00 41.11 C ATOM 626 O GLN A 41 21.638 -22.923 -16.885 1.00 44.24 O ATOM 627 CB GLN A 41 19.475 -22.266 -19.179 1.00 51.02 C ATOM 628 CG GLN A 41 19.389 -23.094 -20.451 1.00 43.23 C ATOM 629 CD GLN A 41 19.689 -22.283 -21.697 1.00 2.04 C ATOM 630 OE1 GLN A 41 19.601 -21.055 -21.688 1.00 0.22 O ATOM 631 NE2 GLN A 41 20.046 -22.967 -22.777 1.00 63.21 N ATOM 0 H GLN A 41 19.574 -21.641 -16.405 1.00 3.33 H new ATOM 0 HA GLN A 41 18.833 -23.977 -18.049 1.00 1.12 H new ATOM 0 HB2 GLN A 41 18.636 -21.571 -19.150 1.00 51.02 H new ATOM 0 HB3 GLN A 41 20.385 -21.666 -19.207 1.00 51.02 H new ATOM 0 HG2 GLN A 41 20.090 -23.926 -20.386 1.00 43.23 H new ATOM 0 HG3 GLN A 41 18.391 -23.524 -20.533 1.00 43.23 H new ATOM 0 HE21 GLN A 41 20.106 -23.985 -22.739 1.00 63.21 H new ATOM 0 HE22 GLN A 41 20.260 -22.475 -23.644 1.00 63.21 H new ATOM 640 N ASN A 42 21.235 -24.755 -18.127 1.00 2.03 N ATOM 641 CA ASN A 42 22.558 -25.329 -17.907 1.00 51.12 C ATOM 642 C ASN A 42 23.426 -25.187 -19.154 1.00 31.31 C ATOM 643 O ASN A 42 22.953 -24.764 -20.209 1.00 40.12 O ATOM 644 CB ASN A 42 22.439 -26.804 -17.520 1.00 74.30 C ATOM 645 CG ASN A 42 21.345 -27.047 -16.498 1.00 75.34 C ATOM 646 OD1 ASN A 42 20.967 -26.145 -15.751 1.00 34.22 O ATOM 647 ND2 ASN A 42 20.830 -28.271 -16.462 1.00 65.21 N ATOM 0 H ASN A 42 20.622 -25.320 -18.715 1.00 2.03 H new ATOM 0 HA ASN A 42 23.033 -24.784 -17.091 1.00 51.12 H new ATOM 0 HB2 ASN A 42 22.237 -27.396 -18.413 1.00 74.30 H new ATOM 0 HB3 ASN A 42 23.391 -27.149 -17.118 1.00 74.30 H new ATOM 0 HD21 ASN A 42 20.090 -28.494 -15.796 1.00 65.21 H new ATOM 0 HD22 ASN A 42 21.174 -28.988 -17.101 1.00 65.21 H new ATOM 654 N THR A 43 24.700 -25.545 -19.025 1.00 71.32 N ATOM 655 CA THR A 43 25.635 -25.458 -20.140 1.00 34.11 C ATOM 656 C THR A 43 26.581 -26.653 -20.159 1.00 33.21 C ATOM 657 O THR A 43 26.562 -27.486 -19.253 1.00 31.42 O ATOM 658 CB THR A 43 26.464 -24.162 -20.077 1.00 44.21 C ATOM 659 OG1 THR A 43 27.436 -24.252 -19.029 1.00 33.21 O ATOM 660 CG2 THR A 43 25.567 -22.956 -19.842 1.00 3.03 C ATOM 0 H THR A 43 25.108 -25.898 -18.159 1.00 71.32 H new ATOM 0 HA THR A 43 25.039 -25.456 -21.053 1.00 34.11 H new ATOM 0 HB THR A 43 26.972 -24.036 -21.033 1.00 44.21 H new ATOM 0 HG1 THR A 43 26.989 -24.481 -18.187 1.00 33.21 H new ATOM 0 HG21 THR A 43 26.175 -22.052 -19.801 1.00 3.03 H new ATOM 0 HG22 THR A 43 24.848 -22.873 -20.657 1.00 3.03 H new ATOM 0 HG23 THR A 43 25.034 -23.077 -18.899 1.00 3.03 H new ATOM 668 N ASP A 44 27.407 -26.731 -21.196 1.00 4.21 N ATOM 669 CA ASP A 44 28.363 -27.824 -21.332 1.00 1.13 C ATOM 670 C ASP A 44 29.774 -27.358 -20.989 1.00 5.52 C ATOM 671 O ASP A 44 30.619 -28.153 -20.578 1.00 62.53 O ATOM 672 CB ASP A 44 28.329 -28.385 -22.754 1.00 64.30 C ATOM 673 CG ASP A 44 29.168 -29.640 -22.901 1.00 41.44 C ATOM 674 OD1 ASP A 44 30.399 -29.514 -23.065 1.00 44.44 O ATOM 675 OD2 ASP A 44 28.593 -30.747 -22.853 1.00 70.34 O ATOM 0 H ASP A 44 27.434 -26.050 -21.955 1.00 4.21 H new ATOM 0 HA ASP A 44 28.080 -28.611 -20.633 1.00 1.13 H new ATOM 0 HB2 ASP A 44 27.298 -28.606 -23.030 1.00 64.30 H new ATOM 0 HB3 ASP A 44 28.689 -27.627 -23.449 1.00 64.30 H new ATOM 680 N ARG A 45 30.023 -26.063 -21.161 1.00 72.42 N ATOM 681 CA ARG A 45 31.332 -25.492 -20.872 1.00 44.43 C ATOM 682 C ARG A 45 31.791 -25.867 -19.466 1.00 43.13 C ATOM 683 O ARG A 45 32.977 -26.097 -19.230 1.00 15.33 O ATOM 684 CB ARG A 45 31.291 -23.969 -21.018 1.00 22.35 C ATOM 685 CG ARG A 45 32.663 -23.336 -21.185 1.00 73.14 C ATOM 686 CD ARG A 45 32.591 -22.062 -22.013 1.00 72.51 C ATOM 687 NE ARG A 45 32.063 -22.309 -23.352 1.00 62.14 N ATOM 688 CZ ARG A 45 32.097 -21.413 -24.332 1.00 51.31 C ATOM 689 NH1 ARG A 45 32.631 -20.217 -24.123 1.00 73.23 N ATOM 690 NH2 ARG A 45 31.596 -21.712 -25.524 1.00 44.21 N ATOM 0 H ARG A 45 29.335 -25.390 -21.499 1.00 72.42 H new ATOM 0 HA ARG A 45 32.045 -25.900 -21.589 1.00 44.43 H new ATOM 0 HB2 ARG A 45 30.674 -23.711 -21.879 1.00 22.35 H new ATOM 0 HB3 ARG A 45 30.807 -23.541 -20.140 1.00 22.35 H new ATOM 0 HG2 ARG A 45 33.083 -23.111 -20.205 1.00 73.14 H new ATOM 0 HG3 ARG A 45 33.337 -24.046 -21.665 1.00 73.14 H new ATOM 0 HD2 ARG A 45 31.960 -21.334 -21.503 1.00 72.51 H new ATOM 0 HD3 ARG A 45 33.586 -21.623 -22.091 1.00 72.51 H new ATOM 0 HE ARG A 45 31.645 -23.219 -23.545 1.00 62.14 H new ATOM 0 HH11 ARG A 45 33.017 -19.984 -23.208 1.00 73.23 H new ATOM 0 HH12 ARG A 45 32.656 -19.531 -24.877 1.00 73.23 H new ATOM 0 HH21 ARG A 45 31.184 -22.631 -25.688 1.00 44.21 H new ATOM 0 HH22 ARG A 45 31.623 -21.023 -26.276 1.00 44.21 H new ATOM 704 N GLY A 46 30.843 -25.926 -18.536 1.00 23.42 N ATOM 705 CA GLY A 46 31.170 -26.273 -17.165 1.00 70.31 C ATOM 706 C GLY A 46 30.602 -25.285 -16.166 1.00 32.22 C ATOM 707 O GLY A 46 31.226 -24.995 -15.144 1.00 55.54 O ATOM 0 H GLY A 46 29.855 -25.740 -18.707 1.00 23.42 H new ATOM 0 HA2 GLY A 46 30.787 -27.269 -16.944 1.00 70.31 H new ATOM 0 HA3 GLY A 46 32.253 -26.316 -17.053 1.00 70.31 H new ATOM 711 N THR A 47 29.414 -24.765 -16.460 1.00 3.11 N ATOM 712 CA THR A 47 28.763 -23.801 -15.581 1.00 61.54 C ATOM 713 C THR A 47 27.248 -23.841 -15.749 1.00 5.14 C ATOM 714 O THR A 47 26.722 -24.613 -16.550 1.00 21.31 O ATOM 715 CB THR A 47 29.261 -22.369 -15.851 1.00 51.04 C ATOM 716 OG1 THR A 47 29.317 -22.128 -17.262 1.00 11.52 O ATOM 717 CG2 THR A 47 30.636 -22.150 -15.239 1.00 41.52 C ATOM 0 H THR A 47 28.883 -24.995 -17.300 1.00 3.11 H new ATOM 0 HA THR A 47 29.020 -24.080 -14.559 1.00 61.54 H new ATOM 0 HB THR A 47 28.561 -21.671 -15.391 1.00 51.04 H new ATOM 0 HG1 THR A 47 29.633 -21.215 -17.426 1.00 11.52 H new ATOM 0 HG21 THR A 47 30.967 -21.132 -15.443 1.00 41.52 H new ATOM 0 HG22 THR A 47 30.584 -22.306 -14.161 1.00 41.52 H new ATOM 0 HG23 THR A 47 31.344 -22.855 -15.674 1.00 41.52 H new ATOM 725 N VAL A 48 26.552 -23.003 -14.988 1.00 14.14 N ATOM 726 CA VAL A 48 25.096 -22.941 -15.053 1.00 44.21 C ATOM 727 C VAL A 48 24.609 -21.497 -15.099 1.00 44.12 C ATOM 728 O VAL A 48 25.071 -20.652 -14.333 1.00 13.13 O ATOM 729 CB VAL A 48 24.450 -23.651 -13.849 1.00 54.01 C ATOM 730 CG1 VAL A 48 22.934 -23.648 -13.978 1.00 61.12 C ATOM 731 CG2 VAL A 48 24.979 -25.071 -13.721 1.00 64.22 C ATOM 0 H VAL A 48 26.972 -22.358 -14.319 1.00 14.14 H new ATOM 0 HA VAL A 48 24.798 -23.451 -15.969 1.00 44.21 H new ATOM 0 HB VAL A 48 24.715 -23.106 -12.943 1.00 54.01 H new ATOM 0 HG11 VAL A 48 22.495 -24.154 -13.118 1.00 61.12 H new ATOM 0 HG12 VAL A 48 22.574 -22.620 -14.017 1.00 61.12 H new ATOM 0 HG13 VAL A 48 22.646 -24.168 -14.891 1.00 61.12 H new ATOM 0 HG21 VAL A 48 24.512 -25.558 -12.865 1.00 64.22 H new ATOM 0 HG22 VAL A 48 24.746 -25.629 -14.628 1.00 64.22 H new ATOM 0 HG23 VAL A 48 26.059 -25.045 -13.579 1.00 64.22 H new ATOM 741 N GLN A 49 23.674 -21.222 -16.003 1.00 25.10 N ATOM 742 CA GLN A 49 23.125 -19.879 -16.149 1.00 31.41 C ATOM 743 C GLN A 49 21.724 -19.797 -15.553 1.00 35.02 C ATOM 744 O GLN A 49 20.923 -20.721 -15.693 1.00 3.22 O ATOM 745 CB GLN A 49 23.089 -19.478 -17.624 1.00 52.24 C ATOM 746 CG GLN A 49 24.439 -19.039 -18.169 1.00 14.33 C ATOM 747 CD GLN A 49 24.678 -17.551 -18.005 1.00 12.31 C ATOM 748 OE1 GLN A 49 23.825 -16.826 -17.492 1.00 10.15 O ATOM 749 NE2 GLN A 49 25.843 -17.087 -18.441 1.00 51.43 N ATOM 0 H GLN A 49 23.281 -21.911 -16.645 1.00 25.10 H new ATOM 0 HA GLN A 49 23.771 -19.188 -15.608 1.00 31.41 H new ATOM 0 HB2 GLN A 49 22.726 -20.321 -18.212 1.00 52.24 H new ATOM 0 HB3 GLN A 49 22.373 -18.667 -17.754 1.00 52.24 H new ATOM 0 HG2 GLN A 49 25.229 -19.589 -17.658 1.00 14.33 H new ATOM 0 HG3 GLN A 49 24.502 -19.299 -19.226 1.00 14.33 H new ATOM 0 HE21 GLN A 49 26.521 -17.724 -18.860 1.00 51.43 H new ATOM 0 HE22 GLN A 49 26.060 -16.094 -18.357 1.00 51.43 H new ATOM 758 N GLY A 50 21.433 -18.683 -14.887 1.00 25.55 N ATOM 759 CA GLY A 50 20.128 -18.501 -14.279 1.00 23.44 C ATOM 760 C GLY A 50 19.611 -17.084 -14.429 1.00 23.42 C ATOM 761 O GLY A 50 20.023 -16.187 -13.695 1.00 15.54 O ATOM 0 H GLY A 50 22.078 -17.904 -14.758 1.00 25.55 H new ATOM 0 HA2 GLY A 50 19.419 -19.193 -14.734 1.00 23.44 H new ATOM 0 HA3 GLY A 50 20.186 -18.753 -13.220 1.00 23.44 H new ATOM 765 N GLN A 51 18.709 -16.884 -15.384 1.00 12.44 N ATOM 766 CA GLN A 51 18.137 -15.565 -15.629 1.00 4.32 C ATOM 767 C GLN A 51 17.111 -15.208 -14.558 1.00 63.42 C ATOM 768 O GLN A 51 16.095 -15.888 -14.407 1.00 0.23 O ATOM 769 CB GLN A 51 17.486 -15.517 -17.012 1.00 43.21 C ATOM 770 CG GLN A 51 17.011 -14.130 -17.413 1.00 43.42 C ATOM 771 CD GLN A 51 18.086 -13.074 -17.246 1.00 42.34 C ATOM 772 OE1 GLN A 51 18.065 -12.295 -16.293 1.00 54.51 O ATOM 773 NE2 GLN A 51 19.035 -13.042 -18.175 1.00 72.41 N ATOM 0 H GLN A 51 18.359 -17.617 -16.000 1.00 12.44 H new ATOM 0 HA GLN A 51 18.945 -14.834 -15.590 1.00 4.32 H new ATOM 0 HB2 GLN A 51 18.200 -15.876 -17.753 1.00 43.21 H new ATOM 0 HB3 GLN A 51 16.638 -16.201 -17.029 1.00 43.21 H new ATOM 0 HG2 GLN A 51 16.684 -14.149 -18.453 1.00 43.42 H new ATOM 0 HG3 GLN A 51 16.144 -13.859 -16.811 1.00 43.42 H new ATOM 0 HE21 GLN A 51 19.014 -13.707 -18.948 1.00 72.41 H new ATOM 0 HE22 GLN A 51 19.785 -12.353 -18.115 1.00 72.41 H new ATOM 782 N LEU A 52 17.383 -14.140 -13.817 1.00 44.24 N ATOM 783 CA LEU A 52 16.484 -13.693 -12.760 1.00 13.23 C ATOM 784 C LEU A 52 15.836 -12.361 -13.123 1.00 13.42 C ATOM 785 O LEU A 52 16.435 -11.537 -13.813 1.00 53.34 O ATOM 786 CB LEU A 52 17.244 -13.560 -11.439 1.00 32.02 C ATOM 787 CG LEU A 52 16.385 -13.400 -10.184 1.00 23.24 C ATOM 788 CD1 LEU A 52 15.705 -14.714 -9.832 1.00 14.23 C ATOM 789 CD2 LEU A 52 17.231 -12.907 -9.019 1.00 12.35 C ATOM 0 H LEU A 52 18.220 -13.567 -13.929 1.00 44.24 H new ATOM 0 HA LEU A 52 15.698 -14.439 -12.646 1.00 13.23 H new ATOM 0 HB2 LEU A 52 17.873 -14.441 -11.314 1.00 32.02 H new ATOM 0 HB3 LEU A 52 17.910 -12.700 -11.511 1.00 32.02 H new ATOM 0 HG LEU A 52 15.613 -12.658 -10.387 1.00 23.24 H new ATOM 0 HD11 LEU A 52 15.098 -14.581 -8.936 1.00 14.23 H new ATOM 0 HD12 LEU A 52 15.068 -15.027 -10.659 1.00 14.23 H new ATOM 0 HD13 LEU A 52 16.461 -15.477 -9.648 1.00 14.23 H new ATOM 0 HD21 LEU A 52 16.604 -12.799 -8.134 1.00 12.35 H new ATOM 0 HD22 LEU A 52 18.024 -13.626 -8.816 1.00 12.35 H new ATOM 0 HD23 LEU A 52 17.672 -11.943 -9.272 1.00 12.35 H new ATOM 801 N GLN A 53 14.610 -12.156 -12.651 1.00 21.50 N ATOM 802 CA GLN A 53 13.882 -10.923 -12.925 1.00 60.32 C ATOM 803 C GLN A 53 13.100 -10.468 -11.697 1.00 70.35 C ATOM 804 O GLN A 53 12.420 -11.265 -11.052 1.00 55.43 O ATOM 805 CB GLN A 53 12.931 -11.120 -14.107 1.00 15.13 C ATOM 806 CG GLN A 53 13.569 -11.827 -15.291 1.00 22.30 C ATOM 807 CD GLN A 53 12.778 -11.651 -16.572 1.00 33.41 C ATOM 808 OE1 GLN A 53 11.566 -11.869 -16.602 1.00 21.14 O ATOM 809 NE2 GLN A 53 13.460 -11.255 -17.640 1.00 20.00 N ATOM 0 H GLN A 53 14.101 -12.828 -12.077 1.00 21.50 H new ATOM 0 HA GLN A 53 14.608 -10.150 -13.177 1.00 60.32 H new ATOM 0 HB2 GLN A 53 12.066 -11.694 -13.775 1.00 15.13 H new ATOM 0 HB3 GLN A 53 12.562 -10.147 -14.431 1.00 15.13 H new ATOM 0 HG2 GLN A 53 14.579 -11.444 -15.437 1.00 22.30 H new ATOM 0 HG3 GLN A 53 13.660 -12.890 -15.068 1.00 22.30 H new ATOM 0 HE21 GLN A 53 14.463 -11.086 -17.570 1.00 20.00 H new ATOM 0 HE22 GLN A 53 12.981 -11.120 -18.530 1.00 20.00 H new ATOM 818 N GLY A 54 13.203 -9.181 -11.380 1.00 35.22 N ATOM 819 CA GLY A 54 12.500 -8.643 -10.230 1.00 10.32 C ATOM 820 C GLY A 54 12.959 -7.243 -9.874 1.00 13.54 C ATOM 821 O GLY A 54 13.913 -6.715 -10.445 1.00 3.23 O ATOM 0 H GLY A 54 13.760 -8.502 -11.898 1.00 35.22 H new ATOM 0 HA2 GLY A 54 11.430 -8.630 -10.436 1.00 10.32 H new ATOM 0 HA3 GLY A 54 12.652 -9.301 -9.374 1.00 10.32 H new ATOM 825 N PRO A 55 12.268 -6.617 -8.909 1.00 1.11 N ATOM 826 CA PRO A 55 12.591 -5.261 -8.457 1.00 3.55 C ATOM 827 C PRO A 55 13.907 -5.204 -7.687 1.00 73.02 C ATOM 828 O PRO A 55 14.240 -6.125 -6.941 1.00 13.14 O ATOM 829 CB PRO A 55 11.419 -4.904 -7.539 1.00 3.13 C ATOM 830 CG PRO A 55 10.903 -6.216 -7.056 1.00 42.44 C ATOM 831 CD PRO A 55 11.119 -7.186 -8.185 1.00 12.30 C ATOM 0 HA PRO A 55 12.721 -4.573 -9.293 1.00 3.55 H new ATOM 0 HB2 PRO A 55 11.743 -4.276 -6.709 1.00 3.13 H new ATOM 0 HB3 PRO A 55 10.650 -4.350 -8.076 1.00 3.13 H new ATOM 0 HG2 PRO A 55 11.432 -6.537 -6.159 1.00 42.44 H new ATOM 0 HG3 PRO A 55 9.847 -6.148 -6.796 1.00 42.44 H new ATOM 0 HD2 PRO A 55 11.333 -8.190 -7.817 1.00 12.30 H new ATOM 0 HD3 PRO A 55 10.239 -7.261 -8.824 1.00 12.30 H new ATOM 839 N ILE A 56 14.650 -4.118 -7.874 1.00 33.42 N ATOM 840 CA ILE A 56 15.928 -3.942 -7.196 1.00 31.34 C ATOM 841 C ILE A 56 15.771 -4.075 -5.685 1.00 3.04 C ATOM 842 O ILE A 56 16.714 -4.440 -4.982 1.00 71.22 O ATOM 843 CB ILE A 56 16.552 -2.571 -7.517 1.00 73.44 C ATOM 844 CG1 ILE A 56 17.943 -2.460 -6.890 1.00 52.12 C ATOM 845 CG2 ILE A 56 15.650 -1.450 -7.023 1.00 23.12 C ATOM 846 CD1 ILE A 56 18.719 -1.247 -7.354 1.00 22.32 C ATOM 0 H ILE A 56 14.389 -3.347 -8.489 1.00 33.42 H new ATOM 0 HA ILE A 56 16.590 -4.727 -7.561 1.00 31.34 H new ATOM 0 HB ILE A 56 16.654 -2.478 -8.598 1.00 73.44 H new ATOM 0 HG12 ILE A 56 17.842 -2.424 -5.805 1.00 52.12 H new ATOM 0 HG13 ILE A 56 18.513 -3.359 -7.127 1.00 52.12 H new ATOM 0 HG21 ILE A 56 16.105 -0.487 -7.257 1.00 23.12 H new ATOM 0 HG22 ILE A 56 14.679 -1.522 -7.513 1.00 23.12 H new ATOM 0 HG23 ILE A 56 15.519 -1.537 -5.944 1.00 23.12 H new ATOM 0 HD11 ILE A 56 19.695 -1.232 -6.869 1.00 22.32 H new ATOM 0 HD12 ILE A 56 18.851 -1.291 -8.435 1.00 22.32 H new ATOM 0 HD13 ILE A 56 18.170 -0.342 -7.092 1.00 22.32 H new ATOM 858 N SER A 57 14.574 -3.777 -5.191 1.00 34.51 N ATOM 859 CA SER A 57 14.293 -3.862 -3.762 1.00 43.53 C ATOM 860 C SER A 57 14.357 -5.308 -3.281 1.00 15.35 C ATOM 861 O SER A 57 14.614 -5.573 -2.106 1.00 52.10 O ATOM 862 CB SER A 57 12.916 -3.270 -3.456 1.00 3.44 C ATOM 863 OG SER A 57 12.780 -1.976 -4.018 1.00 64.11 O ATOM 0 H SER A 57 13.783 -3.474 -5.759 1.00 34.51 H new ATOM 0 HA SER A 57 15.053 -3.288 -3.232 1.00 43.53 H new ATOM 0 HB2 SER A 57 12.139 -3.925 -3.851 1.00 3.44 H new ATOM 0 HB3 SER A 57 12.771 -3.218 -2.377 1.00 3.44 H new ATOM 0 HG SER A 57 11.891 -1.621 -3.810 1.00 64.11 H new ATOM 869 N LYS A 58 14.120 -6.241 -4.196 1.00 53.35 N ATOM 870 CA LYS A 58 14.150 -7.661 -3.868 1.00 63.03 C ATOM 871 C LYS A 58 15.435 -8.309 -4.375 1.00 72.03 C ATOM 872 O LYS A 58 16.025 -9.152 -3.700 1.00 30.31 O ATOM 873 CB LYS A 58 12.936 -8.371 -4.471 1.00 60.00 C ATOM 874 CG LYS A 58 11.707 -8.336 -3.580 1.00 33.34 C ATOM 875 CD LYS A 58 11.278 -6.910 -3.276 1.00 24.54 C ATOM 876 CE LYS A 58 9.773 -6.809 -3.087 1.00 34.01 C ATOM 877 NZ LYS A 58 9.303 -5.396 -3.125 1.00 73.43 N ATOM 0 H LYS A 58 13.905 -6.039 -5.172 1.00 53.35 H new ATOM 0 HA LYS A 58 14.118 -7.758 -2.783 1.00 63.03 H new ATOM 0 HB2 LYS A 58 12.694 -7.909 -5.428 1.00 60.00 H new ATOM 0 HB3 LYS A 58 13.197 -9.409 -4.675 1.00 60.00 H new ATOM 0 HG2 LYS A 58 10.889 -8.867 -4.066 1.00 33.34 H new ATOM 0 HG3 LYS A 58 11.917 -8.860 -2.648 1.00 33.34 H new ATOM 0 HD2 LYS A 58 11.783 -6.561 -2.375 1.00 24.54 H new ATOM 0 HD3 LYS A 58 11.588 -6.254 -4.090 1.00 24.54 H new ATOM 0 HE2 LYS A 58 9.270 -7.380 -3.867 1.00 34.01 H new ATOM 0 HE3 LYS A 58 9.496 -7.259 -2.134 1.00 34.01 H new ATOM 0 HZ1 LYS A 58 8.272 -5.369 -2.993 1.00 73.43 H new ATOM 0 HZ2 LYS A 58 9.764 -4.856 -2.365 1.00 73.43 H new ATOM 0 HZ3 LYS A 58 9.545 -4.974 -4.044 1.00 73.43 H new ATOM 891 N VAL A 59 15.863 -7.909 -5.568 1.00 45.41 N ATOM 892 CA VAL A 59 17.080 -8.449 -6.164 1.00 54.52 C ATOM 893 C VAL A 59 18.279 -8.243 -5.246 1.00 65.24 C ATOM 894 O VAL A 59 19.263 -8.980 -5.320 1.00 2.23 O ATOM 895 CB VAL A 59 17.373 -7.797 -7.528 1.00 42.35 C ATOM 896 CG1 VAL A 59 18.652 -8.363 -8.127 1.00 10.32 C ATOM 897 CG2 VAL A 59 16.199 -7.993 -8.476 1.00 2.32 C ATOM 0 H VAL A 59 15.386 -7.213 -6.141 1.00 45.41 H new ATOM 0 HA VAL A 59 16.916 -9.517 -6.308 1.00 54.52 H new ATOM 0 HB VAL A 59 17.513 -6.727 -7.376 1.00 42.35 H new ATOM 0 HG11 VAL A 59 18.843 -7.890 -9.091 1.00 10.32 H new ATOM 0 HG12 VAL A 59 19.487 -8.166 -7.455 1.00 10.32 H new ATOM 0 HG13 VAL A 59 18.544 -9.439 -8.266 1.00 10.32 H new ATOM 0 HG21 VAL A 59 16.424 -7.526 -9.435 1.00 2.32 H new ATOM 0 HG22 VAL A 59 16.025 -9.059 -8.624 1.00 2.32 H new ATOM 0 HG23 VAL A 59 15.307 -7.535 -8.050 1.00 2.32 H new ATOM 907 N ARG A 60 18.191 -7.238 -4.382 1.00 0.40 N ATOM 908 CA ARG A 60 19.270 -6.935 -3.450 1.00 10.45 C ATOM 909 C ARG A 60 19.428 -8.050 -2.420 1.00 44.13 C ATOM 910 O ARG A 60 20.506 -8.239 -1.856 1.00 22.54 O ATOM 911 CB ARG A 60 19.002 -5.606 -2.740 1.00 53.14 C ATOM 912 CG ARG A 60 20.265 -4.834 -2.394 1.00 73.51 C ATOM 913 CD ARG A 60 20.737 -5.144 -0.982 1.00 12.30 C ATOM 914 NE ARG A 60 20.152 -4.236 0.002 1.00 72.53 N ATOM 915 CZ ARG A 60 20.574 -2.992 0.197 1.00 65.42 C ATOM 916 NH1 ARG A 60 21.580 -2.510 -0.521 1.00 33.04 N ATOM 917 NH2 ARG A 60 19.991 -2.228 1.111 1.00 50.20 N ATOM 0 H ARG A 60 17.383 -6.619 -4.308 1.00 0.40 H new ATOM 0 HA ARG A 60 20.196 -6.855 -4.020 1.00 10.45 H new ATOM 0 HB2 ARG A 60 18.370 -4.986 -3.375 1.00 53.14 H new ATOM 0 HB3 ARG A 60 18.442 -5.799 -1.825 1.00 53.14 H new ATOM 0 HG2 ARG A 60 21.052 -5.084 -3.105 1.00 73.51 H new ATOM 0 HG3 ARG A 60 20.077 -3.765 -2.490 1.00 73.51 H new ATOM 0 HD2 ARG A 60 20.474 -6.171 -0.729 1.00 12.30 H new ATOM 0 HD3 ARG A 60 21.824 -5.074 -0.939 1.00 12.30 H new ATOM 0 HE ARG A 60 19.377 -4.576 0.571 1.00 72.53 H new ATOM 0 HH11 ARG A 60 22.031 -3.095 -1.224 1.00 33.04 H new ATOM 0 HH12 ARG A 60 21.903 -1.554 -0.370 1.00 33.04 H new ATOM 0 HH21 ARG A 60 19.218 -2.596 1.665 1.00 50.20 H new ATOM 0 HH22 ARG A 60 20.316 -1.273 1.260 1.00 50.20 H new ATOM 931 N HIS A 61 18.347 -8.785 -2.181 1.00 21.13 N ATOM 932 CA HIS A 61 18.366 -9.882 -1.219 1.00 40.23 C ATOM 933 C HIS A 61 18.714 -11.200 -1.905 1.00 52.42 C ATOM 934 O HIS A 61 19.661 -11.882 -1.515 1.00 75.22 O ATOM 935 CB HIS A 61 17.011 -9.999 -0.521 1.00 30.11 C ATOM 936 CG HIS A 61 16.940 -9.256 0.778 1.00 63.42 C ATOM 937 ND1 HIS A 61 17.566 -9.690 1.928 1.00 50.34 N ATOM 938 CD2 HIS A 61 16.314 -8.102 1.104 1.00 0.34 C ATOM 939 CE1 HIS A 61 17.326 -8.835 2.906 1.00 42.33 C ATOM 940 NE2 HIS A 61 16.569 -7.862 2.432 1.00 0.41 N ATOM 0 H HIS A 61 17.447 -8.641 -2.640 1.00 21.13 H new ATOM 0 HA HIS A 61 19.132 -9.667 -0.474 1.00 40.23 H new ATOM 0 HB2 HIS A 61 16.235 -9.624 -1.188 1.00 30.11 H new ATOM 0 HB3 HIS A 61 16.794 -11.052 -0.340 1.00 30.11 H new ATOM 0 HD2 HIS A 61 15.724 -7.485 0.443 1.00 0.34 H new ATOM 0 HE1 HIS A 61 17.687 -8.918 3.920 1.00 42.33 H new ATOM 0 HE2 HIS A 61 16.229 -7.062 2.966 1.00 0.41 H new ATOM 948 N MET A 62 17.941 -11.551 -2.928 1.00 42.30 N ATOM 949 CA MET A 62 18.169 -12.787 -3.668 1.00 14.41 C ATOM 950 C MET A 62 19.619 -12.885 -4.130 1.00 1.24 C ATOM 951 O MET A 62 20.199 -13.970 -4.156 1.00 74.21 O ATOM 952 CB MET A 62 17.231 -12.864 -4.874 1.00 51.23 C ATOM 953 CG MET A 62 17.403 -14.130 -5.698 1.00 32.04 C ATOM 954 SD MET A 62 15.850 -14.718 -6.400 1.00 34.24 S ATOM 955 CE MET A 62 14.932 -15.110 -4.912 1.00 3.52 C ATOM 0 H MET A 62 17.152 -10.998 -3.263 1.00 42.30 H new ATOM 0 HA MET A 62 17.962 -13.624 -3.001 1.00 14.41 H new ATOM 0 HB2 MET A 62 16.200 -12.804 -4.526 1.00 51.23 H new ATOM 0 HB3 MET A 62 17.403 -11.998 -5.513 1.00 51.23 H new ATOM 0 HG2 MET A 62 18.113 -13.941 -6.503 1.00 32.04 H new ATOM 0 HG3 MET A 62 17.833 -14.911 -5.071 1.00 32.04 H new ATOM 0 HE1 MET A 62 13.889 -15.299 -5.167 1.00 3.52 H new ATOM 0 HE2 MET A 62 15.358 -15.998 -4.445 1.00 3.52 H new ATOM 0 HE3 MET A 62 14.989 -14.272 -4.218 1.00 3.52 H new ATOM 965 N GLN A 63 20.199 -11.745 -4.492 1.00 75.05 N ATOM 966 CA GLN A 63 21.581 -11.704 -4.954 1.00 21.51 C ATOM 967 C GLN A 63 22.542 -12.066 -3.826 1.00 61.34 C ATOM 968 O GLN A 63 23.585 -12.677 -4.059 1.00 75.25 O ATOM 969 CB GLN A 63 21.918 -10.316 -5.501 1.00 72.33 C ATOM 970 CG GLN A 63 22.012 -9.245 -4.427 1.00 31.12 C ATOM 971 CD GLN A 63 22.249 -7.862 -5.001 1.00 34.13 C ATOM 972 OE1 GLN A 63 21.853 -7.570 -6.130 1.00 1.24 O ATOM 973 NE2 GLN A 63 22.897 -7.002 -4.224 1.00 52.33 N ATOM 0 H GLN A 63 19.733 -10.838 -4.474 1.00 75.05 H new ATOM 0 HA GLN A 63 21.693 -12.438 -5.752 1.00 21.51 H new ATOM 0 HB2 GLN A 63 22.866 -10.366 -6.036 1.00 72.33 H new ATOM 0 HB3 GLN A 63 21.158 -10.026 -6.226 1.00 72.33 H new ATOM 0 HG2 GLN A 63 21.091 -9.239 -3.844 1.00 31.12 H new ATOM 0 HG3 GLN A 63 22.822 -9.493 -3.741 1.00 31.12 H new ATOM 0 HE21 GLN A 63 23.207 -7.287 -3.295 1.00 52.33 H new ATOM 0 HE22 GLN A 63 23.085 -6.056 -4.556 1.00 52.33 H new ATOM 982 N GLU A 64 22.184 -11.684 -2.604 1.00 72.55 N ATOM 983 CA GLU A 64 23.016 -11.968 -1.441 1.00 61.33 C ATOM 984 C GLU A 64 22.489 -13.179 -0.677 1.00 75.32 C ATOM 985 O GLU A 64 22.705 -13.309 0.528 1.00 42.44 O ATOM 986 CB GLU A 64 23.070 -10.751 -0.516 1.00 32.24 C ATOM 987 CG GLU A 64 21.717 -10.359 0.054 1.00 73.34 C ATOM 988 CD GLU A 64 21.780 -9.098 0.893 1.00 21.22 C ATOM 989 OE1 GLU A 64 22.736 -8.961 1.685 1.00 44.43 O ATOM 990 OE2 GLU A 64 20.874 -8.249 0.759 1.00 21.43 O ATOM 0 H GLU A 64 21.324 -11.177 -2.394 1.00 72.55 H new ATOM 0 HA GLU A 64 24.023 -12.193 -1.793 1.00 61.33 H new ATOM 0 HB2 GLU A 64 23.754 -10.960 0.306 1.00 32.24 H new ATOM 0 HB3 GLU A 64 23.482 -9.905 -1.066 1.00 32.24 H new ATOM 0 HG2 GLU A 64 21.011 -10.212 -0.764 1.00 73.34 H new ATOM 0 HG3 GLU A 64 21.333 -11.177 0.663 1.00 73.34 H new ATOM 997 N TRP A 65 21.795 -14.062 -1.386 1.00 62.45 N ATOM 998 CA TRP A 65 21.236 -15.263 -0.775 1.00 53.25 C ATOM 999 C TRP A 65 21.609 -16.506 -1.576 1.00 10.40 C ATOM 1000 O TRP A 65 21.964 -17.539 -1.007 1.00 42.04 O ATOM 1001 CB TRP A 65 19.714 -15.146 -0.672 1.00 41.42 C ATOM 1002 CG TRP A 65 19.091 -16.219 0.168 1.00 4.15 C ATOM 1003 CD1 TRP A 65 18.944 -17.536 -0.161 1.00 25.11 C ATOM 1004 CD2 TRP A 65 18.530 -16.065 1.477 1.00 63.33 C ATOM 1005 NE1 TRP A 65 18.326 -18.211 0.864 1.00 52.31 N ATOM 1006 CE2 TRP A 65 18.062 -17.331 1.880 1.00 22.23 C ATOM 1007 CE3 TRP A 65 18.380 -14.983 2.347 1.00 14.42 C ATOM 1008 CZ2 TRP A 65 17.454 -17.540 3.115 1.00 32.41 C ATOM 1009 CZ3 TRP A 65 17.775 -15.192 3.572 1.00 3.11 C ATOM 1010 CH2 TRP A 65 17.319 -16.463 3.947 1.00 2.44 C ATOM 0 H TRP A 65 21.606 -13.969 -2.384 1.00 62.45 H new ATOM 0 HA TRP A 65 21.655 -15.360 0.226 1.00 53.25 H new ATOM 0 HB2 TRP A 65 19.459 -14.173 -0.253 1.00 41.42 H new ATOM 0 HB3 TRP A 65 19.285 -15.184 -1.673 1.00 41.42 H new ATOM 0 HD1 TRP A 65 19.266 -17.982 -1.090 1.00 25.11 H new ATOM 0 HE1 TRP A 65 18.100 -19.206 0.868 1.00 52.31 H new ATOM 0 HE3 TRP A 65 18.730 -14.000 2.068 1.00 14.42 H new ATOM 0 HZ2 TRP A 65 17.101 -18.518 3.406 1.00 32.41 H new ATOM 0 HZ3 TRP A 65 17.652 -14.362 4.252 1.00 3.11 H new ATOM 0 HH2 TRP A 65 16.852 -16.595 4.912 1.00 2.44 H new ATOM 1021 N LEU A 66 21.527 -16.399 -2.898 1.00 32.54 N ATOM 1022 CA LEU A 66 21.857 -17.516 -3.777 1.00 13.12 C ATOM 1023 C LEU A 66 23.368 -17.678 -3.907 1.00 73.31 C ATOM 1024 O LEU A 66 23.860 -18.761 -4.222 1.00 72.22 O ATOM 1025 CB LEU A 66 21.234 -17.304 -5.158 1.00 21.31 C ATOM 1026 CG LEU A 66 19.745 -17.630 -5.280 1.00 0.21 C ATOM 1027 CD1 LEU A 66 19.239 -17.301 -6.676 1.00 44.00 C ATOM 1028 CD2 LEU A 66 19.490 -19.093 -4.949 1.00 62.23 C ATOM 0 H LEU A 66 21.235 -15.551 -3.384 1.00 32.54 H new ATOM 0 HA LEU A 66 21.449 -18.426 -3.337 1.00 13.12 H new ATOM 0 HB2 LEU A 66 21.382 -16.263 -5.445 1.00 21.31 H new ATOM 0 HB3 LEU A 66 21.779 -17.914 -5.878 1.00 21.31 H new ATOM 0 HG LEU A 66 19.199 -17.016 -4.564 1.00 0.21 H new ATOM 0 HD11 LEU A 66 18.178 -17.540 -6.744 1.00 44.00 H new ATOM 0 HD12 LEU A 66 19.386 -16.240 -6.875 1.00 44.00 H new ATOM 0 HD13 LEU A 66 19.790 -17.888 -7.411 1.00 44.00 H new ATOM 0 HD21 LEU A 66 18.425 -19.307 -5.041 1.00 62.23 H new ATOM 0 HD22 LEU A 66 20.048 -19.725 -5.640 1.00 62.23 H new ATOM 0 HD23 LEU A 66 19.814 -19.297 -3.928 1.00 62.23 H new ATOM 1040 N GLU A 67 24.098 -16.595 -3.660 1.00 73.03 N ATOM 1041 CA GLU A 67 25.553 -16.619 -3.749 1.00 0.11 C ATOM 1042 C GLU A 67 26.149 -17.522 -2.673 1.00 31.11 C ATOM 1043 O GLU A 67 27.256 -18.040 -2.823 1.00 71.33 O ATOM 1044 CB GLU A 67 26.118 -15.203 -3.612 1.00 72.44 C ATOM 1045 CG GLU A 67 26.053 -14.656 -2.196 1.00 75.04 C ATOM 1046 CD GLU A 67 26.460 -13.198 -2.115 1.00 41.34 C ATOM 1047 OE1 GLU A 67 26.676 -12.581 -3.180 1.00 24.54 O ATOM 1048 OE2 GLU A 67 26.562 -12.673 -0.987 1.00 3.14 O ATOM 0 H GLU A 67 23.706 -15.691 -3.397 1.00 73.03 H new ATOM 0 HA GLU A 67 25.825 -17.018 -4.726 1.00 0.11 H new ATOM 0 HB2 GLU A 67 27.156 -15.201 -3.946 1.00 72.44 H new ATOM 0 HB3 GLU A 67 25.568 -14.536 -4.276 1.00 72.44 H new ATOM 0 HG2 GLU A 67 25.038 -14.768 -1.813 1.00 75.04 H new ATOM 0 HG3 GLU A 67 26.704 -15.247 -1.552 1.00 75.04 H new ATOM 1055 N THR A 68 25.407 -17.706 -1.585 1.00 73.23 N ATOM 1056 CA THR A 68 25.861 -18.544 -0.483 1.00 32.41 C ATOM 1057 C THR A 68 24.998 -19.794 -0.351 1.00 13.25 C ATOM 1058 O THR A 68 25.509 -20.894 -0.143 1.00 65.24 O ATOM 1059 CB THR A 68 25.840 -17.776 0.852 1.00 25.31 C ATOM 1060 OG1 THR A 68 25.987 -18.690 1.945 1.00 0.21 O ATOM 1061 CG2 THR A 68 24.544 -16.995 1.008 1.00 63.55 C ATOM 0 H THR A 68 24.489 -17.285 -1.444 1.00 73.23 H new ATOM 0 HA THR A 68 26.886 -18.836 -0.710 1.00 32.41 H new ATOM 0 HB THR A 68 26.672 -17.071 0.853 1.00 25.31 H new ATOM 0 HG1 THR A 68 25.974 -18.194 2.790 1.00 0.21 H new ATOM 0 HG21 THR A 68 24.553 -16.461 1.958 1.00 63.55 H new ATOM 0 HG22 THR A 68 24.450 -16.280 0.191 1.00 63.55 H new ATOM 0 HG23 THR A 68 23.699 -17.684 0.987 1.00 63.55 H new ATOM 1069 N ARG A 69 23.686 -19.617 -0.472 1.00 41.10 N ATOM 1070 CA ARG A 69 22.752 -20.731 -0.365 1.00 72.03 C ATOM 1071 C ARG A 69 22.274 -21.174 -1.745 1.00 61.11 C ATOM 1072 O ARG A 69 22.369 -20.425 -2.716 1.00 52.22 O ATOM 1073 CB ARG A 69 21.553 -20.338 0.499 1.00 13.34 C ATOM 1074 CG ARG A 69 21.820 -20.435 1.992 1.00 3.14 C ATOM 1075 CD ARG A 69 21.411 -21.791 2.545 1.00 62.55 C ATOM 1076 NE ARG A 69 21.770 -21.940 3.952 1.00 24.43 N ATOM 1077 CZ ARG A 69 22.998 -22.227 4.371 1.00 11.02 C ATOM 1078 NH1 ARG A 69 23.979 -22.394 3.495 1.00 72.20 N ATOM 1079 NH2 ARG A 69 23.246 -22.346 5.669 1.00 24.31 N ATOM 0 H ARG A 69 23.246 -18.713 -0.644 1.00 41.10 H new ATOM 0 HA ARG A 69 23.273 -21.565 0.106 1.00 72.03 H new ATOM 0 HB2 ARG A 69 21.261 -19.316 0.256 1.00 13.34 H new ATOM 0 HB3 ARG A 69 20.709 -20.980 0.247 1.00 13.34 H new ATOM 0 HG2 ARG A 69 22.880 -20.267 2.185 1.00 3.14 H new ATOM 0 HG3 ARG A 69 21.273 -19.649 2.512 1.00 3.14 H new ATOM 0 HD2 ARG A 69 20.335 -21.919 2.430 1.00 62.55 H new ATOM 0 HD3 ARG A 69 21.890 -22.579 1.964 1.00 62.55 H new ATOM 0 HE ARG A 69 21.038 -21.817 4.652 1.00 24.43 H new ATOM 0 HH11 ARG A 69 23.792 -22.302 2.496 1.00 72.20 H new ATOM 0 HH12 ARG A 69 24.921 -22.614 3.820 1.00 72.20 H new ATOM 0 HH21 ARG A 69 22.494 -22.217 6.346 1.00 24.31 H new ATOM 0 HH22 ARG A 69 24.189 -22.566 5.990 1.00 24.31 H new ATOM 1093 N GLY A 70 21.761 -22.398 -1.823 1.00 74.13 N ATOM 1094 CA GLY A 70 21.276 -22.920 -3.088 1.00 25.11 C ATOM 1095 C GLY A 70 21.099 -24.425 -3.064 1.00 35.22 C ATOM 1096 O GLY A 70 20.061 -24.941 -3.479 1.00 71.11 O ATOM 0 H GLY A 70 21.672 -23.037 -1.033 1.00 74.13 H new ATOM 0 HA2 GLY A 70 20.323 -22.449 -3.331 1.00 25.11 H new ATOM 0 HA3 GLY A 70 21.975 -22.652 -3.880 1.00 25.11 H new ATOM 1100 N SER A 71 22.114 -25.132 -2.578 1.00 10.01 N ATOM 1101 CA SER A 71 22.067 -26.588 -2.507 1.00 3.34 C ATOM 1102 C SER A 71 23.305 -27.137 -1.803 1.00 74.11 C ATOM 1103 O SER A 71 24.333 -26.470 -1.690 1.00 64.31 O ATOM 1104 CB SER A 71 21.958 -27.185 -3.911 1.00 14.12 C ATOM 1105 OG SER A 71 20.603 -27.388 -4.274 1.00 41.34 O ATOM 0 H SER A 71 22.979 -24.720 -2.228 1.00 10.01 H new ATOM 0 HA SER A 71 21.186 -26.871 -1.931 1.00 3.34 H new ATOM 0 HB2 SER A 71 22.435 -26.520 -4.631 1.00 14.12 H new ATOM 0 HB3 SER A 71 22.494 -28.133 -3.949 1.00 14.12 H new ATOM 0 HG SER A 71 20.087 -26.577 -4.080 1.00 41.34 H new ATOM 1111 N PRO A 72 23.204 -28.384 -1.318 1.00 52.41 N ATOM 1112 CA PRO A 72 24.305 -29.052 -0.618 1.00 14.35 C ATOM 1113 C PRO A 72 25.458 -29.403 -1.551 1.00 74.34 C ATOM 1114 O PRO A 72 26.620 -29.130 -1.251 1.00 13.43 O ATOM 1115 CB PRO A 72 23.655 -30.324 -0.068 1.00 12.03 C ATOM 1116 CG PRO A 72 22.506 -30.586 -0.979 1.00 34.43 C ATOM 1117 CD PRO A 72 22.008 -29.237 -1.417 1.00 12.23 C ATOM 0 HA PRO A 72 24.746 -28.416 0.149 1.00 14.35 H new ATOM 0 HB2 PRO A 72 24.357 -31.158 -0.066 1.00 12.03 H new ATOM 0 HB3 PRO A 72 23.321 -30.185 0.960 1.00 12.03 H new ATOM 0 HG2 PRO A 72 22.816 -31.184 -1.836 1.00 34.43 H new ATOM 0 HG3 PRO A 72 21.722 -31.144 -0.467 1.00 34.43 H new ATOM 0 HD2 PRO A 72 21.616 -29.264 -2.434 1.00 12.23 H new ATOM 0 HD3 PRO A 72 21.204 -28.878 -0.775 1.00 12.23 H new ATOM 1125 N LYS A 73 25.129 -30.011 -2.686 1.00 62.24 N ATOM 1126 CA LYS A 73 26.137 -30.399 -3.666 1.00 73.24 C ATOM 1127 C LYS A 73 26.291 -29.328 -4.741 1.00 45.20 C ATOM 1128 O LYS A 73 26.442 -29.638 -5.923 1.00 1.33 O ATOM 1129 CB LYS A 73 25.761 -31.735 -4.313 1.00 4.52 C ATOM 1130 CG LYS A 73 25.965 -32.931 -3.400 1.00 4.04 C ATOM 1131 CD LYS A 73 25.147 -34.127 -3.856 1.00 54.11 C ATOM 1132 CE LYS A 73 25.553 -35.394 -3.120 1.00 31.31 C ATOM 1133 NZ LYS A 73 24.714 -36.559 -3.516 1.00 63.14 N ATOM 0 H LYS A 73 24.172 -30.246 -2.950 1.00 62.24 H new ATOM 0 HA LYS A 73 27.089 -30.508 -3.147 1.00 73.24 H new ATOM 0 HB2 LYS A 73 24.716 -31.698 -4.622 1.00 4.52 H new ATOM 0 HB3 LYS A 73 26.356 -31.872 -5.216 1.00 4.52 H new ATOM 0 HG2 LYS A 73 27.022 -33.198 -3.380 1.00 4.04 H new ATOM 0 HG3 LYS A 73 25.684 -32.664 -2.381 1.00 4.04 H new ATOM 0 HD2 LYS A 73 24.088 -33.930 -3.687 1.00 54.11 H new ATOM 0 HD3 LYS A 73 25.277 -34.271 -4.929 1.00 54.11 H new ATOM 0 HE2 LYS A 73 26.600 -35.614 -3.326 1.00 31.31 H new ATOM 0 HE3 LYS A 73 25.467 -35.233 -2.045 1.00 31.31 H new ATOM 0 HZ1 LYS A 73 25.022 -37.403 -2.992 1.00 63.14 H new ATOM 0 HZ2 LYS A 73 23.717 -36.360 -3.296 1.00 63.14 H new ATOM 0 HZ3 LYS A 73 24.816 -36.729 -4.537 1.00 63.14 H new ATOM 1147 N SER A 74 26.255 -28.067 -4.323 1.00 14.33 N ATOM 1148 CA SER A 74 26.389 -26.949 -5.250 1.00 75.41 C ATOM 1149 C SER A 74 27.399 -25.931 -4.732 1.00 25.13 C ATOM 1150 O SER A 74 27.083 -24.752 -4.570 1.00 44.15 O ATOM 1151 CB SER A 74 25.033 -26.274 -5.467 1.00 60.13 C ATOM 1152 OG SER A 74 25.149 -25.170 -6.348 1.00 14.12 O ATOM 0 H SER A 74 26.134 -27.794 -3.348 1.00 14.33 H new ATOM 0 HA SER A 74 26.749 -27.340 -6.202 1.00 75.41 H new ATOM 0 HB2 SER A 74 24.325 -26.996 -5.874 1.00 60.13 H new ATOM 0 HB3 SER A 74 24.632 -25.939 -4.510 1.00 60.13 H new ATOM 0 HG SER A 74 25.759 -24.507 -5.963 1.00 14.12 H new ATOM 1158 N HIS A 75 28.618 -26.396 -4.472 1.00 13.50 N ATOM 1159 CA HIS A 75 29.677 -25.526 -3.972 1.00 33.10 C ATOM 1160 C HIS A 75 29.831 -24.293 -4.857 1.00 55.02 C ATOM 1161 O HIS A 75 30.221 -24.397 -6.020 1.00 63.12 O ATOM 1162 CB HIS A 75 31.001 -26.288 -3.904 1.00 11.54 C ATOM 1163 CG HIS A 75 31.148 -27.123 -2.669 1.00 62.24 C ATOM 1164 ND1 HIS A 75 30.821 -28.462 -2.624 1.00 3.04 N ATOM 1165 CD2 HIS A 75 31.592 -26.803 -1.431 1.00 63.25 C ATOM 1166 CE1 HIS A 75 31.056 -28.929 -1.410 1.00 43.04 C ATOM 1167 NE2 HIS A 75 31.525 -27.942 -0.668 1.00 21.43 N ATOM 0 H HIS A 75 28.896 -27.369 -4.599 1.00 13.50 H new ATOM 0 HA HIS A 75 29.402 -25.199 -2.969 1.00 33.10 H new ATOM 0 HB2 HIS A 75 31.086 -26.931 -4.780 1.00 11.54 H new ATOM 0 HB3 HIS A 75 31.824 -25.575 -3.951 1.00 11.54 H new ATOM 0 HD2 HIS A 75 31.935 -25.832 -1.104 1.00 63.25 H new ATOM 0 HE1 HIS A 75 30.892 -29.945 -1.081 1.00 43.04 H new ATOM 0 HE2 HIS A 75 31.794 -28.015 0.313 1.00 21.43 H new ATOM 1175 N ILE A 76 29.520 -23.128 -4.299 1.00 41.32 N ATOM 1176 CA ILE A 76 29.624 -21.876 -5.038 1.00 44.42 C ATOM 1177 C ILE A 76 30.987 -21.224 -4.826 1.00 72.25 C ATOM 1178 O ILE A 76 31.144 -20.355 -3.969 1.00 23.44 O ATOM 1179 CB ILE A 76 28.523 -20.883 -4.622 1.00 10.11 C ATOM 1180 CG1 ILE A 76 27.145 -21.538 -4.739 1.00 0.32 C ATOM 1181 CG2 ILE A 76 28.592 -19.626 -5.476 1.00 63.03 C ATOM 1182 CD1 ILE A 76 26.026 -20.696 -4.168 1.00 15.13 C ATOM 0 H ILE A 76 29.194 -23.025 -3.338 1.00 41.32 H new ATOM 0 HA ILE A 76 29.501 -22.121 -6.093 1.00 44.42 H new ATOM 0 HB ILE A 76 28.684 -20.600 -3.582 1.00 10.11 H new ATOM 0 HG12 ILE A 76 26.936 -21.741 -5.789 1.00 0.32 H new ATOM 0 HG13 ILE A 76 27.164 -22.499 -4.226 1.00 0.32 H new ATOM 0 HG21 ILE A 76 27.807 -18.934 -5.169 1.00 63.03 H new ATOM 0 HG22 ILE A 76 29.565 -19.151 -5.347 1.00 63.03 H new ATOM 0 HG23 ILE A 76 28.453 -19.890 -6.524 1.00 63.03 H new ATOM 0 HD11 ILE A 76 25.079 -21.222 -4.285 1.00 15.13 H new ATOM 0 HD12 ILE A 76 26.211 -20.514 -3.109 1.00 15.13 H new ATOM 0 HD13 ILE A 76 25.980 -19.744 -4.697 1.00 15.13 H new ATOM 1194 N ASP A 77 31.968 -21.648 -5.615 1.00 70.41 N ATOM 1195 CA ASP A 77 33.317 -21.104 -5.517 1.00 25.44 C ATOM 1196 C ASP A 77 33.349 -19.645 -5.959 1.00 54.21 C ATOM 1197 O ASP A 77 34.206 -18.872 -5.529 1.00 74.43 O ATOM 1198 CB ASP A 77 34.286 -21.929 -6.366 1.00 51.34 C ATOM 1199 CG ASP A 77 34.617 -23.266 -5.734 1.00 20.12 C ATOM 1200 OD1 ASP A 77 34.311 -23.449 -4.537 1.00 12.33 O ATOM 1201 OD2 ASP A 77 35.182 -24.130 -6.436 1.00 33.41 O ATOM 0 H ASP A 77 31.854 -22.367 -6.330 1.00 70.41 H new ATOM 0 HA ASP A 77 33.627 -21.155 -4.473 1.00 25.44 H new ATOM 0 HB2 ASP A 77 33.850 -22.094 -7.351 1.00 51.34 H new ATOM 0 HB3 ASP A 77 35.206 -21.363 -6.515 1.00 51.34 H new ATOM 1206 N LYS A 78 32.409 -19.273 -6.822 1.00 32.32 N ATOM 1207 CA LYS A 78 32.327 -17.907 -7.324 1.00 2.34 C ATOM 1208 C LYS A 78 30.929 -17.604 -7.854 1.00 24.50 C ATOM 1209 O LYS A 78 30.347 -18.404 -8.587 1.00 2.53 O ATOM 1210 CB LYS A 78 33.363 -17.685 -8.428 1.00 54.54 C ATOM 1211 CG LYS A 78 33.281 -16.311 -9.071 1.00 51.22 C ATOM 1212 CD LYS A 78 34.179 -16.213 -10.293 1.00 53.41 C ATOM 1213 CE LYS A 78 35.637 -16.032 -9.900 1.00 70.32 C ATOM 1214 NZ LYS A 78 36.450 -15.484 -11.021 1.00 54.30 N ATOM 0 H LYS A 78 31.693 -19.900 -7.188 1.00 32.32 H new ATOM 0 HA LYS A 78 32.536 -17.229 -6.496 1.00 2.34 H new ATOM 0 HB2 LYS A 78 34.361 -17.823 -8.012 1.00 54.54 H new ATOM 0 HB3 LYS A 78 33.231 -18.446 -9.197 1.00 54.54 H new ATOM 0 HG2 LYS A 78 32.250 -16.104 -9.358 1.00 51.22 H new ATOM 0 HG3 LYS A 78 33.569 -15.551 -8.345 1.00 51.22 H new ATOM 0 HD2 LYS A 78 34.073 -17.114 -10.897 1.00 53.41 H new ATOM 0 HD3 LYS A 78 33.861 -15.375 -10.913 1.00 53.41 H new ATOM 0 HE2 LYS A 78 35.702 -15.361 -9.043 1.00 70.32 H new ATOM 0 HE3 LYS A 78 36.050 -16.991 -9.586 1.00 70.32 H new ATOM 0 HZ1 LYS A 78 37.437 -15.375 -10.713 1.00 54.30 H new ATOM 0 HZ2 LYS A 78 36.409 -16.136 -11.830 1.00 54.30 H new ATOM 0 HZ3 LYS A 78 36.072 -14.557 -11.304 1.00 54.30 H new ATOM 1228 N ALA A 79 30.397 -16.445 -7.480 1.00 23.50 N ATOM 1229 CA ALA A 79 29.070 -16.037 -7.921 1.00 54.42 C ATOM 1230 C ALA A 79 29.134 -14.750 -8.738 1.00 23.42 C ATOM 1231 O ALA A 79 29.247 -13.658 -8.184 1.00 14.30 O ATOM 1232 CB ALA A 79 28.147 -15.858 -6.724 1.00 64.42 C ATOM 0 H ALA A 79 30.865 -15.772 -6.873 1.00 23.50 H new ATOM 0 HA ALA A 79 28.670 -16.824 -8.561 1.00 54.42 H new ATOM 0 HB1 ALA A 79 27.159 -15.553 -7.069 1.00 64.42 H new ATOM 0 HB2 ALA A 79 28.067 -16.800 -6.182 1.00 64.42 H new ATOM 0 HB3 ALA A 79 28.553 -15.092 -6.063 1.00 64.42 H new ATOM 1238 N ASN A 80 29.063 -14.889 -10.058 1.00 4.23 N ATOM 1239 CA ASN A 80 29.115 -13.737 -10.951 1.00 3.02 C ATOM 1240 C ASN A 80 27.776 -13.532 -11.652 1.00 50.50 C ATOM 1241 O ASN A 80 26.870 -14.358 -11.539 1.00 25.11 O ATOM 1242 CB ASN A 80 30.224 -13.920 -11.989 1.00 4.22 C ATOM 1243 CG ASN A 80 30.740 -12.597 -12.523 1.00 71.41 C ATOM 1244 OD1 ASN A 80 30.462 -12.225 -13.663 1.00 60.22 O ATOM 1245 ND2 ASN A 80 31.496 -11.881 -11.699 1.00 54.21 N ATOM 0 H ASN A 80 28.969 -15.787 -10.533 1.00 4.23 H new ATOM 0 HA ASN A 80 29.330 -12.853 -10.351 1.00 3.02 H new ATOM 0 HB2 ASN A 80 31.049 -14.475 -11.542 1.00 4.22 H new ATOM 0 HB3 ASN A 80 29.848 -14.521 -12.817 1.00 4.22 H new ATOM 0 HD21 ASN A 80 31.872 -10.983 -12.003 1.00 54.21 H new ATOM 0 HD22 ASN A 80 31.700 -12.229 -10.762 1.00 54.21 H new ATOM 1252 N PHE A 81 27.658 -12.424 -12.377 1.00 73.22 N ATOM 1253 CA PHE A 81 26.429 -12.109 -13.097 1.00 62.30 C ATOM 1254 C PHE A 81 26.734 -11.369 -14.396 1.00 64.30 C ATOM 1255 O PHE A 81 27.895 -11.144 -14.736 1.00 51.13 O ATOM 1256 CB PHE A 81 25.502 -11.264 -12.221 1.00 61.10 C ATOM 1257 CG PHE A 81 26.199 -10.122 -11.538 1.00 61.30 C ATOM 1258 CD1 PHE A 81 26.519 -8.970 -12.238 1.00 62.33 C ATOM 1259 CD2 PHE A 81 26.534 -10.201 -10.196 1.00 13.32 C ATOM 1260 CE1 PHE A 81 27.161 -7.919 -11.612 1.00 43.43 C ATOM 1261 CE2 PHE A 81 27.175 -9.152 -9.564 1.00 45.03 C ATOM 1262 CZ PHE A 81 27.489 -8.009 -10.273 1.00 53.04 C ATOM 0 H PHE A 81 28.398 -11.730 -12.481 1.00 73.22 H new ATOM 0 HA PHE A 81 25.931 -13.047 -13.342 1.00 62.30 H new ATOM 0 HB2 PHE A 81 24.693 -10.870 -12.836 1.00 61.10 H new ATOM 0 HB3 PHE A 81 25.045 -11.904 -11.466 1.00 61.10 H new ATOM 0 HD1 PHE A 81 26.264 -8.893 -13.285 1.00 62.33 H new ATOM 0 HD2 PHE A 81 26.291 -11.093 -9.637 1.00 13.32 H new ATOM 0 HE1 PHE A 81 27.406 -7.027 -12.169 1.00 43.43 H new ATOM 0 HE2 PHE A 81 27.430 -9.226 -8.517 1.00 45.03 H new ATOM 0 HZ PHE A 81 27.990 -7.188 -9.782 1.00 53.04 H new ATOM 1272 N ASN A 82 25.683 -10.995 -15.118 1.00 1.54 N ATOM 1273 CA ASN A 82 25.838 -10.281 -16.380 1.00 53.11 C ATOM 1274 C ASN A 82 24.485 -9.821 -16.914 1.00 54.12 C ATOM 1275 O ASN A 82 23.439 -10.164 -16.364 1.00 25.23 O ATOM 1276 CB ASN A 82 26.530 -11.173 -17.413 1.00 13.13 C ATOM 1277 CG ASN A 82 27.334 -10.374 -18.420 1.00 72.44 C ATOM 1278 OD1 ASN A 82 27.060 -10.412 -19.620 1.00 70.50 O ATOM 1279 ND2 ASN A 82 28.333 -9.646 -17.936 1.00 12.21 N ATOM 0 H ASN A 82 24.715 -11.174 -14.851 1.00 1.54 H new ATOM 0 HA ASN A 82 26.455 -9.401 -16.198 1.00 53.11 H new ATOM 0 HB2 ASN A 82 27.189 -11.874 -16.901 1.00 13.13 H new ATOM 0 HB3 ASN A 82 25.781 -11.765 -17.938 1.00 13.13 H new ATOM 0 HD21 ASN A 82 28.909 -9.088 -18.566 1.00 12.21 H new ATOM 0 HD22 ASN A 82 28.524 -9.644 -16.934 1.00 12.21 H new ATOM 1286 N ASN A 83 24.513 -9.042 -17.991 1.00 23.21 N ATOM 1287 CA ASN A 83 23.289 -8.535 -18.600 1.00 42.21 C ATOM 1288 C ASN A 83 22.448 -7.775 -17.579 1.00 41.31 C ATOM 1289 O ASN A 83 21.225 -7.907 -17.546 1.00 62.35 O ATOM 1290 CB ASN A 83 22.474 -9.686 -19.193 1.00 25.44 C ATOM 1291 CG ASN A 83 23.174 -10.347 -20.365 1.00 3.51 C ATOM 1292 OD1 ASN A 83 23.582 -9.678 -21.315 1.00 62.20 O ATOM 1293 ND2 ASN A 83 23.316 -11.665 -20.303 1.00 22.42 N ATOM 0 H ASN A 83 25.370 -8.748 -18.460 1.00 23.21 H new ATOM 0 HA ASN A 83 23.568 -7.848 -19.399 1.00 42.21 H new ATOM 0 HB2 ASN A 83 22.285 -10.430 -18.419 1.00 25.44 H new ATOM 0 HB3 ASN A 83 21.503 -9.311 -19.518 1.00 25.44 H new ATOM 0 HD21 ASN A 83 23.779 -12.164 -21.062 1.00 22.42 H new ATOM 0 HD22 ASN A 83 22.962 -12.179 -19.496 1.00 22.42 H new ATOM 1300 N GLU A 84 23.113 -6.978 -16.748 1.00 60.01 N ATOM 1301 CA GLU A 84 22.426 -6.197 -15.726 1.00 41.02 C ATOM 1302 C GLU A 84 21.942 -4.865 -16.293 1.00 24.21 C ATOM 1303 O GLU A 84 22.739 -4.047 -16.754 1.00 31.23 O ATOM 1304 CB GLU A 84 23.352 -5.950 -14.533 1.00 71.03 C ATOM 1305 CG GLU A 84 22.617 -5.548 -13.266 1.00 21.25 C ATOM 1306 CD GLU A 84 23.468 -4.698 -12.342 1.00 42.05 C ATOM 1307 OE1 GLU A 84 23.544 -3.472 -12.566 1.00 13.22 O ATOM 1308 OE2 GLU A 84 24.059 -5.260 -11.396 1.00 52.31 O ATOM 0 H GLU A 84 24.126 -6.856 -16.763 1.00 60.01 H new ATOM 0 HA GLU A 84 21.559 -6.766 -15.392 1.00 41.02 H new ATOM 0 HB2 GLU A 84 23.928 -6.854 -14.337 1.00 71.03 H new ATOM 0 HB3 GLU A 84 24.065 -5.168 -14.793 1.00 71.03 H new ATOM 0 HG2 GLU A 84 21.715 -4.997 -13.533 1.00 21.25 H new ATOM 0 HG3 GLU A 84 22.297 -6.445 -12.736 1.00 21.25 H new ATOM 1315 N LYS A 85 20.631 -4.655 -16.256 1.00 0.41 N ATOM 1316 CA LYS A 85 20.039 -3.423 -16.764 1.00 73.13 C ATOM 1317 C LYS A 85 18.637 -3.220 -16.199 1.00 13.21 C ATOM 1318 O LYS A 85 18.067 -4.122 -15.585 1.00 22.12 O ATOM 1319 CB LYS A 85 19.984 -3.452 -18.293 1.00 61.54 C ATOM 1320 CG LYS A 85 19.437 -4.752 -18.858 1.00 30.24 C ATOM 1321 CD LYS A 85 19.252 -4.672 -20.364 1.00 21.33 C ATOM 1322 CE LYS A 85 18.703 -5.974 -20.928 1.00 15.53 C ATOM 1323 NZ LYS A 85 19.786 -6.951 -21.224 1.00 41.15 N ATOM 0 H LYS A 85 19.958 -5.322 -15.879 1.00 0.41 H new ATOM 0 HA LYS A 85 20.665 -2.590 -16.444 1.00 73.13 H new ATOM 0 HB2 LYS A 85 19.365 -2.625 -18.642 1.00 61.54 H new ATOM 0 HB3 LYS A 85 20.987 -3.288 -18.687 1.00 61.54 H new ATOM 0 HG2 LYS A 85 20.117 -5.569 -18.617 1.00 30.24 H new ATOM 0 HG3 LYS A 85 18.482 -4.982 -18.385 1.00 30.24 H new ATOM 0 HD2 LYS A 85 18.573 -3.855 -20.605 1.00 21.33 H new ATOM 0 HD3 LYS A 85 20.207 -4.443 -20.837 1.00 21.33 H new ATOM 0 HE2 LYS A 85 18.004 -6.412 -20.216 1.00 15.53 H new ATOM 0 HE3 LYS A 85 18.142 -5.767 -21.839 1.00 15.53 H new ATOM 0 HZ1 LYS A 85 19.371 -7.824 -21.606 1.00 41.15 H new ATOM 0 HZ2 LYS A 85 20.440 -6.544 -21.923 1.00 41.15 H new ATOM 0 HZ3 LYS A 85 20.306 -7.169 -20.350 1.00 41.15 H new ATOM 1337 N VAL A 86 18.085 -2.029 -16.411 1.00 74.43 N ATOM 1338 CA VAL A 86 16.748 -1.709 -15.925 1.00 50.21 C ATOM 1339 C VAL A 86 15.721 -1.789 -17.049 1.00 14.04 C ATOM 1340 O VAL A 86 16.020 -1.472 -18.200 1.00 75.13 O ATOM 1341 CB VAL A 86 16.701 -0.302 -15.300 1.00 55.23 C ATOM 1342 CG1 VAL A 86 17.722 -0.180 -14.180 1.00 34.25 C ATOM 1343 CG2 VAL A 86 16.934 0.761 -16.363 1.00 65.14 C ATOM 0 H VAL A 86 18.543 -1.270 -16.916 1.00 74.43 H new ATOM 0 HA VAL A 86 16.503 -2.447 -15.161 1.00 50.21 H new ATOM 0 HB VAL A 86 15.710 -0.146 -14.874 1.00 55.23 H new ATOM 0 HG11 VAL A 86 17.674 0.821 -13.751 1.00 34.25 H new ATOM 0 HG12 VAL A 86 17.504 -0.917 -13.407 1.00 34.25 H new ATOM 0 HG13 VAL A 86 18.721 -0.356 -14.578 1.00 34.25 H new ATOM 0 HG21 VAL A 86 16.897 1.749 -15.904 1.00 65.14 H new ATOM 0 HG22 VAL A 86 17.912 0.610 -16.821 1.00 65.14 H new ATOM 0 HG23 VAL A 86 16.160 0.687 -17.127 1.00 65.14 H new ATOM 1353 N ILE A 87 14.509 -2.214 -16.706 1.00 23.12 N ATOM 1354 CA ILE A 87 13.437 -2.334 -17.686 1.00 32.34 C ATOM 1355 C ILE A 87 12.133 -1.756 -17.147 1.00 13.01 C ATOM 1356 O ILE A 87 12.046 -1.374 -15.979 1.00 74.11 O ATOM 1357 CB ILE A 87 13.206 -3.802 -18.090 1.00 71.23 C ATOM 1358 CG1 ILE A 87 12.852 -4.643 -16.862 1.00 31.00 C ATOM 1359 CG2 ILE A 87 14.439 -4.361 -18.784 1.00 5.23 C ATOM 1360 CD1 ILE A 87 14.060 -5.196 -16.139 1.00 44.33 C ATOM 0 H ILE A 87 14.246 -2.481 -15.757 1.00 23.12 H new ATOM 0 HA ILE A 87 13.747 -1.768 -18.564 1.00 32.34 H new ATOM 0 HB ILE A 87 12.370 -3.843 -18.788 1.00 71.23 H new ATOM 0 HG12 ILE A 87 12.272 -4.033 -16.169 1.00 31.00 H new ATOM 0 HG13 ILE A 87 12.213 -5.471 -17.170 1.00 31.00 H new ATOM 0 HG21 ILE A 87 14.260 -5.399 -19.063 1.00 5.23 H new ATOM 0 HG22 ILE A 87 14.650 -3.776 -19.679 1.00 5.23 H new ATOM 0 HG23 ILE A 87 15.292 -4.309 -18.108 1.00 5.23 H new ATOM 0 HD11 ILE A 87 13.733 -5.781 -15.280 1.00 44.33 H new ATOM 0 HD12 ILE A 87 14.629 -5.833 -16.816 1.00 44.33 H new ATOM 0 HD13 ILE A 87 14.689 -4.373 -15.799 1.00 44.33 H new ATOM 1372 N LEU A 88 11.120 -1.696 -18.004 1.00 40.35 N ATOM 1373 CA LEU A 88 9.818 -1.166 -17.615 1.00 11.32 C ATOM 1374 C LEU A 88 9.190 -2.018 -16.517 1.00 14.23 C ATOM 1375 O LEU A 88 8.902 -1.529 -15.424 1.00 50.30 O ATOM 1376 CB LEU A 88 8.886 -1.107 -18.826 1.00 50.44 C ATOM 1377 CG LEU A 88 9.014 0.133 -19.712 1.00 43.20 C ATOM 1378 CD1 LEU A 88 8.667 1.388 -18.927 1.00 15.41 C ATOM 1379 CD2 LEU A 88 10.419 0.234 -20.288 1.00 3.32 C ATOM 0 H LEU A 88 11.175 -2.008 -18.974 1.00 40.35 H new ATOM 0 HA LEU A 88 9.965 -0.157 -17.228 1.00 11.32 H new ATOM 0 HB2 LEU A 88 9.066 -1.989 -19.441 1.00 50.44 H new ATOM 0 HB3 LEU A 88 7.857 -1.171 -18.471 1.00 50.44 H new ATOM 0 HG LEU A 88 8.309 0.040 -20.538 1.00 43.20 H new ATOM 0 HD11 LEU A 88 8.764 2.260 -19.574 1.00 15.41 H new ATOM 0 HD12 LEU A 88 7.642 1.318 -18.563 1.00 15.41 H new ATOM 0 HD13 LEU A 88 9.346 1.487 -18.080 1.00 15.41 H new ATOM 0 HD21 LEU A 88 10.492 1.122 -20.916 1.00 3.32 H new ATOM 0 HD22 LEU A 88 11.141 0.304 -19.475 1.00 3.32 H new ATOM 0 HD23 LEU A 88 10.631 -0.652 -20.887 1.00 3.32 H new ATOM 1391 N LYS A 89 8.981 -3.296 -16.813 1.00 51.04 N ATOM 1392 CA LYS A 89 8.390 -4.219 -15.851 1.00 42.32 C ATOM 1393 C LYS A 89 8.838 -5.651 -16.125 1.00 54.15 C ATOM 1394 O LYS A 89 9.639 -5.900 -17.027 1.00 2.11 O ATOM 1395 CB LYS A 89 6.863 -4.132 -15.901 1.00 41.44 C ATOM 1396 CG LYS A 89 6.310 -2.827 -15.355 1.00 50.33 C ATOM 1397 CD LYS A 89 4.916 -3.010 -14.780 1.00 13.44 C ATOM 1398 CE LYS A 89 3.860 -3.035 -15.874 1.00 73.20 C ATOM 1399 NZ LYS A 89 2.497 -2.772 -15.336 1.00 15.33 N ATOM 0 H LYS A 89 9.212 -3.717 -17.713 1.00 51.04 H new ATOM 0 HA LYS A 89 8.731 -3.935 -14.856 1.00 42.32 H new ATOM 0 HB2 LYS A 89 6.534 -4.253 -16.933 1.00 41.44 H new ATOM 0 HB3 LYS A 89 6.441 -4.961 -15.333 1.00 41.44 H new ATOM 0 HG2 LYS A 89 6.976 -2.444 -14.582 1.00 50.33 H new ATOM 0 HG3 LYS A 89 6.282 -2.082 -16.150 1.00 50.33 H new ATOM 0 HD2 LYS A 89 4.875 -3.939 -14.212 1.00 13.44 H new ATOM 0 HD3 LYS A 89 4.700 -2.201 -14.083 1.00 13.44 H new ATOM 0 HE2 LYS A 89 4.102 -2.288 -16.630 1.00 73.20 H new ATOM 0 HE3 LYS A 89 3.874 -4.006 -16.370 1.00 73.20 H new ATOM 0 HZ1 LYS A 89 1.806 -2.798 -16.113 1.00 15.33 H new ATOM 0 HZ2 LYS A 89 2.255 -3.499 -14.633 1.00 15.33 H new ATOM 0 HZ3 LYS A 89 2.477 -1.835 -14.885 1.00 15.33 H new ATOM 1413 N LEU A 90 8.314 -6.589 -15.344 1.00 61.13 N ATOM 1414 CA LEU A 90 8.658 -7.998 -15.504 1.00 45.31 C ATOM 1415 C LEU A 90 8.177 -8.526 -16.851 1.00 62.45 C ATOM 1416 O LEU A 90 7.263 -7.968 -17.458 1.00 35.32 O ATOM 1417 CB LEU A 90 8.047 -8.824 -14.371 1.00 64.23 C ATOM 1418 CG LEU A 90 8.302 -8.312 -12.953 1.00 45.44 C ATOM 1419 CD1 LEU A 90 7.152 -8.691 -12.034 1.00 24.24 C ATOM 1420 CD2 LEU A 90 9.618 -8.857 -12.418 1.00 4.22 C ATOM 0 H LEU A 90 7.649 -6.400 -14.594 1.00 61.13 H new ATOM 0 HA LEU A 90 9.744 -8.088 -15.466 1.00 45.31 H new ATOM 0 HB2 LEU A 90 6.970 -8.878 -14.528 1.00 64.23 H new ATOM 0 HB3 LEU A 90 8.431 -9.842 -14.443 1.00 64.23 H new ATOM 0 HG LEU A 90 8.369 -7.225 -12.986 1.00 45.44 H new ATOM 0 HD11 LEU A 90 7.351 -8.318 -11.029 1.00 24.24 H new ATOM 0 HD12 LEU A 90 6.227 -8.251 -12.408 1.00 24.24 H new ATOM 0 HD13 LEU A 90 7.052 -9.776 -12.005 1.00 24.24 H new ATOM 0 HD21 LEU A 90 9.783 -8.482 -11.408 1.00 4.22 H new ATOM 0 HD22 LEU A 90 9.580 -9.946 -12.399 1.00 4.22 H new ATOM 0 HD23 LEU A 90 10.435 -8.533 -13.063 1.00 4.22 H new ATOM 1432 N ASP A 91 8.798 -9.607 -17.313 1.00 14.40 N ATOM 1433 CA ASP A 91 8.431 -10.213 -18.587 1.00 75.32 C ATOM 1434 C ASP A 91 7.728 -11.550 -18.370 1.00 64.23 C ATOM 1435 O ASP A 91 6.933 -11.987 -19.202 1.00 62.55 O ATOM 1436 CB ASP A 91 9.672 -10.411 -19.459 1.00 12.41 C ATOM 1437 CG ASP A 91 9.323 -10.694 -20.907 1.00 23.42 C ATOM 1438 OD1 ASP A 91 8.187 -10.377 -21.317 1.00 71.31 O ATOM 1439 OD2 ASP A 91 10.187 -11.233 -21.630 1.00 2.31 O ATOM 0 H ASP A 91 9.557 -10.081 -16.824 1.00 14.40 H new ATOM 0 HA ASP A 91 7.743 -9.539 -19.097 1.00 75.32 H new ATOM 0 HB2 ASP A 91 10.296 -9.519 -19.406 1.00 12.41 H new ATOM 0 HB3 ASP A 91 10.263 -11.237 -19.063 1.00 12.41 H new ATOM 1444 N TYR A 92 8.028 -12.195 -17.248 1.00 45.23 N ATOM 1445 CA TYR A 92 7.429 -13.484 -16.924 1.00 11.44 C ATOM 1446 C TYR A 92 6.672 -13.415 -15.601 1.00 11.41 C ATOM 1447 O TYR A 92 7.190 -12.918 -14.601 1.00 44.52 O ATOM 1448 CB TYR A 92 8.506 -14.567 -16.852 1.00 22.24 C ATOM 1449 CG TYR A 92 8.812 -15.207 -18.187 1.00 53.01 C ATOM 1450 CD1 TYR A 92 7.953 -16.147 -18.742 1.00 73.22 C ATOM 1451 CD2 TYR A 92 9.959 -14.870 -18.894 1.00 64.23 C ATOM 1452 CE1 TYR A 92 8.228 -16.735 -19.962 1.00 5.24 C ATOM 1453 CE2 TYR A 92 10.243 -15.452 -20.115 1.00 54.52 C ATOM 1454 CZ TYR A 92 9.374 -16.384 -20.644 1.00 43.53 C ATOM 1455 OH TYR A 92 9.652 -16.965 -21.860 1.00 31.40 O ATOM 0 H TYR A 92 8.682 -11.846 -16.548 1.00 45.23 H new ATOM 0 HA TYR A 92 6.722 -13.737 -17.714 1.00 11.44 H new ATOM 0 HB2 TYR A 92 9.421 -14.132 -16.449 1.00 22.24 H new ATOM 0 HB3 TYR A 92 8.186 -15.340 -16.153 1.00 22.24 H new ATOM 0 HD1 TYR A 92 7.054 -16.423 -18.211 1.00 73.22 H new ATOM 0 HD2 TYR A 92 10.641 -14.140 -18.483 1.00 64.23 H new ATOM 0 HE1 TYR A 92 7.550 -17.465 -20.379 1.00 5.24 H new ATOM 0 HE2 TYR A 92 11.140 -15.179 -20.652 1.00 54.52 H new ATOM 0 HH TYR A 92 10.495 -16.608 -22.208 1.00 31.40 H new ATOM 1465 N SER A 93 5.442 -13.918 -15.604 1.00 13.13 N ATOM 1466 CA SER A 93 4.610 -13.911 -14.406 1.00 24.34 C ATOM 1467 C SER A 93 4.708 -15.244 -13.669 1.00 41.03 C ATOM 1468 O SER A 93 3.785 -15.643 -12.960 1.00 14.25 O ATOM 1469 CB SER A 93 3.153 -13.624 -14.772 1.00 41.10 C ATOM 1470 OG SER A 93 2.366 -13.419 -13.611 1.00 62.54 O ATOM 0 H SER A 93 4.999 -14.336 -16.422 1.00 13.13 H new ATOM 0 HA SER A 93 4.973 -13.123 -13.746 1.00 24.34 H new ATOM 0 HB2 SER A 93 3.102 -12.742 -15.410 1.00 41.10 H new ATOM 0 HB3 SER A 93 2.748 -14.457 -15.347 1.00 41.10 H new ATOM 0 HG SER A 93 2.577 -14.108 -12.947 1.00 62.54 H new ATOM 1476 N ASP A 94 5.834 -15.928 -13.844 1.00 15.21 N ATOM 1477 CA ASP A 94 6.054 -17.215 -13.196 1.00 22.51 C ATOM 1478 C ASP A 94 7.489 -17.691 -13.405 1.00 54.53 C ATOM 1479 O ASP A 94 8.193 -17.202 -14.289 1.00 53.32 O ATOM 1480 CB ASP A 94 5.074 -18.258 -13.738 1.00 4.44 C ATOM 1481 CG ASP A 94 4.959 -18.213 -15.249 1.00 21.44 C ATOM 1482 OD1 ASP A 94 5.920 -18.629 -15.929 1.00 32.30 O ATOM 1483 OD2 ASP A 94 3.908 -17.762 -15.751 1.00 22.02 O ATOM 0 H ASP A 94 6.608 -15.612 -14.429 1.00 15.21 H new ATOM 0 HA ASP A 94 5.884 -17.089 -12.127 1.00 22.51 H new ATOM 0 HB2 ASP A 94 5.399 -19.252 -13.431 1.00 4.44 H new ATOM 0 HB3 ASP A 94 4.091 -18.093 -13.296 1.00 4.44 H new ATOM 1488 N PHE A 95 7.916 -18.645 -12.586 1.00 32.51 N ATOM 1489 CA PHE A 95 9.267 -19.185 -12.680 1.00 22.32 C ATOM 1490 C PHE A 95 9.239 -20.652 -13.100 1.00 20.02 C ATOM 1491 O PHE A 95 8.245 -21.348 -12.894 1.00 51.52 O ATOM 1492 CB PHE A 95 9.991 -19.041 -11.340 1.00 2.24 C ATOM 1493 CG PHE A 95 9.165 -19.473 -10.162 1.00 52.22 C ATOM 1494 CD1 PHE A 95 8.783 -20.797 -10.015 1.00 43.23 C ATOM 1495 CD2 PHE A 95 8.770 -18.555 -9.202 1.00 70.30 C ATOM 1496 CE1 PHE A 95 8.022 -21.197 -8.933 1.00 42.32 C ATOM 1497 CE2 PHE A 95 8.009 -18.949 -8.117 1.00 61.55 C ATOM 1498 CZ PHE A 95 7.636 -20.272 -7.983 1.00 33.25 C ATOM 0 H PHE A 95 7.346 -19.061 -11.849 1.00 32.51 H new ATOM 0 HA PHE A 95 9.806 -18.618 -13.439 1.00 22.32 H new ATOM 0 HB2 PHE A 95 10.908 -19.630 -11.366 1.00 2.24 H new ATOM 0 HB3 PHE A 95 10.285 -18.000 -11.205 1.00 2.24 H new ATOM 0 HD1 PHE A 95 9.083 -21.525 -10.754 1.00 43.23 H new ATOM 0 HD2 PHE A 95 9.060 -17.520 -9.303 1.00 70.30 H new ATOM 0 HE1 PHE A 95 7.730 -22.232 -8.831 1.00 42.32 H new ATOM 0 HE2 PHE A 95 7.707 -18.224 -7.376 1.00 61.55 H new ATOM 0 HZ PHE A 95 7.043 -20.583 -7.136 1.00 33.25 H new ATOM 1508 N GLN A 96 10.337 -21.114 -13.690 1.00 1.44 N ATOM 1509 CA GLN A 96 10.438 -22.497 -14.140 1.00 12.21 C ATOM 1510 C GLN A 96 11.896 -22.905 -14.322 1.00 71.13 C ATOM 1511 O GLN A 96 12.804 -22.091 -14.154 1.00 40.33 O ATOM 1512 CB GLN A 96 9.675 -22.685 -15.452 1.00 41.14 C ATOM 1513 CG GLN A 96 10.207 -21.831 -16.593 1.00 35.35 C ATOM 1514 CD GLN A 96 9.162 -21.566 -17.659 1.00 22.01 C ATOM 1515 OE1 GLN A 96 8.267 -22.381 -17.884 1.00 63.32 O ATOM 1516 NE2 GLN A 96 9.271 -20.421 -18.322 1.00 53.23 N ATOM 0 H GLN A 96 11.169 -20.551 -13.867 1.00 1.44 H new ATOM 0 HA GLN A 96 9.994 -23.135 -13.376 1.00 12.21 H new ATOM 0 HB2 GLN A 96 9.721 -23.735 -15.742 1.00 41.14 H new ATOM 0 HB3 GLN A 96 8.624 -22.445 -15.289 1.00 41.14 H new ATOM 0 HG2 GLN A 96 10.564 -20.881 -16.195 1.00 35.35 H new ATOM 0 HG3 GLN A 96 11.064 -22.329 -17.046 1.00 35.35 H new ATOM 0 HE21 GLN A 96 10.029 -19.775 -18.102 1.00 53.23 H new ATOM 0 HE22 GLN A 96 8.597 -20.188 -19.051 1.00 53.23 H new ATOM 1525 N ILE A 97 12.112 -24.170 -14.666 1.00 62.14 N ATOM 1526 CA ILE A 97 13.460 -24.685 -14.872 1.00 61.51 C ATOM 1527 C ILE A 97 13.613 -25.285 -16.266 1.00 14.01 C ATOM 1528 O ILE A 97 13.088 -26.362 -16.551 1.00 42.43 O ATOM 1529 CB ILE A 97 13.820 -25.754 -13.823 1.00 62.55 C ATOM 1530 CG1 ILE A 97 13.711 -25.173 -12.412 1.00 63.14 C ATOM 1531 CG2 ILE A 97 15.221 -26.292 -14.074 1.00 43.53 C ATOM 1532 CD1 ILE A 97 14.644 -24.009 -12.165 1.00 45.40 C ATOM 0 H ILE A 97 11.371 -24.857 -14.808 1.00 62.14 H new ATOM 0 HA ILE A 97 14.140 -23.840 -14.767 1.00 61.51 H new ATOM 0 HB ILE A 97 13.114 -26.580 -13.911 1.00 62.55 H new ATOM 0 HG12 ILE A 97 12.685 -24.849 -12.240 1.00 63.14 H new ATOM 0 HG13 ILE A 97 13.923 -25.959 -11.687 1.00 63.14 H new ATOM 0 HG21 ILE A 97 15.461 -27.046 -13.325 1.00 43.53 H new ATOM 0 HG22 ILE A 97 15.266 -26.740 -15.067 1.00 43.53 H new ATOM 0 HG23 ILE A 97 15.941 -25.476 -14.011 1.00 43.53 H new ATOM 0 HD11 ILE A 97 14.513 -23.648 -11.145 1.00 45.40 H new ATOM 0 HD12 ILE A 97 15.675 -24.333 -12.305 1.00 45.40 H new ATOM 0 HD13 ILE A 97 14.418 -23.206 -12.866 1.00 45.40 H new ATOM 1544 N VAL A 98 14.336 -24.581 -17.131 1.00 21.21 N ATOM 1545 CA VAL A 98 14.561 -25.045 -18.495 1.00 0.22 C ATOM 1546 C VAL A 98 15.635 -26.126 -18.538 1.00 31.13 C ATOM 1547 O VAL A 98 16.693 -25.991 -17.922 1.00 34.41 O ATOM 1548 CB VAL A 98 14.978 -23.886 -19.420 1.00 75.00 C ATOM 1549 CG1 VAL A 98 15.164 -24.382 -20.846 1.00 53.50 C ATOM 1550 CG2 VAL A 98 13.950 -22.766 -19.366 1.00 53.10 C ATOM 0 H VAL A 98 14.776 -23.687 -16.912 1.00 21.21 H new ATOM 0 HA VAL A 98 13.617 -25.461 -18.848 1.00 0.22 H new ATOM 0 HB VAL A 98 15.932 -23.490 -19.071 1.00 75.00 H new ATOM 0 HG11 VAL A 98 15.458 -23.550 -21.485 1.00 53.50 H new ATOM 0 HG12 VAL A 98 15.940 -25.148 -20.867 1.00 53.50 H new ATOM 0 HG13 VAL A 98 14.227 -24.805 -21.209 1.00 53.50 H new ATOM 0 HG21 VAL A 98 14.260 -21.955 -20.025 1.00 53.10 H new ATOM 0 HG22 VAL A 98 12.981 -23.146 -19.689 1.00 53.10 H new ATOM 0 HG23 VAL A 98 13.871 -22.393 -18.345 1.00 53.10 H new ATOM 1560 N LYS A 99 15.357 -27.200 -19.270 1.00 11.44 N ATOM 1561 CA LYS A 99 16.299 -28.305 -19.396 1.00 21.23 C ATOM 1562 C LYS A 99 16.626 -28.577 -20.861 1.00 5.44 C ATOM 1563 O LYS A 99 17.547 -29.333 -21.171 1.00 74.52 O ATOM 1564 CB LYS A 99 15.726 -29.567 -18.748 1.00 34.51 C ATOM 1565 CG LYS A 99 14.571 -30.178 -19.523 1.00 62.33 C ATOM 1566 CD LYS A 99 13.900 -31.293 -18.738 1.00 41.05 C ATOM 1567 CE LYS A 99 12.554 -31.666 -19.341 1.00 22.45 C ATOM 1568 NZ LYS A 99 12.691 -32.174 -20.734 1.00 25.54 N ATOM 0 H LYS A 99 14.486 -27.328 -19.785 1.00 11.44 H new ATOM 0 HA LYS A 99 17.219 -28.026 -18.882 1.00 21.23 H new ATOM 0 HB2 LYS A 99 16.520 -30.308 -18.651 1.00 34.51 H new ATOM 0 HB3 LYS A 99 15.389 -29.327 -17.740 1.00 34.51 H new ATOM 0 HG2 LYS A 99 13.839 -29.405 -19.756 1.00 62.33 H new ATOM 0 HG3 LYS A 99 14.936 -30.569 -20.473 1.00 62.33 H new ATOM 0 HD2 LYS A 99 14.548 -32.169 -18.722 1.00 41.05 H new ATOM 0 HD3 LYS A 99 13.762 -30.979 -17.703 1.00 41.05 H new ATOM 0 HE2 LYS A 99 12.077 -32.427 -18.723 1.00 22.45 H new ATOM 0 HE3 LYS A 99 11.900 -30.794 -19.335 1.00 22.45 H new ATOM 0 HZ1 LYS A 99 11.758 -32.465 -21.091 1.00 25.54 H new ATOM 0 HZ2 LYS A 99 13.075 -31.422 -21.341 1.00 25.54 H new ATOM 0 HZ3 LYS A 99 13.335 -32.990 -20.744 1.00 25.54 H new